smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1ccc2c(c1)CCC[C@@]2(NCc1cc(F)c(F)c(F)c1)C(=O)[O-] ZINC000582978586 936342909 /nfs/dbraw/zinc/34/29/09/936342909.db2.gz BFJOEUNBKPJRJZ-IBGZPJMESA-N -1 3 365.351 3.519 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NCC[C@H]3CCc4ccccc43)nc2)n1 ZINC000583005485 936365302 /nfs/dbraw/zinc/36/53/02/936365302.db2.gz KSZWFXLEPSJLHH-MRXNPFEDSA-N -1 3 360.461 3.761 20 0 FHADHM O=S(=O)([N-][C@@H]1CCC[C@@H]1c1ccccc1)c1cccnc1C(F)(F)F ZINC000583042100 936388326 /nfs/dbraw/zinc/38/83/26/936388326.db2.gz HVITYNRHVGCBEL-ZIAGYGMSSA-N -1 3 370.396 3.715 20 0 FHADHM CN(C(=O)c1cc(=O)[n-]c(C2CC2)n1)[C@H]1CCCC[C@H]1c1ccccc1 ZINC000616327729 927233394 /nfs/dbraw/zinc/23/33/94/927233394.db2.gz AXKMFBOQCVKPSN-WMZOPIPTSA-N -1 3 351.450 3.858 20 0 FHADHM CC[C@H](CSC)[N-]S(=O)(=O)c1cc(Cl)ccc1C(F)(F)F ZINC000510039532 927330947 /nfs/dbraw/zinc/33/09/47/927330947.db2.gz FLHOEQXWUZJGSF-SECBINFHSA-N -1 3 361.838 3.779 20 0 FHADHM O=C(Nc1cc(Cl)ccc1[O-])c1ccc(I)cc1 ZINC000049094171 927339430 /nfs/dbraw/zinc/33/94/30/927339430.db2.gz RKPVKOMSICNAJY-UHFFFAOYSA-N -1 3 373.577 3.903 20 0 FHADHM CCc1ccc([C@@H]2CCCCCN2C(=O)c2cc(=O)[n-]c(C3CC3)n2)o1 ZINC000654823057 927378861 /nfs/dbraw/zinc/37/88/61/927378861.db2.gz LKMJJNFVIZLGPI-INIZCTEOSA-N -1 3 355.438 3.973 20 0 FHADHM CC[C@H]1CN(C(=O)c2cc(=O)[n-]c(C3CC3)n2)CC[C@H]1c1ccccc1 ZINC000654850892 927420211 /nfs/dbraw/zinc/42/02/11/927420211.db2.gz WYAJJNJAUXMRLT-WMLDXEAASA-N -1 3 351.450 3.716 20 0 FHADHM CCCNC(=O)Nc1ccc(CC(=O)Nc2ccc(Cl)cc2[O-])cc1 ZINC000153562793 927524129 /nfs/dbraw/zinc/52/41/29/927524129.db2.gz GVZSEHDLOUIUBL-UHFFFAOYSA-N -1 3 361.829 3.758 20 0 FHADHM CCC(CC)[C@H](NC(=O)CCc1c(C)nc(C)[n-]c1=O)c1ccccc1 ZINC000078895598 927547858 /nfs/dbraw/zinc/54/78/58/927547858.db2.gz BWSKQCOUPQLWKJ-FQEVSTJZSA-N -1 3 355.482 3.613 20 0 FHADHM COc1ccc([C@@H](CC(=O)[O-])NCc2cc(Br)cs2)cc1 ZINC000683172140 927745074 /nfs/dbraw/zinc/74/50/74/927745074.db2.gz VNSNXIODXXNOTR-CQSZACIVSA-N -1 3 370.268 3.825 20 0 FHADHM O=C([O-])[C@@H](CNCc1csc(-c2ccccc2)n1)Cc1ccccc1 ZINC000683171349 927746747 /nfs/dbraw/zinc/74/67/47/927746747.db2.gz KHPSCNNURMVRAZ-QGZVFWFLSA-N -1 3 352.459 3.843 20 0 FHADHM Nc1nc(Cl)cc(Sc2nnc([N-]c3ccccc3F)s2)n1 ZINC000045010945 927788350 /nfs/dbraw/zinc/78/83/50/927788350.db2.gz UMDLZRUVENXPJS-UHFFFAOYSA-N -1 3 354.823 3.598 20 0 FHADHM COc1cc(C(=O)Nc2cccc(-c3nc(C)cc(=O)[n-]3)c2)ccc1Cl ZINC000154263233 937196732 /nfs/dbraw/zinc/19/67/32/937196732.db2.gz LRSMGDODGQOVMR-UHFFFAOYSA-N -1 3 369.808 3.660 20 0 FHADHM Cc1cc(C)n(-c2ccc([N-]S(=O)(=O)c3ccc(C)c(C)c3)cc2)n1 ZINC000029403602 927874168 /nfs/dbraw/zinc/87/41/68/927874168.db2.gz KNQUJJHTZGHAGO-UHFFFAOYSA-N -1 3 355.463 3.907 20 0 FHADHM COc1ccc(C(=O)N2C[C@@H](c3cccc(Cl)c3)OC[C@@H]2C)c([O-])c1 ZINC000187094246 928027384 /nfs/dbraw/zinc/02/73/84/928027384.db2.gz IDJPXGUZPWWVJT-SGTLLEGYSA-N -1 3 361.825 3.656 20 0 FHADHM O=[S@](Cc1nc(-c2ccc(C(F)(F)F)cc2)no1)c1ccc([O-])cc1 ZINC000108085016 928058329 /nfs/dbraw/zinc/05/83/29/928058329.db2.gz KNRVPKLTZCDXDP-VWLOTQADSA-N -1 3 368.336 3.769 20 0 FHADHM CC[C@H](C)c1nc(C)c(CC(=O)Nc2cccc(C(C)=O)c2[O-])c(C)n1 ZINC000655081424 928082119 /nfs/dbraw/zinc/08/21/19/928082119.db2.gz JEZTWYKQOQIYFC-NSHDSACASA-N -1 3 355.438 3.696 20 0 FHADHM COc1cccc(-c2nc(Cc3cccc(Br)c3)no2)c1[O-] ZINC000109037339 928116274 /nfs/dbraw/zinc/11/62/74/928116274.db2.gz ZITFMJAZIPLDFN-UHFFFAOYSA-N -1 3 361.195 3.804 20 0 FHADHM Cc1cc(S(=O)(=O)[N-][C@@H](C)c2ccsc2)sc1Br ZINC000126360158 937220621 /nfs/dbraw/zinc/22/06/21/937220621.db2.gz GJKMWCGBDZWVCN-QMMMGPOBSA-N -1 3 366.327 3.920 20 0 FHADHM C[C@H]1CN(C(=O)c2cc(=O)[n-]c(C3CC3)n2)CCc2ccc(Cl)cc21 ZINC000655162256 928395229 /nfs/dbraw/zinc/39/52/29/928395229.db2.gz GKEOSSONOIACDT-NSHDSACASA-N -1 3 357.841 3.515 20 0 FHADHM CN(C(=O)c1c[n-]c2c(F)cc(F)cc2c1=O)[C@@H]1CCc2ccccc21 ZINC000431526485 937245495 /nfs/dbraw/zinc/24/54/95/937245495.db2.gz ZXDUQLPRJGTBLH-QGZVFWFLSA-N -1 3 354.356 3.566 20 0 FHADHM CN(c1ncc(C(=O)[O-])cc1Cl)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000388173511 928432450 /nfs/dbraw/zinc/43/24/50/928432450.db2.gz KYNINWDJDQHHDR-INIZCTEOSA-N -1 3 359.857 3.534 20 0 FHADHM CC(C)(C)OC(=O)Nc1ccccc1CC(=O)[N-]OCc1ccccc1 ZINC000160256975 928514605 /nfs/dbraw/zinc/51/46/05/928514605.db2.gz AAKLHZXJBZHTIB-UHFFFAOYSA-N -1 3 356.422 3.824 20 0 FHADHM CC(C)(C[N-]S(=O)(=O)c1cc(Cl)ccc1Cl)c1ccncc1 ZINC000092263794 937268427 /nfs/dbraw/zinc/26/84/27/937268427.db2.gz IIAVEAHKSTZHAH-UHFFFAOYSA-N -1 3 359.278 3.645 20 0 FHADHM CC(C)(C)OC(=O)Nc1ccc(F)c(NC([O-])=NO[C@H]2CCCCO2)c1 ZINC000274811200 928774925 /nfs/dbraw/zinc/77/49/25/928774925.db2.gz VDCQLJCYRVRYFF-AWEZNQCLSA-N -1 3 369.393 3.752 20 0 FHADHM CC(C)(C)OC(=O)Nc1ccc(F)c(NC(=O)[N-]O[C@H]2CCCCO2)c1 ZINC000274811200 928774933 /nfs/dbraw/zinc/77/49/33/928774933.db2.gz VDCQLJCYRVRYFF-AWEZNQCLSA-N -1 3 369.393 3.752 20 0 FHADHM CCCC(=O)Nc1ccc(Cl)c(NC([O-])=NO[C@H]2CCCCO2)c1 ZINC000274818917 928804666 /nfs/dbraw/zinc/80/46/66/928804666.db2.gz JGIXETAZAZTEQL-HNNXBMFYSA-N -1 3 355.822 3.658 20 0 FHADHM CCCC(=O)Nc1ccc(Cl)c(NC(=O)[N-]O[C@H]2CCCCO2)c1 ZINC000274818917 928804681 /nfs/dbraw/zinc/80/46/81/928804681.db2.gz JGIXETAZAZTEQL-HNNXBMFYSA-N -1 3 355.822 3.658 20 0 FHADHM CC(C)Oc1ccc([C@H](C)NC(=O)c2c[n-]c3ccccc3c2=O)cc1 ZINC000042042570 929261681 /nfs/dbraw/zinc/26/16/81/929261681.db2.gz BWZVQFIOAAVQHQ-AWEZNQCLSA-N -1 3 350.418 3.806 20 0 FHADHM CCCc1ccc([C@@H](NC(=O)NN=c2cccn[n-]2)c2cccs2)cc1 ZINC000077547028 929427223 /nfs/dbraw/zinc/42/72/23/929427223.db2.gz AVJLJWLXGZQZSS-GOSISDBHSA-N -1 3 367.478 3.906 20 0 FHADHM Cc1cc(C)c(S(=O)(=O)[N-]c2c(C)ccnc2Br)s1 ZINC000295260458 929548229 /nfs/dbraw/zinc/54/82/29/929548229.db2.gz IORDMTNSROSPSZ-UHFFFAOYSA-N -1 3 361.286 3.632 20 0 FHADHM COc1ccc(C(=O)N2CCC(c3nc4c(s3)CCCC4)CC2)c([O-])c1 ZINC000583318226 937342383 /nfs/dbraw/zinc/34/23/83/937342383.db2.gz AHZMFLABFXVLIE-UHFFFAOYSA-N -1 3 372.490 3.756 20 0 FHADHM Cc1ccc(C[C@@H](C)[N-]S(=O)(=O)c2cnc(Cl)c(Cl)c2)s1 ZINC000083935214 930171113 /nfs/dbraw/zinc/17/11/13/930171113.db2.gz YGTYNSKHNZFTOC-MRVPVSSYSA-N -1 3 365.307 3.668 20 0 FHADHM COCC[C@H]([N-]C(=O)C(F)(F)c1cc(Cl)ccc1OC)c1ccco1 ZINC001266569044 930188385 /nfs/dbraw/zinc/18/83/85/930188385.db2.gz LIDZIAWKAZWOFD-ZDUSSCGKSA-N -1 3 373.783 3.927 20 0 FHADHM O=C(Nc1nc(-c2cccc(O)c2)cs1)c1c[n-]c2ccccc2c1=O ZINC000156174199 937403627 /nfs/dbraw/zinc/40/36/27/937403627.db2.gz QPVLDDQKHIOJGH-UHFFFAOYSA-N -1 3 363.398 3.610 20 0 FHADHM O=C(OCc1noc(-c2ccccc2[O-])n1)C1CCC(C(F)(F)F)CC1 ZINC000785010501 930365821 /nfs/dbraw/zinc/36/58/21/930365821.db2.gz LWGDEGILWLMPJE-UHFFFAOYSA-N -1 3 370.327 3.854 20 0 FHADHM Cc1cc(=O)[n-]c(-c2cccc(NC(=O)c3coc(-c4ccccc4)n3)c2)n1 ZINC000156278634 937424912 /nfs/dbraw/zinc/42/49/12/937424912.db2.gz MJYJTXSNPWVDPN-UHFFFAOYSA-N -1 3 372.384 3.653 20 0 FHADHM O=C([O-])[C@H](c1ccccc1C(F)(F)F)N1CCC[C@@H](OC2CCC2)C1 ZINC000656191989 930564085 /nfs/dbraw/zinc/56/40/85/930564085.db2.gz VMNDEJSEBFIFDM-CJNGLKHVSA-N -1 3 357.372 3.865 20 0 FHADHM C[C@@H](c1ccc2c(c1)CCC2)[S@](=O)Cc1nc(C(F)(F)F)cc(=O)[n-]1 ZINC000580532077 930814351 /nfs/dbraw/zinc/81/43/51/930814351.db2.gz GXGYIIYVSVXYIX-UXMMLNGASA-N -1 3 370.396 3.700 20 0 FHADHM COc1cc2c(cc1CN[C@@H](C(=O)[O-])c1cccc(C)c1C)O[C@@H](C)C2 ZINC000580539567 930826986 /nfs/dbraw/zinc/82/69/86/930826986.db2.gz UHCQQIGUBWVECT-RNODOKPDSA-N -1 3 355.434 3.551 20 0 FHADHM O=C(N=c1cc2ccccn2[n-]1)c1cc(-c2ccccc2C(F)(F)F)on1 ZINC000580609290 930928800 /nfs/dbraw/zinc/92/88/00/930928800.db2.gz XJSCMMRIJIKOIH-UHFFFAOYSA-N -1 3 372.306 3.682 20 0 FHADHM [O-]c1cc(Br)cnc1Nc1cc(Br)cnc1F ZINC001211265282 931032095 /nfs/dbraw/zinc/03/20/95/931032095.db2.gz SLYWXPGUXXKYAR-UHFFFAOYSA-N -1 3 362.984 3.590 20 0 FHADHM O=C(Nc1nccs1)c1ccc(NCc2c(F)ccc([O-])c2F)cc1 ZINC000580747694 931096868 /nfs/dbraw/zinc/09/68/68/931096868.db2.gz YOOJXVWOIBFMGV-UHFFFAOYSA-N -1 3 361.373 3.991 20 0 FHADHM CC[C@@]1(c2ccc(Cl)cc2)NC(=O)N(Cc2ccc([O-])c(F)c2)C1=O ZINC000580849879 931265640 /nfs/dbraw/zinc/26/56/40/931265640.db2.gz AGBDJEJRLRHDKX-SFHVURJKSA-N -1 3 362.788 3.542 20 0 FHADHM CC(=O)Nc1c(C)ccc([N-]S(=O)(=O)c2ccc(F)cc2C)c1C ZINC000055674207 931323571 /nfs/dbraw/zinc/32/35/71/931323571.db2.gz FVPIBGANERXEFE-UHFFFAOYSA-N -1 3 350.415 3.510 20 0 FHADHM CO[C@H](c1ccc(Cl)cc1)[C@@H](C)NC(=O)c1c[n-]c2ccccc2c1=O ZINC000119352813 931398228 /nfs/dbraw/zinc/39/82/28/931398228.db2.gz MGMUSGZRUOFNDM-BLVKFPJESA-N -1 3 370.836 3.688 20 0 FHADHM Cc1ccc(C)c(C(=O)Nc2cc(I)ccc2[O-])c1 ZINC000610491161 931755157 /nfs/dbraw/zinc/75/51/57/931755157.db2.gz VNQXOCVECQFOSO-UHFFFAOYSA-N -1 3 367.186 3.866 20 0 FHADHM COc1cccc(-c2nc(-c3sccc3Br)no2)c1[O-] ZINC000723210149 931997663 /nfs/dbraw/zinc/99/76/63/931997663.db2.gz HNFUSNZRWYLXLX-UHFFFAOYSA-N -1 3 353.197 3.942 20 0 FHADHM CCOc1cc(CN[C@H]2COc3cc(F)cc(F)c32)cc(Cl)c1[O-] ZINC000656539818 932037261 /nfs/dbraw/zinc/03/72/61/932037261.db2.gz VYCYWNWRERFXAT-ZDUSSCGKSA-N -1 3 355.768 3.946 20 0 FHADHM CCS(=O)(=O)[N-]c1ccc(NC(=O)[C@H]2CCC(C)=C(C)C2)cc1OC ZINC000581430365 932069417 /nfs/dbraw/zinc/06/94/17/932069417.db2.gz AJHGXOHJUHGNSH-AWEZNQCLSA-N -1 3 366.483 3.532 20 0 FHADHM CCc1cccc2cc(CNC[C@@H](Oc3ccc(F)cc3)C(=O)[O-])oc21 ZINC000656565527 932082650 /nfs/dbraw/zinc/08/26/50/932082650.db2.gz OTURWBVUZVHKLP-GOSISDBHSA-N -1 3 357.381 3.756 20 0 FHADHM CO[C@@H](CS(=O)(=O)[N-]c1cccc(-c2nc(C)co2)c1)C1CCCC1 ZINC000656624115 932206374 /nfs/dbraw/zinc/20/63/74/932206374.db2.gz LFHNEEXEJNCMEA-KRWDZBQOSA-N -1 3 364.467 3.597 20 0 FHADHM CC[C@@H](C)n1ncc([N-]S(=O)(=O)CCc2ccccc2F)c1C1CC1 ZINC000656627267 932213423 /nfs/dbraw/zinc/21/34/23/932213423.db2.gz WYPYGCDZDJKQHY-CYBMUJFWSA-N -1 3 365.474 3.855 20 0 FHADHM [O-]c1cccc(CNC2(c3noc(C(F)F)n3)CCC2)c1Br ZINC000656630572 932218010 /nfs/dbraw/zinc/21/80/10/932218010.db2.gz ZAROJSLOTCRNIW-UHFFFAOYSA-N -1 3 374.185 3.644 20 0 FHADHM CC[C@@H](CS(=O)(=O)[N-]c1cc(Cl)c(Br)cc1C)OC ZINC000656633972 932222054 /nfs/dbraw/zinc/22/20/54/932222054.db2.gz LKRHGSIIOIOSIJ-VIFPVBQESA-N -1 3 370.696 3.578 20 0 FHADHM CO[C@@H](CC(C)C)CS(=O)(=O)[N-]c1cc(SC)ccc1Cl ZINC000656633714 932222069 /nfs/dbraw/zinc/22/20/69/932222069.db2.gz MCGXRVKQADOCTE-NSHDSACASA-N -1 3 351.921 3.865 20 0 FHADHM CC(C)COc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)CCOC3)cc1 ZINC000656635923 932223134 /nfs/dbraw/zinc/22/31/34/932223134.db2.gz NKUGRKSELIKAIN-UHFFFAOYSA-N -1 3 361.463 3.595 20 0 FHADHM C[C@@H]1CCCN1C(=O)c1c[n-]c2c(Cl)cc(Br)cc2c1=O ZINC000430612333 932263571 /nfs/dbraw/zinc/26/35/71/932263571.db2.gz RYZFKMGEKDEPDL-MRVPVSSYSA-N -1 3 369.646 3.569 20 0 FHADHM CC(C)=CCNC(=O)c1c[n-]c2c(Cl)cc(Br)cc2c1=O ZINC000430618548 932334089 /nfs/dbraw/zinc/33/40/89/932334089.db2.gz VFUWZWSQSUEPIQ-UHFFFAOYSA-N -1 3 369.646 3.640 20 0 FHADHM O=C([O-])[C@@H]1C[C@H](C(F)(F)F)CN(CCSc2ccc(F)cc2)C1 ZINC000656756845 932392591 /nfs/dbraw/zinc/39/25/91/932392591.db2.gz IEGAQNQHVRQVLD-MNOVXSKESA-N -1 3 351.365 3.503 20 0 FHADHM O=C([O-])[C@@H]1CCN(Cc2csc(-c3ccccn3)n2)[C@@H]2CCCC[C@@H]12 ZINC000656765567 932399805 /nfs/dbraw/zinc/39/98/05/932399805.db2.gz OJIFKOSKTGCQNS-ZMSDIMECSA-N -1 3 357.479 3.670 20 0 FHADHM O=C([O-])[C@H](c1c(F)cccc1Cl)N1CCC[C@@H]([C@H]2CCCCO2)C1 ZINC000656769415 932405061 /nfs/dbraw/zinc/40/50/61/932405061.db2.gz PJHVFGLOVDGOQI-VMGRFDJRSA-N -1 3 355.837 3.886 20 0 FHADHM Cc1cc([N+](=O)[O-])cc(C(=O)[N-]c2cccc([N+](=O)[O-])c2Cl)c1F ZINC000326255449 932441039 /nfs/dbraw/zinc/44/10/39/932441039.db2.gz AWEGZPAJWPVSHL-UHFFFAOYSA-N -1 3 353.693 3.856 20 0 FHADHM Cc1cscc1C(=O)Nc1cc(I)ccc1[O-] ZINC000610527867 932505697 /nfs/dbraw/zinc/50/56/97/932505697.db2.gz VOXGZAYLKQBPQM-UHFFFAOYSA-N -1 3 359.188 3.619 20 0 FHADHM O=C(N=c1cc(-c2ccccc2)[n-][nH]1)c1cccc(Br)c1F ZINC000430663930 932736706 /nfs/dbraw/zinc/73/67/06/932736706.db2.gz NEQOMNQIWCTQSD-UHFFFAOYSA-N -1 3 360.186 3.653 20 0 FHADHM CC(=O)c1cc(F)c([N-]C(=O)c2ccc(NC(=O)C3CC3)s2)c(F)c1 ZINC001266827552 932758669 /nfs/dbraw/zinc/75/86/69/932758669.db2.gz GQKKGQXYCGMQKY-UHFFFAOYSA-N -1 3 364.373 3.830 20 0 FHADHM Cc1csc([C@H]([N-]S(=O)(=O)Cc2cc(F)ccc2Cl)C2CC2)n1 ZINC000656916001 932765769 /nfs/dbraw/zinc/76/57/69/932765769.db2.gz AGMMUSPSYLIKHK-CQSZACIVSA-N -1 3 374.890 3.815 20 0 FHADHM CCC(CC)c1cc(C[N-]S(=O)(=O)c2cccc3c(C)ccnc32)on1 ZINC000548293163 932841019 /nfs/dbraw/zinc/84/10/19/932841019.db2.gz QFGVKLMRHUBAHE-UHFFFAOYSA-N -1 3 373.478 3.913 20 0 FHADHM CC(C)c1ccc([N-]S(=O)(=O)c2ccc3c(c2)CCCC(=O)N3)cc1 ZINC000021880974 932907479 /nfs/dbraw/zinc/90/74/79/932907479.db2.gz JCKFNAPSARZGPY-UHFFFAOYSA-N -1 3 358.463 3.886 20 0 FHADHM C[C@H]1C(=O)CC[C@H](C(=O)Nc2ccc(Br)cc2[O-])C1(C)C ZINC000548361638 933096568 /nfs/dbraw/zinc/09/65/68/933096568.db2.gz SQKCBFZRLVSJCW-GXSJLCMTSA-N -1 3 354.244 3.735 20 0 FHADHM Cc1ccc(S(=O)(=O)[N-][C@@H](C)c2ccc(Br)cc2F)o1 ZINC000510658574 933372984 /nfs/dbraw/zinc/37/29/84/933372984.db2.gz OGVZWFANJQEZQO-VIFPVBQESA-N -1 3 362.220 3.529 20 0 FHADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)c3cc(F)c(C)cc3F)cc2)n1 ZINC000124360061 933831833 /nfs/dbraw/zinc/83/18/33/933831833.db2.gz AMLMQPHMHKYZAF-UHFFFAOYSA-N -1 3 355.344 3.584 20 0 FHADHM O=C(c1c([O-])cccc1O)N1CCC(c2c[nH]c3cc(F)ccc32)CC1 ZINC000092121620 933962061 /nfs/dbraw/zinc/96/20/61/933962061.db2.gz UAYQTOZZVCOVKQ-UHFFFAOYSA-N -1 3 354.381 3.738 20 0 FHADHM COC(=O)c1cccc([N-]S(=O)(=O)c2cc(C)ccc2Cl)c1Cl ZINC000431174853 934015477 /nfs/dbraw/zinc/01/54/77/934015477.db2.gz HWHFFVBLXPXQAB-UHFFFAOYSA-N -1 3 374.245 3.889 20 0 FHADHM C[C@@H]1c2ccc(F)cc2C[C@H](C)N1C(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000535818810 934490340 /nfs/dbraw/zinc/49/03/40/934490340.db2.gz GWSKYLBFHZEYCB-QWHCGFSZSA-N -1 3 350.393 3.815 20 0 FHADHM C[C@@]1(CC[N-]S(=O)(=O)c2cc(C(F)(F)F)ccc2F)CC1(F)F ZINC000657161081 934559394 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COc1ccc2[nH]cc(C3=CCN(C(=O)c4c([O-])cccc4O)CC3)c2c1 ZINC000092117951 938911619 /nfs/dbraw/zinc/91/16/19/938911619.db2.gz JMUPMCAPDMOSNA-UHFFFAOYSA-N -1 3 364.401 3.517 20 0 FHADHM CCc1cccc(C(=O)N[C@H](c2nc(-c3cccnc3)no2)C(C)C)c1[O-] ZINC000094088183 938934772 /nfs/dbraw/zinc/93/47/72/938934772.db2.gz GYUOQJHKBGKVOH-INIZCTEOSA-N -1 3 366.421 3.527 20 0 FHADHM CCOc1cc(CNC(=O)c2cc([O-])ccc2Cl)ccc1OC(F)F ZINC000685625954 939005792 /nfs/dbraw/zinc/00/57/92/939005792.db2.gz RLRKJELFBDBYLA-UHFFFAOYSA-N -1 3 371.767 3.976 20 0 FHADHM CCOCCC1(C[N-]S(=O)(=O)c2ccc(Cl)cc2F)CCCC1 ZINC000472348268 939011564 /nfs/dbraw/zinc/01/15/64/939011564.db2.gz LQYYDTRFVQPSLI-UHFFFAOYSA-N -1 3 363.882 3.744 20 0 FHADHM Cc1ccc(CC[N-]S(=O)(=O)c2ccc(Cl)cc2C(F)(F)F)o1 ZINC000030443626 939082753 /nfs/dbraw/zinc/08/27/53/939082753.db2.gz CUMUNRVYZOKJMN-UHFFFAOYSA-N -1 3 367.776 3.781 20 0 FHADHM COc1ccc(N(C(=O)c2cc(F)cc3n[n-]nc32)[C@H](C)C2CC2)cc1 ZINC000548865913 939113083 /nfs/dbraw/zinc/11/30/83/939113083.db2.gz 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ZINC000819772241 945284114 /nfs/dbraw/zinc/28/41/14/945284114.db2.gz BCBOMVXYRPDSHN-YLGBQOPLSA-N -1 3 352.369 3.714 20 0 FHADHM CC(C)Oc1cncc(C(=O)Nc2ccc(Br)cc2[O-])c1 ZINC000132795989 939965611 /nfs/dbraw/zinc/96/56/11/939965611.db2.gz VJKYQMCTOBJYSU-UHFFFAOYSA-N -1 3 351.200 3.589 20 0 FHADHM O=C(Nc1cc(Cl)ccc1[O-])c1c[nH]c2ncc(Br)cc12 ZINC000472421005 940018891 /nfs/dbraw/zinc/01/88/91/940018891.db2.gz QLCUKTHYSUZFSP-UHFFFAOYSA-N -1 3 366.602 3.937 20 0 FHADHM CCCCCc1cc(C(=O)N2CCC(C(=O)c3ccc([O-])cc3)CC2)n[nH]1 ZINC000612382032 940035140 /nfs/dbraw/zinc/03/51/40/940035140.db2.gz LPIJZMRDNZRFOX-UHFFFAOYSA-N -1 3 369.465 3.583 20 0 FHADHM COC[C@]1(C(=O)[O-])CCCN(Cc2ccc(Oc3ccccc3)c(F)c2)C1 ZINC000569935374 940046680 /nfs/dbraw/zinc/04/66/80/940046680.db2.gz PRFIIIAYORKYAP-NRFANRHFSA-N -1 3 373.424 3.931 20 0 FHADHM CCCCC[C@@](C)(CC)C(=O)N1CCN(C(=O)c2ccc([O-])cc2)CC1 ZINC000780901089 940099703 /nfs/dbraw/zinc/09/97/03/940099703.db2.gz IKPRLWGKNIGFAZ-OAQYLSRUSA-N -1 3 360.498 3.673 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)-c1ccccc1CC2)C1CC1 ZINC000819877425 945303463 /nfs/dbraw/zinc/30/34/63/945303463.db2.gz VSVDISBXJSNXAW-SNVBAGLBSA-N -1 3 365.462 3.678 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)-c1ccccc1CC2)C1CC1 ZINC000819877425 945303470 /nfs/dbraw/zinc/30/34/70/945303470.db2.gz VSVDISBXJSNXAW-SNVBAGLBSA-N -1 3 365.462 3.678 20 0 FHADHM COc1ccc(C(=O)[N-]NC(=S)Nc2ccccc2C(C)C)c(F)c1 ZINC000066123001 940293873 /nfs/dbraw/zinc/29/38/73/940293873.db2.gz LQYJTTYZNPBLSI-UHFFFAOYSA-N -1 3 361.442 3.589 20 0 FHADHM CCc1ccc([O-])c(C(=O)N2CC3(CCOCC3)[C@H]2c2ccccc2)c1 ZINC000413958993 940331366 /nfs/dbraw/zinc/33/13/66/940331366.db2.gz SEFATKLQMZDUSR-HXUWFJFHSA-N -1 3 351.446 3.949 20 0 FHADHM O=C(c1cc([O-])ccc1Cl)N1Cc2cccc(Br)c2C1 ZINC000685826758 940373378 /nfs/dbraw/zinc/37/33/78/940373378.db2.gz CYUMCEFRYRVIBJ-UHFFFAOYSA-N -1 3 352.615 3.964 20 0 FHADHM CC[C@@H]([N-]S(=O)(=O)c1cc(OC)ccc1Cl)c1nc(C)cs1 ZINC000112362355 945314049 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C[C@@H](C(=O)N=c1cc(-c2ccncc2)[n-][nH]1)c1ccc(Cl)c(Cl)c1 ZINC000472527769 940491144 /nfs/dbraw/zinc/49/11/44/940491144.db2.gz MXMKEFUAIJLJPC-SNVBAGLBSA-N -1 3 361.232 3.943 20 0 FHADHM Cc1ccc(C(C)C)c(O[C@H](C)C(=O)Nc2n[n-]c(-c3ccco3)n2)c1 ZINC000613341751 940614102 /nfs/dbraw/zinc/61/41/02/940614102.db2.gz YFFIOZVJIYDPKP-CYBMUJFWSA-N -1 3 354.410 3.903 20 0 FHADHM CC[C@@H](CC(=O)NCc1cc(=O)[n-]c(C2CCC2)n1)c1ccc(OC)cc1 ZINC000636321260 940619921 /nfs/dbraw/zinc/61/99/21/940619921.db2.gz ZECQLCXNODZPQM-AWEZNQCLSA-N -1 3 369.465 3.658 20 0 FHADHM COCCOc1ccccc1[N-]S(=O)(=O)/C=C/c1ccccc1Cl ZINC000066583320 940690039 /nfs/dbraw/zinc/69/00/39/940690039.db2.gz BZGFNLVOLSCMBN-JLHYYAGUSA-N -1 3 367.854 3.778 20 0 FHADHM Cc1cccc(C(=O)Nc2ccc(N3CCc4sccc4C3)nc2)c1[O-] ZINC000613506451 940794440 /nfs/dbraw/zinc/79/44/40/940794440.db2.gz HXIRYNOTASTKOD-UHFFFAOYSA-N -1 3 365.458 3.972 20 0 FHADHM CC(C)Cc1ccc(C[S@@](=O)Cc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000820108725 945352911 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Cc1cnc([C@@H](C)C[N-]S(=O)(=O)c2cccc(Cl)c2Cl)s1 ZINC000186738449 941048989 /nfs/dbraw/zinc/04/89/89/941048989.db2.gz JIUMNJDBIFAEKH-QMMMGPOBSA-N -1 3 365.307 3.840 20 0 FHADHM Cc1ccc([C@H](CNC(=O)c2cc(F)c([O-])c(F)c2)N2CCCC2)cc1 ZINC000177127797 941102523 /nfs/dbraw/zinc/10/25/23/941102523.db2.gz XHGVEGUZJKKICS-SFHVURJKSA-N -1 3 360.404 3.546 20 0 FHADHM O=C(CCCc1ccc([O-])c(F)c1)Nc1ccc(N2CCCCC2)nc1 ZINC000468535947 941162863 /nfs/dbraw/zinc/16/28/63/941162863.db2.gz KIWWDVLGRLMRDU-UHFFFAOYSA-N -1 3 357.429 3.878 20 0 FHADHM CCCNC(=O)c1ccc(C)c([N-]S(=O)(=O)c2c(C)cc(C)cc2C)c1 ZINC000025425963 941166074 /nfs/dbraw/zinc/16/60/74/941166074.db2.gz DQBFNDSNBQLKRT-UHFFFAOYSA-N -1 3 374.506 3.861 20 0 FHADHM O=C([O-])CCCCCNCc1cc(OC(F)F)ccc1Br ZINC000647645969 941166493 /nfs/dbraw/zinc/16/64/93/941166493.db2.gz RDWGVPQXBISRQX-UHFFFAOYSA-N -1 3 366.202 3.785 20 0 FHADHM O=S(=O)([N-]c1ccc(-n2cccn2)c(Cl)c1)c1ccc2c(c1)CCC2 ZINC000589436501 941280528 /nfs/dbraw/zinc/28/05/28/941280528.db2.gz 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O=C([O-])c1ccc(CN2CCC(OCc3ccc(F)cc3)CC2)cc1F ZINC000659787837 941395556 /nfs/dbraw/zinc/39/55/56/941395556.db2.gz RDTGDQHEUCJKHK-UHFFFAOYSA-N -1 3 361.388 3.844 20 0 FHADHM COc1ccc(-c2nc(CN3[C@H](C)[C@H](C(=O)[O-])CC[C@@H]3C)cs2)cc1 ZINC000659797485 941401613 /nfs/dbraw/zinc/40/16/13/941401613.db2.gz JEWGLYKIPULLPF-OGHNNQOOSA-N -1 3 360.479 3.892 20 0 FHADHM O=C(C[C@H](NC(=O)c1ccc([O-])cc1)c1ccccc1)NCc1ccccc1 ZINC000182874172 941466055 /nfs/dbraw/zinc/46/60/55/941466055.db2.gz SFOZVCNUNLRVLS-NRFANRHFSA-N -1 3 374.440 3.570 20 0 FHADHM COc1ccc(NC(=O)c2cccc3n[n-]nc32)c(OCc2ccccc2)c1 ZINC000188689130 941487608 /nfs/dbraw/zinc/48/76/08/941487608.db2.gz AVVRTGAHPQSALM-UHFFFAOYSA-N -1 3 374.400 3.798 20 0 FHADHM C[C@@H](C1CC1)N(C)C(=O)C[C@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000183245300 941494513 /nfs/dbraw/zinc/49/45/13/941494513.db2.gz VWZMZUDAJLTSQL-YWZLYKJASA-N -1 3 366.461 3.510 20 0 FHADHM CCc1cc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2[O-])ccc1C ZINC000183608590 941529068 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COc1ccc2cc(C=CC(=O)Nc3ccc(-c4nn[n-]n4)cc3)ccc2c1 ZINC000729356835 941731003 /nfs/dbraw/zinc/73/10/03/941731003.db2.gz JPBZTJBUCKPQTJ-QDEBKDIKSA-N -1 3 371.400 3.680 20 0 FHADHM CO[C@H](C[N-]S(=O)(=O)c1cc(Cl)ccc1C(F)(F)F)C(C)(C)C ZINC000509916561 941804209 /nfs/dbraw/zinc/80/42/09/941804209.db2.gz XARHGVYTBWBHRH-GFCCVEGCSA-N -1 3 373.824 3.698 20 0 FHADHM C[C@H](NC(=O)c1cc(F)cc2n[n-]nc21)c1ccc(-c2cccnc2)cc1 ZINC000431844652 941806589 /nfs/dbraw/zinc/80/65/89/941806589.db2.gz FCKITMBHBWMUJR-LBPRGKRZSA-N -1 3 361.380 3.650 20 0 FHADHM O=S(=O)([N-]c1cccc2c1CN(C1CC1)C2)c1ccc(C(F)F)cc1 ZINC000377588833 941826925 /nfs/dbraw/zinc/82/69/25/941826925.db2.gz WANKLBDSOWPERM-UHFFFAOYSA-N -1 3 364.417 3.903 20 0 FHADHM Cc1cc([O-])c(I)c(O[C@H](C)Cc2ccco2)c1 ZINC001225511867 941831116 /nfs/dbraw/zinc/83/11/16/941831116.db2.gz WRVMUBIRNZMDRL-SNVBAGLBSA-N -1 3 358.175 3.908 20 0 FHADHM CC1(C)CC(Nc2cc(C(F)(F)F)[n-]c(=S)n2)CC(C)(C)N1O ZINC001167719601 941848751 /nfs/dbraw/zinc/84/87/51/941848751.db2.gz 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20 0 FHADHM CCOc1ccc(NC(=O)CCSCc2cc(=O)[n-]c(C3CC3)n2)cc1 ZINC000419582656 942314038 /nfs/dbraw/zinc/31/40/38/942314038.db2.gz GBDCPLQEGDOZCM-UHFFFAOYSA-N -1 3 373.478 3.720 20 0 FHADHM CCN(CC)C(=O)[C@H](SCc1cc(=O)[n-]c(C2CC2)n1)c1ccccc1 ZINC000419593152 942325342 /nfs/dbraw/zinc/32/53/42/942325342.db2.gz WZMHJQZWLGESDY-GOSISDBHSA-N -1 3 371.506 3.903 20 0 FHADHM CC[C@@H](CS(=O)(=O)[N-]c1cccc(OCc2ccc(F)cc2)c1)OC ZINC000421154823 942375618 /nfs/dbraw/zinc/37/56/18/942375618.db2.gz NQYXYCXEXRWBIL-KRWDZBQOSA-N -1 3 367.442 3.571 20 0 FHADHM CN1CC[C@H](CN=c2[n-]nc(C(F)F)s2)[C@@H]1c1cccc(Cl)c1 ZINC000378195510 942382180 /nfs/dbraw/zinc/38/21/80/942382180.db2.gz XGCSHWSATKKUQQ-PWSUYJOCSA-N -1 3 358.845 3.656 20 0 FHADHM CCC(=O)c1ccc(Cl)c([N-]S(=O)(=O)C[C@H](CC(C)C)OC)c1 ZINC000421147219 942382839 /nfs/dbraw/zinc/38/28/39/942382839.db2.gz DIGVLWXSQFEYPC-ZDUSSCGKSA-N -1 3 361.891 3.736 20 0 FHADHM COc1ccc2c(c1)CCC[C@H]2N(C)C(=O)c1ccc(C(C)=O)c([O-])c1 ZINC000664403569 942404828 /nfs/dbraw/zinc/40/48/28/942404828.db2.gz LKGGHTCEBRMMPV-LJQANCHMSA-N -1 3 353.418 3.753 20 0 FHADHM CSc1ccsc1C(=O)Nc1ccc(-c2nc(C)cc(=O)[n-]2)cc1 ZINC000107130783 942455238 /nfs/dbraw/zinc/45/52/38/942455238.db2.gz PKFHMQIUJLQAOS-UHFFFAOYSA-N -1 3 357.460 3.781 20 0 FHADHM CC(=C([O-])Nc1nc(-c2cccnc2)ns1)c1cccc(CC(C)C)c1 ZINC000502515955 942509678 /nfs/dbraw/zinc/50/96/78/942509678.db2.gz CGQJTWMJDBLEIN-CQSZACIVSA-N -1 3 366.490 3.963 20 0 FHADHM COC(=O)c1cc(NC(=O)CCCc2ccc([O-])c(F)c2)c(C)cc1C ZINC000472953741 942511557 /nfs/dbraw/zinc/51/15/57/942511557.db2.gz PAZQCXDTECUILJ-UHFFFAOYSA-N -1 3 359.397 3.896 20 0 FHADHM CC(C)(C)OC(=O)CC[C@@H]1CCCCN1C(=O)Cc1ccc([O-])c(F)c1 ZINC000416256881 942563858 /nfs/dbraw/zinc/56/38/58/942563858.db2.gz BCLKDYPPOZLNNA-HNNXBMFYSA-N -1 3 365.445 3.577 20 0 FHADHM CC(C)Cn1ncc(NC(=O)c2c[n-]c3ccccc3c2=O)c1C(C)C ZINC000501617103 942577626 /nfs/dbraw/zinc/57/76/26/942577626.db2.gz GGMHPFAQTOVWNM-UHFFFAOYSA-N -1 3 352.438 3.756 20 0 FHADHM O=C(N1CCCc2c(=O)[n-]cnc21)C1(Cc2cccs2)CCCCC1 ZINC000893205213 942597584 /nfs/dbraw/zinc/59/75/84/942597584.db2.gz QQVYURUCDCUDEX-UHFFFAOYSA-N -1 3 357.479 3.716 20 0 FHADHM Cc1ccc([O-])c(CN(C)[C@@H](c2ccc(Cl)cc2)c2cnccn2)n1 ZINC000378345966 942622970 /nfs/dbraw/zinc/62/29/70/942622970.db2.gz OJXGHCZANJIBGR-IBGZPJMESA-N -1 3 354.841 3.760 20 0 FHADHM Cc1ccc2nc(C3CC3)cc(C(=O)N3CCCc4c(=O)[n-]cnc43)c2c1 ZINC000893213513 942638830 /nfs/dbraw/zinc/63/88/30/942638830.db2.gz ZIBLOPBABQAWHN-UHFFFAOYSA-N -1 3 360.417 3.509 20 0 FHADHM Cc1cc2occ(CC(=O)N3CCCc4c(=O)[n-]cnc43)c2cc1C(C)C ZINC000893214219 942647686 /nfs/dbraw/zinc/64/76/86/942647686.db2.gz LXXBRTYEXIOWJI-UHFFFAOYSA-N -1 3 365.433 3.882 20 0 FHADHM O=C(C[C@H](Cc1ccccc1)c1ccccc1)N1CCCc2c(=O)[n-]cnc21 ZINC000893215512 942667679 /nfs/dbraw/zinc/66/76/79/942667679.db2.gz HRRFQXGGDWOHBX-IBGZPJMESA-N -1 3 373.456 3.878 20 0 FHADHM O=C([N-]c1ncn(-c2ccccn2)n1)c1sc2ccccc2c1Cl ZINC000378376509 942675458 /nfs/dbraw/zinc/67/54/58/942675458.db2.gz LKIDEUJSGSFCEQ-UHFFFAOYSA-N -1 3 355.810 3.783 20 0 FHADHM C[C@@H](C(=O)N1CCCc2c(=O)[n-]cnc21)c1c(Cl)cccc1Cl ZINC000893215939 942676436 /nfs/dbraw/zinc/67/64/36/942676436.db2.gz LHHATTGFIKLDMX-SECBINFHSA-N -1 3 352.221 3.572 20 0 FHADHM COc1cccc(C=C2CCN(C(=O)c3cc(=O)c4ccccc4[n-]3)CC2)c1 ZINC000472973633 942691775 /nfs/dbraw/zinc/69/17/75/942691775.db2.gz CWURPINMAWJVMA-UHFFFAOYSA-N -1 3 374.440 3.856 20 0 FHADHM Clc1ccc(-c2csc(N=c3ncnc4[nH][n-]cc3-4)n2)c(Cl)c1 ZINC000502744763 942712554 /nfs/dbraw/zinc/71/25/54/942712554.db2.gz SAFBDAHIAPDFOO-UHFFFAOYSA-N -1 3 363.233 3.900 20 0 FHADHM C[C@@H](CC(C)(C)C)C(=O)N=c1[n-]n(CC(F)(F)F)cc1Br ZINC000421678708 942754479 /nfs/dbraw/zinc/75/44/79/942754479.db2.gz CPFXCWGIMRVXQI-QMMMGPOBSA-N -1 3 370.213 3.641 20 0 FHADHM CCCc1[nH]ccc1C(=O)Nc1cccc(-c2nc(CC)cc(=O)[n-]2)c1 ZINC000421751381 942797068 /nfs/dbraw/zinc/79/70/68/942797068.db2.gz MEDPBNCYSQIGMU-UHFFFAOYSA-N -1 3 350.422 3.945 20 0 FHADHM CC[C@H]1CCCCN1C(=O)[C@H](C)N1CCC(c2ccccc2C(=O)[O-])CC1 ZINC000363858564 942870261 /nfs/dbraw/zinc/87/02/61/942870261.db2.gz UGWSRAASKBZHMS-WMZOPIPTSA-N -1 3 372.509 3.744 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]C[C@@H]2C(C)(C)C2(F)F)c(Cl)c1Cl ZINC000660020008 942881117 /nfs/dbraw/zinc/88/11/17/942881117.db2.gz ACSQASNZKDLLRK-SECBINFHSA-N -1 3 374.236 3.572 20 0 FHADHM C[C@H](NC(=O)c1cc(F)cc2n[n-]nc21)c1ccccc1C(F)(F)F ZINC000502990821 942887412 /nfs/dbraw/zinc/88/74/12/942887412.db2.gz PNNBCJKEFUBCJZ-QMMMGPOBSA-N -1 3 352.291 3.607 20 0 FHADHM C[C@H](c1nc2ccccc2s1)N(C)C(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000503072573 942956541 /nfs/dbraw/zinc/95/65/41/942956541.db2.gz FNZOXTZUUQNJPW-GFCCVEGCSA-N -1 3 363.442 3.971 20 0 FHADHM COCCOc1ccccc1[N-]S(=O)(=O)/C=C/c1cccc(Cl)c1 ZINC000184230300 942987470 /nfs/dbraw/zinc/98/74/70/942987470.db2.gz KPEGJUKYNACGFI-FMIVXFBMSA-N -1 3 367.854 3.778 20 0 FHADHM COC(=O)C1(c2ccc(S(=O)(=O)[N-]c3c(C)cc(C)cc3C)cc2)CC1 ZINC000271825728 943056153 /nfs/dbraw/zinc/05/61/53/943056153.db2.gz DFROWYOFCUEVEV-UHFFFAOYSA-N -1 3 373.474 3.617 20 0 FHADHM CCc1cc2c(CN[C@@H](C)c3nc(C(C)(C)C)no3)cc(=O)oc2cc1[O-] ZINC000185173735 943116806 /nfs/dbraw/zinc/11/68/06/943116806.db2.gz ABGIISLSMDHJMA-NSHDSACASA-N -1 3 371.437 3.592 20 0 FHADHM CCC(CC)c1nnc([N-]C(=O)c2cn(-c3ccc(F)cc3C)nn2)s1 ZINC000503525849 943224655 /nfs/dbraw/zinc/22/46/55/943224655.db2.gz KIRNXMOIDXZOJU-UHFFFAOYSA-N -1 3 374.445 3.722 20 0 FHADHM COC(=O)c1oc(C(=O)[N-]c2cc(Br)c(F)cc2F)cc1C ZINC001269379351 943230402 /nfs/dbraw/zinc/23/04/02/943230402.db2.gz FPTZURAZQTYBHW-UHFFFAOYSA-N -1 3 374.137 3.668 20 0 FHADHM O=C(N[C@@H](CC(F)(F)F)c1ccc(F)cc1)c1cc(F)cc2n[n-]nc21 ZINC000503533686 943247378 /nfs/dbraw/zinc/24/73/78/943247378.db2.gz KLEMHYXTYAVFHV-ZDUSSCGKSA-N -1 3 370.281 3.660 20 0 FHADHM COc1ccc([C@H](C)Nc2ccc(OC)c([N-]S(C)(=O)=O)c2)cc1C ZINC000272990298 943256657 /nfs/dbraw/zinc/25/66/57/943256657.db2.gz VZUTUNUSDBDIHI-ZDUSSCGKSA-N -1 3 364.467 3.557 20 0 FHADHM COC(=O)c1cccc2[n-]c(NC(=O)CC=Cc3cccc(F)c3)nc21 ZINC000503589571 943277083 /nfs/dbraw/zinc/27/70/83/943277083.db2.gz CCLGQCNHACAICL-UTCJRWHESA-N -1 3 353.353 3.531 20 0 FHADHM O=c1cc(CNc2cc(F)ccc2OCC(F)(F)F)nc(C2CC2)[n-]1 ZINC000417009865 943295202 /nfs/dbraw/zinc/29/52/02/943295202.db2.gz YPGLSKMJIKJONY-UHFFFAOYSA-N -1 3 357.307 3.752 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N3CCC([C@H]4CCCCO4)CC3)nc2)n1 ZINC000664481546 943344196 /nfs/dbraw/zinc/34/41/96/943344196.db2.gz CTKOGJQRUKSMCL-GOSISDBHSA-N -1 3 368.481 3.592 20 0 FHADHM Cc1ccc(Cl)c(S(=O)(=O)[N-][C@H](c2ccccc2)[C@@H](C)O)c1Cl ZINC000660162846 943376215 /nfs/dbraw/zinc/37/62/15/943376215.db2.gz QBBLXVJEKURQQR-ABAIWWIYSA-N -1 3 374.289 3.702 20 0 FHADHM CCCc1nc(C[S@@](=O)Cc2cc(=O)[n-]c(-c3ccccc3)n2)cs1 ZINC000417145115 943378795 /nfs/dbraw/zinc/37/87/95/943378795.db2.gz WFVHKZRPFWFTKR-VWLOTQADSA-N -1 3 373.503 3.707 20 0 FHADHM Cc1ccc([O-])c(NC(=O)c2cc(OC(F)F)cc(OC(F)F)c2)n1 ZINC000514969530 943435465 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CCc1ccc([C@H]2CCCN(C(=O)c3cc(OC)c([O-])c(OC)c3)C2)cc1 ZINC000436684727 944523797 /nfs/dbraw/zinc/52/37/97/944523797.db2.gz FJLHOAPHCMDLOZ-KRWDZBQOSA-N -1 3 369.461 3.992 20 0 FHADHM Cc1ccc(C(=O)NCCc2nc(-c3cc(Cl)ccc3C)no2)c([O-])c1 ZINC000436686879 944525193 /nfs/dbraw/zinc/52/51/93/944525193.db2.gz GRWBZIJMCSOVAV-UHFFFAOYSA-N -1 3 371.824 3.685 20 0 FHADHM CCOCc1ccc(-c2noc(-c3cc(OC)c([O-])c(OC)c3)n2)cc1 ZINC000436692335 944526518 /nfs/dbraw/zinc/52/65/18/944526518.db2.gz WXTMVFUPHMWAPA-UHFFFAOYSA-N -1 3 356.378 3.663 20 0 FHADHM COc1cccc(C(=O)Nc2ccnc(Sc3ccccn3)c2)c1[O-] ZINC000436708324 944532037 /nfs/dbraw/zinc/53/20/37/944532037.db2.gz JFMYGUVKBAAHBY-UHFFFAOYSA-N -1 3 353.403 3.594 20 0 FHADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CCC[C@@H]1[C@@H]1CCCO1 ZINC000436715792 944554577 /nfs/dbraw/zinc/55/45/77/944554577.db2.gz QVQZYAXEBIHIHJ-CTNGQTDRSA-N -1 3 351.446 3.767 20 0 FHADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CCC[C@H]1[C@H]1CCCO1 ZINC000436718309 944557569 /nfs/dbraw/zinc/55/75/69/944557569.db2.gz ZLIHCGADVGZDFY-RBBKRZOGSA-N -1 3 365.473 3.961 20 0 FHADHM COc1cccc(Cc2nnc([N-]C(=O)c3ccc(SC)o3)s2)c1 ZINC000112246431 944572654 /nfs/dbraw/zinc/57/26/54/944572654.db2.gz COSLACHJVQCIPS-UHFFFAOYSA-N -1 3 361.448 3.705 20 0 FHADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1CC[C@]2(C1)CCCOC2 ZINC000436731059 944575962 /nfs/dbraw/zinc/57/59/62/944575962.db2.gz ZQTDQPXGMIPHSK-NRFANRHFSA-N -1 3 353.418 3.827 20 0 FHADHM CCOc1ccc([N-]S(=O)(=O)c2ccc(CCCl)cc2)c(C)c1 ZINC000048401546 944581341 /nfs/dbraw/zinc/58/13/41/944581341.db2.gz ZNYXCPIJCTZVGQ-UHFFFAOYSA-N -1 3 353.871 3.976 20 0 FHADHM Cc1ccc(C(=O)N(C)Cc2cc(Br)ccc2F)c([O-])c1 ZINC000436759630 944582367 /nfs/dbraw/zinc/58/23/67/944582367.db2.gz CWUWAXPQAVIEFI-UHFFFAOYSA-N -1 3 352.203 3.874 20 0 FHADHM CCc1ncc(S(=O)(=O)[N-][C@@H](C)c2ccccc2OC(C)C)s1 ZINC000516222159 944583655 /nfs/dbraw/zinc/58/36/55/944583655.db2.gz YCVAZPUHCMIQEB-LBPRGKRZSA-N -1 3 354.497 3.532 20 0 FHADHM CN(C)[C@H](CNC(=O)c1ccc(C(F)(F)F)cc1[O-])c1cccs1 ZINC000436764020 944584596 /nfs/dbraw/zinc/58/45/96/944584596.db2.gz JGYBYESQZFUPGH-GFCCVEGCSA-N -1 3 358.385 3.505 20 0 FHADHM O=S(=O)(CCc1cccc(Cl)c1)[N-]c1cnc(-c2ccccc2)nc1 ZINC000506570111 944594276 /nfs/dbraw/zinc/59/42/76/944594276.db2.gz HVCSHUAFXQSMLA-UHFFFAOYSA-N -1 3 373.865 3.781 20 0 FHADHM NC(=O)Nc1ccc(NC(=O)c2cc(Oc3ccccc3)ccc2[O-])cc1 ZINC000436753746 944595285 /nfs/dbraw/zinc/59/52/85/944595285.db2.gz GGDKPNJVFURVIU-UHFFFAOYSA-N -1 3 363.373 3.927 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(Sc3nncn3C)cc2)c([O-])c1C ZINC000436755734 944598355 /nfs/dbraw/zinc/59/83/55/944598355.db2.gz MTZOBKXQPSYFTA-UHFFFAOYSA-N -1 3 354.435 3.541 20 0 FHADHM O=C(Nc1cnn(C(F)F)c1)c1cc(OCc2ccccc2)ccc1[O-] ZINC000436772410 944601599 /nfs/dbraw/zinc/60/15/99/944601599.db2.gz NRWBZGLODZTXPT-UHFFFAOYSA-N -1 3 359.332 3.815 20 0 FHADHM COc1ccc2[nH]c(SCc3noc(-c4ccccc4[O-])n3)nc2c1 ZINC000436774677 944604046 /nfs/dbraw/zinc/60/40/46/944604046.db2.gz BPKFYLFIMUETLQ-UHFFFAOYSA-N -1 3 354.391 3.619 20 0 FHADHM Cc1nc(-c2cc3c(s2)CCN(C(=O)c2c([O-])cccc2O)C3)cs1 ZINC000436764411 944614074 /nfs/dbraw/zinc/61/40/74/944614074.db2.gz LKESVJYULODIDK-UHFFFAOYSA-N -1 3 372.471 3.790 20 0 FHADHM COc1cccc(C(=O)Nc2nc(-c3cc(F)ccc3OC)cs2)c1[O-] ZINC000436798366 944623345 /nfs/dbraw/zinc/62/33/45/944623345.db2.gz SWECXESSRZMPTQ-UHFFFAOYSA-N -1 3 374.393 3.924 20 0 FHADHM CCc1ccc(C(=O)Nc2ccc(CC(=O)N(CC)CC)cc2)c([O-])c1 ZINC000436799779 944624604 /nfs/dbraw/zinc/62/46/04/944624604.db2.gz ZSOCWKLGQXNWDT-UHFFFAOYSA-N -1 3 354.450 3.618 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N[C@@H](C)c2ccc3c(c2)CCCC3)c1 ZINC000436784247 944626985 /nfs/dbraw/zinc/62/69/85/944626985.db2.gz PDXCSNZKWPXHSL-ZDUSSCGKSA-N -1 3 352.434 3.720 20 0 FHADHM Cc1c(N[C@H](C)C(C)C)cccc1C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000474707899 944633555 /nfs/dbraw/zinc/63/35/55/944633555.db2.gz PBRLAFLCWVJNDJ-CQSZACIVSA-N -1 3 364.453 3.884 20 0 FHADHM Cc1c(N[C@H](C)C(C)C)cccc1C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000474707899 944633560 /nfs/dbraw/zinc/63/35/60/944633560.db2.gz PBRLAFLCWVJNDJ-CQSZACIVSA-N -1 3 364.453 3.884 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N(Cc2cccc(C)c2)CC(C)C)c1 ZINC000436788013 944635165 /nfs/dbraw/zinc/63/51/65/944635165.db2.gz SIXRVXHDRNRVAV-UHFFFAOYSA-N -1 3 354.450 3.957 20 0 FHADHM CCC[C@H](CCc1ccccc1)NC(=O)c1cc(NC(C)=O)ccc1[O-] ZINC000436787927 944635272 /nfs/dbraw/zinc/63/52/72/944635272.db2.gz RNRFBBGXWFCXMN-QGZVFWFLSA-N -1 3 354.450 3.882 20 0 FHADHM C[C@@H]1C[C@@H]1N1CCN(C(=O)c2c([O-])cc(Cl)cc2Cl)C[C@@H](C)C1 ZINC000436790234 944637554 /nfs/dbraw/zinc/63/75/54/944637554.db2.gz GDYMLJLDVBDQMF-WDMOLILDSA-N -1 3 357.281 3.501 20 0 FHADHM CC[C@H](NC(=O)c1cc(NC(C)=O)ccc1[O-])c1ccc(Cl)s1 ZINC000436789313 944640128 /nfs/dbraw/zinc/64/01/28/944640128.db2.gz KKJNCXQWQYOIIJ-LBPRGKRZSA-N -1 3 352.843 3.947 20 0 FHADHM C[C@@H]1C[C@H](CC(=O)N2CCN(C(=O)c3ccc([O-])cc3)CC2)CC(C)(C)C1 ZINC000436790638 944641543 /nfs/dbraw/zinc/64/15/43/944641543.db2.gz HDIOLRUGDIVSRS-IAGOWNOFSA-N -1 3 372.509 3.529 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(OCc3nccn3C)cc2)c([O-])c1C ZINC000436791366 944643680 /nfs/dbraw/zinc/64/36/80/944643680.db2.gz JDWQDJOXTYINSD-UHFFFAOYSA-N -1 3 351.406 3.574 20 0 FHADHM O=C(CCCn1ccc2cc(Cl)ccc21)N=c1cc([C@@H]2CCCO2)[n-][nH]1 ZINC000473842900 944649391 /nfs/dbraw/zinc/64/93/91/944649391.db2.gz MCKQYVBETYEMBU-KRWDZBQOSA-N -1 3 372.856 3.710 20 0 FHADHM CCOC(=O)CN(C(=O)c1cc(Oc2ccccc2)ccc1[O-])C1CCC1 ZINC000436817604 944653888 /nfs/dbraw/zinc/65/38/88/944653888.db2.gz RZRGBOBOJREQHV-UHFFFAOYSA-N -1 3 369.417 3.742 20 0 FHADHM Cc1cc(C(=O)Nc2cc(Br)ccc2[O-])nn1-c1ccccc1 ZINC000436802399 944657816 /nfs/dbraw/zinc/65/78/16/944657816.db2.gz HUXIJAWQCAVTNO-UHFFFAOYSA-N -1 3 372.222 3.901 20 0 FHADHM CCCN1C(=O)CCc2cc(NC(=O)c3ccc(C)c(C)c3[O-])ccc21 ZINC000436811821 944668456 /nfs/dbraw/zinc/66/84/56/944668456.db2.gz KJNIPSPJOAURIV-UHFFFAOYSA-N -1 3 352.434 3.951 20 0 FHADHM C[C@H](O)C[C@@H]1CCCCN1C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436812920 944668609 /nfs/dbraw/zinc/66/86/09/944668609.db2.gz YMCVSZWOJSGMDP-HOTGVXAUSA-N -1 3 355.434 3.950 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(-c3nnc4n3CCCCC4)cc2)c([O-])c1 ZINC000436812924 944668776 /nfs/dbraw/zinc/66/87/76/944668776.db2.gz YMPSFGVIVUEMLO-UHFFFAOYSA-N -1 3 362.433 3.938 20 0 FHADHM CC(C)(C(=O)N=c1cc([C@@H]2CCCO2)[n-][nH]1)c1cccc(C(F)(F)F)c1 ZINC000473847036 944672109 /nfs/dbraw/zinc/67/21/09/944672109.db2.gz LKLBBLVUNQVEBK-AWEZNQCLSA-N -1 3 367.371 3.618 20 0 FHADHM O=C(CCc1ccc(Cl)c(Cl)c1)N=c1cc([C@H]2CCCO2)[n-][nH]1 ZINC000473847815 944673121 /nfs/dbraw/zinc/67/31/21/944673121.db2.gz FOUVXGCWCMJNEP-CQSZACIVSA-N -1 3 354.237 3.561 20 0 FHADHM CCc1ccc(C(=O)N(CCCOC)CCc2ccc(OC)cc2)c([O-])c1 ZINC000436830470 944677460 /nfs/dbraw/zinc/67/74/60/944677460.db2.gz DKTHNZKQVRFKEK-UHFFFAOYSA-N -1 3 371.477 3.685 20 0 FHADHM Cn1cc(CNCc2ccc(C(=O)[O-])cc2)c(-c2ccccc2Cl)n1 ZINC000426682393 944679448 /nfs/dbraw/zinc/67/94/48/944679448.db2.gz ICMXGEQNJFADJD-UHFFFAOYSA-N -1 3 355.825 3.729 20 0 FHADHM COCCC[C@@H](CNC(=O)c1ccc(O)cc1[O-])c1ccc(Cl)cc1 ZINC000436821140 944688357 /nfs/dbraw/zinc/68/83/57/944688357.db2.gz VAAAZAWNOMJQJK-AWEZNQCLSA-N -1 3 363.841 3.691 20 0 FHADHM CCc1ccc(C(=O)NCCCc2nc(-c3ccncc3)cs2)c([O-])c1 ZINC000436822772 944691896 /nfs/dbraw/zinc/69/18/96/944691896.db2.gz XAOROQMVVDAPRR-UHFFFAOYSA-N -1 3 367.474 3.836 20 0 FHADHM O=C(CCCc1ccccc1Br)[N-]OCCC(F)(F)F ZINC000162739081 944692741 /nfs/dbraw/zinc/69/27/41/944692741.db2.gz XCSHWSJTMANYGJ-UHFFFAOYSA-N -1 3 354.166 3.772 20 0 FHADHM CCc1ccc(C(=O)Nc2cccc([C@@H](C)N3CCOCC3)c2)c([O-])c1 ZINC000436825766 944695356 /nfs/dbraw/zinc/69/53/56/944695356.db2.gz MFOHFESAHWPKRX-OAHLLOKOSA-N -1 3 354.450 3.600 20 0 FHADHM CC[C@@H]1CN(C(=O)c2cc(CCc3ccccc3)ccc2[O-])C[C@@H](C)O1 ZINC000436847802 944714904 /nfs/dbraw/zinc/71/49/04/944714904.db2.gz LSCKUWJLHQJBHL-VQIMIIECSA-N -1 3 353.462 3.817 20 0 FHADHM O=C(c1ccccc1[O-])N1CCC(Nc2ncncc2-c2ccccc2)CC1 ZINC000436849127 944716274 /nfs/dbraw/zinc/71/62/74/944716274.db2.gz CYUHQVAZKQZWHE-UHFFFAOYSA-N -1 3 374.444 3.566 20 0 FHADHM CC(C)c1ccc2c(c1)[C@@H](NC(=O)Nc1ccc3c(c1)C(=O)[N-]C3=O)CC2 ZINC000426044314 944719622 /nfs/dbraw/zinc/71/96/22/944719622.db2.gz KZOSUCSGFFZLEP-SFHVURJKSA-N -1 3 363.417 3.503 20 0 FHADHM CCN(CC)[C@@H](CNC(=O)c1ccc([O-])cc1F)c1ccccc1Cl ZINC000436859752 944724223 /nfs/dbraw/zinc/72/42/23/944724223.db2.gz CUZQDNBQSYGNBN-SFHVURJKSA-N -1 3 364.848 3.998 20 0 FHADHM COc1cc2c(c(CN[C@H](c3ccccc3)[C@@H](C)C(=O)[O-])c1)O[C@@H](C)C2 ZINC000426724782 944726140 /nfs/dbraw/zinc/72/61/40/944726140.db2.gz VQKDOTICTFTBBO-KSMMKXTCSA-N -1 3 355.434 3.570 20 0 FHADHM O=C([O-])[C@@H](Cc1ccc(F)cc1)NCc1csc(-c2ccsc2)n1 ZINC000426726066 944727597 /nfs/dbraw/zinc/72/75/97/944727597.db2.gz GVUNIKAQSOFLDV-OAHLLOKOSA-N -1 3 362.451 3.796 20 0 FHADHM CCc1ccc(-c2nc([C@@H](C)CNC(=O)c3ccccc3)no2)c([O-])c1 ZINC000436864146 944728661 /nfs/dbraw/zinc/72/86/61/944728661.db2.gz LGHIGZDPGDJGKF-ZDUSSCGKSA-N -1 3 351.406 3.538 20 0 FHADHM COc1ccc([C@@H]2CCCN2C(=O)c2ccc(C(C)=O)c([O-])c2)c(OC)c1 ZINC000436867880 944733673 /nfs/dbraw/zinc/73/36/73/944733673.db2.gz FKDKCMRRKYSCBN-SFHVURJKSA-N -1 3 369.417 3.589 20 0 FHADHM COc1ccc([C@@H]2CCCN2C(=O)c2ccc(C(C)=O)c([O-])c2)cc1OC ZINC000436872085 944737644 /nfs/dbraw/zinc/73/76/44/944737644.db2.gz SDKCCSDWAKOUKL-KRWDZBQOSA-N -1 3 369.417 3.589 20 0 FHADHM CC(=O)c1ccc(C(=O)Nc2nc(CN3CCC[C@@H](C)C3)cs2)cc1[O-] ZINC000436873131 944739790 /nfs/dbraw/zinc/73/97/90/944739790.db2.gz ZDISGEDOUMJDDW-GFCCVEGCSA-N -1 3 373.478 3.536 20 0 FHADHM O=S(=O)([N-]c1ccc(OCCO)cc1)c1cccc(-c2ccccc2)c1 ZINC000506611773 944748180 /nfs/dbraw/zinc/74/81/80/944748180.db2.gz MGVUMGATGWPXPW-UHFFFAOYSA-N -1 3 369.442 3.526 20 0 FHADHM C[C@H](CC(=O)N=c1cc([C@@H]2CCCO2)[n-][nH]1)c1ccccc1C(F)(F)F ZINC000473849971 944749664 /nfs/dbraw/zinc/74/96/64/944749664.db2.gz MFHDXMUVTIMCSL-ABAIWWIYSA-N -1 3 367.371 3.834 20 0 FHADHM CCC[C@H](CC1CCCC1)C(=O)N1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436887144 944761340 /nfs/dbraw/zinc/76/13/40/944761340.db2.gz PKBXKXACIDXDPE-GOSISDBHSA-N -1 3 372.509 3.673 20 0 FHADHM O=C([O-])C[C@H](NCc1ccc2ncccc2c1)c1cnn(-c2ccccc2)c1 ZINC000426755177 944775743 /nfs/dbraw/zinc/77/57/43/944775743.db2.gz XJJMDVRIUBETRZ-NRFANRHFSA-N -1 3 372.428 3.726 20 0 FHADHM [O-]c1ccccc1-c1nc(-c2ccc(I)cc2)no1 ZINC000436909311 944776479 /nfs/dbraw/zinc/77/64/79/944776479.db2.gz MEZQDJIDZQVBKB-UHFFFAOYSA-N -1 3 364.142 3.714 20 0 FHADHM CCc1ccc(-c2ccc(CN[C@@H](CN3CCCCC3)C(=O)[O-])o2)cc1 ZINC000426756713 944777861 /nfs/dbraw/zinc/77/78/61/944777861.db2.gz MCEIBIPINKVKKF-IBGZPJMESA-N -1 3 356.466 3.538 20 0 FHADHM COc1cccc(CSC[C@H](NCc2ccsc2Cl)C(=O)[O-])c1 ZINC000426757710 944779847 /nfs/dbraw/zinc/77/98/47/944779847.db2.gz FBAATMHJXBGTGN-AWEZNQCLSA-N -1 3 371.911 3.886 20 0 FHADHM COc1cccc(C(=O)Nc2ccccc2OC[C@@H]2CCCCO2)c1[O-] ZINC000436911625 944780831 /nfs/dbraw/zinc/78/08/31/944780831.db2.gz UJNCJFKPCWKRTF-AWEZNQCLSA-N -1 3 357.406 3.601 20 0 FHADHM COc1ccc([O-])c(-c2nc(Cc3ccc(Br)s3)no2)c1 ZINC000436900350 944788732 /nfs/dbraw/zinc/78/87/32/944788732.db2.gz CKZDOAOFZOSXAV-UHFFFAOYSA-N -1 3 367.224 3.866 20 0 FHADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CCc2ccccc2[C@@H]1CO ZINC000436900491 944790518 /nfs/dbraw/zinc/79/05/18/944790518.db2.gz NOIJZFDOLBOYSE-QFIPXVFZSA-N -1 3 373.452 3.715 20 0 FHADHM O=C(Nc1ccc2c(c1)C(=O)[N-]C2=O)NC1(c2ccccc2)CCCCC1 ZINC000506285727 944796572 /nfs/dbraw/zinc/79/65/72/944796572.db2.gz RMZPQQPAQDMWQL-UHFFFAOYSA-N -1 3 363.417 3.551 20 0 FHADHM COc1cc(NC(=O)c2ccc3c(c2[O-])CCCC3)c(OC)c(C)c1OC ZINC000436927118 944812844 /nfs/dbraw/zinc/81/28/44/944812844.db2.gz MJMYTPXPVSPUMM-UHFFFAOYSA-N -1 3 371.433 3.858 20 0 FHADHM COc1cccc([C@@H](CC(=O)[O-])NCc2ccc(OCC3CC3)cc2)c1 ZINC000426795063 944816734 /nfs/dbraw/zinc/81/67/34/944816734.db2.gz WPKQJEPDIXPFLG-HXUWFJFHSA-N -1 3 355.434 3.790 20 0 FHADHM O=C(Nc1cccc2c1OCC(=O)N2)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436933761 944820975 /nfs/dbraw/zinc/82/09/75/944820975.db2.gz IZURWAUPOWQSPT-UHFFFAOYSA-N -1 3 374.396 3.566 20 0 FHADHM O=C([O-])[C@H](NCc1ccc(OCc2ccncc2)cc1)c1cccc(F)c1 ZINC000426800957 944822174 /nfs/dbraw/zinc/82/21/74/944822174.db2.gz PLQLHYAOCYIZJX-HXUWFJFHSA-N -1 3 366.392 3.715 20 0 FHADHM COc1ccc([C@@H](NCc2cccc(Br)c2)C(=O)[O-])cc1F ZINC000426803733 944826028 /nfs/dbraw/zinc/82/60/28/944826028.db2.gz OXYIEYBTCBCSOV-OAHLLOKOSA-N -1 3 368.202 3.512 20 0 FHADHM CCCSC[C@@H](NCc1cc(Br)ccc1Cl)C(=O)[O-] ZINC000426808650 944829383 /nfs/dbraw/zinc/82/93/83/944829383.db2.gz AOUIIJUFSMNFTG-GFCCVEGCSA-N -1 3 366.708 3.789 20 0 FHADHM O=C([N-]c1nc(CC(F)(F)F)cs1)c1cc(-c2ccccn2)no1 ZINC000518824591 944831109 /nfs/dbraw/zinc/83/11/09/944831109.db2.gz FNLJQUQQLJVNGB-UHFFFAOYSA-N -1 3 354.313 3.550 20 0 FHADHM COCCCOc1cc(C)ccc1-c1noc(-c2cc(OC)ccc2[O-])n1 ZINC000436944190 944831155 /nfs/dbraw/zinc/83/11/55/944831155.db2.gz AHDYUTDTKHVHED-UHFFFAOYSA-N -1 3 370.405 3.842 20 0 FHADHM O=S(=O)([N-][C@H]1CCc2cc(F)ccc21)c1csc(-c2ccccc2)n1 ZINC000500415124 944833481 /nfs/dbraw/zinc/83/34/81/944833481.db2.gz JTUJCBPINDLABK-INIZCTEOSA-N -1 3 374.462 3.915 20 0 FHADHM COc1ccc([C@H](NCc2cccc(OC(F)(F)F)c2)C(=O)[O-])cc1F ZINC000426822719 944845278 /nfs/dbraw/zinc/84/52/78/944845278.db2.gz FHQVZBJFLPBQMM-HNNXBMFYSA-N -1 3 373.302 3.648 20 0 FHADHM Cc1cc(CN[C@@H](CC(=O)[O-])c2cccc(Cl)c2)ccc1-n1cncn1 ZINC000426823022 944845552 /nfs/dbraw/zinc/84/55/52/944845552.db2.gz AEPAPFHLERPPBS-KRWDZBQOSA-N -1 3 370.840 3.535 20 0 FHADHM COc1ccc(C(=O)NCC[C@H](c2ccccc2)C(F)(F)F)c([O-])c1 ZINC000436956336 944850420 /nfs/dbraw/zinc/85/04/20/944850420.db2.gz QIJJTNUQRSYPGE-OAHLLOKOSA-N -1 3 353.340 3.867 20 0 FHADHM Cc1cc(NC(=O)c2ccc3c(c2[O-])CCCC3)ccc1C(=O)N(C)C ZINC000436973745 944862809 /nfs/dbraw/zinc/86/28/09/944862809.db2.gz YHXLMOMKPHWTRP-UHFFFAOYSA-N -1 3 352.434 3.534 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)C[C@@H]2CCCc3ccccc32)s1 ZINC000736678717 944868031 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FHADHM CCCOc1ccc(-c2nc(C(=O)NCc3ncccc3[O-])cs2)cc1 ZINC000473634576 945636601 /nfs/dbraw/zinc/63/66/01/945636601.db2.gz WAGHKKWTUWBKAW-UHFFFAOYSA-N -1 3 369.446 3.630 20 0 FHADHM CCCCOc1c(Cl)cc(C(=O)NCc2ncccc2[O-])cc1OC ZINC000473631576 945643394 /nfs/dbraw/zinc/64/33/94/945643394.db2.gz TVGIASYWVBOFRQ-UHFFFAOYSA-N -1 3 364.829 3.558 20 0 FHADHM O=C(NCc1ncccc1[O-])c1ccccc1C(=O)c1ccc(Cl)cc1 ZINC000473638743 945665877 /nfs/dbraw/zinc/66/58/77/945665877.db2.gz ZITXZGDPTNXIJV-UHFFFAOYSA-N -1 3 366.804 3.602 20 0 FHADHM Cc1nc(-c2ccc(Cl)s2)sc1C(=O)NCc1ncccc1[O-] ZINC000473639727 945668434 /nfs/dbraw/zinc/66/84/34/945668434.db2.gz RAFHFBGBTGHJAK-UHFFFAOYSA-N -1 3 365.867 3.864 20 0 FHADHM Cc1c(Br)ccc(NC(=O)c2cc(=O)[n-]c(C3CC3)n2)c1F ZINC000519714942 945692249 /nfs/dbraw/zinc/69/22/49/945692249.db2.gz TWEAIBGMLZEBDZ-UHFFFAOYSA-N -1 3 366.190 3.522 20 0 FHADHM O=C(CCSc1ccnc2cc(Cl)ccc21)NCc1ncccc1[O-] ZINC000473646191 945699457 /nfs/dbraw/zinc/69/94/57/945699457.db2.gz 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CC[C@@H]([N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1F)c1nccs1 ZINC000444082695 945828938 /nfs/dbraw/zinc/82/89/38/945828938.db2.gz ITMYUWMVJBBOCS-SNVBAGLBSA-N -1 3 368.377 3.731 20 0 FHADHM Cc1ccc(C(=O)NCC2(c3cccc(Cl)c3)CCOCC2)c([O-])c1 ZINC000111210477 945844564 /nfs/dbraw/zinc/84/45/64/945844564.db2.gz WVPRSEXJAVWOOW-UHFFFAOYSA-N -1 3 359.853 3.832 20 0 FHADHM O=C(Cc1ccc(-c2ccccc2)cc1)Nc1ccc(Cc2nnn[n-]2)cc1 ZINC000473890946 945972790 /nfs/dbraw/zinc/97/27/90/945972790.db2.gz MZNQVXKVVXDELT-UHFFFAOYSA-N -1 3 369.428 3.639 20 0 FHADHM O=C(Cc1ccc(-c2ccccc2)cc1)Nc1ccc(Cc2nn[n-]n2)cc1 ZINC000473890946 945972801 /nfs/dbraw/zinc/97/28/01/945972801.db2.gz MZNQVXKVVXDELT-UHFFFAOYSA-N -1 3 369.428 3.639 20 0 FHADHM Cc1cc(C)c2ncc(-c3nnn[n-]3)c(N3CCC[C@@H]3c3ccco3)c2c1 ZINC000822194968 945976657 /nfs/dbraw/zinc/97/66/57/945976657.db2.gz BQHSRMUQSSBRME-MRXNPFEDSA-N -1 3 360.421 3.966 20 0 FHADHM Cc1cc(C)c2ncc(-c3nn[n-]n3)c(N3CCC[C@@H]3c3ccco3)c2c1 ZINC000822194968 945976680 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Cc1nc(-c2ccccc2)ccc1C(=O)Nc1ccc(F)cc1-c1nnn[n-]1 ZINC000822418695 946083320 /nfs/dbraw/zinc/08/33/20/946083320.db2.gz DQJYJBXPUMQAJN-UHFFFAOYSA-N -1 3 374.379 3.629 20 0 FHADHM Cc1nc(-c2ccccc2)ccc1C(=O)Nc1ccc(F)cc1-c1nn[n-]n1 ZINC000822418695 946083327 /nfs/dbraw/zinc/08/33/27/946083327.db2.gz DQJYJBXPUMQAJN-UHFFFAOYSA-N -1 3 374.379 3.629 20 0 FHADHM Cc1cc2c(cc1C)O[C@H](C(=O)Nc1ccc([O-])c(C(F)(F)F)c1)C2 ZINC000440998597 946099000 /nfs/dbraw/zinc/09/90/00/946099000.db2.gz BNJIISCYTQLFRI-INIZCTEOSA-N -1 3 351.324 3.970 20 0 FHADHM C[C@@H]1COC2(CCC2)CN1Cc1nc(=O)c2c(-c3ccco3)csc2[n-]1 ZINC000661464448 946153694 /nfs/dbraw/zinc/15/36/94/946153694.db2.gz FEHLORFUXHOGJZ-GFCCVEGCSA-N -1 3 371.462 3.800 20 0 FHADHM O=C(Nc1ccccc1NCC(F)(F)F)c1c[n-]c2ccccc2c1=O ZINC000520121850 946170368 /nfs/dbraw/zinc/17/03/68/946170368.db2.gz PCOSCBSLGWDRPV-UHFFFAOYSA-N -1 3 361.323 3.755 20 0 FHADHM CCCN(C(=O)Nc1ccc2c(c1)C(=O)[N-]C2=O)[C@H](CC)c1ccccc1 ZINC000520153781 946218125 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CCCCOC1CCN(c2c(C(=O)[O-])cnc3ccc(OC)cc32)CC1 ZINC000520412139 946556721 /nfs/dbraw/zinc/55/67/21/946556721.db2.gz NODCEIOWGKWDQF-UHFFFAOYSA-N -1 3 358.438 3.727 20 0 FHADHM Cc1cc(S(=O)(=O)[N-][C@H](c2ccccc2)[C@@H]2CCCO2)sc1Cl ZINC000473910444 946623815 /nfs/dbraw/zinc/62/38/15/946623815.db2.gz GNUBGKKURTXUEV-DZGCQCFKSA-N -1 3 371.911 3.909 20 0 FHADHM Brc1ccccc1CCSc1ccccc1-c1nnn[n-]1 ZINC001573279152 946632109 /nfs/dbraw/zinc/63/21/09/946632109.db2.gz DLUGTSCWOGUKOS-UHFFFAOYSA-N -1 3 361.268 3.964 20 0 FHADHM Brc1ccccc1CCSc1ccccc1-c1nn[n-]n1 ZINC001573279152 946632112 /nfs/dbraw/zinc/63/21/12/946632112.db2.gz DLUGTSCWOGUKOS-UHFFFAOYSA-N -1 3 361.268 3.964 20 0 FHADHM Brc1cc(-c2nnn[n-]2)cnc1Oc1ccc2ccccc2c1 ZINC001573279635 946645609 /nfs/dbraw/zinc/64/56/09/946645609.db2.gz KQJGVFAIIQMQHS-UHFFFAOYSA-N -1 3 368.194 3.970 20 0 FHADHM Brc1cc(-c2nn[n-]n2)cnc1Oc1ccc2ccccc2c1 ZINC001573279635 946645615 /nfs/dbraw/zinc/64/56/15/946645615.db2.gz KQJGVFAIIQMQHS-UHFFFAOYSA-N -1 3 368.194 3.970 20 0 FHADHM Brc1cc(NCc2cc3ccccc3o2)ccc1-c1nnn[n-]1 ZINC001573280639 946665502 /nfs/dbraw/zinc/66/55/02/946665502.db2.gz VDDBMCQVDIERMM-UHFFFAOYSA-N -1 3 370.210 3.988 20 0 FHADHM Brc1cc(NCc2cc3ccccc3o2)ccc1-c1nn[n-]n1 ZINC001573280639 946665507 /nfs/dbraw/zinc/66/55/07/946665507.db2.gz VDDBMCQVDIERMM-UHFFFAOYSA-N -1 3 370.210 3.988 20 0 FHADHM Brc1ccc(-c2nnn[n-]2)c(Nc2cnn(C3CCCC3)c2)c1 ZINC001573281119 946672154 /nfs/dbraw/zinc/67/21/54/946672154.db2.gz ZUSQBNVDHOGGES-UHFFFAOYSA-N -1 3 374.246 3.684 20 0 FHADHM Brc1ccc(-c2nn[n-]n2)c(Nc2cnn(C3CCCC3)c2)c1 ZINC001573281119 946672164 /nfs/dbraw/zinc/67/21/64/946672164.db2.gz ZUSQBNVDHOGGES-UHFFFAOYSA-N -1 3 374.246 3.684 20 0 FHADHM Brc1cc(N2CC[C@H](C3CCCC3)C2)ccc1-c1nnn[n-]1 ZINC001573281110 946672687 /nfs/dbraw/zinc/67/26/87/946672687.db2.gz ZPQGNHHEBLVEBZ-LBPRGKRZSA-N -1 3 362.275 3.646 20 0 FHADHM Brc1cc(N2CC[C@H](C3CCCC3)C2)ccc1-c1nn[n-]n1 ZINC001573281110 946672692 /nfs/dbraw/zinc/67/26/92/946672692.db2.gz ZPQGNHHEBLVEBZ-LBPRGKRZSA-N -1 3 362.275 3.646 20 0 FHADHM CC(C)CCOc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)CCO3)cc1 ZINC000614785558 946703028 /nfs/dbraw/zinc/70/30/28/946703028.db2.gz UQYARCVUBGDEKL-UHFFFAOYSA-N -1 3 361.463 3.847 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2cccc(OC(F)(F)F)c2)c(C)c1 ZINC000614780718 946710338 /nfs/dbraw/zinc/71/03/38/946710338.db2.gz LAGOYJUPSXVWEH-UHFFFAOYSA-N -1 3 361.341 3.703 20 0 FHADHM COc1ccccc1O[C@@H]1CCCN(C(=O)c2cc(SC)ccc2[O-])C1 ZINC000614782950 946715247 /nfs/dbraw/zinc/71/52/47/946715247.db2.gz HYOLAESMQVBJHD-CQSZACIVSA-N -1 3 373.474 3.806 20 0 FHADHM C[C@H](NC(=O)c1ccco1)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824521259 946757708 /nfs/dbraw/zinc/75/77/08/946757708.db2.gz IZFIVTJZHKDWHJ-ZDUSSCGKSA-N -1 3 359.389 3.618 20 0 FHADHM C[C@H](NC(=O)c1ccco1)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824521259 946757712 /nfs/dbraw/zinc/75/77/12/946757712.db2.gz IZFIVTJZHKDWHJ-ZDUSSCGKSA-N -1 3 359.389 3.618 20 0 FHADHM C[C@H](N[C@@H](c1cccc(F)c1)c1ccccn1)c1cccc(-c2nn[n-]n2)c1 ZINC000824538404 946775011 /nfs/dbraw/zinc/77/50/11/946775011.db2.gz IVVJZRIYZSWYER-XOBRGWDASA-N -1 3 374.423 3.841 20 0 FHADHM C[C@@H](N[C@H](c1cccc(F)c1)c1ccccn1)c1cccc(-c2nn[n-]n2)c1 ZINC000824538400 946775639 /nfs/dbraw/zinc/77/56/39/946775639.db2.gz IVVJZRIYZSWYER-JLTOFOAXSA-N -1 3 374.423 3.841 20 0 FHADHM O=C(Nc1ccc(Cc2nnn[n-]2)cc1)c1ccc2c(c1)Cc1ccccc1-2 ZINC000473932856 946776664 /nfs/dbraw/zinc/77/66/64/946776664.db2.gz NCEWENWCJWQPLM-UHFFFAOYSA-N -1 3 367.412 3.614 20 0 FHADHM O=C(Nc1ccc(Cc2nn[n-]n2)cc1)c1ccc2c(c1)Cc1ccccc1-2 ZINC000473932856 946776669 /nfs/dbraw/zinc/77/66/69/946776669.db2.gz NCEWENWCJWQPLM-UHFFFAOYSA-N -1 3 367.412 3.614 20 0 FHADHM CC(C)(C)c1ccc(C(=O)NCC(=O)Nc2cc(Cl)ccc2[O-])cc1 ZINC000104823417 946785121 /nfs/dbraw/zinc/78/51/21/946785121.db2.gz FZRJAFVGQKGIMR-UHFFFAOYSA-N -1 3 360.841 3.712 20 0 FHADHM CCC(CC)[C@H]1C[C@H]([N-]S(=O)(=O)c2cc(C)c(Cl)s2)CCO1 ZINC000473939662 946806006 /nfs/dbraw/zinc/80/60/06/946806006.db2.gz XOMGRSVFGKYWKW-CHWSQXEVSA-N -1 3 365.948 3.972 20 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C[C@@H]1CN(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)[C@H]2CCCC[C@H]12 ZINC000824976917 947016308 /nfs/dbraw/zinc/01/63/08/947016308.db2.gz PKYXUGPZIKDZEP-HCKVZZMMSA-N -1 3 360.849 3.563 20 0 FHADHM C[C@@H]1CN(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)[C@H]2CCCC[C@H]12 ZINC000824976917 947016317 /nfs/dbraw/zinc/01/63/17/947016317.db2.gz PKYXUGPZIKDZEP-HCKVZZMMSA-N -1 3 360.849 3.563 20 0 FHADHM O=S(=O)([N-][C@@H](c1ccccc1)[C@@H]1CCCO1)c1ccc(Cl)cc1F ZINC000523295135 947073025 /nfs/dbraw/zinc/07/30/25/947073025.db2.gz XLZGGFHVONZYSX-RDJZCZTQSA-N -1 3 369.845 3.678 20 0 FHADHM CC[C@@H]1CC[C@@H](C)N1C(=O)c1c[n-]c2ccc(Br)cc2c1=O ZINC000444350848 947089166 /nfs/dbraw/zinc/08/91/66/947089166.db2.gz INIZITHTGVYSDA-ZYHUDNBSSA-N -1 3 363.255 3.694 20 0 FHADHM CCc1nc2c(s1)[C@H](N(C)CCOc1cccc(C(=O)[O-])c1)CCC2 ZINC000652431758 947101274 /nfs/dbraw/zinc/10/12/74/947101274.db2.gz LNYMSKGQXFJYRI-MRXNPFEDSA-N -1 3 360.479 3.792 20 0 FHADHM CCC[C@H](C(=O)Oc1c(Cl)cc(-c2nnn[n-]2)cc1OC)C(C)C ZINC000825224963 947125378 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O=C(Nc1ccc([O-])c(C(F)(F)F)c1)[C@@H]1CCCN(CC(F)(F)F)C1 ZINC000330533426 947211947 /nfs/dbraw/zinc/21/19/47/947211947.db2.gz ULOZPQNNXYYVTG-SECBINFHSA-N -1 3 370.293 3.624 20 0 FHADHM O=C([O-])c1cccc2c1CN(CCOc1ccc(C(F)(F)F)cc1)CC2 ZINC000652487467 947225712 /nfs/dbraw/zinc/22/57/12/947225712.db2.gz GUTYDXDFQRQVCM-UHFFFAOYSA-N -1 3 365.351 3.841 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2ccc(OC(F)F)c(F)c2)c(C)c1 ZINC000055637942 947238284 /nfs/dbraw/zinc/23/82/84/947238284.db2.gz SDVKHRBENIXDQZ-UHFFFAOYSA-N -1 3 361.341 3.545 20 0 FHADHM C[C@@H]1CN(Cc2cc(Br)cc3cccnc32)CC[C@H]1C(=O)[O-] ZINC000652497562 947247578 /nfs/dbraw/zinc/24/75/78/947247578.db2.gz YVQSINHRZUYVEF-IAQYHMDHSA-N -1 3 363.255 3.540 20 0 FHADHM O=C([N-]NC(=O)c1ccc(Cl)c(Cl)c1)c1ccc2ccccc2n1 ZINC000027688548 947248492 /nfs/dbraw/zinc/24/84/92/947248492.db2.gz NYWYEAPZSUAVJK-UHFFFAOYSA-N -1 3 360.200 3.616 20 0 FHADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(Oc3nccc(C)n3)cc2)cc1 ZINC000301249710 947251489 /nfs/dbraw/zinc/25/14/89/947251489.db2.gz AWCUNJKPSKFLJO-UHFFFAOYSA-N -1 3 355.419 3.687 20 0 FHADHM Cc1ccc(Nc2nc(CN3C[C@@H](C(=O)[O-])[C@H](C4CC4)C3)cs2)cc1 ZINC000652514972 947257580 /nfs/dbraw/zinc/25/75/80/947257580.db2.gz JCWBNYADTCFYOO-DLBZAZTESA-N -1 3 357.479 3.738 20 0 FHADHM Cc1cn2cc([N-]S(=O)(=O)c3c(C)c(C)c(C)c(C)c3C)ccc2n1 ZINC000523458458 947280728 /nfs/dbraw/zinc/28/07/28/947280728.db2.gz FZKPPKXPNXMTIW-UHFFFAOYSA-N -1 3 357.479 3.986 20 0 FHADHM Cc1nc(-c2ccc(NCc3ccc(-n4ccnc4)cc3)nc2)[n-]c(=O)c1C ZINC000301355888 947304890 /nfs/dbraw/zinc/30/48/90/947304890.db2.gz KJAOVDCCSKJLBW-UHFFFAOYSA-N -1 3 372.432 3.659 20 0 FHADHM O=S(=O)([N-]CC1(c2cccc(F)c2)CC1)c1cc(F)ccc1Cl ZINC000523522014 947350125 /nfs/dbraw/zinc/35/01/25/947350125.db2.gz QFJYSLADRMQSAP-UHFFFAOYSA-N -1 3 357.809 3.628 20 0 FHADHM CCCCOc1ccc(C(=O)N2Cc3c[nH]nc3CC(C)(C)C2)c([O-])c1 ZINC000663197320 947366971 /nfs/dbraw/zinc/36/69/71/947366971.db2.gz CGUVOZCWUOIKKZ-UHFFFAOYSA-N -1 3 357.454 3.519 20 0 FHADHM CCO[C@H](C[N-]S(=O)(=O)c1ccc(Cl)cc1F)c1ccccc1 ZINC000444971913 947380823 /nfs/dbraw/zinc/38/08/23/947380823.db2.gz DZZQTDGWKDQRQB-OAHLLOKOSA-N -1 3 357.834 3.535 20 0 FHADHM Cc1ncc(S(=O)(=O)[N-][C@H](C)c2ccc(Cl)cc2Cl)s1 ZINC000444972799 947381699 /nfs/dbraw/zinc/38/16/99/947381699.db2.gz CZFQMUTXIPZDIF-SSDOTTSWSA-N -1 3 351.280 3.798 20 0 FHADHM O=S(=O)([N-]C[C@H](c1c[nH]c2ccccc21)c1ccccc1)c1ccco1 ZINC000188559251 947440825 /nfs/dbraw/zinc/44/08/25/947440825.db2.gz CUFGZIBWATZHTE-KRWDZBQOSA-N -1 3 366.442 3.871 20 0 FHADHM COc1cc(C=NNC(=O)c2cc(C)nc3ccccc32)cc(Cl)c1[O-] ZINC000254399389 947490578 /nfs/dbraw/zinc/49/05/78/947490578.db2.gz VXHWQRLESADYCA-UHFFFAOYSA-N -1 3 369.808 3.675 20 0 FHADHM O=C(NN=Cc1cc(Cl)ccc1[O-])c1ccccc1Br ZINC000254305475 947495270 /nfs/dbraw/zinc/49/52/70/947495270.db2.gz JPRKZUOLLPBRCW-UHFFFAOYSA-N -1 3 353.603 3.572 20 0 FHADHM CCOC(=O)c1ccc(NC(=O)[C@@H]2C[C@@H]2c2cc(F)ccc2F)c([O-])c1 ZINC000536336935 947533189 /nfs/dbraw/zinc/53/31/89/947533189.db2.gz QUWSRGCEMGLYFA-TZMCWYRMSA-N -1 3 361.344 3.589 20 0 FHADHM O=C(CCCOc1cccc(Br)c1)[N-]OCCC(F)(F)F ZINC000162882185 947579367 /nfs/dbraw/zinc/57/93/67/947579367.db2.gz RONHFUILZNYAEN-UHFFFAOYSA-N -1 3 370.165 3.608 20 0 FHADHM COc1ccc(CN[C@H](C(=O)[O-])c2cccc(C(F)(F)F)c2)cc1OC ZINC000663260633 947581309 /nfs/dbraw/zinc/58/13/09/947581309.db2.gz CRMAZEICMUVBBO-INIZCTEOSA-N -1 3 369.339 3.638 20 0 FHADHM O=C([O-])[C@H](CC(F)F)NCc1ccccc1OCc1ccc(F)cc1F ZINC000663261348 947584513 /nfs/dbraw/zinc/58/45/13/947584513.db2.gz AYCRDFNRZXIYSX-HNNXBMFYSA-N -1 3 371.330 3.742 20 0 FHADHM O=C([O-])CC[C@H](CNCc1cc(F)cc(Br)c1)C(F)(F)F ZINC000663261878 947584735 /nfs/dbraw/zinc/58/47/35/947584735.db2.gz NUGRZWREMHZRES-SECBINFHSA-N -1 3 372.156 3.721 20 0 FHADHM COc1ccc(CNc2nc3c(ccc(F)c3C)s2)cc1-c1nnn[n-]1 ZINC000826204295 947604651 /nfs/dbraw/zinc/60/46/51/947604651.db2.gz FVZBSTYZBDXABJ-UHFFFAOYSA-N -1 3 370.413 3.545 20 0 FHADHM COc1ccc(CNc2nc3c(ccc(F)c3C)s2)cc1-c1nn[n-]n1 ZINC000826204295 947604662 /nfs/dbraw/zinc/60/46/62/947604662.db2.gz FVZBSTYZBDXABJ-UHFFFAOYSA-N -1 3 370.413 3.545 20 0 FHADHM COC(=O)c1nc2ccc(NCc3c(C)cc(Cl)cc3Cl)nc2[n-]1 ZINC001167795708 947700105 /nfs/dbraw/zinc/70/01/05/947700105.db2.gz KGMBVHKOKIVVIJ-UHFFFAOYSA-N -1 3 365.220 3.972 20 0 FHADHM COC(=O)c1nc2nc(NCc3c(C)cc(Cl)cc3Cl)ccc2[n-]1 ZINC001167795708 947700110 /nfs/dbraw/zinc/70/01/10/947700110.db2.gz KGMBVHKOKIVVIJ-UHFFFAOYSA-N -1 3 365.220 3.972 20 0 FHADHM COC(=O)c1nc2ccc(NCc3c(C)cc(Cl)cc3Cl)[n-]c-2n1 ZINC001167795708 947700114 /nfs/dbraw/zinc/70/01/14/947700114.db2.gz KGMBVHKOKIVVIJ-UHFFFAOYSA-N -1 3 365.220 3.972 20 0 FHADHM C/C(=C/C1CCC(C)CC1)C(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1 ZINC001573363114 947707310 /nfs/dbraw/zinc/70/73/10/947707310.db2.gz BBMMWELCLRUQKR-PTNGSMBKSA-N -1 3 353.470 3.598 20 0 FHADHM C/C(=C/C1CCC(C)CC1)C(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1 ZINC001573363114 947707316 /nfs/dbraw/zinc/70/73/16/947707316.db2.gz BBMMWELCLRUQKR-PTNGSMBKSA-N -1 3 353.470 3.598 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)N(C)[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC001573365168 947728730 /nfs/dbraw/zinc/72/87/30/947728730.db2.gz LJSRGMVHYDREOH-FZDNWWAKSA-N -1 3 365.412 3.629 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)N(C)[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC001573365168 947728740 /nfs/dbraw/zinc/72/87/40/947728740.db2.gz LJSRGMVHYDREOH-FZDNWWAKSA-N -1 3 365.412 3.629 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)N(C)[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC001573365174 947728886 /nfs/dbraw/zinc/72/88/86/947728886.db2.gz LJSRGMVHYDREOH-YPDDLIOESA-N -1 3 365.412 3.629 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)N(C)[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC001573365174 947728893 /nfs/dbraw/zinc/72/88/93/947728893.db2.gz LJSRGMVHYDREOH-YPDDLIOESA-N -1 3 365.412 3.629 20 0 FHADHM CC(=Cc1ccc(C)cc1)C(=O)Nc1c(-c2nnn[n-]2)c(C)c2ccccn21 ZINC001573366012 947737676 /nfs/dbraw/zinc/73/76/76/947737676.db2.gz OPXJDBJTYRJKRT-WYMLVPIESA-N -1 3 372.432 3.778 20 0 FHADHM CC(=Cc1ccc(C)cc1)C(=O)Nc1c(-c2nn[n-]n2)c(C)c2ccccn21 ZINC001573366012 947737679 /nfs/dbraw/zinc/73/76/79/947737679.db2.gz OPXJDBJTYRJKRT-WYMLVPIESA-N -1 3 372.432 3.778 20 0 FHADHM C/C(=C\C1CCC(C)CC1)C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC001573367189 947754647 /nfs/dbraw/zinc/75/46/47/947754647.db2.gz YOXKOCUDEXKGSP-KVPCFKPJSA-N -1 3 353.470 3.817 20 0 FHADHM C/C(=C\C1CCC(C)CC1)C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC001573367189 947754657 /nfs/dbraw/zinc/75/46/57/947754657.db2.gz YOXKOCUDEXKGSP-KVPCFKPJSA-N -1 3 353.470 3.817 20 0 FHADHM O=C(OCc1csc(COc2ccc(F)cc2)n1)c1ccc([O-])cc1 ZINC000728855334 947787104 /nfs/dbraw/zinc/78/71/04/947787104.db2.gz XSXSZZYENLOJHJ-UHFFFAOYSA-N -1 3 359.378 3.924 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)c(NCc2ccccc2OCc2ccccc2)n1 ZINC000826277506 947798252 /nfs/dbraw/zinc/79/82/52/947798252.db2.gz WQZODHYUMAUTQH-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)c(NCc2ccccc2OCc2ccccc2)n1 ZINC000826277506 947798261 /nfs/dbraw/zinc/79/82/61/947798261.db2.gz WQZODHYUMAUTQH-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM Cc1ccc(C(=O)N[C@@H](C)c2ccc(-c3cccc(-c4nnn[n-]4)c3)cc2)o1 ZINC000826281699 947807608 /nfs/dbraw/zinc/80/76/08/947807608.db2.gz GJKNJWMSPZQEFT-AWEZNQCLSA-N -1 3 373.416 3.926 20 0 FHADHM Cc1ccc(C(=O)N[C@@H](C)c2ccc(-c3cccc(-c4nn[n-]n4)c3)cc2)o1 ZINC000826281699 947807618 /nfs/dbraw/zinc/80/76/18/947807618.db2.gz GJKNJWMSPZQEFT-AWEZNQCLSA-N -1 3 373.416 3.926 20 0 FHADHM Cc1ccc(C2CCN(c3cc(-c4nnn[n-]4)c4ccccc4n3)CC2)cn1 ZINC000826285904 947825932 /nfs/dbraw/zinc/82/59/32/947825932.db2.gz NIEAOHZBECDTJK-UHFFFAOYSA-N -1 3 371.448 3.502 20 0 FHADHM Cc1ccc(C2CCN(c3cc(-c4nn[n-]n4)c4ccccc4n3)CC2)cn1 ZINC000826285904 947825938 /nfs/dbraw/zinc/82/59/38/947825938.db2.gz NIEAOHZBECDTJK-UHFFFAOYSA-N -1 3 371.448 3.502 20 0 FHADHM COC(=O)c1ccc(S(=O)(=O)[N-]c2ccsc2Cl)cc1Cl ZINC000189733432 947829053 /nfs/dbraw/zinc/82/90/53/947829053.db2.gz SYHFJEHNAKIBAN-UHFFFAOYSA-N -1 3 366.247 3.642 20 0 FHADHM Cc1ccc(Cl)c2ccc(NC(=O)c3ccc(-c4nnn[n-]4)cc3)nc12 ZINC000826289420 947842637 /nfs/dbraw/zinc/84/26/37/947842637.db2.gz ZGFSQYHEWFQMMB-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1ccc(Cl)c2ccc(NC(=O)c3ccc(-c4nn[n-]n4)cc3)nc12 ZINC000826289420 947842641 /nfs/dbraw/zinc/84/26/41/947842641.db2.gz ZGFSQYHEWFQMMB-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM CSc1ccc([O-])c(C(=O)N[C@@H]2CC(C)(C)Oc3ccc(N)cc32)c1 ZINC000662563875 947905277 /nfs/dbraw/zinc/90/52/77/947905277.db2.gz JSILWPSHWPPRGP-OAHLLOKOSA-N -1 3 358.463 3.729 20 0 FHADHM CCCCOc1ccc(C(=O)N(C)CC(=O)Nc2ccc(C)cc2)c([O-])c1 ZINC000190004466 947909090 /nfs/dbraw/zinc/90/90/90/947909090.db2.gz UPLMGSDFQVQCCN-UHFFFAOYSA-N -1 3 370.449 3.590 20 0 FHADHM Cc1nc(C(C)C)sc1[C@H](C)OC(=O)c1sccc1-c1nnn[n-]1 ZINC000826323951 947947473 /nfs/dbraw/zinc/94/74/73/947947473.db2.gz YVHNZJKHBAKMCS-VIFPVBQESA-N -1 3 363.468 3.735 20 0 FHADHM COC(=O)c1ccc(NC(=O)c2cc([O-])c3ccccc3c2)c(OC)c1 ZINC000473195532 948009604 /nfs/dbraw/zinc/00/96/04/948009604.db2.gz WOPZFGRNDOIZPD-UHFFFAOYSA-N -1 3 351.358 3.593 20 0 FHADHM CCc1ccc(C(=O)N2CCC(OCCc3ccccc3)CC2)c([O-])c1 ZINC000190532472 948049189 /nfs/dbraw/zinc/04/91/89/948049189.db2.gz DUGJQIAJMFPWSE-UHFFFAOYSA-N -1 3 353.462 3.819 20 0 FHADHM Cn1cc(CNc2c(Cl)cccc2-c2nnn[n-]2)c(-c2ccccc2)n1 ZINC000826361714 948134109 /nfs/dbraw/zinc/13/41/09/948134109.db2.gz KSWZXRPZOIZMIF-UHFFFAOYSA-N -1 3 365.828 3.533 20 0 FHADHM Cn1cc(CNc2c(Cl)cccc2-c2nn[n-]n2)c(-c2ccccc2)n1 ZINC000826361714 948134116 /nfs/dbraw/zinc/13/41/16/948134116.db2.gz KSWZXRPZOIZMIF-UHFFFAOYSA-N -1 3 365.828 3.533 20 0 FHADHM FC(F)(F)[C@H](NCCC1=CCCCC1)c1cccc(-c2nnn[n-]2)c1 ZINC000826366907 948146150 /nfs/dbraw/zinc/14/61/50/948146150.db2.gz COYZAMINFKNEDB-OAHLLOKOSA-N -1 3 351.376 3.950 20 0 FHADHM FC(F)(F)[C@H](NCCC1=CCCCC1)c1cccc(-c2nn[n-]n2)c1 ZINC000826366907 948146157 /nfs/dbraw/zinc/14/61/57/948146157.db2.gz COYZAMINFKNEDB-OAHLLOKOSA-N -1 3 351.376 3.950 20 0 FHADHM FC(F)(F)[C@@H](NCc1ccc(Cl)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000826367356 948146269 /nfs/dbraw/zinc/14/62/69/948146269.db2.gz WFMAPSQTKFJYIN-AWEZNQCLSA-N -1 3 367.762 3.913 20 0 FHADHM FC(F)(F)[C@@H](NCc1ccc(Cl)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000826367356 948146274 /nfs/dbraw/zinc/14/62/74/948146274.db2.gz WFMAPSQTKFJYIN-AWEZNQCLSA-N -1 3 367.762 3.913 20 0 FHADHM O=C(Cc1ccc(-c2nnn[n-]2)cc1)Nc1ncc(C2CCCCC2)s1 ZINC000826422052 948267111 /nfs/dbraw/zinc/26/71/11/948267111.db2.gz KPLFSFBLOOVJBE-UHFFFAOYSA-N -1 3 368.466 3.552 20 0 FHADHM O=C(Cc1ccc(-c2nn[n-]n2)cc1)Nc1ncc(C2CCCCC2)s1 ZINC000826422052 948267119 /nfs/dbraw/zinc/26/71/19/948267119.db2.gz KPLFSFBLOOVJBE-UHFFFAOYSA-N -1 3 368.466 3.552 20 0 FHADHM CO[C@@H](CNCc1ccc(-c2ccc(Cl)c(Cl)c2)o1)CC(=O)[O-] ZINC000417637113 948378444 /nfs/dbraw/zinc/37/84/44/948378444.db2.gz MQPKMIWEHYFIHC-GFCCVEGCSA-N -1 3 358.221 3.833 20 0 FHADHM O=C([O-])C[C@H](CNCc1ccc(Br)cc1Cl)C(F)(F)F ZINC000417635199 948382185 /nfs/dbraw/zinc/38/21/85/948382185.db2.gz WCBMIFSNIUBEFS-MRVPVSSYSA-N -1 3 374.584 3.845 20 0 FHADHM Cc1cc(-c2ccccc2)ccc1NC(=O)c1ccc2c(c1)C(=O)[N-]C2=O ZINC000729519386 948466229 /nfs/dbraw/zinc/46/62/29/948466229.db2.gz BAPVIFUABZZJIK-UHFFFAOYSA-N -1 3 356.381 3.798 20 0 FHADHM Cc1cc2occ(C(=O)Nc3cc(-c4nnn[n-]4)ccc3F)c2cc1C ZINC001129613128 948471547 /nfs/dbraw/zinc/47/15/47/948471547.db2.gz OPZQOVUODDFXQA-UHFFFAOYSA-N -1 3 351.341 3.621 20 0 FHADHM Cc1cc2occ(C(=O)Nc3cc(-c4nn[n-]n4)ccc3F)c2cc1C ZINC001129613128 948471550 /nfs/dbraw/zinc/47/15/50/948471550.db2.gz OPZQOVUODDFXQA-UHFFFAOYSA-N -1 3 351.341 3.621 20 0 FHADHM COc1ccc(OCCSCc2noc(-c3ccccc3[O-])n2)cc1 ZINC000050248616 948501174 /nfs/dbraw/zinc/50/11/74/948501174.db2.gz ZLUMLBPTZHEVTR-UHFFFAOYSA-N -1 3 358.419 3.763 20 0 FHADHM CCN(Cc1ccc(OC)cc1)Cc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000053087211 948504426 /nfs/dbraw/zinc/50/44/26/948504426.db2.gz HZEFSCMOWCWCFI-UHFFFAOYSA-N -1 3 363.417 3.700 20 0 FHADHM CC[C@H](C)c1ccccc1OCC(=O)Nc1cc(-c2nnn[n-]2)ccc1F ZINC001460783667 948525973 /nfs/dbraw/zinc/52/59/73/948525973.db2.gz GYMAEIPVNFRUBE-LBPRGKRZSA-N -1 3 369.400 3.537 20 0 FHADHM CC[C@H](C)c1ccccc1OCC(=O)Nc1cc(-c2nn[n-]n2)ccc1F ZINC001460783667 948525978 /nfs/dbraw/zinc/52/59/78/948525978.db2.gz GYMAEIPVNFRUBE-LBPRGKRZSA-N -1 3 369.400 3.537 20 0 FHADHM Cc1nc(-c2ccc(C(=O)Nc3cccc(-c4nnn[n-]4)c3)s2)cs1 ZINC001463831710 948528500 /nfs/dbraw/zinc/52/85/00/948528500.db2.gz CRXFSHOBPGGRSX-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM Cc1nc(-c2ccc(C(=O)Nc3cccc(-c4nn[n-]n4)c3)s2)cs1 ZINC001463831710 948528513 /nfs/dbraw/zinc/52/85/13/948528513.db2.gz CRXFSHOBPGGRSX-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)C=Cc3cccc(F)c3)c2)n1 ZINC000049301964 948536068 /nfs/dbraw/zinc/53/60/68/948536068.db2.gz OYSBMPBQQHZKOT-MDZDMXLPSA-N -1 3 363.392 3.790 20 0 FHADHM O=C(Nc1ccccc1-c1nnn[n-]1)c1cc(Cl)cc(Cl)c1F ZINC001557790079 948556224 /nfs/dbraw/zinc/55/62/24/948556224.db2.gz CAIBCCPMFNMZFD-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccccc1-c1nn[n-]n1)c1cc(Cl)cc(Cl)c1F ZINC001557790079 948556233 /nfs/dbraw/zinc/55/62/33/948556233.db2.gz CAIBCCPMFNMZFD-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM CC(C)CCn1ncc(NC(=O)c2cc3c(cc2[O-])OCO3)c1C(C)C ZINC000436739207 948687548 /nfs/dbraw/zinc/68/75/48/948687548.db2.gz NUROEGPRSOOTNY-UHFFFAOYSA-N -1 3 359.426 3.739 20 0 FHADHM CCCc1nnc([N-]C(=O)c2csc(-c3ccc4c(c3)OCO4)n2)s1 ZINC000523957185 948734083 /nfs/dbraw/zinc/73/40/83/948734083.db2.gz WDOKCFBQXCKNDE-UHFFFAOYSA-N -1 3 374.447 3.595 20 0 FHADHM CC(C)c1ccc(C(=O)N[C@H]2CCCc3cc(-c4nnn[n-]4)ccc32)cc1 ZINC001574416079 948743952 /nfs/dbraw/zinc/74/39/52/948743952.db2.gz OOCKFVVRTVQTMF-IBGZPJMESA-N -1 3 361.449 3.798 20 0 FHADHM CC(C)c1ccc(C(=O)N[C@H]2CCCc3cc(-c4nn[n-]n4)ccc32)cc1 ZINC001574416079 948743959 /nfs/dbraw/zinc/74/39/59/948743959.db2.gz OOCKFVVRTVQTMF-IBGZPJMESA-N -1 3 361.449 3.798 20 0 FHADHM C[C@H](C(=O)Nc1cc(F)cc(-c2nnn[n-]2)c1)c1ccc2ccccc2c1 ZINC001573756530 948820667 /nfs/dbraw/zinc/82/06/67/948820667.db2.gz SRMVDXCRBBIUIP-LBPRGKRZSA-N -1 3 361.380 3.901 20 0 FHADHM C[C@H](C(=O)Nc1cc(F)cc(-c2nn[n-]n2)c1)c1ccc2ccccc2c1 ZINC001573756530 948820683 /nfs/dbraw/zinc/82/06/83/948820683.db2.gz SRMVDXCRBBIUIP-LBPRGKRZSA-N -1 3 361.380 3.901 20 0 FHADHM O=c1ccc(-c2noc(-c3cc(OCc4ccccc4)ccc3[O-])n2)c[nH]1 ZINC000445437870 948820976 /nfs/dbraw/zinc/82/09/76/948820976.db2.gz AAKPUPHBQDUJEN-UHFFFAOYSA-N -1 3 361.357 3.789 20 0 FHADHM CC(C(=O)Nc1c(-c2nnn[n-]2)c(C)c(C)n1-c1ccccc1)=C1CCC1 ZINC001573756876 948823404 /nfs/dbraw/zinc/82/34/04/948823404.db2.gz VCWUMMXKCTWNQA-UHFFFAOYSA-N -1 3 362.437 3.713 20 0 FHADHM CC(C(=O)Nc1c(-c2nn[n-]n2)c(C)c(C)n1-c1ccccc1)=C1CCC1 ZINC001573756876 948823422 /nfs/dbraw/zinc/82/34/22/948823422.db2.gz VCWUMMXKCTWNQA-UHFFFAOYSA-N -1 3 362.437 3.713 20 0 FHADHM Cc1c(NC(=O)c2ccc(C(C)C)cc2[O-])c(=O)n(-c2ccccc2)n1C ZINC000048369303 205162066 /nfs/dbraw/zinc/16/20/66/205162066.db2.gz QNLAEBUXCZPHNK-UHFFFAOYSA-N -1 3 365.433 3.566 20 0 FHADHM C[C@@H](Sc1ccc(Br)cc1)C(=O)Nc1ncccc1[O-] ZINC000048513803 205163809 /nfs/dbraw/zinc/16/38/09/205163809.db2.gz VCVAHQRWHMGGGE-SECBINFHSA-N -1 3 353.241 3.669 20 0 FHADHM CCOC(=O)c1csc(=NC(=O)C(c2ccccc2)c2ccccc2)[n-]1 ZINC000049961554 205176177 /nfs/dbraw/zinc/17/61/77/205176177.db2.gz BVHGYJSKAPKOIP-UHFFFAOYSA-N -1 3 366.442 3.512 20 0 FHADHM Cc1ccc(S(=O)(=O)[N-]c2ccc3nc([C@@H]4CCCO4)[nH]c3c2)cc1C ZINC000060062884 205282663 /nfs/dbraw/zinc/28/26/63/205282663.db2.gz FPPIQONFVPGSOP-SFHVURJKSA-N -1 3 371.462 3.832 20 0 FHADHM CCCc1n[n-]c(=NC(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)s1 ZINC000489536779 514884651 /nfs/dbraw/zinc/88/46/51/514884651.db2.gz SNRSJVVUYXBGJM-ZBFHGGJFSA-N -1 3 373.526 3.523 20 0 FHADHM Cn1[n-]c(=NC(=O)Cc2c(Cl)cccc2Cl)cc1OC(F)F ZINC000490939339 515337392 /nfs/dbraw/zinc/33/73/92/515337392.db2.gz FSTVPGJEDWPXQR-UHFFFAOYSA-N -1 3 350.152 3.510 20 0 FHADHM CC(C)c1ccccc1OCCC(=O)N=c1cc(OC(F)F)n(C)[n-]1 ZINC000490968766 515346512 /nfs/dbraw/zinc/34/65/12/515346512.db2.gz GZGWJMZBLQKAGJ-UHFFFAOYSA-N -1 3 353.369 3.553 20 0 FHADHM Cc1c(Br)cccc1CC(=O)N=c1cc([C@@H]2CCCO2)[n-][nH]1 ZINC000473847736 515774465 /nfs/dbraw/zinc/77/44/65/515774465.db2.gz DMWGTVHZTDEGFM-AWEZNQCLSA-N -1 3 364.243 3.513 20 0 FHADHM CCc1[n-][nH]c(=NC(=O)[C@H]2CCO[C@H](CC)C2)c1-c1ccc2c(c1)OCO2 ZINC000506758244 515974488 /nfs/dbraw/zinc/97/44/88/515974488.db2.gz GZXATBIUNQMOBB-UONOGXRCSA-N -1 3 371.437 3.512 20 0 FHADHM C[C@@H]1[C@@H](NC(=O)N=c2[n-]nc(-c3cc4ccccc4o3)s2)CCCN1C ZINC000470508078 516274025 /nfs/dbraw/zinc/27/40/25/516274025.db2.gz AGKVTZFIHBGVOG-YPMHNXCESA-N -1 3 371.466 3.556 20 0 FHADHM CC[C@@H](c1n[n-]c(=NC(=O)NCCN(C)C(C)C)s1)c1ccccc1 ZINC000524702369 516794397 /nfs/dbraw/zinc/79/43/97/516794397.db2.gz DZSBYDMSOARYGH-OAHLLOKOSA-N -1 3 361.515 3.542 20 0 FHADHM O=C(N=c1cc(-c2ccccc2)[n-][nH]1)C1(C(=O)Nc2ccc(F)cc2)CC1 ZINC000532942943 517213984 /nfs/dbraw/zinc/21/39/84/517213984.db2.gz BJZUPUWFTAGEOH-UHFFFAOYSA-N -1 3 364.380 3.573 20 0 FHADHM CCN=c1[n-]c(C(=O)N2CCC[C@H](OCc3ccccc3F)C2)cs1 ZINC000525966648 517260639 /nfs/dbraw/zinc/26/06/39/517260639.db2.gz NKFNKHSSZVTBFG-AWEZNQCLSA-N -1 3 363.458 3.535 20 0 FHADHM Cc1cc(C)c(-c2cc(=NC(=O)[C@H](C)OC[C@H]3CCCO3)[nH][n-]2)cc1C ZINC000520607451 517453871 /nfs/dbraw/zinc/45/38/71/517453871.db2.gz LOHQXJBWCVTNBO-JKSUJKDBSA-N -1 3 357.454 3.525 20 0 FHADHM O=C(N=c1cc(-c2ccccc2)[n-][nH]1)[C@H]1CCCN(C(=O)c2ccccc2)C1 ZINC000520911785 517550101 /nfs/dbraw/zinc/55/01/01/517550101.db2.gz ITRRVTBFWQTAAW-SFHVURJKSA-N -1 3 374.444 3.568 20 0 FHADHM Cc1ccccc1-c1cc(=NC(=O)c2ccccc2OCCN(C)C)[nH][n-]1 ZINC000539320082 517992866 /nfs/dbraw/zinc/99/28/66/517992866.db2.gz GWENFHDMKABXCF-UHFFFAOYSA-N -1 3 364.449 3.578 20 0 FHADHM Cc1cc(C)c(-c2cc(=NC(=O)CCOC[C@H]3CCCO3)[nH][n-]2)cc1C ZINC000617357564 520454510 /nfs/dbraw/zinc/45/45/10/520454510.db2.gz ZXZBVCDQYGJUSU-MRXNPFEDSA-N -1 3 357.454 3.526 20 0 FHADHM O=C(N=c1cc([C@@H]2CCCO2)[n-][nH]1)c1cccc(F)c1OC(F)(F)F ZINC000628032309 523283390 /nfs/dbraw/zinc/28/33/90/523283390.db2.gz VGXPRPFJEHFOTL-NSHDSACASA-N -1 3 359.279 3.551 20 0 FHADHM O=C(N=c1cc(-c2cccc(Cl)c2)[n-][nH]1)c1cn(-c2ccccc2)nn1 ZINC000622892568 523534185 /nfs/dbraw/zinc/53/41/85/523534185.db2.gz XLLLTFOVFVCCQZ-UHFFFAOYSA-N -1 3 364.796 3.563 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)NC2(c3ccc(Cl)cc3)CCC2)c1 ZINC000051418882 567848556 /nfs/dbraw/zinc/84/85/56/567848556.db2.gz QWOVHJKNNSOGJO-UHFFFAOYSA-N -1 3 358.825 3.813 20 0 FHADHM C[C@@H]1CCN(C(=O)c2ccc3c(c2)NC(=O)[C@@H](C)S3)c2c([O-])cccc21 ZINC000186311694 567904359 /nfs/dbraw/zinc/90/43/59/567904359.db2.gz LOJSGOCJCFKIDX-VXGBXAGGSA-N -1 3 368.458 3.979 20 0 FHADHM C[C@@H]1CCN(C(=O)c2ccc3c(c2)NC(=O)[C@H](C)S3)c2c([O-])cccc21 ZINC000186311657 567904420 /nfs/dbraw/zinc/90/44/20/567904420.db2.gz LOJSGOCJCFKIDX-NEPJUHHUSA-N -1 3 368.458 3.979 20 0 FHADHM COc1ccc([O-])c(C(=O)N[C@H](C)Cc2cccc(Br)c2)c1 ZINC000521414434 567951508 /nfs/dbraw/zinc/95/15/08/567951508.db2.gz LYJIRELOXCRANO-LLVKDONJSA-N -1 3 364.239 3.524 20 0 FHADHM O=S(=O)([N-]c1cccc(F)c1F)c1ccc(F)c(C(F)(F)F)c1 ZINC000521414525 567951846 /nfs/dbraw/zinc/95/18/46/567951846.db2.gz RFABPAFQSGSIKA-UHFFFAOYSA-N -1 3 355.259 3.924 20 0 FHADHM CCOC(=O)c1c([N-]C(=O)c2conc2CC)sc2c1CCSC2 ZINC000602231624 567957939 /nfs/dbraw/zinc/95/79/39/567957939.db2.gz PLWXOEBSZRQIGN-UHFFFAOYSA-N -1 3 366.464 3.517 20 0 FHADHM COc1cc(C(=O)N2CCCCC[C@@H]2c2ccncc2)cc(OC)c1[O-] ZINC000161694702 567960410 /nfs/dbraw/zinc/96/04/10/567960410.db2.gz CODCHXHPWULCQT-MRXNPFEDSA-N -1 3 356.422 3.562 20 0 FHADHM Cc1cccc([O-])c1C(=O)N1C[C@@H](O)C[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000626251248 567975884 /nfs/dbraw/zinc/97/58/84/567975884.db2.gz VXGHIYFJRSFHPZ-LSDHHAIUSA-N -1 3 365.351 3.668 20 0 FHADHM Cc1cc(C(=O)[N-]c2ccc(F)c(C(=O)OC(C)(C)C)c2Cl)no1 ZINC000602406547 567976530 /nfs/dbraw/zinc/97/65/30/567976530.db2.gz SINSWJKOOBQITO-UHFFFAOYSA-N -1 3 354.765 3.983 20 0 FHADHM Cc1oc(-c2ccccc2)c(C(=O)NCc2ccc(-c3nnn[n-]3)cc2)c1C ZINC000186753522 567979758 /nfs/dbraw/zinc/97/97/58/567979758.db2.gz XHHJQQOSGSTBRZ-UHFFFAOYSA-N -1 3 373.416 3.674 20 0 FHADHM Cc1oc(-c2ccccc2)c(C(=O)NCc2ccc(-c3nn[n-]n3)cc2)c1C ZINC000186753522 567979759 /nfs/dbraw/zinc/97/97/59/567979759.db2.gz XHHJQQOSGSTBRZ-UHFFFAOYSA-N -1 3 373.416 3.674 20 0 FHADHM Cc1cccc(F)c1[N-]S(=O)(=O)CCc1ccccc1Br ZINC000461107857 568002170 /nfs/dbraw/zinc/00/21/70/568002170.db2.gz DHRXRPJJBMVXHR-UHFFFAOYSA-N -1 3 372.259 3.881 20 0 FHADHM CCCN(CC(C)C)C(=O)c1cc(=O)c2cc(Br)ccc2[n-]1 ZINC000602745504 568021829 /nfs/dbraw/zinc/02/18/29/568021829.db2.gz GGJFZDPIGPLQEP-UHFFFAOYSA-N -1 3 365.271 3.799 20 0 FHADHM O=c1[n-]nc(SCc2ccc(Cl)s2)n1CCc1ccccc1 ZINC000068897705 568089925 /nfs/dbraw/zinc/08/99/25/568089925.db2.gz QNOQFTRLHCIEBH-UHFFFAOYSA-N -1 3 351.884 3.821 20 0 FHADHM O=S(=O)([N-]C[C@H]1OCCc2ccccc21)c1ccc(Cl)c(Cl)c1 ZINC000603506889 568109855 /nfs/dbraw/zinc/10/98/55/568109855.db2.gz XKDQVDRWCZEJJA-MRXNPFEDSA-N -1 3 372.273 3.586 20 0 FHADHM Cc1noc(C)c1[C@@H](C)NC(=O)Nc1ccc(-c2cc(=O)[n-]c(C)n2)cc1 ZINC000603724282 568142554 /nfs/dbraw/zinc/14/25/54/568142554.db2.gz JHNLVIBJVIALSQ-SNVBAGLBSA-N -1 3 367.409 3.645 20 0 FHADHM Cc1csc([C@@H]([N-]S(=O)(=O)c2ccc(Cl)c(C)c2)C2CC2)n1 ZINC000655525236 568148185 /nfs/dbraw/zinc/14/81/85/568148185.db2.gz IMKHQWAZARGIQN-AWEZNQCLSA-N -1 3 356.900 3.843 20 0 FHADHM Cc1oc(C(=O)[N-]c2sccc2C(=O)C(C)(C)C)cc1S(C)(=O)=O ZINC000636870738 568163133 /nfs/dbraw/zinc/16/31/33/568163133.db2.gz CEKCMSMQZQTAFO-UHFFFAOYSA-N -1 3 369.464 3.534 20 0 FHADHM CCCS(=O)(=O)[N-]c1ccc(C(=O)N2CCCc3c(C)cccc32)cc1 ZINC000603925438 568182296 /nfs/dbraw/zinc/18/22/96/568182296.db2.gz KELLCVKZTALLBX-UHFFFAOYSA-N -1 3 372.490 3.740 20 0 FHADHM Cc1ccc(Cl)c(S(=O)(=O)[N-]Cc2cc(C(C)C)no2)c1Cl ZINC000603947529 568186543 /nfs/dbraw/zinc/18/65/43/568186543.db2.gz MLINYHLHYUSBKA-UHFFFAOYSA-N -1 3 363.266 3.892 20 0 FHADHM COC(=O)c1ccc(S(=O)(=O)[N-][C@H](c2ccccc2)C(C)(C)C)s1 ZINC000604030042 568198277 /nfs/dbraw/zinc/19/82/77/568198277.db2.gz FTJRYFUELNFERD-OAHLLOKOSA-N -1 3 367.492 3.600 20 0 FHADHM CCOC(=O)c1ncc(NC(=O)[C@@H]2C[C@@H]2c2cc(Cl)cc(Cl)c2)[n-]1 ZINC000617877708 568208518 /nfs/dbraw/zinc/20/85/18/568208518.db2.gz VZTSQZCGXCBTQK-VXGBXAGGSA-N -1 3 368.220 3.635 20 0 FHADHM CCOC(=O)c1nc(NC(=O)[C@@H]2C[C@@H]2c2cc(Cl)cc(Cl)c2)c[n-]1 ZINC000617877708 568208519 /nfs/dbraw/zinc/20/85/19/568208519.db2.gz VZTSQZCGXCBTQK-VXGBXAGGSA-N -1 3 368.220 3.635 20 0 FHADHM C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCN2C(=O)c2cc([O-])ccc2C(F)(F)F)C1 ZINC000408262297 568225062 /nfs/dbraw/zinc/22/50/62/568225062.db2.gz WJNBBELLXJVFJH-OFIKQIQMSA-N -1 3 371.399 3.813 20 0 FHADHM CCc1cccc(C(=O)N2C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)c1[O-] ZINC000674604955 568225334 /nfs/dbraw/zinc/22/53/34/568225334.db2.gz HFWIWMPVKJPEKM-QWRGUYRKSA-N -1 3 355.278 3.767 20 0 FHADHM O=S(=O)([N-]CC1(c2ccc(Cl)cc2)CC1)c1cc(F)cc(F)c1 ZINC000303214914 568258391 /nfs/dbraw/zinc/25/83/91/568258391.db2.gz SPEAZADXRIPQLF-UHFFFAOYSA-N -1 3 357.809 3.628 20 0 FHADHM CCOCCCC[N-]S(=O)(=O)c1c(C)c(Cl)cc(C)c1Cl ZINC000055264379 568332152 /nfs/dbraw/zinc/33/21/52/568332152.db2.gz IPUKXHLUFDMVJX-UHFFFAOYSA-N -1 3 354.299 3.705 20 0 FHADHM O=S(=O)([N-][C@H]1C[C@H]1c1c(F)cccc1F)c1ccc(Cl)cc1F ZINC000604771905 568363339 /nfs/dbraw/zinc/36/33/39/568363339.db2.gz KLEBUVUWYDVQND-RNCFNFMXSA-N -1 3 361.772 3.592 20 0 FHADHM CCn1c(=O)[n-]nc1SCC/C=C/c1ccc(Br)cc1 ZINC000604930898 568398457 /nfs/dbraw/zinc/39/84/57/568398457.db2.gz SBWMOLLOBRJNFT-HWKANZROSA-N -1 3 354.273 3.962 20 0 FHADHM COc1ccc(Br)cc1CN(C)C(=O)c1cccc(C)c1[O-] ZINC000006993533 568413798 /nfs/dbraw/zinc/41/37/98/568413798.db2.gz HNIGLVXYATZLJO-UHFFFAOYSA-N -1 3 364.239 3.744 20 0 FHADHM O=C([N-]c1csc(-c2ccccc2)n1)c1cc(CN2CCCC2)on1 ZINC000643271146 568452770 /nfs/dbraw/zinc/45/27/70/568452770.db2.gz BOQQXYMOBYWADZ-UHFFFAOYSA-N -1 3 354.435 3.646 20 0 FHADHM Cn1ncc2c1nc(CN1CCCCC[C@H]1c1ccc(Cl)cc1)[n-]c2=O ZINC000605000290 568513830 /nfs/dbraw/zinc/51/38/30/568513830.db2.gz DXELRTWMFGFLEK-INIZCTEOSA-N -1 3 371.872 3.840 20 0 FHADHM CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1OCC(=O)[N-]c1nncn1Cc1ccccc1 ZINC000605117168 568573055 /nfs/dbraw/zinc/57/30/55/568573055.db2.gz NNUCWEZTDBUYQT-NEWSRXKRSA-N -1 3 370.497 3.742 20 0 FHADHM Cc1cccc(C(=O)N2CCC(c3nc4c(cccc4F)[nH]3)CC2)c1[O-] ZINC000365399938 568619203 /nfs/dbraw/zinc/61/92/03/568619203.db2.gz WFOLEEWDVSBEFG-UHFFFAOYSA-N -1 3 353.397 3.736 20 0 FHADHM Cc1c(-c2ccncc2)[n-][nH]c1=NC(=O)c1cc(F)ccc1-c1ccoc1 ZINC000365405429 568624514 /nfs/dbraw/zinc/62/45/14/568624514.db2.gz WBZXWVSSDOCIRP-UHFFFAOYSA-N -1 3 362.364 3.853 20 0 FHADHM CC(C)c1cnc(SCCOc2cccc(-c3nnn[n-]3)c2)n1C(C)C ZINC000735932505 598824505 /nfs/dbraw/zinc/82/45/05/598824505.db2.gz NGPQYKHOAOWVND-UHFFFAOYSA-N -1 3 372.498 3.939 20 0 FHADHM CC(C)c1cnc(SCCOc2cccc(-c3nn[n-]n3)c2)n1C(C)C ZINC000735932505 598824508 /nfs/dbraw/zinc/82/45/08/598824508.db2.gz NGPQYKHOAOWVND-UHFFFAOYSA-N -1 3 372.498 3.939 20 0 FHADHM CC(C)c1cnc(SCCOc2ccc(-c3nn[n-]n3)cc2)n1C(C)C ZINC000735933090 598824641 /nfs/dbraw/zinc/82/46/41/598824641.db2.gz UIDUJFHLKHGBEA-UHFFFAOYSA-N -1 3 372.498 3.939 20 0 FHADHM CCN(C(=O)[C@@H](C)c1cccc(C)c1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736502448 598830288 /nfs/dbraw/zinc/83/02/88/598830288.db2.gz MWRNASORVJTDMQ-JKSUJKDBSA-N -1 3 363.465 3.888 20 0 FHADHM CCN(C(=O)[C@@H](C)c1cccc(C)c1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736502448 598830290 /nfs/dbraw/zinc/83/02/90/598830290.db2.gz MWRNASORVJTDMQ-JKSUJKDBSA-N -1 3 363.465 3.888 20 0 FHADHM Cc1cccc([C@@H](C)C(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(C)C)c1 ZINC000737384961 598831792 /nfs/dbraw/zinc/83/17/92/598831792.db2.gz OHEYUIUFXSEASC-CQSZACIVSA-N -1 3 365.437 3.705 20 0 FHADHM Cc1cccc([C@@H](C)C(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(C)C)c1 ZINC000737384961 598831793 /nfs/dbraw/zinc/83/17/93/598831793.db2.gz OHEYUIUFXSEASC-CQSZACIVSA-N -1 3 365.437 3.705 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(NCCc2cc3ccccc3o2)n1 ZINC000737635669 598854447 /nfs/dbraw/zinc/85/44/47/598854447.db2.gz LZQYWZOMSBDWFZ-UHFFFAOYSA-N -1 3 374.326 3.681 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(NCCc2cc3ccccc3o2)n1 ZINC000737635669 598854449 /nfs/dbraw/zinc/85/44/49/598854449.db2.gz LZQYWZOMSBDWFZ-UHFFFAOYSA-N -1 3 374.326 3.681 20 0 FHADHM C[C@H](Nc1ncc(-c2nnn[n-]2)cc1Cl)c1ncc(-c2ccccc2)o1 ZINC000736136066 598855479 /nfs/dbraw/zinc/85/54/79/598855479.db2.gz DPPUERKBWQVIDV-JTQLQIEISA-N -1 3 367.800 3.743 20 0 FHADHM C[C@H](Nc1ncc(-c2nn[n-]n2)cc1Cl)c1ncc(-c2ccccc2)o1 ZINC000736136066 598855480 /nfs/dbraw/zinc/85/54/80/598855480.db2.gz DPPUERKBWQVIDV-JTQLQIEISA-N -1 3 367.800 3.743 20 0 FHADHM C(=Cc1ccccc1-c1nnn[n-]1)c1nc(-c2nccc3ccccc32)no1 ZINC000735399234 598890510 /nfs/dbraw/zinc/89/05/10/598890510.db2.gz JNUBAQLUDWMTEC-MDZDMXLPSA-N -1 3 367.372 3.635 20 0 FHADHM C(=Cc1ccccc1-c1nn[n-]n1)c1nc(-c2nccc3ccccc32)no1 ZINC000735399234 598890512 /nfs/dbraw/zinc/89/05/12/598890512.db2.gz JNUBAQLUDWMTEC-MDZDMXLPSA-N -1 3 367.372 3.635 20 0 FHADHM C[C@H](Oc1ccc(-c2nn[n-]n2)cc1)C(=O)OCc1ccc2ccccc2c1 ZINC000736170566 598894266 /nfs/dbraw/zinc/89/42/66/598894266.db2.gz VJDPOZGVCAHQCP-AWEZNQCLSA-N -1 3 374.400 3.531 20 0 FHADHM Cc1noc(C)c1CSc1nc(-c2ccccc2)ccc1-c1nnn[n-]1 ZINC000737535794 598902416 /nfs/dbraw/zinc/90/24/16/598902416.db2.gz BUDKAVCFCKTPSL-UHFFFAOYSA-N -1 3 364.434 3.826 20 0 FHADHM Cc1noc(C)c1CSc1nc(-c2ccccc2)ccc1-c1nn[n-]n1 ZINC000737535794 598902417 /nfs/dbraw/zinc/90/24/17/598902417.db2.gz BUDKAVCFCKTPSL-UHFFFAOYSA-N -1 3 364.434 3.826 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@H](C)CC1CCCC1 ZINC000735986024 598902812 /nfs/dbraw/zinc/90/28/12/598902812.db2.gz PJXKJTHHBFIKJU-OAHLLOKOSA-N -1 3 355.486 3.820 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@H](C)CC1CCCC1 ZINC000735986024 598902815 /nfs/dbraw/zinc/90/28/15/598902815.db2.gz PJXKJTHHBFIKJU-OAHLLOKOSA-N -1 3 355.486 3.820 20 0 FHADHM CCc1ccccc1CNC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736695578 598911324 /nfs/dbraw/zinc/91/13/24/598911324.db2.gz NUTMVQWVKKJQPA-UHFFFAOYSA-N -1 3 372.885 3.569 20 0 FHADHM CCc1ccccc1CNC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736695578 598911326 /nfs/dbraw/zinc/91/13/26/598911326.db2.gz NUTMVQWVKKJQPA-UHFFFAOYSA-N -1 3 372.885 3.569 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)N1CCC[C@]2(CC=CCC2)C1 ZINC000738150750 598924260 /nfs/dbraw/zinc/92/42/60/598924260.db2.gz COLLUCFJWGQECM-GOSISDBHSA-N -1 3 372.860 3.874 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)N1CCC[C@]2(CC=CCC2)C1 ZINC000738150750 598924262 /nfs/dbraw/zinc/92/42/62/598924262.db2.gz COLLUCFJWGQECM-GOSISDBHSA-N -1 3 372.860 3.874 20 0 FHADHM CCOc1ccc([C@H]2CCCN2c2ncc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000736635468 598935488 /nfs/dbraw/zinc/93/54/88/598935488.db2.gz CKQQJHMURQXFEC-MRXNPFEDSA-N -1 3 370.844 3.655 20 0 FHADHM CCOc1ccc([C@H]2CCCN2c2ncc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000736635468 598935490 /nfs/dbraw/zinc/93/54/90/598935490.db2.gz CKQQJHMURQXFEC-MRXNPFEDSA-N -1 3 370.844 3.655 20 0 FHADHM CC(C)C[C@@H](C(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000735757068 598939135 /nfs/dbraw/zinc/93/91/35/598939135.db2.gz SIVZEBWYONTFCY-LJQANCHMSA-N -1 3 363.465 3.655 20 0 FHADHM CC(C)C[C@@H](C(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000735757068 598939137 /nfs/dbraw/zinc/93/91/37/598939137.db2.gz SIVZEBWYONTFCY-LJQANCHMSA-N -1 3 363.465 3.655 20 0 FHADHM Clc1ccccc1[C@@H]1CCCN1c1ncc(-c2nnn[n-]2)cc1Cl ZINC000737584581 598939467 /nfs/dbraw/zinc/93/94/67/598939467.db2.gz TWKPUSVBYJWNFN-AWEZNQCLSA-N -1 3 361.236 3.910 20 0 FHADHM Clc1ccccc1[C@@H]1CCCN1c1ncc(-c2nn[n-]n2)cc1Cl ZINC000737584581 598939468 /nfs/dbraw/zinc/93/94/68/598939468.db2.gz TWKPUSVBYJWNFN-AWEZNQCLSA-N -1 3 361.236 3.910 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1OCCS[C@H](C)c1ccc(F)cc1 ZINC000737033614 598940135 /nfs/dbraw/zinc/94/01/35/598940135.db2.gz ZIHQWWZLDBEOQH-GFCCVEGCSA-N -1 3 374.441 3.888 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1OCCS[C@H](C)c1ccc(F)cc1 ZINC000737033614 598940137 /nfs/dbraw/zinc/94/01/37/598940137.db2.gz ZIHQWWZLDBEOQH-GFCCVEGCSA-N -1 3 374.441 3.888 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1Sc1cccc(Br)c1 ZINC000737558882 598941658 /nfs/dbraw/zinc/94/16/58/598941658.db2.gz QJRXBOGVTZSTAO-UHFFFAOYSA-N -1 3 368.647 3.829 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1Sc1cccc(Br)c1 ZINC000737558882 598941660 /nfs/dbraw/zinc/94/16/60/598941660.db2.gz QJRXBOGVTZSTAO-UHFFFAOYSA-N -1 3 368.647 3.829 20 0 FHADHM C[C@@H](c1ccccc1)N(CC1CCC1)C(=O)c1sccc1-c1nnn[n-]1 ZINC000736205920 598944771 /nfs/dbraw/zinc/94/47/71/598944771.db2.gz ZRUGCYXOBZPSKK-ZDUSSCGKSA-N -1 3 367.478 3.932 20 0 FHADHM C[C@@H](c1ccccc1)N(CC1CCC1)C(=O)c1sccc1-c1nn[n-]n1 ZINC000736205920 598944774 /nfs/dbraw/zinc/94/47/74/598944774.db2.gz ZRUGCYXOBZPSKK-ZDUSSCGKSA-N -1 3 367.478 3.932 20 0 FHADHM O=C(Nc1nc2ccccc2n1C1CCCC1)c1cccc(-c2nnn[n-]2)c1 ZINC000738210137 598946514 /nfs/dbraw/zinc/94/65/14/598946514.db2.gz LEVXYIHUUUCBPA-UHFFFAOYSA-N -1 3 373.420 3.584 20 0 FHADHM O=C(Nc1nc2ccccc2n1C1CCCC1)c1cccc(-c2nn[n-]n2)c1 ZINC000738210137 598946518 /nfs/dbraw/zinc/94/65/18/598946518.db2.gz LEVXYIHUUUCBPA-UHFFFAOYSA-N -1 3 373.420 3.584 20 0 FHADHM Fc1ccccc1[C@H](Cc1ccccc1)Nc1ncccc1-c1nnn[n-]1 ZINC000737665606 598975863 /nfs/dbraw/zinc/97/58/63/598975863.db2.gz SOJVPWPFCOHTOO-SFHVURJKSA-N -1 3 360.396 3.797 20 0 FHADHM Fc1ccccc1[C@H](Cc1ccccc1)Nc1ncccc1-c1nn[n-]n1 ZINC000737665606 598975865 /nfs/dbraw/zinc/97/58/65/598975865.db2.gz SOJVPWPFCOHTOO-SFHVURJKSA-N -1 3 360.396 3.797 20 0 FHADHM Cc1cccc(NC2CCN(c3ccc(-c4nnn[n-]4)c(Cl)c3)CC2)c1 ZINC000737398487 598975895 /nfs/dbraw/zinc/97/58/95/598975895.db2.gz AHDXWSQABQCODZ-UHFFFAOYSA-N -1 3 368.872 3.909 20 0 FHADHM Cc1cccc(NC2CCN(c3ccc(-c4nn[n-]n4)c(Cl)c3)CC2)c1 ZINC000737398487 598975897 /nfs/dbraw/zinc/97/58/97/598975897.db2.gz AHDXWSQABQCODZ-UHFFFAOYSA-N -1 3 368.872 3.909 20 0 FHADHM Cc1cc(C)c(-c2nnn[n-]2)c(N[C@@H]2C[C@@H]2c2c(F)cccc2Cl)n1 ZINC000737243784 598972288 /nfs/dbraw/zinc/97/22/88/598972288.db2.gz BGZQNZVIVGKUGH-GXFFZTMASA-N -1 3 358.808 3.639 20 0 FHADHM Cc1cc(C)c(-c2nn[n-]n2)c(N[C@@H]2C[C@@H]2c2c(F)cccc2Cl)n1 ZINC000737243784 598972289 /nfs/dbraw/zinc/97/22/89/598972289.db2.gz BGZQNZVIVGKUGH-GXFFZTMASA-N -1 3 358.808 3.639 20 0 FHADHM Cc1c(NCc2ncc(-c3ccc(F)cc3)o2)cccc1-c1nnn[n-]1 ZINC000822122554 607256720 /nfs/dbraw/zinc/25/67/20/607256720.db2.gz NTWYXZGLDIDKFH-UHFFFAOYSA-N -1 3 350.357 3.581 20 0 FHADHM Cc1c(NCc2ncc(-c3ccc(F)cc3)o2)cccc1-c1nn[n-]n1 ZINC000822122554 607256721 /nfs/dbraw/zinc/25/67/21/607256721.db2.gz NTWYXZGLDIDKFH-UHFFFAOYSA-N -1 3 350.357 3.581 20 0 FHADHM C[C@@H](Nc1ccc(F)cc1OCC1CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736139747 599009227 /nfs/dbraw/zinc/00/92/27/599009227.db2.gz QVLKJYPBVIPEFT-GFCCVEGCSA-N -1 3 353.401 3.968 20 0 FHADHM C[C@@H](Nc1ccc(F)cc1OCC1CC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736139747 599009229 /nfs/dbraw/zinc/00/92/29/599009229.db2.gz QVLKJYPBVIPEFT-GFCCVEGCSA-N -1 3 353.401 3.968 20 0 FHADHM C[C@H](S[C@H](C(N)=O)c1ccc(-c2nnn[n-]2)cc1)c1ccc(Cl)cc1 ZINC000736192492 599012474 /nfs/dbraw/zinc/01/24/74/599012474.db2.gz ZOUUQLNKKBWJRZ-BONVTDFDSA-N -1 3 373.869 3.541 20 0 FHADHM C[C@H](S[C@H](C(N)=O)c1ccc(-c2nn[n-]n2)cc1)c1ccc(Cl)cc1 ZINC000736192492 599012476 /nfs/dbraw/zinc/01/24/76/599012476.db2.gz ZOUUQLNKKBWJRZ-BONVTDFDSA-N -1 3 373.869 3.541 20 0 FHADHM CC(C)CC[C@H](NC(=O)CCc1ccc(-c2nnn[n-]2)cc1)C(C)(C)C ZINC000735796852 599016559 /nfs/dbraw/zinc/01/65/59/599016559.db2.gz IVLSAQVLPMGWHT-KRWDZBQOSA-N -1 3 357.502 3.766 20 0 FHADHM CC(C)CC[C@H](NC(=O)CCc1ccc(-c2nn[n-]n2)cc1)C(C)(C)C ZINC000735796852 599016561 /nfs/dbraw/zinc/01/65/61/599016561.db2.gz IVLSAQVLPMGWHT-KRWDZBQOSA-N -1 3 357.502 3.766 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N[C@H]2CCCc3ccccc32)n1 ZINC000737633395 599037774 /nfs/dbraw/zinc/03/77/74/599037774.db2.gz QVAPJJFWEOBYAW-ZDUSSCGKSA-N -1 3 360.343 3.770 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N[C@H]2CCCc3ccccc32)n1 ZINC000737633395 599037777 /nfs/dbraw/zinc/03/77/77/599037777.db2.gz QVAPJJFWEOBYAW-ZDUSSCGKSA-N -1 3 360.343 3.770 20 0 FHADHM CC(C)c1csc([C@@H]2CCCN(c3ccc(-c4nn[n-]n4)cc3F)C2)n1 ZINC000820197448 599042909 /nfs/dbraw/zinc/04/29/09/599042909.db2.gz IZMMPVVKILYPEN-CYBMUJFWSA-N -1 3 372.473 3.970 20 0 FHADHM CC(C)c1csc([C@H]2CCCN(c3cccc(F)c3-c3nnn[n-]3)C2)n1 ZINC000820197597 599043340 /nfs/dbraw/zinc/04/33/40/599043340.db2.gz MLNBDDRICRFBLQ-LBPRGKRZSA-N -1 3 372.473 3.970 20 0 FHADHM CC(C)c1csc([C@H]2CCCN(c3cccc(F)c3-c3nn[n-]n3)C2)n1 ZINC000820197597 599043343 /nfs/dbraw/zinc/04/33/43/599043343.db2.gz MLNBDDRICRFBLQ-LBPRGKRZSA-N -1 3 372.473 3.970 20 0 FHADHM CO[C@@H](CNc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccc(Cl)cc1 ZINC000821676799 599045879 /nfs/dbraw/zinc/04/58/79/599045879.db2.gz HIVAVMHMGXCMJQ-HNNXBMFYSA-N -1 3 364.236 3.973 20 0 FHADHM CO[C@@H](CNc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccc(Cl)cc1 ZINC000821676799 599045881 /nfs/dbraw/zinc/04/58/81/599045881.db2.gz HIVAVMHMGXCMJQ-HNNXBMFYSA-N -1 3 364.236 3.973 20 0 FHADHM FC(F)(F)c1cccc(C2(CNc3ccc(-c4nnn[n-]4)cn3)CCC2)c1 ZINC000822727947 599051634 /nfs/dbraw/zinc/05/16/34/599051634.db2.gz CSTPZIVTDYJDQV-UHFFFAOYSA-N -1 3 374.370 3.814 20 0 FHADHM FC(F)(F)c1cccc(C2(CNc3ccc(-c4nn[n-]n4)cn3)CCC2)c1 ZINC000822727947 599051637 /nfs/dbraw/zinc/05/16/37/599051637.db2.gz CSTPZIVTDYJDQV-UHFFFAOYSA-N -1 3 374.370 3.814 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1Sc1ccnc(-c2ccccc2)n1 ZINC000822748176 599058476 /nfs/dbraw/zinc/05/84/76/599058476.db2.gz LMMDRESBTNRXFJ-UHFFFAOYSA-N -1 3 350.382 3.614 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1Sc1ccnc(-c2ccccc2)n1 ZINC000822748176 599058479 /nfs/dbraw/zinc/05/84/79/599058479.db2.gz LMMDRESBTNRXFJ-UHFFFAOYSA-N -1 3 350.382 3.614 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1Sc1ncnc2c3ccccc3oc21 ZINC000822747966 599058559 /nfs/dbraw/zinc/05/85/59/599058559.db2.gz AKARMXJWLCTDFO-UHFFFAOYSA-N -1 3 364.365 3.846 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1Sc1ncnc2c3ccccc3oc21 ZINC000822747966 599058562 /nfs/dbraw/zinc/05/85/62/599058562.db2.gz AKARMXJWLCTDFO-UHFFFAOYSA-N -1 3 364.365 3.846 20 0 FHADHM Clc1cc(N2CC[C@H](COCc3ccccc3)C2)ccc1-c1nnn[n-]1 ZINC000822567699 599063393 /nfs/dbraw/zinc/06/33/93/599063393.db2.gz FOAMHIQHDXOBRH-HNNXBMFYSA-N -1 3 369.856 3.563 20 0 FHADHM Clc1cc(N2CC[C@H](COCc3ccccc3)C2)ccc1-c1nn[n-]n1 ZINC000822567699 599063397 /nfs/dbraw/zinc/06/33/97/599063397.db2.gz FOAMHIQHDXOBRH-HNNXBMFYSA-N -1 3 369.856 3.563 20 0 FHADHM O=C([C@@H]1C[C@@H]1C1CCCCC1)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000737781427 599068886 /nfs/dbraw/zinc/06/88/86/599068886.db2.gz APEFNLJRHJDYCV-RTBURBONSA-N -1 3 365.481 3.574 20 0 FHADHM O=C([C@@H]1C[C@@H]1C1CCCCC1)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000737781427 599068890 /nfs/dbraw/zinc/06/88/90/599068890.db2.gz APEFNLJRHJDYCV-RTBURBONSA-N -1 3 365.481 3.574 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H]2C[C@H]2C2CCCCC2)c1-c1nnn[n-]1 ZINC000736672071 599072425 /nfs/dbraw/zinc/07/24/25/599072425.db2.gz XOWXQOSOBWJQOC-KBPBESRZSA-N -1 3 359.499 3.954 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H]2C[C@H]2C2CCCCC2)c1-c1nn[n-]n1 ZINC000736672071 599072429 /nfs/dbraw/zinc/07/24/29/599072429.db2.gz XOWXQOSOBWJQOC-KBPBESRZSA-N -1 3 359.499 3.954 20 0 FHADHM Cc1ccc([C@H]2CCCCN2C(=O)C=Cc2ccccc2-c2nnn[n-]2)o1 ZINC000737330400 599083235 /nfs/dbraw/zinc/08/32/35/599083235.db2.gz NLGODTAVNZTGIA-XSLBHYSZSA-N -1 3 363.421 3.535 20 0 FHADHM Cc1ccc([C@H]2CCCCN2C(=O)C=Cc2ccccc2-c2nn[n-]n2)o1 ZINC000737330400 599083238 /nfs/dbraw/zinc/08/32/38/599083238.db2.gz NLGODTAVNZTGIA-XSLBHYSZSA-N -1 3 363.421 3.535 20 0 FHADHM C[C@H](Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1cccc(-n2ccnc2)c1 ZINC000820457327 599094864 /nfs/dbraw/zinc/09/48/64/599094864.db2.gz ZQFBDDAVIGWNAO-LBPRGKRZSA-N -1 3 365.828 3.879 20 0 FHADHM C[C@H](Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1cccc(-n2ccnc2)c1 ZINC000820457327 599094868 /nfs/dbraw/zinc/09/48/68/599094868.db2.gz ZQFBDDAVIGWNAO-LBPRGKRZSA-N -1 3 365.828 3.879 20 0 FHADHM Cc1cc(C)c2ncc(-c3nnn[n-]3)c(N3CCS[C@H](C(C)C)C3)c2c1 ZINC000822195612 599099118 /nfs/dbraw/zinc/09/91/18/599099118.db2.gz YJIZRUNBEXQIFI-INIZCTEOSA-N -1 3 368.510 3.610 20 0 FHADHM Cc1cc(C)c2ncc(-c3nn[n-]n3)c(N3CCS[C@H](C(C)C)C3)c2c1 ZINC000822195612 599099121 /nfs/dbraw/zinc/09/91/21/599099121.db2.gz YJIZRUNBEXQIFI-INIZCTEOSA-N -1 3 368.510 3.610 20 0 FHADHM Cc1ccc([C@H]2OCCC[C@H]2CNc2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000822233378 599108420 /nfs/dbraw/zinc/10/84/20/599108420.db2.gz NRKUJBKVUCUQSX-QFBILLFUSA-N -1 3 367.428 3.894 20 0 FHADHM Cc1ccc([C@@H]2OCCC[C@@H]2CNc2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000822233376 599108561 /nfs/dbraw/zinc/10/85/61/599108561.db2.gz NRKUJBKVUCUQSX-APWZRJJASA-N -1 3 367.428 3.894 20 0 FHADHM Cc1ccc([C@@H]2OCCC[C@H]2CNc2ccc(F)cc2-c2nnn[n-]2)cc1 ZINC000822233079 599108616 /nfs/dbraw/zinc/10/86/16/599108616.db2.gz HPRGOWCWSRLSKX-KXBFYZLASA-N -1 3 367.428 3.894 20 0 FHADHM Cc1ccc([C@@H]2OCCC[C@H]2CNc2ccc(F)cc2-c2nn[n-]n2)cc1 ZINC000822233079 599108618 /nfs/dbraw/zinc/10/86/18/599108618.db2.gz HPRGOWCWSRLSKX-KXBFYZLASA-N -1 3 367.428 3.894 20 0 FHADHM O[C@H](C[C@@H]1CCCN1c1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccccc1 ZINC000823675359 599109588 /nfs/dbraw/zinc/10/95/88/599109588.db2.gz WHALAMGNANYVHP-KBXCAEBGSA-N -1 3 369.856 3.613 20 0 FHADHM O[C@H](C[C@@H]1CCCN1c1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccccc1 ZINC000823675359 599109589 /nfs/dbraw/zinc/10/95/89/599109589.db2.gz WHALAMGNANYVHP-KBXCAEBGSA-N -1 3 369.856 3.613 20 0 FHADHM Clc1ccc(Br)c(C=Cc2ccc(-c3nnn[n-]3)cn2)c1 ZINC000822573543 599111293 /nfs/dbraw/zinc/11/12/93/599111293.db2.gz ABANNFYOIGSABB-RJRFIUFISA-N -1 3 362.618 3.848 20 0 FHADHM Clc1ccc(Br)c(C=Cc2ccc(-c3nn[n-]n3)cn2)c1 ZINC000822573543 599111295 /nfs/dbraw/zinc/11/12/95/599111295.db2.gz ABANNFYOIGSABB-RJRFIUFISA-N -1 3 362.618 3.848 20 0 FHADHM COC(=O)[C@@H](Sc1ccc(Cl)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736903312 599112080 /nfs/dbraw/zinc/11/20/80/599112080.db2.gz ZNONCWZSFZOGER-AWEZNQCLSA-N -1 3 360.826 3.527 20 0 FHADHM COC(=O)[C@@H](Sc1ccc(Cl)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736903312 599112081 /nfs/dbraw/zinc/11/20/81/599112081.db2.gz ZNONCWZSFZOGER-AWEZNQCLSA-N -1 3 360.826 3.527 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N[C@@H]2C[C@@H]2C2CCCCC2)n1 ZINC000737632564 599120970 /nfs/dbraw/zinc/12/09/70/599120970.db2.gz LHKDPTQCZFURID-VXGBXAGGSA-N -1 3 352.364 3.661 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N[C@@H]2C[C@@H]2C2CCCCC2)n1 ZINC000737632564 599120972 /nfs/dbraw/zinc/12/09/72/599120972.db2.gz LHKDPTQCZFURID-VXGBXAGGSA-N -1 3 352.364 3.661 20 0 FHADHM CC(=CC(=O)Nc1ccc(-c2nnn[n-]2)cc1)c1cccc(C(F)(F)F)c1 ZINC000742610740 599133528 /nfs/dbraw/zinc/13/35/28/599133528.db2.gz GQWYKAXINPJVOK-PKNBQFBNSA-N -1 3 373.338 3.928 20 0 FHADHM CC(=CC(=O)Nc1ccc(-c2nn[n-]n2)cc1)c1cccc(C(F)(F)F)c1 ZINC000742610740 599133530 /nfs/dbraw/zinc/13/35/30/599133530.db2.gz GQWYKAXINPJVOK-PKNBQFBNSA-N -1 3 373.338 3.928 20 0 FHADHM CCc1ccc(-c2ccc(C(=O)NCc3ccc(-c4nnn[n-]4)cc3)o2)cc1 ZINC000463782557 599139256 /nfs/dbraw/zinc/13/92/56/599139256.db2.gz MLIQVIHXKPTSLA-UHFFFAOYSA-N -1 3 373.416 3.619 20 0 FHADHM CCc1ccc(-c2ccc(C(=O)NCc3ccc(-c4nn[n-]n4)cc3)o2)cc1 ZINC000463782557 599139257 /nfs/dbraw/zinc/13/92/57/599139257.db2.gz MLIQVIHXKPTSLA-UHFFFAOYSA-N -1 3 373.416 3.619 20 0 FHADHM Cc1c(CNC(=O)Nc2cc(-c3nnn[n-]3)ccc2C)oc2ccccc12 ZINC000737293365 599146317 /nfs/dbraw/zinc/14/63/17/599146317.db2.gz CUCAGNBFQGQLCO-UHFFFAOYSA-N -1 3 362.393 3.551 20 0 FHADHM Cc1c(CNC(=O)Nc2cc(-c3nn[n-]n3)ccc2C)oc2ccccc12 ZINC000737293365 599146320 /nfs/dbraw/zinc/14/63/20/599146320.db2.gz CUCAGNBFQGQLCO-UHFFFAOYSA-N -1 3 362.393 3.551 20 0 FHADHM CC(C)CN(C(=O)c1cccc(F)c1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000820081706 599146442 /nfs/dbraw/zinc/14/64/42/599146442.db2.gz RSOLQJMTGDWWRZ-UHFFFAOYSA-N -1 3 373.819 3.962 20 0 FHADHM CC(C)CN(C(=O)c1cccc(F)c1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000820081706 599146445 /nfs/dbraw/zinc/14/64/45/599146445.db2.gz RSOLQJMTGDWWRZ-UHFFFAOYSA-N -1 3 373.819 3.962 20 0 FHADHM CCc1ccc(-c2ccc(C(=O)N(C)c3cccc(-c4nnn[n-]4)c3)o2)cc1 ZINC000821476335 599146865 /nfs/dbraw/zinc/14/68/65/599146865.db2.gz MMPIEAKPVMUJMN-UHFFFAOYSA-N -1 3 373.416 3.966 20 0 FHADHM CCc1ccc(-c2ccc(C(=O)N(C)c3cccc(-c4nn[n-]n4)c3)o2)cc1 ZINC000821476335 599146868 /nfs/dbraw/zinc/14/68/68/599146868.db2.gz MMPIEAKPVMUJMN-UHFFFAOYSA-N -1 3 373.416 3.966 20 0 FHADHM Cc1ccccc1[C@H](C)CC(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2 ZINC000737424674 599159018 /nfs/dbraw/zinc/15/90/18/599159018.db2.gz WQNYSRCPEQCFCQ-GFCCVEGCSA-N -1 3 367.478 3.858 20 0 FHADHM Cc1ccccc1[C@H](C)CC(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2 ZINC000737424674 599159019 /nfs/dbraw/zinc/15/90/19/599159019.db2.gz WQNYSRCPEQCFCQ-GFCCVEGCSA-N -1 3 367.478 3.858 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1SCc1ncc(-c2ccccc2)o1 ZINC000737643246 599173609 /nfs/dbraw/zinc/17/36/09/599173609.db2.gz DPJVINFOEIPEJN-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1SCc1ncc(-c2ccccc2)o1 ZINC000737643246 599173612 /nfs/dbraw/zinc/17/36/12/599173612.db2.gz DPJVINFOEIPEJN-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM O=C(NCc1cc(-c2nnn[n-]2)ccc1F)c1ccc(-c2ccccc2)cc1 ZINC000823242179 599175323 /nfs/dbraw/zinc/17/53/23/599175323.db2.gz QVGHTRCCULHSFL-UHFFFAOYSA-N -1 3 373.391 3.603 20 0 FHADHM O=C(NCc1cc(-c2nn[n-]n2)ccc1F)c1ccc(-c2ccccc2)cc1 ZINC000823242179 599175326 /nfs/dbraw/zinc/17/53/26/599175326.db2.gz QVGHTRCCULHSFL-UHFFFAOYSA-N -1 3 373.391 3.603 20 0 FHADHM S=C(Nc1ccccc1-c1nnn[n-]1)N[C@@H](CC1CC1)c1ccccc1 ZINC000738408104 599177100 /nfs/dbraw/zinc/17/71/00/599177100.db2.gz KNPBGZQZVLUIRT-KRWDZBQOSA-N -1 3 364.478 3.695 20 0 FHADHM S=C(Nc1ccccc1-c1nn[n-]n1)N[C@@H](CC1CC1)c1ccccc1 ZINC000738408104 599177102 /nfs/dbraw/zinc/17/71/02/599177102.db2.gz KNPBGZQZVLUIRT-KRWDZBQOSA-N -1 3 364.478 3.695 20 0 FHADHM CC(C)[C@H](CC1CCCCC1)C(=O)NCc1cc(-c2nnn[n-]2)ccc1F ZINC000820021484 599178039 /nfs/dbraw/zinc/17/80/39/599178039.db2.gz VCKQSSDKOAUODX-KRWDZBQOSA-N -1 3 373.476 3.865 20 0 FHADHM CC(C)[C@H](CC1CCCCC1)C(=O)NCc1cc(-c2nn[n-]n2)ccc1F ZINC000820021484 599178040 /nfs/dbraw/zinc/17/80/40/599178040.db2.gz VCKQSSDKOAUODX-KRWDZBQOSA-N -1 3 373.476 3.865 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)ccc1OC(=O)[C@@H](C)c1cccc(Cl)c1 ZINC000736629159 599179276 /nfs/dbraw/zinc/17/92/76/599179276.db2.gz UWQJPBUYBVZSCM-NSHDSACASA-N -1 3 372.812 3.628 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)ccc1OC(=O)[C@@H](C)c1cccc(Cl)c1 ZINC000736629159 599179279 /nfs/dbraw/zinc/17/92/79/599179279.db2.gz UWQJPBUYBVZSCM-NSHDSACASA-N -1 3 372.812 3.628 20 0 FHADHM CC(C)(C(=O)NCc1ccc(-c2nnn[n-]2)cc1)c1ccc2ccccc2c1 ZINC000607904443 599182200 /nfs/dbraw/zinc/18/22/00/599182200.db2.gz NDCUIJFEQKWYQN-UHFFFAOYSA-N -1 3 371.444 3.614 20 0 FHADHM CC(C)(C(=O)NCc1ccc(-c2nn[n-]n2)cc1)c1ccc2ccccc2c1 ZINC000607904443 599182202 /nfs/dbraw/zinc/18/22/02/599182202.db2.gz NDCUIJFEQKWYQN-UHFFFAOYSA-N -1 3 371.444 3.614 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)c1cc2cccc(F)c2o1 ZINC000735662146 599183689 /nfs/dbraw/zinc/18/36/89/599183689.db2.gz RAZOJFURZOUBAV-UHFFFAOYSA-N -1 3 368.372 3.561 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)c1cc2cccc(F)c2o1 ZINC000735662146 599183691 /nfs/dbraw/zinc/18/36/91/599183691.db2.gz RAZOJFURZOUBAV-UHFFFAOYSA-N -1 3 368.372 3.561 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cc3cccc(F)c3o2)c1-c1nnn[n-]1 ZINC000736674440 599186251 /nfs/dbraw/zinc/18/62/51/599186251.db2.gz CLNUJXMXJYNTHF-UHFFFAOYSA-N -1 3 371.397 3.937 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cc3cccc(F)c3o2)c1-c1nn[n-]n1 ZINC000736674440 599186253 /nfs/dbraw/zinc/18/62/53/599186253.db2.gz CLNUJXMXJYNTHF-UHFFFAOYSA-N -1 3 371.397 3.937 20 0 FHADHM CC[C@@H](C)NC(=O)c1cccc(Oc2cccc(Cl)c2-c2nnn[n-]2)c1 ZINC000736326597 599192863 /nfs/dbraw/zinc/19/28/63/599192863.db2.gz OOTUUZJRVCSHNF-LLVKDONJSA-N -1 3 371.828 3.841 20 0 FHADHM O=C(c1cccc(Oc2cccc(Cl)c2-c2nnn[n-]2)c1)N1CCCC1 ZINC000738277759 599197932 /nfs/dbraw/zinc/19/79/32/599197932.db2.gz DXLWEDNPQRDUBO-UHFFFAOYSA-N -1 3 369.812 3.548 20 0 FHADHM C[C@H]1C[C@H]1C(=O)N(Cc1ccc(Cl)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000736235297 599209353 /nfs/dbraw/zinc/20/93/53/599209353.db2.gz MYONNGJIGPHPLV-YVEFUNNKSA-N -1 3 367.840 3.709 20 0 FHADHM C[C@H]1C[C@H]1C(=O)N(Cc1ccc(Cl)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000736235297 599209356 /nfs/dbraw/zinc/20/93/56/599209356.db2.gz MYONNGJIGPHPLV-YVEFUNNKSA-N -1 3 367.840 3.709 20 0 FHADHM O=C(CC1CCC1)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1 ZINC000822940770 599219317 /nfs/dbraw/zinc/21/93/17/599219317.db2.gz DKTDFPAZCVPYII-UHFFFAOYSA-N -1 3 367.384 3.927 20 0 FHADHM O=C(CC1CCC1)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1 ZINC000822940770 599219319 /nfs/dbraw/zinc/21/93/19/599219319.db2.gz DKTDFPAZCVPYII-UHFFFAOYSA-N -1 3 367.384 3.927 20 0 FHADHM C[C@@H](SCC(=O)N(C)CC1CCCCC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820548536 599222287 /nfs/dbraw/zinc/22/22/87/599222287.db2.gz BMWNAODTJDHTCN-CQSZACIVSA-N -1 3 373.526 3.700 20 0 FHADHM C[C@@H](SCC(=O)N(C)CC1CCCCC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820548536 599222290 /nfs/dbraw/zinc/22/22/90/599222290.db2.gz BMWNAODTJDHTCN-CQSZACIVSA-N -1 3 373.526 3.700 20 0 FHADHM CS[C@@H]1CCC[C@@H](Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)C1 ZINC000737180449 599233409 /nfs/dbraw/zinc/23/34/09/599233409.db2.gz QSSUPUQRIOGQJH-MWLCHTKSSA-N -1 3 357.405 3.972 20 0 FHADHM CS[C@@H]1CCC[C@@H](Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)C1 ZINC000737180449 599233411 /nfs/dbraw/zinc/23/34/11/599233411.db2.gz QSSUPUQRIOGQJH-MWLCHTKSSA-N -1 3 357.405 3.972 20 0 FHADHM CC[C@@]1(C)CCCN(C(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)C1 ZINC000820949740 599228519 /nfs/dbraw/zinc/22/85/19/599228519.db2.gz FCYAERZMBBYUBK-INIZCTEOSA-N -1 3 364.906 3.729 20 0 FHADHM CC[C@@]1(C)CCCN(C(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)C1 ZINC000820949740 599228522 /nfs/dbraw/zinc/22/85/22/599228522.db2.gz FCYAERZMBBYUBK-INIZCTEOSA-N -1 3 364.906 3.729 20 0 FHADHM O=C(Nc1ccc(OC2CCCC2)c(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000738171489 599234546 /nfs/dbraw/zinc/23/45/46/599234546.db2.gz ACHJXAAECOQYLO-UHFFFAOYSA-N -1 3 367.384 3.580 20 0 FHADHM O=C(Nc1ccc(OC2CCCC2)c(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000738171489 599234548 /nfs/dbraw/zinc/23/45/48/599234548.db2.gz ACHJXAAECOQYLO-UHFFFAOYSA-N -1 3 367.384 3.580 20 0 FHADHM C[C@H](NC(=S)Nc1ccccc1Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000820403701 599237432 /nfs/dbraw/zinc/23/74/32/599237432.db2.gz LGMOCFQCPHCKKC-JTQLQIEISA-N -1 3 358.858 3.568 20 0 FHADHM C[C@H](NC(=S)Nc1ccccc1Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000820403701 599237434 /nfs/dbraw/zinc/23/74/34/599237434.db2.gz LGMOCFQCPHCKKC-JTQLQIEISA-N -1 3 358.858 3.568 20 0 FHADHM Cc1ccc(NC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c(Cl)c1 ZINC000822248721 599239128 /nfs/dbraw/zinc/23/91/28/599239128.db2.gz KORAKHQFDQYENM-NSHDSACASA-N -1 3 356.817 3.711 20 0 FHADHM Cc1ccc(NC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c(Cl)c1 ZINC000822248721 599239132 /nfs/dbraw/zinc/23/91/32/599239132.db2.gz KORAKHQFDQYENM-NSHDSACASA-N -1 3 356.817 3.711 20 0 FHADHM Cc1c(NC(=O)c2cccc(-c3cscn3)c2)cccc1-c1nnn[n-]1 ZINC000822108837 607268156 /nfs/dbraw/zinc/26/81/56/607268156.db2.gz LKCNYJZGKXZTKW-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1c(NC(=O)c2cccc(-c3cscn3)c2)cccc1-c1nn[n-]n1 ZINC000822108837 607268157 /nfs/dbraw/zinc/26/81/57/607268157.db2.gz LKCNYJZGKXZTKW-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1nn(-c2ccc(F)cc2F)c(C)c1CNCc1ccc(C(=O)[O-])cc1 ZINC000426696546 597136542 /nfs/dbraw/zinc/13/65/42/597136542.db2.gz OWYPSXPQWXXAEF-UHFFFAOYSA-N -1 3 371.387 3.755 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)/C=C\C1CCCCC1 ZINC000736478975 599247908 /nfs/dbraw/zinc/24/79/08/599247908.db2.gz HCDJFQYOABEBGZ-RAXLEYEMSA-N -1 3 353.470 3.742 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)/C=C\C1CCCCC1 ZINC000736478975 599247910 /nfs/dbraw/zinc/24/79/10/599247910.db2.gz HCDJFQYOABEBGZ-RAXLEYEMSA-N -1 3 353.470 3.742 20 0 FHADHM Cc1c(NC(=O)N[C@@H](c2ccccc2)C(C)C)cccc1-c1nnn[n-]1 ZINC000822091069 607284143 /nfs/dbraw/zinc/28/41/43/607284143.db2.gz NKYNUOBTDJEAFH-QGZVFWFLSA-N -1 3 350.426 3.694 20 0 FHADHM Cc1c(NC(=O)N[C@@H](c2ccccc2)C(C)C)cccc1-c1nn[n-]n1 ZINC000822091069 607284144 /nfs/dbraw/zinc/28/41/44/607284144.db2.gz NKYNUOBTDJEAFH-QGZVFWFLSA-N -1 3 350.426 3.694 20 0 FHADHM Cc1ccc(C[C@@H](C)N(C)C(=O)Nc2cccc(-c3nnn[n-]3)c2C)cc1 ZINC000822234782 607290280 /nfs/dbraw/zinc/29/02/80/607290280.db2.gz HGVDCZAEAAYZCZ-CQSZACIVSA-N -1 3 364.453 3.578 20 0 FHADHM Cc1ccc(C[C@@H](C)N(C)C(=O)Nc2cccc(-c3nn[n-]n3)c2C)cc1 ZINC000822234782 607290281 /nfs/dbraw/zinc/29/02/81/607290281.db2.gz HGVDCZAEAAYZCZ-CQSZACIVSA-N -1 3 364.453 3.578 20 0 FHADHM COc1ccc(CNc2ccc(OC(C)C)c(Cl)c2)cc1-c1nnn[n-]1 ZINC000821821730 607308912 /nfs/dbraw/zinc/30/89/12/607308912.db2.gz UFDMTAQWLQGTOA-UHFFFAOYSA-N -1 3 373.844 3.928 20 0 FHADHM COc1ccc(CNc2ccc(OC(C)C)c(Cl)c2)cc1-c1nn[n-]n1 ZINC000821821730 607308913 /nfs/dbraw/zinc/30/89/13/607308913.db2.gz UFDMTAQWLQGTOA-UHFFFAOYSA-N -1 3 373.844 3.928 20 0 FHADHM Cc1ccc(NCc2cc(-c3nnn[n-]3)cs2)c(OCC(F)(F)F)c1 ZINC000822254093 607314344 /nfs/dbraw/zinc/31/43/44/607314344.db2.gz ABTCECDTELLIDC-UHFFFAOYSA-N -1 3 369.372 3.790 20 0 FHADHM Cc1ccc(NCc2cc(-c3nn[n-]n3)cs2)c(OCC(F)(F)F)c1 ZINC000822254093 607314345 /nfs/dbraw/zinc/31/43/45/607314345.db2.gz ABTCECDTELLIDC-UHFFFAOYSA-N -1 3 369.372 3.790 20 0 FHADHM COc1ccc(CNc2ccccc2OC(C)(C)C)cc1-c1nnn[n-]1 ZINC000821824562 607317884 /nfs/dbraw/zinc/31/78/84/607317884.db2.gz NERGQNLIFXWNLP-UHFFFAOYSA-N -1 3 353.426 3.665 20 0 FHADHM COc1ccc(CNc2ccccc2OC(C)(C)C)cc1-c1nn[n-]n1 ZINC000821824562 607317885 /nfs/dbraw/zinc/31/78/85/607317885.db2.gz NERGQNLIFXWNLP-UHFFFAOYSA-N -1 3 353.426 3.665 20 0 FHADHM C[C@H](NC(=O)Nc1cc(F)ccc1Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000820373948 599276116 /nfs/dbraw/zinc/27/61/16/599276116.db2.gz LUZKDALOMNVPON-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM C[C@H](NC(=O)Nc1cc(F)ccc1Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000820373948 599276119 /nfs/dbraw/zinc/27/61/19/599276119.db2.gz LUZKDALOMNVPON-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM Cc1nc(-c2cccnc2)nc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1C ZINC000737464799 599273366 /nfs/dbraw/zinc/27/33/66/599273366.db2.gz YNRYNYUWILKNOT-AWEZNQCLSA-N -1 3 372.436 3.509 20 0 FHADHM Cc1nc(-c2cccnc2)nc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1C ZINC000737464799 599273368 /nfs/dbraw/zinc/27/33/68/599273368.db2.gz YNRYNYUWILKNOT-AWEZNQCLSA-N -1 3 372.436 3.509 20 0 FHADHM Cc1coc(-c2cc(NCc3ccc(-c4nnn[n-]4)s3)ccc2C)n1 ZINC000822402478 607319573 /nfs/dbraw/zinc/31/95/73/607319573.db2.gz BDJIYSWEVVSYTQ-UHFFFAOYSA-N -1 3 352.423 3.812 20 0 FHADHM CCSc1cccc(NC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000821461665 599281108 /nfs/dbraw/zinc/28/11/08/599281108.db2.gz RDEYQGWWNKZGMY-LBPRGKRZSA-N -1 3 368.466 3.861 20 0 FHADHM CCSc1cccc(NC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000821461665 599281112 /nfs/dbraw/zinc/28/11/12/599281112.db2.gz RDEYQGWWNKZGMY-LBPRGKRZSA-N -1 3 368.466 3.861 20 0 FHADHM CSCc1cccc(NC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000821971162 599282343 /nfs/dbraw/zinc/28/23/43/599282343.db2.gz YBJRVRITUVSCAV-LBPRGKRZSA-N -1 3 368.466 3.612 20 0 FHADHM CSCc1cccc(NC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000821971162 599282345 /nfs/dbraw/zinc/28/23/45/599282345.db2.gz YBJRVRITUVSCAV-LBPRGKRZSA-N -1 3 368.466 3.612 20 0 FHADHM C[C@@H](Sc1nnc(-c2cccs2)n1C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736193525 599287364 /nfs/dbraw/zinc/28/73/64/599287364.db2.gz SIFCCAHUMGIVFL-SNVBAGLBSA-N -1 3 369.479 3.577 20 0 FHADHM C[C@@H](Sc1nnc(-c2cccs2)n1C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736193525 599287365 /nfs/dbraw/zinc/28/73/65/599287365.db2.gz SIFCCAHUMGIVFL-SNVBAGLBSA-N -1 3 369.479 3.577 20 0 FHADHM Cc1c(NC(=O)c2ccccc2SC(C)C)cccc1-c1nnn[n-]1 ZINC000822115681 607321414 /nfs/dbraw/zinc/32/14/14/607321414.db2.gz HIFNMAYFPXQOSK-UHFFFAOYSA-N -1 3 353.451 3.928 20 0 FHADHM Cc1c(NC(=O)c2ccccc2SC(C)C)cccc1-c1nn[n-]n1 ZINC000822115681 607321415 /nfs/dbraw/zinc/32/14/15/607321415.db2.gz HIFNMAYFPXQOSK-UHFFFAOYSA-N -1 3 353.451 3.928 20 0 FHADHM Cc1c(C(=O)Nc2cccc(-c3nnn[n-]3)c2C)sc2nccc(C)c12 ZINC000822116514 607321960 /nfs/dbraw/zinc/32/19/60/607321960.db2.gz SHKCFUWAEPZYBS-UHFFFAOYSA-N -1 3 364.434 3.654 20 0 FHADHM Cc1c(C(=O)Nc2cccc(-c3nn[n-]n3)c2C)sc2nccc(C)c12 ZINC000822116514 607321961 /nfs/dbraw/zinc/32/19/61/607321961.db2.gz SHKCFUWAEPZYBS-UHFFFAOYSA-N -1 3 364.434 3.654 20 0 FHADHM COc1ccc(OCCS[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000737112669 599290327 /nfs/dbraw/zinc/29/03/27/599290327.db2.gz XOYWZXXGRNLXIM-CYBMUJFWSA-N -1 3 356.451 3.749 20 0 FHADHM COc1ccc(OCCS[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000737112669 599290329 /nfs/dbraw/zinc/29/03/29/599290329.db2.gz XOYWZXXGRNLXIM-CYBMUJFWSA-N -1 3 356.451 3.749 20 0 FHADHM CC(C)SCC(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000735921152 598231789 /nfs/dbraw/zinc/23/17/89/598231789.db2.gz LYHZGALGHKLVFY-UHFFFAOYSA-N -1 3 369.450 3.739 20 0 FHADHM CC(C)SCC(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735921152 598231791 /nfs/dbraw/zinc/23/17/91/598231791.db2.gz LYHZGALGHKLVFY-UHFFFAOYSA-N -1 3 369.450 3.739 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)N[C@@H](c1ccccc1)C1CCC1 ZINC000737798575 598232307 /nfs/dbraw/zinc/23/23/07/598232307.db2.gz MGMZSEXRDIIMRO-AIGDTVQASA-N -1 3 359.433 3.538 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)N[C@@H](c1ccccc1)C1CCC1 ZINC000737798575 598232309 /nfs/dbraw/zinc/23/23/09/598232309.db2.gz MGMZSEXRDIIMRO-AIGDTVQASA-N -1 3 359.433 3.538 20 0 FHADHM Fc1ccc(-c2cnc(Sc3cccc(F)c3-c3nnn[n-]3)o2)cc1 ZINC000737650332 598236168 /nfs/dbraw/zinc/23/61/68/598236168.db2.gz HPCJACASYTYZFT-UHFFFAOYSA-N -1 3 357.345 3.951 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1N1CCC(c2cc3ccccc3[nH]2)CC1 ZINC000737641709 598243719 /nfs/dbraw/zinc/24/37/19/598243719.db2.gz XAOQZQDLFYPNLU-UHFFFAOYSA-N -1 3 362.412 3.871 20 0 FHADHM CC[C@@H](SCC(=O)Nc1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000736392799 598273299 /nfs/dbraw/zinc/27/32/99/598273299.db2.gz SIGGAFCUCRBJOW-MRXNPFEDSA-N -1 3 353.451 3.690 20 0 FHADHM CC[C@@H](SCC(=O)Nc1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000736392799 598273303 /nfs/dbraw/zinc/27/33/03/598273303.db2.gz SIGGAFCUCRBJOW-MRXNPFEDSA-N -1 3 353.451 3.690 20 0 FHADHM Clc1cc(NCc2ccnc(OC3CCCC3)c2)ccc1-c1nnn[n-]1 ZINC000737562969 598277235 /nfs/dbraw/zinc/27/72/35/598277235.db2.gz BOMZSASNXCFALU-UHFFFAOYSA-N -1 3 370.844 3.849 20 0 FHADHM Clc1cc(NCc2ccnc(OC3CCCC3)c2)ccc1-c1nn[n-]n1 ZINC000737562969 598277236 /nfs/dbraw/zinc/27/72/36/598277236.db2.gz BOMZSASNXCFALU-UHFFFAOYSA-N -1 3 370.844 3.849 20 0 FHADHM Cc1ccc(CCCCC(=O)N(C)c2ccc(-c3nnn[n-]3)cc2F)cc1 ZINC000737338201 598279590 /nfs/dbraw/zinc/27/95/90/598279590.db2.gz PAWCLLNIQSQXBJ-UHFFFAOYSA-N -1 3 367.428 3.690 20 0 FHADHM Cc1ccc(CCCCC(=O)N(C)c2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000737338201 598279591 /nfs/dbraw/zinc/27/95/91/598279591.db2.gz PAWCLLNIQSQXBJ-UHFFFAOYSA-N -1 3 367.428 3.690 20 0 FHADHM CCCCc1ccc(C(=O)N(C)c2ccc(-c3nnn[n-]3)cc2F)cc1 ZINC000736466519 598281444 /nfs/dbraw/zinc/28/14/44/598281444.db2.gz MBCOLMDUIWUTRB-UHFFFAOYSA-N -1 3 353.401 3.625 20 0 FHADHM CCCCc1ccc(C(=O)N(C)c2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000736466519 598281445 /nfs/dbraw/zinc/28/14/45/598281445.db2.gz MBCOLMDUIWUTRB-UHFFFAOYSA-N -1 3 353.401 3.625 20 0 FHADHM CC[C@@H](NC(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1)C1CCCCC1 ZINC000736362935 598283754 /nfs/dbraw/zinc/28/37/54/598283754.db2.gz LNAUUBJUXYXJEL-CXAGYDPISA-N -1 3 356.474 3.586 20 0 FHADHM CC[C@@H](NC(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1)C1CCCCC1 ZINC000736362935 598283756 /nfs/dbraw/zinc/28/37/56/598283756.db2.gz LNAUUBJUXYXJEL-CXAGYDPISA-N -1 3 356.474 3.586 20 0 FHADHM Cc1c2c(nc(SCc3ccc4ccccc4n3)c1-c1nnn[n-]1)CCC2 ZINC000737220612 598284741 /nfs/dbraw/zinc/28/47/41/598284741.db2.gz ZWQXAACJKZBDKB-UHFFFAOYSA-N -1 3 374.473 3.899 20 0 FHADHM Cc1c2c(nc(SCc3ccc4ccccc4n3)c1-c1nn[n-]n1)CCC2 ZINC000737220612 598284743 /nfs/dbraw/zinc/28/47/43/598284743.db2.gz ZWQXAACJKZBDKB-UHFFFAOYSA-N -1 3 374.473 3.899 20 0 FHADHM Clc1ccc2c(c1Cl)CCN(Cc1cccc(-c3nnn[n-]3)c1)C2 ZINC000737575563 598301291 /nfs/dbraw/zinc/30/12/91/598301291.db2.gz XPWFAAYYHODYHW-UHFFFAOYSA-N -1 3 360.248 3.732 20 0 FHADHM Clc1ccc2c(c1Cl)CCN(Cc1cccc(-c3nn[n-]n3)c1)C2 ZINC000737575563 598301293 /nfs/dbraw/zinc/30/12/93/598301293.db2.gz XPWFAAYYHODYHW-UHFFFAOYSA-N -1 3 360.248 3.732 20 0 FHADHM Cc1cc(F)ccc1C(=O)Nc1sc2c(c1-c1nnn[n-]1)CC[C@H](C)C2 ZINC000822205616 607349384 /nfs/dbraw/zinc/34/93/84/607349384.db2.gz AINPHBSYFRAQFB-VIFPVBQESA-N -1 3 371.441 3.753 20 0 FHADHM Cc1cc(F)ccc1C(=O)Nc1sc2c(c1-c1nn[n-]n1)CC[C@H](C)C2 ZINC000822205616 607349385 /nfs/dbraw/zinc/34/93/85/607349385.db2.gz AINPHBSYFRAQFB-VIFPVBQESA-N -1 3 371.441 3.753 20 0 FHADHM CC(C)N(Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736110237 598303730 /nfs/dbraw/zinc/30/37/30/598303730.db2.gz GQHKUNCPDSXIAZ-HNNXBMFYSA-N -1 3 364.453 3.548 20 0 FHADHM CC(C)N(Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736110237 598303732 /nfs/dbraw/zinc/30/37/32/598303732.db2.gz GQHKUNCPDSXIAZ-HNNXBMFYSA-N -1 3 364.453 3.548 20 0 FHADHM O=C(NCc1ccc(-c2nnn[n-]2)cc1F)c1ccc(-c2ccccc2)cc1 ZINC000738102587 598306627 /nfs/dbraw/zinc/30/66/27/598306627.db2.gz QXOHFKLHNYTOLT-UHFFFAOYSA-N -1 3 373.391 3.603 20 0 FHADHM O=C(NCc1ccc(-c2nn[n-]n2)cc1F)c1ccc(-c2ccccc2)cc1 ZINC000738102587 598306628 /nfs/dbraw/zinc/30/66/28/598306628.db2.gz QXOHFKLHNYTOLT-UHFFFAOYSA-N -1 3 373.391 3.603 20 0 FHADHM O=C(O[C@H](c1ccccc1)c1cccc(F)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000738211888 598307824 /nfs/dbraw/zinc/30/78/24/598307824.db2.gz AENZODUAJUTJRU-LJQANCHMSA-N -1 3 374.375 3.952 20 0 FHADHM O=C(O[C@H](c1ccccc1)c1cccc(F)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000738211888 598307826 /nfs/dbraw/zinc/30/78/26/598307826.db2.gz AENZODUAJUTJRU-LJQANCHMSA-N -1 3 374.375 3.952 20 0 FHADHM CC(C)N(C(=O)c1cccc(-c2nnn[n-]2)c1)c1ccc(F)cc1Cl ZINC000735857007 598310636 /nfs/dbraw/zinc/31/06/36/598310636.db2.gz OOQVNVQLYCLQAZ-UHFFFAOYSA-N -1 3 359.792 3.714 20 0 FHADHM CC(C)N(C(=O)c1cccc(-c2nn[n-]n2)c1)c1ccc(F)cc1Cl ZINC000735857007 598310637 /nfs/dbraw/zinc/31/06/37/598310637.db2.gz OOQVNVQLYCLQAZ-UHFFFAOYSA-N -1 3 359.792 3.714 20 0 FHADHM C[C@@H]1Cc2ccccc2N1C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736295864 598315313 /nfs/dbraw/zinc/31/53/13/598315313.db2.gz AKIZOWIXYNULJA-SNVBAGLBSA-N -1 3 370.869 3.668 20 0 FHADHM C[C@@H]1Cc2ccccc2N1C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736295864 598315315 /nfs/dbraw/zinc/31/53/15/598315315.db2.gz AKIZOWIXYNULJA-SNVBAGLBSA-N -1 3 370.869 3.668 20 0 FHADHM C[C@H]1CCCC[C@@H]1CNC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736269946 598322264 /nfs/dbraw/zinc/32/22/64/598322264.db2.gz HQGQMUICTWDBMH-WDEREUQCSA-N -1 3 364.906 3.633 20 0 FHADHM C[C@H]1CCCC[C@@H]1CNC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736269946 598322266 /nfs/dbraw/zinc/32/22/66/598322266.db2.gz HQGQMUICTWDBMH-WDEREUQCSA-N -1 3 364.906 3.633 20 0 FHADHM Cc1cccc(CN(C)C(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c1 ZINC000737394268 598322759 /nfs/dbraw/zinc/32/27/59/598322759.db2.gz QXTQAEDATQYFLZ-UHFFFAOYSA-N -1 3 372.885 3.657 20 0 FHADHM Cc1cccc(CN(C)C(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c1 ZINC000737394268 598322761 /nfs/dbraw/zinc/32/27/61/598322761.db2.gz QXTQAEDATQYFLZ-UHFFFAOYSA-N -1 3 372.885 3.657 20 0 FHADHM Cc1cc(C)cc(N(C)C(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c1 ZINC000737250764 598322806 /nfs/dbraw/zinc/32/28/06/598322806.db2.gz OVNHTSDTQHOOJW-UHFFFAOYSA-N -1 3 372.885 3.970 20 0 FHADHM Cc1cc(C)cc(N(C)C(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c1 ZINC000737250764 598322808 /nfs/dbraw/zinc/32/28/08/598322808.db2.gz OVNHTSDTQHOOJW-UHFFFAOYSA-N -1 3 372.885 3.970 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=S)Nc1ccc(OC(C)C)cc1 ZINC000737295999 598324403 /nfs/dbraw/zinc/32/44/03/598324403.db2.gz DZYFBWKZXGSDMM-UHFFFAOYSA-N -1 3 368.466 3.771 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=S)Nc1ccc(OC(C)C)cc1 ZINC000737295999 598324404 /nfs/dbraw/zinc/32/44/04/598324404.db2.gz DZYFBWKZXGSDMM-UHFFFAOYSA-N -1 3 368.466 3.771 20 0 FHADHM C[C@H](OC(=O)[C@H]1CCCc2sccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488829 607351930 /nfs/dbraw/zinc/35/19/30/607351930.db2.gz VAEARSSHZFZQEI-NHYWBVRUSA-N -1 3 354.435 3.653 20 0 FHADHM C[C@H](OC(=O)[C@H]1CCCc2sccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488829 607351932 /nfs/dbraw/zinc/35/19/32/607351932.db2.gz VAEARSSHZFZQEI-NHYWBVRUSA-N -1 3 354.435 3.653 20 0 FHADHM Cc1cc(F)ccc1C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000822205926 607352434 /nfs/dbraw/zinc/35/24/34/607352434.db2.gz NOSXXDFOROJGDI-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM Cc1cc(F)ccc1C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000822205926 607352435 /nfs/dbraw/zinc/35/24/35/607352435.db2.gz NOSXXDFOROJGDI-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM Brc1cccc([C@H]2C[C@@H]2Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735369816 598353375 /nfs/dbraw/zinc/35/33/75/598353375.db2.gz XKILONNHEYAXFE-CABCVRRESA-N -1 3 356.227 3.597 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc(-c2nnn[n-]2)cc1)c1csc2ccccc21 ZINC000736116829 598369522 /nfs/dbraw/zinc/36/95/22/598369522.db2.gz NQYYCNWUROLIMN-LLVKDONJSA-N -1 3 364.434 3.964 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc(-c2nn[n-]n2)cc1)c1csc2ccccc21 ZINC000736116829 598369525 /nfs/dbraw/zinc/36/95/25/598369525.db2.gz NQYYCNWUROLIMN-LLVKDONJSA-N -1 3 364.434 3.964 20 0 FHADHM CN(Cc1csc2ccccc12)c1ncc(-c2nnn[n-]2)cc1Cl ZINC000736831181 598389493 /nfs/dbraw/zinc/38/94/93/598389493.db2.gz HQHWZDDKIVNCSW-UHFFFAOYSA-N -1 3 356.842 3.766 20 0 FHADHM CN(Cc1csc2ccccc12)c1ncc(-c2nn[n-]n2)cc1Cl ZINC000736831181 598389494 /nfs/dbraw/zinc/38/94/94/598389494.db2.gz HQHWZDDKIVNCSW-UHFFFAOYSA-N -1 3 356.842 3.766 20 0 FHADHM Clc1cccc(-c2nnc(CSc3ccc(-c4nnn[n-]4)cc3)o2)c1 ZINC000737575223 598392881 /nfs/dbraw/zinc/39/28/81/598392881.db2.gz NQKOAWBNCJCULD-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1cccc(-c2nnc(CSc3ccc(-c4nn[n-]n4)cc3)o2)c1 ZINC000737575223 598392883 /nfs/dbraw/zinc/39/28/83/598392883.db2.gz NQKOAWBNCJCULD-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Cc1ccsc1-c1nnc(SCc2ccc(-c3nnn[n-]3)cc2F)o1 ZINC000737441758 598394119 /nfs/dbraw/zinc/39/41/19/598394119.db2.gz KLAFLUIJRCNPPW-UHFFFAOYSA-N -1 3 374.426 3.718 20 0 FHADHM Cc1ccsc1-c1nnc(SCc2ccc(-c3nn[n-]n3)cc2F)o1 ZINC000737441758 598394121 /nfs/dbraw/zinc/39/41/21/598394121.db2.gz KLAFLUIJRCNPPW-UHFFFAOYSA-N -1 3 374.426 3.718 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1OCc1ccc(Br)s1 ZINC000737221350 598394831 /nfs/dbraw/zinc/39/48/31/598394831.db2.gz JRBPNIHTMORWMZ-UHFFFAOYSA-N -1 3 351.229 3.578 20 0 FHADHM C[C@H](OC(=O)CCc1ccc(-c2nnn[n-]2)cc1)c1ccc(F)cc1Cl ZINC000737196698 598416574 /nfs/dbraw/zinc/41/65/74/598416574.db2.gz YOXYNHBRXUFNNY-NSHDSACASA-N -1 3 374.803 3.896 20 0 FHADHM C[C@H](OC(=O)CCc1ccc(-c2nn[n-]n2)cc1)c1ccc(F)cc1Cl ZINC000737196698 598416576 /nfs/dbraw/zinc/41/65/76/598416576.db2.gz YOXYNHBRXUFNNY-NSHDSACASA-N -1 3 374.803 3.896 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)NCCCC1CCCC1 ZINC000735873984 598427327 /nfs/dbraw/zinc/42/73/27/598427327.db2.gz FMDQMIJWTCOFCE-UHFFFAOYSA-N -1 3 370.501 3.757 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)NCCCC1CCCC1 ZINC000735873984 598427329 /nfs/dbraw/zinc/42/73/29/598427329.db2.gz FMDQMIJWTCOFCE-UHFFFAOYSA-N -1 3 370.501 3.757 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)NC[C@@H]1CCCC[C@@H]1C ZINC000736271841 598429880 /nfs/dbraw/zinc/42/98/80/598429880.db2.gz OTWWQICOEISXDM-YJBOKZPZSA-N -1 3 370.501 3.613 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)NC[C@@H]1CCCC[C@@H]1C ZINC000736271841 598429881 /nfs/dbraw/zinc/42/98/81/598429881.db2.gz OTWWQICOEISXDM-YJBOKZPZSA-N -1 3 370.501 3.613 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N(C)Cc1ccc(F)cc1Cl ZINC000737291721 598431920 /nfs/dbraw/zinc/43/19/20/598431920.db2.gz NZRBYODKKQSTLT-UHFFFAOYSA-N -1 3 374.807 3.632 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N(C)Cc1ccc(F)cc1Cl ZINC000737291721 598431919 /nfs/dbraw/zinc/43/19/19/598431919.db2.gz NZRBYODKKQSTLT-UHFFFAOYSA-N -1 3 374.807 3.632 20 0 FHADHM Cc1cc(OC(=O)c2ccc(-c3nnn[n-]3)cn2)c(C(C)C)cc1Cl ZINC000737281066 598436816 /nfs/dbraw/zinc/43/68/16/598436816.db2.gz ZKQXZTKCQZZJDB-UHFFFAOYSA-N -1 3 357.801 3.566 20 0 FHADHM Cc1cc(OC(=O)c2ccc(-c3nn[n-]n3)cn2)c(C(C)C)cc1Cl ZINC000737281066 598436818 /nfs/dbraw/zinc/43/68/18/598436818.db2.gz ZKQXZTKCQZZJDB-UHFFFAOYSA-N -1 3 357.801 3.566 20 0 FHADHM CC(C)c1ccc([C@H](NC(=O)c2ccc(-c3nnn[n-]3)cn2)C(C)C)cc1 ZINC000735925179 598438827 /nfs/dbraw/zinc/43/88/27/598438827.db2.gz YUBRMJPXXRHQQU-GOSISDBHSA-N -1 3 364.453 3.512 20 0 FHADHM CC(C)c1ccc([C@H](NC(=O)c2ccc(-c3nn[n-]n3)cn2)C(C)C)cc1 ZINC000735925179 598438828 /nfs/dbraw/zinc/43/88/28/598438828.db2.gz YUBRMJPXXRHQQU-GOSISDBHSA-N -1 3 364.453 3.512 20 0 FHADHM CC(C)(NC(=S)Nc1ccccc1-c1nnn[n-]1)c1ccc(Cl)cc1 ZINC000735679031 598440354 /nfs/dbraw/zinc/44/03/54/598440354.db2.gz YLXRBCGFMBWNNA-UHFFFAOYSA-N -1 3 372.885 3.742 20 0 FHADHM CC(C)(NC(=S)Nc1ccccc1-c1nn[n-]n1)c1ccc(Cl)cc1 ZINC000735679031 598440355 /nfs/dbraw/zinc/44/03/55/598440355.db2.gz YLXRBCGFMBWNNA-UHFFFAOYSA-N -1 3 372.885 3.742 20 0 FHADHM CC(C)[C@@H](SCc1ccccc1)C(=O)Oc1ccc(-c2nnn[n-]2)cc1 ZINC000735733893 598440700 /nfs/dbraw/zinc/44/07/00/598440700.db2.gz CTMXZMYVCUNQDS-QGZVFWFLSA-N -1 3 368.462 3.730 20 0 FHADHM CC(C)[C@@H](SCc1ccccc1)C(=O)Oc1ccc(-c2nn[n-]n2)cc1 ZINC000735733893 598440702 /nfs/dbraw/zinc/44/07/02/598440702.db2.gz CTMXZMYVCUNQDS-QGZVFWFLSA-N -1 3 368.462 3.730 20 0 FHADHM CN(C(=O)[C@H]1C[C@H]1c1cccc2ccccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000736733212 598448524 /nfs/dbraw/zinc/44/85/24/598448524.db2.gz SVQZPMHYGFOQFR-PMACEKPBSA-N -1 3 369.428 3.786 20 0 FHADHM CN(C(=O)[C@H]1C[C@H]1c1cccc2ccccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000736733212 598448526 /nfs/dbraw/zinc/44/85/26/598448526.db2.gz SVQZPMHYGFOQFR-PMACEKPBSA-N -1 3 369.428 3.786 20 0 FHADHM Cc1cc(SC(C)(C)C)ccc1NC(=O)c1ccc(-c2nnn[n-]2)cn1 ZINC000737284079 598451626 /nfs/dbraw/zinc/45/16/26/598451626.db2.gz YQENSHUSDYDGHU-UHFFFAOYSA-N -1 3 368.466 3.713 20 0 FHADHM Cc1cc(SC(C)(C)C)ccc1NC(=O)c1ccc(-c2nn[n-]n2)cn1 ZINC000737284079 598451627 /nfs/dbraw/zinc/45/16/27/598451627.db2.gz YQENSHUSDYDGHU-UHFFFAOYSA-N -1 3 368.466 3.713 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)N1CCC[C@@H](c2ccccc2)CC1 ZINC000737801740 598456306 /nfs/dbraw/zinc/45/63/06/598456306.db2.gz TXWZXARNRMKWPQ-QFQMRYFISA-N -1 3 373.460 3.676 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)N1CCC[C@@H](c2ccccc2)CC1 ZINC000737801740 598456307 /nfs/dbraw/zinc/45/63/07/598456307.db2.gz TXWZXARNRMKWPQ-QFQMRYFISA-N -1 3 373.460 3.676 20 0 FHADHM CC(C)CCC[C@H](C)NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000735796545 598476096 /nfs/dbraw/zinc/47/60/96/598476096.db2.gz DDGSENRMPQNRGX-HNNXBMFYSA-N -1 3 370.501 3.756 20 0 FHADHM CC(C)CCC[C@H](C)NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000735796545 598476098 /nfs/dbraw/zinc/47/60/98/598476098.db2.gz DDGSENRMPQNRGX-HNNXBMFYSA-N -1 3 370.501 3.756 20 0 FHADHM C[C@@H](OC(=O)C[C@H](C)c1ccc(F)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000735977453 598482226 /nfs/dbraw/zinc/48/22/26/598482226.db2.gz OPYBIAVHPMZQDV-QWHCGFSZSA-N -1 3 354.385 3.804 20 0 FHADHM C[C@@H](OC(=O)C[C@H](C)c1ccc(F)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000735977453 598482228 /nfs/dbraw/zinc/48/22/28/598482228.db2.gz OPYBIAVHPMZQDV-QWHCGFSZSA-N -1 3 354.385 3.804 20 0 FHADHM C[C@@H](OC(=O)[C@H](C)SCc1ccccc1)c1cccc(-c2nnn[n-]2)c1 ZINC000736190047 598486587 /nfs/dbraw/zinc/48/65/87/598486587.db2.gz FHDXNVFZPPDLBQ-KGLIPLIRSA-N -1 3 368.462 3.793 20 0 FHADHM C[C@@H](OC(=O)[C@H](C)SCc1ccccc1)c1cccc(-c2nn[n-]n2)c1 ZINC000736190047 598486589 /nfs/dbraw/zinc/48/65/89/598486589.db2.gz FHDXNVFZPPDLBQ-KGLIPLIRSA-N -1 3 368.462 3.793 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)c1cc2sccc2s1 ZINC000735661058 598487591 /nfs/dbraw/zinc/48/75/91/598487591.db2.gz HRRVJCZNSCWPGP-UHFFFAOYSA-N -1 3 372.479 3.952 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)c1cc2sccc2s1 ZINC000735661058 598487592 /nfs/dbraw/zinc/48/75/92/598487592.db2.gz HRRVJCZNSCWPGP-UHFFFAOYSA-N -1 3 372.479 3.952 20 0 FHADHM Cc1cc(Cl)ccc1OCC(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000737262656 598489351 /nfs/dbraw/zinc/48/93/51/598489351.db2.gz FJMOYFDNWWHWBF-GFCCVEGCSA-N -1 3 372.812 3.512 20 0 FHADHM Cc1cc(Cl)ccc1OCC(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000737262656 598489353 /nfs/dbraw/zinc/48/93/53/598489353.db2.gz FJMOYFDNWWHWBF-GFCCVEGCSA-N -1 3 372.812 3.512 20 0 FHADHM CC[C@H](Sc1ccc(-c2nnn[n-]2)cc1)C(=O)c1ccc(OC)cc1 ZINC000736392248 598493232 /nfs/dbraw/zinc/49/32/32/598493232.db2.gz PURVOTXXFXMXRS-INIZCTEOSA-N -1 3 354.435 3.629 20 0 FHADHM CC[C@H](Sc1ccc(-c2nn[n-]n2)cc1)C(=O)c1ccc(OC)cc1 ZINC000736392248 598493233 /nfs/dbraw/zinc/49/32/33/598493233.db2.gz PURVOTXXFXMXRS-INIZCTEOSA-N -1 3 354.435 3.629 20 0 FHADHM O=[S@@](Cc1cccc(-c2nnn[n-]2)c1)Cc1c(Cl)cccc1Cl ZINC000738356952 598493284 /nfs/dbraw/zinc/49/32/84/598493284.db2.gz MSWKIEBZHQMLSX-QHCPKHFHSA-N -1 3 367.261 3.622 20 0 FHADHM O=[S@@](Cc1cccc(-c2nn[n-]n2)c1)Cc1c(Cl)cccc1Cl ZINC000738356952 598493285 /nfs/dbraw/zinc/49/32/85/598493285.db2.gz MSWKIEBZHQMLSX-QHCPKHFHSA-N -1 3 367.261 3.622 20 0 FHADHM COc1ccc([C@@H]2CCCN2c2ccc(-c3nnn[n-]3)c(Cl)c2)cc1 ZINC000737078043 598506217 /nfs/dbraw/zinc/50/62/17/598506217.db2.gz YFPXJNBQXZPVLA-KRWDZBQOSA-N -1 3 355.829 3.870 20 0 FHADHM COc1ccc([C@@H]2CCCN2c2ccc(-c3nn[n-]n3)c(Cl)c2)cc1 ZINC000737078043 598506219 /nfs/dbraw/zinc/50/62/19/598506219.db2.gz YFPXJNBQXZPVLA-KRWDZBQOSA-N -1 3 355.829 3.870 20 0 FHADHM Clc1ccc(NCc2cccnc2OC2CCCC2)c(-c2nnn[n-]2)c1 ZINC000737576172 598508447 /nfs/dbraw/zinc/50/84/47/598508447.db2.gz XERGBBMKNIOQRX-UHFFFAOYSA-N -1 3 370.844 3.849 20 0 FHADHM Clc1ccc(NCc2cccnc2OC2CCCC2)c(-c2nn[n-]n2)c1 ZINC000737576172 598508449 /nfs/dbraw/zinc/50/84/49/598508449.db2.gz XERGBBMKNIOQRX-UHFFFAOYSA-N -1 3 370.844 3.849 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cccc3ncccc32)c1-c1nnn[n-]1 ZINC000736675184 598517307 /nfs/dbraw/zinc/51/73/07/598517307.db2.gz FWVIKYYOCXYBOG-UHFFFAOYSA-N -1 3 364.434 3.600 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cccc3ncccc32)c1-c1nn[n-]n1 ZINC000736675184 598517308 /nfs/dbraw/zinc/51/73/08/598517308.db2.gz FWVIKYYOCXYBOG-UHFFFAOYSA-N -1 3 364.434 3.600 20 0 FHADHM CCCCC[C@@H](NC(=O)Cc1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000736441570 598543574 /nfs/dbraw/zinc/54/35/74/598543574.db2.gz SJWJHDVBIBPHJI-LJQANCHMSA-N -1 3 363.465 3.847 20 0 FHADHM CCCCC[C@@H](NC(=O)Cc1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000736441570 598543575 /nfs/dbraw/zinc/54/35/75/598543575.db2.gz SJWJHDVBIBPHJI-LJQANCHMSA-N -1 3 363.465 3.847 20 0 FHADHM Fc1cc(OCc2coc(-c3ccc(Cl)cc3)n2)ccc1-c1nnn[n-]1 ZINC000737654002 598547903 /nfs/dbraw/zinc/54/79/03/598547903.db2.gz VMBFAJNMRMVYMH-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM Fc1cc(OCc2coc(-c3ccc(Cl)cc3)n2)ccc1-c1nn[n-]n1 ZINC000737654002 598547905 /nfs/dbraw/zinc/54/79/05/598547905.db2.gz VMBFAJNMRMVYMH-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM CSC[C@@H](C)C(=O)OCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000737181524 598563806 /nfs/dbraw/zinc/56/38/06/598563806.db2.gz WDJVRTNVHZOBDZ-CYBMUJFWSA-N -1 3 368.462 3.576 20 0 FHADHM CSC[C@@H](C)C(=O)OCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000737181524 598563808 /nfs/dbraw/zinc/56/38/08/598563808.db2.gz WDJVRTNVHZOBDZ-CYBMUJFWSA-N -1 3 368.462 3.576 20 0 FHADHM FC(F)(F)c1cccc(Cn2ccc(-c3ccc(-c4nnn[n-]4)cc3)n2)c1 ZINC000737636452 598568210 /nfs/dbraw/zinc/56/82/10/598568210.db2.gz SPAKANRKSOOZAZ-UHFFFAOYSA-N -1 3 370.338 3.797 20 0 FHADHM FC(F)(F)c1cccc(Cn2ccc(-c3ccc(-c4nn[n-]n4)cc3)n2)c1 ZINC000737636452 598568212 /nfs/dbraw/zinc/56/82/12/598568212.db2.gz SPAKANRKSOOZAZ-UHFFFAOYSA-N -1 3 370.338 3.797 20 0 FHADHM O=C(CCCCCc1cccs1)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000737826692 598570184 /nfs/dbraw/zinc/57/01/84/598570184.db2.gz TZLFJNVOPCGDMN-UHFFFAOYSA-N -1 3 359.430 3.809 20 0 FHADHM O=C(CCCCCc1cccs1)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000737826692 598570185 /nfs/dbraw/zinc/57/01/85/598570185.db2.gz TZLFJNVOPCGDMN-UHFFFAOYSA-N -1 3 359.430 3.809 20 0 FHADHM Cc1ccc(C)c(N(C(=O)CCc2ccc(-c3nnn[n-]3)cc2)C(C)C)c1 ZINC000737321068 598579919 /nfs/dbraw/zinc/57/99/19/598579919.db2.gz CLKLLZDJEOZQHZ-UHFFFAOYSA-N -1 3 363.465 3.858 20 0 FHADHM Cc1ccc(C)c(N(C(=O)CCc2ccc(-c3nn[n-]n3)cc2)C(C)C)c1 ZINC000737321068 598579920 /nfs/dbraw/zinc/57/99/20/598579920.db2.gz CLKLLZDJEOZQHZ-UHFFFAOYSA-N -1 3 363.465 3.858 20 0 FHADHM O[C@@H](CNc1ccc(Cl)cc1-c1nnn[n-]1)c1ccc2ccccc2c1 ZINC000738380558 598580718 /nfs/dbraw/zinc/58/07/18/598580718.db2.gz CCSVBLLCRSZBAP-SFHVURJKSA-N -1 3 365.824 3.819 20 0 FHADHM O[C@@H](CNc1ccc(Cl)cc1-c1nn[n-]n1)c1ccc2ccccc2c1 ZINC000738380558 598580719 /nfs/dbraw/zinc/58/07/19/598580719.db2.gz CCSVBLLCRSZBAP-SFHVURJKSA-N -1 3 365.824 3.819 20 0 FHADHM O[C@H](CNc1ccc(Cl)cc1-c1nnn[n-]1)c1ccc2ccccc2c1 ZINC000738380556 598581067 /nfs/dbraw/zinc/58/10/67/598581067.db2.gz CCSVBLLCRSZBAP-GOSISDBHSA-N -1 3 365.824 3.819 20 0 FHADHM O[C@H](CNc1ccc(Cl)cc1-c1nn[n-]n1)c1ccc2ccccc2c1 ZINC000738380556 598581068 /nfs/dbraw/zinc/58/10/68/598581068.db2.gz CCSVBLLCRSZBAP-GOSISDBHSA-N -1 3 365.824 3.819 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)ccc1OCc1ncc(-c2cccs2)o1 ZINC000736628788 598581501 /nfs/dbraw/zinc/58/15/01/598581501.db2.gz XIEJTCQVEKTZJX-UHFFFAOYSA-N -1 3 369.406 3.561 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)ccc1OCc1ncc(-c2cccs2)o1 ZINC000736628788 598581503 /nfs/dbraw/zinc/58/15/03/598581503.db2.gz XIEJTCQVEKTZJX-UHFFFAOYSA-N -1 3 369.406 3.561 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)C1(c2cccc(Cl)c2)CCC1 ZINC000738160809 598588158 /nfs/dbraw/zinc/58/81/58/598588158.db2.gz BXJOYXNNANONFL-UHFFFAOYSA-N -1 3 371.803 3.720 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)C1(c2cccc(Cl)c2)CCC1 ZINC000738160809 598588160 /nfs/dbraw/zinc/58/81/60/598588160.db2.gz BXJOYXNNANONFL-UHFFFAOYSA-N -1 3 371.803 3.720 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)c1cc(F)c(Cl)cc1Cl ZINC000738168286 598589798 /nfs/dbraw/zinc/58/97/98/598589798.db2.gz YGIBMBQRPYZKJF-UHFFFAOYSA-N -1 3 370.146 3.704 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)c1cc(F)c(Cl)cc1Cl ZINC000738168286 598589800 /nfs/dbraw/zinc/58/98/00/598589800.db2.gz YGIBMBQRPYZKJF-UHFFFAOYSA-N -1 3 370.146 3.704 20 0 FHADHM Fc1cc(-c2nnn[n-]2)cc(F)c1N[C@H](c1ccccc1)c1ccccn1 ZINC000737638570 598592624 /nfs/dbraw/zinc/59/26/24/598592624.db2.gz IJZUJFADSDKYBO-QGZVFWFLSA-N -1 3 364.359 3.741 20 0 FHADHM Fc1cc(-c2nn[n-]n2)cc(F)c1N[C@H](c1ccccc1)c1ccccn1 ZINC000737638570 598592625 /nfs/dbraw/zinc/59/26/25/598592625.db2.gz IJZUJFADSDKYBO-QGZVFWFLSA-N -1 3 364.359 3.741 20 0 FHADHM CCC[C@@H](NC(=O)CCc1ccc(-c2nnn[n-]2)cc1)C1CCCCC1 ZINC000736429865 598593460 /nfs/dbraw/zinc/59/34/60/598593460.db2.gz HGTSCGYUGRKSOL-GOSISDBHSA-N -1 3 355.486 3.665 20 0 FHADHM CCC[C@@H](NC(=O)CCc1ccc(-c2nn[n-]n2)cc1)C1CCCCC1 ZINC000736429865 598593461 /nfs/dbraw/zinc/59/34/61/598593461.db2.gz HGTSCGYUGRKSOL-GOSISDBHSA-N -1 3 355.486 3.665 20 0 FHADHM Fc1ccc(NCc2cc3ccccc3nc2Cl)cc1-c1nnn[n-]1 ZINC000737657640 598603917 /nfs/dbraw/zinc/60/39/17/598603917.db2.gz XYOGQILNVHZQDT-UHFFFAOYSA-N -1 3 354.776 3.820 20 0 FHADHM Fc1ccc(NCc2cc3ccccc3nc2Cl)cc1-c1nn[n-]n1 ZINC000737657640 598603918 /nfs/dbraw/zinc/60/39/18/598603918.db2.gz XYOGQILNVHZQDT-UHFFFAOYSA-N -1 3 354.776 3.820 20 0 FHADHM C[C@H](NC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccc(Cl)s1 ZINC000736117541 598624395 /nfs/dbraw/zinc/62/43/95/598624395.db2.gz PZYMBMWAMNHHGX-ZETCQYMHSA-N -1 3 366.809 3.603 20 0 FHADHM C[C@H](NC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccc(Cl)s1 ZINC000736117541 598624397 /nfs/dbraw/zinc/62/43/97/598624397.db2.gz PZYMBMWAMNHHGX-ZETCQYMHSA-N -1 3 366.809 3.603 20 0 FHADHM CC(C)C[C@@H](NC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1cccs1 ZINC000735787044 598625926 /nfs/dbraw/zinc/62/59/26/598625926.db2.gz HIRSAFBYNAXDEK-CQSZACIVSA-N -1 3 374.445 3.976 20 0 FHADHM CC(C)C[C@@H](NC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1cccs1 ZINC000735787044 598625927 /nfs/dbraw/zinc/62/59/27/598625927.db2.gz HIRSAFBYNAXDEK-CQSZACIVSA-N -1 3 374.445 3.976 20 0 FHADHM CC(C)c1ccc(CN(C)C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)cc1 ZINC000735922253 598630562 /nfs/dbraw/zinc/63/05/62/598630562.db2.gz DQYKBPFYXTWXSS-UHFFFAOYSA-N -1 3 368.416 3.793 20 0 FHADHM CC(C)c1ccc(CN(C)C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)cc1 ZINC000735922253 598630564 /nfs/dbraw/zinc/63/05/64/598630564.db2.gz DQYKBPFYXTWXSS-UHFFFAOYSA-N -1 3 368.416 3.793 20 0 FHADHM CCC[C@@H](NC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccccc1 ZINC000736431464 598633907 /nfs/dbraw/zinc/63/39/07/598633907.db2.gz HIHKPCQWSQNTOC-MRXNPFEDSA-N -1 3 354.389 3.669 20 0 FHADHM CCC[C@@H](NC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccccc1 ZINC000736431464 598633908 /nfs/dbraw/zinc/63/39/08/598633908.db2.gz HIHKPCQWSQNTOC-MRXNPFEDSA-N -1 3 354.389 3.669 20 0 FHADHM Cc1ccc2[nH]c3c(c2c1)CN(c1ccc(-c2nnn[n-]2)c(Cl)c1)CC3 ZINC000737372969 598639378 /nfs/dbraw/zinc/63/93/78/598639378.db2.gz OKDGMHHLXKCSSU-UHFFFAOYSA-N -1 3 364.840 3.873 20 0 FHADHM Cc1ccc2[nH]c3c(c2c1)CN(c1ccc(-c2nn[n-]n2)c(Cl)c1)CC3 ZINC000737372969 598639379 /nfs/dbraw/zinc/63/93/79/598639379.db2.gz OKDGMHHLXKCSSU-UHFFFAOYSA-N -1 3 364.840 3.873 20 0 FHADHM Fc1ccc(CSc2nc3cc(Cl)ccc3[nH]2)c(-c2nn[n-]n2)c1 ZINC000737649157 598643988 /nfs/dbraw/zinc/64/39/88/598643988.db2.gz LYSNJQUEFFUBFM-UHFFFAOYSA-N -1 3 360.805 3.828 20 0 FHADHM Fc1ccc(-c2c[nH]c(SCc3ccc(F)cc3-c3nnn[n-]3)n2)cc1 ZINC000737653447 598644842 /nfs/dbraw/zinc/64/48/42/598644842.db2.gz RRAYGLGIHJWHSQ-UHFFFAOYSA-N -1 3 370.388 3.827 20 0 FHADHM Fc1ccc(-c2c[nH]c(SCc3ccc(F)cc3-c3nn[n-]n3)n2)cc1 ZINC000737653447 598644844 /nfs/dbraw/zinc/64/48/44/598644844.db2.gz RRAYGLGIHJWHSQ-UHFFFAOYSA-N -1 3 370.388 3.827 20 0 FHADHM Cc1ccc(NC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)cc1F ZINC000737355439 598644931 /nfs/dbraw/zinc/64/49/31/598644931.db2.gz HJCUZZKNVNWEPZ-UHFFFAOYSA-N -1 3 369.400 3.502 20 0 FHADHM Cc1ccc(NC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)cc1F ZINC000737355439 598644933 /nfs/dbraw/zinc/64/49/33/598644933.db2.gz HJCUZZKNVNWEPZ-UHFFFAOYSA-N -1 3 369.400 3.502 20 0 FHADHM CC(C)(C)c1ccc(OC(=O)CSc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000735651722 598646487 /nfs/dbraw/zinc/64/64/87/598646487.db2.gz WVGZDVHEPXOQDB-UHFFFAOYSA-N -1 3 368.462 3.862 20 0 FHADHM CC(C)(C)c1ccc(OC(=O)CSc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000735651722 598646488 /nfs/dbraw/zinc/64/64/88/598646488.db2.gz WVGZDVHEPXOQDB-UHFFFAOYSA-N -1 3 368.462 3.862 20 0 FHADHM CC[C@H](Sc1ccccc1)C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736393411 598649934 /nfs/dbraw/zinc/64/99/34/598649934.db2.gz YIHZQLJYIKMBOZ-DYVFJYSZSA-N -1 3 367.478 3.615 20 0 FHADHM CC[C@H](Sc1ccccc1)C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736393411 598649935 /nfs/dbraw/zinc/64/99/35/598649935.db2.gz YIHZQLJYIKMBOZ-DYVFJYSZSA-N -1 3 367.478 3.615 20 0 FHADHM CCCCN(C(=O)CSc1ccc(-c2nnn[n-]2)cc1)C1CCCCC1 ZINC000736452413 598651898 /nfs/dbraw/zinc/65/18/98/598651898.db2.gz XBNWUDCIVFLARO-UHFFFAOYSA-N -1 3 373.526 3.920 20 0 FHADHM CCCCN(C(=O)CSc1ccc(-c2nn[n-]n2)cc1)C1CCCCC1 ZINC000736452413 598651900 /nfs/dbraw/zinc/65/19/00/598651900.db2.gz XBNWUDCIVFLARO-UHFFFAOYSA-N -1 3 373.526 3.920 20 0 FHADHM Cc1cc(OC(=O)CSc2ccc(-c3nnn[n-]3)cc2)cc(C)c1Cl ZINC000737277862 598654035 /nfs/dbraw/zinc/65/40/35/598654035.db2.gz BDLSEYBCSNWSAE-UHFFFAOYSA-N -1 3 374.853 3.835 20 0 FHADHM Cc1cc(OC(=O)CSc2ccc(-c3nn[n-]n3)cc2)cc(C)c1Cl ZINC000737277862 598654037 /nfs/dbraw/zinc/65/40/37/598654037.db2.gz BDLSEYBCSNWSAE-UHFFFAOYSA-N -1 3 374.853 3.835 20 0 FHADHM C[C@H](CNc1ccc(-c2nnn[n-]2)c(Cl)c1)COCc1ccccc1 ZINC000736026978 598655682 /nfs/dbraw/zinc/65/56/82/598655682.db2.gz UBIFTKBTSJDDJL-CYBMUJFWSA-N -1 3 357.845 3.785 20 0 FHADHM C[C@H](CNc1ccc(-c2nn[n-]n2)c(Cl)c1)COCc1ccccc1 ZINC000736026978 598655683 /nfs/dbraw/zinc/65/56/83/598655683.db2.gz UBIFTKBTSJDDJL-CYBMUJFWSA-N -1 3 357.845 3.785 20 0 FHADHM CCC[C@@H](NC(=O)CSc1ccc(-c2nnn[n-]2)cc1)C1CCCCC1 ZINC000736430490 598659782 /nfs/dbraw/zinc/65/97/82/598659782.db2.gz NVLARHXVCYIIFG-QGZVFWFLSA-N -1 3 373.526 3.824 20 0 FHADHM CCC[C@@H](NC(=O)CSc1ccc(-c2nn[n-]n2)cc1)C1CCCCC1 ZINC000736430490 598659783 /nfs/dbraw/zinc/65/97/83/598659783.db2.gz NVLARHXVCYIIFG-QGZVFWFLSA-N -1 3 373.526 3.824 20 0 FHADHM CC(C)C(C)(C)NC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000735695258 598659911 /nfs/dbraw/zinc/65/99/11/598659911.db2.gz QBGVAWUTMRQHQX-UHFFFAOYSA-N -1 3 365.437 3.823 20 0 FHADHM CC(C)C(C)(C)NC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735695258 598659913 /nfs/dbraw/zinc/65/99/13/598659913.db2.gz QBGVAWUTMRQHQX-UHFFFAOYSA-N -1 3 365.437 3.823 20 0 FHADHM Cc1ccnc(NC(=O)c2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)c1 ZINC000737435785 598666620 /nfs/dbraw/zinc/66/66/20/598666620.db2.gz CQAMRIDSMAEBJR-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM COc1ccccc1C1(CNc2ccc(-c3nnn[n-]3)c(Cl)c2)CC1 ZINC000737149709 598668580 /nfs/dbraw/zinc/66/85/80/598668580.db2.gz ZFEUOEDXVWMOHD-UHFFFAOYSA-N -1 3 355.829 3.672 20 0 FHADHM COc1ccccc1C1(CNc2ccc(-c3nn[n-]n3)c(Cl)c2)CC1 ZINC000737149709 598668582 /nfs/dbraw/zinc/66/85/82/598668582.db2.gz ZFEUOEDXVWMOHD-UHFFFAOYSA-N -1 3 355.829 3.672 20 0 FHADHM CCC[C@H](C(=O)OCc1ccc(F)cc1-c1nnn[n-]1)c1ccccc1 ZINC000736416924 598704103 /nfs/dbraw/zinc/70/41/03/598704103.db2.gz PCPSVEQSXNQPQW-INIZCTEOSA-N -1 3 354.385 3.633 20 0 FHADHM CCC[C@H](C(=O)OCc1ccc(F)cc1-c1nn[n-]n1)c1ccccc1 ZINC000736416924 598704105 /nfs/dbraw/zinc/70/41/05/598704105.db2.gz PCPSVEQSXNQPQW-INIZCTEOSA-N -1 3 354.385 3.633 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nnn[n-]1)c1occc1-c1ccccc1 ZINC000738234961 598705280 /nfs/dbraw/zinc/70/52/80/598705280.db2.gz IYFCJRRQZRPALV-UHFFFAOYSA-N -1 3 364.336 3.623 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nn[n-]n1)c1occc1-c1ccccc1 ZINC000738234961 598705281 /nfs/dbraw/zinc/70/52/81/598705281.db2.gz IYFCJRRQZRPALV-UHFFFAOYSA-N -1 3 364.336 3.623 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nnn[n-]1)c1cc2ccccc2s1 ZINC000738234897 598707447 /nfs/dbraw/zinc/70/74/47/598707447.db2.gz GTZWSIBECXPDSX-UHFFFAOYSA-N -1 3 354.366 3.578 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nn[n-]n1)c1cc2ccccc2s1 ZINC000738234897 598707449 /nfs/dbraw/zinc/70/74/49/598707449.db2.gz GTZWSIBECXPDSX-UHFFFAOYSA-N -1 3 354.366 3.578 20 0 FHADHM O=C(OC/C=C/Cl)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000738223476 598712957 /nfs/dbraw/zinc/71/29/57/598712957.db2.gz YOJXEWWQTWJHSL-XNWCZRBMSA-N -1 3 356.769 3.568 20 0 FHADHM O=C(OC/C=C/Cl)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000738223476 598712959 /nfs/dbraw/zinc/71/29/59/598712959.db2.gz YOJXEWWQTWJHSL-XNWCZRBMSA-N -1 3 356.769 3.568 20 0 FHADHM C[C@@H](CCc1ccccc1)OC(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000735993996 598713258 /nfs/dbraw/zinc/71/32/58/598713258.db2.gz XFMKSUNZJXDADT-AWEZNQCLSA-N -1 3 368.462 3.523 20 0 FHADHM C[C@@H](CCc1ccccc1)OC(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000735993996 598713260 /nfs/dbraw/zinc/71/32/60/598713260.db2.gz XFMKSUNZJXDADT-AWEZNQCLSA-N -1 3 368.462 3.523 20 0 FHADHM C[C@@H](CSc1ccccc1)C(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000736047898 598734918 /nfs/dbraw/zinc/73/49/18/598734918.db2.gz TTZYIEXOBMFODI-KBPBESRZSA-N -1 3 368.462 3.899 20 0 FHADHM C[C@@H](CSc1ccccc1)C(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000736047898 598734917 /nfs/dbraw/zinc/73/49/17/598734917.db2.gz TTZYIEXOBMFODI-KBPBESRZSA-N -1 3 368.462 3.899 20 0 FHADHM CCN(C(=O)c1ccc(F)c(C)c1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736508334 598736277 /nfs/dbraw/zinc/73/62/77/598736277.db2.gz KANJREBKPYYUDT-CYBMUJFWSA-N -1 3 353.401 3.538 20 0 FHADHM CCN(C(=O)c1ccc(F)c(C)c1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736508334 598736278 /nfs/dbraw/zinc/73/62/78/598736278.db2.gz KANJREBKPYYUDT-CYBMUJFWSA-N -1 3 353.401 3.538 20 0 FHADHM CCSc1ccc([C@@H](C)NC(=O)c2sccc2-c2nnn[n-]2)cc1 ZINC000736666707 598745945 /nfs/dbraw/zinc/74/59/45/598745945.db2.gz MROYYBOAOJXTKR-SNVBAGLBSA-N -1 3 359.480 3.531 20 0 FHADHM CCSc1ccc([C@@H](C)NC(=O)c2sccc2-c2nn[n-]n2)cc1 ZINC000736666707 598745946 /nfs/dbraw/zinc/74/59/46/598745946.db2.gz MROYYBOAOJXTKR-SNVBAGLBSA-N -1 3 359.480 3.531 20 0 FHADHM C[C@@H](Nc1cccc(F)c1-c1nn[n-]n1)c1nc2cc(Cl)ccc2[nH]1 ZINC000736138175 598747176 /nfs/dbraw/zinc/74/71/76/598747176.db2.gz OQLSJGYJAYCGSF-MRVPVSSYSA-N -1 3 357.780 3.709 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)NC1(c2ccc(Cl)cc2)CC1 ZINC000737293355 598761110 /nfs/dbraw/zinc/76/11/10/598761110.db2.gz COYMQYBXAFDPCH-UHFFFAOYSA-N -1 3 368.828 3.639 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)NC1(c2ccc(Cl)cc2)CC1 ZINC000737293355 598761111 /nfs/dbraw/zinc/76/11/11/598761111.db2.gz COYMQYBXAFDPCH-UHFFFAOYSA-N -1 3 368.828 3.639 20 0 FHADHM Cc1ccccc1[C@@H](NC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)C(C)C ZINC000737423329 598761155 /nfs/dbraw/zinc/76/11/55/598761155.db2.gz QLMLYBAAXODEEX-KRWDZBQOSA-N -1 3 368.416 3.833 20 0 FHADHM Cc1ccccc1[C@@H](NC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)C(C)C ZINC000737423329 598761156 /nfs/dbraw/zinc/76/11/56/598761156.db2.gz QLMLYBAAXODEEX-KRWDZBQOSA-N -1 3 368.416 3.833 20 0 FHADHM Cc1cc(C=Cc2ccc(-c3nnn[n-]3)cn2)ccc1Oc1cccnc1 ZINC000737262817 598761614 /nfs/dbraw/zinc/76/16/14/598761614.db2.gz PZZQPZDQFYSBFF-QPJJXVBHSA-N -1 3 356.389 3.928 20 0 FHADHM Cc1cc(C=Cc2ccc(-c3nn[n-]n3)cn2)ccc1Oc1cccnc1 ZINC000737262817 598761617 /nfs/dbraw/zinc/76/16/17/598761617.db2.gz PZZQPZDQFYSBFF-QPJJXVBHSA-N -1 3 356.389 3.928 20 0 FHADHM Cc1ccccc1[C@@H](NC(=S)Nc1ccccc1-c1nnn[n-]1)C1CC1 ZINC000737422881 598762551 /nfs/dbraw/zinc/76/25/51/598762551.db2.gz PLHDQEWHUXQGQI-KRWDZBQOSA-N -1 3 364.478 3.613 20 0 FHADHM Cc1ccccc1[C@@H](NC(=S)Nc1ccccc1-c1nn[n-]n1)C1CC1 ZINC000737422881 598762552 /nfs/dbraw/zinc/76/25/52/598762552.db2.gz PLHDQEWHUXQGQI-KRWDZBQOSA-N -1 3 364.478 3.613 20 0 FHADHM CCSc1ccc([C@H](C)NC(=O)Nc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000736665917 598769445 /nfs/dbraw/zinc/76/94/45/598769445.db2.gz JHXGSBDPLVTOOP-LBPRGKRZSA-N -1 3 368.466 3.861 20 0 FHADHM CCSc1ccc([C@H](C)NC(=O)Nc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000736665917 598769447 /nfs/dbraw/zinc/76/94/47/598769447.db2.gz JHXGSBDPLVTOOP-LBPRGKRZSA-N -1 3 368.466 3.861 20 0 FHADHM Cc1ccc(CNc2c(-c3nnn[n-]3)cnc3c(F)cc(F)cc32)c(C)c1 ZINC000737342821 598772052 /nfs/dbraw/zinc/77/20/52/598772052.db2.gz QUJJUJMHEQYOCU-UHFFFAOYSA-N -1 3 366.375 3.922 20 0 FHADHM Cc1ccc(CNc2c(-c3nn[n-]n3)cnc3c(F)cc(F)cc32)c(C)c1 ZINC000737342821 598772054 /nfs/dbraw/zinc/77/20/54/598772054.db2.gz QUJJUJMHEQYOCU-UHFFFAOYSA-N -1 3 366.375 3.922 20 0 FHADHM CCC(=CC(=O)OCc1cc(-c2nnn[n-]2)ccc1F)c1ccccc1 ZINC000736303073 598780172 /nfs/dbraw/zinc/78/01/72/598780172.db2.gz HNVLYHSAJOTCMA-QBFSEMIESA-N -1 3 352.369 3.543 20 0 FHADHM CCC(=CC(=O)OCc1cc(-c2nn[n-]n2)ccc1F)c1ccccc1 ZINC000736303073 598780173 /nfs/dbraw/zinc/78/01/73/598780173.db2.gz HNVLYHSAJOTCMA-QBFSEMIESA-N -1 3 352.369 3.543 20 0 FHADHM CCC(=CC(=O)OCc1ccc(-c2nnn[n-]2)cc1F)c1ccccc1 ZINC000736304877 598780219 /nfs/dbraw/zinc/78/02/19/598780219.db2.gz RRGBLJQIWVRBCK-QBFSEMIESA-N -1 3 352.369 3.543 20 0 FHADHM CCC(=CC(=O)OCc1ccc(-c2nn[n-]n2)cc1F)c1ccccc1 ZINC000736304877 598780220 /nfs/dbraw/zinc/78/02/20/598780220.db2.gz RRGBLJQIWVRBCK-QBFSEMIESA-N -1 3 352.369 3.543 20 0 FHADHM CC(C)CNC(=S)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000735839558 598788506 /nfs/dbraw/zinc/78/85/06/598788506.db2.gz YOEYQWVAWWFZFH-UHFFFAOYSA-N -1 3 368.466 3.601 20 0 FHADHM CC(C)CNC(=S)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735839558 598788508 /nfs/dbraw/zinc/78/85/08/598788508.db2.gz YOEYQWVAWWFZFH-UHFFFAOYSA-N -1 3 368.466 3.601 20 0 FHADHM S=C(Nc1ccccc1-c1nnn[n-]1)N[C@H](c1ccccc1)C1CCC1 ZINC000738409588 598789347 /nfs/dbraw/zinc/78/93/47/598789347.db2.gz SRHFMLSERPLUSZ-QGZVFWFLSA-N -1 3 364.478 3.695 20 0 FHADHM S=C(Nc1ccccc1-c1nn[n-]n1)N[C@H](c1ccccc1)C1CCC1 ZINC000738409588 598789348 /nfs/dbraw/zinc/78/93/48/598789348.db2.gz SRHFMLSERPLUSZ-QGZVFWFLSA-N -1 3 364.478 3.695 20 0 FHADHM Clc1ccc(N2CCC(OCc3ccccc3)CC2)c(-c2nnn[n-]2)c1 ZINC000737577778 598792442 /nfs/dbraw/zinc/79/24/42/598792442.db2.gz WJFAGVFVEYMLDQ-UHFFFAOYSA-N -1 3 369.856 3.706 20 0 FHADHM Clc1ccc(N2CCC(OCc3ccccc3)CC2)c(-c2nn[n-]n2)c1 ZINC000737577778 598792443 /nfs/dbraw/zinc/79/24/43/598792443.db2.gz WJFAGVFVEYMLDQ-UHFFFAOYSA-N -1 3 369.856 3.706 20 0 FHADHM FC(F)Oc1ccc(CNc2ccc(Cl)cc2-c2nnn[n-]2)cc1 ZINC000737638660 598792534 /nfs/dbraw/zinc/79/25/34/598792534.db2.gz JANQWNLPTGSHLG-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM FC(F)Oc1ccc(CNc2ccc(Cl)cc2-c2nn[n-]n2)cc1 ZINC000737638660 598792536 /nfs/dbraw/zinc/79/25/36/598792536.db2.gz JANQWNLPTGSHLG-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM CC(C)[C@H](c1ccccc1)N(C)C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000735735255 598801406 /nfs/dbraw/zinc/80/14/06/598801406.db2.gz NAKJQOOJLUSPQE-QGZVFWFLSA-N -1 3 368.416 3.867 20 0 FHADHM CC(C)[C@H](c1ccccc1)N(C)C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000735735255 598801407 /nfs/dbraw/zinc/80/14/07/598801407.db2.gz NAKJQOOJLUSPQE-QGZVFWFLSA-N -1 3 368.416 3.867 20 0 FHADHM CC[C@H](OC1CCCC1)C(=O)N(CC)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736380645 598802554 /nfs/dbraw/zinc/80/25/54/598802554.db2.gz XNSYTLYJNINDIM-KSSFIOAISA-N -1 3 371.485 3.514 20 0 FHADHM CC[C@H](OC1CCCC1)C(=O)N(CC)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736380645 598802555 /nfs/dbraw/zinc/80/25/55/598802555.db2.gz XNSYTLYJNINDIM-KSSFIOAISA-N -1 3 371.485 3.514 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)N(C1CC1)[C@@H]1CCCc2ccccc21 ZINC000738178078 598813407 /nfs/dbraw/zinc/81/34/07/598813407.db2.gz OJNDPZSVUWPASM-LJQANCHMSA-N -1 3 374.448 3.941 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)N(C1CC1)[C@@H]1CCCc2ccccc21 ZINC000738178078 598813408 /nfs/dbraw/zinc/81/34/08/598813408.db2.gz OJNDPZSVUWPASM-LJQANCHMSA-N -1 3 374.448 3.941 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1coc2ccccc12 ZINC000735873210 598821419 /nfs/dbraw/zinc/82/14/19/598821419.db2.gz CHDRPJYEAPLISL-UHFFFAOYSA-N -1 3 361.405 3.664 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1coc2ccccc12 ZINC000735873210 598821421 /nfs/dbraw/zinc/82/14/21/598821421.db2.gz CHDRPJYEAPLISL-UHFFFAOYSA-N -1 3 361.405 3.664 20 0 FHADHM CC(C)[C@@H](c1ccccc1Cl)N(C)C(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000735733499 598822485 /nfs/dbraw/zinc/82/24/85/598822485.db2.gz BAWAZFPGMYVKPD-KRWDZBQOSA-N -1 3 369.856 3.989 20 0 FHADHM CC(C)[C@@H](c1ccccc1Cl)N(C)C(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC000735733499 598822486 /nfs/dbraw/zinc/82/24/86/598822486.db2.gz BAWAZFPGMYVKPD-KRWDZBQOSA-N -1 3 369.856 3.989 20 0 FHADHM CC(C)Oc1c(Cl)cccc1NC(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000735904876 599300746 /nfs/dbraw/zinc/30/07/46/599300746.db2.gz VEMOCELZGNDALM-UHFFFAOYSA-N -1 3 357.801 3.560 20 0 FHADHM CC(C)Oc1c(Cl)cccc1NC(=O)c1cccc(-c2nn[n-]n2)c1 ZINC000735904876 599300749 /nfs/dbraw/zinc/30/07/49/599300749.db2.gz VEMOCELZGNDALM-UHFFFAOYSA-N -1 3 357.801 3.560 20 0 FHADHM Cc1c2cc(Cl)ccc2oc1C(=O)N(C)c1ccc(-c2nnn[n-]2)cc1 ZINC000737202417 599308465 /nfs/dbraw/zinc/30/84/65/599308465.db2.gz MIIXXCGCXOGWHB-UHFFFAOYSA-N -1 3 367.796 3.851 20 0 FHADHM Cc1c2cc(Cl)ccc2oc1C(=O)N(C)c1ccc(-c2nn[n-]n2)cc1 ZINC000737202417 599308468 /nfs/dbraw/zinc/30/84/68/599308468.db2.gz MIIXXCGCXOGWHB-UHFFFAOYSA-N -1 3 367.796 3.851 20 0 FHADHM CCN(C(=O)CCSc1ccccc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000736505325 599309375 /nfs/dbraw/zinc/30/93/75/599309375.db2.gz LUEBVKJJUMBSDI-UHFFFAOYSA-N -1 3 371.441 3.541 20 0 FHADHM CCN(C(=O)CCSc1ccccc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000736505325 599309377 /nfs/dbraw/zinc/30/93/77/599309377.db2.gz LUEBVKJJUMBSDI-UHFFFAOYSA-N -1 3 371.441 3.541 20 0 FHADHM CCN(C(=O)c1cc(Cl)sc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000736506424 599312195 /nfs/dbraw/zinc/31/21/95/599312195.db2.gz XZNDSARHMAFJAI-UHFFFAOYSA-N -1 3 368.249 3.902 20 0 FHADHM CCN(C(=O)c1cc(Cl)sc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000736506424 599312198 /nfs/dbraw/zinc/31/21/98/599312198.db2.gz XZNDSARHMAFJAI-UHFFFAOYSA-N -1 3 368.249 3.902 20 0 FHADHM c1cc(NCCOc2cccc(-c3nnn[n-]3)c2)cc(OC2CCCC2)c1 ZINC000738412715 599326762 /nfs/dbraw/zinc/32/67/62/599326762.db2.gz GIQLJVPVSMQESP-UHFFFAOYSA-N -1 3 365.437 3.679 20 0 FHADHM c1cc(NCCOc2cccc(-c3nn[n-]n3)c2)cc(OC2CCCC2)c1 ZINC000738412715 599326765 /nfs/dbraw/zinc/32/67/65/599326765.db2.gz GIQLJVPVSMQESP-UHFFFAOYSA-N -1 3 365.437 3.679 20 0 FHADHM C[C@@H](S[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)C(=O)NCC1CCCCC1 ZINC000736190354 599328371 /nfs/dbraw/zinc/32/83/71/599328371.db2.gz RKASBGPRBUJSEB-UONOGXRCSA-N -1 3 373.526 3.746 20 0 FHADHM C[C@@H](S[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)C(=O)NCC1CCCCC1 ZINC000736190354 599328373 /nfs/dbraw/zinc/32/83/73/599328373.db2.gz RKASBGPRBUJSEB-UONOGXRCSA-N -1 3 373.526 3.746 20 0 FHADHM c1csc(-c2noc(CCCSc3ccccc3-c3nnn[n-]3)n2)c1 ZINC000823816003 599343781 /nfs/dbraw/zinc/34/37/81/599343781.db2.gz NJQDBHSDNROSFA-UHFFFAOYSA-N -1 3 370.463 3.703 20 0 FHADHM c1csc(-c2noc(CCCSc3ccccc3-c3nn[n-]n3)n2)c1 ZINC000823816003 599343786 /nfs/dbraw/zinc/34/37/86/599343786.db2.gz NJQDBHSDNROSFA-UHFFFAOYSA-N -1 3 370.463 3.703 20 0 FHADHM Cc1cc(C)c(NC(=O)[C@H](C)Sc2ccccc2-c2nnn[n-]2)c(C)c1 ZINC000822194455 599345285 /nfs/dbraw/zinc/34/52/85/599345285.db2.gz XZFGMJNKOHGWCK-AWEZNQCLSA-N -1 3 367.478 3.911 20 0 FHADHM Cc1cc(C)c(NC(=O)[C@H](C)Sc2ccccc2-c2nn[n-]n2)c(C)c1 ZINC000822194455 599345287 /nfs/dbraw/zinc/34/52/87/599345287.db2.gz XZFGMJNKOHGWCK-AWEZNQCLSA-N -1 3 367.478 3.911 20 0 FHADHM C[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000736240635 599348280 /nfs/dbraw/zinc/34/82/80/599348280.db2.gz VPVQLIGKUDHPDT-VNHYZAJKSA-N -1 3 371.489 3.608 20 0 FHADHM C[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000736240635 599348283 /nfs/dbraw/zinc/34/82/83/599348283.db2.gz VPVQLIGKUDHPDT-VNHYZAJKSA-N -1 3 371.489 3.608 20 0 FHADHM C[C@@H](Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccc(-n2cccn2)cc1 ZINC000820456153 599357113 /nfs/dbraw/zinc/35/71/13/599357113.db2.gz QQIWFWXLSAPVRQ-GFCCVEGCSA-N -1 3 365.828 3.879 20 0 FHADHM C[C@@H](Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccc(-n2cccn2)cc1 ZINC000820456153 599357115 /nfs/dbraw/zinc/35/71/15/599357115.db2.gz QQIWFWXLSAPVRQ-GFCCVEGCSA-N -1 3 365.828 3.879 20 0 FHADHM CSC(C)(C)CNc1cc(C)c(-c2nnn[n-]2)c2nc3ccccc3n21 ZINC000821950135 599357764 /nfs/dbraw/zinc/35/77/64/599357764.db2.gz LBENNNFLLQVHQV-UHFFFAOYSA-N -1 3 367.482 3.530 20 0 FHADHM CSC(C)(C)CNc1cc(C)c(-c2nn[n-]n2)c2nc3ccccc3n21 ZINC000821950135 599357767 /nfs/dbraw/zinc/35/77/67/599357767.db2.gz LBENNNFLLQVHQV-UHFFFAOYSA-N -1 3 367.482 3.530 20 0 FHADHM CC(C)C(=O)Nc1ccc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000820011426 599362005 /nfs/dbraw/zinc/36/20/05/599362005.db2.gz MKEVKSVOFNFRKW-ZDUSSCGKSA-N -1 3 350.426 3.634 20 0 FHADHM CC(C)C(=O)Nc1ccc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000820011426 599362007 /nfs/dbraw/zinc/36/20/07/599362007.db2.gz MKEVKSVOFNFRKW-ZDUSSCGKSA-N -1 3 350.426 3.634 20 0 FHADHM CC(C)C(=O)Nc1cccc(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000820010774 599363795 /nfs/dbraw/zinc/36/37/95/599363795.db2.gz DUBZEIJYSMAIDP-CYBMUJFWSA-N -1 3 350.426 3.634 20 0 FHADHM CC(C)C(=O)Nc1cccc(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000820010774 599363798 /nfs/dbraw/zinc/36/37/98/599363798.db2.gz DUBZEIJYSMAIDP-CYBMUJFWSA-N -1 3 350.426 3.634 20 0 FHADHM C[C@@H](Nc1ccc(OC[C@H]2CCCO2)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820455161 599369129 /nfs/dbraw/zinc/36/91/29/599369129.db2.gz FRLHXUSEWMJICC-AUUYWEPGSA-N -1 3 365.437 3.598 20 0 FHADHM C[C@@H](Nc1ccc(OC[C@H]2CCCO2)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820455161 599369132 /nfs/dbraw/zinc/36/91/32/599369132.db2.gz FRLHXUSEWMJICC-AUUYWEPGSA-N -1 3 365.437 3.598 20 0 FHADHM c1ccc2c(c1)cccc2OCc1nnc(-c2ccc(-c3nnn[n-]3)cc2)o1 ZINC000823798300 599383177 /nfs/dbraw/zinc/38/31/77/599383177.db2.gz WHCDWJKJAAGDEZ-UHFFFAOYSA-N -1 3 370.372 3.649 20 0 FHADHM c1ccc2c(c1)cccc2OCc1nnc(-c2ccc(-c3nn[n-]n3)cc2)o1 ZINC000823798300 599383181 /nfs/dbraw/zinc/38/31/81/599383181.db2.gz WHCDWJKJAAGDEZ-UHFFFAOYSA-N -1 3 370.372 3.649 20 0 FHADHM Fc1ccc(Oc2ccc(CNCc3ccc(-c4nnn[n-]4)o3)cc2)cc1 ZINC000822783168 599398234 /nfs/dbraw/zinc/39/82/34/599398234.db2.gz YBCBTFHKONOGAP-UHFFFAOYSA-N -1 3 365.368 3.681 20 0 FHADHM C[C@H](OCCCNc1cc(-c2nnn[n-]2)c2ccccc2n1)c1ccccc1 ZINC000736163272 599398655 /nfs/dbraw/zinc/39/86/55/599398655.db2.gz HPKCARICWMROJX-HNNXBMFYSA-N -1 3 374.448 3.995 20 0 FHADHM C[C@H](OCCCNc1cc(-c2nn[n-]n2)c2ccccc2n1)c1ccccc1 ZINC000736163272 599398659 /nfs/dbraw/zinc/39/86/59/599398659.db2.gz HPKCARICWMROJX-HNNXBMFYSA-N -1 3 374.448 3.995 20 0 FHADHM Cc1nc(-c2ccc([C@H](C)NCc3ccc(-c4nnn[n-]4)o3)cc2)cs1 ZINC000822419776 599399674 /nfs/dbraw/zinc/39/96/74/599399674.db2.gz VEKDRHATANYRGM-NSHDSACASA-N -1 3 366.450 3.742 20 0 FHADHM CN(CCCCNc1cc(-c2nnn[n-]2)c2ccccc2n1)c1ccccc1 ZINC000736791192 599417032 /nfs/dbraw/zinc/41/70/32/599417032.db2.gz ABTDKGCLZXSMCH-UHFFFAOYSA-N -1 3 373.464 3.743 20 0 FHADHM CN(CCCCNc1cc(-c2nn[n-]n2)c2ccccc2n1)c1ccccc1 ZINC000736791192 599417036 /nfs/dbraw/zinc/41/70/36/599417036.db2.gz ABTDKGCLZXSMCH-UHFFFAOYSA-N -1 3 373.464 3.743 20 0 FHADHM CCCC[C@@H]1CCC[C@H]1NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821043626 599434319 /nfs/dbraw/zinc/43/43/19/599434319.db2.gz QVYXKRYKJHGPHF-CKEIUWERSA-N -1 3 356.474 3.586 20 0 FHADHM CCCC[C@@H]1CCC[C@H]1NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821043626 599434321 /nfs/dbraw/zinc/43/43/21/599434321.db2.gz QVYXKRYKJHGPHF-CKEIUWERSA-N -1 3 356.474 3.586 20 0 FHADHM Fc1ccccc1[C@@H](Cc1ccccc1)NCc1ccc(-c2nnn[n-]2)o1 ZINC000822792516 599446657 /nfs/dbraw/zinc/44/66/57/599446657.db2.gz ZILVFUSDSLGDDQ-GOSISDBHSA-N -1 3 363.396 3.672 20 0 FHADHM Fc1ccccc1[C@@H](Cc1ccccc1)NCc1ccc(-c2nn[n-]n2)o1 ZINC000822792516 599446660 /nfs/dbraw/zinc/44/66/60/599446660.db2.gz ZILVFUSDSLGDDQ-GOSISDBHSA-N -1 3 363.396 3.672 20 0 FHADHM CCCCc1noc([C@H](C)SCc2cc(-c3nnn[n-]3)ccc2F)n1 ZINC000736467129 599451370 /nfs/dbraw/zinc/45/13/70/599451370.db2.gz VMELQDBXGWHEQQ-JTQLQIEISA-N -1 3 362.434 3.726 20 0 FHADHM CCCCc1noc([C@H](C)SCc2cc(-c3nn[n-]n3)ccc2F)n1 ZINC000736467129 599451372 /nfs/dbraw/zinc/45/13/72/599451372.db2.gz VMELQDBXGWHEQQ-JTQLQIEISA-N -1 3 362.434 3.726 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CNCc1c(Cl)cccc1Cl ZINC000822762079 599457857 /nfs/dbraw/zinc/45/78/57/599457857.db2.gz YMRVOOSXRXYRJD-UHFFFAOYSA-N -1 3 352.200 3.602 20 0 FHADHM C[C@H](NC(=O)C(C)(C)c1cccc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736094917 599465234 /nfs/dbraw/zinc/46/52/34/599465234.db2.gz AXQCWNCERSTLAB-LBPRGKRZSA-N -1 3 369.856 3.675 20 0 FHADHM C[C@H](NC(=O)C(C)(C)c1cccc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736094917 599465236 /nfs/dbraw/zinc/46/52/36/599465236.db2.gz AXQCWNCERSTLAB-LBPRGKRZSA-N -1 3 369.856 3.675 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1NCc1ccnc(OC2CCCC2)c1 ZINC000822586036 599472537 /nfs/dbraw/zinc/47/25/37/599472537.db2.gz QWRPNPFZBSYJND-UHFFFAOYSA-N -1 3 370.844 3.849 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1NCc1ccnc(OC2CCCC2)c1 ZINC000822586036 599472542 /nfs/dbraw/zinc/47/25/42/599472542.db2.gz QWRPNPFZBSYJND-UHFFFAOYSA-N -1 3 370.844 3.849 20 0 FHADHM CCO[C@H](C)c1nc(CN(C)[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cs1 ZINC000736616631 599475330 /nfs/dbraw/zinc/47/53/30/599475330.db2.gz OPKNQQNUHFTWGV-CHWSQXEVSA-N -1 3 372.498 3.614 20 0 FHADHM CCO[C@H](C)c1nc(CN(C)[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cs1 ZINC000736616631 599475332 /nfs/dbraw/zinc/47/53/32/599475332.db2.gz OPKNQQNUHFTWGV-CHWSQXEVSA-N -1 3 372.498 3.614 20 0 FHADHM Cc1ccccc1[C@H](C)N(C)C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000822345455 599480081 /nfs/dbraw/zinc/48/00/81/599480081.db2.gz JQEMGKMUXAHNEC-CABCVRRESA-N -1 3 364.453 3.639 20 0 FHADHM Cc1ccccc1[C@H](C)N(C)C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000822345455 599480083 /nfs/dbraw/zinc/48/00/83/599480083.db2.gz JQEMGKMUXAHNEC-CABCVRRESA-N -1 3 364.453 3.639 20 0 FHADHM C[C@H](Cc1ccc(Cl)cc1)N(C)C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000736055781 599492663 /nfs/dbraw/zinc/49/26/63/599492663.db2.gz IZZWMYFOTZOEIE-GFCCVEGCSA-N -1 3 370.844 3.615 20 0 FHADHM C[C@H](Cc1ccc(Cl)cc1)N(C)C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000736055781 599492666 /nfs/dbraw/zinc/49/26/66/599492666.db2.gz IZZWMYFOTZOEIE-GFCCVEGCSA-N -1 3 370.844 3.615 20 0 FHADHM Fc1ccc(NC[C@@H]2CCCO[C@H]2c2ccccc2)c(-c2nnn[n-]2)c1 ZINC000822778954 599497353 /nfs/dbraw/zinc/49/73/53/599497353.db2.gz PKFHNKLLPGQLGQ-KSSFIOAISA-N -1 3 353.401 3.586 20 0 FHADHM Fc1ccc(NC[C@@H]2CCCO[C@H]2c2ccccc2)c(-c2nn[n-]n2)c1 ZINC000822778954 599497356 /nfs/dbraw/zinc/49/73/56/599497356.db2.gz PKFHNKLLPGQLGQ-KSSFIOAISA-N -1 3 353.401 3.586 20 0 FHADHM CC(C)(C(=O)OCc1ccc(F)cc1-c1nnn[n-]1)c1cccc(Cl)c1 ZINC000735582108 599498479 /nfs/dbraw/zinc/49/84/79/599498479.db2.gz FVDWIXXRCZAIHI-UHFFFAOYSA-N -1 3 374.803 3.680 20 0 FHADHM CC(C)(C(=O)OCc1ccc(F)cc1-c1nn[n-]n1)c1cccc(Cl)c1 ZINC000735582108 599498480 /nfs/dbraw/zinc/49/84/80/599498480.db2.gz FVDWIXXRCZAIHI-UHFFFAOYSA-N -1 3 374.803 3.680 20 0 FHADHM Cc1cccc(C(C)(C)NC(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c1 ZINC000737385583 599499208 /nfs/dbraw/zinc/49/92/08/599499208.db2.gz UHGXEMJRNDNXLI-UHFFFAOYSA-N -1 3 370.844 3.885 20 0 FHADHM Cc1cccc(C(C)(C)NC(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c1 ZINC000737385583 599499211 /nfs/dbraw/zinc/49/92/11/599499211.db2.gz UHGXEMJRNDNXLI-UHFFFAOYSA-N -1 3 370.844 3.885 20 0 FHADHM C[C@@H](Nc1ccc(F)cc1-c1nnn[n-]1)c1ccc(Br)cc1 ZINC000820455387 599501047 /nfs/dbraw/zinc/50/10/47/599501047.db2.gz IBSXWRNFLYADLF-SECBINFHSA-N -1 3 362.206 3.941 20 0 FHADHM C[C@@H](Nc1ccc(F)cc1-c1nn[n-]n1)c1ccc(Br)cc1 ZINC000820455387 599501049 /nfs/dbraw/zinc/50/10/49/599501049.db2.gz IBSXWRNFLYADLF-SECBINFHSA-N -1 3 362.206 3.941 20 0 FHADHM CCCc1sc(C(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1CC ZINC000821143883 599502213 /nfs/dbraw/zinc/50/22/13/599502213.db2.gz ZNIMBOWTZTVYKO-GFCCVEGCSA-N -1 3 369.494 3.934 20 0 FHADHM CCCc1sc(C(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1CC ZINC000821143883 599502217 /nfs/dbraw/zinc/50/22/17/599502217.db2.gz ZNIMBOWTZTVYKO-GFCCVEGCSA-N -1 3 369.494 3.934 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N[C@@H](C)c1ccc(F)cc1Cl ZINC000737292638 599502647 /nfs/dbraw/zinc/50/26/47/599502647.db2.gz WTUIBKNLJVCIOE-JTQLQIEISA-N -1 3 374.807 3.850 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N[C@@H](C)c1ccc(F)cc1Cl ZINC000737292638 599502650 /nfs/dbraw/zinc/50/26/50/599502650.db2.gz WTUIBKNLJVCIOE-JTQLQIEISA-N -1 3 374.807 3.850 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)N1CCCCC[C@@H]1c1ccco1 ZINC000738161571 599502904 /nfs/dbraw/zinc/50/29/04/599502904.db2.gz FTUXEMKEQXIIKT-OAHLLOKOSA-N -1 3 370.388 3.748 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)N1CCCCC[C@@H]1c1ccco1 ZINC000738161571 599502907 /nfs/dbraw/zinc/50/29/07/599502907.db2.gz FTUXEMKEQXIIKT-OAHLLOKOSA-N -1 3 370.388 3.748 20 0 FHADHM Cc1cc(F)cc2c1ncc(-c1nnn[n-]1)c2N1CC[C@H](c2ccccc2)C1 ZINC000822204427 599503980 /nfs/dbraw/zinc/50/39/80/599503980.db2.gz OOSFPXKQOSVRRH-HNNXBMFYSA-N -1 3 374.423 3.856 20 0 FHADHM Cc1cc(F)cc2c1ncc(-c1nn[n-]n1)c2N1CC[C@H](c2ccccc2)C1 ZINC000822204427 599503982 /nfs/dbraw/zinc/50/39/82/599503982.db2.gz OOSFPXKQOSVRRH-HNNXBMFYSA-N -1 3 374.423 3.856 20 0 FHADHM Cc1csc([C@@H]2CCCN(c3cc(Cl)ccc3-c3nnn[n-]3)C2)n1 ZINC000822409322 599508980 /nfs/dbraw/zinc/50/89/80/599508980.db2.gz PWFAXWUBXSIIMF-LLVKDONJSA-N -1 3 360.874 3.669 20 0 FHADHM Cc1csc([C@@H]2CCCN(c3cc(Cl)ccc3-c3nn[n-]n3)C2)n1 ZINC000822409322 599508983 /nfs/dbraw/zinc/50/89/83/599508983.db2.gz PWFAXWUBXSIIMF-LLVKDONJSA-N -1 3 360.874 3.669 20 0 FHADHM C[C@@H](C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1cccc(Cl)c1 ZINC000820315225 599510663 /nfs/dbraw/zinc/51/06/63/599510663.db2.gz MHORDSRGJXUZGE-NEPJUHHUSA-N -1 3 355.829 3.501 20 0 FHADHM C[C@@H](C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1cccc(Cl)c1 ZINC000820315225 599510664 /nfs/dbraw/zinc/51/06/64/599510664.db2.gz MHORDSRGJXUZGE-NEPJUHHUSA-N -1 3 355.829 3.501 20 0 FHADHM CCCc1cc(C(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)sc1C ZINC000821138544 599517801 /nfs/dbraw/zinc/51/78/01/599517801.db2.gz AZTYVFKVCALQDG-LLVKDONJSA-N -1 3 355.467 3.680 20 0 FHADHM CCCc1cc(C(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)sc1C ZINC000821138544 599517802 /nfs/dbraw/zinc/51/78/02/599517802.db2.gz AZTYVFKVCALQDG-LLVKDONJSA-N -1 3 355.467 3.680 20 0 FHADHM C[C@H](CNc1ccc(-c2nn[n-]n2)cc1C(F)(F)F)Oc1ccccc1 ZINC000736025493 599525770 /nfs/dbraw/zinc/52/57/70/599525770.db2.gz HULPBHOPTURBJS-LLVKDONJSA-N -1 3 363.343 3.765 20 0 FHADHM CC(C)c1ccc(CCC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000820192401 599527517 /nfs/dbraw/zinc/52/75/17/599527517.db2.gz MKMPIHTVQRQGRM-HNNXBMFYSA-N -1 3 363.465 3.800 20 0 FHADHM CC(C)c1ccc(CCC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000820192401 599527519 /nfs/dbraw/zinc/52/75/19/599527519.db2.gz MKMPIHTVQRQGRM-HNNXBMFYSA-N -1 3 363.465 3.800 20 0 FHADHM C[C@@H](NC(=O)c1cc2ccc(F)cc2s1)c1cccc(-c2nnn[n-]2)c1 ZINC000820391459 599529056 /nfs/dbraw/zinc/52/90/56/599529056.db2.gz QDJJTPBLNZXRIP-SNVBAGLBSA-N -1 3 367.409 3.712 20 0 FHADHM C[C@@H](NC(=O)c1cc2ccc(F)cc2s1)c1cccc(-c2nn[n-]n2)c1 ZINC000820391459 599529059 /nfs/dbraw/zinc/52/90/59/599529059.db2.gz QDJJTPBLNZXRIP-SNVBAGLBSA-N -1 3 367.409 3.712 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CC[C@H](C)C2)c1ccsc1 ZINC000736282014 599539145 /nfs/dbraw/zinc/53/91/45/599539145.db2.gz ZQWVBORVHLLDCG-UWVGGRQHSA-N -1 3 373.507 3.857 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CC[C@H](C)C2)c1ccsc1 ZINC000736282014 599539149 /nfs/dbraw/zinc/53/91/49/599539149.db2.gz ZQWVBORVHLLDCG-UWVGGRQHSA-N -1 3 373.507 3.857 20 0 FHADHM CC(C)c1ccc([C@H](C)CC(=O)NCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000735925177 599541548 /nfs/dbraw/zinc/54/15/48/599541548.db2.gz YQFBQNMNWYHJDW-OAHLLOKOSA-N -1 3 363.465 3.800 20 0 FHADHM CC(C)c1ccc([C@H](C)CC(=O)NCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000735925177 599541551 /nfs/dbraw/zinc/54/15/51/599541551.db2.gz YQFBQNMNWYHJDW-OAHLLOKOSA-N -1 3 363.465 3.800 20 0 FHADHM CCN(C(=O)[C@@H](C)c1cccs1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736502385 599542472 /nfs/dbraw/zinc/54/24/72/599542472.db2.gz MDOUUTSQNZRAIE-STQMWFEESA-N -1 3 355.467 3.641 20 0 FHADHM CCN(C(=O)[C@@H](C)c1cccs1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736502385 599542473 /nfs/dbraw/zinc/54/24/73/599542473.db2.gz MDOUUTSQNZRAIE-STQMWFEESA-N -1 3 355.467 3.641 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)CC/C=C\c1ccccc1 ZINC000736638265 599544313 /nfs/dbraw/zinc/54/43/13/599544313.db2.gz ZHEDYFXDRPIHGM-POHAHGRESA-N -1 3 363.421 3.698 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)CC/C=C\c1ccccc1 ZINC000736638265 599544315 /nfs/dbraw/zinc/54/43/15/599544315.db2.gz ZHEDYFXDRPIHGM-POHAHGRESA-N -1 3 363.421 3.698 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)OCc1csc(C2CCCC2)n1 ZINC000826252938 607385035 /nfs/dbraw/zinc/38/50/35/607385035.db2.gz YZQVJYQWGIHUGK-UHFFFAOYSA-N -1 3 369.450 3.646 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)OCc1csc(C2CCCC2)n1 ZINC000826252938 607385037 /nfs/dbraw/zinc/38/50/37/607385037.db2.gz YZQVJYQWGIHUGK-UHFFFAOYSA-N -1 3 369.450 3.646 20 0 FHADHM Cc1cc(F)cc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCCC3)c1 ZINC000822203376 599628673 /nfs/dbraw/zinc/62/86/73/599628673.db2.gz QKPXURPZQAEHDV-UHFFFAOYSA-N -1 3 371.441 3.897 20 0 FHADHM Cc1cc(F)cc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCCC3)c1 ZINC000822203376 599628674 /nfs/dbraw/zinc/62/86/74/599628674.db2.gz QKPXURPZQAEHDV-UHFFFAOYSA-N -1 3 371.441 3.897 20 0 FHADHM CCc1ccc(-c2ccc(C(=O)Nc3ccccc3-c3nnn[n-]3)o2)cc1 ZINC000821476248 599628841 /nfs/dbraw/zinc/62/88/41/599628841.db2.gz JXXJEZMZWIYENB-UHFFFAOYSA-N -1 3 359.389 3.941 20 0 FHADHM CCc1ccc(-c2ccc(C(=O)Nc3ccccc3-c3nn[n-]n3)o2)cc1 ZINC000821476248 599628842 /nfs/dbraw/zinc/62/88/42/599628842.db2.gz JXXJEZMZWIYENB-UHFFFAOYSA-N -1 3 359.389 3.941 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cccc(F)c2Cl)c1-c1nnn[n-]1 ZINC000821465179 599631051 /nfs/dbraw/zinc/63/10/51/599631051.db2.gz CYXNDWBOTGKOLL-UHFFFAOYSA-N -1 3 365.821 3.844 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cccc(F)c2Cl)c1-c1nn[n-]n1 ZINC000821465179 599631052 /nfs/dbraw/zinc/63/10/52/599631052.db2.gz CYXNDWBOTGKOLL-UHFFFAOYSA-N -1 3 365.821 3.844 20 0 FHADHM C[C@H](C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)c1cccs1 ZINC000819865791 599631721 /nfs/dbraw/zinc/63/17/21/599631721.db2.gz HWZCFCVKVJSEFH-QMMMGPOBSA-N -1 3 367.356 3.689 20 0 FHADHM C[C@H](C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)c1cccs1 ZINC000819865791 599631722 /nfs/dbraw/zinc/63/17/22/599631722.db2.gz HWZCFCVKVJSEFH-QMMMGPOBSA-N -1 3 367.356 3.689 20 0 FHADHM CC[C@H](NCc1ccc(-c2nn[n-]n2)cc1)c1nc(C(F)(F)F)cs1 ZINC000820925579 599647281 /nfs/dbraw/zinc/64/72/81/599647281.db2.gz JTMQDKGFCJLIPP-NSHDSACASA-N -1 3 368.388 3.583 20 0 FHADHM CC[C@@H](C)C[C@@H](C)NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C(C)C ZINC000820869575 599678552 /nfs/dbraw/zinc/67/85/52/599678552.db2.gz HYTYOIIFOFKWCR-HUUCEWRRSA-N -1 3 358.490 3.611 20 0 FHADHM CC[C@@H](C)C[C@@H](C)NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C(C)C ZINC000820869575 599678553 /nfs/dbraw/zinc/67/85/53/599678553.db2.gz HYTYOIIFOFKWCR-HUUCEWRRSA-N -1 3 358.490 3.611 20 0 FHADHM CC(C)C[C@H]1CCCCCN1C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820062522 599680535 /nfs/dbraw/zinc/68/05/35/599680535.db2.gz NMECKGATCYSMOQ-MAUKXSAKSA-N -1 3 370.501 3.928 20 0 FHADHM CC(C)C[C@H]1CCCCCN1C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820062522 599680536 /nfs/dbraw/zinc/68/05/36/599680536.db2.gz NMECKGATCYSMOQ-MAUKXSAKSA-N -1 3 370.501 3.928 20 0 FHADHM Cc1ccc(-c2nc(CNc3c(F)cc(-c4nnn[n-]4)cc3F)co2)cc1 ZINC000822214251 599688683 /nfs/dbraw/zinc/68/86/83/599688683.db2.gz WJKAMTGATIGDKO-UHFFFAOYSA-N -1 3 368.347 3.720 20 0 FHADHM Cc1ccc(-c2nc(CNc3c(F)cc(-c4nn[n-]n4)cc3F)co2)cc1 ZINC000822214251 599688684 /nfs/dbraw/zinc/68/86/84/599688684.db2.gz WJKAMTGATIGDKO-UHFFFAOYSA-N -1 3 368.347 3.720 20 0 FHADHM O=C([O-])c1ccccc1NC(=O)CN[C@@H](c1ccc(F)cc1)C1CCC1 ZINC000739307271 599793044 /nfs/dbraw/zinc/79/30/44/599793044.db2.gz LJGNAXADFWVZNO-LJQANCHMSA-N -1 3 356.397 3.593 20 0 FHADHM Cc1cccc([C@H](C)C(=O)Nc2ccc(OC(C)C)c(-c3nnn[n-]3)c2)c1 ZINC000822289112 607397575 /nfs/dbraw/zinc/39/75/75/607397575.db2.gz RQXUEASUDAFFRE-AWEZNQCLSA-N -1 3 365.437 3.705 20 0 FHADHM Cc1cccc([C@H](C)C(=O)Nc2ccc(OC(C)C)c(-c3nn[n-]n3)c2)c1 ZINC000822289112 607397576 /nfs/dbraw/zinc/39/75/76/607397576.db2.gz RQXUEASUDAFFRE-AWEZNQCLSA-N -1 3 365.437 3.705 20 0 FHADHM COc1ccc([C@H](NCc2ccccc2Oc2cccnc2)C(=O)[O-])cc1 ZINC000737973168 599864333 /nfs/dbraw/zinc/86/43/33/599864333.db2.gz YHZCGHLBNFJRDG-FQEVSTJZSA-N -1 3 364.401 3.798 20 0 FHADHM C[C@H](C(=O)[O-])N1CCN([C@@H](c2ccccc2)c2ccccc2Cl)CC1 ZINC000237465729 599951814 /nfs/dbraw/zinc/95/18/14/599951814.db2.gz QRKFLISBANSTPF-BEFAXECRSA-N -1 3 358.869 3.520 20 0 FHADHM C[C@H](c1ccc(C(=O)[O-])o1)N1CCC(CN(C)C(=O)OC(C)(C)C)CC1 ZINC000736715363 600104593 /nfs/dbraw/zinc/10/45/93/600104593.db2.gz RGNQFEGLBBLOBB-CYBMUJFWSA-N -1 3 366.458 3.618 20 0 FHADHM CC[C@H](C)CN(CC)C(=O)Nc1ccc(OC(C)C)c(-c2nnn[n-]2)c1 ZINC000820870027 607426750 /nfs/dbraw/zinc/42/67/50/607426750.db2.gz LHGNOVZQVPHVPV-ZDUSSCGKSA-N -1 3 360.462 3.554 20 0 FHADHM CC[C@H](C)CN(CC)C(=O)Nc1ccc(OC(C)C)c(-c2nn[n-]n2)c1 ZINC000820870027 607426751 /nfs/dbraw/zinc/42/67/51/607426751.db2.gz LHGNOVZQVPHVPV-ZDUSSCGKSA-N -1 3 360.462 3.554 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@H]2C[C@H]2c2sccc2C)s1 ZINC000825694650 607430160 /nfs/dbraw/zinc/43/01/60/607430160.db2.gz YHGYWRWLWRFFIH-MNOVXSKESA-N -1 3 359.480 3.603 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@H]2C[C@H]2c2sccc2C)s1 ZINC000825694650 607430162 /nfs/dbraw/zinc/43/01/62/607430162.db2.gz YHGYWRWLWRFFIH-MNOVXSKESA-N -1 3 359.480 3.603 20 0 FHADHM CN(C(=O)C1CCC(c2ccccc2)CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825812532 607433365 /nfs/dbraw/zinc/43/33/65/607433365.db2.gz MCZJXEYSQHGRFR-UHFFFAOYSA-N -1 3 361.449 3.804 20 0 FHADHM CN(C(=O)C1CCC(c2ccccc2)CC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825812532 607433367 /nfs/dbraw/zinc/43/33/67/607433367.db2.gz MCZJXEYSQHGRFR-UHFFFAOYSA-N -1 3 361.449 3.804 20 0 FHADHM CN(C(=O)c1ccc2c(c1)-c1ccccc1C2)c1ccc(-c2nnn[n-]2)cc1 ZINC000825829423 607437656 /nfs/dbraw/zinc/43/76/56/607437656.db2.gz FECLKEJTSQDQRQ-UHFFFAOYSA-N -1 3 367.412 3.715 20 0 FHADHM CN(C(=O)c1ccc2c(c1)-c1ccccc1C2)c1ccc(-c2nn[n-]n2)cc1 ZINC000825829423 607437658 /nfs/dbraw/zinc/43/76/58/607437658.db2.gz FECLKEJTSQDQRQ-UHFFFAOYSA-N -1 3 367.412 3.715 20 0 FHADHM CN(C(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825812428 607439596 /nfs/dbraw/zinc/43/95/96/607439596.db2.gz KRKMGJRHNIQRDC-UXHICEINSA-N -1 3 369.428 3.786 20 0 FHADHM CN(C(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825812428 607439597 /nfs/dbraw/zinc/43/95/97/607439597.db2.gz KRKMGJRHNIQRDC-UXHICEINSA-N -1 3 369.428 3.786 20 0 FHADHM Cc1ccc(CN[C@H](C(=O)[O-])c2ccc(Br)cc2)cc1F ZINC000426813643 600418753 /nfs/dbraw/zinc/41/87/53/600418753.db2.gz YJTOJTZVJIKVSD-HNNXBMFYSA-N -1 3 352.203 3.812 20 0 FHADHM COCc1ccc(CN[C@H](C(=O)[O-])c2ccc(Br)cc2)cc1 ZINC000737834285 600422654 /nfs/dbraw/zinc/42/26/54/600422654.db2.gz OMWKQQXFLYINPZ-INIZCTEOSA-N -1 3 364.239 3.511 20 0 FHADHM O=C([O-])[C@@H](NCc1ccc(Oc2ccc(F)cc2)nc1)c1ccccc1 ZINC000738524640 600425965 /nfs/dbraw/zinc/42/59/65/600425965.db2.gz HSPWKJBPUPSPOV-IBGZPJMESA-N -1 3 352.365 3.929 20 0 FHADHM O=C([O-])c1cc(F)ccc1CN1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000740079820 600430993 /nfs/dbraw/zinc/43/09/93/600430993.db2.gz VJNDPTUNFGLOOA-UHFFFAOYSA-N -1 3 351.381 3.690 20 0 FHADHM Cc1cc(Br)ccc1CN[C@H](C(=O)[O-])c1ccc(F)cc1 ZINC000426774113 600436246 /nfs/dbraw/zinc/43/62/46/600436246.db2.gz MVHMVOQNNXKICO-HNNXBMFYSA-N -1 3 352.203 3.812 20 0 FHADHM CCN(CC)C(=O)[C@H](NCCc1ccc(NC(=O)[O-])cc1)c1ccccc1 ZINC000737077662 600453190 /nfs/dbraw/zinc/45/31/90/600453190.db2.gz CYYYPFYQLFLRDW-LJQANCHMSA-N -1 3 369.465 3.518 20 0 FHADHM CCCC[C@@H](CCC)NC(=O)NC1(c2cccc(-c3nnn[n-]3)c2)CC1 ZINC000825258811 607458682 /nfs/dbraw/zinc/45/86/82/607458682.db2.gz DTNGFCDHSBJRHN-MRXNPFEDSA-N -1 3 356.474 3.514 20 0 FHADHM CCCC[C@@H](CCC)NC(=O)NC1(c2cccc(-c3nn[n-]n3)c2)CC1 ZINC000825258811 607458684 /nfs/dbraw/zinc/45/86/84/607458684.db2.gz DTNGFCDHSBJRHN-MRXNPFEDSA-N -1 3 356.474 3.514 20 0 FHADHM O=C([O-])[C@@H](NCCOc1cccc(F)c1)c1ccc(Cl)cc1Cl ZINC000833164928 600738631 /nfs/dbraw/zinc/73/86/31/600738631.db2.gz DQELVHDFRIIGHA-HNNXBMFYSA-N -1 3 358.196 3.927 20 0 FHADHM O=C([O-])c1ccc(OCCN2CCCN(c3ccccc3)CC2)c(Cl)c1 ZINC000833321250 600819730 /nfs/dbraw/zinc/81/97/30/600819730.db2.gz OWLCUOLUSRPHSI-UHFFFAOYSA-N -1 3 374.868 3.629 20 0 FHADHM Cc1oc(CN(CCc2ccc(C)cc2)C[C@H]2CCCO2)cc1C(=O)[O-] ZINC000519599928 600848064 /nfs/dbraw/zinc/84/80/64/600848064.db2.gz FBOAOLPYZIFRSV-GOSISDBHSA-N -1 3 357.450 3.818 20 0 FHADHM CC(C)Oc1ccccc1[C@H](C)NCc1ccc(-c2nn[n-]n2)cc1F ZINC000820178420 607473247 /nfs/dbraw/zinc/47/32/47/607473247.db2.gz PDYQCCYOHYJMIW-ZDUSSCGKSA-N -1 3 355.417 3.644 20 0 FHADHM CC(C)c1nc2cc(NCc3ccc(-c4nnn[n-]4)cc3F)ccc2o1 ZINC000820201930 607474366 /nfs/dbraw/zinc/47/43/66/607474366.db2.gz CKZBGFDJAWZLCA-UHFFFAOYSA-N -1 3 352.373 3.883 20 0 FHADHM CC(C)c1nc2cc(NCc3ccc(-c4nn[n-]n4)cc3F)ccc2o1 ZINC000820201930 607474367 /nfs/dbraw/zinc/47/43/67/607474367.db2.gz CKZBGFDJAWZLCA-UHFFFAOYSA-N -1 3 352.373 3.883 20 0 FHADHM CN(c1nc(Cl)c(C(=O)[O-])s1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000388497340 600986989 /nfs/dbraw/zinc/98/69/89/600986989.db2.gz FLQWUTWEIUDUIH-ZDUSSCGKSA-N -1 3 365.886 3.596 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)cc1CSCc1noc(C2CCCCC2)n1 ZINC000822761921 607479617 /nfs/dbraw/zinc/47/96/17/607479617.db2.gz WBNIZEQXQQAADB-UHFFFAOYSA-N -1 3 374.445 3.870 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CSCc1noc(C2CCCCC2)n1 ZINC000822761921 607479618 /nfs/dbraw/zinc/47/96/18/607479618.db2.gz WBNIZEQXQQAADB-UHFFFAOYSA-N -1 3 374.445 3.870 20 0 FHADHM Cc1nccn1[C@@H]1CCCN([C@@H](C(=O)[O-])c2ccc(Cl)cc2Cl)C1 ZINC000833010438 601002097 /nfs/dbraw/zinc/00/20/97/601002097.db2.gz HPCKVNWBXLLTEB-CZUORRHYSA-N -1 3 368.264 3.961 20 0 FHADHM C[C@](NCc1ccc(Cl)nc1)(C(=O)[O-])c1cccc(Br)c1 ZINC000827740861 601005788 /nfs/dbraw/zinc/00/57/88/601005788.db2.gz DMTCJPADSZDXCL-OAHLLOKOSA-N -1 3 369.646 3.587 20 0 FHADHM COc1ccc([C@H](NCc2cc(F)cc(Br)c2)C(=O)[O-])cc1 ZINC000832253414 601165974 /nfs/dbraw/zinc/16/59/74/601165974.db2.gz YQNTUJPZZZYSKQ-HNNXBMFYSA-N -1 3 368.202 3.512 20 0 FHADHM Cc1c(Cl)cccc1NC(=O)CN[C@H](c1ccccc1)[C@@H](C)C(=O)[O-] ZINC000832854267 601202152 /nfs/dbraw/zinc/20/21/52/601202152.db2.gz CPDYUIVGXMQORR-ACJLOTCBSA-N -1 3 360.841 3.639 20 0 FHADHM Cc1ccc(CN[C@@H](C(=O)[O-])c2ccccc2)c(OCC(F)(F)F)c1 ZINC000832933461 601497435 /nfs/dbraw/zinc/49/74/35/601497435.db2.gz CWCBWXYBUMTUQB-MRXNPFEDSA-N -1 3 353.340 3.852 20 0 FHADHM CCC(CC)n1ccc(CN(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)n1 ZINC000825114749 607518929 /nfs/dbraw/zinc/51/89/29/607518929.db2.gz PNKNKYDHQBAUCF-UHFFFAOYSA-N -1 3 367.501 3.835 20 0 FHADHM CC(C)c1ccccc1NC(=O)CN[C@H](c1ccccc1)[C@H](C)C(=O)[O-] ZINC000827134098 601650665 /nfs/dbraw/zinc/65/06/65/601650665.db2.gz CYIIAHJZWZMMPQ-YWZLYKJASA-N -1 3 354.450 3.800 20 0 FHADHM Cc1cc(Cl)ccc1NC(=O)CN[C@H](c1ccccc1)[C@@H](C)C(=O)[O-] ZINC000832886447 601657272 /nfs/dbraw/zinc/65/72/72/601657272.db2.gz NXVBBKKKHSQVED-ACJLOTCBSA-N -1 3 360.841 3.639 20 0 FHADHM CN(C)Cc1c2ccccc2oc1C(=O)Nc1ccc(C(=O)[O-])c(F)c1 ZINC000830619666 601850069 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COc1cc(C(C)=O)ccc1SCc1cc(-c2nn[n-]n2)ccc1F ZINC000826177597 607540920 /nfs/dbraw/zinc/54/09/20/607540920.db2.gz OFLXTRKBSBUIAC-UHFFFAOYSA-N -1 3 358.398 3.509 20 0 FHADHM COc1cc(C(C)=O)ccc1SCc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000826177320 607541297 /nfs/dbraw/zinc/54/12/97/607541297.db2.gz CVNJDWGLQSYTKP-UHFFFAOYSA-N -1 3 358.398 3.509 20 0 FHADHM COc1cc(C(C)=O)ccc1SCc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000826177320 607541299 /nfs/dbraw/zinc/54/12/99/607541299.db2.gz CVNJDWGLQSYTKP-UHFFFAOYSA-N -1 3 358.398 3.509 20 0 FHADHM COC(=O)CCC1CCN([C@H](C(=O)[O-])c2cc(Cl)cc(Cl)c2)CC1 ZINC000831151755 602049506 /nfs/dbraw/zinc/04/95/06/602049506.db2.gz BZJVGRKUSRXJBX-INIZCTEOSA-N -1 3 374.264 3.784 20 0 FHADHM c1csc(CNc2cccc(OCc3cccc(-c4nnn[n-]4)c3)c2)n1 ZINC000826517054 607549766 /nfs/dbraw/zinc/54/97/66/607549766.db2.gz NQTXGSGSCLPHGW-UHFFFAOYSA-N -1 3 364.434 3.514 20 0 FHADHM c1csc(CNc2cccc(OCc3cccc(-c4nn[n-]n4)c3)c2)n1 ZINC000826517054 607549768 /nfs/dbraw/zinc/54/97/68/607549768.db2.gz 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/nfs/dbraw/zinc/72/99/68/607729968.db2.gz NBGUDUUALGQFKE-UHFFFAOYSA-N -1 3 373.844 3.548 20 0 FHADHM COCCCOc1cccc(CNc2ccc(-c3nnn[n-]3)c(Cl)c2)c1 ZINC000826157218 607730079 /nfs/dbraw/zinc/73/00/79/607730079.db2.gz LXJWYUDTMSIJED-UHFFFAOYSA-N -1 3 373.844 3.548 20 0 FHADHM COCCCOc1cccc(CNc2ccc(-c3nn[n-]n3)c(Cl)c2)c1 ZINC000826157218 607730081 /nfs/dbraw/zinc/73/00/81/607730081.db2.gz LXJWYUDTMSIJED-UHFFFAOYSA-N -1 3 373.844 3.548 20 0 FHADHM C[C@@]1(NCc2csc(COc3ccccc3)n2)CCCC[C@H]1C(=O)[O-] ZINC000833568903 605060122 /nfs/dbraw/zinc/06/01/22/605060122.db2.gz IGTJVCHVBMJAAK-QFBILLFUSA-N -1 3 360.479 3.845 20 0 FHADHM C[C@]1(NCc2coc(-c3c(F)cccc3F)n2)CCCC[C@@H]1C(=O)[O-] ZINC000833568416 605070710 /nfs/dbraw/zinc/07/07/10/605070710.db2.gz FIEJYRSGJPLKTD-XIKOKIGWSA-N -1 3 350.365 3.743 20 0 FHADHM C[C@@H](NCc1ccc([C@H](C)NC(=O)[O-])cc1)c1ccc2c(c1)OCCO2 ZINC000825502734 605118845 /nfs/dbraw/zinc/11/88/45/605118845.db2.gz KCPKMYPFZLALOY-KGLIPLIRSA-N -1 3 356.422 3.637 20 0 FHADHM C[C@H](NCc1ccc([C@H](C)NC(=O)[O-])cc1)c1ccc2c(c1)OCCO2 ZINC000825502732 605119001 /nfs/dbraw/zinc/11/90/01/605119001.db2.gz KCPKMYPFZLALOY-KBPBESRZSA-N -1 3 356.422 3.637 20 0 FHADHM C[C@H](c1ccccc1)N(C)C(=O)CN[C@@H](c1ccccc1)C(C)(C)C(=O)[O-] ZINC000833548229 605183581 /nfs/dbraw/zinc/18/35/81/605183581.db2.gz JHILTYLHQOYDSZ-UZLBHIALSA-N -1 3 368.477 3.648 20 0 FHADHM CCc1cnccc1[C@H](C)N[C@H](C(=O)[O-])c1cccc(Br)c1 ZINC000833675459 605270623 /nfs/dbraw/zinc/27/06/23/605270623.db2.gz YRRBDXFLXBLWNW-ZBEGNZNMSA-N -1 3 363.255 3.883 20 0 FHADHM COc1ccc(C)cc1[C@H](C)N[C@H](C)CC(=O)Nc1cccc(C(=O)[O-])c1 ZINC000833731021 605299944 /nfs/dbraw/zinc/29/99/44/605299944.db2.gz SHBOPIAWHYTPDV-CABCVRRESA-N -1 3 370.449 3.770 20 0 FHADHM CC1=C(C(=O)[O-])C[C@H](CN2CCC(c3nc(C(C)(C)C)cs3)CC2)O1 ZINC000833585739 605328996 /nfs/dbraw/zinc/32/89/96/605328996.db2.gz UTJUPVOYTTZDIW-CQSZACIVSA-N -1 3 364.511 3.768 20 0 FHADHM Cc1c(NC(=O)C[C@@H](C)c2ccc(F)cc2F)cccc1-c1nnn[n-]1 ZINC000826240668 607755349 /nfs/dbraw/zinc/75/53/49/607755349.db2.gz DBSKKQUJUZOJRL-SNVBAGLBSA-N -1 3 357.364 3.586 20 0 FHADHM Cc1c(NC(=O)C[C@@H](C)c2ccc(F)cc2F)cccc1-c1nn[n-]n1 ZINC000826240668 607755350 /nfs/dbraw/zinc/75/53/50/607755350.db2.gz DBSKKQUJUZOJRL-SNVBAGLBSA-N -1 3 357.364 3.586 20 0 FHADHM O=C([O-])N1CCC[C@H]1[C@@H]1CCCN(Cc2cnc(-c3ccccn3)s2)C1 ZINC000834104685 605473405 /nfs/dbraw/zinc/47/34/05/605473405.db2.gz FCJZDLQLLFSYML-PBHICJAKSA-N -1 3 372.494 3.560 20 0 FHADHM O=C([O-])N1CCC(N(Cc2cnc(-c3cccs3)s2)C2CC2)CC1 ZINC000834086402 605495448 /nfs/dbraw/zinc/49/54/48/605495448.db2.gz YMWXZHATXJTCSX-UHFFFAOYSA-N -1 3 363.508 3.978 20 0 FHADHM CCC(C)(C)CC(=O)Nc1nc(-c2cccc(-c3nnn[n-]3)c2)cs1 ZINC000825039091 607771219 /nfs/dbraw/zinc/77/12/19/607771219.db2.gz MFIGEBHBMOLDSS-UHFFFAOYSA-N -1 3 356.455 3.755 20 0 FHADHM CCC(C)(C)CC(=O)Nc1nc(-c2cccc(-c3nn[n-]n3)c2)cs1 ZINC000825039091 607771220 /nfs/dbraw/zinc/77/12/20/607771220.db2.gz MFIGEBHBMOLDSS-UHFFFAOYSA-N -1 3 356.455 3.755 20 0 FHADHM O=C([O-])N[C@@H]1C[C@@H](NCc2ccc(N3CCCCC3)nc2)c2ccccc21 ZINC000834159874 605792787 /nfs/dbraw/zinc/79/27/87/605792787.db2.gz ZDJFEGNICDSYIK-RTBURBONSA-N -1 3 366.465 3.615 20 0 FHADHM O=C([O-])NCCc1ccc(CN[C@@H]2CCCOc3cc(F)ccc32)cc1 ZINC000834245922 605914225 /nfs/dbraw/zinc/91/42/25/605914225.db2.gz VORCLWFZQQCOMB-GOSISDBHSA-N -1 3 358.413 3.639 20 0 FHADHM O=C([O-])N1CCC([C@H](NCc2ccccc2CO)c2ccc(F)cc2)CC1 ZINC000834073511 605983095 /nfs/dbraw/zinc/98/30/95/605983095.db2.gz HDWUICBXMXXVCF-HXUWFJFHSA-N -1 3 372.440 3.539 20 0 FHADHM O=C([O-])N1CCC[C@@H]1[C@H]1CCC[C@H]1NCc1coc(-c2cccs2)n1 ZINC000834107594 605989248 /nfs/dbraw/zinc/98/92/48/605989248.db2.gz MZROFIQBZSGTQL-RRFJBIMHSA-N -1 3 361.467 3.804 20 0 FHADHM O=C([O-])N1CCC[C@@H]1[C@@H]1CCC[C@@H]1NCc1coc(-c2ccccc2)n1 ZINC000834108862 605990195 /nfs/dbraw/zinc/99/01/95/605990195.db2.gz RUKLJRVUTQOTAJ-FGTMMUONSA-N -1 3 355.438 3.742 20 0 FHADHM COc1cccc(-c2ccc(CNc3ccc(-c4nnn[n-]4)nc3)cc2)c1 ZINC000821853871 606093474 /nfs/dbraw/zinc/09/34/74/606093474.db2.gz BWOBAAAOGNUGJS-UHFFFAOYSA-N -1 3 358.405 3.549 20 0 FHADHM COc1cccc(-c2ccc(CNc3ccc(-c4nn[n-]n4)nc3)cc2)c1 ZINC000821853871 606093476 /nfs/dbraw/zinc/09/34/76/606093476.db2.gz BWOBAAAOGNUGJS-UHFFFAOYSA-N -1 3 358.405 3.549 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)cc1CNc1ncc(-c2ccccc2)s1 ZINC000822762077 606096818 /nfs/dbraw/zinc/09/68/18/606096818.db2.gz YLCJVZGLWQYZKG-UHFFFAOYSA-N -1 3 352.398 3.741 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CNc1ncc(-c2ccccc2)s1 ZINC000822762077 606096821 /nfs/dbraw/zinc/09/68/21/606096821.db2.gz YLCJVZGLWQYZKG-UHFFFAOYSA-N -1 3 352.398 3.741 20 0 FHADHM COc1ccc(-c2csc(CNc3ccc(-c4nnn[n-]4)nc3)c2)cc1 ZINC000821732405 606099756 /nfs/dbraw/zinc/09/97/56/606099756.db2.gz NWACIYWJPRXBLK-UHFFFAOYSA-N -1 3 364.434 3.611 20 0 FHADHM COc1ccc(-c2csc(CNc3ccc(-c4nn[n-]n4)nc3)c2)cc1 ZINC000821732405 606099759 /nfs/dbraw/zinc/09/97/59/606099759.db2.gz NWACIYWJPRXBLK-UHFFFAOYSA-N -1 3 364.434 3.611 20 0 FHADHM Cc1ccc(CCC(=O)Nc2sc3c(c2-c2nnn[n-]2)CC[C@H](C)C3)o1 ZINC000822234579 606101210 /nfs/dbraw/zinc/10/12/10/606101210.db2.gz AIVPHTDOJBGIRV-JTQLQIEISA-N -1 3 371.466 3.526 20 0 FHADHM Cc1ccc(CCC(=O)Nc2sc3c(c2-c2nn[n-]n2)CC[C@H](C)C3)o1 ZINC000822234579 606101211 /nfs/dbraw/zinc/10/12/11/606101211.db2.gz AIVPHTDOJBGIRV-JTQLQIEISA-N -1 3 371.466 3.526 20 0 FHADHM O=C(Cc1ccc(-c2nnn[n-]2)cc1)N(c1ccccc1F)C1CCCC1 ZINC000823074307 606103729 /nfs/dbraw/zinc/10/37/29/606103729.db2.gz PDTLOJASXBBTAQ-UHFFFAOYSA-N -1 3 365.412 3.524 20 0 FHADHM O=C(Cc1ccc(-c2nn[n-]n2)cc1)N(c1ccccc1F)C1CCCC1 ZINC000823074307 606103730 /nfs/dbraw/zinc/10/37/30/606103730.db2.gz PDTLOJASXBBTAQ-UHFFFAOYSA-N -1 3 365.412 3.524 20 0 FHADHM CCS[C@H]1CCCC[C@@H]1Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000821456844 606105666 /nfs/dbraw/zinc/10/56/66/606105666.db2.gz SBIKSVUKZYCZHO-QWRGUYRKSA-N -1 3 372.420 3.757 20 0 FHADHM CCS[C@H]1CCCC[C@@H]1Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000821456844 606105668 /nfs/dbraw/zinc/10/56/68/606105668.db2.gz SBIKSVUKZYCZHO-QWRGUYRKSA-N -1 3 372.420 3.757 20 0 FHADHM CCc1ccc(C(C)(C)C(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000821476377 606116953 /nfs/dbraw/zinc/11/69/53/606116953.db2.gz NMQRUARNDNSPMF-CQSZACIVSA-N -1 3 363.465 3.584 20 0 FHADHM CCc1ccc(C(C)(C)C(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000821476377 606116954 /nfs/dbraw/zinc/11/69/54/606116954.db2.gz NMQRUARNDNSPMF-CQSZACIVSA-N -1 3 363.465 3.584 20 0 FHADHM CC[C@H](Oc1ccccc1C)C(=O)Nc1sc(C)c(C)c1-c1nnn[n-]1 ZINC000820939522 606121708 /nfs/dbraw/zinc/12/17/08/606121708.db2.gz VWYSFASYLORPSF-ZDUSSCGKSA-N -1 3 371.466 3.650 20 0 FHADHM CC[C@H](Oc1ccccc1C)C(=O)Nc1sc(C)c(C)c1-c1nn[n-]n1 ZINC000820939522 606121709 /nfs/dbraw/zinc/12/17/09/606121709.db2.gz VWYSFASYLORPSF-ZDUSSCGKSA-N -1 3 371.466 3.650 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccc(Cl)s1 ZINC000819866744 606122340 /nfs/dbraw/zinc/12/23/40/606122340.db2.gz PIUPCQXMBQEDJF-SSDOTTSWSA-N -1 3 368.249 3.977 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccc(Cl)s1 ZINC000819866744 606122341 /nfs/dbraw/zinc/12/23/41/606122341.db2.gz PIUPCQXMBQEDJF-SSDOTTSWSA-N -1 3 368.249 3.977 20 0 FHADHM CCCCOc1cccc(NCc2ccc(OC)c(-c3nnn[n-]3)c2)c1 ZINC000821077615 606132191 /nfs/dbraw/zinc/13/21/91/606132191.db2.gz NNNXMMCPLNZQHU-UHFFFAOYSA-N -1 3 353.426 3.666 20 0 FHADHM CCCCOc1cccc(NCc2ccc(OC)c(-c3nn[n-]n3)c2)c1 ZINC000821077615 606132193 /nfs/dbraw/zinc/13/21/93/606132193.db2.gz NNNXMMCPLNZQHU-UHFFFAOYSA-N -1 3 353.426 3.666 20 0 FHADHM C[C@@H]1c2ccccc2CN1c1c(-c2nnn[n-]2)cnc2c(F)ccc(F)c21 ZINC000820825839 606137448 /nfs/dbraw/zinc/13/74/48/606137448.db2.gz FJSIEZDNYRSEIP-SNVBAGLBSA-N -1 3 364.359 3.774 20 0 FHADHM C[C@@H]1c2ccccc2CN1c1c(-c2nn[n-]n2)cnc2c(F)ccc(F)c21 ZINC000820825839 606137449 /nfs/dbraw/zinc/13/74/49/606137449.db2.gz FJSIEZDNYRSEIP-SNVBAGLBSA-N -1 3 364.359 3.774 20 0 FHADHM Cc1ccc(Oc2ccccc2NC(=O)c2cc(-c3nnn[n-]3)cn2C)cc1 ZINC000822266463 606210688 /nfs/dbraw/zinc/21/06/88/606210688.db2.gz AJHNKQJFYIZWFV-UHFFFAOYSA-N -1 3 374.404 3.558 20 0 FHADHM Cc1ccc(Oc2ccccc2NC(=O)c2cc(-c3nn[n-]n3)cn2C)cc1 ZINC000822266463 606210689 /nfs/dbraw/zinc/21/06/89/606210689.db2.gz AJHNKQJFYIZWFV-UHFFFAOYSA-N -1 3 374.404 3.558 20 0 FHADHM C[C@H](NCc1cc(-c2nnn[n-]2)cs1)c1nc(-c2ccccc2)cs1 ZINC000820427469 606217553 /nfs/dbraw/zinc/21/75/53/606217553.db2.gz RGEJJKJWAZOQOX-NSHDSACASA-N -1 3 368.491 3.903 20 0 FHADHM C[C@H](NCc1cc(-c2nn[n-]n2)cs1)c1nc(-c2ccccc2)cs1 ZINC000820427469 606217555 /nfs/dbraw/zinc/21/75/55/606217555.db2.gz RGEJJKJWAZOQOX-NSHDSACASA-N -1 3 368.491 3.903 20 0 FHADHM CC(C)[C@H](CNc1cc(-c2nnn[n-]2)c2ccccc2n1)c1cccnc1 ZINC000820020418 606229359 /nfs/dbraw/zinc/22/93/59/606229359.db2.gz GBDVSUOKKICBIJ-KRWDZBQOSA-N -1 3 359.437 3.662 20 0 FHADHM CC(C)[C@H](CNc1cc(-c2nn[n-]n2)c2ccccc2n1)c1cccnc1 ZINC000820020418 606229360 /nfs/dbraw/zinc/22/93/60/606229360.db2.gz GBDVSUOKKICBIJ-KRWDZBQOSA-N -1 3 359.437 3.662 20 0 FHADHM O=C(Nc1ccc(Oc2ccccc2-c2nnn[n-]2)cc1)[C@@H]1C[C@H]1C1CC1 ZINC000823357655 606236643 /nfs/dbraw/zinc/23/66/43/606236643.db2.gz XDWHQLHNVUIIMA-DLBZAZTESA-N -1 3 361.405 3.644 20 0 FHADHM O=C(Nc1ccc(Oc2ccccc2-c2nn[n-]n2)cc1)[C@@H]1C[C@H]1C1CC1 ZINC000823357655 606236644 /nfs/dbraw/zinc/23/66/44/606236644.db2.gz XDWHQLHNVUIIMA-DLBZAZTESA-N -1 3 361.405 3.644 20 0 FHADHM O=C(Oc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1)[C@@H]1C[C@@H]1C1CC1 ZINC000823453822 606260633 /nfs/dbraw/zinc/26/06/33/606260633.db2.gz ATQANMIKQNMSPT-QZTJIDSGSA-N -1 3 362.389 3.611 20 0 FHADHM O=C(Oc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1)[C@@H]1C[C@@H]1C1CC1 ZINC000823453822 606260634 /nfs/dbraw/zinc/26/06/34/606260634.db2.gz ATQANMIKQNMSPT-QZTJIDSGSA-N -1 3 362.389 3.611 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)[C@@H]1C[C@H]1c1cccc2ccccc21 ZINC000823343718 606272184 /nfs/dbraw/zinc/27/21/84/606272184.db2.gz FHLWDRFBQUGKMU-DLBZAZTESA-N -1 3 373.391 3.901 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)[C@@H]1C[C@H]1c1cccc2ccccc21 ZINC000823343718 606272187 /nfs/dbraw/zinc/27/21/87/606272187.db2.gz FHLWDRFBQUGKMU-DLBZAZTESA-N -1 3 373.391 3.901 20 0 FHADHM Cc1nc(C2CCCC2)sc1C(=O)Nc1ccc(F)cc1-c1nnn[n-]1 ZINC000822432025 606273947 /nfs/dbraw/zinc/27/39/47/606273947.db2.gz UCXFCRCNKHPWKB-UHFFFAOYSA-N -1 3 372.429 3.681 20 0 FHADHM Cc1nc(C2CCCC2)sc1C(=O)Nc1ccc(F)cc1-c1nn[n-]n1 ZINC000822432025 606273948 /nfs/dbraw/zinc/27/39/48/606273948.db2.gz UCXFCRCNKHPWKB-UHFFFAOYSA-N -1 3 372.429 3.681 20 0 FHADHM O=C(NCCC1CC1)c1ccc(Sc2ccccc2-c2nnn[n-]2)cc1 ZINC000823183342 606286762 /nfs/dbraw/zinc/28/67/62/606286762.db2.gz VCQPHLUQBGQMLO-UHFFFAOYSA-N -1 3 365.462 3.548 20 0 FHADHM O=C(NCCC1CC1)c1ccc(Sc2ccccc2-c2nn[n-]n2)cc1 ZINC000823183342 606286763 /nfs/dbraw/zinc/28/67/63/606286763.db2.gz VCQPHLUQBGQMLO-UHFFFAOYSA-N -1 3 365.462 3.548 20 0 FHADHM Clc1ccc(-c2noc(CSc3cccc(-c4nnn[n-]4)c3)n2)cc1 ZINC000822573758 606324311 /nfs/dbraw/zinc/32/43/11/606324311.db2.gz HLMGJYRAKGUIEL-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1ccc(-c2noc(CSc3cccc(-c4nn[n-]n4)c3)n2)cc1 ZINC000822573758 606324313 /nfs/dbraw/zinc/32/43/13/606324313.db2.gz HLMGJYRAKGUIEL-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM CCn1c(CSc2cccc(-c3nnn[n-]3)c2)nc2c1cccc2F ZINC000821563837 606325519 /nfs/dbraw/zinc/32/55/19/606325519.db2.gz HXLUDWUBCFIUBR-UHFFFAOYSA-N -1 3 354.414 3.668 20 0 FHADHM CCn1c(CSc2cccc(-c3nn[n-]n3)c2)nc2c1cccc2F ZINC000821563837 606325522 /nfs/dbraw/zinc/32/55/22/606325522.db2.gz HXLUDWUBCFIUBR-UHFFFAOYSA-N -1 3 354.414 3.668 20 0 FHADHM C[C@@H](Sc1cccc(-c2nnn[n-]2)c1)c1nc(-c2ccccc2)no1 ZINC000820557277 606325864 /nfs/dbraw/zinc/32/58/64/606325864.db2.gz XTXGDVVVYGBRIY-LLVKDONJSA-N -1 3 350.407 3.770 20 0 FHADHM C[C@@H](Sc1cccc(-c2nn[n-]n2)c1)c1nc(-c2ccccc2)no1 ZINC000820557277 606325865 /nfs/dbraw/zinc/32/58/65/606325865.db2.gz XTXGDVVVYGBRIY-LLVKDONJSA-N -1 3 350.407 3.770 20 0 FHADHM Cc1c(Cl)cccc1NC(=O)[C@H](C)Sc1cccc(-c2nnn[n-]2)c1 ZINC000822035705 606326432 /nfs/dbraw/zinc/32/64/32/606326432.db2.gz YJMJNQWEWMBBKH-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM Cc1c(Cl)cccc1NC(=O)[C@H](C)Sc1cccc(-c2nn[n-]n2)c1 ZINC000822035705 606326434 /nfs/dbraw/zinc/32/64/34/606326434.db2.gz YJMJNQWEWMBBKH-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM C[C@H](Oc1ccccc1Cl)C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820550204 606339191 /nfs/dbraw/zinc/33/91/91/606339191.db2.gz VTJUXLXKEWOKPB-RYUDHWBXSA-N -1 3 372.812 3.592 20 0 FHADHM C[C@H](Oc1ccccc1Cl)C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820550204 606339193 /nfs/dbraw/zinc/33/91/93/606339193.db2.gz VTJUXLXKEWOKPB-RYUDHWBXSA-N -1 3 372.812 3.592 20 0 FHADHM CCc1ccc([C@@H]2CCCN2C(=O)Nc2ccc(F)cc2-c2nnn[n-]2)o1 ZINC000821482799 606345840 /nfs/dbraw/zinc/34/58/40/606345840.db2.gz VDXVCDLBHOZUIQ-HNNXBMFYSA-N -1 3 370.388 3.530 20 0 FHADHM CCc1ccc([C@@H]2CCCN2C(=O)Nc2ccc(F)cc2-c2nn[n-]n2)o1 ZINC000821482799 606345842 /nfs/dbraw/zinc/34/58/42/606345842.db2.gz VDXVCDLBHOZUIQ-HNNXBMFYSA-N -1 3 370.388 3.530 20 0 FHADHM C[C@H](OC(=O)[C@@H]1C[C@H]1c1cccc(F)c1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000820487234 606346080 /nfs/dbraw/zinc/34/60/80/606346080.db2.gz FUSVVPGVJIUERH-NZVBXONLSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@@H]1C[C@H]1c1cccc(F)c1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000820487234 606346082 /nfs/dbraw/zinc/34/60/82/606346082.db2.gz FUSVVPGVJIUERH-NZVBXONLSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@@H](OC(=O)[C@H](C)Oc1cccc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820533326 606346190 /nfs/dbraw/zinc/34/61/90/606346190.db2.gz DNGCGWGPSRQJNK-NEPJUHHUSA-N -1 3 372.812 3.592 20 0 FHADHM C[C@@H](OC(=O)[C@H](C)Oc1cccc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820533326 606346191 /nfs/dbraw/zinc/34/61/91/606346191.db2.gz DNGCGWGPSRQJNK-NEPJUHHUSA-N -1 3 372.812 3.592 20 0 FHADHM C[C@H](CC(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccccc1F ZINC000820225477 606355771 /nfs/dbraw/zinc/35/57/71/606355771.db2.gz JORJMBMPLDOMBX-OLZOCXBDSA-N -1 3 354.385 3.804 20 0 FHADHM C[C@H](CC(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccccc1F ZINC000820225477 606355773 /nfs/dbraw/zinc/35/57/73/606355773.db2.gz JORJMBMPLDOMBX-OLZOCXBDSA-N -1 3 354.385 3.804 20 0 FHADHM C[C@H](OC(=O)CCc1cc(Cl)cs1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820495300 606356030 /nfs/dbraw/zinc/35/60/30/606356030.db2.gz GYAUEIUPMLZZDZ-JTQLQIEISA-N -1 3 362.842 3.819 20 0 FHADHM C[C@H](OC(=O)CCc1cc(Cl)cs1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820495300 606356031 /nfs/dbraw/zinc/35/60/31/606356031.db2.gz GYAUEIUPMLZZDZ-JTQLQIEISA-N -1 3 362.842 3.819 20 0 FHADHM Cc1ccccc1[C@@H](C)N(C)C(=O)Nc1ccc(F)cc1-c1nnn[n-]1 ZINC000822345444 606356395 /nfs/dbraw/zinc/35/63/95/606356395.db2.gz JFNMZHFRKIOGON-GFCCVEGCSA-N -1 3 354.389 3.539 20 0 FHADHM Cc1ccccc1[C@@H](C)N(C)C(=O)Nc1ccc(F)cc1-c1nn[n-]n1 ZINC000822345444 606356397 /nfs/dbraw/zinc/35/63/97/606356397.db2.gz JFNMZHFRKIOGON-GFCCVEGCSA-N -1 3 354.389 3.539 20 0 FHADHM Cc1cccc(OCCCC(=O)O[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000822327214 606358528 /nfs/dbraw/zinc/35/85/28/606358528.db2.gz CZNZKJGCQIKOIZ-HNNXBMFYSA-N -1 3 366.421 3.639 20 0 FHADHM Cc1cccc(OCCCC(=O)O[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000822327214 606358530 /nfs/dbraw/zinc/35/85/30/606358530.db2.gz CZNZKJGCQIKOIZ-HNNXBMFYSA-N -1 3 366.421 3.639 20 0 FHADHM Cc1nc(C(C)C)sc1C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000822427639 606359023 /nfs/dbraw/zinc/35/90/23/606359023.db2.gz SFVHGPNJISRRQS-NSHDSACASA-N -1 3 357.439 3.673 20 0 FHADHM Cc1nc(C(C)C)sc1C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000822427639 606359025 /nfs/dbraw/zinc/35/90/25/606359025.db2.gz SFVHGPNJISRRQS-NSHDSACASA-N -1 3 357.439 3.673 20 0 FHADHM Cc1ncccc1C(=O)Oc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000822471792 606360995 /nfs/dbraw/zinc/36/09/95/606360995.db2.gz JVXRSRUPWJEUFL-UHFFFAOYSA-N -1 3 373.372 3.582 20 0 FHADHM Cc1ncccc1C(=O)Oc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000822471792 606360998 /nfs/dbraw/zinc/36/09/98/606360998.db2.gz JVXRSRUPWJEUFL-UHFFFAOYSA-N -1 3 373.372 3.582 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)c1ccc(Oc2ccccc2)o1 ZINC000822220421 606363544 /nfs/dbraw/zinc/36/35/44/606363544.db2.gz QPVVKRULNXHELU-UHFFFAOYSA-N -1 3 361.361 3.813 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)c1ccc(Oc2ccccc2)o1 ZINC000822220421 606363545 /nfs/dbraw/zinc/36/35/45/606363545.db2.gz QPVVKRULNXHELU-UHFFFAOYSA-N -1 3 361.361 3.813 20 0 FHADHM COc1cc2nc(C=Cc3ccc(-c4nnn[n-]4)s3)sc2cc1OC ZINC000821728642 606390426 /nfs/dbraw/zinc/39/04/26/606390426.db2.gz XXJVENTXQOLZPR-GQCTYLIASA-N -1 3 371.447 3.726 20 0 FHADHM CC(=O)c1ccc2cc(OCCOc3ccccc3-c3nnn[n-]3)ccc2c1 ZINC000819834616 606399326 /nfs/dbraw/zinc/39/93/26/606399326.db2.gz OYOQBEGALVQRRY-UHFFFAOYSA-N -1 3 374.400 3.680 20 0 FHADHM CC(=O)c1ccc2cc(OCCOc3ccccc3-c3nn[n-]n3)ccc2c1 ZINC000819834616 606399328 /nfs/dbraw/zinc/39/93/28/606399328.db2.gz OYOQBEGALVQRRY-UHFFFAOYSA-N -1 3 374.400 3.680 20 0 FHADHM CCc1sc(C(=O)N(C)c2cc(Cl)ccc2-c2nnn[n-]2)cc1C ZINC000821564012 606411905 /nfs/dbraw/zinc/41/19/05/606411905.db2.gz PPXIHFPSJSUGTR-UHFFFAOYSA-N -1 3 361.858 3.729 20 0 FHADHM CCc1sc(C(=O)N(C)c2cc(Cl)ccc2-c2nn[n-]n2)cc1C ZINC000821564012 606411907 /nfs/dbraw/zinc/41/19/07/606411907.db2.gz PPXIHFPSJSUGTR-UHFFFAOYSA-N -1 3 361.858 3.729 20 0 FHADHM C[C@H](Nc1ncc(-c2nnn[n-]2)cc1Cl)c1c(F)cccc1Cl ZINC000820461366 606422480 /nfs/dbraw/zinc/42/24/80/606422480.db2.gz IOAPBJVZVDQCAS-ZETCQYMHSA-N -1 3 353.188 3.881 20 0 FHADHM C[C@H](Nc1ncc(-c2nn[n-]n2)cc1Cl)c1c(F)cccc1Cl ZINC000820461366 606422482 /nfs/dbraw/zinc/42/24/82/606422482.db2.gz IOAPBJVZVDQCAS-ZETCQYMHSA-N -1 3 353.188 3.881 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)N1CCCC[C@H]1c1ccc(F)cc1 ZINC000823308834 606439717 /nfs/dbraw/zinc/43/97/17/606439717.db2.gz KSWLQLDYWCOZID-KRWDZBQOSA-N -1 3 366.400 3.765 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)N1CCCC[C@H]1c1ccc(F)cc1 ZINC000823308834 606439718 /nfs/dbraw/zinc/43/97/18/606439718.db2.gz KSWLQLDYWCOZID-KRWDZBQOSA-N -1 3 366.400 3.765 20 0 FHADHM Fc1ccc(NCc2csc(-c3ccccc3)n2)c(-c2nnn[n-]2)c1 ZINC000822783013 606445690 /nfs/dbraw/zinc/44/56/90/606445690.db2.gz PXVPRNRTRUXPFN-UHFFFAOYSA-N -1 3 352.398 3.741 20 0 FHADHM Fc1ccc(NCc2csc(-c3ccccc3)n2)c(-c2nn[n-]n2)c1 ZINC000822783013 606445691 /nfs/dbraw/zinc/44/56/91/606445691.db2.gz PXVPRNRTRUXPFN-UHFFFAOYSA-N -1 3 352.398 3.741 20 0 FHADHM Cc1c(NCc2cccc(-c3nnn[n-]3)c2)cccc1OCC(F)(F)F ZINC000822122065 606455585 /nfs/dbraw/zinc/45/55/85/606455585.db2.gz JKOWJECDCZXJHI-UHFFFAOYSA-N -1 3 363.343 3.728 20 0 FHADHM Cc1c(NCc2cccc(-c3nn[n-]n3)c2)cccc1OCC(F)(F)F ZINC000822122065 606455586 /nfs/dbraw/zinc/45/55/86/606455586.db2.gz JKOWJECDCZXJHI-UHFFFAOYSA-N -1 3 363.343 3.728 20 0 FHADHM O=C(C[C@@H]1C=CCC1)Nc1ccccc1NCc1cccc(-c2nnn[n-]2)c1 ZINC000822941528 606459572 /nfs/dbraw/zinc/45/95/72/606459572.db2.gz YNDPIOOLYXFLDK-OAHLLOKOSA-N -1 3 374.448 3.774 20 0 FHADHM O=C(C[C@@H]1C=CCC1)Nc1ccccc1NCc1cccc(-c2nn[n-]n2)c1 ZINC000822941528 606459574 /nfs/dbraw/zinc/45/95/74/606459574.db2.gz YNDPIOOLYXFLDK-OAHLLOKOSA-N -1 3 374.448 3.774 20 0 FHADHM C[C@@H](OC(=O)c1cc(-c2nnn[n-]2)cs1)c1ccc(F)c(Cl)c1 ZINC000820508510 606462674 /nfs/dbraw/zinc/46/26/74/606462674.db2.gz QOBAWQYAEJGWTP-SSDOTTSWSA-N -1 3 352.778 3.639 20 0 FHADHM C[C@@H](OC(=O)c1cc(-c2nn[n-]n2)cs1)c1ccc(F)c(Cl)c1 ZINC000820508510 606462676 /nfs/dbraw/zinc/46/26/76/606462676.db2.gz QOBAWQYAEJGWTP-SSDOTTSWSA-N -1 3 352.778 3.639 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccc2ccccc2n1)c1cccc(-c2nnn[n-]2)c1 ZINC000820487773 606464920 /nfs/dbraw/zinc/46/49/20/606464920.db2.gz IQKPAZAMIHHKMA-GETOMWPZSA-N -1 3 371.400 3.733 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccc2ccccc2n1)c1cccc(-c2nn[n-]n2)c1 ZINC000820487773 606464921 /nfs/dbraw/zinc/46/49/21/606464921.db2.gz IQKPAZAMIHHKMA-GETOMWPZSA-N -1 3 371.400 3.733 20 0 FHADHM Cc1cccc(C(NCc2ccc(-c3nnn[n-]3)o2)c2cccc(C)c2)c1 ZINC000822289255 606473852 /nfs/dbraw/zinc/47/38/52/606473852.db2.gz VJPQSDIFNXHVIK-UHFFFAOYSA-N -1 3 359.433 3.956 20 0 FHADHM Cc1cccc(C(NCc2ccc(-c3nn[n-]n3)o2)c2cccc(C)c2)c1 ZINC000822289255 606473854 /nfs/dbraw/zinc/47/38/54/606473854.db2.gz VJPQSDIFNXHVIK-UHFFFAOYSA-N -1 3 359.433 3.956 20 0 FHADHM O=C(Nc1ccc2c(c1)Cc1ccccc1-2)c1cc(-c2nnn[n-]2)cs1 ZINC000823357695 606480566 /nfs/dbraw/zinc/48/05/66/606480566.db2.gz YROBCOLVPAUAGG-UHFFFAOYSA-N -1 3 359.414 3.752 20 0 FHADHM O=C(Nc1ccc2c(c1)Cc1ccccc1-2)c1cc(-c2nn[n-]n2)cs1 ZINC000823357695 606480568 /nfs/dbraw/zinc/48/05/68/606480568.db2.gz YROBCOLVPAUAGG-UHFFFAOYSA-N -1 3 359.414 3.752 20 0 FHADHM Cc1cc(C)c(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CC[C@@H](C)C3)o1 ZINC000822194402 606489240 /nfs/dbraw/zinc/48/92/40/606489240.db2.gz WFJHAITYBVJXRG-MRVPVSSYSA-N -1 3 357.439 3.515 20 0 FHADHM Cc1cc(C)c(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CC[C@@H](C)C3)o1 ZINC000822194402 606489242 /nfs/dbraw/zinc/48/92/42/606489242.db2.gz WFJHAITYBVJXRG-MRVPVSSYSA-N -1 3 357.439 3.515 20 0 FHADHM O=C(CCC1CCC1)Nc1nc(-c2ccc(-c3nnn[n-]3)cc2)cs1 ZINC000822950442 606489653 /nfs/dbraw/zinc/48/96/53/606489653.db2.gz OGLFTJUZLBNJHN-UHFFFAOYSA-N -1 3 354.439 3.509 20 0 FHADHM O=C(CCC1CCC1)Nc1nc(-c2ccc(-c3nn[n-]n3)cc2)cs1 ZINC000822950442 606489655 /nfs/dbraw/zinc/48/96/55/606489655.db2.gz OGLFTJUZLBNJHN-UHFFFAOYSA-N -1 3 354.439 3.509 20 0 FHADHM CCCN(C(=O)c1cc(-c2nnn[n-]2)cs1)[C@H](CC)c1ccccc1 ZINC000821081864 606492020 /nfs/dbraw/zinc/49/20/20/606492020.db2.gz CHTRZPIKOYQBNT-OAHLLOKOSA-N -1 3 355.467 3.932 20 0 FHADHM CCCN(C(=O)c1cc(-c2nn[n-]n2)cs1)[C@H](CC)c1ccccc1 ZINC000821081864 606492021 /nfs/dbraw/zinc/49/20/21/606492021.db2.gz CHTRZPIKOYQBNT-OAHLLOKOSA-N -1 3 355.467 3.932 20 0 FHADHM Cc1ccc(C(=O)N(CC(C)C)c2ccc(-c3nnn[n-]3)cc2)c(F)c1 ZINC000822226054 606506063 /nfs/dbraw/zinc/50/60/63/606506063.db2.gz AFJXLVWINVXRCF-UHFFFAOYSA-N -1 3 353.401 3.617 20 0 FHADHM Cc1ccc(C(=O)N(CC(C)C)c2ccc(-c3nn[n-]n3)cc2)c(F)c1 ZINC000822226054 606506065 /nfs/dbraw/zinc/50/60/65/606506065.db2.gz AFJXLVWINVXRCF-UHFFFAOYSA-N -1 3 353.401 3.617 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)cc1CN(Cc1cccs1)CC(F)(F)F ZINC000822758680 606506166 /nfs/dbraw/zinc/50/61/66/606506166.db2.gz VUPXCJIUKVEDQO-UHFFFAOYSA-N -1 3 371.363 3.632 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CN(Cc1cccs1)CC(F)(F)F ZINC000822758680 606506168 /nfs/dbraw/zinc/50/61/68/606506168.db2.gz VUPXCJIUKVEDQO-UHFFFAOYSA-N -1 3 371.363 3.632 20 0 FHADHM Cc1cscc1C(=O)N(Cc1ccco1)c1ccccc1-c1nnn[n-]1 ZINC000822414712 606507063 /nfs/dbraw/zinc/50/70/63/606507063.db2.gz QVCYOPGSHBBPHV-UHFFFAOYSA-N -1 3 365.418 3.677 20 0 FHADHM Cc1cscc1C(=O)N(Cc1ccco1)c1ccccc1-c1nn[n-]n1 ZINC000822414712 606507065 /nfs/dbraw/zinc/50/70/65/606507065.db2.gz QVCYOPGSHBBPHV-UHFFFAOYSA-N -1 3 365.418 3.677 20 0 FHADHM Cc1ccc(N(C(=O)c2cc(-c3nnn[n-]3)cs2)C2CCCCC2)nc1 ZINC000822241345 606509631 /nfs/dbraw/zinc/50/96/31/606509631.db2.gz SKAXDWDFRTZDJR-UHFFFAOYSA-N -1 3 368.466 3.611 20 0 FHADHM Cc1ccc(N(C(=O)c2cc(-c3nn[n-]n3)cs2)C2CCCCC2)nc1 ZINC000822241345 606509632 /nfs/dbraw/zinc/50/96/32/606509632.db2.gz SKAXDWDFRTZDJR-UHFFFAOYSA-N -1 3 368.466 3.611 20 0 FHADHM O=C(Nc1cccc(N2CCCCCC2)c1)c1cc(-c2nnn[n-]2)cs1 ZINC000823363833 606516923 /nfs/dbraw/zinc/51/69/23/606516923.db2.gz PDROQVAOXWVTGY-UHFFFAOYSA-N -1 3 368.466 3.561 20 0 FHADHM O=C(Nc1cccc(N2CCCCCC2)c1)c1cc(-c2nn[n-]n2)cs1 ZINC000823363833 606516925 /nfs/dbraw/zinc/51/69/25/606516925.db2.gz PDROQVAOXWVTGY-UHFFFAOYSA-N -1 3 368.466 3.561 20 0 FHADHM Cc1cc(NC(=O)c2cc(-c3nnn[n-]3)cs2)ccc1C(F)(F)F ZINC000822208129 606520083 /nfs/dbraw/zinc/52/00/83/606520083.db2.gz CEDBNRMVXPRKRD-UHFFFAOYSA-N -1 3 353.329 3.508 20 0 FHADHM Cc1cc(NC(=O)c2cc(-c3nn[n-]n3)cs2)ccc1C(F)(F)F ZINC000822208129 606520085 /nfs/dbraw/zinc/52/00/85/606520085.db2.gz CEDBNRMVXPRKRD-UHFFFAOYSA-N -1 3 353.329 3.508 20 0 FHADHM CCc1ccc([C@H]2C[C@H](C)CCN2C(=O)c2cc(-c3nnn[n-]3)cs2)o1 ZINC000821480844 606520518 /nfs/dbraw/zinc/52/05/18/606520518.db2.gz FLUQDBGTVWXJQG-BXUZGUMPSA-N -1 3 371.466 3.697 20 0 FHADHM CCc1ccc([C@H]2C[C@H](C)CCN2C(=O)c2cc(-c3nn[n-]n3)cs2)o1 ZINC000821480844 606520520 /nfs/dbraw/zinc/52/05/20/606520520.db2.gz FLUQDBGTVWXJQG-BXUZGUMPSA-N -1 3 371.466 3.697 20 0 FHADHM O=C(C/C=C/c1cccc(F)c1)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000822945776 606523773 /nfs/dbraw/zinc/52/37/73/606523773.db2.gz QLVGHMYREZUSDT-DUXPYHPUSA-N -1 3 357.776 3.701 20 0 FHADHM O=C(C/C=C/c1cccc(F)c1)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000822945776 606523774 /nfs/dbraw/zinc/52/37/74/606523774.db2.gz QLVGHMYREZUSDT-DUXPYHPUSA-N -1 3 357.776 3.701 20 0 FHADHM C[C@H]1CCCN1C(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000820710908 606577669 /nfs/dbraw/zinc/57/76/69/606577669.db2.gz SNGDJUHLRVUOKF-ZDUSSCGKSA-N -1 3 364.409 3.675 20 0 FHADHM C[C@H]1CCCN1C(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000820710908 606577671 /nfs/dbraw/zinc/57/76/71/606577671.db2.gz SNGDJUHLRVUOKF-ZDUSSCGKSA-N -1 3 364.409 3.675 20 0 FHADHM COc1cccc(SCc2ccc(-c3nnn[n-]3)cc2OC(F)F)c1 ZINC000821877090 606589174 /nfs/dbraw/zinc/58/91/74/606589174.db2.gz AQYCKAAMULOQBM-UHFFFAOYSA-N -1 3 364.377 3.769 20 0 FHADHM COc1cccc(SCc2ccc(-c3nn[n-]n3)cc2OC(F)F)c1 ZINC000821877090 606589176 /nfs/dbraw/zinc/58/91/76/606589176.db2.gz AQYCKAAMULOQBM-UHFFFAOYSA-N -1 3 364.377 3.769 20 0 FHADHM Cc1cccc([C@H](NC(=O)Cc2ccc(-c3nnn[n-]3)cc2)C(C)(C)C)c1 ZINC000822288784 606590138 /nfs/dbraw/zinc/59/01/38/606590138.db2.gz JLPHPSWEJCKQEJ-IBGZPJMESA-N -1 3 363.465 3.621 20 0 FHADHM Cc1cccc([C@H](NC(=O)Cc2ccc(-c3nn[n-]n3)cc2)C(C)(C)C)c1 ZINC000822288784 606590139 /nfs/dbraw/zinc/59/01/39/606590139.db2.gz JLPHPSWEJCKQEJ-IBGZPJMESA-N -1 3 363.465 3.621 20 0 FHADHM CSc1ccccc1NCc1ccc(-c2nnn[n-]2)cc1OC(F)F ZINC000821988863 606597007 /nfs/dbraw/zinc/59/70/07/606597007.db2.gz HWOVOUBWCFHQHP-UHFFFAOYSA-N -1 3 363.393 3.802 20 0 FHADHM CSc1ccccc1NCc1ccc(-c2nn[n-]n2)cc1OC(F)F ZINC000821988863 606597008 /nfs/dbraw/zinc/59/70/08/606597008.db2.gz HWOVOUBWCFHQHP-UHFFFAOYSA-N -1 3 363.393 3.802 20 0 FHADHM FC(F)Oc1cc(-c2nnn[n-]2)ccc1CNc1cccc(Cl)c1 ZINC000822732004 606597277 /nfs/dbraw/zinc/59/72/77/606597277.db2.gz HGIPOLIAKOGACM-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM FC(F)Oc1cc(-c2nn[n-]n2)ccc1CNc1cccc(Cl)c1 ZINC000822732004 606597278 /nfs/dbraw/zinc/59/72/78/606597278.db2.gz HGIPOLIAKOGACM-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM COc1cccc([C@H](C)CC(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c1 ZINC000821860010 606601169 /nfs/dbraw/zinc/60/11/69/606601169.db2.gz VXDUZCQCXOUBSQ-LLVKDONJSA-N -1 3 371.828 3.661 20 0 FHADHM COc1cccc([C@H](C)CC(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c1 ZINC000821860010 606601170 /nfs/dbraw/zinc/60/11/70/606601170.db2.gz VXDUZCQCXOUBSQ-LLVKDONJSA-N -1 3 371.828 3.661 20 0 FHADHM O=C(Nc1ccc(CCC(F)(F)F)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000823323330 606605743 /nfs/dbraw/zinc/60/57/43/606605743.db2.gz KSRAJHBGBUNSCR-UHFFFAOYSA-N -1 3 361.327 3.614 20 0 FHADHM O=C(Nc1ccc(CCC(F)(F)F)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000823323330 606605745 /nfs/dbraw/zinc/60/57/45/606605745.db2.gz KSRAJHBGBUNSCR-UHFFFAOYSA-N -1 3 361.327 3.614 20 0 FHADHM Cc1ccc(/C=C\CC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)cc1 ZINC000822233903 606619895 /nfs/dbraw/zinc/61/98/95/606619895.db2.gz XMZBCBIUPHCRHZ-IHWYPQMZSA-N -1 3 373.460 3.770 20 0 FHADHM Cc1ccc(/C=C\CC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)cc1 ZINC000822233903 606619896 /nfs/dbraw/zinc/61/98/96/606619896.db2.gz XMZBCBIUPHCRHZ-IHWYPQMZSA-N -1 3 373.460 3.770 20 0 FHADHM C[C@H](OC(=O)C/C=C/c1ccc(F)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000820486777 606626677 /nfs/dbraw/zinc/62/66/77/606626677.db2.gz CUIIUJSLAKSWDH-OHVSUOQFSA-N -1 3 352.369 3.714 20 0 FHADHM C[C@H](OC(=O)C/C=C/c1ccc(F)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000820486777 606626679 /nfs/dbraw/zinc/62/66/79/606626679.db2.gz CUIIUJSLAKSWDH-OHVSUOQFSA-N -1 3 352.369 3.714 20 0 FHADHM CC(C)CCc1noc(CSc2ccc(Cl)cc2-c2nnn[n-]2)n1 ZINC000820081487 606628322 /nfs/dbraw/zinc/62/83/22/606628322.db2.gz INCJCGDVCZEZGB-UHFFFAOYSA-N -1 3 364.862 3.784 20 0 FHADHM CC(C)CCc1noc(CSc2ccc(Cl)cc2-c2nn[n-]n2)n1 ZINC000820081487 606628325 /nfs/dbraw/zinc/62/83/25/606628325.db2.gz INCJCGDVCZEZGB-UHFFFAOYSA-N -1 3 364.862 3.784 20 0 FHADHM CC(C)c1noc([C@@H](C)Sc2ccc(Cl)cc2-c2nnn[n-]2)n1 ZINC000820211326 606628328 /nfs/dbraw/zinc/62/83/28/606628328.db2.gz IOWMWHCAARQGJU-MRVPVSSYSA-N -1 3 350.835 3.880 20 0 FHADHM CC(C)c1noc([C@@H](C)Sc2ccc(Cl)cc2-c2nn[n-]n2)n1 ZINC000820211326 606628330 /nfs/dbraw/zinc/62/83/30/606628330.db2.gz IOWMWHCAARQGJU-MRVPVSSYSA-N -1 3 350.835 3.880 20 0 FHADHM O=C(CC1CCCCCC1)Nc1cc(-c2nnn[n-]2)ccc1OC(F)F ZINC000822941102 606632595 /nfs/dbraw/zinc/63/25/95/606632595.db2.gz PVBLXPZZCBEBCX-UHFFFAOYSA-N -1 3 365.384 3.767 20 0 FHADHM O=C(CC1CCCCCC1)Nc1cc(-c2nn[n-]n2)ccc1OC(F)F ZINC000822941102 606632596 /nfs/dbraw/zinc/63/25/96/606632596.db2.gz PVBLXPZZCBEBCX-UHFFFAOYSA-N -1 3 365.384 3.767 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CC[C@H]1c1ccc(Cl)cc1 ZINC000822217804 606660789 /nfs/dbraw/zinc/66/07/89/606660789.db2.gz NYHFWWBJZMNSFF-INIZCTEOSA-N -1 3 368.828 3.807 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CC[C@H]1c1ccc(Cl)cc1 ZINC000822217804 606660790 /nfs/dbraw/zinc/66/07/90/606660790.db2.gz NYHFWWBJZMNSFF-INIZCTEOSA-N -1 3 368.828 3.807 20 0 FHADHM CC[C@@H](C)c1ccc(C(=O)N(C)c2ccc(-c3nnn[n-]3)cc2F)cc1 ZINC000820881817 606675744 /nfs/dbraw/zinc/67/57/44/606675744.db2.gz DIPIXOSVIXGEJJ-GFCCVEGCSA-N -1 3 353.401 3.796 20 0 FHADHM CC[C@@H](C)c1ccc(C(=O)N(C)c2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000820881817 606675745 /nfs/dbraw/zinc/67/57/45/606675745.db2.gz DIPIXOSVIXGEJJ-GFCCVEGCSA-N -1 3 353.401 3.796 20 0 FHADHM CC(C)C[C@H]1CCCCCN1C(=O)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000820063152 606681637 /nfs/dbraw/zinc/68/16/37/606681637.db2.gz RRJYNQNPYAHEJN-CYBMUJFWSA-N -1 3 363.412 3.576 20 0 FHADHM CC(C)C[C@H]1CCCCCN1C(=O)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000820063152 606681638 /nfs/dbraw/zinc/68/16/38/606681638.db2.gz RRJYNQNPYAHEJN-CYBMUJFWSA-N -1 3 363.412 3.576 20 0 FHADHM O=C(N[C@@H](c1ccccc1F)C1CCCC1)c1cc(-c2nnn[n-]2)cs1 ZINC000823139255 606693959 /nfs/dbraw/zinc/69/39/59/606693959.db2.gz AJXAQWMHQNACTH-MRXNPFEDSA-N -1 3 371.441 3.729 20 0 FHADHM O=C(N[C@@H](c1ccccc1F)C1CCCC1)c1cc(-c2nn[n-]n2)cs1 ZINC000823139255 606693960 /nfs/dbraw/zinc/69/39/60/606693960.db2.gz AJXAQWMHQNACTH-MRXNPFEDSA-N -1 3 371.441 3.729 20 0 FHADHM CCc1noc(CC)c1CNc1ccc(-c2nn[n-]n2)cc1C(F)(F)F ZINC000821558831 606724547 /nfs/dbraw/zinc/72/45/47/606724547.db2.gz GYGPNKYUJUMHLJ-UHFFFAOYSA-N -1 3 366.347 3.610 20 0 FHADHM CC[C@H](OC1CCCCC1)C(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820937916 606735888 /nfs/dbraw/zinc/73/58/88/606735888.db2.gz FHCVMPPQIDYVEA-DYVFJYSZSA-N -1 3 358.442 3.599 20 0 FHADHM CC[C@H](OC1CCCCC1)C(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820937916 606735890 /nfs/dbraw/zinc/73/58/90/606735890.db2.gz FHCVMPPQIDYVEA-DYVFJYSZSA-N -1 3 358.442 3.599 20 0 FHADHM O=C(O[C@@H]1CC[C@H]2CCCC[C@@H]2C1)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000823391826 606748134 /nfs/dbraw/zinc/74/81/34/606748134.db2.gz GPDBPQZETNJKBH-NQBHXWOUSA-N -1 3 362.380 3.661 20 0 FHADHM O=C(O[C@@H]1CC[C@H]2CCCC[C@@H]2C1)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000823391826 606748136 /nfs/dbraw/zinc/74/81/36/606748136.db2.gz GPDBPQZETNJKBH-NQBHXWOUSA-N -1 3 362.380 3.661 20 0 FHADHM CC(C)C[C@H](OC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1ccccn1 ZINC000820062169 606763997 /nfs/dbraw/zinc/76/39/97/606763997.db2.gz IMANUKQMIOJHJT-ZGKFYVQTSA-N -1 3 363.421 3.606 20 0 FHADHM CC(C)C[C@H](OC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1ccccn1 ZINC000820062169 606764000 /nfs/dbraw/zinc/76/40/00/606764000.db2.gz IMANUKQMIOJHJT-ZGKFYVQTSA-N -1 3 363.421 3.606 20 0 FHADHM Cc1nnc(-c2cccc(-c3nnn[n-]3)c2)n1CC[C@H]1CCC[C@H](C)C1 ZINC000822505452 606769980 /nfs/dbraw/zinc/76/99/80/606769980.db2.gz LBDAVPBVMPDZGT-DZGCQCFKSA-N -1 3 351.458 3.650 20 0 FHADHM Cc1nnc(-c2cccc(-c3nn[n-]n3)c2)n1CC[C@H]1CCC[C@H](C)C1 ZINC000822505452 606769981 /nfs/dbraw/zinc/76/99/81/606769981.db2.gz LBDAVPBVMPDZGT-DZGCQCFKSA-N -1 3 351.458 3.650 20 0 FHADHM CC(C)CN(C(=O)c1cc(F)cc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820081620 606788328 /nfs/dbraw/zinc/78/83/28/606788328.db2.gz NSGCDKHCYVDJLQ-UHFFFAOYSA-N -1 3 373.819 3.962 20 0 FHADHM CC(C)CN(C(=O)c1cc(F)cc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820081620 606788330 /nfs/dbraw/zinc/78/83/30/606788330.db2.gz NSGCDKHCYVDJLQ-UHFFFAOYSA-N -1 3 373.819 3.962 20 0 FHADHM CCc1cc2c(ncnc2Oc2cc(Cl)ccc2-c2nnn[n-]2)s1 ZINC000821476675 606789534 /nfs/dbraw/zinc/78/95/34/606789534.db2.gz QWNDQTYMTQUVLL-UHFFFAOYSA-N -1 3 358.814 3.880 20 0 FHADHM CCc1cc2c(ncnc2Oc2cc(Cl)ccc2-c2nn[n-]n2)s1 ZINC000821476675 606789536 /nfs/dbraw/zinc/78/95/36/606789536.db2.gz QWNDQTYMTQUVLL-UHFFFAOYSA-N -1 3 358.814 3.880 20 0 FHADHM CC[C@H](C)CS[C@@H](C)C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2 ZINC000820870754 606796231 /nfs/dbraw/zinc/79/62/31/606796231.db2.gz YYIMFKQBLVLENP-UWVGGRQHSA-N -1 3 365.528 3.523 20 0 FHADHM CC[C@H](C)CS[C@@H](C)C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2 ZINC000820870754 606796233 /nfs/dbraw/zinc/79/62/33/606796233.db2.gz YYIMFKQBLVLENP-UWVGGRQHSA-N -1 3 365.528 3.523 20 0 FHADHM CC(C)CC1(CNC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)CC1 ZINC000820062144 606835840 /nfs/dbraw/zinc/83/58/40/606835840.db2.gz HYAUKIVOLIFBNO-UHFFFAOYSA-N -1 3 370.501 3.613 20 0 FHADHM CC(C)CC1(CNC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)CC1 ZINC000820062144 606835842 /nfs/dbraw/zinc/83/58/42/606835842.db2.gz HYAUKIVOLIFBNO-UHFFFAOYSA-N -1 3 370.501 3.613 20 0 FHADHM C[C@@H](NC(=O)c1ccc(C(C)(C)C)s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820397707 606864785 /nfs/dbraw/zinc/86/47/85/606864785.db2.gz RGSJPMPIYZVKJU-LLVKDONJSA-N -1 3 355.467 3.717 20 0 FHADHM C[C@@H](NC(=O)c1ccc(C(C)(C)C)s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820397707 606864787 /nfs/dbraw/zinc/86/47/87/606864787.db2.gz RGSJPMPIYZVKJU-LLVKDONJSA-N -1 3 355.467 3.717 20 0 FHADHM CC1(C)CCCC[C@@H]1NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000820594701 606873992 /nfs/dbraw/zinc/87/39/92/606873992.db2.gz BQJWNMDVYOSVCP-KRWDZBQOSA-N -1 3 368.485 3.510 20 0 FHADHM CC1(C)CCCC[C@@H]1NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000820594701 606873993 /nfs/dbraw/zinc/87/39/93/606873993.db2.gz BQJWNMDVYOSVCP-KRWDZBQOSA-N -1 3 368.485 3.510 20 0 FHADHM Cc1nc(CCNc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)sc1C ZINC000822439556 606875157 /nfs/dbraw/zinc/87/51/57/606875157.db2.gz CCZVGWBILVCUFW-UHFFFAOYSA-N -1 3 368.388 3.613 20 0 FHADHM Cc1nc(CCNc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)sc1C ZINC000822440452 606875723 /nfs/dbraw/zinc/87/57/23/606875723.db2.gz MFDJQJBIYKNJFU-UHFFFAOYSA-N -1 3 368.388 3.613 20 0 FHADHM Cc1nc(CCNc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)sc1C ZINC000822440452 606875725 /nfs/dbraw/zinc/87/57/25/606875725.db2.gz MFDJQJBIYKNJFU-UHFFFAOYSA-N -1 3 368.388 3.613 20 0 FHADHM Cc1ccc(-c2cncc(C(=O)OCc3cccc(-c4nnn[n-]4)c3)c2)cc1 ZINC000822214047 606890128 /nfs/dbraw/zinc/89/01/28/606890128.db2.gz MYQWVDHUCXUHIP-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM Cc1ccc(-c2cncc(C(=O)OCc3cccc(-c4nn[n-]n4)c3)c2)cc1 ZINC000822214047 606890130 /nfs/dbraw/zinc/89/01/30/606890130.db2.gz MYQWVDHUCXUHIP-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM CCc1noc(CC)c1CNc1ccc(C(F)(F)F)cc1-c1nnn[n-]1 ZINC000821559107 606943444 /nfs/dbraw/zinc/94/34/44/606943444.db2.gz UDMCWZRNMNTHMU-UHFFFAOYSA-N -1 3 366.347 3.610 20 0 FHADHM CCc1noc(CC)c1CNc1ccc(C(F)(F)F)cc1-c1nn[n-]n1 ZINC000821559107 606943445 /nfs/dbraw/zinc/94/34/45/606943445.db2.gz UDMCWZRNMNTHMU-UHFFFAOYSA-N -1 3 366.347 3.610 20 0 FHADHM C[C@@H](Cc1cccc(F)c1)C(=O)N(C)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000820299684 606960347 /nfs/dbraw/zinc/96/03/47/606960347.db2.gz JCTOVMWGMLJOPK-NSHDSACASA-N -1 3 373.819 3.501 20 0 FHADHM C[C@@H](Cc1cccc(F)c1)C(=O)N(C)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000820299684 606960349 /nfs/dbraw/zinc/96/03/49/606960349.db2.gz JCTOVMWGMLJOPK-NSHDSACASA-N -1 3 373.819 3.501 20 0 FHADHM CSc1ccc(C)c(C(=O)N(C)c2cc(Cl)ccc2-c2nnn[n-]2)c1 ZINC000821976474 606963702 /nfs/dbraw/zinc/96/37/02/606963702.db2.gz BBXJEKBMRBEGFP-UHFFFAOYSA-N -1 3 373.869 3.827 20 0 FHADHM CSc1ccc(C)c(C(=O)N(C)c2cc(Cl)ccc2-c2nn[n-]n2)c1 ZINC000821976474 606963704 /nfs/dbraw/zinc/96/37/04/606963704.db2.gz BBXJEKBMRBEGFP-UHFFFAOYSA-N -1 3 373.869 3.827 20 0 FHADHM CCc1ccc([C@@H](C)C(=O)N(C)c2cc(Cl)ccc2-c2nnn[n-]2)cc1 ZINC000821476934 606964067 /nfs/dbraw/zinc/96/40/67/606964067.db2.gz VIAIUGXSGKWEID-GFCCVEGCSA-N -1 3 369.856 3.849 20 0 FHADHM CCc1ccc([C@@H](C)C(=O)N(C)c2cc(Cl)ccc2-c2nn[n-]n2)cc1 ZINC000821476934 606964068 /nfs/dbraw/zinc/96/40/68/606964068.db2.gz VIAIUGXSGKWEID-GFCCVEGCSA-N -1 3 369.856 3.849 20 0 FHADHM Cc1c2cc(Cl)ccc2oc1C(=O)N(C)c1ccccc1-c1nnn[n-]1 ZINC000822015822 606973504 /nfs/dbraw/zinc/97/35/04/606973504.db2.gz PICJCHRWPFCURG-UHFFFAOYSA-N -1 3 367.796 3.851 20 0 FHADHM Cc1c2cc(Cl)ccc2oc1C(=O)N(C)c1ccccc1-c1nn[n-]n1 ZINC000822015822 606973507 /nfs/dbraw/zinc/97/35/07/606973507.db2.gz PICJCHRWPFCURG-UHFFFAOYSA-N -1 3 367.796 3.851 20 0 FHADHM C[C@@H](NC(=O)Cc1ccc(C(C)(C)C)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820334252 606991931 /nfs/dbraw/zinc/99/19/31/606991931.db2.gz MCITVYPNEXYWCF-CQSZACIVSA-N -1 3 363.465 3.584 20 0 FHADHM C[C@@H](NC(=O)Cc1ccc(C(C)(C)C)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820334252 606991933 /nfs/dbraw/zinc/99/19/33/606991933.db2.gz MCITVYPNEXYWCF-CQSZACIVSA-N -1 3 363.465 3.584 20 0 FHADHM Fc1c(F)c(F)c(CSc2cccc(-c3nnn[n-]3)c2)c(F)c1F ZINC000822736719 607017522 /nfs/dbraw/zinc/01/75/22/607017522.db2.gz IYUWVUUVYSORRU-UHFFFAOYSA-N -1 3 358.295 3.855 20 0 FHADHM Fc1c(F)c(F)c(CSc2cccc(-c3nn[n-]n3)c2)c(F)c1F ZINC000822736719 607017523 /nfs/dbraw/zinc/01/75/23/607017523.db2.gz IYUWVUUVYSORRU-UHFFFAOYSA-N -1 3 358.295 3.855 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)N(C1CC1)C1CCCCC1 ZINC000823303524 607022460 /nfs/dbraw/zinc/02/24/60/607022460.db2.gz LMKZLTGUMWHREA-UHFFFAOYSA-N -1 3 360.849 3.849 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)N(C1CC1)C1CCCCC1 ZINC000823303524 607022462 /nfs/dbraw/zinc/02/24/62/607022462.db2.gz LMKZLTGUMWHREA-UHFFFAOYSA-N -1 3 360.849 3.849 20 0 FHADHM FC(F)C1CCN(c2c(-c3nnn[n-]3)cnc3ccc(Cl)cc32)CC1 ZINC000822728965 607040473 /nfs/dbraw/zinc/04/04/73/607040473.db2.gz OZUQKRUNWSMJGP-UHFFFAOYSA-N -1 3 364.787 3.550 20 0 FHADHM FC(F)C1CCN(c2c(-c3nn[n-]n3)cnc3ccc(Cl)cc32)CC1 ZINC000822728965 607040475 /nfs/dbraw/zinc/04/04/75/607040475.db2.gz OZUQKRUNWSMJGP-UHFFFAOYSA-N -1 3 364.787 3.550 20 0 FHADHM CCC(CC)CC(=O)N(Cc1ccco1)c1ccccc1-c1nnn[n-]1 ZINC000820893163 607054675 /nfs/dbraw/zinc/05/46/75/607054675.db2.gz LHNTYDRWDDDNDD-UHFFFAOYSA-N -1 3 353.426 3.819 20 0 FHADHM CCC(CC)CC(=O)N(Cc1ccco1)c1ccccc1-c1nn[n-]n1 ZINC000820893163 607054677 /nfs/dbraw/zinc/05/46/77/607054677.db2.gz LHNTYDRWDDDNDD-UHFFFAOYSA-N -1 3 353.426 3.819 20 0 FHADHM C[C@H](Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccccc1-n1cccn1 ZINC000820456322 607118929 /nfs/dbraw/zinc/11/89/29/607118929.db2.gz SLZPGTJOERGMKH-LBPRGKRZSA-N -1 3 365.828 3.879 20 0 FHADHM C[C@H](Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccccc1-n1cccn1 ZINC000820456322 607118931 /nfs/dbraw/zinc/11/89/31/607118931.db2.gz SLZPGTJOERGMKH-LBPRGKRZSA-N -1 3 365.828 3.879 20 0 FHADHM FC(F)Oc1ccc(CNc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000822731902 607125094 /nfs/dbraw/zinc/12/50/94/607125094.db2.gz DQQVHUGCDSAXKA-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM Fc1cccc(-c2cnc(CNc3ccc(-c4nn[n-]n4)cc3Cl)o2)c1 ZINC000822786108 607126459 /nfs/dbraw/zinc/12/64/59/607126459.db2.gz DLHZRPAICSAFFX-UHFFFAOYSA-N -1 3 370.775 3.926 20 0 FHADHM FC(F)(F)c1cc(N[C@@H]2CCOC3(CCCC3)C2)ccc1-c1nnn[n-]1 ZINC000822723972 607130060 /nfs/dbraw/zinc/13/00/60/607130060.db2.gz VCWQZHHGANECKR-GFCCVEGCSA-N -1 3 367.375 3.789 20 0 FHADHM FC(F)(F)c1cc(N[C@@H]2CCOC3(CCCC3)C2)ccc1-c1nn[n-]n1 ZINC000822723972 607130061 /nfs/dbraw/zinc/13/00/61/607130061.db2.gz VCWQZHHGANECKR-GFCCVEGCSA-N -1 3 367.375 3.789 20 0 FHADHM Fc1cc(F)c2ncc(-c3nnn[n-]3)c(N[C@@H]3CCCC(F)(F)C3)c2c1 ZINC000822753604 607131053 /nfs/dbraw/zinc/13/10/53/607131053.db2.gz PDLKKKNUENLFDJ-SECBINFHSA-N -1 3 366.322 3.683 20 0 FHADHM Fc1cc(F)c2ncc(-c3nn[n-]n3)c(N[C@@H]3CCCC(F)(F)C3)c2c1 ZINC000822753604 607131054 /nfs/dbraw/zinc/13/10/54/607131054.db2.gz PDLKKKNUENLFDJ-SECBINFHSA-N -1 3 366.322 3.683 20 0 FHADHM C[C@@H](OC1CCCCCC1)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820518558 607149870 /nfs/dbraw/zinc/14/98/70/607149870.db2.gz GQENIBPSSPVCFE-LLVKDONJSA-N -1 3 363.849 3.587 20 0 FHADHM C[C@@H](OC1CCCCCC1)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820518558 607149872 /nfs/dbraw/zinc/14/98/72/607149872.db2.gz GQENIBPSSPVCFE-LLVKDONJSA-N -1 3 363.849 3.587 20 0 FHADHM Cc1cccc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CC[C@@H](C)C3)c1F ZINC000822284533 607150806 /nfs/dbraw/zinc/15/08/06/607150806.db2.gz TYMYJQYSZVLNQA-SECBINFHSA-N -1 3 371.441 3.753 20 0 FHADHM Cc1cccc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CC[C@@H](C)C3)c1F ZINC000822284533 607150807 /nfs/dbraw/zinc/15/08/07/607150807.db2.gz TYMYJQYSZVLNQA-SECBINFHSA-N -1 3 371.441 3.753 20 0 FHADHM CCC[C@H](C)[C@H]1CCCN1C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821014202 607152953 /nfs/dbraw/zinc/15/29/53/607152953.db2.gz BTHPAJHDVGHHAA-GRDNDAEWSA-N -1 3 356.474 3.538 20 0 FHADHM CCC[C@H](C)[C@H]1CCCN1C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821014202 607152954 /nfs/dbraw/zinc/15/29/54/607152954.db2.gz BTHPAJHDVGHHAA-GRDNDAEWSA-N -1 3 356.474 3.538 20 0 FHADHM CCc1oc(C(=O)N(CC)[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1C ZINC000821559011 607153695 /nfs/dbraw/zinc/15/36/95/607153695.db2.gz OYZIJRLUZPNTJC-ZDUSSCGKSA-N -1 3 353.426 3.554 20 0 FHADHM CCc1oc(C(=O)N(CC)[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1C ZINC000821559011 607153696 /nfs/dbraw/zinc/15/36/96/607153696.db2.gz OYZIJRLUZPNTJC-ZDUSSCGKSA-N -1 3 353.426 3.554 20 0 FHADHM Cc1cccc(C(=O)N(CC(C)C)c2ccc(-c3nnn[n-]3)cc2)c1F ZINC000822284030 607154309 /nfs/dbraw/zinc/15/43/09/607154309.db2.gz GTOUZRRFCILSIR-UHFFFAOYSA-N -1 3 353.401 3.617 20 0 FHADHM Cc1cccc(C(=O)N(CC(C)C)c2ccc(-c3nn[n-]n3)cc2)c1F ZINC000822284030 607154310 /nfs/dbraw/zinc/15/43/10/607154310.db2.gz GTOUZRRFCILSIR-UHFFFAOYSA-N -1 3 353.401 3.617 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1ccc(F)c(Cl)c1 ZINC000821123442 607156338 /nfs/dbraw/zinc/15/63/38/607156338.db2.gz SSKDNIYYTFIIQN-UHFFFAOYSA-N -1 3 374.807 3.733 20 0 FHADHM O=C(CCc1ccc(-c2nnn[n-]2)cc1)N1CCC[C@H]1CCC1CCCC1 ZINC000822978172 607163179 /nfs/dbraw/zinc/16/31/79/607163179.db2.gz DSLGHUMSZNEOFM-IBGZPJMESA-N -1 3 367.497 3.761 20 0 FHADHM O=C(CCc1ccc(-c2nn[n-]n2)cc1)N1CCC[C@H]1CCC1CCCC1 ZINC000822978172 607163181 /nfs/dbraw/zinc/16/31/81/607163181.db2.gz DSLGHUMSZNEOFM-IBGZPJMESA-N -1 3 367.497 3.761 20 0 FHADHM Cc1cccc(-c2cncc(C(=O)OCc3cccc(-c4nnn[n-]4)c3)c2)c1 ZINC000822283745 607179582 /nfs/dbraw/zinc/17/95/82/607179582.db2.gz BXQXVNNDIHUFAC-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM Cc1cccc(-c2cncc(C(=O)OCc3cccc(-c4nn[n-]n4)c3)c2)c1 ZINC000822283745 607179583 /nfs/dbraw/zinc/17/95/83/607179583.db2.gz BXQXVNNDIHUFAC-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM CCCOc1cccc(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)c1 ZINC000821134081 607189138 /nfs/dbraw/zinc/18/91/38/607189138.db2.gz NGRYNTIXEGPFBX-UHFFFAOYSA-N -1 3 357.801 3.561 20 0 FHADHM CCCOc1cccc(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)c1 ZINC000821134081 607189139 /nfs/dbraw/zinc/18/91/39/607189139.db2.gz NGRYNTIXEGPFBX-UHFFFAOYSA-N -1 3 357.801 3.561 20 0 FHADHM Cc1ccccc1OCCCC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822366602 607189975 /nfs/dbraw/zinc/18/99/75/607189975.db2.gz OTTXFLSFNCBALI-UHFFFAOYSA-N -1 3 371.828 3.626 20 0 FHADHM Cc1ccccc1OCCCC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822366602 607189976 /nfs/dbraw/zinc/18/99/76/607189976.db2.gz OTTXFLSFNCBALI-UHFFFAOYSA-N -1 3 371.828 3.626 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)c1cccc(C(F)(F)F)c1 ZINC000823318625 607190321 /nfs/dbraw/zinc/19/03/21/607190321.db2.gz GASUZFDSBBAAPM-UHFFFAOYSA-N -1 3 367.718 3.791 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)c1cccc(C(F)(F)F)c1 ZINC000823318625 607190322 /nfs/dbraw/zinc/19/03/22/607190322.db2.gz GASUZFDSBBAAPM-UHFFFAOYSA-N -1 3 367.718 3.791 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccc(F)cc1Cl ZINC000823319815 607190461 /nfs/dbraw/zinc/19/04/61/607190461.db2.gz YTIQQPIRDJFKFR-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccc(F)cc1Cl ZINC000823319815 607190462 /nfs/dbraw/zinc/19/04/62/607190462.db2.gz YTIQQPIRDJFKFR-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM Cc1ccccc1[C@@H](C)CC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822345932 607190932 /nfs/dbraw/zinc/19/09/32/607190932.db2.gz WXKPFXJGCDYMMO-LBPRGKRZSA-N -1 3 355.829 3.961 20 0 FHADHM Cc1ccccc1[C@@H](C)CC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822345932 607190933 /nfs/dbraw/zinc/19/09/33/607190933.db2.gz WXKPFXJGCDYMMO-LBPRGKRZSA-N -1 3 355.829 3.961 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)[C@H]1C[C@H]1c1cccc(Cl)c1 ZINC000823314988 607191295 /nfs/dbraw/zinc/19/12/95/607191295.db2.gz VYUMGQXXSGJEIW-STQMWFEESA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)[C@H]1C[C@H]1c1cccc(Cl)c1 ZINC000823314988 607191296 /nfs/dbraw/zinc/19/12/96/607191296.db2.gz VYUMGQXXSGJEIW-STQMWFEESA-N -1 3 374.231 3.916 20 0 FHADHM CC(C)(CC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccccc1 ZINC000819976091 607191650 /nfs/dbraw/zinc/19/16/50/607191650.db2.gz LKEIRKQQDRUYAY-UHFFFAOYSA-N -1 3 355.829 3.827 20 0 FHADHM CC(C)(CC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccccc1 ZINC000819976091 607191651 /nfs/dbraw/zinc/19/16/51/607191651.db2.gz LKEIRKQQDRUYAY-UHFFFAOYSA-N -1 3 355.829 3.827 20 0 FHADHM C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820813642 607195407 /nfs/dbraw/zinc/19/54/07/607195407.db2.gz LIGRLLDLZOLYMV-QLJPJBMISA-N -1 3 368.828 3.575 20 0 FHADHM C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820813642 607195408 /nfs/dbraw/zinc/19/54/08/607195408.db2.gz LIGRLLDLZOLYMV-QLJPJBMISA-N -1 3 368.828 3.575 20 0 FHADHM CC(C)N(Cc1ccco1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820121622 607201601 /nfs/dbraw/zinc/20/16/01/607201601.db2.gz SGILULMRVMFXOO-UHFFFAOYSA-N -1 3 360.805 3.556 20 0 FHADHM CC(C)N(Cc1ccco1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820121622 607201602 /nfs/dbraw/zinc/20/16/02/607201602.db2.gz SGILULMRVMFXOO-UHFFFAOYSA-N -1 3 360.805 3.556 20 0 FHADHM C[C@H]1C[C@H]1c1ccc(CNC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)o1 ZINC000820674859 607202532 /nfs/dbraw/zinc/20/25/32/607202532.db2.gz GTRHYLMXHMDXLX-JOYOIKCWSA-N -1 3 372.816 3.558 20 0 FHADHM C[C@H]1C[C@H]1c1ccc(CNC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)o1 ZINC000820674859 607202533 /nfs/dbraw/zinc/20/25/33/607202533.db2.gz GTRHYLMXHMDXLX-JOYOIKCWSA-N -1 3 372.816 3.558 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)[C@@H](C)c1ccccc1 ZINC000820374853 607204136 /nfs/dbraw/zinc/20/41/36/607204136.db2.gz ROGTVCORMXMVHE-VXGBXAGGSA-N -1 3 370.844 3.834 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)[C@@H](C)c1ccccc1 ZINC000820374853 607204137 /nfs/dbraw/zinc/20/41/37/607204137.db2.gz ROGTVCORMXMVHE-VXGBXAGGSA-N -1 3 370.844 3.834 20 0 FHADHM CN(C(=O)c1ccc(-c2ccco2)s1)c1ccc(-c2nnn[n-]2)cc1F ZINC000821573357 607238188 /nfs/dbraw/zinc/23/81/88/607238188.db2.gz MWKYELPTJLDLHR-UHFFFAOYSA-N -1 3 369.381 3.604 20 0 FHADHM CN(C(=O)c1ccc(-c2ccco2)s1)c1ccc(-c2nn[n-]n2)cc1F ZINC000821573357 607238189 /nfs/dbraw/zinc/23/81/89/607238189.db2.gz MWKYELPTJLDLHR-UHFFFAOYSA-N -1 3 369.381 3.604 20 0 FHADHM CC[C@@H](C)Oc1ccc(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000820876555 607241317 /nfs/dbraw/zinc/24/13/17/607241317.db2.gz REDUAVWPKSNVDM-LLVKDONJSA-N -1 3 371.828 3.950 20 0 FHADHM CC[C@@H](C)Oc1ccc(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000820876555 607241318 /nfs/dbraw/zinc/24/13/18/607241318.db2.gz REDUAVWPKSNVDM-LLVKDONJSA-N -1 3 371.828 3.950 20 0 FHADHM CC(C)(C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccc(F)cc1 ZINC000819891905 607242053 /nfs/dbraw/zinc/24/20/53/607242053.db2.gz KUMQJETUXQFKAF-UHFFFAOYSA-N -1 3 359.792 3.576 20 0 FHADHM CC(C)(C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccc(F)cc1 ZINC000819891905 607242054 /nfs/dbraw/zinc/24/20/54/607242054.db2.gz KUMQJETUXQFKAF-UHFFFAOYSA-N -1 3 359.792 3.576 20 0 FHADHM Cc1ccc(CC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)c(Cl)c1 ZINC000822234633 607242369 /nfs/dbraw/zinc/24/23/69/607242369.db2.gz BXGGSBJPLWVHNB-UHFFFAOYSA-N -1 3 362.220 3.663 20 0 FHADHM Cc1ccc(CC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)c(Cl)c1 ZINC000822234633 607242370 /nfs/dbraw/zinc/24/23/70/607242370.db2.gz BXGGSBJPLWVHNB-UHFFFAOYSA-N -1 3 362.220 3.663 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@@H](C)c2cccc(F)c2)cc1-c1nnn[n-]1 ZINC000825552730 607783931 /nfs/dbraw/zinc/78/39/31/607783931.db2.gz DCZCDRYJVJPGBY-NSHDSACASA-N -1 3 370.388 3.747 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@@H](C)c2cccc(F)c2)cc1-c1nn[n-]n1 ZINC000825552730 607783932 /nfs/dbraw/zinc/78/39/32/607783932.db2.gz DCZCDRYJVJPGBY-NSHDSACASA-N -1 3 370.388 3.747 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@@H](C)c2ccccc2C)cc1-c1nnn[n-]1 ZINC000825553532 607783936 /nfs/dbraw/zinc/78/39/36/607783936.db2.gz SJUGUEHAGUQVPA-ZDUSSCGKSA-N -1 3 366.425 3.917 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@@H](C)c2ccccc2C)cc1-c1nn[n-]n1 ZINC000825553532 607783937 /nfs/dbraw/zinc/78/39/37/607783937.db2.gz SJUGUEHAGUQVPA-ZDUSSCGKSA-N -1 3 366.425 3.917 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@H](C)c2ccccc2C)cc1-c1nnn[n-]1 ZINC000825553531 607783967 /nfs/dbraw/zinc/78/39/67/607783967.db2.gz SJUGUEHAGUQVPA-CYBMUJFWSA-N -1 3 366.425 3.917 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@H](C)c2ccccc2C)cc1-c1nn[n-]n1 ZINC000825553531 607783968 /nfs/dbraw/zinc/78/39/68/607783968.db2.gz SJUGUEHAGUQVPA-CYBMUJFWSA-N -1 3 366.425 3.917 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@@H]2C(=O)N(C)c2ccccc2-c2nnn[n-]2)cc1 ZINC000824347831 607787922 /nfs/dbraw/zinc/78/79/22/607787922.db2.gz PCCMTZNSIBJVLD-MSOLQXFVSA-N -1 3 361.449 3.757 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@@H]2C(=O)N(C)c2ccccc2-c2nn[n-]n2)cc1 ZINC000824347831 607787923 /nfs/dbraw/zinc/78/79/23/607787923.db2.gz PCCMTZNSIBJVLD-MSOLQXFVSA-N -1 3 361.449 3.757 20 0 FHADHM CN(C(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1)c1ccccc1-c1nnn[n-]1 ZINC000825812848 607789099 /nfs/dbraw/zinc/78/90/99/607789099.db2.gz VXFUEHUYCZVRIQ-RBUKOAKNSA-N -1 3 369.428 3.786 20 0 FHADHM CN(C(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1)c1ccccc1-c1nn[n-]n1 ZINC000825812848 607789100 /nfs/dbraw/zinc/78/91/00/607789100.db2.gz VXFUEHUYCZVRIQ-RBUKOAKNSA-N -1 3 369.428 3.786 20 0 FHADHM C[C@H](Sc1ccccc1Cl)C(=O)N(C)c1ccccc1-c1nnn[n-]1 ZINC000824763273 607790554 /nfs/dbraw/zinc/79/05/54/607790554.db2.gz MMSRPUOQUSKZOH-NSHDSACASA-N -1 3 373.869 3.664 20 0 FHADHM C[C@H](Sc1ccccc1Cl)C(=O)N(C)c1ccccc1-c1nn[n-]n1 ZINC000824763273 607790555 /nfs/dbraw/zinc/79/05/55/607790555.db2.gz MMSRPUOQUSKZOH-NSHDSACASA-N -1 3 373.869 3.664 20 0 FHADHM Cc1ccc(Cl)cc1C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000826289015 607794052 /nfs/dbraw/zinc/79/40/52/607794052.db2.gz GZHATAJFRIPFTA-UHFFFAOYSA-N -1 3 358.833 3.637 20 0 FHADHM Cc1ccc(Cl)cc1C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000826289015 607794053 /nfs/dbraw/zinc/79/40/53/607794053.db2.gz GZHATAJFRIPFTA-UHFFFAOYSA-N -1 3 358.833 3.637 20 0 FHADHM CCN(C(=O)c1cc(C)c(F)cc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000825380788 607799977 /nfs/dbraw/zinc/79/99/77/607799977.db2.gz TYCFERSEOJNHPN-UHFFFAOYSA-N -1 3 359.792 3.634 20 0 FHADHM CCN(C(=O)c1cc(C)c(F)cc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000825380788 607799978 /nfs/dbraw/zinc/79/99/78/607799978.db2.gz TYCFERSEOJNHPN-UHFFFAOYSA-N -1 3 359.792 3.634 20 0 FHADHM CCCC(CCC)C(=O)Nc1ccc(NC(=O)OCC)c(-c2nnn[n-]2)c1 ZINC000825242051 607801176 /nfs/dbraw/zinc/80/11/76/607801176.db2.gz GZIKKMXUFZMUIE-UHFFFAOYSA-N -1 3 374.445 3.590 20 0 FHADHM CCCC(CCC)C(=O)Nc1ccc(NC(=O)OCC)c(-c2nn[n-]n2)c1 ZINC000825242051 607801177 /nfs/dbraw/zinc/80/11/77/607801177.db2.gz GZIKKMXUFZMUIE-UHFFFAOYSA-N -1 3 374.445 3.590 20 0 FHADHM CC(C)(C)O[C@@H](C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccccc1 ZINC000824119654 607817430 /nfs/dbraw/zinc/81/74/30/607817430.db2.gz MXCRTYCTGGLTPL-MRXNPFEDSA-N -1 3 369.400 3.501 20 0 FHADHM CC(C)(C)O[C@@H](C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccccc1 ZINC000824119654 607817431 /nfs/dbraw/zinc/81/74/31/607817431.db2.gz MXCRTYCTGGLTPL-MRXNPFEDSA-N -1 3 369.400 3.501 20 0 FHADHM C[C@@H](Cc1ccccc1Cl)C(=O)N(C)c1ccc(-c2nnn[n-]2)cc1F ZINC000824457495 607826929 /nfs/dbraw/zinc/82/69/29/607826929.db2.gz NXNVHMKEKYMSEJ-NSHDSACASA-N -1 3 373.819 3.501 20 0 FHADHM C[C@@H](Cc1ccccc1Cl)C(=O)N(C)c1ccc(-c2nn[n-]n2)cc1F ZINC000824457495 607826930 /nfs/dbraw/zinc/82/69/30/607826930.db2.gz NXNVHMKEKYMSEJ-NSHDSACASA-N -1 3 373.819 3.501 20 0 FHADHM Cc1ccc(CC(=O)Nc2sc(-c3ccccc3)cc2-c2nnn[n-]2)o1 ZINC000826286879 607827454 /nfs/dbraw/zinc/82/74/54/607827454.db2.gz UPIMAWITKPNORD-UHFFFAOYSA-N -1 3 365.418 3.678 20 0 FHADHM Cc1ccc(CC(=O)Nc2sc(-c3ccccc3)cc2-c2nn[n-]n2)o1 ZINC000826286879 607827455 /nfs/dbraw/zinc/82/74/55/607827455.db2.gz UPIMAWITKPNORD-UHFFFAOYSA-N -1 3 365.418 3.678 20 0 FHADHM Cc1ccc(F)cc1NC(=O)c1c(Cl)cc(-c2nnn[n-]2)cc1Cl ZINC000826290030 607832614 /nfs/dbraw/zinc/83/26/14/607832614.db2.gz XEVORIKEGWOEQK-UHFFFAOYSA-N -1 3 366.183 3.873 20 0 FHADHM Cc1ccc(F)cc1NC(=O)c1c(Cl)cc(-c2nn[n-]n2)cc1Cl ZINC000826290030 607832615 /nfs/dbraw/zinc/83/26/15/607832615.db2.gz XEVORIKEGWOEQK-UHFFFAOYSA-N -1 3 366.183 3.873 20 0 FHADHM CCN(C(=O)CCCCCCC(C)=O)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825371384 607834011 /nfs/dbraw/zinc/83/40/11/607834011.db2.gz FYDQNQKXXUJVJT-MRXNPFEDSA-N -1 3 371.485 3.706 20 0 FHADHM CCN(C(=O)CCCCCCC(C)=O)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825371384 607834012 /nfs/dbraw/zinc/83/40/12/607834012.db2.gz FYDQNQKXXUJVJT-MRXNPFEDSA-N -1 3 371.485 3.706 20 0 FHADHM Cc1ccccc1NC(=O)CCSc1ccc(-c2nnn[n-]2)cc1Cl ZINC000826307768 607842904 /nfs/dbraw/zinc/84/29/04/607842904.db2.gz WFJZPFPGJCNTDU-UHFFFAOYSA-N -1 3 373.869 3.949 20 0 FHADHM Cc1ccccc1NC(=O)CCSc1ccc(-c2nn[n-]n2)cc1Cl ZINC000826307768 607842905 /nfs/dbraw/zinc/84/29/05/607842905.db2.gz WFJZPFPGJCNTDU-UHFFFAOYSA-N -1 3 373.869 3.949 20 0 FHADHM Cc1ccc(NC(=O)CSc2ccc(-c3nnn[n-]3)cc2Cl)cc1C ZINC000826291079 607844912 /nfs/dbraw/zinc/84/49/12/607844912.db2.gz NYPOHEPTQUBWMO-UHFFFAOYSA-N -1 3 373.869 3.868 20 0 FHADHM Cc1ccc(NC(=O)CSc2ccc(-c3nn[n-]n3)cc2Cl)cc1C ZINC000826291079 607844913 /nfs/dbraw/zinc/84/49/13/607844913.db2.gz NYPOHEPTQUBWMO-UHFFFAOYSA-N -1 3 373.869 3.868 20 0 FHADHM Cc1c(C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)cccc1-c1ccccn1 ZINC000826234744 607855786 /nfs/dbraw/zinc/85/57/86/607855786.db2.gz LVYSQXUOFHLQGF-UHFFFAOYSA-N -1 3 374.379 3.629 20 0 FHADHM Cc1c(C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)cccc1-c1ccccn1 ZINC000826234744 607855787 /nfs/dbraw/zinc/85/57/87/607855787.db2.gz LVYSQXUOFHLQGF-UHFFFAOYSA-N -1 3 374.379 3.629 20 0 FHADHM CCN(C(=O)CSc1ccccc1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825376765 607878971 /nfs/dbraw/zinc/87/89/71/607878971.db2.gz NHYVTOZVWZUMSZ-UHFFFAOYSA-N -1 3 373.869 3.665 20 0 FHADHM CCN(C(=O)CSc1ccccc1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825376765 607878972 /nfs/dbraw/zinc/87/89/72/607878972.db2.gz NHYVTOZVWZUMSZ-UHFFFAOYSA-N -1 3 373.869 3.665 20 0 FHADHM C[C@H](NC(=O)[C@@H]1CC[C@H]2CCCC[C@@H]2C1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824472992 607881171 /nfs/dbraw/zinc/88/11/71/607881171.db2.gz YAQPSRUFAPJCJY-PAYONLEZSA-N -1 3 353.470 3.650 20 0 FHADHM C[C@H](NC(=O)[C@@H]1CC[C@H]2CCCC[C@@H]2C1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824472992 607881172 /nfs/dbraw/zinc/88/11/72/607881172.db2.gz YAQPSRUFAPJCJY-PAYONLEZSA-N -1 3 353.470 3.650 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@H](C)Cc1cccc(Cl)c1 ZINC000826277090 607889596 /nfs/dbraw/zinc/88/95/96/607889596.db2.gz IZHSDNGJTAQVCS-GFCCVEGCSA-N -1 3 355.829 3.646 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@H](C)Cc1cccc(Cl)c1 ZINC000826277090 607889597 /nfs/dbraw/zinc/88/95/97/607889597.db2.gz IZHSDNGJTAQVCS-GFCCVEGCSA-N -1 3 355.829 3.646 20 0 FHADHM Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000826323497 607913294 /nfs/dbraw/zinc/91/32/94/607913294.db2.gz GUHNJMNRBWQGNB-LBPRGKRZSA-N -1 3 370.482 3.588 20 0 FHADHM Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC000826323497 607913295 /nfs/dbraw/zinc/91/32/95/607913295.db2.gz GUHNJMNRBWQGNB-LBPRGKRZSA-N -1 3 370.482 3.588 20 0 FHADHM c1sc(C2CC2)nc1CSc1nc2c(cc1-c1nnn[n-]1)CCCC2 ZINC000826527116 607966101 /nfs/dbraw/zinc/96/61/01/607966101.db2.gz ZNOJIQLOJDIUSS-UHFFFAOYSA-N -1 3 370.507 3.767 20 0 FHADHM c1sc(C2CC2)nc1CSc1nc2c(cc1-c1nn[n-]n1)CCCC2 ZINC000826527116 607966102 /nfs/dbraw/zinc/96/61/02/607966102.db2.gz ZNOJIQLOJDIUSS-UHFFFAOYSA-N -1 3 370.507 3.767 20 0 FHADHM CCN(Cc1csc(C2CC2)n1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825444258 607983266 /nfs/dbraw/zinc/98/32/66/607983266.db2.gz KQWVERXMAXNZQG-GFCCVEGCSA-N -1 3 354.483 3.784 20 0 FHADHM CCN(Cc1csc(C2CC2)n1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825444258 607983267 /nfs/dbraw/zinc/98/32/67/607983267.db2.gz KQWVERXMAXNZQG-GFCCVEGCSA-N -1 3 354.483 3.784 20 0 FHADHM COc1ccc(CSCc2ccc3ccccc3n2)cc1-c1nnn[n-]1 ZINC000826207730 607983923 /nfs/dbraw/zinc/98/39/23/607983923.db2.gz ANFVVJUYRXMFST-UHFFFAOYSA-N -1 3 363.446 3.857 20 0 FHADHM COc1ccc(CSCc2ccc3ccccc3n2)cc1-c1nn[n-]n1 ZINC000826207730 607983924 /nfs/dbraw/zinc/98/39/24/607983924.db2.gz ANFVVJUYRXMFST-UHFFFAOYSA-N -1 3 363.446 3.857 20 0 FHADHM Cc1c(NC(=O)N2Cc3ccccc3C(C)(C)C2)cccc1-c1nnn[n-]1 ZINC000826241980 608007837 /nfs/dbraw/zinc/00/78/37/608007837.db2.gz VWIYCANTJJPQEC-UHFFFAOYSA-N -1 3 362.437 3.500 20 0 FHADHM Cc1c(NC(=O)N2Cc3ccccc3C(C)(C)C2)cccc1-c1nn[n-]n1 ZINC000826241980 608007838 /nfs/dbraw/zinc/00/78/38/608007838.db2.gz VWIYCANTJJPQEC-UHFFFAOYSA-N -1 3 362.437 3.500 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)C1(c2ccc(F)cc2F)CCCC1 ZINC000122500463 608023954 /nfs/dbraw/zinc/02/39/54/608023954.db2.gz HMDAIMSJODKLSS-UHFFFAOYSA-N -1 3 369.375 3.595 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)C1(c2ccc(F)cc2F)CCCC1 ZINC000122500463 608023955 /nfs/dbraw/zinc/02/39/55/608023955.db2.gz HMDAIMSJODKLSS-UHFFFAOYSA-N -1 3 369.375 3.595 20 0 FHADHM O=C(c1sccc1-c1nnn[n-]1)N1CCCC[C@@H]1CCc1ccccc1 ZINC000826475519 608032322 /nfs/dbraw/zinc/03/23/22/608032322.db2.gz IMUPOGWMFSHYFM-OAHLLOKOSA-N -1 3 367.478 3.556 20 0 FHADHM O=C(c1sccc1-c1nn[n-]n1)N1CCCC[C@@H]1CCc1ccccc1 ZINC000826475519 608032323 /nfs/dbraw/zinc/03/23/23/608032323.db2.gz IMUPOGWMFSHYFM-OAHLLOKOSA-N -1 3 367.478 3.556 20 0 FHADHM C[C@@H](Nc1ccc(-c2nn[n-]n2)cc1Br)c1cccs1 ZINC000824647956 608047074 /nfs/dbraw/zinc/04/70/74/608047074.db2.gz CLTAWSWFNFRFIQ-MRVPVSSYSA-N -1 3 350.245 3.864 20 0 FHADHM Cc1noc(-c2ccc(Oc3ccccc3-c3nnn[n-]3)c(Cl)c2)n1 ZINC000826338287 608050355 /nfs/dbraw/zinc/05/03/55/608050355.db2.gz QBIQIARQQRPILJ-UHFFFAOYSA-N -1 3 354.757 3.671 20 0 FHADHM Cc1noc(-c2ccc(Oc3ccccc3-c3nn[n-]n3)c(Cl)c2)n1 ZINC000826338287 608050356 /nfs/dbraw/zinc/05/03/56/608050356.db2.gz QBIQIARQQRPILJ-UHFFFAOYSA-N -1 3 354.757 3.671 20 0 FHADHM Cc1cnc([C@@H](C)Nc2ccc(-c3nn[n-]n3)cc2Br)s1 ZINC000826317758 608050853 /nfs/dbraw/zinc/05/08/53/608050853.db2.gz MQYFYBIDTJBLKK-MRVPVSSYSA-N -1 3 365.260 3.567 20 0 FHADHM C[C@H](c1ccccc1Cl)N1CCO[C@H](c2cccc(-c3nnn[n-]3)c2)C1 ZINC000824772606 608066004 /nfs/dbraw/zinc/06/60/04/608066004.db2.gz VRNKGADFIMEQGL-ACJLOTCBSA-N -1 3 369.856 3.655 20 0 FHADHM C[C@H](c1ccccc1Cl)N1CCO[C@H](c2cccc(-c3nn[n-]n3)c2)C1 ZINC000824772606 608066005 /nfs/dbraw/zinc/06/60/05/608066005.db2.gz VRNKGADFIMEQGL-ACJLOTCBSA-N -1 3 369.856 3.655 20 0 FHADHM CC(C)(C)[C@@H]1C[C@H](Nc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)CCO1 ZINC000824078603 608149319 /nfs/dbraw/zinc/14/93/19/608149319.db2.gz JIJJKERAWCPQDY-RISCZKNCSA-N -1 3 369.391 3.891 20 0 FHADHM Cc1cnc([C@@H](C)SCc2ccc(-c3nnn[n-]3)cc2OC(F)F)o1 ZINC000826317475 608154231 /nfs/dbraw/zinc/15/42/31/608154231.db2.gz DTUSECCKLYTNLF-SECBINFHSA-N -1 3 367.381 3.759 20 0 FHADHM Cc1cnc([C@@H](C)SCc2ccc(-c3nn[n-]n3)cc2OC(F)F)o1 ZINC000826317475 608154233 /nfs/dbraw/zinc/15/42/33/608154233.db2.gz DTUSECCKLYTNLF-SECBINFHSA-N -1 3 367.381 3.759 20 0 FHADHM O=C(CCCC(F)(F)F)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000826405428 608160874 /nfs/dbraw/zinc/16/08/74/608160874.db2.gz FKNVZIMGURVEMD-UHFFFAOYSA-N -1 3 367.253 3.557 20 0 FHADHM O=C(CCCC(F)(F)F)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000826405428 608160875 /nfs/dbraw/zinc/16/08/75/608160875.db2.gz FKNVZIMGURVEMD-UHFFFAOYSA-N -1 3 367.253 3.557 20 0 FHADHM CCCCNc1ccccc1C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000825291396 608168765 /nfs/dbraw/zinc/16/87/65/608168765.db2.gz QPZRBESZXAZNIJ-CQSZACIVSA-N -1 3 364.453 3.570 20 0 FHADHM CCCCNc1ccccc1C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000825291396 608168766 /nfs/dbraw/zinc/16/87/66/608168766.db2.gz QPZRBESZXAZNIJ-CQSZACIVSA-N -1 3 364.453 3.570 20 0 FHADHM CS[C@H](C(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000826224674 608185935 /nfs/dbraw/zinc/18/59/35/608185935.db2.gz JYBGDJANOSJVNZ-LRDDRELGSA-N -1 3 354.435 3.575 20 0 FHADHM CS[C@H](C(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000826224674 608185938 /nfs/dbraw/zinc/18/59/38/608185938.db2.gz JYBGDJANOSJVNZ-LRDDRELGSA-N -1 3 354.435 3.575 20 0 FHADHM CS[C@@H](C(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000826224673 608186173 /nfs/dbraw/zinc/18/61/73/608186173.db2.gz JYBGDJANOSJVNZ-BLLLJJGKSA-N -1 3 354.435 3.575 20 0 FHADHM CS[C@@H](C(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000826224673 608186174 /nfs/dbraw/zinc/18/61/74/608186174.db2.gz JYBGDJANOSJVNZ-BLLLJJGKSA-N -1 3 354.435 3.575 20 0 FHADHM Cc1ccccc1NC(=O)[C@@H](C)Sc1cccc(Cl)c1-c1nnn[n-]1 ZINC000826307603 608206431 /nfs/dbraw/zinc/20/64/31/608206431.db2.gz OVYZONHCRNMAJN-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM Cc1ccccc1NC(=O)[C@@H](C)Sc1cccc(Cl)c1-c1nn[n-]n1 ZINC000826307603 608206432 /nfs/dbraw/zinc/20/64/32/608206432.db2.gz OVYZONHCRNMAJN-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM Clc1cccc(SCc2nc(-c3ccccc3)no2)c1-c1nnn[n-]1 ZINC000826353245 608206561 /nfs/dbraw/zinc/20/65/61/608206561.db2.gz HLUBWBXNYVRVGQ-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1cccc(SCc2nc(-c3ccccc3)no2)c1-c1nn[n-]n1 ZINC000826353245 608206563 /nfs/dbraw/zinc/20/65/63/608206563.db2.gz HLUBWBXNYVRVGQ-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM CC(C)N(C(=O)[C@H](C)Sc1cccc(Cl)c1-c1nnn[n-]1)C(C)C ZINC000824756573 608206968 /nfs/dbraw/zinc/20/69/68/608206968.db2.gz PADHLKWOIWDHDA-NSHDSACASA-N -1 3 367.906 3.646 20 0 FHADHM CC(C)N(C(=O)[C@H](C)Sc1cccc(Cl)c1-c1nn[n-]n1)C(C)C ZINC000824756573 608206969 /nfs/dbraw/zinc/20/69/69/608206969.db2.gz PADHLKWOIWDHDA-NSHDSACASA-N -1 3 367.906 3.646 20 0 FHADHM Cc1ccc(NC(=O)CSc2cccc(Cl)c2-c2nnn[n-]2)cc1 ZINC000826290933 608207702 /nfs/dbraw/zinc/20/77/02/608207702.db2.gz HSDMGMUVAKLEMA-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1ccc(NC(=O)CSc2cccc(Cl)c2-c2nn[n-]n2)cc1 ZINC000826290933 608207704 /nfs/dbraw/zinc/20/77/04/608207704.db2.gz HSDMGMUVAKLEMA-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM C[C@@H]1CCN(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)CC12CCC2 ZINC000824946850 608208656 /nfs/dbraw/zinc/20/86/56/608208656.db2.gz LERCVFAYNYYPJW-LLVKDONJSA-N -1 3 360.849 3.564 20 0 FHADHM C[C@@H]1CCN(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)CC12CCC2 ZINC000824946850 608208657 /nfs/dbraw/zinc/20/86/57/608208657.db2.gz LERCVFAYNYYPJW-LLVKDONJSA-N -1 3 360.849 3.564 20 0 FHADHM CCOc1ccc([C@H](C)Nc2ccc3cc(-c4nnn[n-]4)ccc3n2)cc1 ZINC000825637906 608221767 /nfs/dbraw/zinc/22/17/67/608221767.db2.gz AZVYHVBGSUDTAT-ZDUSSCGKSA-N -1 3 360.421 3.987 20 0 FHADHM CCOc1ccc([C@H](C)Nc2ccc3cc(-c4nn[n-]n4)ccc3n2)cc1 ZINC000825637906 608221769 /nfs/dbraw/zinc/22/17/69/608221769.db2.gz AZVYHVBGSUDTAT-ZDUSSCGKSA-N -1 3 360.421 3.987 20 0 FHADHM COc1ccc(Cl)cc1CNc1ccc2cc(-c3nnn[n-]3)ccc2n1 ZINC000826208321 608223610 /nfs/dbraw/zinc/22/36/10/608223610.db2.gz DWEMEERLAZFFCN-UHFFFAOYSA-N -1 3 366.812 3.689 20 0 FHADHM COc1ccc(Cl)cc1CNc1ccc2cc(-c3nn[n-]n3)ccc2n1 ZINC000826208321 608223612 /nfs/dbraw/zinc/22/36/12/608223612.db2.gz DWEMEERLAZFFCN-UHFFFAOYSA-N -1 3 366.812 3.689 20 0 FHADHM Cc1ccccc1[C@H]1CCN(c2ccc3cc(-c4nnn[n-]4)ccc3n2)C1 ZINC000826306684 608225583 /nfs/dbraw/zinc/22/55/83/608225583.db2.gz HYFOIWRYCLPDAF-KRWDZBQOSA-N -1 3 356.433 3.717 20 0 FHADHM Cc1ccccc1[C@H]1CCN(c2ccc3cc(-c4nn[n-]n4)ccc3n2)C1 ZINC000826306684 608225584 /nfs/dbraw/zinc/22/55/84/608225584.db2.gz HYFOIWRYCLPDAF-KRWDZBQOSA-N -1 3 356.433 3.717 20 0 FHADHM c1ccc(COCCCCNc2ccc3cc(-c4nnn[n-]4)ccc3n2)cc1 ZINC000826521718 608226164 /nfs/dbraw/zinc/22/61/64/608226164.db2.gz WPAKOYRFDDGKMW-UHFFFAOYSA-N -1 3 374.448 3.824 20 0 FHADHM c1ccc(COCCCCNc2ccc3cc(-c4nn[n-]n4)ccc3n2)cc1 ZINC000826521718 608226165 /nfs/dbraw/zinc/22/61/65/608226165.db2.gz WPAKOYRFDDGKMW-UHFFFAOYSA-N -1 3 374.448 3.824 20 0 FHADHM Fc1cccc([C@@H](Nc2ccc(-c3nn[n-]n3)cc2F)c2ccccn2)c1 ZINC000826376888 608234538 /nfs/dbraw/zinc/23/45/38/608234538.db2.gz WXSMXMUORWKBDL-GOSISDBHSA-N -1 3 364.359 3.741 20 0 FHADHM Fc1ccc(NCc2c(F)cccc2Br)cc1-c1nnn[n-]1 ZINC000826375347 608236574 /nfs/dbraw/zinc/23/65/74/608236574.db2.gz JRIOOZZIPVWJNQ-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1ccc(NCc2c(F)cccc2Br)cc1-c1nn[n-]n1 ZINC000826375347 608236576 /nfs/dbraw/zinc/23/65/76/608236576.db2.gz JRIOOZZIPVWJNQ-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)NCC(C)(C)C1CCCCC1 ZINC000825958503 608240776 /nfs/dbraw/zinc/24/07/76/608240776.db2.gz YWHBNZHKDGKQNK-UHFFFAOYSA-N -1 3 370.501 3.615 20 0 FHADHM CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)NCC(C)(C)C1CCCCC1 ZINC000825958503 608240778 /nfs/dbraw/zinc/24/07/78/608240778.db2.gz YWHBNZHKDGKQNK-UHFFFAOYSA-N -1 3 370.501 3.615 20 0 FHADHM Fc1ccc(C2(NCc3ccc(-c4nnn[n-]4)o3)CCCCC2)c(F)c1 ZINC000826374427 608243242 /nfs/dbraw/zinc/24/32/42/608243242.db2.gz YNJKNZPSROWQRV-UHFFFAOYSA-N -1 3 359.380 3.687 20 0 FHADHM Fc1ccc(C2(NCc3ccc(-c4nn[n-]n4)o3)CCCCC2)c(F)c1 ZINC000826374427 608243244 /nfs/dbraw/zinc/24/32/44/608243244.db2.gz YNJKNZPSROWQRV-UHFFFAOYSA-N -1 3 359.380 3.687 20 0 FHADHM CCn1c2ccccc2nc1SCc1ccc(-c2nnn[n-]2)cc1OC ZINC000825796979 608260452 /nfs/dbraw/zinc/26/04/52/608260452.db2.gz SFTJJXKANPTSER-UHFFFAOYSA-N -1 3 366.450 3.537 20 0 FHADHM CCn1c2ccccc2nc1SCc1ccc(-c2nn[n-]n2)cc1OC ZINC000825796979 608260453 /nfs/dbraw/zinc/26/04/53/608260453.db2.gz SFTJJXKANPTSER-UHFFFAOYSA-N -1 3 366.450 3.537 20 0 FHADHM C[C@H]1CCC[C@H](OCCCCCC(=O)Nc2ccc(-c3nnn[n-]3)cc2)C1 ZINC000162236413 608261676 /nfs/dbraw/zinc/26/16/76/608261676.db2.gz OVXUIMXTLYDIRZ-YJBOKZPZSA-N -1 3 371.485 3.961 20 0 FHADHM C[C@H]1CCC[C@H](OCCCCCC(=O)Nc2ccc(-c3nn[n-]n3)cc2)C1 ZINC000162236413 608261677 /nfs/dbraw/zinc/26/16/77/608261677.db2.gz OVXUIMXTLYDIRZ-YJBOKZPZSA-N -1 3 371.485 3.961 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)c2ccc(Cl)c(F)c2)s1 ZINC000825693699 608275366 /nfs/dbraw/zinc/27/53/66/608275366.db2.gz AQONXOGHJMWLDB-UHFFFAOYSA-N -1 3 351.794 3.535 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)c2ccc(Cl)c(F)c2)s1 ZINC000825693699 608275368 /nfs/dbraw/zinc/27/53/68/608275368.db2.gz AQONXOGHJMWLDB-UHFFFAOYSA-N -1 3 351.794 3.535 20 0 FHADHM O=C(NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1)C(C1CC1)C1CC1 ZINC000826440448 608330343 /nfs/dbraw/zinc/33/03/43/608330343.db2.gz NANYRZYAHBUDFC-UHFFFAOYSA-N -1 3 373.460 3.586 20 0 FHADHM O=C(NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1)C(C1CC1)C1CC1 ZINC000826440448 608330345 /nfs/dbraw/zinc/33/03/45/608330345.db2.gz NANYRZYAHBUDFC-UHFFFAOYSA-N -1 3 373.460 3.586 20 0 FHADHM Cc1scc(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)c1C ZINC000826350143 608342950 /nfs/dbraw/zinc/34/29/50/608342950.db2.gz JWBRXQQABRAWSZ-UHFFFAOYSA-N -1 3 367.356 3.816 20 0 FHADHM Cc1scc(C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)c1C ZINC000826350143 608342952 /nfs/dbraw/zinc/34/29/52/608342952.db2.gz JWBRXQQABRAWSZ-UHFFFAOYSA-N -1 3 367.356 3.816 20 0 FHADHM CCN(C(=O)C1CCC(F)(F)CC1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825367570 608343781 /nfs/dbraw/zinc/34/37/81/608343781.db2.gz SQWIBCCFAMOZIH-UHFFFAOYSA-N -1 3 369.803 3.699 20 0 FHADHM CCN(C(=O)C1CCC(F)(F)CC1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825367570 608343782 /nfs/dbraw/zinc/34/37/82/608343782.db2.gz SQWIBCCFAMOZIH-UHFFFAOYSA-N -1 3 369.803 3.699 20 0 FHADHM CCN(C(=O)c1ccc(C(C)C)nc1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825379513 608345484 /nfs/dbraw/zinc/34/54/84/608345484.db2.gz GSVIGPYUKAHSDS-UHFFFAOYSA-N -1 3 370.844 3.705 20 0 FHADHM CCN(C(=O)c1ccc(C(C)C)nc1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825379513 608345486 /nfs/dbraw/zinc/34/54/86/608345486.db2.gz GSVIGPYUKAHSDS-UHFFFAOYSA-N -1 3 370.844 3.705 20 0 FHADHM CCN(C(=O)[C@@H](C)Cc1ccccc1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825362726 608346939 /nfs/dbraw/zinc/34/69/39/608346939.db2.gz QNUWYBVLQATCAQ-ZDUSSCGKSA-N -1 3 369.856 3.752 20 0 FHADHM CCN(C(=O)[C@@H](C)Cc1ccccc1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825362726 608346941 /nfs/dbraw/zinc/34/69/41/608346941.db2.gz QNUWYBVLQATCAQ-ZDUSSCGKSA-N -1 3 369.856 3.752 20 0 FHADHM Fc1cccc([C@H]2CCCN2c2cc(-c3nnn[n-]3)c3ccccc3n2)c1 ZINC000826376586 608371800 /nfs/dbraw/zinc/37/18/00/608371800.db2.gz KAJWMBGMSBIBLL-GOSISDBHSA-N -1 3 360.396 3.896 20 0 FHADHM Fc1cccc([C@H]2CCCN2c2cc(-c3nn[n-]n3)c3ccccc3n2)c1 ZINC000826376586 608371802 /nfs/dbraw/zinc/37/18/02/608371802.db2.gz KAJWMBGMSBIBLL-GOSISDBHSA-N -1 3 360.396 3.896 20 0 FHADHM Oc1cccc2c1CC[C@@H]2Nc1ccc(C(F)(F)F)cc1-c1nnn[n-]1 ZINC000826511438 608381904 /nfs/dbraw/zinc/38/19/04/608381904.db2.gz QGJWLCBRTPOCEO-ZDUSSCGKSA-N -1 3 361.327 3.691 20 0 FHADHM Oc1cccc2c1CC[C@@H]2Nc1ccc(C(F)(F)F)cc1-c1nn[n-]n1 ZINC000826511438 608381906 /nfs/dbraw/zinc/38/19/06/608381906.db2.gz QGJWLCBRTPOCEO-ZDUSSCGKSA-N -1 3 361.327 3.691 20 0 FHADHM CC[C@@H](C)n1ncc(NCc2ccc(-c3nnn[n-]3)cc2F)c1C1CC1 ZINC000825082318 608427806 /nfs/dbraw/zinc/42/78/06/608427806.db2.gz RYXKIUNADHSMDN-LLVKDONJSA-N -1 3 355.421 3.663 20 0 FHADHM CC[C@@H](C)n1ncc(NCc2ccc(-c3nn[n-]n3)cc2F)c1C1CC1 ZINC000825082318 608427807 /nfs/dbraw/zinc/42/78/07/608427807.db2.gz RYXKIUNADHSMDN-LLVKDONJSA-N -1 3 355.421 3.663 20 0 FHADHM CSc1cccc(NC(=O)C=Cc2ccccc2-c2nnn[n-]2)c1C ZINC000826230790 608432396 /nfs/dbraw/zinc/43/23/96/608432396.db2.gz KBCFDWOHTNZUOR-ZHACJKMWSA-N -1 3 351.435 3.549 20 0 FHADHM CSc1cccc(NC(=O)C=Cc2ccccc2-c2nn[n-]n2)c1C ZINC000826230790 608432397 /nfs/dbraw/zinc/43/23/97/608432397.db2.gz KBCFDWOHTNZUOR-ZHACJKMWSA-N -1 3 351.435 3.549 20 0 FHADHM O=C(OCc1cccc(-c2nnn[n-]2)c1F)[C@H]1C[C@@H]1c1cccc(Cl)c1 ZINC000826465989 608445371 /nfs/dbraw/zinc/44/53/71/608445371.db2.gz LAEWQHWAPOZMNX-CABCVRRESA-N -1 3 372.787 3.506 20 0 FHADHM O=C(OCc1cccc(-c2nn[n-]n2)c1F)[C@H]1C[C@@H]1c1cccc(Cl)c1 ZINC000826465989 608445373 /nfs/dbraw/zinc/44/53/73/608445373.db2.gz LAEWQHWAPOZMNX-CABCVRRESA-N -1 3 372.787 3.506 20 0 FHADHM CSc1cccc(NC(=O)N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1C ZINC000826231092 608478215 /nfs/dbraw/zinc/47/82/15/608478215.db2.gz WZCMBMYJHDLELY-GFCCVEGCSA-N -1 3 368.466 3.780 20 0 FHADHM CSc1cccc(NC(=O)N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1C ZINC000826231092 608478217 /nfs/dbraw/zinc/47/82/17/608478217.db2.gz WZCMBMYJHDLELY-GFCCVEGCSA-N -1 3 368.466 3.780 20 0 FHADHM Cc1oc(-c2cccs2)nc1CN[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000826340573 608493008 /nfs/dbraw/zinc/49/30/08/608493008.db2.gz CYOOEOGCDUTQOP-LLVKDONJSA-N -1 3 366.450 3.742 20 0 FHADHM Cc1c(NC(=O)N[C@@H](C)c2ccccc2Cl)cccc1-c1nnn[n-]1 ZINC000822090725 608494432 /nfs/dbraw/zinc/49/44/32/608494432.db2.gz MJKYVSCOOVGDOM-NSHDSACASA-N -1 3 356.817 3.711 20 0 FHADHM Cc1c(NC(=O)N[C@@H](C)c2ccccc2Cl)cccc1-c1nn[n-]n1 ZINC000822090725 608494435 /nfs/dbraw/zinc/49/44/35/608494435.db2.gz MJKYVSCOOVGDOM-NSHDSACASA-N -1 3 356.817 3.711 20 0 FHADHM CC[C@H](OC(=O)c1c(F)cc(-c2nnn[n-]2)cc1F)c1ccc(F)cc1 ZINC000825154184 608498373 /nfs/dbraw/zinc/49/83/73/608498373.db2.gz MLIUFNHHYGUUDW-AWEZNQCLSA-N -1 3 362.311 3.592 20 0 FHADHM CC[C@H](OC(=O)c1c(F)cc(-c2nn[n-]n2)cc1F)c1ccc(F)cc1 ZINC000825154184 608498374 /nfs/dbraw/zinc/49/83/74/608498374.db2.gz MLIUFNHHYGUUDW-AWEZNQCLSA-N -1 3 362.311 3.592 20 0 FHADHM CN(Cc1cc(-c2nnn[n-]2)cs1)Cc1cccc(Cl)c1Cl ZINC000825953948 608500299 /nfs/dbraw/zinc/50/02/99/608500299.db2.gz SMZHKAPFHRBKJK-UHFFFAOYSA-N -1 3 354.266 3.867 20 0 FHADHM CN(Cc1cc(-c2nn[n-]n2)cs1)Cc1cccc(Cl)c1Cl ZINC000825953948 608500300 /nfs/dbraw/zinc/50/03/00/608500300.db2.gz SMZHKAPFHRBKJK-UHFFFAOYSA-N -1 3 354.266 3.867 20 0 FHADHM Cc1ccc(-c2cc(CNC3(c4cccc(-c5nn[n-]n5)c4)CC3)on2)cc1 ZINC000826272984 608529254 /nfs/dbraw/zinc/52/92/54/608529254.db2.gz KCQSPMXFJNICBK-UHFFFAOYSA-N -1 3 372.432 3.609 20 0 FHADHM CN(C(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1)c1cccc2ccccc21 ZINC000825829810 608575298 /nfs/dbraw/zinc/57/52/98/608575298.db2.gz JGHJTYUFUIEBBU-UHFFFAOYSA-N -1 3 363.808 3.950 20 0 FHADHM CN(C(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1)c1cccc2ccccc21 ZINC000825829810 608575299 /nfs/dbraw/zinc/57/52/99/608575299.db2.gz JGHJTYUFUIEBBU-UHFFFAOYSA-N -1 3 363.808 3.950 20 0 FHADHM Cc1ccc(N(C(=O)c2ccc(Cl)c(-c3nnn[n-]3)c2)C(C)C)cc1 ZINC000826289822 608575893 /nfs/dbraw/zinc/57/58/93/608575893.db2.gz OMYMXZICLWMVLM-UHFFFAOYSA-N -1 3 355.829 3.884 20 0 FHADHM Cc1ccc(N(C(=O)c2ccc(Cl)c(-c3nn[n-]n3)c2)C(C)C)cc1 ZINC000826289822 608575894 /nfs/dbraw/zinc/57/58/94/608575894.db2.gz OMYMXZICLWMVLM-UHFFFAOYSA-N -1 3 355.829 3.884 20 0 FHADHM C[C@@H]1CCN(C(=O)c2ccc(Cl)c(-c3nnn[n-]3)c2)[C@H](c2ccco2)C1 ZINC000824947776 608576719 /nfs/dbraw/zinc/57/67/19/608576719.db2.gz QVJYOKHBCWHKOH-ABAIWWIYSA-N -1 3 371.828 3.727 20 0 FHADHM C[C@@H]1CCN(C(=O)c2ccc(Cl)c(-c3nn[n-]n3)c2)[C@H](c2ccco2)C1 ZINC000824947776 608576721 /nfs/dbraw/zinc/57/67/21/608576721.db2.gz QVJYOKHBCWHKOH-ABAIWWIYSA-N -1 3 371.828 3.727 20 0 FHADHM CC(C)c1ccc(OC2CCN(Cc3ccc(-c4nnn[n-]4)o3)CC2)cc1 ZINC000824347869 608607685 /nfs/dbraw/zinc/60/76/85/608607685.db2.gz QBJJYJHGFBITIN-UHFFFAOYSA-N -1 3 367.453 3.627 20 0 FHADHM Cc1ccc(C)c([C@H]2CN(Cc3ccc(-c4nnn[n-]4)s3)[C@H](C)CO2)c1 ZINC000826284842 608728997 /nfs/dbraw/zinc/72/89/97/608728997.db2.gz HTRGOZBZPLNXKP-RHSMWYFYSA-N -1 3 369.494 3.507 20 0 FHADHM Cc1ccc(C)c([C@H]2CN(Cc3ccc(-c4nn[n-]n4)s3)[C@H](C)CO2)c1 ZINC000826284842 608728999 /nfs/dbraw/zinc/72/89/99/608728999.db2.gz HTRGOZBZPLNXKP-RHSMWYFYSA-N -1 3 369.494 3.507 20 0 FHADHM S=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)N[C@@H]1CC12CCCCC2 ZINC000826512237 608884639 /nfs/dbraw/zinc/88/46/39/608884639.db2.gz UGCYHSFINZRQJZ-CYBMUJFWSA-N -1 3 362.890 3.529 20 0 FHADHM S=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)N[C@@H]1CC12CCCCC2 ZINC000826512237 608884644 /nfs/dbraw/zinc/88/46/44/608884644.db2.gz UGCYHSFINZRQJZ-CYBMUJFWSA-N -1 3 362.890 3.529 20 0 FHADHM CC(C)COC[C@H](N[C@@H](C)c1ccc(-c2nnn[n-]2)c(F)c1)c1ccco1 ZINC000824266072 609139200 /nfs/dbraw/zinc/13/92/00/609139200.db2.gz FAHVCVOMNNIHCI-GUYCJALGSA-N -1 3 373.432 3.663 20 0 FHADHM CC(C)COC[C@H](N[C@@H](C)c1ccc(-c2nn[n-]n2)c(F)c1)c1ccco1 ZINC000824266072 609139202 /nfs/dbraw/zinc/13/92/02/609139202.db2.gz FAHVCVOMNNIHCI-GUYCJALGSA-N -1 3 373.432 3.663 20 0 FHADHM Cc1ccc2c(c1)[C@@H](NC(=O)Nc1cc(-c3nnn[n-]3)ccc1C)[C@H](C)C2 ZINC000826294630 609157484 /nfs/dbraw/zinc/15/74/84/609157484.db2.gz XSWVJCLLDJDCET-ACJLOTCBSA-N -1 3 362.437 3.539 20 0 FHADHM Cc1ccc2c(c1)[C@@H](NC(=O)Nc1cc(-c3nn[n-]n3)ccc1C)[C@H](C)C2 ZINC000826294630 609157486 /nfs/dbraw/zinc/15/74/86/609157486.db2.gz XSWVJCLLDJDCET-ACJLOTCBSA-N -1 3 362.437 3.539 20 0 FHADHM CCOc1cc(N[C@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)ccc1OC ZINC000825615804 609173966 /nfs/dbraw/zinc/17/39/66/609173966.db2.gz LKXJBQCFQMHPHS-LLVKDONJSA-N -1 3 357.389 3.586 20 0 FHADHM CCOc1cc(N[C@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)ccc1OC ZINC000825615804 609173968 /nfs/dbraw/zinc/17/39/68/609173968.db2.gz LKXJBQCFQMHPHS-LLVKDONJSA-N -1 3 357.389 3.586 20 0 FHADHM CC(=O)Nc1c(C)ccc(N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1C ZINC000823993973 609180063 /nfs/dbraw/zinc/18/00/63/609180063.db2.gz CIEITMJSBCSDLO-CYBMUJFWSA-N -1 3 350.426 3.615 20 0 FHADHM CC(=O)Nc1c(C)ccc(N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1C ZINC000823993973 609180065 /nfs/dbraw/zinc/18/00/65/609180065.db2.gz CIEITMJSBCSDLO-CYBMUJFWSA-N -1 3 350.426 3.615 20 0 FHADHM CCCCCN(Cc1ccc(Cl)cc1)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC000825276164 609191632 /nfs/dbraw/zinc/19/16/32/609191632.db2.gz RYUKNGXHBADDLS-UHFFFAOYSA-N -1 3 372.860 3.681 20 0 FHADHM CCCCCN(Cc1ccc(Cl)cc1)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC000825276164 609191634 /nfs/dbraw/zinc/19/16/34/609191634.db2.gz RYUKNGXHBADDLS-UHFFFAOYSA-N -1 3 372.860 3.681 20 0 FHADHM FC1=CCCN(Cc2cccc(OCc3cccc(-c4nnn[n-]4)c3)c2)C1 ZINC000826370258 609201157 /nfs/dbraw/zinc/20/11/57/609201157.db2.gz KPAXWVDBKYGTMQ-UHFFFAOYSA-N -1 3 365.412 3.505 20 0 FHADHM FC1=CCCN(Cc2cccc(OCc3cccc(-c4nn[n-]n4)c3)c2)C1 ZINC000826370258 609201159 /nfs/dbraw/zinc/20/11/59/609201159.db2.gz KPAXWVDBKYGTMQ-UHFFFAOYSA-N -1 3 365.412 3.505 20 0 FHADHM O=C(N[C@@H](c1ccc(Cl)cc1)C1CCCC1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC000826427076 609210650 /nfs/dbraw/zinc/21/06/50/609210650.db2.gz FPTALGWQDOGANS-MRXNPFEDSA-N -1 3 370.844 3.510 20 0 FHADHM O=C(N[C@@H](c1ccc(Cl)cc1)C1CCCC1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC000826427076 609210652 /nfs/dbraw/zinc/21/06/52/609210652.db2.gz FPTALGWQDOGANS-MRXNPFEDSA-N -1 3 370.844 3.510 20 0 FHADHM CC(C)c1ccc([C@H]2CCCCN2C(=O)c2c[nH]c(-c3nnn[n-]3)c2)cc1 ZINC000824347584 609229531 /nfs/dbraw/zinc/22/95/31/609229531.db2.gz FNMVSQGNPISMAU-GOSISDBHSA-N -1 3 364.453 3.686 20 0 FHADHM CC(C)c1ccc([C@H]2CCCCN2C(=O)c2c[nH]c(-c3nn[n-]n3)c2)cc1 ZINC000824347584 609229532 /nfs/dbraw/zinc/22/95/32/609229532.db2.gz FNMVSQGNPISMAU-GOSISDBHSA-N -1 3 364.453 3.686 20 0 FHADHM C[C@@H](Nc1ccc(-n2cccn2)c(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824657896 609277486 /nfs/dbraw/zinc/27/74/86/609277486.db2.gz SHZLESHDKZHBSZ-GFCCVEGCSA-N -1 3 365.828 3.879 20 0 FHADHM C[C@@H](Nc1ccc(-n2cccn2)c(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824657896 609277488 /nfs/dbraw/zinc/27/74/88/609277488.db2.gz SHZLESHDKZHBSZ-GFCCVEGCSA-N -1 3 365.828 3.879 20 0 FHADHM COc1c(F)cc(F)cc1N[C@H]1CCCc2cc(-c3nnn[n-]3)ccc21 ZINC000826166991 609278676 /nfs/dbraw/zinc/27/86/76/609278676.db2.gz KXVHZEPOBCPIGO-HNNXBMFYSA-N -1 3 357.364 3.643 20 0 FHADHM COc1c(F)cc(F)cc1N[C@H]1CCCc2cc(-c3nn[n-]n3)ccc21 ZINC000826166991 609278678 /nfs/dbraw/zinc/27/86/78/609278678.db2.gz KXVHZEPOBCPIGO-HNNXBMFYSA-N -1 3 357.364 3.643 20 0 FHADHM C[C@H](Nc1ccc(F)c(Br)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824655154 609278840 /nfs/dbraw/zinc/27/88/40/609278840.db2.gz BOJVBTBJLUYNQG-VIFPVBQESA-N -1 3 362.206 3.941 20 0 FHADHM C[C@H](Nc1ccc(F)c(Br)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824655154 609278841 /nfs/dbraw/zinc/27/88/41/609278841.db2.gz BOJVBTBJLUYNQG-VIFPVBQESA-N -1 3 362.206 3.941 20 0 FHADHM Cc1cnn(-c2ccc(N[C@@H](C)c3ccc(-c4nnn[n-]4)cc3)cc2F)c1 ZINC000826319860 609280478 /nfs/dbraw/zinc/28/04/78/609280478.db2.gz WLMFGPGEYFHNAL-ZDUSSCGKSA-N -1 3 363.400 3.673 20 0 FHADHM Cc1cnn(-c2ccc(N[C@@H](C)c3ccc(-c4nn[n-]n4)cc3)cc2F)c1 ZINC000826319860 609280480 /nfs/dbraw/zinc/28/04/80/609280480.db2.gz WLMFGPGEYFHNAL-ZDUSSCGKSA-N -1 3 363.400 3.673 20 0 FHADHM O=C(c1ccc(Cl)c(-c2nnn[n-]2)c1)N(CC1CC1)c1ccccc1 ZINC000826472345 609302217 /nfs/dbraw/zinc/30/22/17/609302217.db2.gz HPXYXCHDUQGLCX-UHFFFAOYSA-N -1 3 353.813 3.577 20 0 FHADHM O=C(c1ccc(Cl)c(-c2nn[n-]n2)c1)N(CC1CC1)c1ccccc1 ZINC000826472345 609302219 /nfs/dbraw/zinc/30/22/19/609302219.db2.gz HPXYXCHDUQGLCX-UHFFFAOYSA-N -1 3 353.813 3.577 20 0 FHADHM Clc1ccc(C2=CCN(c3cnccc3-c3nnn[n-]3)CC2)cc1Cl ZINC000826351495 609312029 /nfs/dbraw/zinc/31/20/29/609312029.db2.gz ORXQHAXBJARJBW-UHFFFAOYSA-N -1 3 373.247 3.862 20 0 FHADHM Clc1ccc(C2=CCN(c3cnccc3-c3nn[n-]n3)CC2)cc1Cl ZINC000826351495 609312031 /nfs/dbraw/zinc/31/20/31/609312031.db2.gz ORXQHAXBJARJBW-UHFFFAOYSA-N -1 3 373.247 3.862 20 0 FHADHM CCC(CC)[C@@H]1C[C@H](Nc2nc3ccccc3cc2-c2nnn[n-]2)CCO1 ZINC000825108335 609322174 /nfs/dbraw/zinc/32/21/74/609322174.db2.gz VVWBCRVJWLJTBF-QAPCUYQASA-N -1 3 366.469 3.811 20 0 FHADHM CCC(CC)[C@@H]1C[C@H](Nc2nc3ccccc3cc2-c2nn[n-]n2)CCO1 ZINC000825108335 609322176 /nfs/dbraw/zinc/32/21/76/609322176.db2.gz VVWBCRVJWLJTBF-QAPCUYQASA-N -1 3 366.469 3.811 20 0 FHADHM CCC(CC)[C@H]1C[C@@H](Nc2c(F)cc(-c3nnn[n-]3)cc2F)CCO1 ZINC000825107554 609322321 /nfs/dbraw/zinc/32/23/21/609322321.db2.gz QRULXIGJLROEFG-SWLSCSKDSA-N -1 3 351.401 3.541 20 0 FHADHM CCC(CC)[C@H]1C[C@@H](Nc2c(F)cc(-c3nn[n-]n3)cc2F)CCO1 ZINC000825107554 609322323 /nfs/dbraw/zinc/32/23/23/609322323.db2.gz QRULXIGJLROEFG-SWLSCSKDSA-N -1 3 351.401 3.541 20 0 FHADHM Clc1ccc(CSCCCOc2cccc(-c3nnn[n-]3)c2)nc1 ZINC000826352130 609329539 /nfs/dbraw/zinc/32/95/39/609329539.db2.gz OPFZNFTXDZCMTO-UHFFFAOYSA-N -1 3 361.858 3.617 20 0 FHADHM Clc1ccc(CSCCCOc2cccc(-c3nn[n-]n3)c2)nc1 ZINC000826352130 609329541 /nfs/dbraw/zinc/32/95/41/609329541.db2.gz OPFZNFTXDZCMTO-UHFFFAOYSA-N -1 3 361.858 3.617 20 0 FHADHM COc1ccc2ccccc2c1-c1cc(Cn2ccc(-c3nnn[n-]3)c2)on1 ZINC000826213922 609329750 /nfs/dbraw/zinc/32/97/50/609329750.db2.gz RZPCJDAIZPMJSV-UHFFFAOYSA-N -1 3 372.388 3.533 20 0 FHADHM COc1ccc2ccccc2c1-c1cc(Cn2ccc(-c3nn[n-]n3)c2)on1 ZINC000826213922 609329752 /nfs/dbraw/zinc/32/97/52/609329752.db2.gz RZPCJDAIZPMJSV-UHFFFAOYSA-N -1 3 372.388 3.533 20 0 FHADHM C[C@H](N[C@@H]1CCCOc2ccc(F)cc21)c1ccc(-c2nn[n-]n2)cc1F ZINC000824545951 609330285 /nfs/dbraw/zinc/33/02/85/609330285.db2.gz FOVUITPBPMLCLF-APPDUMDISA-N -1 3 371.391 3.709 20 0 FHADHM C[C@@H](NCc1nc(C(C)(C)C)cs1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824625396 609333324 /nfs/dbraw/zinc/33/33/24/609333324.db2.gz HBURLYVMGDQTQO-SNVBAGLBSA-N -1 3 360.462 3.611 20 0 FHADHM C[C@@H](NCc1nc(C(C)(C)C)cs1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824625396 609333326 /nfs/dbraw/zinc/33/33/26/609333326.db2.gz HBURLYVMGDQTQO-SNVBAGLBSA-N -1 3 360.462 3.611 20 0 FHADHM CC(C)C(=O)Nc1ccc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2F)cc1 ZINC000824185286 609345703 /nfs/dbraw/zinc/34/57/03/609345703.db2.gz USIUFLKJSKOGFE-LBPRGKRZSA-N -1 3 368.416 3.773 20 0 FHADHM CC(C)C(=O)Nc1ccc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000824185286 609345704 /nfs/dbraw/zinc/34/57/04/609345704.db2.gz USIUFLKJSKOGFE-LBPRGKRZSA-N -1 3 368.416 3.773 20 0 FHADHM CC(C)C(=O)Nc1cccc(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2F)c1 ZINC000824184018 609345758 /nfs/dbraw/zinc/34/57/58/609345758.db2.gz BQXNPYOMSAXDPB-GFCCVEGCSA-N -1 3 368.416 3.773 20 0 FHADHM CC(C)C(=O)Nc1cccc(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2F)c1 ZINC000824184018 609345759 /nfs/dbraw/zinc/34/57/59/609345759.db2.gz BQXNPYOMSAXDPB-GFCCVEGCSA-N -1 3 368.416 3.773 20 0 FHADHM CCC(=O)Nc1ccc(C)c(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2F)c1 ZINC000825034888 609346429 /nfs/dbraw/zinc/34/64/29/609346429.db2.gz SQIJKNUCWPMOHD-GFCCVEGCSA-N -1 3 368.416 3.836 20 0 FHADHM CCC(=O)Nc1ccc(C)c(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2F)c1 ZINC000825034888 609346430 /nfs/dbraw/zinc/34/64/30/609346430.db2.gz SQIJKNUCWPMOHD-GFCCVEGCSA-N -1 3 368.416 3.836 20 0 FHADHM COCCOc1ccc(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2F)c(C)c1 ZINC000826162581 609348148 /nfs/dbraw/zinc/34/81/48/609348148.db2.gz JBMMOVQORLTMCF-CYBMUJFWSA-N -1 3 371.416 3.513 20 0 FHADHM COCCOc1ccc(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2F)c(C)c1 ZINC000826162581 609348150 /nfs/dbraw/zinc/34/81/50/609348150.db2.gz JBMMOVQORLTMCF-CYBMUJFWSA-N -1 3 371.416 3.513 20 0 FHADHM O=C(N[C@H](CC1CCC1)c1ccccc1)c1sccc1-c1nnn[n-]1 ZINC000826426884 609350828 /nfs/dbraw/zinc/35/08/28/609350828.db2.gz YOKHCSYMEACUPN-OAHLLOKOSA-N -1 3 353.451 3.590 20 0 FHADHM O=C(N[C@H](CC1CCC1)c1ccccc1)c1sccc1-c1nn[n-]n1 ZINC000826426884 609350832 /nfs/dbraw/zinc/35/08/32/609350832.db2.gz YOKHCSYMEACUPN-OAHLLOKOSA-N -1 3 353.451 3.590 20 0 FHADHM Cc1nn(-c2ccccc2)cc1N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1F ZINC000826332973 609351350 /nfs/dbraw/zinc/35/13/50/609351350.db2.gz OQLFESJWNHFPBB-LBPRGKRZSA-N -1 3 363.400 3.673 20 0 FHADHM Cc1nn(-c2ccccc2)cc1N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000826332973 609351352 /nfs/dbraw/zinc/35/13/52/609351352.db2.gz OQLFESJWNHFPBB-LBPRGKRZSA-N -1 3 363.400 3.673 20 0 FHADHM CC(C)S[C@H]1CCCC[C@H]1OC(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000824337547 609365118 /nfs/dbraw/zinc/36/51/18/609365118.db2.gz AFTHHQCSUHKTTK-NEPJUHHUSA-N -1 3 352.485 3.538 20 0 FHADHM CC(C)S[C@H]1CCCC[C@H]1OC(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000824337547 609365121 /nfs/dbraw/zinc/36/51/21/609365121.db2.gz AFTHHQCSUHKTTK-NEPJUHHUSA-N -1 3 352.485 3.538 20 0 FHADHM Cc1ccc(-c2ccc(C(=O)N(C)c3ccccc3-c3nnn[n-]3)s2)o1 ZINC000826273497 609394805 /nfs/dbraw/zinc/39/48/05/609394805.db2.gz HELPFCKEFPHMFN-UHFFFAOYSA-N -1 3 365.418 3.773 20 0 FHADHM Cc1ccc(-c2ccc(C(=O)N(C)c3ccccc3-c3nn[n-]n3)s2)o1 ZINC000826273497 609394809 /nfs/dbraw/zinc/39/48/09/609394809.db2.gz HELPFCKEFPHMFN-UHFFFAOYSA-N -1 3 365.418 3.773 20 0 FHADHM CC(=O)c1ccc(-c2nnn[n-]2)cc1N[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000824019798 609420572 /nfs/dbraw/zinc/42/05/72/609420572.db2.gz OXAKYSBQJDUYEO-NWDGAFQWSA-N -1 3 353.348 3.602 20 0 FHADHM CC(=O)c1ccc(-c2nn[n-]n2)cc1N[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000824019798 609420574 /nfs/dbraw/zinc/42/05/74/609420574.db2.gz OXAKYSBQJDUYEO-NWDGAFQWSA-N -1 3 353.348 3.602 20 0 FHADHM CC(C)Nc1cc(F)ccc1NCCCOc1cccc(-c2nnn[n-]2)c1 ZINC000824305429 609439084 /nfs/dbraw/zinc/43/90/84/609439084.db2.gz PRZFKKBWFNMZNA-UHFFFAOYSA-N -1 3 370.432 3.707 20 0 FHADHM CC(C)Nc1cc(F)ccc1NCCCOc1cccc(-c2nn[n-]n2)c1 ZINC000824305429 609439085 /nfs/dbraw/zinc/43/90/85/609439085.db2.gz PRZFKKBWFNMZNA-UHFFFAOYSA-N -1 3 370.432 3.707 20 0 FHADHM C[C@H](NC(=O)NC(C)(C)C)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824492007 609441273 /nfs/dbraw/zinc/44/12/73/609441273.db2.gz WLFVSAXMFWNCBM-ZDUSSCGKSA-N -1 3 364.453 3.692 20 0 FHADHM C[C@H](NC(=O)NC(C)(C)C)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824492007 609441275 /nfs/dbraw/zinc/44/12/75/609441275.db2.gz WLFVSAXMFWNCBM-ZDUSSCGKSA-N -1 3 364.453 3.692 20 0 FHADHM CCCCNC(=O)N[C@@H](C)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000825285063 609443671 /nfs/dbraw/zinc/44/36/71/609443671.db2.gz IGWZIFRKNBCILG-AWEZNQCLSA-N -1 3 364.453 3.694 20 0 FHADHM CCCCNC(=O)N[C@@H](C)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000825285063 609443672 /nfs/dbraw/zinc/44/36/72/609443672.db2.gz IGWZIFRKNBCILG-AWEZNQCLSA-N -1 3 364.453 3.694 20 0 FHADHM CCCCCCOCc1cccc(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)c1 ZINC000825271984 609448735 /nfs/dbraw/zinc/44/87/35/609448735.db2.gz SXDSPEUZWDEQMS-UHFFFAOYSA-N -1 3 368.441 3.544 20 0 FHADHM CCCCCCOCc1cccc(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)c1 ZINC000825271984 609448737 /nfs/dbraw/zinc/44/87/37/609448737.db2.gz SXDSPEUZWDEQMS-UHFFFAOYSA-N -1 3 368.441 3.544 20 0 FHADHM CC(C)(C)Sc1cc(C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)ccn1 ZINC000824123327 609453998 /nfs/dbraw/zinc/45/39/98/609453998.db2.gz FEXPMFPMQTXSSY-UHFFFAOYSA-N -1 3 372.429 3.544 20 0 FHADHM CC(C)(C)Sc1cc(C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)ccn1 ZINC000824123327 609454000 /nfs/dbraw/zinc/45/40/00/609454000.db2.gz FEXPMFPMQTXSSY-UHFFFAOYSA-N -1 3 372.429 3.544 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NCc1cnc(CC(C)C)s1 ZINC000825632305 609477567 /nfs/dbraw/zinc/47/75/67/609477567.db2.gz OICKNOBANSNWOW-UHFFFAOYSA-N -1 3 358.471 3.533 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NCc1cnc(CC(C)C)s1 ZINC000825632305 609477568 /nfs/dbraw/zinc/47/75/68/609477568.db2.gz OICKNOBANSNWOW-UHFFFAOYSA-N -1 3 358.471 3.533 20 0 FHADHM CN(c1ccccc1NCc1cccc(-c2nnn[n-]2)c1F)C1CCCC1 ZINC000826010305 609481019 /nfs/dbraw/zinc/48/10/19/609481019.db2.gz HZOKPYPSTLMZPA-UHFFFAOYSA-N -1 3 366.444 3.997 20 0 FHADHM CN(c1ccccc1NCc1cccc(-c2nn[n-]n2)c1F)C1CCCC1 ZINC000826010305 609481020 /nfs/dbraw/zinc/48/10/20/609481020.db2.gz HZOKPYPSTLMZPA-UHFFFAOYSA-N -1 3 366.444 3.997 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NCc1csc(-c2cccs2)n1 ZINC000826278695 609482762 /nfs/dbraw/zinc/48/27/62/609482762.db2.gz ONBMMWJKAHPTJV-UHFFFAOYSA-N -1 3 354.464 3.972 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NCc1csc(-c2cccs2)n1 ZINC000826278695 609482765 /nfs/dbraw/zinc/48/27/65/609482765.db2.gz ONBMMWJKAHPTJV-UHFFFAOYSA-N -1 3 354.464 3.972 20 0 FHADHM CCOC(=O)Nc1ccc(NCc2ccc(CC)s2)cc1-c1nnn[n-]1 ZINC000825553800 609488199 /nfs/dbraw/zinc/48/81/99/609488199.db2.gz XAABPKKEHCAIGI-UHFFFAOYSA-N -1 3 372.454 3.671 20 0 FHADHM CCOC(=O)Nc1ccc(NCc2ccc(CC)s2)cc1-c1nn[n-]n1 ZINC000825553800 609488201 /nfs/dbraw/zinc/48/82/01/609488201.db2.gz XAABPKKEHCAIGI-UHFFFAOYSA-N -1 3 372.454 3.671 20 0 FHADHM C[C@@H]1CCC[C@@H]1C(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000824930047 609501806 /nfs/dbraw/zinc/50/18/06/609501806.db2.gz ZVNDRGNRNPPAKQ-DOMZBBRYSA-N -1 3 367.478 3.648 20 0 FHADHM C[C@H]1CCC[C@H]1C(=O)NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000824929483 609512238 /nfs/dbraw/zinc/51/22/38/609512238.db2.gz XWQASRQZZARIAK-WMLDXEAASA-N -1 3 361.449 3.586 20 0 FHADHM C[C@H]1CCC[C@H]1C(=O)NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000824929483 609512239 /nfs/dbraw/zinc/51/22/39/609512239.db2.gz XWQASRQZZARIAK-WMLDXEAASA-N -1 3 361.449 3.586 20 0 FHADHM Cc1cc(NCc2cc(-c3nnn[n-]3)cs2)cnc1N1CCCC[C@H]1C ZINC000826271469 609512931 /nfs/dbraw/zinc/51/29/31/609512931.db2.gz SKFWMWYFJOTBEW-CYBMUJFWSA-N -1 3 369.498 3.623 20 0 FHADHM Cc1cc(NCc2cc(-c3nn[n-]n3)cs2)cnc1N1CCCC[C@H]1C ZINC000826271469 609512932 /nfs/dbraw/zinc/51/29/32/609512932.db2.gz SKFWMWYFJOTBEW-CYBMUJFWSA-N -1 3 369.498 3.623 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)cc1CNc1ccc(Cl)c(OC(F)F)c1 ZINC000826373634 609513352 /nfs/dbraw/zinc/51/33/52/609513352.db2.gz ULYRRNHCEKLWMH-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CNc1ccc(Cl)c(OC(F)F)c1 ZINC000826373634 609513353 /nfs/dbraw/zinc/51/33/53/609513353.db2.gz ULYRRNHCEKLWMH-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM CC[C@H](C)[C@@H](C)C(=O)Nc1ncc(Cc2ccc(-c3nnn[n-]3)cc2)s1 ZINC000825052144 609517049 /nfs/dbraw/zinc/51/70/49/609517049.db2.gz VANAKBVDOHVJMJ-NWDGAFQWSA-N -1 3 370.482 3.535 20 0 FHADHM CC[C@H](C)[C@@H](C)C(=O)Nc1ncc(Cc2ccc(-c3nn[n-]n3)cc2)s1 ZINC000825052144 609517051 /nfs/dbraw/zinc/51/70/51/609517051.db2.gz VANAKBVDOHVJMJ-NWDGAFQWSA-N -1 3 370.482 3.535 20 0 FHADHM COc1ccc([C@H](C)Nc2ncc(Cl)c(C)c2-c2nnn[n-]2)cc1F ZINC000826189239 609523871 /nfs/dbraw/zinc/52/38/71/609523871.db2.gz QPUAHKIGRQHPIX-VIFPVBQESA-N -1 3 362.796 3.544 20 0 FHADHM COc1ccc([C@H](C)Nc2ncc(Cl)c(C)c2-c2nn[n-]n2)cc1F ZINC000826189239 609523873 /nfs/dbraw/zinc/52/38/73/609523873.db2.gz QPUAHKIGRQHPIX-VIFPVBQESA-N -1 3 362.796 3.544 20 0 FHADHM Cc1cc(F)ccc1N(Cc1cccc(-c2nnn[n-]2)c1)C(=O)C1=CCC1 ZINC000826268615 609525687 /nfs/dbraw/zinc/52/56/87/609525687.db2.gz GFENZPWFJAHKOR-UHFFFAOYSA-N -1 3 363.396 3.568 20 0 FHADHM Cc1cc(F)ccc1N(Cc1cccc(-c2nn[n-]n2)c1)C(=O)C1=CCC1 ZINC000826268615 609525689 /nfs/dbraw/zinc/52/56/89/609525689.db2.gz GFENZPWFJAHKOR-UHFFFAOYSA-N -1 3 363.396 3.568 20 0 FHADHM CC[C@@H](C)[C@@H](C)C(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)nc1 ZINC000825049392 609529896 /nfs/dbraw/zinc/52/98/96/609529896.db2.gz BRGPCIGRYDIWAJ-CHWSQXEVSA-N -1 3 366.425 3.675 20 0 FHADHM Cc1ccnc(N[C@@H](C)c2cccc(OC(F)(F)F)c2)c1-c1nnn[n-]1 ZINC000826311661 609573839 /nfs/dbraw/zinc/57/38/39/609573839.db2.gz KJPMSLXHBJMJAG-JTQLQIEISA-N -1 3 364.331 3.642 20 0 FHADHM Cc1ccnc(N[C@@H](C)c2cccc(OC(F)(F)F)c2)c1-c1nn[n-]n1 ZINC000826311661 609573841 /nfs/dbraw/zinc/57/38/41/609573841.db2.gz KJPMSLXHBJMJAG-JTQLQIEISA-N -1 3 364.331 3.642 20 0 FHADHM C[C@H]1C[C@H](CCNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)CCO1 ZINC000824886111 609596507 /nfs/dbraw/zinc/59/65/07/609596507.db2.gz VUAQOTMISQANTL-WDEREUQCSA-N -1 3 355.364 3.503 20 0 FHADHM C[C@H]1C[C@H](CCNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)CCO1 ZINC000824886111 609596509 /nfs/dbraw/zinc/59/65/09/609596509.db2.gz VUAQOTMISQANTL-WDEREUQCSA-N -1 3 355.364 3.503 20 0 FHADHM CC[C@@H](C)[C@H](C)C(=O)Nc1nc(-c2cccc(-c3nnn[n-]3)c2)cs1 ZINC000825051286 609599241 /nfs/dbraw/zinc/59/92/41/609599241.db2.gz NEXRTEXOBSQQBJ-MNOVXSKESA-N -1 3 356.455 3.611 20 0 FHADHM CC[C@@H](C)[C@H](C)C(=O)Nc1nc(-c2cccc(-c3nn[n-]n3)c2)cs1 ZINC000825051286 609599243 /nfs/dbraw/zinc/59/92/43/609599243.db2.gz NEXRTEXOBSQQBJ-MNOVXSKESA-N -1 3 356.455 3.611 20 0 FHADHM FC(F)Oc1cc(NCc2cc(-c3nnn[n-]3)cs2)ccc1Cl ZINC000826369746 609600223 /nfs/dbraw/zinc/60/02/23/609600223.db2.gz PCIMMCSDMDOVDT-UHFFFAOYSA-N -1 3 357.773 3.795 20 0 FHADHM FC(F)Oc1cc(NCc2cc(-c3nn[n-]n3)cs2)ccc1Cl ZINC000826369746 609600224 /nfs/dbraw/zinc/60/02/24/609600224.db2.gz PCIMMCSDMDOVDT-UHFFFAOYSA-N -1 3 357.773 3.795 20 0 FHADHM CN(C[C@@H]1CC=CCC1)C(=O)c1ccccc1-c1ccccc1-c1nnn[n-]1 ZINC000825907897 609608144 /nfs/dbraw/zinc/60/81/44/609608144.db2.gz CWDBVLXTZBKXJZ-MRXNPFEDSA-N -1 3 373.460 3.962 20 0 FHADHM CN(C[C@@H]1CC=CCC1)C(=O)c1ccccc1-c1ccccc1-c1nn[n-]n1 ZINC000825907897 609608146 /nfs/dbraw/zinc/60/81/46/609608146.db2.gz CWDBVLXTZBKXJZ-MRXNPFEDSA-N -1 3 373.460 3.962 20 0 FHADHM Cc1nc(C)c(CC(=O)NC[C@H](c2ccc(Cl)cc2)C(C)C)c(=O)[n-]1 ZINC000583015829 936370975 /nfs/dbraw/zinc/37/09/75/936370975.db2.gz GNHUHPRFWIIVKI-KRWDZBQOSA-N -1 3 361.873 3.551 20 0 FHADHM COCc1cc(Cl)cc(S(=O)(=O)[N-]c2cc(F)c(F)cc2F)c1 ZINC000516609873 945064402 /nfs/dbraw/zinc/06/44/02/945064402.db2.gz HEDIHUVJEMYUNM-UHFFFAOYSA-N -1 3 365.760 3.705 20 0 FHADHM O=C(N=c1cc([C@H]2CCCO2)[n-][nH]1)c1cncc(-c2ccc(Cl)cc2)c1 ZINC000473853744 945065601 /nfs/dbraw/zinc/06/56/01/945065601.db2.gz XFGKGZONLUGUFS-QGZVFWFLSA-N -1 3 368.824 3.651 20 0 FHADHM O=C(N=c1cc([C@@H]2CCCO2)[n-][nH]1)c1cncc(-c2ccc(Cl)cc2)c1 ZINC000473853742 945065992 /nfs/dbraw/zinc/06/59/92/945065992.db2.gz XFGKGZONLUGUFS-KRWDZBQOSA-N -1 3 368.824 3.651 20 0 FHADHM O=S(=O)(Cc1ccccc1F)[N-]c1ccc(Br)c(F)c1 ZINC000396494899 927196476 /nfs/dbraw/zinc/19/64/76/927196476.db2.gz FTYUMDDYCZBSKP-UHFFFAOYSA-N -1 3 362.195 3.669 20 0 FHADHM C[C@@H](OCc1ccccc1)C(=O)Nc1ccc(Br)cc1[O-] ZINC000078829111 927287224 /nfs/dbraw/zinc/28/72/24/927287224.db2.gz WDJATWCEWOFNOF-LLVKDONJSA-N -1 3 350.212 3.699 20 0 FHADHM COc1cc(C)c(S(=O)(=O)[N-]c2ccc(Cl)cc2C)cc1OC ZINC000026527836 927290138 /nfs/dbraw/zinc/29/01/38/927290138.db2.gz JEDCMNJVOGIPDT-UHFFFAOYSA-N -1 3 355.843 3.775 20 0 FHADHM Cc1noc2nc(C3CC3)cc(C(=O)[N-]c3nnc(C(F)(F)F)s3)c12 ZINC000029284341 927315192 /nfs/dbraw/zinc/31/51/92/927315192.db2.gz AYFCYHNGRTUTKR-UHFFFAOYSA-N -1 3 369.328 3.531 20 0 FHADHM CCOc1ccc(C2(CNC(=O)c3ccc(C)cc3[O-])CCOCC2)cc1 ZINC000108952035 927683099 /nfs/dbraw/zinc/68/30/99/927683099.db2.gz NWPDYXGPMOUQNK-UHFFFAOYSA-N -1 3 369.461 3.578 20 0 FHADHM O=C([O-])[C@H](CNCc1ncc(-c2ccccc2)s1)Cc1ccccc1 ZINC000683171737 927737333 /nfs/dbraw/zinc/73/73/33/927737333.db2.gz PMQWCHCGTXQERZ-KRWDZBQOSA-N -1 3 352.459 3.843 20 0 FHADHM CC[C@H](C)Oc1cc(CN[C@@H](C(=O)[O-])c2cccc(F)c2)ccc1OC ZINC000683172831 927757325 /nfs/dbraw/zinc/75/73/25/927757325.db2.gz DVJYJFZNSMZADG-ORAYPTAESA-N -1 3 361.413 3.927 20 0 FHADHM CCc1cccc(C(=O)N(Cc2ccccc2)C[C@H](O)c2ccco2)c1[O-] ZINC000092426256 927774862 /nfs/dbraw/zinc/77/48/62/927774862.db2.gz CPYPRKVAXLMCNW-IBGZPJMESA-N -1 3 365.429 3.924 20 0 FHADHM CC(C)(C)Oc1c(F)cc(-n2c([O-])c(CC(F)(F)F)[nH]c2=O)cc1F ZINC000278109511 937193894 /nfs/dbraw/zinc/19/38/94/937193894.db2.gz KUDCFAPQGBXRAA-JTQLQIEISA-N -1 3 366.286 3.519 20 0 FHADHM CCCn1ccc(C[N-]S(=O)(=O)c2cc(Cl)sc2Cl)c1 ZINC000683185202 927835940 /nfs/dbraw/zinc/83/59/40/927835940.db2.gz UHRXBHQZCAUDLT-UHFFFAOYSA-N -1 3 353.296 3.745 20 0 FHADHM CC(=O)c1cccc(NC(=O)c2cnn(CC(C)C)c2C(F)F)c1[O-] ZINC000583166302 937197472 /nfs/dbraw/zinc/19/74/72/937197472.db2.gz LKWVMOFQKISVDN-UHFFFAOYSA-N -1 3 351.353 3.637 20 0 FHADHM O=C([N-]c1nnc(C(F)F)s1)c1cc(Br)ccc1F ZINC000108998663 927929163 /nfs/dbraw/zinc/92/91/63/927929163.db2.gz GSFGGHLMEICAFV-UHFFFAOYSA-N -1 3 352.135 3.630 20 0 FHADHM Cc1cc(C)cc(N2CC[C@H](C(=O)Nc3c([O-])cccc3Cl)C2=O)c1 ZINC000655110540 928166131 /nfs/dbraw/zinc/16/61/31/928166131.db2.gz DHBXZSLJSMZUFT-CQSZACIVSA-N -1 3 358.825 3.654 20 0 FHADHM CC(C)[C@H](NC(=O)CCCc1ccc([O-])c(F)c1)C1(CO)CCCC1 ZINC000655172312 928426217 /nfs/dbraw/zinc/42/62/17/928426217.db2.gz YFJUSOZWHUCNJI-IBGZPJMESA-N -1 3 351.462 3.548 20 0 FHADHM O=C(NCc1ncccc1[O-])Nc1ccc(-c2nc3ccccc3o2)cc1 ZINC000471177204 928596625 /nfs/dbraw/zinc/59/66/25/928596625.db2.gz MLCKNWCKPSGSRZ-UHFFFAOYSA-N -1 3 360.373 3.917 20 0 FHADHM 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ZINC000064956863 930056770 /nfs/dbraw/zinc/05/67/70/930056770.db2.gz XVXBLFBHXIKOFB-GXTWGEPZSA-N -1 3 370.927 3.515 20 0 FHADHM O=C(Nc1cccc([O-])c1F)C1(c2ccc(Br)cc2)CC1 ZINC000129478274 930185647 /nfs/dbraw/zinc/18/56/47/930185647.db2.gz YXVQTOMIEQYHGB-UHFFFAOYSA-N -1 3 350.187 3.964 20 0 FHADHM O=S(=O)(CCOc1ccc(F)cc1)[N-]c1ccc(Cl)cc1Cl ZINC000070879253 930193133 /nfs/dbraw/zinc/19/31/33/930193133.db2.gz OOPPLFQHQQLJIK-UHFFFAOYSA-N -1 3 364.225 3.953 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N2CCSC[C@@H]2c2ccc(C)cc2)c1 ZINC000122579097 930454186 /nfs/dbraw/zinc/45/41/86/930454186.db2.gz ZAMJOHKHURFVMW-GOSISDBHSA-N -1 3 370.474 3.589 20 0 FHADHM C[C@@H](C(=O)Nc1nnc(C(F)(F)F)[n-]1)c1ccc(C(F)(F)F)cc1 ZINC000467128514 937417132 /nfs/dbraw/zinc/41/71/32/937417132.db2.gz ZKUAIZBSCUVHHX-ZCFIWIBFSA-N -1 3 352.238 3.585 20 0 FHADHM C[C@@H](C(=O)Nc1nc(C(F)(F)F)n[n-]1)c1ccc(C(F)(F)F)cc1 ZINC000467128514 937417133 /nfs/dbraw/zinc/41/71/33/937417133.db2.gz ZKUAIZBSCUVHHX-ZCFIWIBFSA-N -1 3 352.238 3.585 20 0 FHADHM COc1ccc(CN(C)C)cc1[N-]S(=O)(=O)c1ccc(Cl)c(C)c1 ZINC000656183904 930531453 /nfs/dbraw/zinc/53/14/53/930531453.db2.gz RVWGVKJUBKEOAN-UHFFFAOYSA-N -1 3 368.886 3.519 20 0 FHADHM O=C(Nc1ccc(Nc2ccccc2)cn1)c1nnc2ccccc2c1[O-] ZINC001167416142 930793093 /nfs/dbraw/zinc/79/30/93/930793093.db2.gz HBQFGSMISITUBU-UHFFFAOYSA-N -1 3 357.373 3.726 20 0 FHADHM CSCc1ccc(C(=O)N[N-]C(=O)c2ccc(Cl)cc2Cl)cc1 ZINC000023691636 930840776 /nfs/dbraw/zinc/84/07/76/930840776.db2.gz QXAXOTBFMQVAKF-UHFFFAOYSA-N -1 3 369.273 3.931 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)CSCCC(C)C)c2)n1 ZINC000056408892 930936723 /nfs/dbraw/zinc/93/67/23/930936723.db2.gz IFBVTFNYQNULHS-UHFFFAOYSA-N -1 3 359.495 3.717 20 0 FHADHM CN(CCCOc1ccccc1)Cc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000029853649 931570603 /nfs/dbraw/zinc/57/06/03/931570603.db2.gz WJUZZTYBKCVWTP-UHFFFAOYSA-N -1 3 363.417 3.983 20 0 FHADHM O=C([O-])[C@]1(C(F)(F)F)CCN(Cc2cc(Cl)cc3cccnc32)C1 ZINC000581195765 931657601 /nfs/dbraw/zinc/65/76/01/931657601.db2.gz HOPNAQXOJZYVSG-HNNXBMFYSA-N -1 3 358.747 3.727 20 0 FHADHM CCOc1cc(CN2C[C@@H](C)O[C@H](C(F)(F)F)C2)cc(Cl)c1[O-] ZINC000656444423 931736721 /nfs/dbraw/zinc/73/67/21/931736721.db2.gz AGUOCPHYLXRERO-RNCFNFMXSA-N -1 3 353.768 3.596 20 0 FHADHM CC(C)C[C@H](NC(=O)Nc1ccc2c(c1)C(=O)[N-]C2=O)c1cccs1 ZINC000065818372 931793899 /nfs/dbraw/zinc/79/38/99/931793899.db2.gz QWCOJJICUHNJHY-AWEZNQCLSA-N -1 3 357.435 3.541 20 0 FHADHM COc1cccc([C@H](CC(=O)[O-])NCc2cc3ccncc3s2)c1OC ZINC000656565336 932080152 /nfs/dbraw/zinc/08/01/52/932080152.db2.gz LAWMYTSHIFVIFL-HNNXBMFYSA-N -1 3 372.446 3.619 20 0 FHADHM CC[C@H](C)Oc1cc(CN[C@H](CC(=O)[O-])c2ccncc2)ccc1OC ZINC000656567663 932090089 /nfs/dbraw/zinc/09/00/89/932090089.db2.gz ZCTWKFHPDDFJGT-WMLDXEAASA-N -1 3 358.438 3.573 20 0 FHADHM CCCc1cc(=O)[n-]c(C(=Cc2ccc(O[C@H]3CCOC3)cc2)CC)n1 ZINC000656613206 932174911 /nfs/dbraw/zinc/17/49/11/932174911.db2.gz HJBSUAYUAMLKAX-UIRWJGRMSA-N -1 3 354.450 3.841 20 0 FHADHM CC[C@@H](C)Oc1cccc(S(=O)(=O)[N-]c2cc(OC)ccc2F)c1 ZINC000656624452 932209487 /nfs/dbraw/zinc/20/94/87/932209487.db2.gz PAXIZONXWSPYFY-GFCCVEGCSA-N -1 3 353.415 3.812 20 0 FHADHM CCOc1cc(CN2CCC(=O)Nc3cc(F)ccc32)cc(Cl)c1[O-] ZINC000656626502 932212834 /nfs/dbraw/zinc/21/28/34/932212834.db2.gz DDRJAOSHSSOZDS-UHFFFAOYSA-N -1 3 364.804 3.932 20 0 FHADHM CC[C@H](C)n1ncc([N-]S(=O)(=O)CCc2ccc(F)cc2)c1C1CC1 ZINC000656627183 932213556 /nfs/dbraw/zinc/21/35/56/932213556.db2.gz UCBKJRVOHBTVLF-ZDUSSCGKSA-N -1 3 365.474 3.855 20 0 FHADHM CCCCn1ncc([N-]S(=O)(=O)CCc2ccccc2F)c1C(C)C ZINC000656629489 932219869 /nfs/dbraw/zinc/21/98/69/932219869.db2.gz WOPKPFZTEOMPMV-UHFFFAOYSA-N -1 3 367.490 3.930 20 0 FHADHM O=C([O-])[C@@H]1CCN(Cc2nnc(-c3ccccc3)s2)[C@H]2CCCC[C@H]12 ZINC000656766823 932399072 /nfs/dbraw/zinc/39/90/72/932399072.db2.gz QFAWMLJVJKWXMZ-OAGGEKHMSA-N -1 3 357.479 3.670 20 0 FHADHM O=C([O-])[C@@H]1CCN(Cc2ccc(Br)s2)[C@@H]2CCCC[C@@H]12 ZINC000656766463 932401742 /nfs/dbraw/zinc/40/17/42/932401742.db2.gz SARCJHDZBPUUBK-YNEHKIRRSA-N -1 3 358.301 3.976 20 0 FHADHM O=C([O-])[C@@H]1CCN(Cc2ccc(-c3ccccn3)nc2)[C@@H]2CCCC[C@@H]12 ZINC000656768728 932405247 /nfs/dbraw/zinc/40/52/47/932405247.db2.gz WLPYPPFKVWSNBJ-SQGPQFPESA-N -1 3 351.450 3.609 20 0 FHADHM O=C(Nc1nc2ccc(C(F)(F)F)cc2[nH]1)c1c(F)ccc([O-])c1F ZINC000581694423 932509856 /nfs/dbraw/zinc/50/98/56/932509856.db2.gz QBZFAUOXHBKLEF-UHFFFAOYSA-N -1 3 357.238 3.818 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@H]3Cc4ccc(F)cc43)c2)n1 ZINC000684396748 932539246 /nfs/dbraw/zinc/53/92/46/932539246.db2.gz RWEPMFQMRXNXAZ-SFHVURJKSA-N -1 3 363.392 3.829 20 0 FHADHM CC(C)(C)OCc1ccccc1C(=O)Nc1cc(-c2nnn[n-]2)ccc1F ZINC000891470632 932625525 /nfs/dbraw/zinc/62/55/25/932625525.db2.gz FMPBBDRKRGCJDK-UHFFFAOYSA-N -1 3 369.400 3.573 20 0 FHADHM CC(C)(C)OCc1ccccc1C(=O)Nc1cc(-c2nn[n-]n2)ccc1F ZINC000891470632 932625533 /nfs/dbraw/zinc/62/55/33/932625533.db2.gz FMPBBDRKRGCJDK-UHFFFAOYSA-N -1 3 369.400 3.573 20 0 FHADHM CCCCOc1ccc(C(=O)Nc2ccc(-c3nnn[n-]3)cc2)c(Cl)c1 ZINC000471772035 932841183 /nfs/dbraw/zinc/84/11/83/932841183.db2.gz QHXMDLGPFULVDW-UHFFFAOYSA-N -1 3 371.828 3.951 20 0 FHADHM CCCCOc1ccc(C(=O)Nc2ccc(-c3nn[n-]n3)cc2)c(Cl)c1 ZINC000471772035 932841185 /nfs/dbraw/zinc/84/11/85/932841185.db2.gz QHXMDLGPFULVDW-UHFFFAOYSA-N -1 3 371.828 3.951 20 0 FHADHM CCN(c1ccc([N-]S(=O)(=O)c2cccc(C(C)=O)c2)cc1)C(C)C ZINC000326456201 933012846 /nfs/dbraw/zinc/01/28/46/933012846.db2.gz FNVOKYGKTHAJQQ-UHFFFAOYSA-N -1 3 360.479 3.925 20 0 FHADHM C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)NCc1ncccc1[O-] ZINC000471817593 933029359 /nfs/dbraw/zinc/02/93/59/933029359.db2.gz VHFPXHHMLMAVKG-JTQLQIEISA-N -1 3 354.237 3.524 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2cccc(-c3cn[nH]c3)c2)c(C)c1C ZINC000090166419 933603464 /nfs/dbraw/zinc/60/34/64/933603464.db2.gz JQTAUKGJIQJJNY-UHFFFAOYSA-N -1 3 357.435 3.503 20 0 FHADHM C[C@H](CC(=O)c1ccccc1)[N-]S(=O)(=O)c1c(Cl)cccc1Cl ZINC000431072510 933782676 /nfs/dbraw/zinc/78/26/76/933782676.db2.gz SJNXHLBLKGJACL-LLVKDONJSA-N -1 3 372.273 3.933 20 0 FHADHM CC1(C)Cc2cc(S(=O)(=O)[N-]c3cc(F)cc(F)c3F)ccc2O1 ZINC000431146560 933934795 /nfs/dbraw/zinc/93/47/95/933934795.db2.gz PZIVZHBQDOACBA-UHFFFAOYSA-N -1 3 357.353 3.618 20 0 FHADHM O=C(NCc1cccc(NC(=O)C2CCCCC2)c1)c1c([O-])cccc1O ZINC000092120133 933962260 /nfs/dbraw/zinc/96/22/60/933962260.db2.gz BKEUIBNSTPKOQB-UHFFFAOYSA-N -1 3 368.433 3.547 20 0 FHADHM COc1cc(CN[C@@H](CC(=O)[O-])c2ccsc2)ccc1OC(F)F ZINC000276935886 934062183 /nfs/dbraw/zinc/06/21/83/934062183.db2.gz BZJGWKQHAGFXLG-LBPRGKRZSA-N -1 3 357.378 3.664 20 0 FHADHM CCc1ccc([C@@H]2CN(C(=O)c3cc(=O)c4ccccc4[n-]3)CCO2)cc1 ZINC000276965392 934152143 /nfs/dbraw/zinc/15/21/43/934152143.db2.gz UIXMBECACLMEOY-NRFANRHFSA-N -1 3 362.429 3.717 20 0 FHADHM O=C(Nc1ccc(Cl)cc1)C(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000535706163 934303470 /nfs/dbraw/zinc/30/34/70/934303470.db2.gz YMACVDHHUXUOGQ-UHFFFAOYSA-N -1 3 358.703 3.642 20 0 FHADHM COc1ccc(CN[C@H](CC(=O)[O-])c2ccsc2)cc1OC(F)F ZINC000277026745 934458642 /nfs/dbraw/zinc/45/86/42/934458642.db2.gz 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ZINC000435473928 943433617 /nfs/dbraw/zinc/43/36/17/943433617.db2.gz SQOFEBGTCWQCTA-UHFFFAOYSA-N -1 3 351.454 3.673 20 0 FHADHM COc1cc(C(=O)N(Cc2ccc(C)c(C)c2)C2CC2)cc(OC)c1[O-] ZINC000163577508 943468065 /nfs/dbraw/zinc/46/80/65/943468065.db2.gz QVTPLIQVERZZJW-UHFFFAOYSA-N -1 3 355.434 3.831 20 0 FHADHM C[C@@H](Oc1ccccc1F)C(=O)Nc1ccc(Br)cc1[O-] ZINC000515078471 943488459 /nfs/dbraw/zinc/48/84/59/943488459.db2.gz SLTOHMIDZIMCHD-SECBINFHSA-N -1 3 354.175 3.700 20 0 FHADHM O=C(Cc1ccc(Cl)s1)NCc1ccc([O-])c(Br)c1 ZINC000513806996 943493756 /nfs/dbraw/zinc/49/37/56/943493756.db2.gz TYAVXTHVBWSZOZ-UHFFFAOYSA-N -1 3 360.660 3.729 20 0 FHADHM Cc1ccccc1[C@H](c1noc(Cc2c(C)nc(C)[n-]c2=O)n1)C(C)C ZINC000584749001 943528289 /nfs/dbraw/zinc/52/82/89/943528289.db2.gz XTLGXOVVJLAODD-GOSISDBHSA-N -1 3 352.438 3.869 20 0 FHADHM CCc1ccc(-c2csc(NC(=O)Cc3c(C)nc(C)[n-]c3=O)n2)s1 ZINC000515209128 943568771 /nfs/dbraw/zinc/56/87/71/943568771.db2.gz GCUQZBLBZDIKIG-UHFFFAOYSA-N -1 3 374.491 3.728 20 0 FHADHM CC(C)(C)CCC(=O)Nc1cc(C(F)(F)F)ccc1[N-]S(C)(=O)=O ZINC000159115866 943615544 /nfs/dbraw/zinc/61/55/44/943615544.db2.gz RTRJLAUMFCIXRD-UHFFFAOYSA-N -1 3 366.405 3.842 20 0 FHADHM O=C([O-])[C@H](CNCc1csc(C2CC2)n1)Cc1ccccc1Cl ZINC000417546674 943686339 /nfs/dbraw/zinc/68/63/39/943686339.db2.gz MXLOVXUFVMXURE-ZDUSSCGKSA-N -1 3 350.871 3.707 20 0 FHADHM CCCc1csc(CNC[C@@H](Cc2ccc(Cl)cc2)C(=O)[O-])n1 ZINC000417547828 943688036 /nfs/dbraw/zinc/68/80/36/943688036.db2.gz PHSAGSUDUXWTEZ-CYBMUJFWSA-N -1 3 352.887 3.782 20 0 FHADHM CC(C)[C@H]1C[C@@](NCc2cnn(C(C)(C)C)c2)(C(=O)[O-])c2ccccc21 ZINC000417562756 943694627 /nfs/dbraw/zinc/69/46/27/943694627.db2.gz CTKVRVMNFCOQQV-UTKZUKDTSA-N -1 3 355.482 3.851 20 0 FHADHM COc1cccc(C[C@@H](NCc2csc(Cl)c2Cl)C(=O)[O-])c1 ZINC000417579704 943724622 /nfs/dbraw/zinc/72/46/22/943724622.db2.gz CUXISXCSFLCSCE-GFCCVEGCSA-N -1 3 360.262 3.849 20 0 FHADHM CC(C)Cn1cc(CN[C@@]2(C(=O)[O-])C[C@@H](C(C)C)c3ccccc32)cn1 ZINC000417587642 943735563 /nfs/dbraw/zinc/73/55/63/943735563.db2.gz ODQXHGBACKRPAY-RXVVDRJESA-N -1 3 355.482 3.752 20 0 FHADHM COc1cc(-c2ccccc2)ccc1CN[C@@H](COC(C)(C)C)C(=O)[O-] ZINC000417591326 943739547 /nfs/dbraw/zinc/73/95/47/943739547.db2.gz GCWGQWGONQDIKY-SFHVURJKSA-N -1 3 357.450 3.720 20 0 FHADHM C[C@@H](C(=O)[O-])[C@H](C)NCc1csc(-c2cccc(Br)c2)n1 ZINC000417606650 943747118 /nfs/dbraw/zinc/74/71/18/943747118.db2.gz FSFKSIAUYCKHPL-ZJUUUORDSA-N -1 3 369.284 3.771 20 0 FHADHM O=C([N-]c1nnc(C(F)F)s1)c1cc(Br)ncc1Cl ZINC000188806569 943758910 /nfs/dbraw/zinc/75/89/10/943758910.db2.gz YMRFXSPPZDBPGU-UHFFFAOYSA-N -1 3 369.578 3.539 20 0 FHADHM Cc1cc(Br)c(CNC[C@@H](CC(=O)[O-])C(F)(F)F)s1 ZINC000417623397 943760018 /nfs/dbraw/zinc/76/00/18/943760018.db2.gz JQQDWVAVOYRXNL-SSDOTTSWSA-N -1 3 360.195 3.562 20 0 FHADHM O=C([O-])C[C@H](CNCc1ccc(Br)cc1Cl)C(F)F ZINC000417629136 943767339 /nfs/dbraw/zinc/76/73/39/943767339.db2.gz VGMPIAVBRFDDNG-MRVPVSSYSA-N -1 3 356.594 3.548 20 0 FHADHM COc1cc(CN[C@H]2C[C@H](C(=O)[O-])c3ccccc32)ccc1OC(C)C ZINC000417628387 943778480 /nfs/dbraw/zinc/77/84/80/943778480.db2.gz WDSBMBMJDCLUPN-ROUUACIJSA-N -1 3 355.434 3.885 20 0 FHADHM CO[C@H](CNCc1ccc(-c2ccc(C(F)(F)F)cc2)o1)CC(=O)[O-] ZINC000417639767 943788795 /nfs/dbraw/zinc/78/87/95/943788795.db2.gz UCBVAQDZGPGWIU-AWEZNQCLSA-N -1 3 357.328 3.545 20 0 FHADHM O=C([O-])C[C@@H](CCNCc1cc(F)ccc1Br)C(F)(F)F ZINC000417643437 943791430 /nfs/dbraw/zinc/79/14/30/943791430.db2.gz AEQQRBXZROGBGL-SECBINFHSA-N -1 3 372.156 3.721 20 0 FHADHM CC(C)C[C@@H](NC(=O)CN1CCCC[C@H]1CCC(=O)[O-])c1ccccc1 ZINC000424248939 943805173 /nfs/dbraw/zinc/80/51/73/943805173.db2.gz ACVDIKDJKIEHPJ-RBUKOAKNSA-N -1 3 360.498 3.609 20 0 FHADHM CCOC[C@@H](NCc1ccccc1Oc1ccc(F)cc1Cl)C(=O)[O-] ZINC000417664690 943807958 /nfs/dbraw/zinc/80/79/58/943807958.db2.gz YUQRTWNHGQIWBT-OAHLLOKOSA-N -1 3 367.804 3.851 20 0 FHADHM C[C@@H](NC(=O)CN1CCCC[C@H]1CCC(=O)[O-])c1ccc2ccccc2c1 ZINC000424254925 943808178 /nfs/dbraw/zinc/80/81/78/943808178.db2.gz HIRPICCIHONLPS-UZLBHIALSA-N -1 3 368.477 3.736 20 0 FHADHM CC[C@H](NC(=O)CN1CCCC[C@@H]1CCC(=O)[O-])c1ccc(Cl)cc1 ZINC000424255908 943808951 /nfs/dbraw/zinc/80/89/51/943808951.db2.gz IKIRHWGKJCQRJZ-SJORKVTESA-N -1 3 366.889 3.627 20 0 FHADHM COC(=O)c1cccc2[n-]c(NC(=O)c3ccc(C)c(Cl)c3F)nc21 ZINC000515455606 943892715 /nfs/dbraw/zinc/89/27/15/943892715.db2.gz IXQYVUMTQGWWPH-UHFFFAOYSA-N -1 3 361.760 3.703 20 0 FHADHM O=S(=O)([N-]Cc1ccc2sccc2c1)c1cnccc1C(F)(F)F ZINC000516997348 943901874 /nfs/dbraw/zinc/90/18/74/943901874.db2.gz DQCQUUJJTLOXBY-UHFFFAOYSA-N -1 3 372.393 3.794 20 0 FHADHM CCn1ccnc1[C@H]1CCCCN1C(=O)CCCc1ccc([O-])c(F)c1 ZINC000435986687 943913783 /nfs/dbraw/zinc/91/37/83/943913783.db2.gz VCWVXIOMTAJZLV-QGZVFWFLSA-N -1 3 359.445 3.824 20 0 FHADHM COc1cc(C(=O)N2CCC[C@@]2(C)Cc2cccc(F)c2)cc(OC)c1[O-] ZINC000515487981 943934849 /nfs/dbraw/zinc/93/48/49/943934849.db2.gz ZOFFYXLZCYJFGO-NRFANRHFSA-N -1 3 373.424 3.786 20 0 FHADHM COC[C@H](C)Nc1ccccc1NC(=O)c1ccc2c(c1[O-])OC(C)(C)C2 ZINC000437597524 943939540 /nfs/dbraw/zinc/93/95/40/943939540.db2.gz CZGGCNRCOOPVMY-ZDUSSCGKSA-N -1 3 370.449 3.805 20 0 FHADHM COc1ccc(Cl)cc1-c1cc(=NC(=O)C[C@@H](C)n2cccc2)[nH][n-]1 ZINC000517096368 943996376 /nfs/dbraw/zinc/99/63/76/943996376.db2.gz AQWHTNFGXAZQRN-GFCCVEGCSA-N -1 3 358.829 3.552 20 0 FHADHM O=C([O-])[C@H]1CCO[C@H]1CNCc1ccc(-c2cccc(Cl)c2Cl)o1 ZINC000424631065 944020793 /nfs/dbraw/zinc/02/07/93/944020793.db2.gz ZQGOMWQLSYGAMH-WFASDCNBSA-N -1 3 370.232 3.833 20 0 FHADHM O=S(=O)([N-]c1ccc(F)cc1)c1ccc(CNCc2ccco2)cc1 ZINC000531884853 944021747 /nfs/dbraw/zinc/02/17/47/944021747.db2.gz JEIVKQFRZHXWBV-UHFFFAOYSA-N -1 3 360.410 3.509 20 0 FHADHM Cc1ccccc1[C@H](CC(F)(F)F)NC(=O)c1cc(F)cc2n[n-]nc21 ZINC000505117593 944048088 /nfs/dbraw/zinc/04/80/88/944048088.db2.gz PAXYDTGXPCZAHR-AWEZNQCLSA-N -1 3 366.318 3.829 20 0 FHADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(-n3cccn3)c(F)c2)cc1Cl ZINC000515630654 944062466 /nfs/dbraw/zinc/06/24/66/944062466.db2.gz DIJNNXKKPRDUKK-UHFFFAOYSA-N -1 3 365.817 3.774 20 0 FHADHM Cc1ccc(S(=O)(=O)[N-]c2cccc(Br)c2Cl)cn1 ZINC000549994720 944062752 /nfs/dbraw/zinc/06/27/52/944062752.db2.gz RPWFJKGNHXEHQW-UHFFFAOYSA-N -1 3 361.648 3.607 20 0 FHADHM O=C([O-])c1cccc(Cl)c1CN1CCC(OC[C@@H]2CCCCO2)CC1 ZINC000515660179 944104199 /nfs/dbraw/zinc/10/41/99/944104199.db2.gz PVZFLJOJWRXIDM-HNNXBMFYSA-N -1 3 367.873 3.588 20 0 FHADHM COc1ccc(C)cc1S(=O)(=O)[N-][C@@H](c1ccccc1)C(F)(F)F ZINC000515751917 944180526 /nfs/dbraw/zinc/18/05/26/944180526.db2.gz DUJZNQKRTOSUNO-HNNXBMFYSA-N -1 3 359.369 3.586 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N3CC(Cc4ccccc4C)C3)nc2)n1 ZINC000664545951 944229956 /nfs/dbraw/zinc/22/99/56/944229956.db2.gz GGFPUMHEKNPKSR-UHFFFAOYSA-N -1 3 360.461 3.794 20 0 FHADHM COc1cc(C)c(S(=O)(=O)[N-]c2cccc(CSC)c2)cc1C ZINC000518310187 944270681 /nfs/dbraw/zinc/27/06/81/944270681.db2.gz YZMVVXWYYQXGBS-UHFFFAOYSA-N -1 3 351.493 3.976 20 0 FHADHM O=C(N=c1cc(-c2ccncc2)[n-][nH]1)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1 ZINC000439145806 944378439 /nfs/dbraw/zinc/37/84/39/944378439.db2.gz XZMKZFWDVLHEFI-HUUCEWRRSA-N -1 3 373.243 3.943 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N[C@]2(c3ccc(Cl)cc3)C[C@@H]2C)c1 ZINC000436509659 944379760 /nfs/dbraw/zinc/37/97/60/944379760.db2.gz SDSVXXYHNMGLCK-JEOXALJRSA-N -1 3 358.825 3.669 20 0 FHADHM COc1ccccc1[C@@H](CNC(=O)c1ccc2ccccc2c1[O-])N(C)C ZINC000436521809 944390367 /nfs/dbraw/zinc/39/03/67/944390367.db2.gz HTRLHWDVQVPVBZ-LJQANCHMSA-N -1 3 364.445 3.587 20 0 FHADHM COc1ccc(Br)cc1CN(C)C(=O)c1ccc(C)cc1[O-] ZINC000436522225 944390826 /nfs/dbraw/zinc/39/08/26/944390826.db2.gz SCBVFLZLNFXRKO-UHFFFAOYSA-N -1 3 364.239 3.744 20 0 FHADHM COC(=O)c1ccccc1CC1CCN(C(=O)c2ccc(C)cc2[O-])CC1 ZINC000436531181 944398790 /nfs/dbraw/zinc/39/87/90/944398790.db2.gz VRBZRFPLPHRKIE-UHFFFAOYSA-N -1 3 367.445 3.582 20 0 FHADHM C[C@H]1CCN(C)CCN1C(=O)c1cc(-c2ccccc2)cc(Cl)c1[O-] ZINC000436548784 944407417 /nfs/dbraw/zinc/40/74/17/944407417.db2.gz UZWBIJXMLAPTIP-AWEZNQCLSA-N -1 3 358.869 3.879 20 0 FHADHM COc1cc(F)ccc1N1CCN(C(=O)c2ccc(C(C)C)cc2[O-])CC1 ZINC000436552042 944411734 /nfs/dbraw/zinc/41/17/34/944411734.db2.gz TWIQFNBEWBMSLC-UHFFFAOYSA-N -1 3 372.440 3.626 20 0 FHADHM CC(=O)Nc1ccc(Cl)cc1NC(=O)c1ccc2c(c1[O-])OC(C)(C)C2 ZINC000436538042 944416204 /nfs/dbraw/zinc/41/62/04/944416204.db2.gz ILBZJQLNEUEXGL-UHFFFAOYSA-N -1 3 374.824 3.970 20 0 FHADHM Cc1nccn1C[C@@H](C)CNC(=O)c1cc(Cl)c2ccccc2c1[O-] ZINC000436544918 944421792 /nfs/dbraw/zinc/42/17/92/944421792.db2.gz AMPCKOWJFATDLO-LBPRGKRZSA-N -1 3 357.841 3.770 20 0 FHADHM CC1(C)Cc2ccc(C(=O)Nc3nc4c(s3)CSCC4)c([O-])c2O1 ZINC000436558694 944426312 /nfs/dbraw/zinc/42/63/12/944426312.db2.gz WTKOKZAGLWIPRC-UHFFFAOYSA-N -1 3 362.476 3.604 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)c3ccc(C)c(C)c3O)c2)n1 ZINC000436565770 944430097 /nfs/dbraw/zinc/43/00/97/944430097.db2.gz WARBFQQJVKNRCO-UHFFFAOYSA-N -1 3 363.417 3.986 20 0 FHADHM Cc1nn(C)cc1[C@@H](C)NC(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436570709 944433848 /nfs/dbraw/zinc/43/38/48/944433848.db2.gz RZCQNGNTEGASGI-CYBMUJFWSA-N -1 3 351.406 3.717 20 0 FHADHM O=C(Nc1ccc2c(c1)CCCC(=O)N2)c1cc2c(cc1[O-])CCCC2 ZINC000436570308 944434483 /nfs/dbraw/zinc/43/44/83/944434483.db2.gz OSDCGPQJHHPYEQ-UHFFFAOYSA-N -1 3 350.418 3.798 20 0 FHADHM Cc1nccn1CCCCNC(=O)c1cc(Cl)c2ccccc2c1[O-] ZINC000436592406 944437703 /nfs/dbraw/zinc/43/77/03/944437703.db2.gz VANNQFLPXUTKIF-UHFFFAOYSA-N -1 3 357.841 3.914 20 0 FHADHM C[S@](=O)c1ccc(NC(=O)c2cc(Cc3ccccc3)ccc2[O-])cc1 ZINC000436591781 944437899 /nfs/dbraw/zinc/43/78/99/944437899.db2.gz RKIYWSHVXZKTDT-SANMLTNESA-N -1 3 365.454 3.973 20 0 FHADHM COc1ccc(C[C@H]2CCCN(C(=O)c3ccc(OC)cc3[O-])C2)cc1 ZINC000436592363 944439330 /nfs/dbraw/zinc/43/93/30/944439330.db2.gz UMPWPDSKRDEDGY-MRXNPFEDSA-N -1 3 355.434 3.504 20 0 FHADHM C[C@@H](NC(=O)c1cc(CCc2ccccc2)ccc1[O-])[C@H]1CCCOC1 ZINC000436579045 944444385 /nfs/dbraw/zinc/44/43/85/944444385.db2.gz TZSJIKVFXKUCIJ-APWZRJJASA-N -1 3 353.462 3.722 20 0 FHADHM COCCc1nc2cc(NC(=O)c3cc4c(cc3[O-])CCCC4)ccc2o1 ZINC000436583095 944447036 /nfs/dbraw/zinc/44/70/36/944447036.db2.gz JPBQTCZJVCICGN-UHFFFAOYSA-N -1 3 366.417 3.853 20 0 FHADHM CC(C)OC(=O)[C@H](C)N(C)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436586076 944449509 /nfs/dbraw/zinc/44/95/09/944449509.db2.gz LEHOCHCLMVNUTK-AWEZNQCLSA-N -1 3 357.406 3.597 20 0 FHADHM Cc1ccc([C@@H](Cn2ccnc2)NC(=O)c2cc(F)ccc2[O-])c(C)c1 ZINC000436600252 944452891 /nfs/dbraw/zinc/45/28/91/944452891.db2.gz FPRQHRBMQPLOGY-GOSISDBHSA-N -1 3 353.397 3.516 20 0 FHADHM Cc1cc(C)n(CCCNC(=O)c2cc(Cc3ccccc3)ccc2[O-])n1 ZINC000436605983 944455710 /nfs/dbraw/zinc/45/57/10/944455710.db2.gz CSVTVKKATYYZMT-UHFFFAOYSA-N -1 3 363.461 3.616 20 0 FHADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CC[C@H]([C@@H]2CCOC2)C1 ZINC000436605616 944456473 /nfs/dbraw/zinc/45/64/73/944456473.db2.gz PJURFBFEUJQMBV-VQTJNVASSA-N -1 3 365.473 3.676 20 0 FHADHM COc1ccc(NC(=O)c2cc(Cc3ccccc3)ccc2[O-])cc1CO ZINC000436611855 944461113 /nfs/dbraw/zinc/46/11/13/944461113.db2.gz ZBBPNIRBKNMSHX-UHFFFAOYSA-N -1 3 363.413 3.736 20 0 FHADHM CC(C)c1ccc(C(=O)N2CC[C@@H](C(=O)N(C)c3ccccc3)C2)c([O-])c1 ZINC000436624727 944466394 /nfs/dbraw/zinc/46/63/94/944466394.db2.gz CBDIPTKFZJVXJR-QGZVFWFLSA-N -1 3 366.461 3.641 20 0 FHADHM CC(=O)c1ccc(C(=O)N[C@H](c2nccs2)c2ccccc2)cc1[O-] ZINC000436629931 944470434 /nfs/dbraw/zinc/47/04/34/944470434.db2.gz LTCLDNARYAFXQI-KRWDZBQOSA-N -1 3 352.415 3.571 20 0 FHADHM CC(C)(C)[C@@H]1CCCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2[O-])CC1 ZINC000436623571 944479897 /nfs/dbraw/zinc/47/98/97/944479897.db2.gz HAUPFBVHFUYPSE-SJLPKXTDSA-N -1 3 372.509 3.672 20 0 FHADHM CC(=O)c1ccc(C(=O)NCCCO[C@H]2CCCc3ccccc32)cc1[O-] ZINC000436650611 944480897 /nfs/dbraw/zinc/48/08/97/944480897.db2.gz SDLGDJRFXKFSRU-NRFANRHFSA-N -1 3 367.445 3.809 20 0 FHADHM COc1ccc(C(=O)N[C@@H](c2c[nH]c3ccccc32)C(F)(F)F)c([O-])c1 ZINC000436656138 944488522 /nfs/dbraw/zinc/48/85/22/944488522.db2.gz OUCURHOZDJDODV-INIZCTEOSA-N -1 3 364.323 3.916 20 0 FHADHM CCN(Cc1cccc(Br)c1)C(=O)c1c([O-])cccc1O ZINC000436648384 944497021 /nfs/dbraw/zinc/49/70/21/944497021.db2.gz QAQTUTIVPJWAPM-UHFFFAOYSA-N -1 3 350.212 3.523 20 0 FHADHM O=C(c1cc2ccccc2cc1[O-])N1CCN[C@@H](c2cccc(Cl)c2)C1 ZINC000436658996 944508894 /nfs/dbraw/zinc/50/88/94/944508894.db2.gz NGWXRTYOJNLRBK-LJQANCHMSA-N -1 3 366.848 3.986 20 0 FHADHM O=C(N[C@@H]1CCO[C@H](C2CC2)C1)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436657493 944509330 /nfs/dbraw/zinc/50/93/30/944509330.db2.gz QWKNKJUDTDUIJD-QRWLVFNGSA-N -1 3 353.418 3.872 20 0 FHADHM COc1cc(-c2nc(-c3ccc(CSC)cc3)no2)cc(OC)c1[O-] ZINC000436685829 944524914 /nfs/dbraw/zinc/52/49/14/944524914.db2.gz CBHCWAHHJNCYHP-UHFFFAOYSA-N -1 3 358.419 3.989 20 0 FHADHM Cc1ccc(C(=O)N(C)CCCc2cc(-c3ccccc3)n(C)n2)c([O-])c1 ZINC000050173668 944527609 /nfs/dbraw/zinc/52/76/09/944527609.db2.gz HWCPBIQJBQEYCE-UHFFFAOYSA-N -1 3 363.461 3.806 20 0 FHADHM COC(=O)c1cccc2[n-]c(NC(=O)C3(c4ccc(Cl)cc4)CC3)nc21 ZINC000438358793 944530436 /nfs/dbraw/zinc/53/04/36/944530436.db2.gz QOYOISHYQQVJAS-UHFFFAOYSA-N -1 3 369.808 3.673 20 0 FHADHM O=C(c1ccc([O-])cc1)N1CCN(Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000436693634 944532843 /nfs/dbraw/zinc/53/28/43/944532843.db2.gz CBUQSGHVVJGRSW-UHFFFAOYSA-N -1 3 365.260 3.657 20 0 FHADHM O=C(Nc1nc(C2CCOCC2)cs1)c1cc2c(cc1[O-])CCCC2 ZINC000436696835 944536105 /nfs/dbraw/zinc/53/61/05/944536105.db2.gz ICFMEYYHFWAGCR-UHFFFAOYSA-N -1 3 358.463 3.874 20 0 FHADHM CC[C@@H](NC(=O)CCc1c(C)[n-]c(=O)c(C#N)c1C)c1ccc(C)c(F)c1 ZINC000093021147 944539184 /nfs/dbraw/zinc/53/91/84/944539184.db2.gz RUXAPIUVJITCMO-LJQANCHMSA-N -1 3 369.440 3.511 20 0 FHADHM O=C(NC1(c2cccc(C(F)(F)F)c2)CCOCC1)c1ccccc1[O-] ZINC000436709909 944539855 /nfs/dbraw/zinc/53/98/55/944539855.db2.gz XKYHDXDYCYLAAQ-UHFFFAOYSA-N -1 3 365.351 3.847 20 0 FHADHM CCn1cc(C(=O)[N-]c2nc(-c3cccs3)ns2)c(C(F)(F)F)n1 ZINC000438379254 944546986 /nfs/dbraw/zinc/54/69/86/944546986.db2.gz OSVUJGVURUKOMY-UHFFFAOYSA-N -1 3 373.385 3.754 20 0 FHADHM Cc1noc(C(C)(C)NC(=O)c2cc(CCc3ccccc3)ccc2[O-])n1 ZINC000436726829 944549300 /nfs/dbraw/zinc/54/93/00/944549300.db2.gz ZMPWRXQIHDYEKL-UHFFFAOYSA-N -1 3 365.433 3.534 20 0 FHADHM COc1ccc(C(=O)N2CCn3c(cc4c3cccc4Cl)C2)c([O-])c1 ZINC000436710355 944550850 /nfs/dbraw/zinc/55/08/50/944550850.db2.gz SLOKGMZMMJXRAA-UHFFFAOYSA-N -1 3 356.809 3.665 20 0 FHADHM Cc1c2cc(F)ccc2oc1CNC(=O)c1c[n-]c2ccccc2c1=O ZINC000120734491 944558320 /nfs/dbraw/zinc/55/83/20/944558320.db2.gz YBDVDPVSXYPFDX-UHFFFAOYSA-N -1 3 350.349 3.652 20 0 FHADHM CCOC(=O)c1ccc(C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)nc1C ZINC000436721928 944560312 /nfs/dbraw/zinc/56/03/12/944560312.db2.gz LYPZXHLLVPGRPA-UHFFFAOYSA-N -1 3 368.311 3.543 20 0 FHADHM Cn1ncc2c1CCC[C@@H]2NC(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436757783 944580615 /nfs/dbraw/zinc/58/06/15/944580615.db2.gz UKRRGUUWJNFBMI-SFHVURJKSA-N -1 3 363.417 3.725 20 0 FHADHM O=C(c1cc(Cl)c2ccccc2c1[O-])N1CCN(C2CCCC2)CC1 ZINC000436759849 944582513 /nfs/dbraw/zinc/58/25/13/944582513.db2.gz HMPXUGIFVWCKPC-UHFFFAOYSA-N -1 3 358.869 3.899 20 0 FHADHM [O-]c1ccccc1-c1nc(CSc2n[nH]c(-c3ccccc3)n2)no1 ZINC000436775897 944605119 /nfs/dbraw/zinc/60/51/19/944605119.db2.gz GOOKPHIJPKKAMD-UHFFFAOYSA-N -1 3 351.391 3.520 20 0 FHADHM CCN(CCNC(=O)c1cc2ccccc2cc1[O-])CCC(F)(F)F ZINC000436799940 944624686 /nfs/dbraw/zinc/62/46/86/944624686.db2.gz RLKSQZIEGAFZPD-UHFFFAOYSA-N -1 3 354.372 3.550 20 0 FHADHM CC(C)[C@H](C(=O)Nc1ccc(-c2nnn[n-]2)cc1)c1cccc(Cl)c1 ZINC000487744590 944634718 /nfs/dbraw/zinc/63/47/18/944634718.db2.gz XYEUYYNDXBFNTD-INIZCTEOSA-N -1 3 355.829 3.898 20 0 FHADHM CC(C)[C@H](C(=O)Nc1ccc(-c2nn[n-]n2)cc1)c1cccc(Cl)c1 ZINC000487744590 944634720 /nfs/dbraw/zinc/63/47/20/944634720.db2.gz XYEUYYNDXBFNTD-INIZCTEOSA-N -1 3 355.829 3.898 20 0 FHADHM C[C@@H](CC(=O)Nc1cccc(-c2nnn[n-]2)c1)Cc1ccc(Cl)cc1 ZINC000539038675 944637424 /nfs/dbraw/zinc/63/74/24/944637424.db2.gz JHKDBVSWCYLOPR-GFCCVEGCSA-N -1 3 355.829 3.728 20 0 FHADHM C[C@@H](CC(=O)Nc1cccc(-c2nn[n-]n2)c1)Cc1ccc(Cl)cc1 ZINC000539038675 944637429 /nfs/dbraw/zinc/63/74/29/944637429.db2.gz JHKDBVSWCYLOPR-GFCCVEGCSA-N -1 3 355.829 3.728 20 0 FHADHM C[C@@H](C(=O)Nc1cccc(-c2nnn[n-]2)c1)c1c(Cl)cccc1Cl ZINC000625108090 944639669 /nfs/dbraw/zinc/63/96/69/944639669.db2.gz XIDDTFCEBXXYIP-SECBINFHSA-N -1 3 362.220 3.916 20 0 FHADHM C[C@@H](C(=O)Nc1cccc(-c2nn[n-]n2)c1)c1c(Cl)cccc1Cl ZINC000625108090 944639675 /nfs/dbraw/zinc/63/96/75/944639675.db2.gz XIDDTFCEBXXYIP-SECBINFHSA-N -1 3 362.220 3.916 20 0 FHADHM COc1ccccc1[C@H](CC(C)C)NC(=O)c1cc(NC(C)=O)ccc1[O-] ZINC000436791711 944642402 /nfs/dbraw/zinc/64/24/02/944642402.db2.gz SVDDYCRJPKGPEJ-SFHVURJKSA-N -1 3 370.449 3.876 20 0 FHADHM Cc1ccc(C(=O)N[C@H](C)c2noc(-c3ccc(Cl)cc3)n2)c([O-])c1 ZINC000436804870 944659257 /nfs/dbraw/zinc/65/92/57/944659257.db2.gz BNGFXLZFRZNNRQ-LLVKDONJSA-N -1 3 357.797 3.895 20 0 FHADHM COC(=O)CSCc1cccc(NC(=O)c2ccc(C)c(C)c2[O-])c1 ZINC000436809215 944664082 /nfs/dbraw/zinc/66/40/82/944664082.db2.gz RVZZOKATTRKWOI-UHFFFAOYSA-N -1 3 359.447 3.668 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCCC2)c1ccco1 ZINC000735570985 944671795 /nfs/dbraw/zinc/67/17/95/944671795.db2.gz QXRKQIJJQOYEDT-JTQLQIEISA-N -1 3 357.439 3.532 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCCC2)c1ccco1 ZINC000735570985 944671800 /nfs/dbraw/zinc/67/18/00/944671800.db2.gz QXRKQIJJQOYEDT-JTQLQIEISA-N -1 3 357.439 3.532 20 0 FHADHM CCc1ccc(C(=O)Nc2ccc([C@H](C)N3CCOCC3)cc2)c([O-])c1 ZINC000436827511 944673617 /nfs/dbraw/zinc/67/36/17/944673617.db2.gz SSIDLFJZUCIAPY-HNNXBMFYSA-N -1 3 354.450 3.600 20 0 FHADHM CC[C@@]1(CO)CCCN(C(=O)c2cc(CCc3ccccc3)ccc2[O-])C1 ZINC000436830581 944677266 /nfs/dbraw/zinc/67/72/66/944677266.db2.gz DBJYHJVZHRXNBL-HSZRJFAPSA-N -1 3 367.489 3.802 20 0 FHADHM CCc1ccc(C(=O)N[C@@H](c2ccccn2)c2ccccc2OC)c([O-])c1 ZINC000436831516 944679008 /nfs/dbraw/zinc/67/90/08/944679008.db2.gz PTYUCLLRGMKTBD-OAQYLSRUSA-N -1 3 362.429 3.878 20 0 FHADHM CC(C)N(C(=O)c1cc(CCc2ccccc2)ccc1[O-])[C@@H]1CCOC1 ZINC000436832880 944680135 /nfs/dbraw/zinc/68/01/35/944680135.db2.gz TXPMDLKASVDTTE-LJQANCHMSA-N -1 3 353.462 3.817 20 0 FHADHM CCc1ccc(C(=O)N(CCCC(=O)OC)Cc2ccccc2)c([O-])c1 ZINC000436832749 944680251 /nfs/dbraw/zinc/68/02/51/944680251.db2.gz IIRRZWZLYQTQCB-UHFFFAOYSA-N -1 3 355.434 3.550 20 0 FHADHM COc1ccc(-c2ccncc2)cc1CN[C@@H](C(=O)[O-])c1ccc(C)cc1 ZINC000426684402 944684445 /nfs/dbraw/zinc/68/44/45/944684445.db2.gz ZKWUENJBFCQZBT-OAQYLSRUSA-N -1 3 362.429 3.981 20 0 FHADHM C[C@H](CN(C)C(=O)c1ccc(O)cc1[O-])Oc1ccc(Cl)c(Cl)c1 ZINC000436840511 944706483 /nfs/dbraw/zinc/70/64/83/944706483.db2.gz XACXUFVEYRCWPK-SNVBAGLBSA-N -1 3 370.232 3.944 20 0 FHADHM Cc1ccc(C(=O)Nc2cccc(F)c2Cn2cccc(C)c2=O)c([O-])c1 ZINC000436843888 944709592 /nfs/dbraw/zinc/70/95/92/944709592.db2.gz KTWUOGDIBQBUTO-UHFFFAOYSA-N -1 3 366.392 3.610 20 0 FHADHM O=C([O-])[C@H](NCc1ccc(-n2cccn2)cc1)c1ccc(Cl)c(F)c1 ZINC000426723148 944723502 /nfs/dbraw/zinc/72/35/02/944723502.db2.gz KJFMNACQZWKIHM-QGZVFWFLSA-N -1 3 359.788 3.580 20 0 FHADHM CC(=O)c1ccc(C(=O)NCCCCOc2ccc(Cl)cc2)cc1[O-] ZINC000436859945 944724528 /nfs/dbraw/zinc/72/45/28/944724528.db2.gz ZTIFXBPZSGFVIQ-UHFFFAOYSA-N -1 3 361.825 3.837 20 0 FHADHM O=C(c1ccc([O-])cc1F)N1CCN(Cc2cccc3ccccc32)CC1 ZINC000436863713 944728919 /nfs/dbraw/zinc/72/89/19/944728919.db2.gz VLBOIUWAJUSNLH-UHFFFAOYSA-N -1 3 364.420 3.643 20 0 FHADHM CCc1nc(C)c([C@H](C)N(C)C(=O)c2cc(OC)c([O-])c(OC)c2)s1 ZINC000164180301 944737755 /nfs/dbraw/zinc/73/77/55/944737755.db2.gz GJYBQAJUPGLMKI-NSHDSACASA-N -1 3 364.467 3.570 20 0 FHADHM CC[C@@H](CC1CCCCC1)C(=O)N1CCN(C(=O)c2ccc([O-])cc2)CC1 ZINC000436874459 944742984 /nfs/dbraw/zinc/74/29/84/944742984.db2.gz QQWFHJPBUCZERF-SFHVURJKSA-N -1 3 372.509 3.673 20 0 FHADHM CSc1cc2c(cc1CN[C@@H](C(=O)[O-])c1cccc(C)c1C)OCCO2 ZINC000426742401 944755825 /nfs/dbraw/zinc/75/58/25/944755825.db2.gz JKVZXATWXDMETM-LJQANCHMSA-N -1 3 373.474 3.712 20 0 FHADHM CCCOc1cccc2c(NCCNC(=O)c3ccc([O-])cc3)ccnc12 ZINC000436883810 944757621 /nfs/dbraw/zinc/75/76/21/944757621.db2.gz HZNFDKLZAIZJHY-UHFFFAOYSA-N -1 3 365.433 3.571 20 0 FHADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1C[C@H](CO)c2ccccc21 ZINC000436884809 944759367 /nfs/dbraw/zinc/75/93/67/944759367.db2.gz DJAYTSHXUHGSPD-OAHLLOKOSA-N -1 3 361.397 3.921 20 0 FHADHM Cc1cccc([C@@H](NCc2cnn(-c3ccc(F)cc3)c2)C(=O)[O-])c1C ZINC000426745795 944760013 /nfs/dbraw/zinc/76/00/13/944760013.db2.gz WAQZFHFGJDBUHY-LJQANCHMSA-N -1 3 353.397 3.544 20 0 FHADHM O=S(=O)(Cc1noc(-c2cc3ccccc3cc2[O-])n1)c1ccccc1 ZINC000436885907 944760602 /nfs/dbraw/zinc/76/06/02/944760602.db2.gz KZFFZJVTMZDRKB-UHFFFAOYSA-N -1 3 366.398 3.569 20 0 FHADHM COc1ccccc1[C@H](NCc1ccc(C(F)(F)F)cc1C)C(=O)[O-] ZINC000426766063 944765313 /nfs/dbraw/zinc/76/53/13/944765313.db2.gz WAPNPNSYDMAHET-INIZCTEOSA-N -1 3 353.340 3.938 20 0 FHADHM C[C@H](N=c1cc(N[C@@H](C)c2ccccc2)n2[n-]cnc2n1)c1ccccc1 ZINC000439567576 944768794 /nfs/dbraw/zinc/76/87/94/944768794.db2.gz HTQIHVAGKNBIBX-HOTGVXAUSA-N -1 3 358.449 3.892 20 0 FHADHM COc1ccc(CN[C@H](CCC(C)(C)C)C(=O)[O-])c(Br)c1O ZINC000426753501 944774057 /nfs/dbraw/zinc/77/40/57/944774057.db2.gz ITSTWFNZCGDOBP-LLVKDONJSA-N -1 3 374.275 3.532 20 0 FHADHM C[C@@H]1CCC[C@H](C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCCC3)C1 ZINC000736243905 944775439 /nfs/dbraw/zinc/77/54/39/944775439.db2.gz AUUFNCNMMZLMOR-NEPJUHHUSA-N -1 3 359.499 3.962 20 0 FHADHM C[C@@H]1CCC[C@H](C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCCC3)C1 ZINC000736243905 944775446 /nfs/dbraw/zinc/77/54/46/944775446.db2.gz AUUFNCNMMZLMOR-NEPJUHHUSA-N -1 3 359.499 3.962 20 0 FHADHM C[C@@H]1CCC[C@@H](C(=O)Nc2nc(-c3ccc(-c4nnn[n-]4)cc3)cs2)C1 ZINC000736245756 944776525 /nfs/dbraw/zinc/77/65/25/944776525.db2.gz WEXYPKPAKLUMFN-BXUZGUMPSA-N -1 3 368.466 3.755 20 0 FHADHM C[C@@H]1CCC[C@@H](C(=O)Nc2nc(-c3ccc(-c4nn[n-]n4)cc3)cs2)C1 ZINC000736245756 944776530 /nfs/dbraw/zinc/77/65/30/944776530.db2.gz WEXYPKPAKLUMFN-BXUZGUMPSA-N -1 3 368.466 3.755 20 0 FHADHM C[C@@H](C(=O)[O-])[C@@H](NCc1cnc(-c2ccccn2)s1)c1ccccc1 ZINC000426759741 944782251 /nfs/dbraw/zinc/78/22/51/944782251.db2.gz OIPMBGVSTQOLNO-CXAGYDPISA-N -1 3 353.447 3.757 20 0 FHADHM COc1cccc(-c2nc(-c3ccc(OC(F)F)c(OC)c3)no2)c1[O-] ZINC000436896167 944783249 /nfs/dbraw/zinc/78/32/49/944783249.db2.gz LTICZDRSLJRVKS-UHFFFAOYSA-N -1 3 364.304 3.728 20 0 FHADHM CCC[C@]1(CO)CCN(C(=O)c2cc(Cc3ccccc3)ccc2[O-])C1 ZINC000436929497 944791942 /nfs/dbraw/zinc/79/19/42/944791942.db2.gz VOWISBHHSNXTCN-QFIPXVFZSA-N -1 3 353.462 3.608 20 0 FHADHM CCCOc1ccc(CN[C@H](C(=O)[O-])c2ccc(F)cc2)cc1OCC ZINC000426776756 944793663 /nfs/dbraw/zinc/79/36/63/944793663.db2.gz HMTKBFAGDBTIOY-IBGZPJMESA-N -1 3 361.413 3.929 20 0 FHADHM COc1ccc([C@@H](NCc2ccc(OCC(C)C)cc2)C(=O)[O-])cc1F ZINC000426777564 944794906 /nfs/dbraw/zinc/79/49/06/944794906.db2.gz OMUJFBNLZWBFOJ-LJQANCHMSA-N -1 3 361.413 3.785 20 0 FHADHM CCC[C@H](C)N(C)C(=O)C[C@@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436914553 944796726 /nfs/dbraw/zinc/79/67/26/944796726.db2.gz ZOQOGYSXPKLFMX-OXJNMPFZSA-N -1 3 368.477 3.900 20 0 FHADHM COc1cccc(C[C@@H](NCc2csc(-c3ccccc3)n2)C(=O)[O-])c1 ZINC000426784904 944801604 /nfs/dbraw/zinc/80/16/04/944801604.db2.gz NXJFBMXCRYSCEH-GOSISDBHSA-N -1 3 368.458 3.604 20 0 FHADHM CCCSC[C@H](NCc1cc(Cl)cc(Cl)c1OC)C(=O)[O-] ZINC000426768314 944805583 /nfs/dbraw/zinc/80/55/83/944805583.db2.gz XKTFJPINZPQWSM-LBPRGKRZSA-N -1 3 352.283 3.688 20 0 FHADHM COc1cccc(C[C@H](NCc2csc(-c3cccs3)n2)C(=O)[O-])c1 ZINC000426806048 944806323 /nfs/dbraw/zinc/80/63/23/944806323.db2.gz IAMKIKMMEOCLTM-HNNXBMFYSA-N -1 3 374.487 3.666 20 0 FHADHM COc1cccc([C@H](CC(=O)[O-])NCc2cccc(OC(F)F)c2)c1 ZINC000426805380 944806437 /nfs/dbraw/zinc/80/64/37/944806437.db2.gz AYCFEHACYUDHRV-INIZCTEOSA-N -1 3 351.349 3.602 20 0 FHADHM COc1cccc([C@H](CC(=O)[O-])NCc2cnc(-c3ccccn3)s2)c1 ZINC000426788104 944810852 /nfs/dbraw/zinc/81/08/52/944810852.db2.gz KHEQOCQSTAUPGW-KRWDZBQOSA-N -1 3 369.446 3.519 20 0 FHADHM COc1ccc([C@H](CC(=O)[O-])NCc2ccc(Cl)cc2C)cc1OC ZINC000426790068 944812019 /nfs/dbraw/zinc/81/20/19/944812019.db2.gz AEVAJPVDGLDVJP-INIZCTEOSA-N -1 3 363.841 3.971 20 0 FHADHM O=C([O-])C[C@@H](NCc1cc2ccccc2[nH]c1=O)c1cccc(Cl)c1 ZINC000426790192 944812039 /nfs/dbraw/zinc/81/20/39/944812039.db2.gz BKBMDXOJDHBAEJ-QGZVFWFLSA-N -1 3 356.809 3.899 20 0 FHADHM COc1cccc([C@H](CC(=O)[O-])NCc2cc(C)c3ncccc3c2)c1 ZINC000426789700 944813545 /nfs/dbraw/zinc/81/35/45/944813545.db2.gz XAKRRGYPMFHRCS-IBGZPJMESA-N -1 3 350.418 3.857 20 0 FHADHM CC(C)NC(=O)NCc1ccc(C(=O)Nc2cc(Cl)ccc2[O-])cc1 ZINC000516395273 944813997 /nfs/dbraw/zinc/81/39/97/944813997.db2.gz XTLMRDFCLIBBKW-UHFFFAOYSA-N -1 3 361.829 3.506 20 0 FHADHM CCOc1cc(CN[C@H](C(=O)[O-])c2ccsc2)ccc1OC(F)F ZINC000426793744 944816893 /nfs/dbraw/zinc/81/68/93/944816893.db2.gz RMTYNBZPFIMCDZ-AWEZNQCLSA-N -1 3 357.378 3.664 20 0 FHADHM COCCOc1cccc(CN[C@H](CC(=O)[O-])c2cccc(Cl)c2)c1 ZINC000426796619 944818776 /nfs/dbraw/zinc/81/87/76/944818776.db2.gz COBGIAKVDYBGKA-GOSISDBHSA-N -1 3 363.841 3.671 20 0 FHADHM CCCOc1ccc(C(C)(C)NC(=O)c2cc(OC)c([O-])c(OC)c2)cc1 ZINC000436932691 944820519 /nfs/dbraw/zinc/82/05/19/944820519.db2.gz QLYXMLMYBYWCSS-UHFFFAOYSA-N -1 3 373.449 3.863 20 0 FHADHM COc1ccc([C@H](NCc2cc(C)c3ncccc3c2)C(=O)[O-])cc1F ZINC000426803318 944825448 /nfs/dbraw/zinc/82/54/48/944825448.db2.gz LTDFWCHJSNKZNV-IBGZPJMESA-N -1 3 354.381 3.606 20 0 FHADHM Cc1cccc(C(=O)Nc2cccc(CN3C[C@@H](C)O[C@H](C)C3)c2)c1[O-] ZINC000436941870 944828534 /nfs/dbraw/zinc/82/85/34/944828534.db2.gz GOEVDKXAJDRCAQ-HZPDHXFCSA-N -1 3 354.450 3.562 20 0 FHADHM CC[C@H]1CCCC[C@@H]1NC(=O)c1cc(NC(=O)c2cnoc2C)ccc1[O-] ZINC000436947367 944834328 /nfs/dbraw/zinc/83/43/28/944834328.db2.gz DLSDEHZEKOTSBQ-GUYCJALGSA-N -1 3 371.437 3.640 20 0 FHADHM CN(C)[C@H](CNC(=O)c1cc(Oc2ccccc2)ccc1[O-])c1ccco1 ZINC000436953394 944848250 /nfs/dbraw/zinc/84/82/50/944848250.db2.gz OZMBWZNCRFAXGN-GOSISDBHSA-N -1 3 366.417 3.810 20 0 FHADHM CCCN(C(=O)c1cc(OC)c([O-])c(OC)c1)[C@@H]1CCCc2cccnc21 ZINC000436954418 944849572 /nfs/dbraw/zinc/84/95/72/944849572.db2.gz GOHLQXKQOYVYRO-MRXNPFEDSA-N -1 3 370.449 3.734 20 0 FHADHM CCCOc1cc(CN[C@@H](C(=O)[O-])c2ccc(CC)cc2)ccc1OC ZINC000426826109 944850207 /nfs/dbraw/zinc/85/02/07/944850207.db2.gz NRXATHQUFBCENP-HXUWFJFHSA-N -1 3 357.450 3.962 20 0 FHADHM COc1ccc([C@H](NCc2ccc(Br)cc2)C(=O)[O-])cc1F ZINC000426826114 944850460 /nfs/dbraw/zinc/85/04/60/944850460.db2.gz CVMVJVXROTYWJI-HNNXBMFYSA-N -1 3 368.202 3.512 20 0 FHADHM CN(C(=O)c1cc(F)c([O-])c(Cl)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000436956858 944851996 /nfs/dbraw/zinc/85/19/96/944851996.db2.gz UMDSEWBMSDAGGM-HNNXBMFYSA-N -1 3 362.832 3.531 20 0 FHADHM CCCCOc1ccc(C(=O)N(C)CCOc2ccc(OC)cc2)c([O-])c1 ZINC000436970707 944857737 /nfs/dbraw/zinc/85/77/37/944857737.db2.gz GSDHLJCRMLZLCZ-UHFFFAOYSA-N -1 3 373.449 3.731 20 0 FHADHM COc1ccc2c(c1)C[C@H](C)N(C(=O)c1cc(OC)c([O-])c(OC)c1)[C@@H]2C ZINC000436971034 944857819 /nfs/dbraw/zinc/85/78/19/944857819.db2.gz NDWZMKGPHYRDED-QWHCGFSZSA-N -1 3 371.433 3.566 20 0 FHADHM CCCCOc1ccc(C(=O)N(C)CCc2ccccc2OC)c([O-])c1 ZINC000436973892 944863069 /nfs/dbraw/zinc/86/30/69/944863069.db2.gz VRHVCAJLZLAVKG-UHFFFAOYSA-N -1 3 357.450 3.894 20 0 FHADHM CCCSC[C@H](NCc1cc(Cl)c(OC)cc1Cl)C(=O)[O-] ZINC000426830452 944869210 /nfs/dbraw/zinc/86/92/10/944869210.db2.gz YCVBAEXTSFSGJY-LBPRGKRZSA-N -1 3 352.283 3.688 20 0 FHADHM C[C@]1(CCCO)CCCN1C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436981496 944873652 /nfs/dbraw/zinc/87/36/52/944873652.db2.gz UTDISBOKIQSLEI-OAQYLSRUSA-N -1 3 355.434 3.952 20 0 FHADHM CN(C(=O)c1ccccc1[O-])[C@H]1CCOc2ccc(Br)cc21 ZINC000438639275 944874709 /nfs/dbraw/zinc/87/47/09/944874709.db2.gz VLLYPWFHXLYFLR-AWEZNQCLSA-N -1 3 362.223 3.751 20 0 FHADHM CC1(CCNC(=O)C[C@H](NC(=O)c2ccc([O-])cc2)c2ccccc2)CC1 ZINC000436988502 944882254 /nfs/dbraw/zinc/88/22/54/944882254.db2.gz LKHKIJFRLRAJKA-IBGZPJMESA-N -1 3 366.461 3.560 20 0 FHADHM COc1cccc([C@@H](C)CCCC(=O)N=c2cc([C@H]3CCCO3)[n-][nH]2)c1 ZINC000473850551 944886701 /nfs/dbraw/zinc/88/67/01/944886701.db2.gz OFDLHRXEGSYDKY-KBXCAEBGSA-N -1 3 357.454 3.604 20 0 FHADHM COc1cccc([C@H](C)CCCC(=O)N=c2cc([C@@H]3CCCO3)[n-][nH]2)c1 ZINC000473850552 944886789 /nfs/dbraw/zinc/88/67/89/944886789.db2.gz OFDLHRXEGSYDKY-KDOFPFPSSA-N -1 3 357.454 3.604 20 0 FHADHM O=C(NCc1ccccc1)C1CCN(Cc2cccc([O-])c2Cl)CC1 ZINC000507024697 944890677 /nfs/dbraw/zinc/89/06/77/944890677.db2.gz BMYPPVPTSAZIPD-UHFFFAOYSA-N -1 3 358.869 3.574 20 0 FHADHM COc1ccc([O-])c(-c2nc(-c3cc(Cl)c4c(c3)OCCCO4)no2)c1 ZINC000436995774 944892396 /nfs/dbraw/zinc/89/23/96/944892396.db2.gz DTTBMMCFOMBOKE-UHFFFAOYSA-N -1 3 374.780 3.933 20 0 FHADHM CN(Cc1ccc(F)cc1-c1nnn[n-]1)c1cccc(OC(F)(F)F)c1 ZINC000736818970 944895795 /nfs/dbraw/zinc/89/57/95/944895795.db2.gz FEBBWFPPUFDDBD-UHFFFAOYSA-N -1 3 367.306 3.541 20 0 FHADHM CN(Cc1ccc(F)cc1-c1nn[n-]n1)c1cccc(OC(F)(F)F)c1 ZINC000736818970 944895801 /nfs/dbraw/zinc/89/58/01/944895801.db2.gz FEBBWFPPUFDDBD-UHFFFAOYSA-N -1 3 367.306 3.541 20 0 FHADHM O=C(c1ccccc1[O-])N1CC[C@H](Cc2ccc(Br)cc2)C1 ZINC000437001582 944898566 /nfs/dbraw/zinc/89/85/66/944898566.db2.gz OLOGSGJNIUSQPU-CQSZACIVSA-N -1 3 360.251 3.860 20 0 FHADHM O=C(Nc1n[n-]c(-c2ccco2)n1)c1cc(-c2ccc(Cl)cc2)c[nH]1 ZINC000426470998 944904965 /nfs/dbraw/zinc/90/49/65/944904965.db2.gz RBZAVIJMJWOSDH-UHFFFAOYSA-N -1 3 353.769 3.966 20 0 FHADHM O=C(NCc1ccc(F)cc1C(F)(F)F)c1cc(=O)c2ccccc2[n-]1 ZINC000507053297 944905635 /nfs/dbraw/zinc/90/56/35/944905635.db2.gz PZBUEMIVAVXDAM-UHFFFAOYSA-N -1 3 364.298 3.616 20 0 FHADHM CCCCOC1CCN(c2ccc(-c3nc(CC)cc(=O)[n-]3)cn2)CC1 ZINC000439722203 944920954 /nfs/dbraw/zinc/92/09/54/944920954.db2.gz VOGNKLUHSLOYNU-UHFFFAOYSA-N -1 3 356.470 3.592 20 0 FHADHM O=C(Nc1ccc(Cl)cc1[O-])c1cnn(-c2ccncc2)c1C(F)F ZINC000426987909 944980727 /nfs/dbraw/zinc/98/07/27/944980727.db2.gz WRMDJSWFGXSKAR-UHFFFAOYSA-N -1 3 364.739 3.816 20 0 FHADHM O=C(Nc1cc(Br)ccc1[O-])[C@@H]1CCCN1c1ccccc1 ZINC000426996311 944986648 /nfs/dbraw/zinc/98/66/48/944986648.db2.gz ZGHCERLJBZYHPZ-HNNXBMFYSA-N -1 3 361.239 3.762 20 0 FHADHM C[C@@H]1Cc2cc(S(=O)(=O)[N-]c3cccc(CC(F)(F)F)c3)ccc2O1 ZINC000438759197 944995206 /nfs/dbraw/zinc/99/52/06/944995206.db2.gz REMRBNOVSBYSOD-LLVKDONJSA-N -1 3 371.380 3.916 20 0 FHADHM COc1ccc(CN(C)Cc2c(F)ccc([O-])c2F)cc1OC(F)F ZINC000507188748 945033414 /nfs/dbraw/zinc/03/34/14/945033414.db2.gz RCOCMMRBGRQMGR-UHFFFAOYSA-N -1 3 359.319 3.912 20 0 FHADHM Cc1ccc(S(=O)(=O)[N-]c2cccc(F)c2F)cc1Br ZINC000438794065 945040295 /nfs/dbraw/zinc/04/02/95/945040295.db2.gz HRJDLWALBJEJSB-UHFFFAOYSA-N -1 3 362.195 3.837 20 0 FHADHM CCOCc1cccc([N-]S(=O)(=O)c2ccc3c(c2)CC(C)(C)O3)c1 ZINC000440290364 945380010 /nfs/dbraw/zinc/38/00/10/945380010.db2.gz BIVIHWADPFDQQB-UHFFFAOYSA-N -1 3 361.463 3.737 20 0 FHADHM C[C@H](NC(=O)N(CC1CC1)C1CCCCC1)c1cccc(-c2nnn[n-]2)c1 ZINC000820340449 945418350 /nfs/dbraw/zinc/41/83/50/945418350.db2.gz KUHKEKWZWXZVBV-AWEZNQCLSA-N -1 3 368.485 3.682 20 0 FHADHM C[C@H](NC(=O)N(CC1CC1)C1CCCCC1)c1cccc(-c2nn[n-]n2)c1 ZINC000820340449 945418356 /nfs/dbraw/zinc/41/83/56/945418356.db2.gz KUHKEKWZWXZVBV-AWEZNQCLSA-N -1 3 368.485 3.682 20 0 FHADHM Cc1ccccc1C[C@@H](CNCc1csc(-c2ccccn2)n1)C(=O)[O-] ZINC000426638080 945431631 /nfs/dbraw/zinc/43/16/31/945431631.db2.gz HWSGUZDYKUJNPC-INIZCTEOSA-N -1 3 367.474 3.547 20 0 FHADHM Cc1cc(=O)[n-]c(C(C)(C)NCc2ccc(Br)cc2Cl)n1 ZINC000660748065 945455176 /nfs/dbraw/zinc/45/51/76/945455176.db2.gz YCHVKUSHOKZHCW-UHFFFAOYSA-N -1 3 370.678 3.931 20 0 FHADHM CC(C)S(=O)(=O)Cc1ccc(NC(=O)c2cc([O-])ccc2Cl)cc1 ZINC000550304626 945560894 /nfs/dbraw/zinc/56/08/94/945560894.db2.gz IIRIVBNNDHYIHO-UHFFFAOYSA-N -1 3 367.854 3.621 20 0 FHADHM Cc1nonc1C(=O)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000093095505 945575896 /nfs/dbraw/zinc/57/58/96/945575896.db2.gz CXIVDRUBYHGQDD-UHFFFAOYSA-N -1 3 352.375 3.613 20 0 FHADHM CC(C)c1ccc(NC(=O)N2CCC(C[N-]C(=O)C(F)(F)F)CC2)cc1 ZINC000281396018 945622096 /nfs/dbraw/zinc/62/20/96/945622096.db2.gz OOCSRFGZCFNCED-UHFFFAOYSA-N -1 3 371.403 3.732 20 0 FHADHM Cc1ccc(Sc2ncccc2C(=O)NCc2ncccc2[O-])c(C)c1 ZINC000473633673 945634612 /nfs/dbraw/zinc/63/46/12/945634612.db2.gz KQSSDCVSKZABMZ-UHFFFAOYSA-N -1 3 365.458 3.880 20 0 FHADHM O=C(NCc1ncccc1[O-])c1ccc2noc(-c3ccc(F)cc3)c2c1 ZINC000473639874 945667182 /nfs/dbraw/zinc/66/71/82/945667182.db2.gz JUSFSXXCWKWESO-UHFFFAOYSA-N -1 3 363.348 3.665 20 0 FHADHM CCOc1cccc([C@@H]2C[C@H]2[N-]S(=O)(=O)c2ccc(C)c(F)c2F)c1 ZINC001211663940 945687760 /nfs/dbraw/zinc/68/77/60/945687760.db2.gz BGEAAROJIKALSY-LSDHHAIUSA-N -1 3 367.417 3.506 20 0 FHADHM O=C(Nc1nnc(C(F)(F)F)[n-]1)[C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1 ZINC000110657377 945717342 /nfs/dbraw/zinc/71/73/42/945717342.db2.gz FMBHVSKQOKMPFB-DTWKUNHWSA-N -1 3 364.249 3.585 20 0 FHADHM O=C(Nc1nc(C(F)(F)F)n[n-]1)[C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1 ZINC000110657377 945717345 /nfs/dbraw/zinc/71/73/45/945717345.db2.gz FMBHVSKQOKMPFB-DTWKUNHWSA-N -1 3 364.249 3.585 20 0 FHADHM COc1cccc2c1[C@@H](C(=O)Nc1ccc(Br)cc1[O-])CC2 ZINC000519801978 945768265 /nfs/dbraw/zinc/76/82/65/945768265.db2.gz XAIQIBUOHPAQDQ-LBPRGKRZSA-N -1 3 362.223 3.832 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@H]3CCCO[C@@H]3C(C)C)nc2)n1 ZINC000301518545 945825750 /nfs/dbraw/zinc/82/57/50/945825750.db2.gz HBBOXJLQQWJBJZ-AUUYWEPGSA-N -1 3 356.470 3.670 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)N(C)C3Cc4ccccc4C3)cc2)cc(=O)[n-]1 ZINC000519945900 945914859 /nfs/dbraw/zinc/91/48/59/945914859.db2.gz ZMALGIDECNTTGD-UHFFFAOYSA-N -1 3 374.444 3.789 20 0 FHADHM Cc1c(NC(=O)c2ccc3nc(Cl)ccc3c2)cccc1-c1nnn[n-]1 ZINC000822108253 945961556 /nfs/dbraw/zinc/96/15/56/945961556.db2.gz GGOXIDYCEVBASF-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1c(NC(=O)c2ccc3nc(Cl)ccc3c2)cccc1-c1nn[n-]n1 ZINC000822108253 945961566 /nfs/dbraw/zinc/96/15/66/945961566.db2.gz GGOXIDYCEVBASF-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1ccc([C@H](C)N(C)C(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000822229572 946010733 /nfs/dbraw/zinc/01/07/33/946010733.db2.gz XIUYWSINJUAPGZ-GJZGRUSLSA-N -1 3 364.453 3.639 20 0 FHADHM Cc1ccc([C@H](C)N(C)C(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000822229572 946010748 /nfs/dbraw/zinc/01/07/48/946010748.db2.gz XIUYWSINJUAPGZ-GJZGRUSLSA-N -1 3 364.453 3.639 20 0 FHADHM C[C@@H](OC(=O)c1cc(Cl)c(Cl)[n-]1)C(=O)Nc1ccc(F)cc1F ZINC000011810573 946036302 /nfs/dbraw/zinc/03/63/02/946036302.db2.gz FPSPUISNPKKMPB-ZCFIWIBFSA-N -1 3 363.147 3.784 20 0 FHADHM O=S(=O)([N-]Cc1cc(-c2ccccc2)no1)c1ccc(Cl)cc1F ZINC000045812287 946165038 /nfs/dbraw/zinc/16/50/38/946165038.db2.gz SSMBKXYJZYYVLU-UHFFFAOYSA-N -1 3 366.801 3.613 20 0 FHADHM CC(C)Cc1ccc(S(=O)(=O)[N-]c2ccc3oc(=O)ccc3c2)cc1 ZINC000108929640 946172687 /nfs/dbraw/zinc/17/26/87/946172687.db2.gz OORFYNOXRRGKDI-UHFFFAOYSA-N -1 3 357.431 3.792 20 0 FHADHM CN(Cc1cc(=O)[n-]c(C2CC2)n1)[C@H](CO)c1cccc(Cl)c1Cl ZINC000661642059 946354982 /nfs/dbraw/zinc/35/49/82/946354982.db2.gz YAPCBMRKNLJRTF-CQSZACIVSA-N -1 3 368.264 3.532 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)N1CCCC2(C1)CCCCCC2 ZINC000823359186 946418153 /nfs/dbraw/zinc/41/81/53/946418153.db2.gz JVAFNPHNWWHDJM-UHFFFAOYSA-N -1 3 354.458 3.835 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)N1CCCC2(C1)CCCCCC2 ZINC000823359186 946418158 /nfs/dbraw/zinc/41/81/58/946418158.db2.gz JVAFNPHNWWHDJM-UHFFFAOYSA-N -1 3 354.458 3.835 20 0 FHADHM CC(=O)c1ccc(NCCCOc2cccc(-c3nnn[n-]3)c2)cc1Cl ZINC000824024818 946559637 /nfs/dbraw/zinc/55/96/37/946559637.db2.gz QJIOQRONWNXUAP-UHFFFAOYSA-N -1 3 371.828 3.604 20 0 FHADHM CC(=O)c1ccc(NCCCOc2cccc(-c3nn[n-]n3)c2)cc1Cl ZINC000824024818 946559648 /nfs/dbraw/zinc/55/96/48/946559648.db2.gz QJIOQRONWNXUAP-UHFFFAOYSA-N -1 3 371.828 3.604 20 0 FHADHM CC(C)C[C@H](C)N(C)C(=O)CSc1cccc(Cl)c1-c1nnn[n-]1 ZINC000824229103 946628987 /nfs/dbraw/zinc/62/89/87/946628987.db2.gz NNIITHQEYCFFPH-NSHDSACASA-N -1 3 367.906 3.505 20 0 FHADHM CC(C)C[C@H](C)N(C)C(=O)CSc1cccc(Cl)c1-c1nn[n-]n1 ZINC000824229103 946628994 /nfs/dbraw/zinc/62/89/94/946628994.db2.gz 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CC(=Cc1ccc(Cl)cc1)C(=O)Nc1cc(C)cc(-c2nnn[n-]2)c1 ZINC001573364869 947725485 /nfs/dbraw/zinc/72/54/85/947725485.db2.gz KBDPBWKIYZILIX-XFXZXTDPSA-N -1 3 353.813 3.871 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)Nc1cc(C)cc(-c2nn[n-]n2)c1 ZINC001573364869 947725490 /nfs/dbraw/zinc/72/54/90/947725490.db2.gz KBDPBWKIYZILIX-XFXZXTDPSA-N -1 3 353.813 3.871 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1COC(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000826253580 947730975 /nfs/dbraw/zinc/73/09/75/947730975.db2.gz VRNHOADZLQJPSG-OCCSQVGLSA-N -1 3 368.359 3.587 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1COC(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000826253580 947730979 /nfs/dbraw/zinc/73/09/79/947730979.db2.gz VRNHOADZLQJPSG-OCCSQVGLSA-N -1 3 368.359 3.587 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)c(NCc2cccc(OCc3ccccc3)c2)n1 ZINC000826277464 947800242 /nfs/dbraw/zinc/80/02/42/947800242.db2.gz VPFIERPYAQAMDV-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)c(NCc2cccc(OCc3ccccc3)c2)n1 ZINC000826277464 947800248 /nfs/dbraw/zinc/80/02/48/947800248.db2.gz VPFIERPYAQAMDV-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM Cc1ccc(C[C@H](C)C(=O)N(C)c2cc(Cl)ccc2-c2nnn[n-]2)cc1 ZINC000826286903 947831057 /nfs/dbraw/zinc/83/10/57/947831057.db2.gz VHELYFBZSZRNTC-ZDUSSCGKSA-N -1 3 369.856 3.670 20 0 FHADHM Cc1ccc(C[C@H](C)C(=O)N(C)c2cc(Cl)ccc2-c2nn[n-]n2)cc1 ZINC000826286903 947831065 /nfs/dbraw/zinc/83/10/65/947831065.db2.gz VHELYFBZSZRNTC-ZDUSSCGKSA-N -1 3 369.856 3.670 20 0 FHADHM Cc1ccc(Oc2ccccc2)c(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)c1 ZINC000826292651 947848760 /nfs/dbraw/zinc/84/87/60/947848760.db2.gz FZJQBRHKYOICTE-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM Cc1ccc(Oc2ccccc2)c(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)c1 ZINC000826292651 947848768 /nfs/dbraw/zinc/84/87/68/947848768.db2.gz FZJQBRHKYOICTE-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM Cc1cccc(NC(=O)[C@@H](C)Sc2cccc(Cl)c2-c2nnn[n-]2)c1 ZINC000826299256 947865113 /nfs/dbraw/zinc/86/51/13/947865113.db2.gz XNQIKLSIGYEHEC-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM Cc1cccc(NC(=O)[C@@H](C)Sc2cccc(Cl)c2-c2nn[n-]n2)c1 ZINC000826299256 947865119 /nfs/dbraw/zinc/86/51/19/947865119.db2.gz XNQIKLSIGYEHEC-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM CCOC(=O)c1sc2[n-]c([C@H](C)N3CC[C@@H](C)[C@@H]3C)nc(=O)c2c1C ZINC000253551373 947869525 /nfs/dbraw/zinc/86/95/25/947869525.db2.gz YBASZPRELUBQQM-USWWRNFRSA-N -1 3 363.483 3.673 20 0 FHADHM Cc1ccnc(N[C@H](C)c2ccc(OCC3CC3)c(F)c2)c1-c1nnn[n-]1 ZINC000826311752 947902304 /nfs/dbraw/zinc/90/23/04/947902304.db2.gz MPMPXPRQRINPFF-GFCCVEGCSA-N -1 3 368.416 3.671 20 0 FHADHM Cc1ccnc(N[C@H](C)c2ccc(OCC3CC3)c(F)c2)c1-c1nn[n-]n1 ZINC000826311752 947902314 /nfs/dbraw/zinc/90/23/14/947902314.db2.gz MPMPXPRQRINPFF-GFCCVEGCSA-N -1 3 368.416 3.671 20 0 FHADHM Cc1ccnc(N[C@H]2CCCOc3c(Cl)cccc32)c1-c1nnn[n-]1 ZINC000826313229 947910759 /nfs/dbraw/zinc/91/07/59/947910759.db2.gz YROMUKMXQGUZFT-ZDUSSCGKSA-N -1 3 356.817 3.549 20 0 FHADHM Cc1ccnc(N[C@H]2CCCOc3c(Cl)cccc32)c1-c1nn[n-]n1 ZINC000826313229 947910769 /nfs/dbraw/zinc/91/07/69/947910769.db2.gz YROMUKMXQGUZFT-ZDUSSCGKSA-N -1 3 356.817 3.549 20 0 FHADHM Cc1ccc(S(=O)(=O)[N-]c2cc(C(=O)NCC3CC3)ccc2C)c(C)c1 ZINC000190149118 947936114 /nfs/dbraw/zinc/93/61/14/947936114.db2.gz IATDSFUMJHDIPG-UHFFFAOYSA-N -1 3 372.490 3.552 20 0 FHADHM Cc1nc(C(C)C)sc1[C@@H](C)OC(=O)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000826323362 947945386 /nfs/dbraw/zinc/94/53/86/947945386.db2.gz AYMAJPFLSZRRKJ-GFCCVEGCSA-N -1 3 371.466 3.602 20 0 FHADHM Cc1nc(C(C)C)sc1[C@@H](C)OC(=O)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000826323362 947945392 /nfs/dbraw/zinc/94/53/92/947945392.db2.gz AYMAJPFLSZRRKJ-GFCCVEGCSA-N -1 3 371.466 3.602 20 0 FHADHM CCCCCC[C@@](C)(NC(=O)c1cccc(CN2CCCC2)c1)C(=O)[O-] ZINC000909432271 947968034 /nfs/dbraw/zinc/96/80/34/947968034.db2.gz NYIFTBRRXLJBPD-OAQYLSRUSA-N -1 3 360.498 3.826 20 0 FHADHM C[C@H]([N-]S(=O)(=O)c1cc(Cl)ccc1C(F)(F)F)c1cncs1 ZINC000509731478 948060714 /nfs/dbraw/zinc/06/07/14/948060714.db2.gz XDDWLFKNMABZQA-ZETCQYMHSA-N -1 3 370.805 3.855 20 0 FHADHM Cc1sc(NC(=O)[C@@H]2CCc3c2cccc3Cl)c(-c2nnn[n-]2)c1C ZINC000826349251 948091178 /nfs/dbraw/zinc/09/11/78/948091178.db2.gz ATGGXZMLRWXQIM-GFCCVEGCSA-N -1 3 373.869 3.867 20 0 FHADHM Cc1sc(NC(=O)[C@@H]2CCc3c2cccc3Cl)c(-c2nn[n-]n2)c1C ZINC000826349251 948091186 /nfs/dbraw/zinc/09/11/86/948091186.db2.gz ATGGXZMLRWXQIM-GFCCVEGCSA-N -1 3 373.869 3.867 20 0 FHADHM O=S(=O)([N-]Cc1cc(F)cc(F)c1)c1csc(-c2ccccc2)n1 ZINC000500447583 948094436 /nfs/dbraw/zinc/09/44/36/948094436.db2.gz QRVMAYMVSIJJML-UHFFFAOYSA-N -1 3 366.414 3.567 20 0 FHADHM Clc1cccc(SCc2cccc3c2OCCO3)c1-c1nnn[n-]1 ZINC000826353652 948103638 /nfs/dbraw/zinc/10/36/38/948103638.db2.gz YHCOSGSICAEPJW-UHFFFAOYSA-N -1 3 360.826 3.584 20 0 FHADHM Clc1cccc(SCc2cccc3c2OCCO3)c1-c1nn[n-]n1 ZINC000826353652 948103646 /nfs/dbraw/zinc/10/36/46/948103646.db2.gz YHCOSGSICAEPJW-UHFFFAOYSA-N -1 3 360.826 3.584 20 0 FHADHM FC(F)(F)c1cc(NCc2ccc(Cl)cn2)ccc1-c1nnn[n-]1 ZINC000826368329 948148865 /nfs/dbraw/zinc/14/88/65/948148865.db2.gz LTHYYRISKGKSHB-UHFFFAOYSA-N -1 3 354.723 3.546 20 0 FHADHM FC(F)(F)c1cc(NCc2ccc(Cl)cn2)ccc1-c1nn[n-]n1 ZINC000826368329 948148870 /nfs/dbraw/zinc/14/88/70/948148870.db2.gz LTHYYRISKGKSHB-UHFFFAOYSA-N -1 3 354.723 3.546 20 0 FHADHM O=C(CC1CCC(C(F)(F)F)CC1)Oc1ccc(-c2nnn[n-]2)cc1F ZINC000826404043 948229030 /nfs/dbraw/zinc/22/90/30/948229030.db2.gz MDPDPZKGFYUKKC-UHFFFAOYSA-N -1 3 372.322 3.670 20 0 FHADHM O=C(CC1CCC(C(F)(F)F)CC1)Oc1ccc(-c2nn[n-]n2)cc1F ZINC000826404043 948229036 /nfs/dbraw/zinc/22/90/36/948229036.db2.gz MDPDPZKGFYUKKC-UHFFFAOYSA-N -1 3 372.322 3.670 20 0 FHADHM O=C(N[C@@H](c1ccc(F)cc1)C1CCC1)c1cc(=O)c2ccccc2[n-]1 ZINC000520532247 948239223 /nfs/dbraw/zinc/23/92/23/948239223.db2.gz KBSLGAVYJHQTKA-HXUWFJFHSA-N -1 3 350.393 3.938 20 0 FHADHM CC[C@H](C)[N-]S(=O)(=O)c1ccc(Br)cc1C(F)(F)F ZINC000614598311 948326736 /nfs/dbraw/zinc/32/67/36/948326736.db2.gz ATNXYSIQLLUOGG-ZETCQYMHSA-N -1 3 360.195 3.545 20 0 FHADHM Cc1ccc(Cl)c(S(=O)(=O)[N-]CCCOCC(C)C)c1Cl ZINC000614603998 948354187 /nfs/dbraw/zinc/35/41/87/948354187.db2.gz XUASQABTTDSXFU-UHFFFAOYSA-N -1 3 354.299 3.643 20 0 FHADHM CC(C)(C)C(=O)NC1CCC(C(=O)Nc2cc(Cl)ccc2[O-])CC1 ZINC000279085919 948484476 /nfs/dbraw/zinc/48/44/76/948484476.db2.gz BVHBFRFGCPNNSG-UHFFFAOYSA-N -1 3 352.862 3.705 20 0 FHADHM Cc1ccc(-c2ccccc2NC(=O)c2ccc(-c3nnn[n-]3)cn2)s1 ZINC001454698890 948524501 /nfs/dbraw/zinc/52/45/01/948524501.db2.gz AVEAHKCFVVDMHO-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1ccc(-c2ccccc2NC(=O)c2ccc(-c3nn[n-]n3)cn2)s1 ZINC001454698890 948524509 /nfs/dbraw/zinc/52/45/09/948524509.db2.gz AVEAHKCFVVDMHO-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)Nc1cc(-c2nnn[n-]2)ccc1F ZINC001525059806 948539142 /nfs/dbraw/zinc/53/91/42/948539142.db2.gz LWSNPESNWGWHFJ-JXMROGBWSA-N -1 3 357.776 3.701 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)Nc1cc(-c2nn[n-]n2)ccc1F ZINC001525059806 948539151 /nfs/dbraw/zinc/53/91/51/948539151.db2.gz LWSNPESNWGWHFJ-JXMROGBWSA-N -1 3 357.776 3.701 20 0 FHADHM CC(C)c1ccc(S(=O)(=O)[N-]c2cccc3c2OCC[C@H]3N(C)C)cc1 ZINC000432478892 948541265 /nfs/dbraw/zinc/54/12/65/948541265.db2.gz OQNAEWXASHDNBX-LJQANCHMSA-N -1 3 374.506 3.996 20 0 FHADHM CO[C@@]1(C)CCCN(Cc2nc(=O)c3c(-c4ccco4)csc3[n-]2)C1 ZINC000279244972 948655236 /nfs/dbraw/zinc/65/52/36/948655236.db2.gz GLODABUZIMMSGS-SFHVURJKSA-N -1 3 359.451 3.658 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)C(C)(C)CC2)c1ccsc1 ZINC001573754227 948738975 /nfs/dbraw/zinc/73/89/75/948738975.db2.gz CYXPLGYTSPCCNT-SECBINFHSA-N -1 3 373.507 3.956 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)C(C)(C)CC2)c1ccsc1 ZINC001573754227 948738985 /nfs/dbraw/zinc/73/89/85/948738985.db2.gz CYXPLGYTSPCCNT-SECBINFHSA-N -1 3 373.507 3.956 20 0 FHADHM CC[C@@]1(CO)CCCN(C(=O)c2cc(Oc3ccccc3)ccc2[O-])C1 ZINC000187052682 948755854 /nfs/dbraw/zinc/75/58/54/948755854.db2.gz GEKZITAGXRXOOM-OAQYLSRUSA-N -1 3 355.434 3.809 20 0 FHADHM O=S(=O)([N-]c1ccc(F)cc1F)c1ccc(OC(F)(F)F)cc1 ZINC000010463193 204396750 /nfs/dbraw/zinc/39/67/50/204396750.db2.gz PVMTZHHLSPKEMH-UHFFFAOYSA-N -1 3 353.268 3.664 20 0 FHADHM O=C(Nc1ccccc1[O-])C1CCN(C(=O)c2ccc(Cl)cc2)CC1 ZINC000022024217 204768720 /nfs/dbraw/zinc/76/87/20/204768720.db2.gz ADNXFHOQVCOOFY-UHFFFAOYSA-N -1 3 358.825 3.537 20 0 FHADHM CN(Cc1nc(=O)c2c(-c3ccccc3)csc2[n-]1)C[C@H]1CCCCO1 ZINC000126171814 206117321 /nfs/dbraw/zinc/11/73/21/206117321.db2.gz NLVFTQSWJPQVFF-OAHLLOKOSA-N -1 3 369.490 3.653 20 0 FHADHM Cc1cc(S(=O)(=O)[N-]c2ccc(F)cc2F)ccc1Br ZINC000007405067 206245527 /nfs/dbraw/zinc/24/55/27/206245527.db2.gz GOZNYISIGFHIKM-UHFFFAOYSA-N -1 3 362.195 3.837 20 0 FHADHM CCCc1n[n-]c(=NC(=O)N[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)s1 ZINC000489536778 514885559 /nfs/dbraw/zinc/88/55/59/514885559.db2.gz SNRSJVVUYXBGJM-HOCLYGCPSA-N -1 3 373.526 3.523 20 0 FHADHM C[C@@H]1C[C@H](NC(=O)c2csc(=NC3CC3)[n-]2)CCN1Cc1ccccc1 ZINC000476563184 515103678 /nfs/dbraw/zinc/10/36/78/515103678.db2.gz JECREBCMMOLRGF-RHSMWYFYSA-N -1 3 370.522 3.500 20 0 FHADHM Cn1cccc1C(=O)C(=O)N=c1cc(-c2cc(Cl)cc(Cl)c2)[n-][nH]1 ZINC000493957919 515697778 /nfs/dbraw/zinc/69/77/78/515697778.db2.gz LAPYQXIMPCAGRK-UHFFFAOYSA-N -1 3 363.204 3.543 20 0 FHADHM Cc1[nH]c(=O)c(Br)cc1C(=O)N=c1cc(-c2ccccc2)[n-][nH]1 ZINC000483275211 516014603 /nfs/dbraw/zinc/01/46/03/516014603.db2.gz CUIQNXQFVUWCPA-UHFFFAOYSA-N -1 3 373.210 3.501 20 0 FHADHM Cc1cc(C)cc(-c2cc(=NC(=O)[C@H](C)NC(=O)c3cccs3)[nH][n-]2)c1 ZINC000512545668 516303363 /nfs/dbraw/zinc/30/33/63/516303363.db2.gz PULVFTNCOVZQJM-ZDUSSCGKSA-N -1 3 368.462 3.512 20 0 FHADHM CCCCc1n[n-]c(=NC(=O)NC[C@H](C)N(C)Cc2ccccc2)s1 ZINC000523593227 516513409 /nfs/dbraw/zinc/51/34/09/516513409.db2.gz MTYDUJBVXKLMPS-AWEZNQCLSA-N -1 3 361.515 3.523 20 0 FHADHM Cc1[n-][nH]c(=NC(=O)c2cccc(C[S@](C)=O)c2)c1-c1ccccc1 ZINC000522812185 518165765 /nfs/dbraw/zinc/16/57/65/518165765.db2.gz ZORBAWMTTDVSIT-RUZDIDTESA-N -1 3 353.447 3.516 20 0 FHADHM Cc1nn(C)c(C)c1C[C@@H](C)C(=O)N=c1[nH][n-]c(C)c1-c1ccccc1 ZINC000608359422 519947627 /nfs/dbraw/zinc/94/76/27/519947627.db2.gz PKWFUUSPNPOZQQ-GFCCVEGCSA-N -1 3 351.454 3.553 20 0 FHADHM Cc1[n-][nH]c(=NC(=O)c2cn3c(n2)C[C@H](C)CC3)c1-c1ccccc1F ZINC000634422739 523395326 /nfs/dbraw/zinc/39/53/26/523395326.db2.gz NOWNZNSVNZBWQU-LLVKDONJSA-N -1 3 353.401 3.555 20 0 FHADHM O=C(N=c1cc(-c2cccc(Cl)c2)[n-][nH]1)c1ccc2[nH]c(=O)[nH]c2c1 ZINC000622891061 523532725 /nfs/dbraw/zinc/53/27/25/523532725.db2.gz CRRXFDYUORFHAG-UHFFFAOYSA-N -1 3 353.769 3.564 20 0 FHADHM Cc1cnccc1C[N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl ZINC000188840135 567863925 /nfs/dbraw/zinc/86/39/25/567863925.db2.gz ORBIRSLXQVHPEC-UHFFFAOYSA-N -1 3 365.669 3.829 20 0 FHADHM COc1ccc(CNC(=O)c2ccc(C(=O)c3cccc([O-])c3)cc2)cc1 ZINC000186997942 568047159 /nfs/dbraw/zinc/04/71/59/568047159.db2.gz CBKKCEJULALOJP-UHFFFAOYSA-N -1 3 361.397 3.562 20 0 FHADHM COc1ccccc1-c1cc(=NC(=O)[C@@H]2C[C@@H]2c2ccc(F)cc2F)[nH][n-]1 ZINC000603547010 568118042 /nfs/dbraw/zinc/11/80/42/568118042.db2.gz FUNBZACRLORZAA-HUUCEWRRSA-N -1 3 369.371 3.528 20 0 FHADHM O=C(Nc1n[n-]c(-c2ccccc2F)n1)c1cccn1Cc1ccccc1 ZINC000603547136 568118061 /nfs/dbraw/zinc/11/80/61/568118061.db2.gz VNNGVKWEPOBQNX-UHFFFAOYSA-N -1 3 361.380 3.713 20 0 FHADHM Cc1csc([C@H]([N-]S(=O)(=O)c2ccc(Cl)c(C)c2)C2CC2)n1 ZINC000655525237 568148107 /nfs/dbraw/zinc/14/81/07/568148107.db2.gz IMKHQWAZARGIQN-CQSZACIVSA-N -1 3 356.900 3.843 20 0 FHADHM CCOc1cc(CN2CC[C@@H](O)[C@H](C3CCCC3)C2)cc(Cl)c1[O-] ZINC000563106651 568189231 /nfs/dbraw/zinc/18/92/31/568189231.db2.gz WCNRVXGENGKFSJ-DOTOQJQBSA-N -1 3 353.890 3.817 20 0 FHADHM COC(=O)c1ccc(S(=O)(=O)[N-][C@@H](CC(C)C)c2ccccc2)s1 ZINC000603957604 568189884 /nfs/dbraw/zinc/18/98/84/568189884.db2.gz WKIFKWSUHHEJFS-AWEZNQCLSA-N -1 3 367.492 3.600 20 0 FHADHM COC(=O)c1sc2[n-]c(CSc3ccc(C)cc3C)nc(=O)c2c1C ZINC000007487128 568236047 /nfs/dbraw/zinc/23/60/47/568236047.db2.gz LCKIXNVQAFZSEZ-UHFFFAOYSA-N -1 3 374.487 3.989 20 0 FHADHM CC(=O)Nc1ccc(S(=O)(=O)[N-][C@H](C)CCC2CCCCC2)c(F)c1 ZINC000604407835 568269243 /nfs/dbraw/zinc/26/92/43/568269243.db2.gz HIVANCDVXPTPBX-CYBMUJFWSA-N -1 3 370.490 3.811 20 0 FHADHM CC(C)c1cc(C(=O)N2CCO[C@]3(CCO[C@@H]3C)C2)c([O-])c(C(C)C)c1 ZINC000408276747 568287897 /nfs/dbraw/zinc/28/78/97/568287897.db2.gz LEOCZMXKFHDUNG-QVKFZJNVSA-N -1 3 361.482 3.659 20 0 FHADHM O=C([N-]c1c(F)cc(F)cc1F)c1cn(-c2ccc(Cl)cc2)nn1 ZINC000525797442 568298928 /nfs/dbraw/zinc/29/89/28/568298928.db2.gz JKPZTOUWVIKIOC-UHFFFAOYSA-N -1 3 352.703 3.590 20 0 FHADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1CCC(C2(O)CC2)CC1 ZINC000652662658 568325809 /nfs/dbraw/zinc/32/58/09/568325809.db2.gz YKLNONAFAYGZTP-UHFFFAOYSA-N -1 3 353.418 3.562 20 0 FHADHM CC(=O)c1cc(F)c([N-]C(=O)c2sc([C@H]3CCOC3)nc2C)c(F)c1 ZINC000637052822 568330900 /nfs/dbraw/zinc/33/09/00/568330900.db2.gz CSNXOCYGCYBTKH-JTQLQIEISA-N -1 3 366.389 3.689 20 0 FHADHM COc1ccccc1-c1cc(=NC(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)[nH][n-]1 ZINC000604789395 568367294 /nfs/dbraw/zinc/36/72/94/568367294.db2.gz ZAVPUQHUPZKBEF-CHWSQXEVSA-N -1 3 369.371 3.528 20 0 FHADHM Cc1cc(C)cc(-c2cc(=NC(=O)[C@H](c3ccccc3)n3cccn3)[nH][n-]2)c1 ZINC000604901468 568384826 /nfs/dbraw/zinc/38/48/26/568384826.db2.gz NLOQKTHHAOYMPT-NRFANRHFSA-N -1 3 371.444 3.540 20 0 FHADHM C[C@@H](Sc1cc(F)ccc1F)C(=O)c1ccc([N-]S(C)(=O)=O)cc1 ZINC000007069105 568431754 /nfs/dbraw/zinc/43/17/54/568431754.db2.gz AAVZUDDZCLPWDJ-SNVBAGLBSA-N -1 3 371.430 3.700 20 0 FHADHM CC(C)c1cccc(O[C@@H](C)C(=O)[N-]c2nncn2Cc2ccccc2)c1 ZINC000605117811 568573271 /nfs/dbraw/zinc/57/32/71/568573271.db2.gz KXBYWMOWUIGTPF-INIZCTEOSA-N -1 3 364.449 3.856 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)c1ccc(OC2CCCCC2)cc1 ZINC000605120135 568573882 /nfs/dbraw/zinc/57/38/82/568573882.db2.gz QIRPDAKOYGVZRG-UHFFFAOYSA-N -1 3 363.421 3.831 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)c1ccc(OC2CCCCC2)cc1 ZINC000605120135 568573883 /nfs/dbraw/zinc/57/38/83/568573883.db2.gz QIRPDAKOYGVZRG-UHFFFAOYSA-N -1 3 363.421 3.831 20 0 FHADHM C[C@@H]1CCN(C(=O)c2cc(=O)c3ccccc3[n-]2)[C@@H]1c1cccc(F)c1 ZINC000365370415 568574894 /nfs/dbraw/zinc/57/48/94/568574894.db2.gz VIRZSSNCDNJWLE-XCLFUZPHSA-N -1 3 350.393 3.891 20 0 FHADHM CN(C(=O)c1sccc1-c1nnn[n-]1)c1cc(Cl)cc(Cl)c1 ZINC000736741928 598823322 /nfs/dbraw/zinc/82/33/22/598823322.db2.gz VWFYEVBIQDBPPV-UHFFFAOYSA-N -1 3 354.222 3.512 20 0 FHADHM CN(C(=O)c1sccc1-c1nn[n-]n1)c1cc(Cl)cc(Cl)c1 ZINC000736741928 598823324 /nfs/dbraw/zinc/82/33/24/598823324.db2.gz VWFYEVBIQDBPPV-UHFFFAOYSA-N -1 3 354.222 3.512 20 0 FHADHM CC[C@@H](OC(=O)CCc1ccc(-c2nnn[n-]2)cc1)c1ccc(F)cc1F ZINC000736384658 598823720 /nfs/dbraw/zinc/82/37/20/598823720.db2.gz YBMFIKHGCICYAQ-QGZVFWFLSA-N -1 3 372.375 3.772 20 0 FHADHM CC[C@@H](OC(=O)CCc1ccc(-c2nn[n-]n2)cc1)c1ccc(F)cc1F ZINC000736384658 598823721 /nfs/dbraw/zinc/82/37/21/598823721.db2.gz YBMFIKHGCICYAQ-QGZVFWFLSA-N -1 3 372.375 3.772 20 0 FHADHM CC[C@H]1CCCCCN1C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736401133 598827204 /nfs/dbraw/zinc/82/72/04/598827204.db2.gz VVODTQIQOHSTFR-LBPRGKRZSA-N -1 3 364.906 3.872 20 0 FHADHM CC[C@H]1CCCCCN1C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736401133 598827206 /nfs/dbraw/zinc/82/72/06/598827206.db2.gz VVODTQIQOHSTFR-LBPRGKRZSA-N -1 3 364.906 3.872 20 0 FHADHM O=C(NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1)C1CCCCC1 ZINC000738113195 598834818 /nfs/dbraw/zinc/83/48/18/598834818.db2.gz WLLMEYIWEPJQBQ-UHFFFAOYSA-N -1 3 367.478 3.792 20 0 FHADHM CCC(C)(C)C(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000736313600 598835607 /nfs/dbraw/zinc/83/56/07/598835607.db2.gz OCPHZGBKKATDGM-UHFFFAOYSA-N -1 3 355.467 3.648 20 0 FHADHM CCc1ccc([C@@H]2CCCCCN2C(=O)c2ccc(-c3nnn[n-]3)cc2)o1 ZINC000736684976 598835666 /nfs/dbraw/zinc/83/56/66/598835666.db2.gz JAOLRFCJAGZXQE-KRWDZBQOSA-N -1 3 365.437 3.780 20 0 FHADHM CCc1ccc([C@@H]2CCCCCN2C(=O)c2ccc(-c3nn[n-]n3)cc2)o1 ZINC000736684976 598835667 /nfs/dbraw/zinc/83/56/67/598835667.db2.gz JAOLRFCJAGZXQE-KRWDZBQOSA-N -1 3 365.437 3.780 20 0 FHADHM Cc1ccccc1NC(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(C)C ZINC000737434252 598851601 /nfs/dbraw/zinc/85/16/01/598851601.db2.gz DIAIHNVULFWRLJ-UHFFFAOYSA-N -1 3 352.398 3.606 20 0 FHADHM Cc1ccccc1NC(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(C)C ZINC000737434252 598851603 /nfs/dbraw/zinc/85/16/03/598851603.db2.gz DIAIHNVULFWRLJ-UHFFFAOYSA-N -1 3 352.398 3.606 20 0 FHADHM Cc1cc(NCc2cccc(-c3ccc(-c4nnn[n-]4)s3)c2)nc(C)n1 ZINC000737280053 598853956 /nfs/dbraw/zinc/85/39/56/598853956.db2.gz JWLGPIIZIIYSLY-UHFFFAOYSA-N -1 3 363.450 3.614 20 0 FHADHM Cc1cc(NCc2cccc(-c3ccc(-c4nn[n-]n4)s3)c2)nc(C)n1 ZINC000737280053 598853957 /nfs/dbraw/zinc/85/39/57/598853957.db2.gz JWLGPIIZIIYSLY-UHFFFAOYSA-N -1 3 363.450 3.614 20 0 FHADHM C[C@@H](NC(=O)c1ccccc1-c1ccccc1-c1nnn[n-]1)C1CCCC1 ZINC000736125359 598865653 /nfs/dbraw/zinc/86/56/53/598865653.db2.gz YDFMJCZBAFIUIA-CQSZACIVSA-N -1 3 361.449 3.842 20 0 FHADHM C[C@@H](NC(=O)c1ccccc1-c1ccccc1-c1nn[n-]n1)C1CCCC1 ZINC000736125359 598865655 /nfs/dbraw/zinc/86/56/55/598865655.db2.gz YDFMJCZBAFIUIA-CQSZACIVSA-N -1 3 361.449 3.842 20 0 FHADHM Clc1cc(N[C@H](c2ccccc2)[C@@H]2CCCO2)ccc1-c1nnn[n-]1 ZINC000737562904 598870600 /nfs/dbraw/zinc/87/06/00/598870600.db2.gz AFOAORFLGYPSHJ-DLBZAZTESA-N -1 3 355.829 3.852 20 0 FHADHM Clc1cc(N[C@H](c2ccccc2)[C@@H]2CCCO2)ccc1-c1nn[n-]n1 ZINC000737562904 598870601 /nfs/dbraw/zinc/87/06/01/598870601.db2.gz AFOAORFLGYPSHJ-DLBZAZTESA-N -1 3 355.829 3.852 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H](C)C1CCCC1 ZINC000735831773 598876307 /nfs/dbraw/zinc/87/63/07/598876307.db2.gz VIQNIPLAEHBJMK-HNNXBMFYSA-N -1 3 370.501 3.613 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H](C)C1CCCC1 ZINC000735831773 598876308 /nfs/dbraw/zinc/87/63/08/598876308.db2.gz VIQNIPLAEHBJMK-HNNXBMFYSA-N -1 3 370.501 3.613 20 0 FHADHM O=C(CCc1ccc(-c2nnn[n-]2)cc1)OCCc1ccc2ccccc2c1 ZINC000737854142 598881923 /nfs/dbraw/zinc/88/19/23/598881923.db2.gz RRYKHDIMIWNABP-UHFFFAOYSA-N -1 3 372.428 3.738 20 0 FHADHM O=C(CCc1ccc(-c2nn[n-]n2)cc1)OCCc1ccc2ccccc2c1 ZINC000737854142 598881924 /nfs/dbraw/zinc/88/19/24/598881924.db2.gz RRYKHDIMIWNABP-UHFFFAOYSA-N -1 3 372.428 3.738 20 0 FHADHM CC(C)(C)/C=C\C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)nc1 ZINC000735592553 598904104 /nfs/dbraw/zinc/90/41/04/598904104.db2.gz BFAMGLVWIMVTFL-KTKRTIGZSA-N -1 3 364.409 3.595 20 0 FHADHM CC(C)(C)/C=C\C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)nc1 ZINC000735592553 598904105 /nfs/dbraw/zinc/90/41/05/598904105.db2.gz BFAMGLVWIMVTFL-KTKRTIGZSA-N -1 3 364.409 3.595 20 0 FHADHM CC[C@@H](CC1CCCCC1)C(=O)NCc1ccc(-c2nnn[n-]2)cc1F ZINC000736350045 598905813 /nfs/dbraw/zinc/90/58/13/598905813.db2.gz KXQNJQMAMAOJDM-AWEZNQCLSA-N -1 3 359.449 3.619 20 0 FHADHM CC[C@@H](CC1CCCCC1)C(=O)NCc1ccc(-c2nn[n-]n2)cc1F ZINC000736350045 598905815 /nfs/dbraw/zinc/90/58/15/598905815.db2.gz KXQNJQMAMAOJDM-AWEZNQCLSA-N -1 3 359.449 3.619 20 0 FHADHM Fc1ccc(-c2c[nH]c(Sc3ncc(-c4nnn[n-]4)cc3Cl)n2)cc1 ZINC000737651318 598936769 /nfs/dbraw/zinc/93/67/69/598936769.db2.gz JUELVYIIKYZOGK-UHFFFAOYSA-N -1 3 373.804 3.596 20 0 FHADHM Fc1ccc(-c2c[nH]c(Sc3ncc(-c4nn[n-]n4)cc3Cl)n2)cc1 ZINC000737651318 598936771 /nfs/dbraw/zinc/93/67/71/598936771.db2.gz JUELVYIIKYZOGK-UHFFFAOYSA-N -1 3 373.804 3.596 20 0 FHADHM CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)C3CC=CC3)c2-c2nnn[n-]2)C1 ZINC000735598212 598938553 /nfs/dbraw/zinc/93/85/53/598938553.db2.gz XTYKRYLIVFSWHG-GFCCVEGCSA-N -1 3 371.510 3.984 20 0 FHADHM CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)C3CC=CC3)c2-c2nn[n-]n2)C1 ZINC000735598212 598938555 /nfs/dbraw/zinc/93/85/55/598938555.db2.gz XTYKRYLIVFSWHG-GFCCVEGCSA-N -1 3 371.510 3.984 20 0 FHADHM Fc1cccc(Cl)c1[C@@H]1C[C@@H]1Nc1ncc(-c2nnn[n-]2)cc1Cl ZINC000737659966 598972062 /nfs/dbraw/zinc/97/20/62/598972062.db2.gz GWECQIHHLVGQEL-PELKAZGASA-N -1 3 365.199 3.676 20 0 FHADHM Fc1cccc(Cl)c1[C@@H]1C[C@@H]1Nc1ncc(-c2nn[n-]n2)cc1Cl ZINC000737659966 598972063 /nfs/dbraw/zinc/97/20/63/598972063.db2.gz GWECQIHHLVGQEL-PELKAZGASA-N -1 3 365.199 3.676 20 0 FHADHM Fc1cccc(Cl)c1[C@H]1C[C@H]1Nc1nc2c(cc1-c1nnn[n-]1)CCC2 ZINC000737659387 598971998 /nfs/dbraw/zinc/97/19/98/598971998.db2.gz CPVXMBOCNFIQMU-ZUZCIYMTSA-N -1 3 370.819 3.511 20 0 FHADHM Fc1cccc(Cl)c1[C@H]1C[C@H]1Nc1nc2c(cc1-c1nn[n-]n1)CCC2 ZINC000737659387 598972000 /nfs/dbraw/zinc/97/20/00/598972000.db2.gz CPVXMBOCNFIQMU-ZUZCIYMTSA-N -1 3 370.819 3.511 20 0 FHADHM Cc1ccc(-c2nc(CNc3cccc(-c4nnn[n-]4)c3C)cs2)o1 ZINC000822213901 607256858 /nfs/dbraw/zinc/25/68/58/607256858.db2.gz GFUBJHINGPDGQK-UHFFFAOYSA-N -1 3 352.423 3.812 20 0 FHADHM Cc1ccc(-c2nc(CNc3cccc(-c4nn[n-]n4)c3C)cs2)o1 ZINC000822213901 607256859 /nfs/dbraw/zinc/25/68/59/607256859.db2.gz GFUBJHINGPDGQK-UHFFFAOYSA-N -1 3 352.423 3.812 20 0 FHADHM O=C(CCC1CC1)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000737823965 599003813 /nfs/dbraw/zinc/00/38/13/599003813.db2.gz MLMXIEDWDPXZHE-UHFFFAOYSA-N -1 3 363.421 3.574 20 0 FHADHM O=C(CCC1CC1)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000737823965 599003815 /nfs/dbraw/zinc/00/38/15/599003815.db2.gz MLMXIEDWDPXZHE-UHFFFAOYSA-N -1 3 363.421 3.574 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1OCCS[C@H](C)c1cccc(F)c1 ZINC000737031726 599009783 /nfs/dbraw/zinc/00/97/83/599009783.db2.gz FHVBCUUISZTZMZ-GFCCVEGCSA-N -1 3 374.441 3.888 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1OCCS[C@H](C)c1cccc(F)c1 ZINC000737031726 599009785 /nfs/dbraw/zinc/00/97/85/599009785.db2.gz FHVBCUUISZTZMZ-GFCCVEGCSA-N -1 3 374.441 3.888 20 0 FHADHM c1cc(OCCSCCOC2CCCCCC2)cc(-c2nnn[n-]2)c1 ZINC000738417900 599010265 /nfs/dbraw/zinc/01/02/65/599010265.db2.gz FCRLCAMGEYUUET-UHFFFAOYSA-N -1 3 362.499 3.718 20 0 FHADHM c1cc(OCCSCCOC2CCCCCC2)cc(-c2nn[n-]n2)c1 ZINC000738417900 599010267 /nfs/dbraw/zinc/01/02/67/599010267.db2.gz FCRLCAMGEYUUET-UHFFFAOYSA-N -1 3 362.499 3.718 20 0 FHADHM C[C@H](C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)nc1)C(C)(C)C ZINC000735561083 599015175 /nfs/dbraw/zinc/01/51/75/599015175.db2.gz VDRIPGRHUHXVIY-GFCCVEGCSA-N -1 3 366.425 3.675 20 0 FHADHM C[C@H](C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)nc1)C(C)(C)C ZINC000735561083 599015176 /nfs/dbraw/zinc/01/51/76/599015176.db2.gz VDRIPGRHUHXVIY-GFCCVEGCSA-N -1 3 366.425 3.675 20 0 FHADHM CC(C)(C)Oc1ccccc1NC(=O)CCc1ccc(-c2nnn[n-]2)cc1 ZINC000735639680 599017837 /nfs/dbraw/zinc/01/78/37/599017837.db2.gz MWNKJYUKZCNSNL-UHFFFAOYSA-N -1 3 365.437 3.615 20 0 FHADHM CC(C)(C)Oc1ccccc1NC(=O)CCc1ccc(-c2nn[n-]n2)cc1 ZINC000735639680 599017839 /nfs/dbraw/zinc/01/78/39/599017839.db2.gz MWNKJYUKZCNSNL-UHFFFAOYSA-N -1 3 365.437 3.615 20 0 FHADHM CC[C@H]1CCC[C@@H](NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)C1 ZINC000736395036 599023680 /nfs/dbraw/zinc/02/36/80/599023680.db2.gz GKSXXSFGNKIRFL-MAUKXSAKSA-N -1 3 370.501 3.756 20 0 FHADHM CC[C@H]1CCC[C@@H](NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)C1 ZINC000736395036 599023681 /nfs/dbraw/zinc/02/36/81/599023681.db2.gz GKSXXSFGNKIRFL-MAUKXSAKSA-N -1 3 370.501 3.756 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(NCCCCc2ccccc2)n1 ZINC000737635690 599042718 /nfs/dbraw/zinc/04/27/18/599042718.db2.gz MURLBZCNHBQQKU-UHFFFAOYSA-N -1 3 362.359 3.715 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(NCCCCc2ccccc2)n1 ZINC000737635690 599042719 /nfs/dbraw/zinc/04/27/19/599042719.db2.gz MURLBZCNHBQQKU-UHFFFAOYSA-N -1 3 362.359 3.715 20 0 FHADHM C[C@@H](CNc1nc(C(F)(F)F)ccc1-c1nnn[n-]1)c1ccc(F)cc1 ZINC000736025448 599048467 /nfs/dbraw/zinc/04/84/67/599048467.db2.gz GOWRSQUGJVLPAU-VIFPVBQESA-N -1 3 366.322 3.635 20 0 FHADHM C[C@@H](CNc1nc(C(F)(F)F)ccc1-c1nn[n-]n1)c1ccc(F)cc1 ZINC000736025448 599048469 /nfs/dbraw/zinc/04/84/69/599048469.db2.gz GOWRSQUGJVLPAU-VIFPVBQESA-N -1 3 366.322 3.635 20 0 FHADHM CSc1ccc(CNc2nc(C(F)(F)F)ccc2-c2nnn[n-]2)cc1 ZINC000737189310 599049758 /nfs/dbraw/zinc/04/97/58/599049758.db2.gz DSFDUNONVMATOP-UHFFFAOYSA-N -1 3 366.372 3.615 20 0 FHADHM CSc1ccc(CNc2nc(C(F)(F)F)ccc2-c2nn[n-]n2)cc1 ZINC000737189310 599049764 /nfs/dbraw/zinc/04/97/64/599049764.db2.gz DSFDUNONVMATOP-UHFFFAOYSA-N -1 3 366.372 3.615 20 0 FHADHM C[C@H]1CN(c2ncc(-c3nnn[n-]3)cc2Cl)CC[C@H]1c1ccccc1 ZINC000820774323 599050329 /nfs/dbraw/zinc/05/03/29/599050329.db2.gz ANWQOIZOAUOMRG-SWLSCSKDSA-N -1 3 354.845 3.545 20 0 FHADHM C[C@H]1CN(c2ncc(-c3nn[n-]n3)cc2Cl)CC[C@H]1c1ccccc1 ZINC000820774323 599050332 /nfs/dbraw/zinc/05/03/32/599050332.db2.gz ANWQOIZOAUOMRG-SWLSCSKDSA-N -1 3 354.845 3.545 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(NCc2coc3ccccc23)n1 ZINC000737635914 599057457 /nfs/dbraw/zinc/05/74/57/599057457.db2.gz PYGSAQGUVSNNSN-UHFFFAOYSA-N -1 3 360.299 3.639 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(NCc2coc3ccccc23)n1 ZINC000737635914 599057460 /nfs/dbraw/zinc/05/74/60/599057460.db2.gz PYGSAQGUVSNNSN-UHFFFAOYSA-N -1 3 360.299 3.639 20 0 FHADHM CC(C)[C@H]1CCCN(c2nc(C(F)(F)F)ccc2-c2nnn[n-]2)CC1 ZINC000735748060 599058180 /nfs/dbraw/zinc/05/81/80/599058180.db2.gz HAQMWOQTJNYJNE-NSHDSACASA-N -1 3 354.380 3.543 20 0 FHADHM CC(C)[C@H]1CCCN(c2nc(C(F)(F)F)ccc2-c2nn[n-]n2)CC1 ZINC000735748060 599058183 /nfs/dbraw/zinc/05/81/83/599058183.db2.gz HAQMWOQTJNYJNE-NSHDSACASA-N -1 3 354.380 3.543 20 0 FHADHM Cc1ccnc(Oc2cc(Nc3ccc(-c4nnn[n-]4)cn3)ccc2C)c1 ZINC000822378861 599060945 /nfs/dbraw/zinc/06/09/45/599060945.db2.gz GOWMOCQERNRHRH-UHFFFAOYSA-N -1 3 359.393 3.809 20 0 FHADHM Cc1ccnc(Oc2cc(Nc3ccc(-c4nn[n-]n4)cn3)ccc2C)c1 ZINC000822378861 599060948 /nfs/dbraw/zinc/06/09/48/599060948.db2.gz GOWMOCQERNRHRH-UHFFFAOYSA-N -1 3 359.393 3.809 20 0 FHADHM CCN(C(=O)[C@@H](C)Sc1ccc(-c2nnn[n-]2)cc1F)c1ccccc1 ZINC000736501171 599067832 /nfs/dbraw/zinc/06/78/32/599067832.db2.gz ABTGLKZNWRZABS-GFCCVEGCSA-N -1 3 371.441 3.540 20 0 FHADHM CCN(C(=O)[C@@H](C)Sc1ccc(-c2nn[n-]n2)cc1F)c1ccccc1 ZINC000736501171 599067835 /nfs/dbraw/zinc/06/78/35/599067835.db2.gz ABTGLKZNWRZABS-GFCCVEGCSA-N -1 3 371.441 3.540 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)[C@H]1C[C@@H]1C1CCCCC1 ZINC000735654816 599070224 /nfs/dbraw/zinc/07/02/24/599070224.db2.gz JCBKDMBVLDNCEZ-CABCVRRESA-N -1 3 356.474 3.578 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)[C@H]1C[C@@H]1C1CCCCC1 ZINC000735654816 599070226 /nfs/dbraw/zinc/07/02/26/599070226.db2.gz JCBKDMBVLDNCEZ-CABCVRRESA-N -1 3 356.474 3.578 20 0 FHADHM C[C@H]1CCC[C@@H](C(=O)N(Cc2ccco2)c2ccccc2-c2nnn[n-]2)C1 ZINC000736244666 599070574 /nfs/dbraw/zinc/07/05/74/599070574.db2.gz LSRNBSMFJFBNBQ-LSDHHAIUSA-N -1 3 365.437 3.819 20 0 FHADHM C[C@H]1CCC[C@@H](C(=O)N(Cc2ccco2)c2ccccc2-c2nn[n-]n2)C1 ZINC000736244666 599070577 /nfs/dbraw/zinc/07/05/77/599070577.db2.gz LSRNBSMFJFBNBQ-LSDHHAIUSA-N -1 3 365.437 3.819 20 0 FHADHM Fc1cccc(N[C@@H]2COc3c2ccc(Cl)c3Cl)c1-c1nnn[n-]1 ZINC000822792463 599076312 /nfs/dbraw/zinc/07/63/12/599076312.db2.gz XNEVRHFIZBVLCM-LLVKDONJSA-N -1 3 366.183 3.858 20 0 FHADHM Fc1cccc(N[C@@H]2COc3c2ccc(Cl)c3Cl)c1-c1nn[n-]n1 ZINC000822792463 599076315 /nfs/dbraw/zinc/07/63/15/599076315.db2.gz XNEVRHFIZBVLCM-LLVKDONJSA-N -1 3 366.183 3.858 20 0 FHADHM CC(C)Sc1c(Cl)cccc1NC(=O)c1ccc(-c2nnn[n-]2)cn1 ZINC000735920984 599076641 /nfs/dbraw/zinc/07/66/41/599076641.db2.gz DHVTZKBMNLCJCM-UHFFFAOYSA-N -1 3 374.857 3.668 20 0 FHADHM CC(C)Sc1c(Cl)cccc1NC(=O)c1ccc(-c2nn[n-]n2)cn1 ZINC000735920984 599076643 /nfs/dbraw/zinc/07/66/43/599076643.db2.gz DHVTZKBMNLCJCM-UHFFFAOYSA-N -1 3 374.857 3.668 20 0 FHADHM CCSCc1cccc(NC(=O)C=Cc2ccccc2-c2nnn[n-]2)c1 ZINC000736665439 599084573 /nfs/dbraw/zinc/08/45/73/599084573.db2.gz HYIQDSVZAOJFOA-ZHACJKMWSA-N -1 3 365.462 3.772 20 0 FHADHM CCSCc1cccc(NC(=O)C=Cc2ccccc2-c2nn[n-]n2)c1 ZINC000736665439 599084576 /nfs/dbraw/zinc/08/45/76/599084576.db2.gz HYIQDSVZAOJFOA-ZHACJKMWSA-N -1 3 365.462 3.772 20 0 FHADHM C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)N1C(=O)C=Cc1ccccc1-c1nnn[n-]1 ZINC000736235678 599090000 /nfs/dbraw/zinc/09/00/00/599090000.db2.gz PLAIXLZHMRYMBV-DAMHDEGHSA-N -1 3 373.460 3.673 20 0 FHADHM C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)N1C(=O)C=Cc1ccccc1-c1nn[n-]n1 ZINC000736235678 599090002 /nfs/dbraw/zinc/09/00/02/599090002.db2.gz PLAIXLZHMRYMBV-DAMHDEGHSA-N -1 3 373.460 3.673 20 0 FHADHM CC(C)CC[C@@H](NC(=O)NCc1ccc(-c2nnn[n-]2)cc1)C(C)(C)C ZINC000735797179 599103113 /nfs/dbraw/zinc/10/31/13/599103113.db2.gz MBTJDYVNCZXOCG-MRXNPFEDSA-N -1 3 358.490 3.517 20 0 FHADHM CC(C)CC[C@@H](NC(=O)NCc1ccc(-c2nn[n-]n2)cc1)C(C)(C)C ZINC000735797179 599103114 /nfs/dbraw/zinc/10/31/14/599103114.db2.gz MBTJDYVNCZXOCG-MRXNPFEDSA-N -1 3 358.490 3.517 20 0 FHADHM Cc1cccc([C@@H](C)NC(=O)N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1C ZINC000737390260 599104950 /nfs/dbraw/zinc/10/49/50/599104950.db2.gz RXWCQOOVFPGGIO-HUUCEWRRSA-N -1 3 364.453 3.605 20 0 FHADHM Cc1cccc([C@@H](C)NC(=O)N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1C ZINC000737390260 599104951 /nfs/dbraw/zinc/10/49/51/599104951.db2.gz RXWCQOOVFPGGIO-HUUCEWRRSA-N -1 3 364.453 3.605 20 0 FHADHM Cc1ccc([C@H]2OCCC[C@@H]2CNc2cccc(F)c2-c2nnn[n-]2)cc1 ZINC000822233571 599108408 /nfs/dbraw/zinc/10/84/08/599108408.db2.gz RLDFUAFUISKGGN-DNVCBOLYSA-N -1 3 367.428 3.894 20 0 FHADHM Cc1ccc([C@H]2OCCC[C@@H]2CNc2cccc(F)c2-c2nn[n-]n2)cc1 ZINC000822233571 599108411 /nfs/dbraw/zinc/10/84/11/599108411.db2.gz RLDFUAFUISKGGN-DNVCBOLYSA-N -1 3 367.428 3.894 20 0 FHADHM O[C@H](C[C@H]1CCCN1c1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccccc1 ZINC000823675362 599109822 /nfs/dbraw/zinc/10/98/22/599109822.db2.gz WHALAMGNANYVHP-RDTXWAMCSA-N -1 3 369.856 3.613 20 0 FHADHM O[C@H](C[C@H]1CCCN1c1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccccc1 ZINC000823675362 599109824 /nfs/dbraw/zinc/10/98/24/599109824.db2.gz WHALAMGNANYVHP-RDTXWAMCSA-N -1 3 369.856 3.613 20 0 FHADHM CCN(CC)C(=O)[C@H](Sc1ccccc1-c1nnn[n-]1)c1ccccc1 ZINC000736520801 599110079 /nfs/dbraw/zinc/11/00/79/599110079.db2.gz CJNVGPVEGFOTIA-QGZVFWFLSA-N -1 3 367.478 3.569 20 0 FHADHM CCN(CC)C(=O)[C@H](Sc1ccccc1-c1nn[n-]n1)c1ccccc1 ZINC000736520801 599110080 /nfs/dbraw/zinc/11/00/80/599110080.db2.gz CJNVGPVEGFOTIA-QGZVFWFLSA-N -1 3 367.478 3.569 20 0 FHADHM O=C(CSc1ccccc1-c1nnn[n-]1)Nc1cccc2ccccc21 ZINC000737946206 599110620 /nfs/dbraw/zinc/11/06/20/599110620.db2.gz BSTGZCMTQDWGDO-UHFFFAOYSA-N -1 3 361.430 3.751 20 0 FHADHM O=C(CSc1ccccc1-c1nn[n-]n1)Nc1cccc2ccccc21 ZINC000737946206 599110623 /nfs/dbraw/zinc/11/06/23/599110623.db2.gz BSTGZCMTQDWGDO-UHFFFAOYSA-N -1 3 361.430 3.751 20 0 FHADHM Clc1ccccc1-c1nnc(CSc2ccccc2-c2nnn[n-]2)o1 ZINC000737576068 599112013 /nfs/dbraw/zinc/11/20/13/599112013.db2.gz STMGOXCPYPOIDS-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1ccccc1-c1nnc(CSc2ccccc2-c2nn[n-]n2)o1 ZINC000737576068 599112015 /nfs/dbraw/zinc/11/20/15/599112015.db2.gz STMGOXCPYPOIDS-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM CCO[C@H]1C[C@@H](Nc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)C12CCC2 ZINC000736614951 599119518 /nfs/dbraw/zinc/11/95/18/599119518.db2.gz WHSFOCLSFKMPBZ-KGLIPLIRSA-N -1 3 367.375 3.645 20 0 FHADHM COc1ccccc1[C@@H](C)SCCOc1cccc(-c2nnn[n-]2)c1 ZINC000821883319 599127906 /nfs/dbraw/zinc/12/79/06/599127906.db2.gz SRQXLLNYOMJLDY-CYBMUJFWSA-N -1 3 356.451 3.749 20 0 FHADHM COc1ccccc1[C@@H](C)SCCOc1cccc(-c2nn[n-]n2)c1 ZINC000821883319 599127910 /nfs/dbraw/zinc/12/79/10/599127910.db2.gz SRQXLLNYOMJLDY-CYBMUJFWSA-N -1 3 356.451 3.749 20 0 FHADHM CC(C)[C@@H](C)S[C@H](C)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820550764 599130749 /nfs/dbraw/zinc/13/07/49/599130749.db2.gz YRROZZQCTSRPQR-NXEZZACHSA-N -1 3 353.879 3.625 20 0 FHADHM CC(C)[C@@H](C)S[C@H](C)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820550764 599130750 /nfs/dbraw/zinc/13/07/50/599130750.db2.gz YRROZZQCTSRPQR-NXEZZACHSA-N -1 3 353.879 3.625 20 0 FHADHM COc1ccc(C=C(Cl)c2nc3ccccc3o2)cc1-c1nnn[n-]1 ZINC000737083881 599153098 /nfs/dbraw/zinc/15/30/98/599153098.db2.gz PYBMTCAAOVARRS-XFXZXTDPSA-N -1 3 353.769 3.753 20 0 FHADHM COc1ccc(C=C(Cl)c2nc3ccccc3o2)cc1-c1nn[n-]n1 ZINC000737083881 599153099 /nfs/dbraw/zinc/15/30/99/599153099.db2.gz PYBMTCAAOVARRS-XFXZXTDPSA-N -1 3 353.769 3.753 20 0 FHADHM COc1ccc(C=Cc2nc3cc(Cl)ccc3o2)cc1-c1nnn[n-]1 ZINC000737080808 599153180 /nfs/dbraw/zinc/15/31/80/599153180.db2.gz HOIMNRUQXNWTEJ-CLTKARDFSA-N -1 3 353.769 3.840 20 0 FHADHM COc1ccc(C=Cc2nc3cc(Cl)ccc3o2)cc1-c1nn[n-]n1 ZINC000737080808 599153183 /nfs/dbraw/zinc/15/31/83/599153183.db2.gz HOIMNRUQXNWTEJ-CLTKARDFSA-N -1 3 353.769 3.840 20 0 FHADHM C[C@H](CC(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1)c1cccc(F)c1 ZINC000735977503 599159543 /nfs/dbraw/zinc/15/95/43/599159543.db2.gz PHUOCJXUKZGRFQ-SNVBAGLBSA-N -1 3 359.792 3.792 20 0 FHADHM C[C@H](CC(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1)c1cccc(F)c1 ZINC000735977503 599159545 /nfs/dbraw/zinc/15/95/45/599159545.db2.gz PHUOCJXUKZGRFQ-SNVBAGLBSA-N -1 3 359.792 3.792 20 0 FHADHM Cc1ccccc1[C@@H](C)CC(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000737420797 599161449 /nfs/dbraw/zinc/16/14/49/599161449.db2.gz JPKOGWCJNRPPEE-LBPRGKRZSA-N -1 3 355.829 3.961 20 0 FHADHM Cc1ccccc1[C@@H](C)CC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000737420797 599161452 /nfs/dbraw/zinc/16/14/52/599161452.db2.gz JPKOGWCJNRPPEE-LBPRGKRZSA-N -1 3 355.829 3.961 20 0 FHADHM CC(C)c1ccc(C(=O)[C@H](C)Sc2ccc(-c3nnn[n-]3)cn2)cc1 ZINC000736189226 599164152 /nfs/dbraw/zinc/16/41/52/599164152.db2.gz BKDQDXWNKYRDFB-LBPRGKRZSA-N -1 3 353.451 3.749 20 0 FHADHM CC(C)c1ccc(C(=O)[C@H](C)Sc2ccc(-c3nn[n-]n3)cn2)cc1 ZINC000736189226 599164154 /nfs/dbraw/zinc/16/41/54/599164154.db2.gz BKDQDXWNKYRDFB-LBPRGKRZSA-N -1 3 353.451 3.749 20 0 FHADHM C[C@H](SCc1nnc(-c2ccc(-c3nnn[n-]3)cc2)o1)c1cccs1 ZINC000736192157 599166977 /nfs/dbraw/zinc/16/69/77/599166977.db2.gz LDWRANCDEOQNDV-JTQLQIEISA-N -1 3 370.463 3.973 20 0 FHADHM C[C@H](SCc1nnc(-c2ccc(-c3nn[n-]n3)cc2)o1)c1cccs1 ZINC000736192157 599166978 /nfs/dbraw/zinc/16/69/78/599166978.db2.gz LDWRANCDEOQNDV-JTQLQIEISA-N -1 3 370.463 3.973 20 0 FHADHM CCSc1ccccc1OC(=O)C=Cc1ccccc1-c1nnn[n-]1 ZINC000736665065 599165189 /nfs/dbraw/zinc/16/51/89/599165189.db2.gz FBOWPXSBUXTHGI-VAWYXSNFSA-N -1 3 352.419 3.598 20 0 FHADHM CCSc1ccccc1OC(=O)C=Cc1ccccc1-c1nn[n-]n1 ZINC000736665065 599165191 /nfs/dbraw/zinc/16/51/91/599165191.db2.gz FBOWPXSBUXTHGI-VAWYXSNFSA-N -1 3 352.419 3.598 20 0 FHADHM Cc1cccc(NC(=O)[C@H](C)Sc2ccc(-c3nnn[n-]3)cc2F)c1C ZINC000737400553 599172206 /nfs/dbraw/zinc/17/22/06/599172206.db2.gz TUVIQJIGGIQZNE-LBPRGKRZSA-N -1 3 371.441 3.742 20 0 FHADHM Cc1cccc(NC(=O)[C@H](C)Sc2ccc(-c3nn[n-]n3)cc2F)c1C ZINC000737400553 599172207 /nfs/dbraw/zinc/17/22/07/599172207.db2.gz TUVIQJIGGIQZNE-LBPRGKRZSA-N -1 3 371.441 3.742 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2)c1cccc(Cl)c1 ZINC000735570309 599177464 /nfs/dbraw/zinc/17/74/64/599177464.db2.gz NHGLPNAEFPHQOV-VIFPVBQESA-N -1 3 373.869 3.813 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2)c1cccc(Cl)c1 ZINC000735570309 599177465 /nfs/dbraw/zinc/17/74/65/599177465.db2.gz NHGLPNAEFPHQOV-VIFPVBQESA-N -1 3 373.869 3.813 20 0 FHADHM S=C(Nc1ccccc1-c1nnn[n-]1)N1CC[C@@H]1c1ccc(Cl)cc1 ZINC000738408617 599177650 /nfs/dbraw/zinc/17/76/50/599177650.db2.gz NFGJSTOSYCQFRX-OAHLLOKOSA-N -1 3 370.869 3.664 20 0 FHADHM S=C(Nc1ccccc1-c1nn[n-]n1)N1CC[C@@H]1c1ccc(Cl)cc1 ZINC000738408617 599177651 /nfs/dbraw/zinc/17/76/51/599177651.db2.gz NFGJSTOSYCQFRX-OAHLLOKOSA-N -1 3 370.869 3.664 20 0 FHADHM Cc1sc(NC(=O)[C@H](C)c2cccc(Cl)c2)c(-c2nnn[n-]2)c1C ZINC000737560834 599178591 /nfs/dbraw/zinc/17/85/91/599178591.db2.gz HTFZKSAWOOYNSX-SECBINFHSA-N -1 3 361.858 3.941 20 0 FHADHM Cc1sc(NC(=O)[C@H](C)c2cccc(Cl)c2)c(-c2nn[n-]n2)c1C ZINC000737560834 599178594 /nfs/dbraw/zinc/17/85/94/599178594.db2.gz HTFZKSAWOOYNSX-SECBINFHSA-N -1 3 361.858 3.941 20 0 FHADHM CCCCCC[C@@H](C)C(=O)Nc1ccnn1-c1ccc(-c2nn[n-]n2)cc1 ZINC000736447288 599188905 /nfs/dbraw/zinc/18/89/05/599188905.db2.gz SVNYLWIALILVJU-CQSZACIVSA-N -1 3 367.457 3.597 20 0 FHADHM CC(C)CCC[C@@H](C)N(CCC(C)C)C(=O)c1ccc(-c2nnn[n-]2)cn1 ZINC000820073138 599189283 /nfs/dbraw/zinc/18/92/83/599189283.db2.gz QVIQZINMGURHMM-MRXNPFEDSA-N -1 3 372.517 3.965 20 0 FHADHM CC(C)CCC[C@@H](C)N(CCC(C)C)C(=O)c1ccc(-c2nn[n-]n2)cn1 ZINC000820073138 599189286 /nfs/dbraw/zinc/18/92/86/599189286.db2.gz QVIQZINMGURHMM-MRXNPFEDSA-N -1 3 372.517 3.965 20 0 FHADHM C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)C)CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736113519 599187178 /nfs/dbraw/zinc/18/71/78/599187178.db2.gz OWUIMUIOJYQZQM-RHSMWYFYSA-N -1 3 370.501 3.786 20 0 FHADHM C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)C)CC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736113519 599187180 /nfs/dbraw/zinc/18/71/80/599187180.db2.gz OWUIMUIOJYQZQM-RHSMWYFYSA-N -1 3 370.501 3.786 20 0 FHADHM O=C(CSCc1ccc(-c2nnn[n-]2)cc1)NCCCCC1CCCC1 ZINC000823060408 599208303 /nfs/dbraw/zinc/20/83/03/599208303.db2.gz AOWRADKLFZBRGF-UHFFFAOYSA-N -1 3 373.526 3.577 20 0 FHADHM O=C(CSCc1ccc(-c2nn[n-]n2)cc1)NCCCCC1CCCC1 ZINC000823060408 599208306 /nfs/dbraw/zinc/20/83/06/599208306.db2.gz AOWRADKLFZBRGF-UHFFFAOYSA-N -1 3 373.526 3.577 20 0 FHADHM CC=CC=CC(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1 ZINC000820832782 599219923 /nfs/dbraw/zinc/21/99/23/599219923.db2.gz NQVCXMOCSBAASG-OQIXSKIXSA-N -1 3 365.368 3.869 20 0 FHADHM CC=CC=CC(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1 ZINC000820832782 599219925 /nfs/dbraw/zinc/21/99/25/599219925.db2.gz NQVCXMOCSBAASG-OQIXSKIXSA-N -1 3 365.368 3.869 20 0 FHADHM CCc1ccc([C@H]2C[C@H](C)CCN2C(=O)c2cccc(-c3nnn[n-]3)c2)o1 ZINC000821482513 599220502 /nfs/dbraw/zinc/22/05/02/599220502.db2.gz SEKAQZAYGKTODU-CXAGYDPISA-N -1 3 365.437 3.636 20 0 FHADHM CCc1ccc([C@H]2C[C@H](C)CCN2C(=O)c2cccc(-c3nn[n-]n3)c2)o1 ZINC000821482513 599220505 /nfs/dbraw/zinc/22/05/05/599220505.db2.gz SEKAQZAYGKTODU-CXAGYDPISA-N -1 3 365.437 3.636 20 0 FHADHM C[C@H](SCC(=O)N(C)CC1CCCCC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820548535 599222732 /nfs/dbraw/zinc/22/27/32/599222732.db2.gz BMWNAODTJDHTCN-AWEZNQCLSA-N -1 3 373.526 3.700 20 0 FHADHM C[C@H](SCC(=O)N(C)CC1CCCCC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820548535 599222736 /nfs/dbraw/zinc/22/27/36/599222736.db2.gz BMWNAODTJDHTCN-AWEZNQCLSA-N -1 3 373.526 3.700 20 0 FHADHM COc1cccc(CCCSCCOc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000821867950 599223027 /nfs/dbraw/zinc/22/30/27/599223027.db2.gz MLBZBLCTTDJYIZ-UHFFFAOYSA-N -1 3 370.478 3.620 20 0 FHADHM Cc1ccc(NCc2cccc(OCc3ccccc3-c3nnn[n-]3)c2)cn1 ZINC000822258927 607259945 /nfs/dbraw/zinc/25/99/45/607259945.db2.gz HREDHTMGKALIOE-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM Cc1ccc(NCc2cccc(OCc3ccccc3-c3nn[n-]n3)c2)cn1 ZINC000822258927 607259946 /nfs/dbraw/zinc/25/99/46/607259946.db2.gz HREDHTMGKALIOE-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM Fc1ccc(-n2ccc(CSCc3ccc(-c4nnn[n-]4)cc3)n2)cc1 ZINC000822761207 599226716 /nfs/dbraw/zinc/22/67/16/599226716.db2.gz CBOMOXYHYMBCPN-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM Fc1ccc(-n2ccc(CSCc3ccc(-c4nn[n-]n4)cc3)n2)cc1 ZINC000822761207 599226719 /nfs/dbraw/zinc/22/67/19/599226719.db2.gz CBOMOXYHYMBCPN-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM CC[C@]1(C)CCCN(C(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)C1 ZINC000820949742 599228510 /nfs/dbraw/zinc/22/85/10/599228510.db2.gz FCYAERZMBBYUBK-MRXNPFEDSA-N -1 3 364.906 3.729 20 0 FHADHM CC[C@]1(C)CCCN(C(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)C1 ZINC000820949742 599228513 /nfs/dbraw/zinc/22/85/13/599228513.db2.gz FCYAERZMBBYUBK-MRXNPFEDSA-N -1 3 364.906 3.729 20 0 FHADHM S=C(Nc1ccccc1-c1nnn[n-]1)N1CCCC2(C1)CCCCCC2 ZINC000823731995 599229168 /nfs/dbraw/zinc/22/91/68/599229168.db2.gz ICHARRJNZHFRQT-UHFFFAOYSA-N -1 3 370.526 4.000 20 0 FHADHM S=C(Nc1ccccc1-c1nn[n-]n1)N1CCCC2(C1)CCCCCC2 ZINC000823731995 599229169 /nfs/dbraw/zinc/22/91/69/599229169.db2.gz ICHARRJNZHFRQT-UHFFFAOYSA-N -1 3 370.526 4.000 20 0 FHADHM C[C@@H](NC(=S)Nc1cccc(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820403965 599237981 /nfs/dbraw/zinc/23/79/81/599237981.db2.gz NZNWSQQPVIYJFY-SNVBAGLBSA-N -1 3 358.858 3.568 20 0 FHADHM C[C@@H](NC(=S)Nc1cccc(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820403965 599237982 /nfs/dbraw/zinc/23/79/82/599237982.db2.gz NZNWSQQPVIYJFY-SNVBAGLBSA-N -1 3 358.858 3.568 20 0 FHADHM Cc1c(NC(=O)c2csc(-c3cccs3)n2)cccc1-c1nnn[n-]1 ZINC000822116032 607267530 /nfs/dbraw/zinc/26/75/30/607267530.db2.gz KYJHPWXTLATNKA-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM Cc1c(NC(=O)c2csc(-c3cccs3)n2)cccc1-c1nn[n-]n1 ZINC000822116032 607267531 /nfs/dbraw/zinc/26/75/31/607267531.db2.gz KYJHPWXTLATNKA-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM Cc1c(NC(=O)c2cc(Oc3ccccc3)ccn2)cccc1-c1nnn[n-]1 ZINC000822108727 607268099 /nfs/dbraw/zinc/26/80/99/607268099.db2.gz KVELIANHQOTZBD-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1c(NC(=O)c2cc(Oc3ccccc3)ccn2)cccc1-c1nn[n-]n1 ZINC000822108727 607268100 /nfs/dbraw/zinc/26/81/00/607268100.db2.gz KVELIANHQOTZBD-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM C[C@@H]1C[C@H](c2ccccc2F)N(C(=O)Nc2ccc(-c3nnn[n-]3)cc2)C1 ZINC000820666589 599240236 /nfs/dbraw/zinc/24/02/36/599240236.db2.gz JALMHLUJGJIADM-SJKOYZFVSA-N -1 3 366.400 3.621 20 0 FHADHM C[C@@H]1C[C@H](c2ccccc2F)N(C(=O)Nc2ccc(-c3nn[n-]n3)cc2)C1 ZINC000820666589 599240239 /nfs/dbraw/zinc/24/02/39/599240239.db2.gz JALMHLUJGJIADM-SJKOYZFVSA-N -1 3 366.400 3.621 20 0 FHADHM C[C@@H]1CN(C(=O)Nc2cccc(-c3nnn[n-]3)c2)CC[C@@H]1c1ccccc1 ZINC000820743481 599243250 /nfs/dbraw/zinc/24/32/50/599243250.db2.gz UQZOGIWXBMUXDJ-KDOFPFPSSA-N -1 3 362.437 3.524 20 0 FHADHM C[C@@H]1CN(C(=O)Nc2cccc(-c3nn[n-]n3)c2)CC[C@@H]1c1ccccc1 ZINC000820743481 599243252 /nfs/dbraw/zinc/24/32/52/599243252.db2.gz UQZOGIWXBMUXDJ-KDOFPFPSSA-N -1 3 362.437 3.524 20 0 FHADHM Cc1c(NC(=O)C=Cc2cnc(C(C)(C)C)s2)cccc1-c1nnn[n-]1 ZINC000822068946 607268904 /nfs/dbraw/zinc/26/89/04/607268904.db2.gz XALXFHZVRBFNCO-CMDGGOBGSA-N -1 3 368.466 3.581 20 0 FHADHM Cc1c(NC(=O)C=Cc2cnc(C(C)(C)C)s2)cccc1-c1nn[n-]n1 ZINC000822068946 607268905 /nfs/dbraw/zinc/26/89/05/607268905.db2.gz XALXFHZVRBFNCO-CMDGGOBGSA-N -1 3 368.466 3.581 20 0 FHADHM Cc1c(NC(=O)c2cnc(-c3ccccc3)s2)cccc1-c1nnn[n-]1 ZINC000822116466 607268960 /nfs/dbraw/zinc/26/89/60/607268960.db2.gz RNMZQOZRJHPRBO-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1c(NC(=O)c2cnc(-c3ccccc3)s2)cccc1-c1nn[n-]n1 ZINC000822116466 607268961 /nfs/dbraw/zinc/26/89/61/607268961.db2.gz RNMZQOZRJHPRBO-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1ccc([C@H]2CCCCN2C(=O)Nc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000822233169 599243792 /nfs/dbraw/zinc/24/37/92/599243792.db2.gz IYTIVGNZUHHBBD-GOSISDBHSA-N -1 3 362.437 3.934 20 0 FHADHM Cc1ccc([C@H]2CCCCN2C(=O)Nc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000822233169 599243797 /nfs/dbraw/zinc/24/37/97/599243797.db2.gz IYTIVGNZUHHBBD-GOSISDBHSA-N -1 3 362.437 3.934 20 0 FHADHM CCc1ccc([C@@H]2CCCN2C(=S)Nc2ccccc2-c2nnn[n-]2)o1 ZINC000736688501 599246467 /nfs/dbraw/zinc/24/64/67/599246467.db2.gz WAUHJUFANLPREX-HNNXBMFYSA-N -1 3 368.466 3.556 20 0 FHADHM CCc1ccc([C@@H]2CCCN2C(=S)Nc2ccccc2-c2nn[n-]n2)o1 ZINC000736688501 599246469 /nfs/dbraw/zinc/24/64/69/599246469.db2.gz WAUHJUFANLPREX-HNNXBMFYSA-N -1 3 368.466 3.556 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)N[C@@H]1CC[C@H]2CCC[C@@H]2C1 ZINC000823308465 599251567 /nfs/dbraw/zinc/25/15/67/599251567.db2.gz BDYKAQNHOWRFAW-IJLUTSLNSA-N -1 3 360.849 3.610 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)N[C@@H]1CC[C@H]2CCC[C@@H]2C1 ZINC000823308465 599251570 /nfs/dbraw/zinc/25/15/70/599251570.db2.gz BDYKAQNHOWRFAW-IJLUTSLNSA-N -1 3 360.849 3.610 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)N1CC[C@@H]1c1ccc(Cl)cc1 ZINC000737795994 599251992 /nfs/dbraw/zinc/25/19/92/599251992.db2.gz DMTROVUQWFROND-CGQZWFTASA-N -1 3 365.824 3.507 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)N1CC[C@@H]1c1ccc(Cl)cc1 ZINC000737795994 599251993 /nfs/dbraw/zinc/25/19/93/599251993.db2.gz DMTROVUQWFROND-CGQZWFTASA-N -1 3 365.824 3.507 20 0 FHADHM CCCN(Cc1ccccc1F)C(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000821109731 607281411 /nfs/dbraw/zinc/28/14/11/607281411.db2.gz NKPOIOKSFDESJU-UHFFFAOYSA-N -1 3 368.416 3.758 20 0 FHADHM CCCN(Cc1ccccc1F)C(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000821109731 607281412 /nfs/dbraw/zinc/28/14/12/607281412.db2.gz NKPOIOKSFDESJU-UHFFFAOYSA-N -1 3 368.416 3.758 20 0 FHADHM CC[C@H](NC(=O)Nc1cccc(-c2nnn[n-]2)c1C)c1ccc(F)cc1F ZINC000820920323 607287983 /nfs/dbraw/zinc/28/79/83/607287983.db2.gz OZWIWXSVLOOPOW-HNNXBMFYSA-N -1 3 372.379 3.726 20 0 FHADHM CC[C@H](NC(=O)Nc1cccc(-c2nn[n-]n2)c1C)c1ccc(F)cc1F ZINC000820920323 607287984 /nfs/dbraw/zinc/28/79/84/607287984.db2.gz OZWIWXSVLOOPOW-HNNXBMFYSA-N -1 3 372.379 3.726 20 0 FHADHM Cc1c(NC(=O)N(C)[C@H](C)c2ccc(F)c(F)c2)cccc1-c1nnn[n-]1 ZINC000822075996 607287382 /nfs/dbraw/zinc/28/73/82/607287382.db2.gz KWHTZIKURFRGSI-LLVKDONJSA-N -1 3 372.379 3.678 20 0 FHADHM Cc1c(NC(=O)N(C)[C@H](C)c2ccc(F)c(F)c2)cccc1-c1nn[n-]n1 ZINC000822075996 607287383 /nfs/dbraw/zinc/28/73/83/607287383.db2.gz KWHTZIKURFRGSI-LLVKDONJSA-N -1 3 372.379 3.678 20 0 FHADHM Clc1cc(-c2nnn[n-]2)ccc1Oc1ncncc1-c1ccccc1 ZINC000822563465 607302258 /nfs/dbraw/zinc/30/22/58/607302258.db2.gz KDCBYOGLGMIXBV-UHFFFAOYSA-N -1 3 350.769 3.769 20 0 FHADHM Clc1cc(-c2nn[n-]n2)ccc1Oc1ncncc1-c1ccccc1 ZINC000822563465 607302259 /nfs/dbraw/zinc/30/22/59/607302259.db2.gz KDCBYOGLGMIXBV-UHFFFAOYSA-N -1 3 350.769 3.769 20 0 FHADHM Cc1ccccc1[C@H](NC(=O)Nc1cccc(-c2nnn[n-]2)c1C)C1CC1 ZINC000822352394 607290286 /nfs/dbraw/zinc/29/02/86/607290286.db2.gz YOUCNLWAMLTYLC-GOSISDBHSA-N -1 3 362.437 3.756 20 0 FHADHM Cc1ccccc1[C@H](NC(=O)Nc1cccc(-c2nn[n-]n2)c1C)C1CC1 ZINC000822352394 607290287 /nfs/dbraw/zinc/29/02/87/607290287.db2.gz YOUCNLWAMLTYLC-GOSISDBHSA-N -1 3 362.437 3.756 20 0 FHADHM Cc1ccc(C[C@H](C)N(C)C(=O)Nc2cccc(-c3nnn[n-]3)c2C)cc1 ZINC000822234781 607290365 /nfs/dbraw/zinc/29/03/65/607290365.db2.gz HGVDCZAEAAYZCZ-AWEZNQCLSA-N -1 3 364.453 3.578 20 0 FHADHM Cc1ccc(C[C@H](C)N(C)C(=O)Nc2cccc(-c3nn[n-]n3)c2C)cc1 ZINC000822234781 607290366 /nfs/dbraw/zinc/29/03/66/607290366.db2.gz HGVDCZAEAAYZCZ-AWEZNQCLSA-N -1 3 364.453 3.578 20 0 FHADHM CCC[C@@H]1[C@H](C)CCCN1C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821033771 599262544 /nfs/dbraw/zinc/26/25/44/599262544.db2.gz FDYJKXWUTMTKMS-CKEIUWERSA-N -1 3 356.474 3.538 20 0 FHADHM CCC[C@@H]1[C@H](C)CCCN1C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821033771 599262547 /nfs/dbraw/zinc/26/25/47/599262547.db2.gz FDYJKXWUTMTKMS-CKEIUWERSA-N -1 3 356.474 3.538 20 0 FHADHM CC[C@H](NC(=O)Nc1cccc(-c2nnn[n-]2)c1C)c1cc(F)ccc1F ZINC000820919940 607293164 /nfs/dbraw/zinc/29/31/64/607293164.db2.gz HWSHBJVMCXISFS-HNNXBMFYSA-N -1 3 372.379 3.726 20 0 FHADHM CC[C@H](NC(=O)Nc1cccc(-c2nn[n-]n2)c1C)c1cc(F)ccc1F ZINC000820919940 607293165 /nfs/dbraw/zinc/29/31/65/607293165.db2.gz HWSHBJVMCXISFS-HNNXBMFYSA-N -1 3 372.379 3.726 20 0 FHADHM C[C@H](NC(=O)NCCCCC1CCCC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820368282 599259293 /nfs/dbraw/zinc/25/92/93/599259293.db2.gz ZIDUUTIXBXRTHX-AWEZNQCLSA-N -1 3 356.474 3.587 20 0 FHADHM C[C@H](NC(=O)NCCCCC1CCCC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820368282 599259295 /nfs/dbraw/zinc/25/92/95/599259295.db2.gz ZIDUUTIXBXRTHX-AWEZNQCLSA-N -1 3 356.474 3.587 20 0 FHADHM O[C@H]1CCCC[C@@H]1CCCNc1ccc(-c2nn[n-]n2)cc1C(F)(F)F ZINC000823706781 607306523 /nfs/dbraw/zinc/30/65/23/607306523.db2.gz PCMFXLOSQQTYLZ-ABAIWWIYSA-N -1 3 369.391 3.629 20 0 FHADHM CC[C@H](C)C[C@H](C)NC(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(C)C ZINC000820869458 599264554 /nfs/dbraw/zinc/26/45/54/599264554.db2.gz HAZRWBQTEKLUIS-STQMWFEESA-N -1 3 360.462 3.600 20 0 FHADHM CC[C@H](C)C[C@H](C)NC(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(C)C ZINC000820869458 599264556 /nfs/dbraw/zinc/26/45/56/599264556.db2.gz HAZRWBQTEKLUIS-STQMWFEESA-N -1 3 360.462 3.600 20 0 FHADHM c1c(-c2cccc(NCc3cccc(-c4nnn[n-]4)c3)c2)nc2n1CCCC2 ZINC000823757510 607314778 /nfs/dbraw/zinc/31/47/78/607314778.db2.gz RFIXOPRBGPOKTB-UHFFFAOYSA-N -1 3 371.448 3.679 20 0 FHADHM c1c(-c2cccc(NCc3cccc(-c4nn[n-]n4)c3)c2)nc2n1CCCC2 ZINC000823757510 607314779 /nfs/dbraw/zinc/31/47/79/607314779.db2.gz RFIXOPRBGPOKTB-UHFFFAOYSA-N -1 3 371.448 3.679 20 0 FHADHM CN(C(=O)Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1)C1CCC1 ZINC000821571902 599268044 /nfs/dbraw/zinc/26/80/44/599268044.db2.gz KIJKJDKEJFRISH-UHFFFAOYSA-N -1 3 364.409 3.675 20 0 FHADHM CN(C(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1)C1CCC1 ZINC000821571902 599268047 /nfs/dbraw/zinc/26/80/47/599268047.db2.gz KIJKJDKEJFRISH-UHFFFAOYSA-N -1 3 364.409 3.675 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cccc(Cl)c1 ZINC000736487860 599275552 /nfs/dbraw/zinc/27/55/52/599275552.db2.gz JCIULFPTJATROS-UHFFFAOYSA-N -1 3 356.817 3.594 20 0 FHADHM COc1ccc(CNc2cccc(CC(F)(F)F)c2)cc1-c1nnn[n-]1 ZINC000821821723 607318473 /nfs/dbraw/zinc/31/84/73/607318473.db2.gz SZABHKHYQTWHAT-UHFFFAOYSA-N -1 3 363.343 3.592 20 0 FHADHM COc1ccc(CNc2cccc(CC(F)(F)F)c2)cc1-c1nn[n-]n1 ZINC000821821723 607318474 /nfs/dbraw/zinc/31/84/74/607318474.db2.gz SZABHKHYQTWHAT-UHFFFAOYSA-N -1 3 363.343 3.592 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1ccccc1Cl ZINC000736487110 599276911 /nfs/dbraw/zinc/27/69/11/599276911.db2.gz COKLUNKNJHIJGS-UHFFFAOYSA-N -1 3 356.817 3.594 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)N1CCCC2(C1)CCCCCC2 ZINC000823332264 599280110 /nfs/dbraw/zinc/28/01/10/599280110.db2.gz MGUPQLUGKBRFNV-UHFFFAOYSA-N -1 3 372.448 3.974 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)N1CCCC2(C1)CCCCCC2 ZINC000823332264 599280113 /nfs/dbraw/zinc/28/01/13/599280113.db2.gz MGUPQLUGKBRFNV-UHFFFAOYSA-N -1 3 372.448 3.974 20 0 FHADHM C[C@@H](Sc1nc2cc(Cl)cnc2[nH]1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736191046 599284854 /nfs/dbraw/zinc/28/48/54/599284854.db2.gz HFVZRKWCELSNQT-MRVPVSSYSA-N -1 3 357.830 3.645 20 0 FHADHM Cc1csc(CSc2nc(C)cc(C(F)(F)F)c2-c2nnn[n-]2)n1 ZINC000737453453 599284899 /nfs/dbraw/zinc/28/48/99/599284899.db2.gz VEBCYDMCSZOZNB-UHFFFAOYSA-N -1 3 372.401 3.646 20 0 FHADHM COc1ccc2[nH]c(S[C@@H](C)c3ccc(-c4nn[n-]n4)cc3)nc2c1 ZINC000737120177 599285542 /nfs/dbraw/zinc/28/55/42/599285542.db2.gz LJANQNHEOBIHMD-JTQLQIEISA-N -1 3 352.423 3.605 20 0 FHADHM C[C@@H](Sc1nnc(-c2ccccc2F)o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736193255 599287398 /nfs/dbraw/zinc/28/73/98/599287398.db2.gz QRPQBTHUFJMQCL-SNVBAGLBSA-N -1 3 368.397 3.909 20 0 FHADHM C[C@@H](Sc1nnc(-c2ccccc2F)o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736193255 599287400 /nfs/dbraw/zinc/28/74/00/599287400.db2.gz QRPQBTHUFJMQCL-SNVBAGLBSA-N -1 3 368.397 3.909 20 0 FHADHM C[C@@H](Sc1nnc(Cc2cccs2)o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736192770 599289242 /nfs/dbraw/zinc/28/92/42/599289242.db2.gz NKLBYGKWFWVPMK-SNVBAGLBSA-N -1 3 370.463 3.755 20 0 FHADHM C[C@@H](Sc1nnc(Cc2cccs2)o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736192770 599289243 /nfs/dbraw/zinc/28/92/43/599289243.db2.gz NKLBYGKWFWVPMK-SNVBAGLBSA-N -1 3 370.463 3.755 20 0 FHADHM Cc1ccncc1CSc1nc(-c2ccccc2)ccc1-c1nnn[n-]1 ZINC000822378893 607327381 /nfs/dbraw/zinc/32/73/81/607327381.db2.gz HDUJWOJZTGDKQA-UHFFFAOYSA-N -1 3 360.446 3.924 20 0 FHADHM Cc1ccncc1CSc1nc(-c2ccccc2)ccc1-c1nn[n-]n1 ZINC000822378893 607327382 /nfs/dbraw/zinc/32/73/82/607327382.db2.gz HDUJWOJZTGDKQA-UHFFFAOYSA-N -1 3 360.446 3.924 20 0 FHADHM Cc1ccncc1NC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737445516 598234896 /nfs/dbraw/zinc/23/48/96/598234896.db2.gz QDCIHMWFERWWHE-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccncc1NC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737445516 598234897 /nfs/dbraw/zinc/23/48/97/598234897.db2.gz QDCIHMWFERWWHE-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM O=C(N[C@H](c1ccc(Cl)cc1)C1CCC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000737999328 598235369 /nfs/dbraw/zinc/23/53/69/598235369.db2.gz STZORIZSYRCUAA-KRWDZBQOSA-N -1 3 367.840 3.791 20 0 FHADHM O=C(N[C@H](c1ccc(Cl)cc1)C1CCC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000737999328 598235372 /nfs/dbraw/zinc/23/53/72/598235372.db2.gz STZORIZSYRCUAA-KRWDZBQOSA-N -1 3 367.840 3.791 20 0 FHADHM Fc1ccc(Br)cc1CNc1ccc(-c2nn[n-]n2)cc1F ZINC000737647049 598238471 /nfs/dbraw/zinc/23/84/71/598238471.db2.gz ASHWJRSHHAMGKS-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1cccc(N2CCC[C@H](c3cc4ccccc4[nH]3)C2)c1-c1nnn[n-]1 ZINC000737659450 598239990 /nfs/dbraw/zinc/23/99/90/598239990.db2.gz DGQUNXZJKSIMJZ-AWEZNQCLSA-N -1 3 362.412 3.871 20 0 FHADHM Fc1cccc(N2CCC[C@H](c3cc4ccccc4[nH]3)C2)c1-c1nn[n-]n1 ZINC000737659450 598239991 /nfs/dbraw/zinc/23/99/91/598239991.db2.gz DGQUNXZJKSIMJZ-AWEZNQCLSA-N -1 3 362.412 3.871 20 0 FHADHM CC[C@@H](C)[C@H](C)N(C(=O)CSCc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000736334573 598240827 /nfs/dbraw/zinc/24/08/27/598240827.db2.gz XFJRPHUCCVEPDU-KGLIPLIRSA-N -1 3 373.526 3.526 20 0 FHADHM CC[C@@H](C)[C@H](C)N(C(=O)CSCc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000736334573 598240830 /nfs/dbraw/zinc/24/08/30/598240830.db2.gz XFJRPHUCCVEPDU-KGLIPLIRSA-N -1 3 373.526 3.526 20 0 FHADHM CCCc1nc(COc2c(Cl)cc(-c3nnn[n-]3)cc2OC)cs1 ZINC000736495547 598247633 /nfs/dbraw/zinc/24/76/33/598247633.db2.gz OHIKBQKVBPWYBM-UHFFFAOYSA-N -1 3 365.846 3.517 20 0 FHADHM CCCc1nc(COc2c(Cl)cc(-c3nn[n-]n3)cc2OC)cs1 ZINC000736495547 598247634 /nfs/dbraw/zinc/24/76/34/598247634.db2.gz OHIKBQKVBPWYBM-UHFFFAOYSA-N -1 3 365.846 3.517 20 0 FHADHM O=C(c1ccccc1)c1cccc(NCc2ccc(-c3nnn[n-]3)cc2F)c1 ZINC000738278943 598250454 /nfs/dbraw/zinc/25/04/54/598250454.db2.gz QCXTWIXRRFHCRH-UHFFFAOYSA-N -1 3 373.391 3.849 20 0 FHADHM O=C(c1ccccc1)c1cccc(NCc2ccc(-c3nn[n-]n3)cc2F)c1 ZINC000738278943 598250456 /nfs/dbraw/zinc/25/04/56/598250456.db2.gz QCXTWIXRRFHCRH-UHFFFAOYSA-N -1 3 373.391 3.849 20 0 FHADHM O=C(Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)Nc1ccccn1 ZINC000738185182 598254925 /nfs/dbraw/zinc/25/49/25/598254925.db2.gz TVQYHOYWAYGFGX-UHFFFAOYSA-N -1 3 373.376 3.698 20 0 FHADHM C[C@H](NC(=O)NCc1ccc2ccccc2c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736119618 598263117 /nfs/dbraw/zinc/26/31/17/598263117.db2.gz SVEZSLFRCZKXRB-AWEZNQCLSA-N -1 3 372.432 3.580 20 0 FHADHM C[C@H](NC(=O)NCc1ccc2ccccc2c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736119618 598263119 /nfs/dbraw/zinc/26/31/19/598263119.db2.gz SVEZSLFRCZKXRB-AWEZNQCLSA-N -1 3 372.432 3.580 20 0 FHADHM CC(C)CCNC(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000735810920 598266434 /nfs/dbraw/zinc/26/64/34/598266434.db2.gz AJFYRIZPLCZKEE-UHFFFAOYSA-N -1 3 366.425 3.827 20 0 FHADHM CC(C)CCNC(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735810920 598266435 /nfs/dbraw/zinc/26/64/35/598266435.db2.gz AJFYRIZPLCZKEE-UHFFFAOYSA-N -1 3 366.425 3.827 20 0 FHADHM C[C@H](CCc1ccco1)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000735992715 598274545 /nfs/dbraw/zinc/27/45/45/598274545.db2.gz LTKHLDIOHRZCRX-SNVBAGLBSA-N -1 3 351.332 3.912 20 0 FHADHM C[C@H](CCc1ccco1)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000735992715 598274546 /nfs/dbraw/zinc/27/45/46/598274546.db2.gz LTKHLDIOHRZCRX-SNVBAGLBSA-N -1 3 351.332 3.912 20 0 FHADHM Cc1cccc(NC(=O)Nc2cc(-c3nnn[n-]3)cn2C(C)(C)C)c1C ZINC000737400556 598276934 /nfs/dbraw/zinc/27/69/34/598276934.db2.gz VSKRSZVNXNSXNU-UHFFFAOYSA-N -1 3 353.430 3.684 20 0 FHADHM Cc1cccc(NC(=O)Nc2cc(-c3nn[n-]n3)cn2C(C)(C)C)c1C ZINC000737400556 598276936 /nfs/dbraw/zinc/27/69/36/598276936.db2.gz VSKRSZVNXNSXNU-UHFFFAOYSA-N -1 3 353.430 3.684 20 0 FHADHM C[C@@H]1CN(C(=O)Nc2cc(-c3nnn[n-]3)cn2C(C)(C)C)c2ccccc21 ZINC000736282636 598278023 /nfs/dbraw/zinc/27/80/23/598278023.db2.gz ZABLYXZNNCGDSA-GFCCVEGCSA-N -1 3 365.441 3.579 20 0 FHADHM C[C@@H]1CN(C(=O)Nc2cc(-c3nn[n-]n3)cn2C(C)(C)C)c2ccccc21 ZINC000736282636 598278024 /nfs/dbraw/zinc/27/80/24/598278024.db2.gz ZABLYXZNNCGDSA-GFCCVEGCSA-N -1 3 365.441 3.579 20 0 FHADHM C[C@H](c1cccs1)N(C)C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000736203900 598279245 /nfs/dbraw/zinc/27/92/45/598279245.db2.gz PCCHUCPIWYGSQP-LLVKDONJSA-N -1 3 373.486 3.710 20 0 FHADHM C[C@H](c1cccs1)N(C)C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000736203900 598279246 /nfs/dbraw/zinc/27/92/46/598279246.db2.gz PCCHUCPIWYGSQP-LLVKDONJSA-N -1 3 373.486 3.710 20 0 FHADHM CC(C)(C)C[C@@H]1CCCN1C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000735604853 598280671 /nfs/dbraw/zinc/28/06/71/598280671.db2.gz ZVWNNGQEEKWXJS-AWEZNQCLSA-N -1 3 373.505 3.856 20 0 FHADHM CC(C)(C)C[C@@H]1CCCN1C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000735604853 598280672 /nfs/dbraw/zinc/28/06/72/598280672.db2.gz ZVWNNGQEEKWXJS-AWEZNQCLSA-N -1 3 373.505 3.856 20 0 FHADHM CN(C(=O)c1cc2ccc(F)cc2s1)c1ccc(-c2nnn[n-]2)cc1F ZINC000736750146 598281902 /nfs/dbraw/zinc/28/19/02/598281902.db2.gz UBZHRHZVBZVZLS-UHFFFAOYSA-N -1 3 371.372 3.636 20 0 FHADHM CN(C(=O)c1cc2ccc(F)cc2s1)c1ccc(-c2nn[n-]n2)cc1F ZINC000736750146 598281903 /nfs/dbraw/zinc/28/19/03/598281903.db2.gz UBZHRHZVBZVZLS-UHFFFAOYSA-N -1 3 371.372 3.636 20 0 FHADHM CC(C)N(Cc1ccccc1)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000735873223 598292101 /nfs/dbraw/zinc/29/21/01/598292101.db2.gz CUFYONBZZODALD-UHFFFAOYSA-N -1 3 370.844 3.963 20 0 FHADHM CC(C)N(Cc1ccccc1)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000735873223 598292102 /nfs/dbraw/zinc/29/21/02/598292102.db2.gz CUFYONBZZODALD-UHFFFAOYSA-N -1 3 370.844 3.963 20 0 FHADHM Cc1sc(NC(=O)Cc2c[nH]c3cc(C)ccc23)c(-c2nnn[n-]2)c1C ZINC000737372470 598295841 /nfs/dbraw/zinc/29/58/41/598295841.db2.gz YNVZWKAUGAERDO-UHFFFAOYSA-N -1 3 366.450 3.516 20 0 FHADHM Cc1sc(NC(=O)Cc2c[nH]c3cc(C)ccc23)c(-c2nn[n-]n2)c1C ZINC000737372470 598295842 /nfs/dbraw/zinc/29/58/42/598295842.db2.gz YNVZWKAUGAERDO-UHFFFAOYSA-N -1 3 366.450 3.516 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1N1CCc2c(ccc(Cl)c2Cl)C1 ZINC000737641092 598299302 /nfs/dbraw/zinc/29/93/02/598299302.db2.gz RGTRTFWQCQGIGO-UHFFFAOYSA-N -1 3 364.211 3.875 20 0 FHADHM O=C(O[C@@H](c1ccccc1)c1cccc(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000738216044 598307717 /nfs/dbraw/zinc/30/77/17/598307717.db2.gz VNMVAONIHLXARO-IBGZPJMESA-N -1 3 374.375 3.952 20 0 FHADHM O=C(O[C@@H](c1ccccc1)c1cccc(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000738216044 598307718 /nfs/dbraw/zinc/30/77/18/598307718.db2.gz VNMVAONIHLXARO-IBGZPJMESA-N -1 3 374.375 3.952 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)cc1CSCc1ccc(-n2cccn2)cc1 ZINC000737650114 598314245 /nfs/dbraw/zinc/31/42/45/598314245.db2.gz NMWAOVLESPNOHF-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CSCc1ccc(-n2cccn2)cc1 ZINC000737650114 598314247 /nfs/dbraw/zinc/31/42/47/598314247.db2.gz NMWAOVLESPNOHF-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM CCN(Cc1ccccc1)C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736558429 598316812 /nfs/dbraw/zinc/31/68/12/598316812.db2.gz JXTRTODBCJQOBH-UHFFFAOYSA-N -1 3 372.885 3.739 20 0 FHADHM CCN(Cc1ccccc1)C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736558429 598316814 /nfs/dbraw/zinc/31/68/14/598316814.db2.gz JXTRTODBCJQOBH-UHFFFAOYSA-N -1 3 372.885 3.739 20 0 FHADHM Cc1cc(F)ccc1C(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)CC(C)C ZINC000822204220 607351422 /nfs/dbraw/zinc/35/14/22/607351422.db2.gz IMSKAQNPAPIMME-UHFFFAOYSA-N -1 3 367.428 3.613 20 0 FHADHM Cc1cc(F)ccc1C(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)CC(C)C ZINC000822204220 607351424 /nfs/dbraw/zinc/35/14/24/607351424.db2.gz IMSKAQNPAPIMME-UHFFFAOYSA-N -1 3 367.428 3.613 20 0 FHADHM Cc1sc(NC(=O)c2ccccc2OC(C)C)c(-c2nnn[n-]2)c1C ZINC000737563708 598359632 /nfs/dbraw/zinc/35/96/32/598359632.db2.gz PGVJKNXLXXUFJU-UHFFFAOYSA-N -1 3 357.439 3.585 20 0 FHADHM Cc1sc(NC(=O)c2ccccc2OC(C)C)c(-c2nn[n-]n2)c1C ZINC000737563708 598359634 /nfs/dbraw/zinc/35/96/34/598359634.db2.gz PGVJKNXLXXUFJU-UHFFFAOYSA-N -1 3 357.439 3.585 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)ccc1OC(=O)C[C@@H](C)c1ccccc1F ZINC000736625544 598365547 /nfs/dbraw/zinc/36/55/47/598365547.db2.gz BIRPRGOQDVRJHP-GFCCVEGCSA-N -1 3 370.384 3.504 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)ccc1OC(=O)C[C@@H](C)c1ccccc1F ZINC000736625544 598365548 /nfs/dbraw/zinc/36/55/48/598365548.db2.gz BIRPRGOQDVRJHP-GFCCVEGCSA-N -1 3 370.384 3.504 20 0 FHADHM C[C@@H](Nc1ncc(-c2nnn[n-]2)cc1Cl)c1ccccc1OC(F)F ZINC000736135514 598387780 /nfs/dbraw/zinc/38/77/80/598387780.db2.gz AVOKPFWVGNSSIG-MRVPVSSYSA-N -1 3 366.759 3.690 20 0 FHADHM C[C@@H](Nc1ncc(-c2nn[n-]n2)cc1Cl)c1ccccc1OC(F)F ZINC000736135514 598387783 /nfs/dbraw/zinc/38/77/83/598387783.db2.gz AVOKPFWVGNSSIG-MRVPVSSYSA-N -1 3 366.759 3.690 20 0 FHADHM Clc1cccc(CNc2ncc(-c3nnn[n-]3)cc2Cl)c1Cl ZINC000737558022 598392382 /nfs/dbraw/zinc/39/23/82/598392382.db2.gz ITWUCFGKPRIIOJ-UHFFFAOYSA-N -1 3 355.616 3.834 20 0 FHADHM Clc1cccc(CNc2ncc(-c3nn[n-]n3)cc2Cl)c1Cl ZINC000737558022 598392383 /nfs/dbraw/zinc/39/23/83/598392383.db2.gz ITWUCFGKPRIIOJ-UHFFFAOYSA-N -1 3 355.616 3.834 20 0 FHADHM Cc1ccc2c(c1)[C@@H](NC(=O)Nc1ccc(-c3nnn[n-]3)c(Cl)c1)CC2 ZINC000737371752 598393231 /nfs/dbraw/zinc/39/32/31/598393231.db2.gz KRNWLFDJCXRFAZ-INIZCTEOSA-N -1 3 368.828 3.638 20 0 FHADHM Cc1ccc2c(c1)[C@@H](NC(=O)Nc1ccc(-c3nn[n-]n3)c(Cl)c1)CC2 ZINC000737371752 598393233 /nfs/dbraw/zinc/39/32/33/598393233.db2.gz KRNWLFDJCXRFAZ-INIZCTEOSA-N -1 3 368.828 3.638 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)CC1=CCCCC1 ZINC000736627877 598393787 /nfs/dbraw/zinc/39/37/87/598393787.db2.gz OSIYRACQUIXNEW-UHFFFAOYSA-N -1 3 362.817 3.715 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)CC1=CCCCC1 ZINC000736627877 598393790 /nfs/dbraw/zinc/39/37/90/598393790.db2.gz OSIYRACQUIXNEW-UHFFFAOYSA-N -1 3 362.817 3.715 20 0 FHADHM COc1ccc(-c2nc(CNc3ccc(-c4nn[n-]n4)cc3)cs2)cc1 ZINC000737055292 598415606 /nfs/dbraw/zinc/41/56/06/598415606.db2.gz COINJCMNBUTZDY-UHFFFAOYSA-N -1 3 364.434 3.611 20 0 FHADHM Clc1cccc(-c2cnc(CNc3ccc(-c4nn[n-]n4)cc3)o2)c1 ZINC000737573964 598416331 /nfs/dbraw/zinc/41/63/31/598416331.db2.gz IJDQWDZSBACXSG-UHFFFAOYSA-N -1 3 352.785 3.787 20 0 FHADHM CC(C)[C@@H](Sc1ccccc1)C(=O)OCc1ccccc1-c1nnn[n-]1 ZINC000735736764 598425571 /nfs/dbraw/zinc/42/55/71/598425571.db2.gz WEOPVULTCMPKJQ-QGZVFWFLSA-N -1 3 368.462 3.727 20 0 FHADHM CC(C)[C@@H](Sc1ccccc1)C(=O)OCc1ccccc1-c1nn[n-]n1 ZINC000735736764 598425572 /nfs/dbraw/zinc/42/55/72/598425572.db2.gz WEOPVULTCMPKJQ-QGZVFWFLSA-N -1 3 368.462 3.727 20 0 FHADHM Cc1ccc(NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)c(C)c1 ZINC000737357239 598426699 /nfs/dbraw/zinc/42/66/99/598426699.db2.gz NKQSMFMIBORRKN-UHFFFAOYSA-N -1 3 364.453 3.926 20 0 FHADHM Cc1ccc(NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)c(C)c1 ZINC000737357239 598426701 /nfs/dbraw/zinc/42/67/01/598426701.db2.gz NKQSMFMIBORRKN-UHFFFAOYSA-N -1 3 364.453 3.926 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@H]1CCC[C@@H](C)[C@@H]1C ZINC000736263473 598427997 /nfs/dbraw/zinc/42/79/97/598427997.db2.gz ROPMWUHADPQECY-VKJFTORMSA-N -1 3 370.501 3.611 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@H]1CCC[C@@H](C)[C@@H]1C ZINC000736263473 598427999 /nfs/dbraw/zinc/42/79/99/598427999.db2.gz ROPMWUHADPQECY-VKJFTORMSA-N -1 3 370.501 3.611 20 0 FHADHM CCCCN(C)c1ccc(NC(=O)Nc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736452233 598428513 /nfs/dbraw/zinc/42/85/13/598428513.db2.gz CYWFKQDNZPFXEH-UHFFFAOYSA-N -1 3 365.441 3.747 20 0 FHADHM CCCCN(C)c1ccc(NC(=O)Nc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736452233 598428514 /nfs/dbraw/zinc/42/85/14/598428514.db2.gz CYWFKQDNZPFXEH-UHFFFAOYSA-N -1 3 365.441 3.747 20 0 FHADHM Cc1cc(C)cc([C@@H](C)NC(=O)Nc2cc(-c3nnn[n-]3)ccc2C)c1 ZINC000737254084 598431595 /nfs/dbraw/zinc/43/15/95/598431595.db2.gz WHHATGILXLONEG-CQSZACIVSA-N -1 3 350.426 3.675 20 0 FHADHM Cc1cc(C)cc([C@@H](C)NC(=O)Nc2cc(-c3nn[n-]n3)ccc2C)c1 ZINC000737254084 598431596 /nfs/dbraw/zinc/43/15/96/598431596.db2.gz WHHATGILXLONEG-CQSZACIVSA-N -1 3 350.426 3.675 20 0 FHADHM O=C(OCc1ccc(-c2nnn[n-]2)cc1)c1sccc1SC(F)F ZINC000738232446 598432239 /nfs/dbraw/zinc/43/22/39/598432239.db2.gz QSGXFHKUOUNUEP-UHFFFAOYSA-N -1 3 368.390 3.600 20 0 FHADHM O=C(OCc1ccc(-c2nn[n-]n2)cc1)c1sccc1SC(F)F ZINC000738232446 598432240 /nfs/dbraw/zinc/43/22/40/598432240.db2.gz QSGXFHKUOUNUEP-UHFFFAOYSA-N -1 3 368.390 3.600 20 0 FHADHM CC(=CC(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccccc1Cl ZINC000735448849 598442191 /nfs/dbraw/zinc/44/21/91/598442191.db2.gz LOGPGALMLKHAJG-HHQWOOOKSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=CC(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccccc1Cl ZINC000735448849 598442193 /nfs/dbraw/zinc/44/21/93/598442193.db2.gz LOGPGALMLKHAJG-HHQWOOOKSA-N -1 3 367.840 3.801 20 0 FHADHM C[C@H]1C[C@@H](CC(=O)N(C)Cc2ccc(-c3nnn[n-]3)cc2)CC(C)(C)C1 ZINC000736227966 598442460 /nfs/dbraw/zinc/44/24/60/598442460.db2.gz MOLCXWHZMLAVOO-HOCLYGCPSA-N -1 3 355.486 3.678 20 0 FHADHM C[C@H]1C[C@@H](CC(=O)N(C)Cc2ccc(-c3nn[n-]n3)cc2)CC(C)(C)C1 ZINC000736227966 598442462 /nfs/dbraw/zinc/44/24/62/598442462.db2.gz MOLCXWHZMLAVOO-HOCLYGCPSA-N -1 3 355.486 3.678 20 0 FHADHM CC[C@@H](C)Sc1ccc(NC(=O)c2ccc(-c3nnn[n-]3)cn2)c(C)c1 ZINC000736327540 598449470 /nfs/dbraw/zinc/44/94/70/598449470.db2.gz MFVOCASILIVMRJ-GFCCVEGCSA-N -1 3 368.466 3.713 20 0 FHADHM CC[C@@H](C)Sc1ccc(NC(=O)c2ccc(-c3nn[n-]n3)cn2)c(C)c1 ZINC000736327540 598449471 /nfs/dbraw/zinc/44/94/71/598449471.db2.gz MFVOCASILIVMRJ-GFCCVEGCSA-N -1 3 368.466 3.713 20 0 FHADHM CC(C)(NC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1ccc(Cl)cc1 ZINC000735671736 598449888 /nfs/dbraw/zinc/44/98/88/598449888.db2.gz DODSFCSFRRZRRW-GHXNOFRVSA-N -1 3 367.840 3.585 20 0 FHADHM CC(C)(NC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1ccc(Cl)cc1 ZINC000735671736 598449889 /nfs/dbraw/zinc/44/98/89/598449889.db2.gz DODSFCSFRRZRRW-GHXNOFRVSA-N -1 3 367.840 3.585 20 0 FHADHM C[C@H](Nc1nc(-c2cccc(Cl)c2)no1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736137049 598466873 /nfs/dbraw/zinc/46/68/73/598466873.db2.gz JYMVUXCBIUFJHI-JTQLQIEISA-N -1 3 367.800 3.743 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)Nc1cccc(SC(F)F)c1 ZINC000738150145 598468792 /nfs/dbraw/zinc/46/87/92/598468792.db2.gz ADZZSPTWIFCDRC-UHFFFAOYSA-N -1 3 362.365 3.825 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)Nc1cccc(SC(F)F)c1 ZINC000738150145 598468793 /nfs/dbraw/zinc/46/87/93/598468793.db2.gz ADZZSPTWIFCDRC-UHFFFAOYSA-N -1 3 362.365 3.825 20 0 FHADHM O=C(OCc1cccc(-c2nnn[n-]2)c1)[C@H]1C[C@@H]1c1cccc2ccccc21 ZINC000738232603 598475732 /nfs/dbraw/zinc/47/57/32/598475732.db2.gz MNMAQYOQWSWQRJ-UXHICEINSA-N -1 3 370.412 3.867 20 0 FHADHM O=C(OCc1cccc(-c2nn[n-]n2)c1)[C@H]1C[C@@H]1c1cccc2ccccc21 ZINC000738232603 598475734 /nfs/dbraw/zinc/47/57/34/598475734.db2.gz MNMAQYOQWSWQRJ-UXHICEINSA-N -1 3 370.412 3.867 20 0 FHADHM O=C(OCc1ccc(-c2nnn[n-]2)cc1)[C@H]1C[C@@H]1c1cccc2ccccc21 ZINC000738236217 598476150 /nfs/dbraw/zinc/47/61/50/598476150.db2.gz FIRVEZKPXVUDHQ-UXHICEINSA-N -1 3 370.412 3.867 20 0 FHADHM O=C(OCc1ccc(-c2nn[n-]n2)cc1)[C@H]1C[C@@H]1c1cccc2ccccc21 ZINC000738236217 598476151 /nfs/dbraw/zinc/47/61/51/598476151.db2.gz FIRVEZKPXVUDHQ-UXHICEINSA-N -1 3 370.412 3.867 20 0 FHADHM CC[C@@](C)(NC(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000736312898 598483791 /nfs/dbraw/zinc/48/37/91/598483791.db2.gz DEZRLCDMNULMIS-JLTOFOAXSA-N -1 3 364.453 3.552 20 0 FHADHM CC[C@@](C)(NC(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000736312898 598483792 /nfs/dbraw/zinc/48/37/92/598483792.db2.gz DEZRLCDMNULMIS-JLTOFOAXSA-N -1 3 364.453 3.552 20 0 FHADHM Cc1nc(C(C)C)sc1C(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000737468338 598485297 /nfs/dbraw/zinc/48/52/97/598485297.db2.gz WNDJVNOQYZRURO-NSHDSACASA-N -1 3 357.439 3.673 20 0 FHADHM Cc1nc(C(C)C)sc1C(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000737468338 598485299 /nfs/dbraw/zinc/48/52/99/598485299.db2.gz WNDJVNOQYZRURO-NSHDSACASA-N -1 3 357.439 3.673 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccc(Cl)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000736147982 598490151 /nfs/dbraw/zinc/49/01/51/598490151.db2.gz BKXJFWVWASSLHA-PMDBQALLSA-N -1 3 354.797 3.838 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccc(Cl)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000736147982 598490153 /nfs/dbraw/zinc/49/01/53/598490153.db2.gz BKXJFWVWASSLHA-PMDBQALLSA-N -1 3 354.797 3.838 20 0 FHADHM Cc1sc(NC(=O)C[C@H]2CCCc3ccccc32)c(-c2nnn[n-]2)c1C ZINC000737565269 598493842 /nfs/dbraw/zinc/49/38/42/598493842.db2.gz XWOCXYBSXOGOHB-CQSZACIVSA-N -1 3 367.478 3.994 20 0 FHADHM Cc1sc(NC(=O)C[C@H]2CCCc3ccccc32)c(-c2nn[n-]n2)c1C ZINC000737565269 598493844 /nfs/dbraw/zinc/49/38/44/598493844.db2.gz XWOCXYBSXOGOHB-CQSZACIVSA-N -1 3 367.478 3.994 20 0 FHADHM Clc1cc(N2CCc3[nH]c4ccccc4c3C2)ccc1-c1nnn[n-]1 ZINC000737564829 598508160 /nfs/dbraw/zinc/50/81/60/598508160.db2.gz KGZICQCETOYSJZ-UHFFFAOYSA-N -1 3 350.813 3.564 20 0 FHADHM Clc1cc(N2CCc3[nH]c4ccccc4c3C2)ccc1-c1nn[n-]n1 ZINC000737564829 598508161 /nfs/dbraw/zinc/50/81/61/598508161.db2.gz KGZICQCETOYSJZ-UHFFFAOYSA-N -1 3 350.813 3.564 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)[C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000590030796 598513294 /nfs/dbraw/zinc/51/32/94/598513294.db2.gz GLEGLUSXJXMQFQ-CHWSQXEVSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)[C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000590030796 598513296 /nfs/dbraw/zinc/51/32/96/598513296.db2.gz GLEGLUSXJXMQFQ-CHWSQXEVSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(C[C@H]1CCCc2ccccc21)OCc1ccc(-c2nnn[n-]2)cc1F ZINC000737822710 598515029 /nfs/dbraw/zinc/51/50/29/598515029.db2.gz OGFZMHGWOYYAMC-CQSZACIVSA-N -1 3 366.396 3.559 20 0 FHADHM O=C(C[C@H]1CCCc2ccccc21)OCc1ccc(-c2nn[n-]n2)cc1F ZINC000737822710 598515031 /nfs/dbraw/zinc/51/50/31/598515031.db2.gz OGFZMHGWOYYAMC-CQSZACIVSA-N -1 3 366.396 3.559 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H]2CCCc3ccccc32)c1-c1nnn[n-]1 ZINC000736669229 598516578 /nfs/dbraw/zinc/51/65/78/598516578.db2.gz ABTBZMRYMBWPKW-HNNXBMFYSA-N -1 3 367.478 3.858 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H]2CCCc3ccccc32)c1-c1nn[n-]n1 ZINC000736669229 598516580 /nfs/dbraw/zinc/51/65/80/598516580.db2.gz ABTBZMRYMBWPKW-HNNXBMFYSA-N -1 3 367.478 3.858 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccc(OC(C)C)cc2)c1-c1nnn[n-]1 ZINC000736675101 598518650 /nfs/dbraw/zinc/51/86/50/598518650.db2.gz FDKKHXLBVRCQIR-UHFFFAOYSA-N -1 3 371.466 3.839 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccc(OC(C)C)cc2)c1-c1nn[n-]n1 ZINC000736675101 598518652 /nfs/dbraw/zinc/51/86/52/598518652.db2.gz FDKKHXLBVRCQIR-UHFFFAOYSA-N -1 3 371.466 3.839 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccc(CSC)cc2)c1-c1nnn[n-]1 ZINC000736675717 598518793 /nfs/dbraw/zinc/51/87/93/598518793.db2.gz KWNQNRHQJFMTNJ-UHFFFAOYSA-N -1 3 373.507 3.914 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccc(CSC)cc2)c1-c1nn[n-]n1 ZINC000736675717 598518795 /nfs/dbraw/zinc/51/87/95/598518795.db2.gz KWNQNRHQJFMTNJ-UHFFFAOYSA-N -1 3 373.507 3.914 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)[C@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000108710223 598532413 /nfs/dbraw/zinc/53/24/13/598532413.db2.gz MJFWMUZGRPGURZ-MOPGFXCFSA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)[C@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000108710223 598532415 /nfs/dbraw/zinc/53/24/15/598532415.db2.gz MJFWMUZGRPGURZ-MOPGFXCFSA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1sccc1-c1nnn[n-]1)[C@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000738206761 598533587 /nfs/dbraw/zinc/53/35/87/598533587.db2.gz GWMDKVFJTKNRDB-HOTGVXAUSA-N -1 3 361.430 3.824 20 0 FHADHM O=C(Nc1sccc1-c1nn[n-]n1)[C@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000738206761 598533589 /nfs/dbraw/zinc/53/35/89/598533589.db2.gz GWMDKVFJTKNRDB-HOTGVXAUSA-N -1 3 361.430 3.824 20 0 FHADHM O=C(Nc1sccc1-c1nnn[n-]1)c1cccc(OC2CCCC2)c1 ZINC000738206646 598533903 /nfs/dbraw/zinc/53/39/03/598533903.db2.gz FTZBEGUHDXQDTD-UHFFFAOYSA-N -1 3 355.423 3.502 20 0 FHADHM O=C(Nc1sccc1-c1nn[n-]n1)c1cccc(OC2CCCC2)c1 ZINC000738206646 598533905 /nfs/dbraw/zinc/53/39/05/598533905.db2.gz FTZBEGUHDXQDTD-UHFFFAOYSA-N -1 3 355.423 3.502 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)c1ccc(SC(F)(F)F)cc1 ZINC000068255390 598534150 /nfs/dbraw/zinc/53/41/50/598534150.db2.gz NDCQZOVXGVZMJM-UHFFFAOYSA-N -1 3 365.340 3.731 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)c1ccc(SC(F)(F)F)cc1 ZINC000068255390 598534151 /nfs/dbraw/zinc/53/41/51/598534151.db2.gz NDCQZOVXGVZMJM-UHFFFAOYSA-N -1 3 365.340 3.731 20 0 FHADHM CC(C)=CC(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)cc1C ZINC000735680165 598541452 /nfs/dbraw/zinc/54/14/52/598541452.db2.gz SSBLJUSLCXVMTR-UHFFFAOYSA-N -1 3 363.421 3.659 20 0 FHADHM CC(C)=CC(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)cc1C ZINC000735680165 598541454 /nfs/dbraw/zinc/54/14/54/598541454.db2.gz SSBLJUSLCXVMTR-UHFFFAOYSA-N -1 3 363.421 3.659 20 0 FHADHM O=C(OCc1cccc(-c2nnn[n-]2)c1)[C@@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000738233163 598544558 /nfs/dbraw/zinc/54/45/58/598544558.db2.gz QNKCXOKOOLAHIC-VQTJNVASSA-N -1 3 370.412 3.867 20 0 FHADHM O=C(OCc1cccc(-c2nn[n-]n2)c1)[C@@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000738233163 598544560 /nfs/dbraw/zinc/54/45/60/598544560.db2.gz QNKCXOKOOLAHIC-VQTJNVASSA-N -1 3 370.412 3.867 20 0 FHADHM O=C(OCc1cccc(-c2nnn[n-]2)c1)[C@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000738233159 598544675 /nfs/dbraw/zinc/54/46/75/598544675.db2.gz QNKCXOKOOLAHIC-UXHICEINSA-N -1 3 370.412 3.867 20 0 FHADHM O=C(OCc1cccc(-c2nn[n-]n2)c1)[C@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000738233159 598544677 /nfs/dbraw/zinc/54/46/77/598544677.db2.gz QNKCXOKOOLAHIC-UXHICEINSA-N -1 3 370.412 3.867 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCC2)c1ccccc1F ZINC000735570958 598551495 /nfs/dbraw/zinc/55/14/95/598551495.db2.gz QMMNJQLJGMTATF-SNVBAGLBSA-N -1 3 371.441 3.688 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCC2)c1ccccc1F ZINC000735570958 598551497 /nfs/dbraw/zinc/55/14/97/598551497.db2.gz QMMNJQLJGMTATF-SNVBAGLBSA-N -1 3 371.441 3.688 20 0 FHADHM CCCCNC(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736461742 598565349 /nfs/dbraw/zinc/56/53/49/598565349.db2.gz SXPZQXDLIOXANN-UHFFFAOYSA-N -1 3 352.398 3.581 20 0 FHADHM CCCCNC(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736461742 598565350 /nfs/dbraw/zinc/56/53/50/598565350.db2.gz SXPZQXDLIOXANN-UHFFFAOYSA-N -1 3 352.398 3.581 20 0 FHADHM FC(F)(F)c1cc(N[C@H]2CCOc3ccccc32)ccc1-c1nnn[n-]1 ZINC000737633755 598572199 /nfs/dbraw/zinc/57/21/99/598572199.db2.gz VVFMQBOGPWWBRP-AWEZNQCLSA-N -1 3 361.327 3.821 20 0 FHADHM FC(F)(F)c1cc(N[C@H]2CCOc3ccccc32)ccc1-c1nn[n-]n1 ZINC000737633755 598572200 /nfs/dbraw/zinc/57/22/00/598572200.db2.gz VVFMQBOGPWWBRP-AWEZNQCLSA-N -1 3 361.327 3.821 20 0 FHADHM C[C@H](Cc1ccsc1)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000736066521 598575806 /nfs/dbraw/zinc/57/58/06/598575806.db2.gz NWJBGLKAKNMVIO-SECBINFHSA-N -1 3 353.373 3.990 20 0 FHADHM C[C@H](Cc1ccsc1)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000736066521 598575807 /nfs/dbraw/zinc/57/58/07/598575807.db2.gz NWJBGLKAKNMVIO-SECBINFHSA-N -1 3 353.373 3.990 20 0 FHADHM Fc1ccccc1-c1nc(COc2ccccc2-c2nnn[n-]2)cs1 ZINC000737663107 598580867 /nfs/dbraw/zinc/58/08/67/598580867.db2.gz GKEMTOYFEAWFPS-UHFFFAOYSA-N -1 3 353.382 3.708 20 0 FHADHM Fc1ccccc1-c1nc(COc2ccccc2-c2nn[n-]n2)cs1 ZINC000737663107 598580869 /nfs/dbraw/zinc/58/08/69/598580869.db2.gz GKEMTOYFEAWFPS-UHFFFAOYSA-N -1 3 353.382 3.708 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N(Cc1ccco1)C1CCCC1 ZINC000737291390 598599383 /nfs/dbraw/zinc/59/93/83/598599383.db2.gz KFIGGCZPZMBKOQ-UHFFFAOYSA-N -1 3 366.425 3.745 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N(Cc1ccco1)C1CCCC1 ZINC000737291390 598599384 /nfs/dbraw/zinc/59/93/84/598599384.db2.gz KFIGGCZPZMBKOQ-UHFFFAOYSA-N -1 3 366.425 3.745 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)c1cc(C2CC2)nc2ccccc21 ZINC000738165426 598599734 /nfs/dbraw/zinc/59/97/34/598599734.db2.gz DJLRYLKFWLCPED-UHFFFAOYSA-N -1 3 374.379 3.684 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)c1cc(C2CC2)nc2ccccc21 ZINC000738165426 598599736 /nfs/dbraw/zinc/59/97/36/598599736.db2.gz DJLRYLKFWLCPED-UHFFFAOYSA-N -1 3 374.379 3.684 20 0 FHADHM CCC[C@H](NC(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1)C1CCCCC1 ZINC000736431992 598607405 /nfs/dbraw/zinc/60/74/05/598607405.db2.gz ZVBKHKIPQNCPDD-KDOFPFPSSA-N -1 3 370.501 3.976 20 0 FHADHM CCC[C@H](NC(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1)C1CCCCC1 ZINC000736431992 598607407 /nfs/dbraw/zinc/60/74/07/598607407.db2.gz ZVBKHKIPQNCPDD-KDOFPFPSSA-N -1 3 370.501 3.976 20 0 FHADHM C[C@@H](Oc1ccccc1-c1nnn[n-]1)c1nc(-c2cccc(Cl)c2)no1 ZINC000736186863 598608522 /nfs/dbraw/zinc/60/85/22/598608522.db2.gz FDASLOSJKOBECQ-SNVBAGLBSA-N -1 3 368.784 3.710 20 0 FHADHM C[C@@H](Oc1ccccc1-c1nn[n-]n1)c1nc(-c2cccc(Cl)c2)no1 ZINC000736186863 598608524 /nfs/dbraw/zinc/60/85/24/598608524.db2.gz FDASLOSJKOBECQ-SNVBAGLBSA-N -1 3 368.784 3.710 20 0 FHADHM Cc1ccccc1CC(C)(C)NC(=O)Nc1cc(-c2nnn[n-]2)ccc1C ZINC000737420711 598623687 /nfs/dbraw/zinc/62/36/87/598623687.db2.gz GYSAKIMXKWCYFO-UHFFFAOYSA-N -1 3 364.453 3.626 20 0 FHADHM Cc1ccccc1CC(C)(C)NC(=O)Nc1cc(-c2nn[n-]n2)ccc1C ZINC000737420711 598623688 /nfs/dbraw/zinc/62/36/88/598623688.db2.gz GYSAKIMXKWCYFO-UHFFFAOYSA-N -1 3 364.453 3.626 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)NC1CC(c2ccccc2)C1 ZINC000738151391 598623726 /nfs/dbraw/zinc/62/37/26/598623726.db2.gz HPPMWWMDWGFJPS-UHFFFAOYSA-N -1 3 368.828 3.588 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)NC1CC(c2ccccc2)C1 ZINC000738151391 598623728 /nfs/dbraw/zinc/62/37/28/598623728.db2.gz HPPMWWMDWGFJPS-UHFFFAOYSA-N -1 3 368.828 3.588 20 0 FHADHM CC(C)N(Cc1cccs1)C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000735874553 598627457 /nfs/dbraw/zinc/62/74/57/598627457.db2.gz FYDXPJUEOZXGCS-UHFFFAOYSA-N -1 3 360.418 3.510 20 0 FHADHM CC(C)N(Cc1cccs1)C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000735874553 598627458 /nfs/dbraw/zinc/62/74/58/598627458.db2.gz FYDXPJUEOZXGCS-UHFFFAOYSA-N -1 3 360.418 3.510 20 0 FHADHM CC(C)(C)[C@H](NC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccccc1 ZINC000735590099 598628707 /nfs/dbraw/zinc/62/87/07/598628707.db2.gz UJBQXLRSPIJZEE-MRXNPFEDSA-N -1 3 368.416 3.915 20 0 FHADHM CC(C)(C)[C@H](NC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccccc1 ZINC000735590099 598628709 /nfs/dbraw/zinc/62/87/09/598628709.db2.gz UJBQXLRSPIJZEE-MRXNPFEDSA-N -1 3 368.416 3.915 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)cc1C ZINC000737321274 598629163 /nfs/dbraw/zinc/62/91/63/598629163.db2.gz SHSYIZHLPAFXEL-LBPRGKRZSA-N -1 3 354.389 3.505 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)cc1C ZINC000737321274 598629164 /nfs/dbraw/zinc/62/91/64/598629164.db2.gz SHSYIZHLPAFXEL-LBPRGKRZSA-N -1 3 354.389 3.505 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)c(C)c1 ZINC000737322603 598629541 /nfs/dbraw/zinc/62/95/41/598629541.db2.gz ZQBUZEOYNNSDPS-LBPRGKRZSA-N -1 3 354.389 3.505 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)c(C)c1 ZINC000737322603 598629542 /nfs/dbraw/zinc/62/95/42/598629542.db2.gz ZQBUZEOYNNSDPS-LBPRGKRZSA-N -1 3 354.389 3.505 20 0 FHADHM Cc1nc(-c2ccc3ccccc3c2)n(Cc2cccc(-c3nnn[n-]3)c2)n1 ZINC000737463477 598643671 /nfs/dbraw/zinc/64/36/71/598643671.db2.gz UNYYKGGYWYWPMV-UHFFFAOYSA-N -1 3 367.416 3.635 20 0 FHADHM Cc1nc(-c2ccc3ccccc3c2)n(Cc2cccc(-c3nn[n-]n3)c2)n1 ZINC000737463477 598643672 /nfs/dbraw/zinc/64/36/72/598643672.db2.gz UNYYKGGYWYWPMV-UHFFFAOYSA-N -1 3 367.416 3.635 20 0 FHADHM Cc1ccc(NC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)cc1C ZINC000737356516 598643847 /nfs/dbraw/zinc/64/38/47/598643847.db2.gz QANICXMZVAQSDY-UHFFFAOYSA-N -1 3 365.437 3.671 20 0 FHADHM Cc1ccc(NC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)cc1C ZINC000737356516 598643849 /nfs/dbraw/zinc/64/38/49/598643849.db2.gz QANICXMZVAQSDY-UHFFFAOYSA-N -1 3 365.437 3.671 20 0 FHADHM O=C(CCCCOc1cccc(-c2nnn[n-]2)c1)Oc1ccccc1Cl ZINC000737841014 598645558 /nfs/dbraw/zinc/64/55/58/598645558.db2.gz IJDLXMNXLRAPIG-UHFFFAOYSA-N -1 3 372.812 3.675 20 0 FHADHM O=C(CCCCOc1cccc(-c2nn[n-]n2)c1)Oc1ccccc1Cl ZINC000737841014 598645559 /nfs/dbraw/zinc/64/55/59/598645559.db2.gz IJDLXMNXLRAPIG-UHFFFAOYSA-N -1 3 372.812 3.675 20 0 FHADHM CCCN(CCC)C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736473184 598650365 /nfs/dbraw/zinc/65/03/65/598650365.db2.gz JMJYRYVKAKBOMS-UHFFFAOYSA-N -1 3 365.437 3.921 20 0 FHADHM CCCN(CCC)C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736473184 598650367 /nfs/dbraw/zinc/65/03/67/598650367.db2.gz JMJYRYVKAKBOMS-UHFFFAOYSA-N -1 3 365.437 3.921 20 0 FHADHM Cc1ccc(C(C)(C)C(=O)Nc2ccc(Cl)c(-c3nnn[n-]3)c2)cc1 ZINC000737317454 598650693 /nfs/dbraw/zinc/65/06/93/598650693.db2.gz LKQVHDYOPYPFDT-UHFFFAOYSA-N -1 3 355.829 3.745 20 0 FHADHM Cc1ccc(C(C)(C)C(=O)Nc2ccc(Cl)c(-c3nn[n-]n3)c2)cc1 ZINC000737317454 598650694 /nfs/dbraw/zinc/65/06/94/598650694.db2.gz LKQVHDYOPYPFDT-UHFFFAOYSA-N -1 3 355.829 3.745 20 0 FHADHM CC[C@@H](Sc1ccccc1)C(=O)Nc1cc(-c2nnn[n-]2)ccc1C ZINC000736391192 598656354 /nfs/dbraw/zinc/65/63/54/598656354.db2.gz LEQOJXSXLHUAPU-MRXNPFEDSA-N -1 3 353.451 3.685 20 0 FHADHM CC[C@@H](Sc1ccccc1)C(=O)Nc1cc(-c2nn[n-]n2)ccc1C ZINC000736391192 598656356 /nfs/dbraw/zinc/65/63/56/598656356.db2.gz LEQOJXSXLHUAPU-MRXNPFEDSA-N -1 3 353.451 3.685 20 0 FHADHM CC(C)CC[C@H]1CCC[C@@H]1NC(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000735796951 598657812 /nfs/dbraw/zinc/65/78/12/598657812.db2.gz KSKFAIRFKQLAFE-PBHICJAKSA-N -1 3 373.526 3.680 20 0 FHADHM CC(C)CC[C@H]1CCC[C@@H]1NC(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000735796951 598657814 /nfs/dbraw/zinc/65/78/14/598657814.db2.gz KSKFAIRFKQLAFE-PBHICJAKSA-N -1 3 373.526 3.680 20 0 FHADHM Fc1ccc(N2CC[C@H](CNc3ccc(-c4nnn[n-]4)c(Cl)c3)C2)cc1 ZINC000737660191 598658128 /nfs/dbraw/zinc/65/81/28/598658128.db2.gz ORUQMJAUUJCXJX-GFCCVEGCSA-N -1 3 372.835 3.598 20 0 FHADHM Fc1ccc(N2CC[C@H](CNc3ccc(-c4nn[n-]n4)c(Cl)c3)C2)cc1 ZINC000737660191 598658130 /nfs/dbraw/zinc/65/81/30/598658130.db2.gz ORUQMJAUUJCXJX-GFCCVEGCSA-N -1 3 372.835 3.598 20 0 FHADHM Cc1ccc(NCc2ccccc2-c2nnn[n-]2)cc1NC(=O)C(C)(C)C ZINC000737362946 598700622 /nfs/dbraw/zinc/70/06/22/598700622.db2.gz ZGVKKNLUYKWTMN-UHFFFAOYSA-N -1 3 364.453 3.772 20 0 FHADHM Cc1ccc(NCc2ccccc2-c2nn[n-]n2)cc1NC(=O)C(C)(C)C ZINC000737362946 598700624 /nfs/dbraw/zinc/70/06/24/598700624.db2.gz ZGVKKNLUYKWTMN-UHFFFAOYSA-N -1 3 364.453 3.772 20 0 FHADHM CC(C)CN(Cc1cc2ccccc2[nH]c1=O)c1ccc(-c2nn[n-]n2)cc1 ZINC000735830592 598701216 /nfs/dbraw/zinc/70/12/16/598701216.db2.gz ZXQIRZCODJZZHU-UHFFFAOYSA-N -1 3 374.448 3.783 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nnn[n-]1)c1cc2cc(F)ccc2s1 ZINC000738236322 598704121 /nfs/dbraw/zinc/70/41/21/598704121.db2.gz UHKXVBPMTWKWPO-UHFFFAOYSA-N -1 3 372.356 3.717 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nn[n-]n1)c1cc2cc(F)ccc2s1 ZINC000738236322 598704122 /nfs/dbraw/zinc/70/41/22/598704122.db2.gz UHKXVBPMTWKWPO-UHFFFAOYSA-N -1 3 372.356 3.717 20 0 FHADHM CC(C)[C@@H](CC(=O)OCc1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000735706512 598712000 /nfs/dbraw/zinc/71/20/00/598712000.db2.gz CJFKZDGRLFSCHO-GOSISDBHSA-N -1 3 350.422 3.740 20 0 FHADHM CC(C)[C@@H](CC(=O)OCc1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000735706512 598712002 /nfs/dbraw/zinc/71/20/02/598712002.db2.gz CJFKZDGRLFSCHO-GOSISDBHSA-N -1 3 350.422 3.740 20 0 FHADHM CC(C)[C@@H](CC(=O)OCc1ccc(-c2nnn[n-]2)cc1F)c1ccccc1 ZINC000735711984 598712203 /nfs/dbraw/zinc/71/22/03/598712203.db2.gz ZOWVQDFJOSZYDM-QGZVFWFLSA-N -1 3 368.412 3.879 20 0 FHADHM CC(C)[C@@H](CC(=O)OCc1ccc(-c2nn[n-]n2)cc1F)c1ccccc1 ZINC000735711984 598712205 /nfs/dbraw/zinc/71/22/05/598712205.db2.gz ZOWVQDFJOSZYDM-QGZVFWFLSA-N -1 3 368.412 3.879 20 0 FHADHM O=C(OC/C=C\Cl)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000738223474 598712659 /nfs/dbraw/zinc/71/26/59/598712659.db2.gz YOJXEWWQTWJHSL-MBXJOHMKSA-N -1 3 356.769 3.568 20 0 FHADHM O=C(OC/C=C\Cl)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000738223474 598712661 /nfs/dbraw/zinc/71/26/61/598712661.db2.gz YOJXEWWQTWJHSL-MBXJOHMKSA-N -1 3 356.769 3.568 20 0 FHADHM c1cn(Cc2cccc3ccccc32)nc1-c1ccc(-c2nnn[n-]2)cc1 ZINC000738431991 598723834 /nfs/dbraw/zinc/72/38/34/598723834.db2.gz AXYRBYSUBJXQIK-UHFFFAOYSA-N -1 3 352.401 3.932 20 0 FHADHM c1cn(Cc2cccc3ccccc32)nc1-c1ccc(-c2nn[n-]n2)cc1 ZINC000738431991 598723835 /nfs/dbraw/zinc/72/38/35/598723835.db2.gz AXYRBYSUBJXQIK-UHFFFAOYSA-N -1 3 352.401 3.932 20 0 FHADHM O=C(C[C@H]1CCc2ccccc2C1)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000737821016 598742380 /nfs/dbraw/zinc/74/23/80/598742380.db2.gz UIEHDNKTTAPUCE-LBPRGKRZSA-N -1 3 367.840 3.654 20 0 FHADHM O=C(C[C@H]1CCc2ccccc2C1)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000737821016 598742381 /nfs/dbraw/zinc/74/23/81/598742381.db2.gz UIEHDNKTTAPUCE-LBPRGKRZSA-N -1 3 367.840 3.654 20 0 FHADHM C[C@H](O)c1ccc(CNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)cc1 ZINC000736151156 598745669 /nfs/dbraw/zinc/74/56/69/598745669.db2.gz LCMLVZGEOQZTPX-JTQLQIEISA-N -1 3 363.343 3.551 20 0 FHADHM C[C@H](O)c1ccc(CNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)cc1 ZINC000736151156 598745670 /nfs/dbraw/zinc/74/56/70/598745670.db2.gz LCMLVZGEOQZTPX-JTQLQIEISA-N -1 3 363.343 3.551 20 0 FHADHM CC(C)(C)CN(Cc1ccccc1)C(=O)c1sccc1-c1nnn[n-]1 ZINC000735619058 598746368 /nfs/dbraw/zinc/74/63/68/598746368.db2.gz RTEAWJCWMPSCPT-UHFFFAOYSA-N -1 3 355.467 3.617 20 0 FHADHM CC(C)(C)CN(Cc1ccccc1)C(=O)c1sccc1-c1nn[n-]n1 ZINC000735619058 598746369 /nfs/dbraw/zinc/74/63/69/598746369.db2.gz RTEAWJCWMPSCPT-UHFFFAOYSA-N -1 3 355.467 3.617 20 0 FHADHM CC(NC(=O)c1ccc(-c2nnn[n-]2)cc1)(c1ccccc1)c1ccccc1 ZINC000736119219 598748485 /nfs/dbraw/zinc/74/84/85/598748485.db2.gz MSQJQOUQOIEHBL-UHFFFAOYSA-N -1 3 369.428 3.560 20 0 FHADHM CC(NC(=O)c1ccc(-c2nn[n-]n2)cc1)(c1ccccc1)c1ccccc1 ZINC000736119219 598748487 /nfs/dbraw/zinc/74/84/87/598748487.db2.gz MSQJQOUQOIEHBL-UHFFFAOYSA-N -1 3 369.428 3.560 20 0 FHADHM COCCSc1ccc([C@@H](C)Nc2cccc(F)c2-c2nnn[n-]2)cc1 ZINC000737013460 598755525 /nfs/dbraw/zinc/75/55/25/598755525.db2.gz IQIMCCAFPBUJIR-GFCCVEGCSA-N -1 3 373.457 3.917 20 0 FHADHM COCCSc1ccc([C@@H](C)Nc2cccc(F)c2-c2nn[n-]n2)cc1 ZINC000737013460 598755527 /nfs/dbraw/zinc/75/55/27/598755527.db2.gz IQIMCCAFPBUJIR-GFCCVEGCSA-N -1 3 373.457 3.917 20 0 FHADHM COCCSc1ccc([C@H](C)Nc2cccc(F)c2-c2nnn[n-]2)cc1 ZINC000737013463 598755793 /nfs/dbraw/zinc/75/57/93/598755793.db2.gz IQIMCCAFPBUJIR-LBPRGKRZSA-N -1 3 373.457 3.917 20 0 FHADHM COCCSc1ccc([C@H](C)Nc2cccc(F)c2-c2nn[n-]n2)cc1 ZINC000737013463 598755794 /nfs/dbraw/zinc/75/57/94/598755794.db2.gz IQIMCCAFPBUJIR-LBPRGKRZSA-N -1 3 373.457 3.917 20 0 FHADHM Cc1ccccc1[C@H](CC(C)C)NC(=O)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000737424039 598764614 /nfs/dbraw/zinc/76/46/14/598764614.db2.gz UHRJMTJCOZLPNL-IBGZPJMESA-N -1 3 363.465 3.621 20 0 FHADHM Cc1ccccc1[C@H](CC(C)C)NC(=O)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000737424039 598764615 /nfs/dbraw/zinc/76/46/15/598764615.db2.gz UHRJMTJCOZLPNL-IBGZPJMESA-N -1 3 363.465 3.621 20 0 FHADHM Fc1cc(F)c2ncc(-c3nnn[n-]3)c(NCc3cccc(Cl)c3)c2c1 ZINC000737649247 598769333 /nfs/dbraw/zinc/76/93/33/598769333.db2.gz DWBOEPBUVIASGO-UHFFFAOYSA-N -1 3 372.766 3.959 20 0 FHADHM Fc1cc(F)c2ncc(-c3nn[n-]n3)c(NCc3cccc(Cl)c3)c2c1 ZINC000737649247 598769335 /nfs/dbraw/zinc/76/93/35/598769335.db2.gz DWBOEPBUVIASGO-UHFFFAOYSA-N -1 3 372.766 3.959 20 0 FHADHM CC(C)(C(=O)OCc1ccc(-c2nnn[n-]2)cc1)c1ccccc1Cl ZINC000735582663 598778414 /nfs/dbraw/zinc/77/84/14/598778414.db2.gz MZJVDFVONMYAAZ-UHFFFAOYSA-N -1 3 356.813 3.541 20 0 FHADHM CC(C)(C(=O)OCc1ccc(-c2nn[n-]n2)cc1)c1ccccc1Cl ZINC000735582663 598778415 /nfs/dbraw/zinc/77/84/15/598778415.db2.gz MZJVDFVONMYAAZ-UHFFFAOYSA-N -1 3 356.813 3.541 20 0 FHADHM C[C@H](OC(=O)c1cnc(-c2ccco2)s1)c1cccc(-c2nnn[n-]2)c1 ZINC000736164444 598786018 /nfs/dbraw/zinc/78/60/18/598786018.db2.gz WNGSJUCBKWPBCI-JTQLQIEISA-N -1 3 367.390 3.501 20 0 FHADHM C[C@H](OC(=O)c1cnc(-c2ccco2)s1)c1cccc(-c2nn[n-]n2)c1 ZINC000736164444 598786019 /nfs/dbraw/zinc/78/60/19/598786019.db2.gz WNGSJUCBKWPBCI-JTQLQIEISA-N -1 3 367.390 3.501 20 0 FHADHM Cc1ccc2[nH]c3c(c2c1)CN(c1ccc(Cl)cc1-c1nnn[n-]1)CC3 ZINC000737374261 598793763 /nfs/dbraw/zinc/79/37/63/598793763.db2.gz ZZNOTVDZVKBZTM-UHFFFAOYSA-N -1 3 364.840 3.873 20 0 FHADHM Cc1ccc2[nH]c3c(c2c1)CN(c1ccc(Cl)cc1-c1nn[n-]n1)CC3 ZINC000737374261 598793764 /nfs/dbraw/zinc/79/37/64/598793764.db2.gz ZZNOTVDZVKBZTM-UHFFFAOYSA-N -1 3 364.840 3.873 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)N1CCC[C@@H]1c1ccc(F)c(F)c1 ZINC000738178157 598799458 /nfs/dbraw/zinc/79/94/58/598799458.db2.gz GDGXHKFBNSWSQN-MRXNPFEDSA-N -1 3 370.363 3.514 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)N1CCC[C@@H]1c1ccc(F)c(F)c1 ZINC000738178157 598799459 /nfs/dbraw/zinc/79/94/59/598799459.db2.gz GDGXHKFBNSWSQN-MRXNPFEDSA-N -1 3 370.363 3.514 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)Nc1cccc2[nH]ccc21 ZINC000735661478 598812806 /nfs/dbraw/zinc/81/28/06/598812806.db2.gz LMLKLSUIAVAEQR-UHFFFAOYSA-N -1 3 364.413 3.549 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)Nc1cccc2[nH]ccc21 ZINC000735661478 598812807 /nfs/dbraw/zinc/81/28/07/598812807.db2.gz LMLKLSUIAVAEQR-UHFFFAOYSA-N -1 3 364.413 3.549 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)N(C1CC1)[C@H]1CCCc2ccccc21 ZINC000738178077 598813082 /nfs/dbraw/zinc/81/30/82/598813082.db2.gz OJNDPZSVUWPASM-IBGZPJMESA-N -1 3 374.448 3.941 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)N(C1CC1)[C@H]1CCCc2ccccc21 ZINC000738178077 598813084 /nfs/dbraw/zinc/81/30/84/598813084.db2.gz OJNDPZSVUWPASM-IBGZPJMESA-N -1 3 374.448 3.941 20 0 FHADHM CC(C)[C@H](Nc1cccc(F)c1-c1nnn[n-]1)c1nc2ccccc2[nH]1 ZINC000735921587 598813745 /nfs/dbraw/zinc/81/37/45/598813745.db2.gz WBYJWHSMEVJKRI-INIZCTEOSA-N -1 3 351.389 3.691 20 0 FHADHM CC(C)[C@H](Nc1cccc(F)c1-c1nn[n-]n1)c1nc2ccccc2[nH]1 ZINC000735921587 598813747 /nfs/dbraw/zinc/81/37/47/598813747.db2.gz WBYJWHSMEVJKRI-INIZCTEOSA-N -1 3 351.389 3.691 20 0 FHADHM CC[C@H](CC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)CC(C)C)C(C)C ZINC000736333068 598819881 /nfs/dbraw/zinc/81/98/81/598819881.db2.gz PMKUYEXZHXGGLL-QGZVFWFLSA-N -1 3 357.502 3.924 20 0 FHADHM CC[C@H](CC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)CC(C)C)C(C)C ZINC000736333068 598819883 /nfs/dbraw/zinc/81/98/83/598819883.db2.gz PMKUYEXZHXGGLL-QGZVFWFLSA-N -1 3 357.502 3.924 20 0 FHADHM CCC[C@@H](CC1CCCC1)C(=O)NCc1ccc(-c2nnn[n-]2)cc1F ZINC000736422649 598822387 /nfs/dbraw/zinc/82/23/87/598822387.db2.gz NHMYDPHCCJTJQY-HNNXBMFYSA-N -1 3 359.449 3.619 20 0 FHADHM CCC[C@@H](CC1CCCC1)C(=O)NCc1ccc(-c2nn[n-]n2)cc1F ZINC000736422649 598822388 /nfs/dbraw/zinc/82/23/88/598822388.db2.gz NHMYDPHCCJTJQY-HNNXBMFYSA-N -1 3 359.449 3.619 20 0 FHADHM O=C(Nc1sc2c(c1-c1nnn[n-]1)CCCC2)c1coc2ccccc12 ZINC000738206157 598822425 /nfs/dbraw/zinc/82/24/25/598822425.db2.gz FFMXSCHYCSLVPY-UHFFFAOYSA-N -1 3 365.418 3.806 20 0 FHADHM O=C(Nc1sc2c(c1-c1nn[n-]n1)CCCC2)c1coc2ccccc12 ZINC000738206157 598822426 /nfs/dbraw/zinc/82/24/26/598822426.db2.gz FFMXSCHYCSLVPY-UHFFFAOYSA-N -1 3 365.418 3.806 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)c1cccc(Nc2ccccc2)c1 ZINC000522797322 599302216 /nfs/dbraw/zinc/30/22/16/599302216.db2.gz RJRZKPZZROVWMJ-UHFFFAOYSA-N -1 3 356.389 3.863 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)c1cccc(Nc2ccccc2)c1 ZINC000522797322 599302220 /nfs/dbraw/zinc/30/22/20/599302220.db2.gz RJRZKPZZROVWMJ-UHFFFAOYSA-N -1 3 356.389 3.863 20 0 FHADHM O=C(c1ccc(-c2nnn[n-]2)cc1)N(c1ccccc1F)C1CCCC1 ZINC000738254258 599303343 /nfs/dbraw/zinc/30/33/43/599303343.db2.gz JXSWOMLCQGYUHZ-UHFFFAOYSA-N -1 3 351.385 3.595 20 0 FHADHM O=C(c1ccc(-c2nn[n-]n2)cc1)N(c1ccccc1F)C1CCCC1 ZINC000738254258 599303345 /nfs/dbraw/zinc/30/33/45/599303345.db2.gz JXSWOMLCQGYUHZ-UHFFFAOYSA-N -1 3 351.385 3.595 20 0 FHADHM CCN(C(=O)CCCc1ccc(Cl)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736504547 599308738 /nfs/dbraw/zinc/30/87/38/599308738.db2.gz GCZBJRUKXUMCBT-UHFFFAOYSA-N -1 3 369.856 3.896 20 0 FHADHM CCN(C(=O)CCCc1ccc(Cl)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736504547 599308740 /nfs/dbraw/zinc/30/87/40/599308740.db2.gz GCZBJRUKXUMCBT-UHFFFAOYSA-N -1 3 369.856 3.896 20 0 FHADHM C[C@@H](N[C@H](c1nccs1)c1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736131160 599311137 /nfs/dbraw/zinc/31/11/37/599311137.db2.gz JNMOOIPNWRTCEE-DYVFJYSZSA-N -1 3 362.462 3.763 20 0 FHADHM C[C@@H](N[C@H](c1nccs1)c1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736131160 599311140 /nfs/dbraw/zinc/31/11/40/599311140.db2.gz JNMOOIPNWRTCEE-DYVFJYSZSA-N -1 3 362.462 3.763 20 0 FHADHM CC(C)CCc1noc(CS[C@H](C)c2ccc(-c3nnn[n-]3)cc2)n1 ZINC000735817481 599325000 /nfs/dbraw/zinc/32/50/00/599325000.db2.gz AFLPUKNIOZDTDG-GFCCVEGCSA-N -1 3 358.471 3.833 20 0 FHADHM CC(C)CCc1noc(CS[C@H](C)c2ccc(-c3nn[n-]n3)cc2)n1 ZINC000735817481 599325002 /nfs/dbraw/zinc/32/50/02/599325002.db2.gz AFLPUKNIOZDTDG-GFCCVEGCSA-N -1 3 358.471 3.833 20 0 FHADHM Clc1ccc(NCc2cc(Br)cs2)cc1-c1nnn[n-]1 ZINC000737573294 599326176 /nfs/dbraw/zinc/32/61/76/599326176.db2.gz FLPRGKOKKPWZMD-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM Clc1ccc(NCc2cc(Br)cs2)cc1-c1nn[n-]n1 ZINC000737573294 599326178 /nfs/dbraw/zinc/32/61/78/599326178.db2.gz FLPRGKOKKPWZMD-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM C[C@@H](SCCOCCOc1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736189270 599326152 /nfs/dbraw/zinc/32/61/52/599326152.db2.gz OTJSJNKMBOMRSC-OAHLLOKOSA-N -1 3 370.478 3.757 20 0 FHADHM C[C@@H](SCCOCCOc1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736189270 599326155 /nfs/dbraw/zinc/32/61/55/599326155.db2.gz OTJSJNKMBOMRSC-OAHLLOKOSA-N -1 3 370.478 3.757 20 0 FHADHM CCCCC[C@@H](C)NC(=O)CS[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736440518 599328943 /nfs/dbraw/zinc/32/89/43/599328943.db2.gz CQBZUUXHOVJTBO-KGLIPLIRSA-N -1 3 361.515 3.746 20 0 FHADHM CCCCC[C@@H](C)NC(=O)CS[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736440518 599328946 /nfs/dbraw/zinc/32/89/46/599328946.db2.gz CQBZUUXHOVJTBO-KGLIPLIRSA-N -1 3 361.515 3.746 20 0 FHADHM Fc1ccc(NCCOc2cccc(-c3nnn[n-]3)c2)cc1C(F)(F)F ZINC000737656012 599329776 /nfs/dbraw/zinc/32/97/76/599329776.db2.gz FUWGQUICUZBKLF-UHFFFAOYSA-N -1 3 367.306 3.516 20 0 FHADHM Fc1ccc(NCCOc2cccc(-c3nn[n-]n3)c2)cc1C(F)(F)F ZINC000737656012 599329779 /nfs/dbraw/zinc/32/97/79/599329779.db2.gz FUWGQUICUZBKLF-UHFFFAOYSA-N -1 3 367.306 3.516 20 0 FHADHM C[C@H](SCC(=O)Nc1cccc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736192457 599330867 /nfs/dbraw/zinc/33/08/67/599330867.db2.gz ZAFCOQCKXVYYFO-NSHDSACASA-N -1 3 373.869 3.953 20 0 FHADHM C[C@H](SCC(=O)Nc1cccc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736192457 599330869 /nfs/dbraw/zinc/33/08/69/599330869.db2.gz ZAFCOQCKXVYYFO-NSHDSACASA-N -1 3 373.869 3.953 20 0 FHADHM Fc1ccc(NCc2ccc(SC(F)F)cc2)cc1-c1nnn[n-]1 ZINC000737655605 599331020 /nfs/dbraw/zinc/33/10/20/599331020.db2.gz AOBNDJPTPARSKZ-UHFFFAOYSA-N -1 3 351.357 3.933 20 0 FHADHM Fc1ccc(NCc2ccc(SC(F)F)cc2)cc1-c1nn[n-]n1 ZINC000737655605 599331023 /nfs/dbraw/zinc/33/10/23/599331023.db2.gz AOBNDJPTPARSKZ-UHFFFAOYSA-N -1 3 351.357 3.933 20 0 FHADHM C[C@@H](SCC(=O)Nc1cccc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736192456 599331260 /nfs/dbraw/zinc/33/12/60/599331260.db2.gz ZAFCOQCKXVYYFO-LLVKDONJSA-N -1 3 373.869 3.953 20 0 FHADHM C[C@@H](SCC(=O)Nc1cccc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736192456 599331265 /nfs/dbraw/zinc/33/12/65/599331265.db2.gz ZAFCOQCKXVYYFO-LLVKDONJSA-N -1 3 373.869 3.953 20 0 FHADHM Cc1cccc(NC(=O)CS[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737398624 599331872 /nfs/dbraw/zinc/33/18/72/599331872.db2.gz IWDJTWYRMCBZOG-ZDUSSCGKSA-N -1 3 353.451 3.608 20 0 FHADHM Cc1cccc(NC(=O)CS[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737398624 599331874 /nfs/dbraw/zinc/33/18/74/599331874.db2.gz IWDJTWYRMCBZOG-ZDUSSCGKSA-N -1 3 353.451 3.608 20 0 FHADHM CC(C)[C@@H](Sc1ccccc1-c1nnn[n-]1)C(=O)N(C)c1ccccc1 ZINC000820031904 599341801 /nfs/dbraw/zinc/34/18/01/599341801.db2.gz JRRQILZZTNDRMU-QGZVFWFLSA-N -1 3 367.478 3.646 20 0 FHADHM CC(C)[C@@H](Sc1ccccc1-c1nn[n-]n1)C(=O)N(C)c1ccccc1 ZINC000820031904 599341804 /nfs/dbraw/zinc/34/18/04/599341804.db2.gz JRRQILZZTNDRMU-QGZVFWFLSA-N -1 3 367.478 3.646 20 0 FHADHM Cc1ccccc1[C@H](C)NC(=O)[C@@H](C)Sc1ccccc1-c1nnn[n-]1 ZINC000822345929 599348081 /nfs/dbraw/zinc/34/80/81/599348081.db2.gz WWDJMTVQYHBCEV-UONOGXRCSA-N -1 3 367.478 3.533 20 0 FHADHM Cc1ccccc1[C@H](C)NC(=O)[C@@H](C)Sc1ccccc1-c1nn[n-]n1 ZINC000822345929 599348082 /nfs/dbraw/zinc/34/80/82/599348082.db2.gz WWDJMTVQYHBCEV-UONOGXRCSA-N -1 3 367.478 3.533 20 0 FHADHM CCN(C(=O)Nc1cc(C)ccc1F)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736505426 599351797 /nfs/dbraw/zinc/35/17/97/599351797.db2.gz IMORVQBMJZDSGH-CYBMUJFWSA-N -1 3 368.416 3.929 20 0 FHADHM CCN(C(=O)Nc1cc(C)ccc1F)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736505426 599351801 /nfs/dbraw/zinc/35/18/01/599351801.db2.gz IMORVQBMJZDSGH-CYBMUJFWSA-N -1 3 368.416 3.929 20 0 FHADHM C[C@@H](Nc1cccc(OC[C@H]2CCCO2)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820461721 599365204 /nfs/dbraw/zinc/36/52/04/599365204.db2.gz QOBLHERRXNJLMZ-AUUYWEPGSA-N -1 3 365.437 3.598 20 0 FHADHM C[C@@H](Nc1cccc(OC[C@H]2CCCO2)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820461721 599365206 /nfs/dbraw/zinc/36/52/06/599365206.db2.gz QOBLHERRXNJLMZ-AUUYWEPGSA-N -1 3 365.437 3.598 20 0 FHADHM C[C@@H](Nc1cccc(OCC(F)(F)F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820461421 599367508 /nfs/dbraw/zinc/36/75/08/599367508.db2.gz JSBOOCRAGBGTMZ-LLVKDONJSA-N -1 3 363.343 3.981 20 0 FHADHM C[C@@H](Nc1cccc(OCC(F)(F)F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820461421 599367511 /nfs/dbraw/zinc/36/75/11/599367511.db2.gz JSBOOCRAGBGTMZ-LLVKDONJSA-N -1 3 363.343 3.981 20 0 FHADHM CCOCCOCc1cccc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000821384129 599369455 /nfs/dbraw/zinc/36/94/55/599369455.db2.gz QKOQOPSHGOUWSH-HNNXBMFYSA-N -1 3 367.453 3.593 20 0 FHADHM CCOCCOCc1cccc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000821384129 599369457 /nfs/dbraw/zinc/36/94/57/599369457.db2.gz QKOQOPSHGOUWSH-HNNXBMFYSA-N -1 3 367.453 3.593 20 0 FHADHM CSCCCC(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000737184575 599374012 /nfs/dbraw/zinc/37/40/12/599374012.db2.gz ZUYSEYGLLLXUKU-UHFFFAOYSA-N -1 3 369.450 3.741 20 0 FHADHM CSCCCC(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000737184575 599374015 /nfs/dbraw/zinc/37/40/15/599374015.db2.gz ZUYSEYGLLLXUKU-UHFFFAOYSA-N -1 3 369.450 3.741 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CNc1ccc(Oc2ccccn2)cc1 ZINC000821737672 607371894 /nfs/dbraw/zinc/37/18/94/607371894.db2.gz ZTQKRUDYGSCNSD-UHFFFAOYSA-N -1 3 374.404 3.675 20 0 FHADHM C[C@@H](CCC(C)(C)C)NC(=O)CCCCOc1cccc(-c2nnn[n-]2)c1 ZINC000735984974 599380082 /nfs/dbraw/zinc/38/00/82/599380082.db2.gz HUHQVIDJBBDGBZ-HNNXBMFYSA-N -1 3 373.501 3.747 20 0 FHADHM C[C@@H](CCC(C)(C)C)NC(=O)CCCCOc1cccc(-c2nn[n-]n2)c1 ZINC000735984974 599380084 /nfs/dbraw/zinc/38/00/84/599380084.db2.gz HUHQVIDJBBDGBZ-HNNXBMFYSA-N -1 3 373.501 3.747 20 0 FHADHM C[C@@H](Nc1ccc(F)c(Br)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820456815 599386955 /nfs/dbraw/zinc/38/69/55/599386955.db2.gz WDBGEYDZECRCMW-SECBINFHSA-N -1 3 362.206 3.941 20 0 FHADHM C[C@@H](Nc1ccc(F)c(Br)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820456815 599386957 /nfs/dbraw/zinc/38/69/57/599386957.db2.gz WDBGEYDZECRCMW-SECBINFHSA-N -1 3 362.206 3.941 20 0 FHADHM Fc1ccc([C@@H](NCc2ccc(-c3nnn[n-]3)o2)c2cccs2)cc1 ZINC000822766346 599397180 /nfs/dbraw/zinc/39/71/80/599397180.db2.gz HVNIFCVUOYMXNZ-MRXNPFEDSA-N -1 3 355.398 3.540 20 0 FHADHM Fc1ccc([C@@H](NCc2ccc(-c3nn[n-]n3)o2)c2cccs2)cc1 ZINC000822766346 599397182 /nfs/dbraw/zinc/39/71/82/599397182.db2.gz HVNIFCVUOYMXNZ-MRXNPFEDSA-N -1 3 355.398 3.540 20 0 FHADHM C[C@@H](NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1cccc(Cl)c1 ZINC000820352312 599398645 /nfs/dbraw/zinc/39/86/45/599398645.db2.gz UFGPSGDAUXYXGQ-NWDGAFQWSA-N -1 3 370.844 3.642 20 0 FHADHM C[C@@H](NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1cccc(Cl)c1 ZINC000820352312 599398648 /nfs/dbraw/zinc/39/86/48/599398648.db2.gz UFGPSGDAUXYXGQ-NWDGAFQWSA-N -1 3 370.844 3.642 20 0 FHADHM CCC[C@H](NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000821021914 599404823 /nfs/dbraw/zinc/40/48/23/599404823.db2.gz PVGLEUTTYJRMJD-KDOFPFPSSA-N -1 3 364.453 3.768 20 0 FHADHM CCC[C@H](NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000821021914 599404824 /nfs/dbraw/zinc/40/48/24/599404824.db2.gz PVGLEUTTYJRMJD-KDOFPFPSSA-N -1 3 364.453 3.768 20 0 FHADHM Fc1ccc(N2CC[C@H](CNc3cc(Cl)ccc3-c3nnn[n-]3)C2)cc1 ZINC000737661419 599417050 /nfs/dbraw/zinc/41/70/50/599417050.db2.gz VUCVEFHVZOZSKD-GFCCVEGCSA-N -1 3 372.835 3.598 20 0 FHADHM Fc1ccc(N2CC[C@H](CNc3cc(Cl)ccc3-c3nn[n-]n3)C2)cc1 ZINC000737661419 599417051 /nfs/dbraw/zinc/41/70/51/599417051.db2.gz VUCVEFHVZOZSKD-GFCCVEGCSA-N -1 3 372.835 3.598 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(NC2CCN(c3ccccc3)CC2)c1 ZINC000737570966 599417140 /nfs/dbraw/zinc/41/71/40/599417140.db2.gz NKSPVUAJWQROTA-UHFFFAOYSA-N -1 3 354.845 3.601 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(NC2CCN(c3ccccc3)CC2)c1 ZINC000737570966 599417141 /nfs/dbraw/zinc/41/71/41/599417141.db2.gz NKSPVUAJWQROTA-UHFFFAOYSA-N -1 3 354.845 3.601 20 0 FHADHM CC(C)c1ccc(CNC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000820191930 599421520 /nfs/dbraw/zinc/42/15/20/599421520.db2.gz AXNLXGYFRBRKIU-CQSZACIVSA-N -1 3 364.453 3.551 20 0 FHADHM CC(C)c1ccc(CNC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000820191930 599421522 /nfs/dbraw/zinc/42/15/22/599421522.db2.gz AXNLXGYFRBRKIU-CQSZACIVSA-N -1 3 364.453 3.551 20 0 FHADHM C[C@@H](NC(=O)NCC1CCCCCCC1)c1cccc(-c2nnn[n-]2)c1 ZINC000820360135 599421976 /nfs/dbraw/zinc/42/19/76/599421976.db2.gz XDBFNTXOFLPTAD-CQSZACIVSA-N -1 3 356.474 3.587 20 0 FHADHM C[C@@H](NC(=O)NCC1CCCCCCC1)c1cccc(-c2nn[n-]n2)c1 ZINC000820360135 599421978 /nfs/dbraw/zinc/42/19/78/599421978.db2.gz XDBFNTXOFLPTAD-CQSZACIVSA-N -1 3 356.474 3.587 20 0 FHADHM COc1cc(Cl)ccc1CNc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000737047242 599433548 /nfs/dbraw/zinc/43/35/48/599433548.db2.gz KAROFTWCWUOOOD-UHFFFAOYSA-N -1 3 366.812 3.689 20 0 FHADHM COc1cc(Cl)ccc1CNc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000737047242 599433550 /nfs/dbraw/zinc/43/35/50/599433550.db2.gz KAROFTWCWUOOOD-UHFFFAOYSA-N -1 3 366.812 3.689 20 0 FHADHM CC[C@H](C)C[C@@H](C)NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)CC(C)C ZINC000820870784 599458810 /nfs/dbraw/zinc/45/88/10/599458810.db2.gz ZHXXLXKLJBMKSY-JKSUJKDBSA-N -1 3 372.517 3.859 20 0 FHADHM CC[C@H](C)C[C@@H](C)NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)CC(C)C ZINC000820870784 599458811 /nfs/dbraw/zinc/45/88/11/599458811.db2.gz ZHXXLXKLJBMKSY-JKSUJKDBSA-N -1 3 372.517 3.859 20 0 FHADHM CCCOc1ccc(CNc2c(Cl)cccc2-c2nnn[n-]2)cc1OC ZINC000821133559 599470765 /nfs/dbraw/zinc/47/07/65/599470765.db2.gz ARISWNLDHVESRH-UHFFFAOYSA-N -1 3 373.844 3.930 20 0 FHADHM CCCOc1ccc(CNc2c(Cl)cccc2-c2nn[n-]n2)cc1OC ZINC000821133559 599470768 /nfs/dbraw/zinc/47/07/68/599470768.db2.gz ARISWNLDHVESRH-UHFFFAOYSA-N -1 3 373.844 3.930 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1NCc1ccc(N2CCCCC2)nc1 ZINC000822586091 599480966 /nfs/dbraw/zinc/48/09/66/599480966.db2.gz RXZVWHBJMNSVKA-UHFFFAOYSA-N -1 3 369.860 3.518 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1NCc1ccc(N2CCCCC2)nc1 ZINC000822586091 599480968 /nfs/dbraw/zinc/48/09/68/599480968.db2.gz RXZVWHBJMNSVKA-UHFFFAOYSA-N -1 3 369.860 3.518 20 0 FHADHM Fc1ccc(N[C@@H]2CCc3cc(Br)ccc32)c(-c2nnn[n-]2)c1 ZINC000822778943 599493219 /nfs/dbraw/zinc/49/32/19/599493219.db2.gz PATJEWRREOWCEI-CQSZACIVSA-N -1 3 374.217 3.868 20 0 FHADHM Fc1ccc(N[C@@H]2CCc3cc(Br)ccc32)c(-c2nn[n-]n2)c1 ZINC000822778943 599493221 /nfs/dbraw/zinc/49/32/21/599493221.db2.gz PATJEWRREOWCEI-CQSZACIVSA-N -1 3 374.217 3.868 20 0 FHADHM CCC(CC)(C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000820882105 599493808 /nfs/dbraw/zinc/49/38/08/599493808.db2.gz JUVRNZUSSUUFHC-HNNXBMFYSA-N -1 3 363.465 3.802 20 0 FHADHM CCC(CC)(C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000820882105 599493811 /nfs/dbraw/zinc/49/38/11/599493811.db2.gz JUVRNZUSSUUFHC-HNNXBMFYSA-N -1 3 363.465 3.802 20 0 FHADHM CC(C)[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820313169 599497917 /nfs/dbraw/zinc/49/79/17/599497917.db2.gz BLFPLOCZVUSPDZ-HNAYVOBHSA-N -1 3 363.465 3.559 20 0 FHADHM CC(C)[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820313169 599497919 /nfs/dbraw/zinc/49/79/19/599497919.db2.gz BLFPLOCZVUSPDZ-HNAYVOBHSA-N -1 3 363.465 3.559 20 0 FHADHM CCn1c(CCNc2c(Cl)cccc2-c2nnn[n-]2)nc2ccccc21 ZINC000821563829 599500930 /nfs/dbraw/zinc/50/09/30/599500930.db2.gz HLCWAVCJJGGYNO-UHFFFAOYSA-N -1 3 367.844 3.544 20 0 FHADHM CCn1c(CCNc2c(Cl)cccc2-c2nn[n-]n2)nc2ccccc21 ZINC000821563829 599500933 /nfs/dbraw/zinc/50/09/33/599500933.db2.gz HLCWAVCJJGGYNO-UHFFFAOYSA-N -1 3 367.844 3.544 20 0 FHADHM Cc1cccc2c1ncc(-c1nnn[n-]1)c2N1CC[C@@H](c2ccccc2)C1 ZINC000822332047 599503547 /nfs/dbraw/zinc/50/35/47/599503547.db2.gz LEXYCHOIHVNACS-MRXNPFEDSA-N -1 3 356.433 3.717 20 0 FHADHM Cc1cccc2c1ncc(-c1nn[n-]n1)c2N1CC[C@@H](c2ccccc2)C1 ZINC000822332047 599503549 /nfs/dbraw/zinc/50/35/49/599503549.db2.gz LEXYCHOIHVNACS-MRXNPFEDSA-N -1 3 356.433 3.717 20 0 FHADHM Cc1ccc(N[C@H](C)C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c(C)c1 ZINC000737361055 599504716 /nfs/dbraw/zinc/50/47/16/599504716.db2.gz RETIPYQWSSUARA-GFCCVEGCSA-N -1 3 370.844 3.576 20 0 FHADHM Cc1ccc(N[C@H](C)C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c(C)c1 ZINC000737361055 599504718 /nfs/dbraw/zinc/50/47/18/599504718.db2.gz RETIPYQWSSUARA-GFCCVEGCSA-N -1 3 370.844 3.576 20 0 FHADHM C[C@@H](NC(=O)CCCCCc1cccs1)c1cccc(-c2nnn[n-]2)c1 ZINC000820322679 599506116 /nfs/dbraw/zinc/50/61/16/599506116.db2.gz UCJJNIIZFLHXBN-CQSZACIVSA-N -1 3 369.494 3.909 20 0 FHADHM C[C@@H](NC(=O)CCCCCc1cccs1)c1cccc(-c2nn[n-]n2)c1 ZINC000820322679 599506118 /nfs/dbraw/zinc/50/61/18/599506118.db2.gz UCJJNIIZFLHXBN-CQSZACIVSA-N -1 3 369.494 3.909 20 0 FHADHM Cc1csc([C@H]2CCCN(c3ccc(-c4nnn[n-]4)c(Cl)c3)C2)n1 ZINC000822408725 599509387 /nfs/dbraw/zinc/50/93/87/599509387.db2.gz HLLQNPNRWGSXAU-NSHDSACASA-N -1 3 360.874 3.669 20 0 FHADHM Cc1csc([C@H]2CCCN(c3ccc(-c4nn[n-]n4)c(Cl)c3)C2)n1 ZINC000822408725 599509389 /nfs/dbraw/zinc/50/93/89/599509389.db2.gz HLLQNPNRWGSXAU-NSHDSACASA-N -1 3 360.874 3.669 20 0 FHADHM C[C@H](C[C@H](O)c1ccc(F)cc1)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820235621 607381829 /nfs/dbraw/zinc/38/18/29/607381829.db2.gz TXKCIGNPGMSSPU-HWPZZCPQSA-N -1 3 361.808 3.583 20 0 FHADHM C[C@H](C[C@H](O)c1ccc(F)cc1)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820235621 607381831 /nfs/dbraw/zinc/38/18/31/607381831.db2.gz TXKCIGNPGMSSPU-HWPZZCPQSA-N -1 3 361.808 3.583 20 0 FHADHM COc1ccc([C@H]2CCN(c3c(Cl)cccc3-c3nnn[n-]3)C2)cc1 ZINC000821787326 599511271 /nfs/dbraw/zinc/51/12/71/599511271.db2.gz RKJCJUGOAQXGCS-ZDUSSCGKSA-N -1 3 355.829 3.523 20 0 FHADHM COc1ccc([C@H]2CCN(c3c(Cl)cccc3-c3nn[n-]n3)C2)cc1 ZINC000821787326 599511274 /nfs/dbraw/zinc/51/12/74/599511274.db2.gz RKJCJUGOAQXGCS-ZDUSSCGKSA-N -1 3 355.829 3.523 20 0 FHADHM COc1ccccc1CN(C)c1ccc(-c2nn[n-]n2)cc1C(F)(F)F ZINC000737149338 599518293 /nfs/dbraw/zinc/51/82/93/599518293.db2.gz GHNDRSQEUGOESX-UHFFFAOYSA-N -1 3 363.343 3.531 20 0 FHADHM C[C@@H](NC(=O)c1cc2c(s1)CC[C@H](C)C2)c1cccc(-c2nnn[n-]2)c1 ZINC000820735595 599521892 /nfs/dbraw/zinc/52/18/92/599521892.db2.gz TXPYEGYXHBXJJD-NWDGAFQWSA-N -1 3 367.478 3.544 20 0 FHADHM C[C@@H](NC(=O)c1cc2c(s1)CC[C@H](C)C2)c1cccc(-c2nn[n-]n2)c1 ZINC000820735595 599521895 /nfs/dbraw/zinc/52/18/95/599521895.db2.gz TXPYEGYXHBXJJD-NWDGAFQWSA-N -1 3 367.478 3.544 20 0 FHADHM COc1ccccc1[C@H]1CCN(c2ccc(Cl)cc2-c2nnn[n-]2)C1 ZINC000737147125 599537566 /nfs/dbraw/zinc/53/75/66/599537566.db2.gz KIADXZHGYFZNKM-LBPRGKRZSA-N -1 3 355.829 3.523 20 0 FHADHM COc1ccccc1[C@H]1CCN(c2ccc(Cl)cc2-c2nn[n-]n2)C1 ZINC000737147125 599537568 /nfs/dbraw/zinc/53/75/68/599537568.db2.gz KIADXZHGYFZNKM-LBPRGKRZSA-N -1 3 355.829 3.523 20 0 FHADHM CC(C)(C)CCC(=O)N(Cc1ccco1)c1ccccc1-c1nnn[n-]1 ZINC000735602744 599541236 /nfs/dbraw/zinc/54/12/36/599541236.db2.gz GGAAAOLYUCZSLW-UHFFFAOYSA-N -1 3 353.426 3.819 20 0 FHADHM CC(C)(C)CCC(=O)N(Cc1ccco1)c1ccccc1-c1nn[n-]n1 ZINC000735602744 599541238 /nfs/dbraw/zinc/54/12/38/599541238.db2.gz GGAAAOLYUCZSLW-UHFFFAOYSA-N -1 3 353.426 3.819 20 0 FHADHM CC(C)(C)CCC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)CC(F)(F)F ZINC000735603712 599541380 /nfs/dbraw/zinc/54/13/80/599541380.db2.gz OJPSIMSURCLQID-UHFFFAOYSA-N -1 3 369.391 3.584 20 0 FHADHM CC(C)(C)CCC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)CC(F)(F)F ZINC000735603712 599541381 /nfs/dbraw/zinc/54/13/81/599541381.db2.gz OJPSIMSURCLQID-UHFFFAOYSA-N -1 3 369.391 3.584 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@@H](C)c1cccs1 ZINC000735829741 599541404 /nfs/dbraw/zinc/54/14/04/599541404.db2.gz NJTQZXRLGHCQIP-AWEZNQCLSA-N -1 3 369.494 3.717 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@@H](C)c1cccs1 ZINC000735829741 599541406 /nfs/dbraw/zinc/54/14/06/599541406.db2.gz NJTQZXRLGHCQIP-AWEZNQCLSA-N -1 3 369.494 3.717 20 0 FHADHM CC(C)c1ccc([C@H](C)CC(=O)NCc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000523151837 599541426 /nfs/dbraw/zinc/54/14/26/599541426.db2.gz BSBIVYWAPPRWIH-OAHLLOKOSA-N -1 3 363.465 3.800 20 0 FHADHM CC(C)c1ccc([C@H](C)CC(=O)NCc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000523151837 599541427 /nfs/dbraw/zinc/54/14/27/599541427.db2.gz BSBIVYWAPPRWIH-OAHLLOKOSA-N -1 3 363.465 3.800 20 0 FHADHM CC[C@@H](Sc1ccccc1)C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820939851 599542517 /nfs/dbraw/zinc/54/25/17/599542517.db2.gz ZFOFUCBIGZSURS-SUMWQHHRSA-N -1 3 367.478 3.615 20 0 FHADHM CC[C@@H](Sc1ccccc1)C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820939851 599542519 /nfs/dbraw/zinc/54/25/19/599542519.db2.gz ZFOFUCBIGZSURS-SUMWQHHRSA-N -1 3 367.478 3.615 20 0 FHADHM CCc1ccc([C@H](C)CC(=O)N(C)c2ccc(-c3nnn[n-]3)cc2F)cc1 ZINC000736686821 599545188 /nfs/dbraw/zinc/54/51/88/599545188.db2.gz LEYIDHLTXFPWBO-CYBMUJFWSA-N -1 3 367.428 3.725 20 0 FHADHM CCc1ccc([C@H](C)CC(=O)N(C)c2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000736686821 599545190 /nfs/dbraw/zinc/54/51/90/599545190.db2.gz LEYIDHLTXFPWBO-CYBMUJFWSA-N -1 3 367.428 3.725 20 0 FHADHM CCCO[C@H]1CCCN(c2c(-c3nnn[n-]3)cnc3c(C)cccc32)CC1 ZINC000821127294 599546795 /nfs/dbraw/zinc/54/67/95/599546795.db2.gz FWDXOKRSKZURRA-HNNXBMFYSA-N -1 3 366.469 3.509 20 0 FHADHM CCCO[C@H]1CCCN(c2c(-c3nn[n-]n3)cnc3c(C)cccc32)CC1 ZINC000821127294 599546796 /nfs/dbraw/zinc/54/67/96/599546796.db2.gz FWDXOKRSKZURRA-HNNXBMFYSA-N -1 3 366.469 3.509 20 0 FHADHM Cc1cc(Br)ccc1CNc1ccc(F)cc1-c1nnn[n-]1 ZINC000822161893 599547401 /nfs/dbraw/zinc/54/74/01/599547401.db2.gz VDJILXPVBRXKSC-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Cc1cc(Br)ccc1CNc1ccc(F)cc1-c1nn[n-]n1 ZINC000822161893 599547403 /nfs/dbraw/zinc/54/74/03/599547403.db2.gz VDJILXPVBRXKSC-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM CCSCc1cccc(NC(=O)Nc2cccc(-c3nnn[n-]3)c2)c1 ZINC000821461479 599550854 /nfs/dbraw/zinc/55/08/54/599550854.db2.gz PKXSKMXULVUEKI-UHFFFAOYSA-N -1 3 354.439 3.764 20 0 FHADHM CCSCc1cccc(NC(=O)Nc2cccc(-c3nn[n-]n3)c2)c1 ZINC000821461479 599550856 /nfs/dbraw/zinc/55/08/56/599550856.db2.gz PKXSKMXULVUEKI-UHFFFAOYSA-N -1 3 354.439 3.764 20 0 FHADHM O=C(NCc1ccccc1)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000738118113 599563701 /nfs/dbraw/zinc/56/37/01/599563701.db2.gz XQSNGNTUWWMKRI-UHFFFAOYSA-N -1 3 370.416 3.540 20 0 FHADHM C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1c1c(-c2nnn[n-]2)cnc2ccccc21 ZINC000820668822 599564312 /nfs/dbraw/zinc/56/43/12/599564312.db2.gz XBXYNAVXMQFAAT-UKRRQHHQSA-N -1 3 374.423 3.936 20 0 FHADHM C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1c1c(-c2nn[n-]n2)cnc2ccccc21 ZINC000820668822 599564314 /nfs/dbraw/zinc/56/43/14/599564314.db2.gz XBXYNAVXMQFAAT-UKRRQHHQSA-N -1 3 374.423 3.936 20 0 FHADHM COc1ccccc1[C@@H]1CCN(c2c(Cl)cccc2-c2nnn[n-]2)C1 ZINC000821891276 599566641 /nfs/dbraw/zinc/56/66/41/599566641.db2.gz ZHAXZXAIFGMKGX-GFCCVEGCSA-N -1 3 355.829 3.523 20 0 FHADHM COc1ccccc1[C@@H]1CCN(c2c(Cl)cccc2-c2nn[n-]n2)C1 ZINC000821891276 599566643 /nfs/dbraw/zinc/56/66/43/599566643.db2.gz ZHAXZXAIFGMKGX-GFCCVEGCSA-N -1 3 355.829 3.523 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1NCc1ccccc1OCC1CC1 ZINC000822586249 599567286 /nfs/dbraw/zinc/56/72/86/599567286.db2.gz VICOZSUZHJJSQI-UHFFFAOYSA-N -1 3 355.829 3.921 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1NCc1ccccc1OCC1CC1 ZINC000822586249 599567289 /nfs/dbraw/zinc/56/72/89/599567289.db2.gz VICOZSUZHJJSQI-UHFFFAOYSA-N -1 3 355.829 3.921 20 0 FHADHM C[C@@H]1CCC[C@@H]1NC(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736264315 599568839 /nfs/dbraw/zinc/56/88/39/599568839.db2.gz VSACEOSCTPLTGG-ACJLOTCBSA-N -1 3 362.437 3.529 20 0 FHADHM C[C@H]1CCC[C@@H]1NC(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736264324 599569036 /nfs/dbraw/zinc/56/90/36/599569036.db2.gz VSACEOSCTPLTGG-UGSOOPFHSA-N -1 3 362.437 3.529 20 0 FHADHM Cc1cccc2c(CCNc3cc(-c4nnn[n-]4)c4ccccc4n3)c[nH]c21 ZINC000822331333 599579846 /nfs/dbraw/zinc/57/98/46/599579846.db2.gz DUWBREIZUQZXGD-UHFFFAOYSA-N -1 3 369.432 3.859 20 0 FHADHM Cc1cccc2c(CCNc3cc(-c4nn[n-]n4)c4ccccc4n3)c[nH]c21 ZINC000822331333 599579847 /nfs/dbraw/zinc/57/98/47/599579847.db2.gz DUWBREIZUQZXGD-UHFFFAOYSA-N -1 3 369.432 3.859 20 0 FHADHM O=C(CC/C=C/c1ccccc1)OCc1cn2ccccc2c1-c1nnn[n-]1 ZINC000737825626 599606039 /nfs/dbraw/zinc/60/60/39/599606039.db2.gz NDLAQDBTMBGVFY-ONNFQVAWSA-N -1 3 373.416 3.656 20 0 FHADHM O=C(CC/C=C/c1ccccc1)OCc1cn2ccccc2c1-c1nn[n-]n1 ZINC000737825626 599606040 /nfs/dbraw/zinc/60/60/40/599606040.db2.gz NDLAQDBTMBGVFY-ONNFQVAWSA-N -1 3 373.416 3.656 20 0 FHADHM O=C(CC/C=C/c1ccccc1)OCc1ccc(F)cc1-c1nnn[n-]1 ZINC000737824889 599606322 /nfs/dbraw/zinc/60/63/22/599606322.db2.gz JJOVDXSIZGGXAD-XBXARRHUSA-N -1 3 352.369 3.543 20 0 FHADHM O=C(CC/C=C/c1ccccc1)OCc1ccc(F)cc1-c1nn[n-]n1 ZINC000737824889 599606324 /nfs/dbraw/zinc/60/63/24/599606324.db2.gz JJOVDXSIZGGXAD-XBXARRHUSA-N -1 3 352.369 3.543 20 0 FHADHM CCC(CC)(C(=O)OCc1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000820882109 599623836 /nfs/dbraw/zinc/62/38/36/599623836.db2.gz JVJKRGJNOPUOBI-UHFFFAOYSA-N -1 3 350.422 3.668 20 0 FHADHM CCC(CC)(C(=O)OCc1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000820882109 599623837 /nfs/dbraw/zinc/62/38/37/599623837.db2.gz JVJKRGJNOPUOBI-UHFFFAOYSA-N -1 3 350.422 3.668 20 0 FHADHM Cc1cc(F)cc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CC[C@@H](C)C3)c1 ZINC000822203042 599628719 /nfs/dbraw/zinc/62/87/19/599628719.db2.gz BBIIBOPPZFDZSC-SECBINFHSA-N -1 3 371.441 3.753 20 0 FHADHM Cc1cc(F)cc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CC[C@@H](C)C3)c1 ZINC000822203042 599628720 /nfs/dbraw/zinc/62/87/20/599628720.db2.gz BBIIBOPPZFDZSC-SECBINFHSA-N -1 3 371.441 3.753 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)/C=C(/C)C(C)(C)C ZINC000821390477 599629545 /nfs/dbraw/zinc/62/95/45/599629545.db2.gz YBSCDDSMHFJSLY-YFHOEESVSA-N -1 3 364.833 3.817 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)/C=C(/C)C(C)(C)C ZINC000821390477 599629546 /nfs/dbraw/zinc/62/95/46/599629546.db2.gz YBSCDDSMHFJSLY-YFHOEESVSA-N -1 3 364.833 3.817 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)c1cccs1 ZINC000819865789 599631686 /nfs/dbraw/zinc/63/16/86/599631686.db2.gz HWZCFCVKVJSEFH-MRVPVSSYSA-N -1 3 367.356 3.689 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)c1cccs1 ZINC000819865789 599631687 /nfs/dbraw/zinc/63/16/87/599631687.db2.gz HWZCFCVKVJSEFH-MRVPVSSYSA-N -1 3 367.356 3.689 20 0 FHADHM O=C(C=Cc1ccccc1)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000822928301 599633198 /nfs/dbraw/zinc/63/31/98/599633198.db2.gz GOCOXEFVEMFWKT-TWGQIWQCSA-N -1 3 359.311 3.537 20 0 FHADHM O=C(C=Cc1ccccc1)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000822928301 599633199 /nfs/dbraw/zinc/63/31/99/599633199.db2.gz GOCOXEFVEMFWKT-TWGQIWQCSA-N -1 3 359.311 3.537 20 0 FHADHM CCC(=CC(=O)NCc1cccc(-c2nnn[n-]2)c1)c1cccc(Cl)c1 ZINC000820831863 599647716 /nfs/dbraw/zinc/64/77/16/599647716.db2.gz DKLDWTGXSCOYND-SDNWHVSQSA-N -1 3 367.840 3.630 20 0 FHADHM CCC(=CC(=O)NCc1cccc(-c2nn[n-]n2)c1)c1cccc(Cl)c1 ZINC000820831863 599647717 /nfs/dbraw/zinc/64/77/17/599647717.db2.gz DKLDWTGXSCOYND-SDNWHVSQSA-N -1 3 367.840 3.630 20 0 FHADHM CC(C)CN(C(=O)c1cccc2cnccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000820081423 599649372 /nfs/dbraw/zinc/64/93/72/599649372.db2.gz FRLLFIKQLDBQHO-UHFFFAOYSA-N -1 3 372.432 3.718 20 0 FHADHM CC(C)CN(C(=O)c1cccc2cnccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000820081423 599649373 /nfs/dbraw/zinc/64/93/73/599649373.db2.gz FRLLFIKQLDBQHO-UHFFFAOYSA-N -1 3 372.432 3.718 20 0 FHADHM CC(C)[C@H]1CC[C@@H](C)C[C@@H]1NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820683430 599667247 /nfs/dbraw/zinc/66/72/47/599667247.db2.gz AZSRRQVEJFWHPT-NONVJHHQSA-N -1 3 370.501 3.688 20 0 FHADHM CC(C)[C@H]1CC[C@@H](C)C[C@@H]1NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820683430 599667248 /nfs/dbraw/zinc/66/72/48/599667248.db2.gz AZSRRQVEJFWHPT-NONVJHHQSA-N -1 3 370.501 3.688 20 0 FHADHM C[C@@H](NC(=O)N1CCC(C2CCCC2)CC1)c1cccc(-c2nnn[n-]2)c1 ZINC000820339845 599681965 /nfs/dbraw/zinc/68/19/65/599681965.db2.gz HAXPBBGFQMILGB-CQSZACIVSA-N -1 3 368.485 3.540 20 0 FHADHM C[C@@H](NC(=O)N1CCC(C2CCCC2)CC1)c1cccc(-c2nn[n-]n2)c1 ZINC000820339845 599681966 /nfs/dbraw/zinc/68/19/66/599681966.db2.gz HAXPBBGFQMILGB-CQSZACIVSA-N -1 3 368.485 3.540 20 0 FHADHM Cc1ccc(-c2nc(CNc3cccc(F)c3-c3nnn[n-]3)co2)cc1 ZINC000822213886 599688780 /nfs/dbraw/zinc/68/87/80/599688780.db2.gz FMSAVWPTARNJAD-UHFFFAOYSA-N -1 3 350.357 3.581 20 0 FHADHM Cc1ccc(-c2nc(CNc3cccc(F)c3-c3nn[n-]n3)co2)cc1 ZINC000822213886 599688781 /nfs/dbraw/zinc/68/87/81/599688781.db2.gz FMSAVWPTARNJAD-UHFFFAOYSA-N -1 3 350.357 3.581 20 0 FHADHM C[C@H](CCOc1ccccc1)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820248657 599689515 /nfs/dbraw/zinc/68/95/15/599689515.db2.gz LZHVZKHCGQGTCN-GFCCVEGCSA-N -1 3 371.828 3.564 20 0 FHADHM C[C@H](CCOc1ccccc1)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820248657 599689516 /nfs/dbraw/zinc/68/95/16/599689516.db2.gz LZHVZKHCGQGTCN-GFCCVEGCSA-N -1 3 371.828 3.564 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NCc1ncc(-c2ccccc2F)o1 ZINC000822221603 599691534 /nfs/dbraw/zinc/69/15/34/599691534.db2.gz WSTOZECSFUCELC-UHFFFAOYSA-N -1 3 350.357 3.581 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NCc1ncc(-c2ccccc2F)o1 ZINC000822221603 599691535 /nfs/dbraw/zinc/69/15/35/599691535.db2.gz WSTOZECSFUCELC-UHFFFAOYSA-N -1 3 350.357 3.581 20 0 FHADHM Cc1[nH]c(C(=O)[C@@H](C)N2CC[C@@H](c3ccccc3C)C2)c(C)c1C(=O)[O-] ZINC000738768679 599718026 /nfs/dbraw/zinc/71/80/26/599718026.db2.gz MSTHZEQGOZJWOK-HZPDHXFCSA-N -1 3 354.450 3.699 20 0 FHADHM CN(CCCc1cc(-c2ccc(F)cc2)no1)Cc1ccoc1C(=O)[O-] ZINC000737440301 599720465 /nfs/dbraw/zinc/72/04/65/599720465.db2.gz DITWGJAEZOSPOG-UHFFFAOYSA-N -1 3 358.369 3.837 20 0 FHADHM Cc1ccc(Cl)cc1NC(=O)NC1(c2cccc(-c3nnn[n-]3)c2)CC1 ZINC000826288886 607391215 /nfs/dbraw/zinc/39/12/15/607391215.db2.gz AYXBKZOFRSAIAQ-UHFFFAOYSA-N -1 3 368.828 3.639 20 0 FHADHM Cc1ccc(Cl)cc1NC(=O)NC1(c2cccc(-c3nn[n-]n3)c2)CC1 ZINC000826288886 607391217 /nfs/dbraw/zinc/39/12/17/607391217.db2.gz AYXBKZOFRSAIAQ-UHFFFAOYSA-N -1 3 368.828 3.639 20 0 FHADHM O=C([O-])[C@H](NCc1cc(Cl)c2c(c1)OCCCO2)c1ccc(F)cc1 ZINC000739501276 599842392 /nfs/dbraw/zinc/84/23/92/599842392.db2.gz VQSADGAFOCONDU-MRXNPFEDSA-N -1 3 365.788 3.556 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)O[C@@H](C)c1cnc2ccccc2c1 ZINC000826251686 607400251 /nfs/dbraw/zinc/40/02/51/607400251.db2.gz XRJIUAQEMKBIAH-ZDUSSCGKSA-N -1 3 359.389 3.641 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)O[C@@H](C)c1cnc2ccccc2c1 ZINC000826251686 607400252 /nfs/dbraw/zinc/40/02/52/607400252.db2.gz XRJIUAQEMKBIAH-ZDUSSCGKSA-N -1 3 359.389 3.641 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@@H]1C(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000826316099 607400594 /nfs/dbraw/zinc/40/05/94/607400594.db2.gz CTTBYTFYTQKSGY-GLQYFDAESA-N -1 3 354.435 3.645 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@@H]1C(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000826316099 607400596 /nfs/dbraw/zinc/40/05/96/607400596.db2.gz CTTBYTFYTQKSGY-GLQYFDAESA-N -1 3 354.435 3.645 20 0 FHADHM O=C([O-])c1c(CN2CCC[C@@H](O)C2)nc2ccccc2c1-c1ccccc1 ZINC000740065842 600011028 /nfs/dbraw/zinc/01/10/28/600011028.db2.gz GNOVASRYVQIFHD-MRXNPFEDSA-N -1 3 362.429 3.557 20 0 FHADHM Cc1cc(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)ccc1C(=O)[O-] ZINC000738441219 600012760 /nfs/dbraw/zinc/01/27/60/600012760.db2.gz JWENICLUIDUHOI-QAPCUYQASA-N -1 3 367.449 3.650 20 0 FHADHM CC[C@@H](C)c1ccc([C@H](NCC(=O)N2CCC(C(=O)[O-])CC2)C(C)C)cc1 ZINC000736891286 600049822 /nfs/dbraw/zinc/04/98/22/600049822.db2.gz MOXVQCACHHBGOD-IIBYNOLFSA-N -1 3 374.525 3.810 20 0 FHADHM C[C@@](NCc1ccc(F)cc1)(C(=O)[O-])c1cccc(Br)c1 ZINC000041756955 600076689 /nfs/dbraw/zinc/07/66/89/600076689.db2.gz WQEGWKQBKHBZCG-INIZCTEOSA-N -1 3 352.203 3.678 20 0 FHADHM Cc1cc(C)cc([C@H](C)N[C@@H](C)C(=O)Nc2cc(C(=O)[O-])ccc2C)c1 ZINC000738364501 600139596 /nfs/dbraw/zinc/13/95/96/600139596.db2.gz WTRYEJWODOBTBZ-HOTGVXAUSA-N -1 3 354.450 3.988 20 0 FHADHM Cc1cc(C)cc([C@H](C)N[C@H](C)C(=O)Nc2cc(C(=O)[O-])ccc2C)c1 ZINC000738364509 600139640 /nfs/dbraw/zinc/13/96/40/600139640.db2.gz WTRYEJWODOBTBZ-JKSUJKDBSA-N -1 3 354.450 3.988 20 0 FHADHM CC1CCC(N2CCN(C(=O)Nc3ccc(N(C)C(=O)[O-])cc3)CC2)CC1 ZINC000736769669 600181871 /nfs/dbraw/zinc/18/18/71/600181871.db2.gz WBPJKLPQTFPUDC-UHFFFAOYSA-N -1 3 374.485 3.529 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@H]1C(=O)Nc1sc(C)c(C)c1-c1nnn[n-]1 ZINC000826316514 607428720 /nfs/dbraw/zinc/42/87/20/607428720.db2.gz QWQBOTYUZIEWPX-GHMZBOCLSA-N -1 3 359.480 3.657 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@H]1C(=O)Nc1sc(C)c(C)c1-c1nn[n-]n1 ZINC000826316514 607428722 /nfs/dbraw/zinc/42/87/22/607428722.db2.gz QWQBOTYUZIEWPX-GHMZBOCLSA-N -1 3 359.480 3.657 20 0 FHADHM Cc1c(C(=O)N(C)c2ccc(-c3nnn[n-]3)cc2)oc2c1c(C)ccc2C ZINC000826285355 607434631 /nfs/dbraw/zinc/43/46/31/607434631.db2.gz XJTPCMLWPUNAFN-UHFFFAOYSA-N -1 3 361.405 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Cc1cc(Br)cc(C)c1CNCc1ccc(NC(=O)[O-])nc1 ZINC000829899485 603544682 /nfs/dbraw/zinc/54/46/82/603544682.db2.gz GTJMWNSLBGBLGG-UHFFFAOYSA-N -1 3 364.243 3.841 20 0 FHADHM CC[C@@H](NCCC1CCN(C(=O)[O-])CC1)c1nc(C(F)(F)F)cs1 ZINC000826618919 603603207 /nfs/dbraw/zinc/60/32/07/603603207.db2.gz HZBNQZMKGQMKDJ-LLVKDONJSA-N -1 3 365.421 3.983 20 0 FHADHM Clc1ccc(Nc2nc(-c3cccc(-c4nnn[n-]4)c3)cs2)cn1 ZINC000826352606 607645068 /nfs/dbraw/zinc/64/50/68/607645068.db2.gz HMBAAGQDFLJFGL-UHFFFAOYSA-N -1 3 355.814 3.782 20 0 FHADHM Clc1ccc(Nc2nc(-c3cccc(-c4nn[n-]n4)c3)cs2)cn1 ZINC000826352606 607645069 /nfs/dbraw/zinc/64/50/69/607645069.db2.gz HMBAAGQDFLJFGL-UHFFFAOYSA-N -1 3 355.814 3.782 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N[C@H](c1ccc(Cl)cc1)C1CC1 ZINC000826246381 607651447 /nfs/dbraw/zinc/65/14/47/607651447.db2.gz CJKLOTSTOCAUQA-KRWDZBQOSA-N -1 3 367.840 3.710 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N[C@H](c1ccc(Cl)cc1)C1CC1 ZINC000826246381 607651448 /nfs/dbraw/zinc/65/14/48/607651448.db2.gz CJKLOTSTOCAUQA-KRWDZBQOSA-N -1 3 367.840 3.710 20 0 FHADHM CN(C(=O)c1cccc(NC(=O)[O-])c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000827945277 603885710 /nfs/dbraw/zinc/88/57/10/603885710.db2.gz MFKYINCHBGQWSZ-IBGZPJMESA-N -1 3 367.449 3.513 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N(C)[C@H](C)c1ccccc1Cl ZINC000826243551 607660387 /nfs/dbraw/zinc/66/03/87/607660387.db2.gz MGHACJWTPRUYEE-GFCCVEGCSA-N -1 3 355.829 3.662 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N(C)[C@H](C)c1ccccc1Cl ZINC000826243551 607660389 /nfs/dbraw/zinc/66/03/89/607660389.db2.gz MGHACJWTPRUYEE-GFCCVEGCSA-N -1 3 355.829 3.662 20 0 FHADHM Cc1c2ccccc2oc1[C@@H](C)NC(=O)c1ccc(-c2nnn[n-]2)cc1C ZINC000826246643 607666729 /nfs/dbraw/zinc/66/67/29/607666729.db2.gz IILXNXVAQFTYRO-CYBMUJFWSA-N -1 3 361.405 3.721 20 0 FHADHM Cc1c2ccccc2oc1[C@@H](C)NC(=O)c1ccc(-c2nn[n-]n2)cc1C ZINC000826246643 607666731 /nfs/dbraw/zinc/66/67/31/607666731.db2.gz IILXNXVAQFTYRO-CYBMUJFWSA-N -1 3 361.405 3.721 20 0 FHADHM Cc1ccc(CN(C(=O)c2ccc(-c3nnn[n-]3)cc2C)C(C)C)s1 ZINC000826287196 607671282 /nfs/dbraw/zinc/67/12/82/607671282.db2.gz GXBZJNRQGMXSPC-UHFFFAOYSA-N -1 3 355.467 3.596 20 0 FHADHM Cc1ccc(CN(C(=O)c2ccc(-c3nn[n-]n3)cc2C)C(C)C)s1 ZINC000826287196 607671284 /nfs/dbraw/zinc/67/12/84/607671284.db2.gz GXBZJNRQGMXSPC-UHFFFAOYSA-N -1 3 355.467 3.596 20 0 FHADHM CC(C)n1c2ccccc2nc1[C@H]1CCCN1C[C@@H]1CCN(C(=O)[O-])C1 ZINC000824515568 604099272 /nfs/dbraw/zinc/09/92/72/604099272.db2.gz QQZWSHCUSDBJQO-MAUKXSAKSA-N -1 3 356.470 3.754 20 0 FHADHM CCCN(C(=O)c1ccc(-c2nnn[n-]2)cc1C)[C@H]1CCc2ccccc21 ZINC000825302235 607674964 /nfs/dbraw/zinc/67/49/64/607674964.db2.gz YPXADJUWWGPDCO-IBGZPJMESA-N -1 3 361.449 3.715 20 0 FHADHM CCCN(C(=O)c1ccc(-c2nn[n-]n2)cc1C)[C@H]1CCc2ccccc21 ZINC000825302235 607674965 /nfs/dbraw/zinc/67/49/65/607674965.db2.gz YPXADJUWWGPDCO-IBGZPJMESA-N -1 3 361.449 3.715 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N(Cc1ccccc1)[C@H](C)C1CC1 ZINC000826244451 607686118 /nfs/dbraw/zinc/68/61/18/607686118.db2.gz SPLORDRCEJNYMF-OAHLLOKOSA-N -1 3 361.449 3.616 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N(Cc1ccccc1)[C@H](C)C1CC1 ZINC000826244451 607686121 /nfs/dbraw/zinc/68/61/21/607686121.db2.gz SPLORDRCEJNYMF-OAHLLOKOSA-N -1 3 361.449 3.616 20 0 FHADHM C[C@H](CC(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccc(F)cc1F ZINC000824384649 607692402 /nfs/dbraw/zinc/69/24/02/607692402.db2.gz FSPOCMQHUAUMOU-NEPJUHHUSA-N -1 3 371.391 3.516 20 0 FHADHM C[C@H](CC(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccc(F)cc1F ZINC000824384649 607692404 /nfs/dbraw/zinc/69/24/04/607692404.db2.gz FSPOCMQHUAUMOU-NEPJUHHUSA-N -1 3 371.391 3.516 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1C[C@H](C)C[C@@H]1c1cccc(F)c1 ZINC000826244535 607695853 /nfs/dbraw/zinc/69/58/53/607695853.db2.gz WMWKAUVKQJOKGF-KZULUSFZSA-N -1 3 365.412 3.538 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1C[C@H](C)C[C@@H]1c1cccc(F)c1 ZINC000826244535 607695855 /nfs/dbraw/zinc/69/58/55/607695855.db2.gz WMWKAUVKQJOKGF-KZULUSFZSA-N -1 3 365.412 3.538 20 0 FHADHM O=C([O-])[C@H](c1cc(Cl)cc(Cl)c1)N1CC[C@]2(O)CCCC[C@H]2C1 ZINC000833172413 604501581 /nfs/dbraw/zinc/50/15/81/604501581.db2.gz UZZFPMGZQWBLDK-YLQAJVPDSA-N -1 3 358.265 3.746 20 0 FHADHM CC(C)(C)n1cc(CN2CC[C@H](C(=O)[O-])C2)c(-c2ccccc2Cl)n1 ZINC000263426560 604546106 /nfs/dbraw/zinc/54/61/06/604546106.db2.gz QTOZUFBLVOQDNW-ZDUSSCGKSA-N -1 3 361.873 3.865 20 0 FHADHM CC(C)(C)[C@@H](NCc1coc(-c2ccc(C(F)(F)F)cc2)n1)C(=O)[O-] ZINC000833423397 604618323 /nfs/dbraw/zinc/61/83/23/604618323.db2.gz ATTMFWMOQHUNTI-ZDUSSCGKSA-N -1 3 356.344 3.949 20 0 FHADHM CCCN(C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@@H](C)c1cc2ccccc2o1 ZINC000825302053 607705413 /nfs/dbraw/zinc/70/54/13/607705413.db2.gz UTHMWVVMBWNABS-LBPRGKRZSA-N -1 3 364.409 3.554 20 0 FHADHM CCCN(C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@@H](C)c1cc2ccccc2o1 ZINC000825302053 607705414 /nfs/dbraw/zinc/70/54/14/607705414.db2.gz UTHMWVVMBWNABS-LBPRGKRZSA-N -1 3 364.409 3.554 20 0 FHADHM Cc1cc(Oc2ccc(-c3nnn[n-]3)cc2)ccc1NC(=O)[C@@H]1CC1(C)C ZINC000826272062 607706021 /nfs/dbraw/zinc/70/60/21/607706021.db2.gz SHNPBRPHJWRMAS-INIZCTEOSA-N -1 3 363.421 3.952 20 0 FHADHM Cc1cc(Oc2ccc(-c3nn[n-]n3)cc2)ccc1NC(=O)[C@@H]1CC1(C)C ZINC000826272062 607706023 /nfs/dbraw/zinc/70/60/23/607706023.db2.gz SHNPBRPHJWRMAS-INIZCTEOSA-N -1 3 363.421 3.952 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1cccc(C(F)(F)F)c1C ZINC000826250519 607707554 /nfs/dbraw/zinc/70/75/54/607707554.db2.gz FHKVMTAHANEEKY-UHFFFAOYSA-N -1 3 361.327 3.755 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1cccc(C(F)(F)F)c1C ZINC000826250519 607707555 /nfs/dbraw/zinc/70/75/55/607707555.db2.gz FHKVMTAHANEEKY-UHFFFAOYSA-N -1 3 361.327 3.755 20 0 FHADHM CC(C)(C(=O)[O-])[C@H]1CCCN(Cc2coc(-c3c(F)cccc3F)n2)C1 ZINC000833418819 604940717 /nfs/dbraw/zinc/94/07/17/604940717.db2.gz BBGXBIHIYRIVGP-LBPRGKRZSA-N -1 3 364.392 3.943 20 0 FHADHM CC(C)(C(=O)[O-])[C@H]1CCCN(CC(=O)Nc2cccc3ccccc32)C1 ZINC000833420939 604943649 /nfs/dbraw/zinc/94/36/49/604943649.db2.gz CXLZQUZPNUZXBC-INIZCTEOSA-N -1 3 354.450 3.601 20 0 FHADHM CCc1nc2ccccc2n1C1CCN(Cc2ccoc2C(=O)[O-])CC1 ZINC000833677493 604962875 /nfs/dbraw/zinc/96/28/75/604962875.db2.gz RKBBKPAZFJZTNA-UHFFFAOYSA-N -1 3 353.422 3.727 20 0 FHADHM CC(C)(COc1ncc(Cl)cc1Cl)NCc1ccoc1C(=O)[O-] ZINC000833461568 604989535 /nfs/dbraw/zinc/98/95/35/604989535.db2.gz FVGBNRLQPZTBIV-UHFFFAOYSA-N -1 3 359.209 3.627 20 0 FHADHM CC(C)(COc1ncc(Cl)cc1Cl)NCc1ccc(C(=O)[O-])o1 ZINC000833461979 604989596 /nfs/dbraw/zinc/98/95/96/604989596.db2.gz OOQBSDIUQFCMDB-UHFFFAOYSA-N -1 3 359.209 3.627 20 0 FHADHM C[C@]1(NCc2csc(COc3ccccc3)n2)CCCC[C@H]1C(=O)[O-] ZINC000833568902 605059778 /nfs/dbraw/zinc/05/97/78/605059778.db2.gz IGTJVCHVBMJAAK-LPHOPBHVSA-N -1 3 360.479 3.845 20 0 FHADHM Cc1noc(C)c1[C@@H](C)CNc1ccc(-c2nn[n-]n2)cc1C(F)(F)F ZINC000826339206 607734288 /nfs/dbraw/zinc/73/42/88/607734288.db2.gz VVJASKAXZYFTTE-QMMMGPOBSA-N -1 3 366.347 3.706 20 0 FHADHM CC(C)(CNCc1csc(COc2ccc(Cl)cc2)n1)C(=O)[O-] ZINC000277059685 605112157 /nfs/dbraw/zinc/11/21/57/605112157.db2.gz UDSBAQADUBYQLE-UHFFFAOYSA-N -1 3 354.859 3.576 20 0 FHADHM Cc1c([C@H](C)NCCc2ccc(NC(=O)[O-])cc2)nnn1-c1ccccc1 ZINC000829859366 605113756 /nfs/dbraw/zinc/11/37/56/605113756.db2.gz MFHYVKDMNAATCZ-AWEZNQCLSA-N -1 3 365.437 3.559 20 0 FHADHM CC(C)(C(=O)[O-])[C@@H](NCC(=O)Nc1ccc(Cl)cc1)c1ccccc1 ZINC000833413583 605175185 /nfs/dbraw/zinc/17/51/85/605175185.db2.gz ODHATHBANWSCEX-KRWDZBQOSA-N -1 3 360.841 3.720 20 0 FHADHM CC(C)(C(=O)[O-])[C@@H](NCc1cc(F)cc2c1OCOC2)c1ccccc1 ZINC000833414357 605180123 /nfs/dbraw/zinc/18/01/23/605180123.db2.gz MESFURYZALWBLS-SFHVURJKSA-N -1 3 359.397 3.634 20 0 FHADHM CC(C)(C)CCN1CCN(C(=O)Nc2ccc(NC(=O)[O-])c(F)c2)CC1 ZINC000833429426 605282879 /nfs/dbraw/zinc/28/28/79/605282879.db2.gz LVTMRYHBGHVMGS-UHFFFAOYSA-N -1 3 366.437 3.501 20 0 FHADHM Cc1ccn(-c2ccccc2CNCc2cccc3c2N(C(=O)[O-])CC3)n1 ZINC000830602414 605285237 /nfs/dbraw/zinc/28/52/37/605285237.db2.gz XLFHRVLGJKZWDZ-UHFFFAOYSA-N -1 3 362.433 3.511 20 0 FHADHM CC1(C)CCCC[C@@H]1CC(=O)NC1(c2cccc(-c3nnn[n-]3)c2)CC1 ZINC000824803098 607756961 /nfs/dbraw/zinc/75/69/61/607756961.db2.gz SOXJSFCGOZOELP-OAHLLOKOSA-N -1 3 353.470 3.579 20 0 FHADHM CC1(C)CCCC[C@@H]1CC(=O)NC1(c2cccc(-c3nn[n-]n3)c2)CC1 ZINC000824803098 607756962 /nfs/dbraw/zinc/75/69/62/607756962.db2.gz SOXJSFCGOZOELP-OAHLLOKOSA-N -1 3 353.470 3.579 20 0 FHADHM CCCC1(C(=O)Nc2nc(-c3cccc(-c4nnn[n-]4)c3)cs2)CC1 ZINC000825247769 607768358 /nfs/dbraw/zinc/76/83/58/607768358.db2.gz HIBGMHCWFKDUPO-UHFFFAOYSA-N -1 3 354.439 3.509 20 0 FHADHM CCCC1(C(=O)Nc2nc(-c3cccc(-c4nn[n-]n4)c3)cs2)CC1 ZINC000825247769 607768359 /nfs/dbraw/zinc/76/83/59/607768359.db2.gz HIBGMHCWFKDUPO-UHFFFAOYSA-N -1 3 354.439 3.509 20 0 FHADHM CCC[C@@H](C)CC(=O)Nc1nc(-c2cccc(-c3nnn[n-]3)c2)cs1 ZINC000825233556 607769255 /nfs/dbraw/zinc/76/92/55/607769255.db2.gz QRYOKJCTTUSBSE-LLVKDONJSA-N -1 3 356.455 3.755 20 0 FHADHM CCC[C@@H](C)CC(=O)Nc1nc(-c2cccc(-c3nn[n-]n3)c2)cs1 ZINC000825233556 607769256 /nfs/dbraw/zinc/76/92/56/607769256.db2.gz QRYOKJCTTUSBSE-LLVKDONJSA-N -1 3 356.455 3.755 20 0 FHADHM Cc1cc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)ccc1NC(=O)[O-] ZINC000829944405 605874159 /nfs/dbraw/zinc/87/41/59/605874159.db2.gz BCAAYEUFMDNQHH-LJQANCHMSA-N -1 3 367.449 3.652 20 0 FHADHM COc1cccc2c1CC[C@@H]2N[C@@H](C)c1ccc(CNC(=O)[O-])nc1C ZINC000833891952 605989910 /nfs/dbraw/zinc/98/99/10/605989910.db2.gz WWIJLBRXCGNERK-UGSOOPFHSA-N -1 3 355.438 3.504 20 0 FHADHM CC[C@@H]1CN(C(=O)c2sccc2-c2nnn[n-]2)CC[C@@H]1c1ccccc1 ZINC000820994989 606030138 /nfs/dbraw/zinc/03/01/38/606030138.db2.gz LVRCQXIVVNCDGC-HIFRSBDPSA-N -1 3 367.478 3.584 20 0 FHADHM CC[C@@H]1CN(C(=O)c2sccc2-c2nn[n-]n2)CC[C@@H]1c1ccccc1 ZINC000820994989 606030145 /nfs/dbraw/zinc/03/01/45/606030145.db2.gz LVRCQXIVVNCDGC-HIFRSBDPSA-N -1 3 367.478 3.584 20 0 FHADHM CCO[C@@H](CCNc1ccc(-c2nn[n-]n2)cc1C(F)(F)F)C(C)C ZINC000821350823 606038210 /nfs/dbraw/zinc/03/82/10/606038210.db2.gz DWUNINOCHLQHKJ-AWEZNQCLSA-N -1 3 357.380 3.749 20 0 FHADHM Fc1cccc([C@H]2CCN(c3nc4ccccc4cc3-c3nnn[n-]3)C2)c1 ZINC000822786251 606075040 /nfs/dbraw/zinc/07/50/40/606075040.db2.gz GLZRCINRTKCSAB-HNNXBMFYSA-N -1 3 360.396 3.548 20 0 FHADHM Fc1cccc([C@H]2CCN(c3nc4ccccc4cc3-c3nn[n-]n3)C2)c1 ZINC000822786251 606075046 /nfs/dbraw/zinc/07/50/46/606075046.db2.gz GLZRCINRTKCSAB-HNNXBMFYSA-N -1 3 360.396 3.548 20 0 FHADHM O=C([O-])NC1CCC(N[C@@H]2CCc3c2c(Br)ccc3F)CC1 ZINC000834164106 606076049 /nfs/dbraw/zinc/07/60/49/606076049.db2.gz FTRVYZOQZBXMPQ-RPFQZYLTSA-N -1 3 371.250 3.744 20 0 FHADHM Cc1cccc2oc(CCNc3nc4ccccc4cc3-c3nnn[n-]3)nc21 ZINC000822340758 606097296 /nfs/dbraw/zinc/09/72/96/606097296.db2.gz GIZHMOLIZIKJNP-UHFFFAOYSA-N -1 3 371.404 3.519 20 0 FHADHM Cc1cccc2oc(CCNc3nc4ccccc4cc3-c3nn[n-]n3)nc21 ZINC000822340758 606097300 /nfs/dbraw/zinc/09/73/00/606097300.db2.gz GIZHMOLIZIKJNP-UHFFFAOYSA-N -1 3 371.404 3.519 20 0 FHADHM C[C@@H](NC(=O)[C@@H](C)c1ccc(Cl)s1)c1cccc(-c2nnn[n-]2)c1 ZINC000820314449 606116769 /nfs/dbraw/zinc/11/67/69/606116769.db2.gz IZYFNWSMWCFLEU-VHSXEESVSA-N -1 3 361.858 3.563 20 0 FHADHM C[C@@H](NC(=O)[C@@H](C)c1ccc(Cl)s1)c1cccc(-c2nn[n-]n2)c1 ZINC000820314449 606116771 /nfs/dbraw/zinc/11/67/71/606116771.db2.gz IZYFNWSMWCFLEU-VHSXEESVSA-N -1 3 361.858 3.563 20 0 FHADHM COc1ccccc1[C@H]1CCCN1c1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000821889521 606124951 /nfs/dbraw/zinc/12/49/51/606124951.db2.gz BZFVSJHXEHSSKT-GOSISDBHSA-N -1 3 372.432 3.765 20 0 FHADHM COc1ccccc1[C@H]1CCCN1c1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000821889521 606124953 /nfs/dbraw/zinc/12/49/53/606124953.db2.gz BZFVSJHXEHSSKT-GOSISDBHSA-N -1 3 372.432 3.765 20 0 FHADHM C[C@H](C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccc(Cl)s1 ZINC000820480885 606127226 /nfs/dbraw/zinc/12/72/26/606127226.db2.gz QEEKDTWJKCCHSL-UWVGGRQHSA-N -1 3 362.842 3.990 20 0 FHADHM C[C@H](C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccc(Cl)s1 ZINC000820480885 606127228 /nfs/dbraw/zinc/12/72/28/606127228.db2.gz QEEKDTWJKCCHSL-UWVGGRQHSA-N -1 3 362.842 3.990 20 0 FHADHM COc1ccc([C@@H](C)CC(=O)O[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000821777118 606127791 /nfs/dbraw/zinc/12/77/91/606127791.db2.gz APMWEKKHVZYMTH-KBPBESRZSA-N -1 3 366.421 3.673 20 0 FHADHM COc1ccc([C@@H](C)CC(=O)O[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000821777118 606127792 /nfs/dbraw/zinc/12/77/92/606127792.db2.gz APMWEKKHVZYMTH-KBPBESRZSA-N -1 3 366.421 3.673 20 0 FHADHM C[C@@H](OC(=O)Cc1ccc(-c2nnn[n-]2)cc1)c1c(F)cccc1Cl ZINC000820494961 606134378 /nfs/dbraw/zinc/13/43/78/606134378.db2.gz DNURVTBECUGVMU-SNVBAGLBSA-N -1 3 360.776 3.506 20 0 FHADHM C[C@@H](OC(=O)Cc1ccc(-c2nn[n-]n2)cc1)c1c(F)cccc1Cl ZINC000820494961 606134380 /nfs/dbraw/zinc/13/43/80/606134380.db2.gz DNURVTBECUGVMU-SNVBAGLBSA-N -1 3 360.776 3.506 20 0 FHADHM C[C@@H](NC(=O)c1c(Cl)cccc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000820386422 606136234 /nfs/dbraw/zinc/13/62/34/606136234.db2.gz YTWUOBWTWLSWBB-SECBINFHSA-N -1 3 362.220 3.665 20 0 FHADHM C[C@@H](NC(=O)c1c(Cl)cccc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000820386422 606136235 /nfs/dbraw/zinc/13/62/35/606136235.db2.gz YTWUOBWTWLSWBB-SECBINFHSA-N -1 3 362.220 3.665 20 0 FHADHM CC[C@H](Oc1cccc(C)c1)C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820939466 606179972 /nfs/dbraw/zinc/17/99/72/606179972.db2.gz VCHNBEPVFHLQDD-KSSFIOAISA-N -1 3 366.421 3.637 20 0 FHADHM CC[C@H](Oc1cccc(C)c1)C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820939466 606179973 /nfs/dbraw/zinc/17/99/73/606179973.db2.gz VCHNBEPVFHLQDD-KSSFIOAISA-N -1 3 366.421 3.637 20 0 FHADHM O=[S@@](Cc1ccc(-c2nnn[n-]2)cc1)Cc1ccc(-c2ccccc2)cc1 ZINC000823606846 606180361 /nfs/dbraw/zinc/18/03/61/606180361.db2.gz OCCAYVOAULUZSR-HHHXNRCGSA-N -1 3 374.469 3.983 20 0 FHADHM O=[S@@](Cc1ccc(-c2nn[n-]n2)cc1)Cc1ccc(-c2ccccc2)cc1 ZINC000823606846 606180362 /nfs/dbraw/zinc/18/03/62/606180362.db2.gz OCCAYVOAULUZSR-HHHXNRCGSA-N -1 3 374.469 3.983 20 0 FHADHM CCCN(CC1CC1)C(=O)c1ccccc1-c1ccccc1-c1nnn[n-]1 ZINC000821094328 606203503 /nfs/dbraw/zinc/20/35/03/606203503.db2.gz GRMGIPMMMLQJIE-UHFFFAOYSA-N -1 3 361.449 3.796 20 0 FHADHM CCCN(CC1CC1)C(=O)c1ccccc1-c1ccccc1-c1nn[n-]n1 ZINC000821094328 606203505 /nfs/dbraw/zinc/20/35/05/606203505.db2.gz GRMGIPMMMLQJIE-UHFFFAOYSA-N -1 3 361.449 3.796 20 0 FHADHM Oc1ccc(C2CCN(c3ccc(Cl)cc3-c3nnn[n-]3)CC2)cc1 ZINC000823726926 606214100 /nfs/dbraw/zinc/21/41/00/606214100.db2.gz IWSSUWPUEMALEL-UHFFFAOYSA-N -1 3 355.829 3.610 20 0 FHADHM Oc1ccc(C2CCN(c3ccc(Cl)cc3-c3nn[n-]n3)CC2)cc1 ZINC000823726926 606214103 /nfs/dbraw/zinc/21/41/03/606214103.db2.gz IWSSUWPUEMALEL-UHFFFAOYSA-N -1 3 355.829 3.610 20 0 FHADHM CC[C@@H](NCc1cc(-c2nnn[n-]2)cs1)c1nc(C(F)(F)F)cs1 ZINC000820926357 606224557 /nfs/dbraw/zinc/22/45/57/606224557.db2.gz RMRRJYPPECBTJL-SECBINFHSA-N -1 3 374.417 3.644 20 0 FHADHM CC[C@@H](NCc1cc(-c2nn[n-]n2)cs1)c1nc(C(F)(F)F)cs1 ZINC000820926357 606224559 /nfs/dbraw/zinc/22/45/59/606224559.db2.gz RMRRJYPPECBTJL-SECBINFHSA-N -1 3 374.417 3.644 20 0 FHADHM C[C@H]1[C@H](c2ccccc2)CCN1c1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000820643654 606233934 /nfs/dbraw/zinc/23/39/34/606233934.db2.gz YCYPNXRITZIUKT-WCQYABFASA-N -1 3 374.370 3.663 20 0 FHADHM C[C@H]1[C@H](c2ccccc2)CCN1c1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000820643654 606233936 /nfs/dbraw/zinc/23/39/36/606233936.db2.gz YCYPNXRITZIUKT-WCQYABFASA-N -1 3 374.370 3.663 20 0 FHADHM CC(C)n1c2ccccc2nc1[C@H]1CCCN1c1ccc(-c2nnn[n-]2)cn1 ZINC000820211250 606239930 /nfs/dbraw/zinc/23/99/30/606239930.db2.gz FLHDCYUWXQQQLQ-QGZVFWFLSA-N -1 3 374.452 3.534 20 0 FHADHM CC(C)n1c2ccccc2nc1[C@H]1CCCN1c1ccc(-c2nn[n-]n2)cn1 ZINC000820211250 606239931 /nfs/dbraw/zinc/23/99/31/606239931.db2.gz FLHDCYUWXQQQLQ-QGZVFWFLSA-N -1 3 374.452 3.534 20 0 FHADHM CCn1c2ccccc2c2cc(NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)ccc21 ZINC000821565326 606246754 /nfs/dbraw/zinc/24/67/54/606246754.db2.gz NTWUUVNRNXDQQY-UHFFFAOYSA-N -1 3 371.404 3.575 20 0 FHADHM CCn1c2ccccc2c2cc(NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)ccc21 ZINC000821565326 606246756 /nfs/dbraw/zinc/24/67/56/606246756.db2.gz NTWUUVNRNXDQQY-UHFFFAOYSA-N -1 3 371.404 3.575 20 0 FHADHM CCC1(C(=O)NCc2cccc(-c3ccc(-c4nnn[n-]4)s3)c2)CCC1 ZINC000820945840 606256180 /nfs/dbraw/zinc/25/61/80/606256180.db2.gz YFEWTFOQNJIGPI-UHFFFAOYSA-N -1 3 367.478 3.792 20 0 FHADHM O=C(Oc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1)[C@H]1C[C@H]1C1CC1 ZINC000823453823 606260761 /nfs/dbraw/zinc/26/07/61/606260761.db2.gz ATQANMIKQNMSPT-ROUUACIJSA-N -1 3 362.389 3.611 20 0 FHADHM O=C(Oc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1)[C@H]1C[C@H]1C1CC1 ZINC000823453823 606260762 /nfs/dbraw/zinc/26/07/62/606260762.db2.gz ATQANMIKQNMSPT-ROUUACIJSA-N -1 3 362.389 3.611 20 0 FHADHM CC(C)c1ccc(OCCC(=O)Nc2ccc(F)cc2-c2nnn[n-]2)cc1 ZINC000820192763 606272407 /nfs/dbraw/zinc/27/24/07/606272407.db2.gz YMTRMWXFIDFJAZ-UHFFFAOYSA-N -1 3 369.400 3.537 20 0 FHADHM CC(C)c1ccc(OCCC(=O)Nc2ccc(F)cc2-c2nn[n-]n2)cc1 ZINC000820192763 606272409 /nfs/dbraw/zinc/27/24/09/606272409.db2.gz YMTRMWXFIDFJAZ-UHFFFAOYSA-N -1 3 369.400 3.537 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)c1cc(Cl)sc1Cl ZINC000823344489 606273263 /nfs/dbraw/zinc/27/32/63/606273263.db2.gz XDVXQFWXQZSGDM-UHFFFAOYSA-N -1 3 358.185 3.626 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)c1cc(Cl)sc1Cl ZINC000823344489 606273264 /nfs/dbraw/zinc/27/32/64/606273264.db2.gz XDVXQFWXQZSGDM-UHFFFAOYSA-N -1 3 358.185 3.626 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)c1ccc(Oc2ccccc2)o1 ZINC000823347565 606273513 /nfs/dbraw/zinc/27/35/13/606273513.db2.gz ZUTQIHYIFRPUHS-UHFFFAOYSA-N -1 3 365.324 3.643 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)c1ccc(Oc2ccccc2)o1 ZINC000823347565 606273514 /nfs/dbraw/zinc/27/35/14/606273514.db2.gz ZUTQIHYIFRPUHS-UHFFFAOYSA-N -1 3 365.324 3.643 20 0 FHADHM COc1cc2nc(C=Cc3cc(-c4nnn[n-]4)cs3)sc2cc1OC ZINC000821728036 606305834 /nfs/dbraw/zinc/30/58/34/606305834.db2.gz QYYHOXICXSWXHA-ONEGZZNKSA-N -1 3 371.447 3.726 20 0 FHADHM COc1cc2nc(C=Cc3cc(-c4nn[n-]n4)cs3)sc2cc1OC ZINC000821728036 606305835 /nfs/dbraw/zinc/30/58/35/606305835.db2.gz QYYHOXICXSWXHA-ONEGZZNKSA-N -1 3 371.447 3.726 20 0 FHADHM CC[C@@H](Sc1cccc(-c2nnn[n-]2)c1)C(=O)c1ccc(OC)cc1 ZINC000820937932 606327401 /nfs/dbraw/zinc/32/74/01/606327401.db2.gz FJQLAHZCCKAZCW-MRXNPFEDSA-N -1 3 354.435 3.629 20 0 FHADHM CC[C@@H](Sc1cccc(-c2nn[n-]n2)c1)C(=O)c1ccc(OC)cc1 ZINC000820937932 606327403 /nfs/dbraw/zinc/32/74/03/606327403.db2.gz FJQLAHZCCKAZCW-MRXNPFEDSA-N -1 3 354.435 3.629 20 0 FHADHM CC(C)Oc1cccc(CC(=O)O[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000820177836 606341534 /nfs/dbraw/zinc/34/15/34/606341534.db2.gz BHWOWMFDAUNYMX-AWEZNQCLSA-N -1 3 366.421 3.501 20 0 FHADHM CC(C)Oc1cccc(CC(=O)O[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000820177836 606341535 /nfs/dbraw/zinc/34/15/35/606341535.db2.gz BHWOWMFDAUNYMX-AWEZNQCLSA-N -1 3 366.421 3.501 20 0 FHADHM C[C@@H](CCOc1ccccc1)C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820249561 606341635 /nfs/dbraw/zinc/34/16/35/606341635.db2.gz WSHOBPLKWUFNBE-GJZGRUSLSA-N -1 3 366.421 3.576 20 0 FHADHM C[C@@H](CCOc1ccccc1)C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820249561 606341637 /nfs/dbraw/zinc/34/16/37/606341637.db2.gz WSHOBPLKWUFNBE-GJZGRUSLSA-N -1 3 366.421 3.576 20 0 FHADHM C[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820678620 606342313 /nfs/dbraw/zinc/34/23/13/606342313.db2.gz WKOKPLBXFZHSDD-HFAKWTLXSA-N -1 3 360.849 3.705 20 0 FHADHM C[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820678620 606342315 /nfs/dbraw/zinc/34/23/15/606342315.db2.gz WKOKPLBXFZHSDD-HFAKWTLXSA-N -1 3 360.849 3.705 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CC[C@@H](c2ccccc2)[C@H]1C ZINC000822218194 606345321 /nfs/dbraw/zinc/34/53/21/606345321.db2.gz ZNDQFJRMTNYJJL-RHSMWYFYSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CC[C@@H](c2ccccc2)[C@H]1C ZINC000822218194 606345323 /nfs/dbraw/zinc/34/53/23/606345323.db2.gz ZNDQFJRMTNYJJL-RHSMWYFYSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1ccc2c(CC(=O)O[C@@H](C)c3ccc(-c4nnn[n-]4)cc3)c[nH]c2c1 ZINC000822275880 606356857 /nfs/dbraw/zinc/35/68/57/606356857.db2.gz ZATKNOARBSLJQE-ZDUSSCGKSA-N -1 3 361.405 3.503 20 0 FHADHM Cc1ccc2c(CC(=O)O[C@@H](C)c3ccc(-c4nn[n-]n4)cc3)c[nH]c2c1 ZINC000822275880 606356859 /nfs/dbraw/zinc/35/68/59/606356859.db2.gz ZATKNOARBSLJQE-ZDUSSCGKSA-N -1 3 361.405 3.503 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccc(Cl)s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488986 606357341 /nfs/dbraw/zinc/35/73/41/606357341.db2.gz XPVGTNFCWMWWBO-RNKPRXRFSA-N -1 3 360.826 3.899 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccc(Cl)s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488986 606357343 /nfs/dbraw/zinc/35/73/43/606357343.db2.gz XPVGTNFCWMWWBO-RNKPRXRFSA-N -1 3 360.826 3.899 20 0 FHADHM Cc1cc(OCC(=O)O[C@H](C)c2ccc(-c3nnn[n-]3)cc2)ccc1Cl ZINC000822210525 606358804 /nfs/dbraw/zinc/35/88/04/606358804.db2.gz FYTIEVLPMOASPG-GFCCVEGCSA-N -1 3 372.812 3.512 20 0 FHADHM Cc1cc(OCC(=O)O[C@H](C)c2ccc(-c3nn[n-]n3)cc2)ccc1Cl ZINC000822210525 606358806 /nfs/dbraw/zinc/35/88/06/606358806.db2.gz FYTIEVLPMOASPG-GFCCVEGCSA-N -1 3 372.812 3.512 20 0 FHADHM Cc1cc(C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)c(F)cc1F ZINC000822167887 606363388 /nfs/dbraw/zinc/36/33/88/606363388.db2.gz JROVCOPAENEIJB-UHFFFAOYSA-N -1 3 371.391 3.504 20 0 FHADHM Cc1cc(C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)c(F)cc1F ZINC000822167887 606363390 /nfs/dbraw/zinc/36/33/90/606363390.db2.gz JROVCOPAENEIJB-UHFFFAOYSA-N -1 3 371.391 3.504 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)c2cnc3ccccc3c2C)s1 ZINC000821466433 606372813 /nfs/dbraw/zinc/37/28/13/606372813.db2.gz WQRDZAQMZSAUQV-UHFFFAOYSA-N -1 3 364.434 3.600 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)c2cnc3ccccc3c2C)s1 ZINC000821466433 606372814 /nfs/dbraw/zinc/37/28/14/606372814.db2.gz WQRDZAQMZSAUQV-UHFFFAOYSA-N -1 3 364.434 3.600 20 0 FHADHM CC[C@@H](Sc1ccccc1)C(=O)OCc1cc(-c2nnn[n-]2)ccc1F ZINC000820938905 606373819 /nfs/dbraw/zinc/37/38/19/606373819.db2.gz OIXLXOAUORMVKZ-MRXNPFEDSA-N -1 3 372.425 3.620 20 0 FHADHM CC[C@@H](Sc1ccccc1)C(=O)OCc1cc(-c2nn[n-]n2)ccc1F ZINC000820938905 606373821 /nfs/dbraw/zinc/37/38/21/606373821.db2.gz OIXLXOAUORMVKZ-MRXNPFEDSA-N -1 3 372.425 3.620 20 0 FHADHM COc1cc2nc(C=Cc3ccc(-c4nnn[n-]4)s3)sc2cc1OC ZINC000821728643 606390376 /nfs/dbraw/zinc/39/03/76/606390376.db2.gz XXJVENTXQOLZPR-XQRVVYSFSA-N -1 3 371.447 3.726 20 0 FHADHM COc1cccc(C(C)=CC(=O)O[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000821859200 606409607 /nfs/dbraw/zinc/40/96/07/606409607.db2.gz MIOJAESWQDJIME-QLKUMGTLSA-N -1 3 364.405 3.583 20 0 FHADHM COc1cccc(C(C)=CC(=O)O[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000821859200 606409609 /nfs/dbraw/zinc/40/96/09/606409609.db2.gz MIOJAESWQDJIME-QLKUMGTLSA-N -1 3 364.405 3.583 20 0 FHADHM Cc1ccc(CCCC(=O)N(C)c2cc(Cl)ccc2-c2nnn[n-]2)cc1 ZINC000822236216 606413179 /nfs/dbraw/zinc/41/31/79/606413179.db2.gz OSUONRYMSBBAMQ-UHFFFAOYSA-N -1 3 369.856 3.814 20 0 FHADHM Cc1ccc(CCCC(=O)N(C)c2cc(Cl)ccc2-c2nn[n-]n2)cc1 ZINC000822236216 606413182 /nfs/dbraw/zinc/41/31/82/606413182.db2.gz OSUONRYMSBBAMQ-UHFFFAOYSA-N -1 3 369.856 3.814 20 0 FHADHM C[C@@H](NC(=O)Nc1cccc(-c2nnn[n-]2)c1)c1c(F)cccc1Cl ZINC000820380276 606437411 /nfs/dbraw/zinc/43/74/11/606437411.db2.gz PAOLEOIMIMJLNF-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM C[C@@H](NC(=O)Nc1cccc(-c2nn[n-]n2)c1)c1c(F)cccc1Cl ZINC000820380276 606437412 /nfs/dbraw/zinc/43/74/12/606437412.db2.gz PAOLEOIMIMJLNF-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc(-c2nnn[n-]2)cc1)c1c(F)cccc1Cl ZINC000820372540 606437735 /nfs/dbraw/zinc/43/77/35/606437735.db2.gz ANVYXUZKDXLXMH-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc(-c2nn[n-]n2)cc1)c1c(F)cccc1Cl ZINC000820372540 606437737 /nfs/dbraw/zinc/43/77/37/606437737.db2.gz ANVYXUZKDXLXMH-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM C[C@@H](NC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1c(F)cccc1Cl ZINC000820321942 606444172 /nfs/dbraw/zinc/44/41/72/606444172.db2.gz OMRLNNXAFBSTRI-PBQZMEPESA-N -1 3 371.803 3.550 20 0 FHADHM C[C@@H](NC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1c(F)cccc1Cl ZINC000820321942 606444174 /nfs/dbraw/zinc/44/41/74/606444174.db2.gz OMRLNNXAFBSTRI-PBQZMEPESA-N -1 3 371.803 3.550 20 0 FHADHM FC(F)(F)[C@@H]1CCC[C@H](Nc2cc(-c3nnn[n-]3)c3ccccc3n2)C1 ZINC000822714376 606447303 /nfs/dbraw/zinc/44/73/03/606447303.db2.gz MRNWOJVKTLDJMP-MNOVXSKESA-N -1 3 362.359 3.948 20 0 FHADHM FC(F)(F)[C@@H]1CCC[C@H](Nc2cc(-c3nn[n-]n3)c3ccccc3n2)C1 ZINC000822714376 606447304 /nfs/dbraw/zinc/44/73/04/606447304.db2.gz MRNWOJVKTLDJMP-MNOVXSKESA-N -1 3 362.359 3.948 20 0 FHADHM O=C(C[C@H]1C=CCC1)Nc1ccccc1NCc1cccc(-c2nnn[n-]2)c1 ZINC000822941527 606459406 /nfs/dbraw/zinc/45/94/06/606459406.db2.gz YNDPIOOLYXFLDK-HNNXBMFYSA-N -1 3 374.448 3.774 20 0 FHADHM O=C(C[C@H]1C=CCC1)Nc1ccccc1NCc1cccc(-c2nn[n-]n2)c1 ZINC000822941527 606459407 /nfs/dbraw/zinc/45/94/07/606459407.db2.gz YNDPIOOLYXFLDK-HNNXBMFYSA-N -1 3 374.448 3.774 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccc2ccccc2n1)c1cccc(-c2nnn[n-]2)c1 ZINC000820487775 606464985 /nfs/dbraw/zinc/46/49/85/606464985.db2.gz IQKPAZAMIHHKMA-NYHXXUGCSA-N -1 3 371.400 3.733 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccc2ccccc2n1)c1cccc(-c2nn[n-]n2)c1 ZINC000820487775 606464987 /nfs/dbraw/zinc/46/49/87/606464987.db2.gz IQKPAZAMIHHKMA-NYHXXUGCSA-N -1 3 371.400 3.733 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)O[C@@H](C1CCCC1)C(F)(F)F ZINC000822936500 606471028 /nfs/dbraw/zinc/47/10/28/606471028.db2.gz VGBBCIKZKAFASL-KVPUOBJLSA-N -1 3 366.343 3.544 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)O[C@@H](C1CCCC1)C(F)(F)F ZINC000822936500 606471030 /nfs/dbraw/zinc/47/10/30/606471030.db2.gz VGBBCIKZKAFASL-KVPUOBJLSA-N -1 3 366.343 3.544 20 0 FHADHM Cc1ccc([C@H]2CCCCN2c2ncc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000822233739 606476497 /nfs/dbraw/zinc/47/64/97/606476497.db2.gz UJHGCZIDNIQSPX-MRXNPFEDSA-N -1 3 354.845 3.955 20 0 FHADHM Cc1ccc([C@H]2CCCCN2c2ncc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000822233739 606476498 /nfs/dbraw/zinc/47/64/98/606476498.db2.gz UJHGCZIDNIQSPX-MRXNPFEDSA-N -1 3 354.845 3.955 20 0 FHADHM C[C@H](NC(=O)c1cc(-c2nnn[n-]2)cs1)c1ccc(Cl)cc1Cl ZINC000820391378 606479526 /nfs/dbraw/zinc/47/95/26/606479526.db2.gz OMOZVWKMDHLNCM-ZETCQYMHSA-N -1 3 368.249 3.726 20 0 FHADHM C[C@H](NC(=O)c1cc(-c2nn[n-]n2)cs1)c1ccc(Cl)cc1Cl ZINC000820391378 606479528 /nfs/dbraw/zinc/47/95/28/606479528.db2.gz OMOZVWKMDHLNCM-ZETCQYMHSA-N -1 3 368.249 3.726 20 0 FHADHM CCc1oc2ccccc2c1CN(C)C(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000821563868 606485392 /nfs/dbraw/zinc/48/53/92/606485392.db2.gz JCNVLPJQYZTJTA-UHFFFAOYSA-N -1 3 367.434 3.509 20 0 FHADHM CCc1oc2ccccc2c1CN(C)C(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000821563868 606485393 /nfs/dbraw/zinc/48/53/93/606485393.db2.gz JCNVLPJQYZTJTA-UHFFFAOYSA-N -1 3 367.434 3.509 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)c3cc(-c4nnn[n-]4)cs3)cc2)cs1 ZINC000822418979 606485803 /nfs/dbraw/zinc/48/58/03/606485803.db2.gz KWQSRCFPSJBHJN-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)c3cc(-c4nn[n-]n4)cs3)cc2)cs1 ZINC000822418979 606485805 /nfs/dbraw/zinc/48/58/05/606485805.db2.gz KWQSRCFPSJBHJN-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM CCCCN(Cc1ccccc1F)C(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000821066656 606491959 /nfs/dbraw/zinc/49/19/59/606491959.db2.gz VTASCQPSYDWDAC-UHFFFAOYSA-N -1 3 359.430 3.510 20 0 FHADHM CCCCN(Cc1ccccc1F)C(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000821066656 606491960 /nfs/dbraw/zinc/49/19/60/606491960.db2.gz VTASCQPSYDWDAC-UHFFFAOYSA-N -1 3 359.430 3.510 20 0 FHADHM O=C(c1cc(-c2nnn[n-]2)cs1)N(C1CC1)[C@@H]1CCCc2ccccc21 ZINC000823466707 606492370 /nfs/dbraw/zinc/49/23/70/606492370.db2.gz OIRSNGIMKYDSSI-MRXNPFEDSA-N -1 3 365.462 3.610 20 0 FHADHM O=C(c1cc(-c2nn[n-]n2)cs1)N(C1CC1)[C@@H]1CCCc2ccccc21 ZINC000823466707 606492372 /nfs/dbraw/zinc/49/23/72/606492372.db2.gz OIRSNGIMKYDSSI-MRXNPFEDSA-N -1 3 365.462 3.610 20 0 FHADHM CCC(CC)[C@@H](NC(=O)c1cc(-c2nnn[n-]2)cs1)c1cccs1 ZINC000820893585 606497278 /nfs/dbraw/zinc/49/72/78/606497278.db2.gz RWCYYQAELFWVNJ-CQSZACIVSA-N -1 3 361.496 3.897 20 0 FHADHM CCC(CC)[C@@H](NC(=O)c1cc(-c2nn[n-]n2)cs1)c1cccs1 ZINC000820893585 606497280 /nfs/dbraw/zinc/49/72/80/606497280.db2.gz RWCYYQAELFWVNJ-CQSZACIVSA-N -1 3 361.496 3.897 20 0 FHADHM CC(C)[C@@H](C(=O)NCc1ccc(-c2nnn[n-]2)cc1)c1cccc(Cl)c1 ZINC000487234507 606502930 /nfs/dbraw/zinc/50/29/30/606502930.db2.gz IPXLMWJECQIJOF-QGZVFWFLSA-N -1 3 369.856 3.576 20 0 FHADHM CC(C)[C@@H](C(=O)NCc1ccc(-c2nn[n-]n2)cc1)c1cccc(Cl)c1 ZINC000487234507 606502931 /nfs/dbraw/zinc/50/29/31/606502931.db2.gz IPXLMWJECQIJOF-QGZVFWFLSA-N -1 3 369.856 3.576 20 0 FHADHM CCSc1ccc([C@@H](C)NC(=O)c2cc(-c3nnn[n-]3)cs2)cc1 ZINC000821462210 606507548 /nfs/dbraw/zinc/50/75/48/606507548.db2.gz XEHIHIWTSSOWQW-SNVBAGLBSA-N -1 3 359.480 3.531 20 0 FHADHM CCSc1ccc([C@@H](C)NC(=O)c2cc(-c3nn[n-]n3)cs2)cc1 ZINC000821462210 606507549 /nfs/dbraw/zinc/50/75/49/606507549.db2.gz XEHIHIWTSSOWQW-SNVBAGLBSA-N -1 3 359.480 3.531 20 0 FHADHM CN(C(=O)c1cc(-c2nnn[n-]2)cs1)c1cc(Cl)cc(Cl)c1 ZINC000821573572 606512688 /nfs/dbraw/zinc/51/26/88/606512688.db2.gz WBLTZUPGFQCWMI-UHFFFAOYSA-N -1 3 354.222 3.512 20 0 FHADHM CN(C(=O)c1cc(-c2nn[n-]n2)cs1)c1cc(Cl)cc(Cl)c1 ZINC000821573572 606512689 /nfs/dbraw/zinc/51/26/89/606512689.db2.gz WBLTZUPGFQCWMI-UHFFFAOYSA-N -1 3 354.222 3.512 20 0 FHADHM Cc1ccc([C@@H]2CCCCN2C(=O)c2cc(-c3nnn[n-]3)cs2)cc1 ZINC000822233837 606516123 /nfs/dbraw/zinc/51/61/23/606516123.db2.gz WFYIUIGXPHAJMB-HNNXBMFYSA-N -1 3 353.451 3.604 20 0 FHADHM Cc1ccc([C@@H]2CCCCN2C(=O)c2cc(-c3nn[n-]n3)cs2)cc1 ZINC000822233837 606516125 /nfs/dbraw/zinc/51/61/25/606516125.db2.gz WFYIUIGXPHAJMB-HNNXBMFYSA-N -1 3 353.451 3.604 20 0 FHADHM C[C@H](Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1)c1ccc(F)cc1F ZINC000736138987 606592137 /nfs/dbraw/zinc/59/21/37/606592137.db2.gz TUVVCTPUYMZNAO-ZETCQYMHSA-N -1 3 370.285 3.732 20 0 FHADHM C[C@H](Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1)c1ccc(F)cc1F ZINC000736138987 606592139 /nfs/dbraw/zinc/59/21/39/606592139.db2.gz TUVVCTPUYMZNAO-ZETCQYMHSA-N -1 3 370.285 3.732 20 0 FHADHM Cc1cc(C)c(-c2nnn[n-]2)c(NC[C@@H]2CCC[C@H](C(F)(F)F)C2)n1 ZINC000822192832 606594978 /nfs/dbraw/zinc/59/49/78/606594978.db2.gz CIYBQZUZTLLDLZ-NEPJUHHUSA-N -1 3 354.380 3.659 20 0 FHADHM Cc1cc(C)c(-c2nn[n-]n2)c(NC[C@@H]2CCC[C@H](C(F)(F)F)C2)n1 ZINC000822192832 606594980 /nfs/dbraw/zinc/59/49/80/606594980.db2.gz CIYBQZUZTLLDLZ-NEPJUHHUSA-N -1 3 354.380 3.659 20 0 FHADHM FC(F)Oc1cc(-c2nnn[n-]2)ccc1COc1cccc2cccnc21 ZINC000822732564 606595222 /nfs/dbraw/zinc/59/52/22/606595222.db2.gz KFOPOWOTNKBTQV-UHFFFAOYSA-N -1 3 369.331 3.595 20 0 FHADHM FC(F)Oc1cc(-c2nn[n-]n2)ccc1COc1cccc2cccnc21 ZINC000822732564 606595223 /nfs/dbraw/zinc/59/52/23/606595223.db2.gz KFOPOWOTNKBTQV-UHFFFAOYSA-N -1 3 369.331 3.595 20 0 FHADHM COc1cccc([C@H](C)CC(=O)Nc2sc(C)c(C)c2-c2nnn[n-]2)c1 ZINC000821859625 606600893 /nfs/dbraw/zinc/60/08/93/606600893.db2.gz REXWANKEUMWWKQ-SNVBAGLBSA-N -1 3 371.466 3.686 20 0 FHADHM COc1cccc([C@H](C)CC(=O)Nc2sc(C)c(C)c2-c2nn[n-]n2)c1 ZINC000821859625 606600895 /nfs/dbraw/zinc/60/08/95/606600895.db2.gz REXWANKEUMWWKQ-SNVBAGLBSA-N -1 3 371.466 3.686 20 0 FHADHM Cc1cc(CCCC(=O)N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c(C)s1 ZINC000822199847 606602556 /nfs/dbraw/zinc/60/25/56/606602556.db2.gz JTLXIOXZKSIFRG-ZDUSSCGKSA-N -1 3 369.494 3.745 20 0 FHADHM Cc1cc(CCCC(=O)N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c(C)s1 ZINC000822199847 606602557 /nfs/dbraw/zinc/60/25/57/606602557.db2.gz JTLXIOXZKSIFRG-ZDUSSCGKSA-N -1 3 369.494 3.745 20 0 FHADHM CC(=CC(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1cccc(Cl)c1 ZINC000819766034 606626033 /nfs/dbraw/zinc/62/60/33/606626033.db2.gz UOBTWLZGJQDAEO-UKVQZPPCSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=CC(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1cccc(Cl)c1 ZINC000819766034 606626036 /nfs/dbraw/zinc/62/60/36/606626036.db2.gz UOBTWLZGJQDAEO-UKVQZPPCSA-N -1 3 367.840 3.801 20 0 FHADHM O=C(c1cccc(-c2nnn[n-]2)c1)N1CCCCC[C@@H]1/C=C\c1ccccc1 ZINC000823487735 606626694 /nfs/dbraw/zinc/62/66/94/606626694.db2.gz GYHSNWBFAOBXOB-CLEWGBKMSA-N -1 3 373.460 3.965 20 0 FHADHM O=C(c1cccc(-c2nn[n-]n2)c1)N1CCCCC[C@@H]1/C=C\c1ccccc1 ZINC000823487735 606626696 /nfs/dbraw/zinc/62/66/96/606626696.db2.gz GYHSNWBFAOBXOB-CLEWGBKMSA-N -1 3 373.460 3.965 20 0 FHADHM Cc1ccc(C)c(NC(=O)CSc2ccc(Cl)cc2-c2nnn[n-]2)c1 ZINC000822232160 606628889 /nfs/dbraw/zinc/62/88/89/606628889.db2.gz VNECRFJQCRLZPK-UHFFFAOYSA-N -1 3 373.869 3.868 20 0 FHADHM Cc1ccc(C)c(NC(=O)CSc2ccc(Cl)cc2-c2nn[n-]n2)c1 ZINC000822232160 606628891 /nfs/dbraw/zinc/62/88/91/606628891.db2.gz VNECRFJQCRLZPK-UHFFFAOYSA-N -1 3 373.869 3.868 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NCc1csc(C(C)(C)C)n1 ZINC000821411813 606656472 /nfs/dbraw/zinc/65/64/72/606656472.db2.gz BUKFPUMGWQDNCJ-UHFFFAOYSA-N -1 3 358.471 3.632 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NCc1csc(C(C)(C)C)n1 ZINC000821411813 606656473 /nfs/dbraw/zinc/65/64/73/606656473.db2.gz BUKFPUMGWQDNCJ-UHFFFAOYSA-N -1 3 358.471 3.632 20 0 FHADHM CC(C)CN(C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)C1CCCC1 ZINC000820081765 606657005 /nfs/dbraw/zinc/65/70/05/606657005.db2.gz UXTOPPRRZZUJQU-UHFFFAOYSA-N -1 3 362.865 3.953 20 0 FHADHM CC(C)CN(C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)C1CCCC1 ZINC000820081765 606657006 /nfs/dbraw/zinc/65/70/06/606657006.db2.gz UXTOPPRRZZUJQU-UHFFFAOYSA-N -1 3 362.865 3.953 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)N1CC[C@H]1c1ccc(Cl)cc1 ZINC000823331180 606660994 /nfs/dbraw/zinc/66/09/94/606660994.db2.gz BTTWBLQFHPDHHP-HNNXBMFYSA-N -1 3 372.791 3.638 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)N1CC[C@H]1c1ccc(Cl)cc1 ZINC000823331180 606660995 /nfs/dbraw/zinc/66/09/95/606660995.db2.gz BTTWBLQFHPDHHP-HNNXBMFYSA-N -1 3 372.791 3.638 20 0 FHADHM CCN(C(=O)CCO[C@@H](C)CC(C)C)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821153857 606670431 /nfs/dbraw/zinc/67/04/31/606670431.db2.gz FTEZEZBHNDNINK-HOTGVXAUSA-N -1 3 373.501 3.618 20 0 FHADHM CCN(C(=O)CCO[C@@H](C)CC(C)C)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821153857 606670432 /nfs/dbraw/zinc/67/04/32/606670432.db2.gz FTEZEZBHNDNINK-HOTGVXAUSA-N -1 3 373.501 3.618 20 0 FHADHM CCCCOc1ccccc1NC(=O)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000821077573 606674220 /nfs/dbraw/zinc/67/42/20/606674220.db2.gz MBICFYSLLJWTAF-UHFFFAOYSA-N -1 3 373.363 3.576 20 0 FHADHM CCCCOc1ccccc1NC(=O)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000821077573 606674221 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CC[C@H]1CCN(C(=O)c2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)C1 ZINC000820989476 606689860 /nfs/dbraw/zinc/68/98/60/606689860.db2.gz UHZXNEDHNVQZGP-AWEZNQCLSA-N -1 3 363.421 3.531 20 0 FHADHM COCCC1(CNc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)CCC1 ZINC000821687077 606721196 /nfs/dbraw/zinc/72/11/96/606721196.db2.gz NKBGERAENNLEHZ-UHFFFAOYSA-N -1 3 355.364 3.504 20 0 FHADHM COCCC1(CNc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)CCC1 ZINC000821687077 606721198 /nfs/dbraw/zinc/72/11/98/606721198.db2.gz NKBGERAENNLEHZ-UHFFFAOYSA-N -1 3 355.364 3.504 20 0 FHADHM CC(C)C[C@@H](OC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1ccccn1 ZINC000820062168 606763784 /nfs/dbraw/zinc/76/37/84/606763784.db2.gz IMANUKQMIOJHJT-RXQFDZFGSA-N -1 3 363.421 3.606 20 0 FHADHM CC(C)C[C@@H](OC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1ccccn1 ZINC000820062168 606763785 /nfs/dbraw/zinc/76/37/85/606763785.db2.gz IMANUKQMIOJHJT-RXQFDZFGSA-N -1 3 363.421 3.606 20 0 FHADHM CN(c1ccccc1NCc1ccc(-c2nnn[n-]2)cc1F)C1CCCC1 ZINC000821618974 606776334 /nfs/dbraw/zinc/77/63/34/606776334.db2.gz 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/nfs/dbraw/zinc/19/96/79/607199679.db2.gz GKEDBIXRNGQWNK-SNVBAGLBSA-N -1 3 354.801 3.676 20 0 FHADHM C[C@H]1C[C@@H]1c1ccc(CNC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)o1 ZINC000820674858 607202344 /nfs/dbraw/zinc/20/23/44/607202344.db2.gz GTRHYLMXHMDXLX-CABZTGNLSA-N -1 3 372.816 3.558 20 0 FHADHM C[C@H]1C[C@@H]1c1ccc(CNC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)o1 ZINC000820674858 607202345 /nfs/dbraw/zinc/20/23/45/607202345.db2.gz GTRHYLMXHMDXLX-CABZTGNLSA-N -1 3 372.816 3.558 20 0 FHADHM CCCOc1ccccc1NC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000821138906 607202358 /nfs/dbraw/zinc/20/23/58/607202358.db2.gz KFUPWXPYKQFMST-UHFFFAOYSA-N -1 3 372.816 3.953 20 0 FHADHM CCCOc1ccccc1NC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000821138906 607202359 /nfs/dbraw/zinc/20/23/59/607202359.db2.gz KFUPWXPYKQFMST-UHFFFAOYSA-N -1 3 372.816 3.953 20 0 FHADHM C[C@@H](CN(C)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccccc1 ZINC000820252477 607202363 /nfs/dbraw/zinc/20/23/63/607202363.db2.gz ATWHLNMPZDFZHY-LBPRGKRZSA-N -1 3 370.844 3.788 20 0 FHADHM C[C@@H](CN(C)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccccc1 ZINC000820252477 607202364 /nfs/dbraw/zinc/20/23/64/607202364.db2.gz ATWHLNMPZDFZHY-LBPRGKRZSA-N -1 3 370.844 3.788 20 0 FHADHM CN(CCCc1ccccc1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000821600179 607202552 /nfs/dbraw/zinc/20/25/52/607202552.db2.gz AWZVBRIEOHCEEV-UHFFFAOYSA-N -1 3 370.844 3.617 20 0 FHADHM CN(CCCc1ccccc1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000821600179 607202553 /nfs/dbraw/zinc/20/25/53/607202553.db2.gz AWZVBRIEOHCEEV-UHFFFAOYSA-N -1 3 370.844 3.617 20 0 FHADHM CSc1cccc(NC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)c1 ZINC000821983747 607202731 /nfs/dbraw/zinc/20/27/31/607202731.db2.gz IZPAQRRCWFQUBY-UHFFFAOYSA-N -1 3 360.830 3.886 20 0 FHADHM CSc1cccc(NC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)c1 ZINC000821983747 607202732 /nfs/dbraw/zinc/20/27/32/607202732.db2.gz IZPAQRRCWFQUBY-UHFFFAOYSA-N -1 3 360.830 3.886 20 0 FHADHM CC(C)[C@@H]1CCCN(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)CC1 ZINC000820037552 607202988 /nfs/dbraw/zinc/20/29/88/607202988.db2.gz DJYYNHRBGNMGSP-GFCCVEGCSA-N -1 3 362.865 3.810 20 0 FHADHM CC(C)[C@@H]1CCCN(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)CC1 ZINC000820037552 607202989 /nfs/dbraw/zinc/20/29/89/607202989.db2.gz DJYYNHRBGNMGSP-GFCCVEGCSA-N -1 3 362.865 3.810 20 0 FHADHM C[C@@H](CCNC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccccc1 ZINC000820241546 607203021 /nfs/dbraw/zinc/20/30/21/607203021.db2.gz GRQGXFZGAXAFCK-LBPRGKRZSA-N -1 3 370.844 3.835 20 0 FHADHM C[C@@H](CCNC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccccc1 ZINC000820241546 607203022 /nfs/dbraw/zinc/20/30/22/607203022.db2.gz GRQGXFZGAXAFCK-LBPRGKRZSA-N -1 3 370.844 3.835 20 0 FHADHM CCc1cc(C)c(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCCC3)o1 ZINC000821470559 607235542 /nfs/dbraw/zinc/23/55/42/607235542.db2.gz QGPFMUMEJLAJNH-UHFFFAOYSA-N -1 3 371.466 3.913 20 0 FHADHM CCc1cc(C)c(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCCC3)o1 ZINC000821470559 607235543 /nfs/dbraw/zinc/23/55/43/607235543.db2.gz QGPFMUMEJLAJNH-UHFFFAOYSA-N -1 3 371.466 3.913 20 0 FHADHM Cc1cc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CC[C@H](C)C3)oc1C ZINC000822184637 607235776 /nfs/dbraw/zinc/23/57/76/607235776.db2.gz YLDZIDOGBFTEGB-QMMMGPOBSA-N -1 3 357.439 3.515 20 0 FHADHM Cc1cc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CC[C@H](C)C3)oc1C ZINC000822184637 607235777 /nfs/dbraw/zinc/23/57/77/607235777.db2.gz YLDZIDOGBFTEGB-QMMMGPOBSA-N -1 3 357.439 3.515 20 0 FHADHM CCc1cc(C(=O)N(C)c2cc(Cl)ccc2-c2nnn[n-]2)oc1CC ZINC000821471300 607238906 /nfs/dbraw/zinc/23/89/06/607238906.db2.gz YWXUIJZYYLGEOU-UHFFFAOYSA-N -1 3 359.817 3.515 20 0 FHADHM CCc1cc(C(=O)N(C)c2cc(Cl)ccc2-c2nn[n-]n2)oc1CC ZINC000821471300 607238907 /nfs/dbraw/zinc/23/89/07/607238907.db2.gz YWXUIJZYYLGEOU-UHFFFAOYSA-N -1 3 359.817 3.515 20 0 FHADHM Cc1ccccc1[C@@H](C)OC(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000822345897 607240971 /nfs/dbraw/zinc/24/09/71/607240971.db2.gz VXILEBXQNRLFHC-CYBMUJFWSA-N -1 3 354.435 3.572 20 0 FHADHM Cc1ccccc1[C@@H](C)OC(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000822345897 607240972 /nfs/dbraw/zinc/24/09/72/607240972.db2.gz VXILEBXQNRLFHC-CYBMUJFWSA-N -1 3 354.435 3.572 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccccc1OC1CCC1 ZINC000823318617 607241856 /nfs/dbraw/zinc/24/18/56/607241856.db2.gz FWCZGSRPWIQCII-UHFFFAOYSA-N -1 3 369.812 3.704 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccccc1OC1CCC1 ZINC000823318617 607241857 /nfs/dbraw/zinc/24/18/57/607241857.db2.gz FWCZGSRPWIQCII-UHFFFAOYSA-N -1 3 369.812 3.704 20 0 FHADHM Cc1ccc(OCCCC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000822263803 607242826 /nfs/dbraw/zinc/24/28/26/607242826.db2.gz ZSHDJVQAXLANSS-UHFFFAOYSA-N -1 3 371.828 3.626 20 0 FHADHM Cc1ccc(OCCCC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000822263803 607242827 /nfs/dbraw/zinc/24/28/27/607242827.db2.gz ZSHDJVQAXLANSS-UHFFFAOYSA-N -1 3 371.828 3.626 20 0 FHADHM COc1ccc(Cl)c(NC(=S)Nc2cccc(-c3nnn[n-]3)c2C)c1 ZINC000821824524 607251788 /nfs/dbraw/zinc/25/17/88/607251788.db2.gz LTRTZPFLJVTORB-UHFFFAOYSA-N -1 3 374.857 3.646 20 0 FHADHM COc1ccc(Cl)c(NC(=S)Nc2cccc(-c3nn[n-]n3)c2C)c1 ZINC000821824524 607251789 /nfs/dbraw/zinc/25/17/89/607251789.db2.gz LTRTZPFLJVTORB-UHFFFAOYSA-N -1 3 374.857 3.646 20 0 FHADHM Cc1cc(-c2nn[n-]n2)cc(C)c1OCc1nc(C(F)(F)F)cs1 ZINC000826242750 607784085 /nfs/dbraw/zinc/78/40/85/607784085.db2.gz DRDYBIYZCXMSON-UHFFFAOYSA-N -1 3 355.345 3.538 20 0 FHADHM CCSc1ccc(CC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000825674094 607790671 /nfs/dbraw/zinc/79/06/71/607790671.db2.gz HWRDSAQHRZWQGS-UHFFFAOYSA-N -1 3 373.869 3.813 20 0 FHADHM CCSc1ccc(CC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000825674094 607790672 /nfs/dbraw/zinc/79/06/72/607790672.db2.gz HWRDSAQHRZWQGS-UHFFFAOYSA-N -1 3 373.869 3.813 20 0 FHADHM Cc1cc(Cl)c(NC(=O)Cc2ccc(-c3nnn[n-]3)cc2)cc1Cl ZINC000826267463 607791639 /nfs/dbraw/zinc/79/16/39/607791639.db2.gz HFDUTHAYLWFHMH-UHFFFAOYSA-N -1 3 362.220 3.663 20 0 FHADHM Cc1cc(Cl)c(NC(=O)Cc2ccc(-c3nn[n-]n3)cc2)cc1Cl ZINC000826267463 607791640 /nfs/dbraw/zinc/79/16/40/607791640.db2.gz HFDUTHAYLWFHMH-UHFFFAOYSA-N -1 3 362.220 3.663 20 0 FHADHM CC1(C)C[C@@H]1C(=O)Nc1sc2c(c1-c1nnn[n-]1)-c1ccccc1CC2 ZINC000824796638 607793861 /nfs/dbraw/zinc/79/38/61/607793861.db2.gz SEAJOBZVHAVGMZ-GFCCVEGCSA-N -1 3 365.462 3.678 20 0 FHADHM CC1(C)C[C@@H]1C(=O)Nc1sc2c(c1-c1nn[n-]n1)-c1ccccc1CC2 ZINC000824796638 607793862 /nfs/dbraw/zinc/79/38/62/607793862.db2.gz SEAJOBZVHAVGMZ-GFCCVEGCSA-N -1 3 365.462 3.678 20 0 FHADHM CCN(C(=O)CCc1ccc(C)c(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825372435 607797304 /nfs/dbraw/zinc/79/73/04/607797304.db2.gz YLRPSOPHXFURBZ-UHFFFAOYSA-N -1 3 369.856 3.814 20 0 FHADHM CCN(C(=O)CCc1ccc(C)c(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825372435 607797305 /nfs/dbraw/zinc/79/73/05/607797305.db2.gz YLRPSOPHXFURBZ-UHFFFAOYSA-N -1 3 369.856 3.814 20 0 FHADHM CC[C@H](O[C@@H]1CCC[C@H](C)C1)C(=O)N(CC)c1ccc(-c2nnn[n-]2)cc1 ZINC000825153605 607797857 /nfs/dbraw/zinc/79/78/57/607797857.db2.gz ISULDHJLSBWHQY-QGTPRVQTSA-N -1 3 371.485 3.594 20 0 FHADHM CC[C@H](O[C@@H]1CCC[C@H](C)C1)C(=O)N(CC)c1ccc(-c2nn[n-]n2)cc1 ZINC000825153605 607797858 /nfs/dbraw/zinc/79/78/58/607797858.db2.gz ISULDHJLSBWHQY-QGTPRVQTSA-N -1 3 371.485 3.594 20 0 FHADHM CCN(C(=O)c1sc(C(C)(C)C)nc1C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825391412 607800342 /nfs/dbraw/zinc/80/03/42/607800342.db2.gz ZFTROHUPZUHMOY-UHFFFAOYSA-N -1 3 370.482 3.596 20 0 FHADHM CCN(C(=O)c1sc(C(C)(C)C)nc1C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825391412 607800343 /nfs/dbraw/zinc/80/03/43/607800343.db2.gz ZFTROHUPZUHMOY-UHFFFAOYSA-N -1 3 370.482 3.596 20 0 FHADHM CC(C)(C)O[C@H](C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccccc1 ZINC000824119653 607817400 /nfs/dbraw/zinc/81/74/00/607817400.db2.gz MXCRTYCTGGLTPL-INIZCTEOSA-N -1 3 369.400 3.501 20 0 FHADHM CC(C)(C)O[C@H](C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccccc1 ZINC000824119653 607817401 /nfs/dbraw/zinc/81/74/01/607817401.db2.gz MXCRTYCTGGLTPL-INIZCTEOSA-N -1 3 369.400 3.501 20 0 FHADHM C[C@H](Cc1ccccc1Cl)C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000824458279 607819089 /nfs/dbraw/zinc/81/90/89/607819089.db2.gz VATOZVMCMVQYOW-OLZOCXBDSA-N -1 3 369.856 3.576 20 0 FHADHM C[C@H](Cc1ccccc1Cl)C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000824458279 607819090 /nfs/dbraw/zinc/81/90/90/607819090.db2.gz VATOZVMCMVQYOW-OLZOCXBDSA-N -1 3 369.856 3.576 20 0 FHADHM C[C@@H](NC(=O)[C@@H](C)Cc1ccccc1Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000824458280 607819214 /nfs/dbraw/zinc/81/92/14/607819214.db2.gz VATOZVMCMVQYOW-QWHCGFSZSA-N -1 3 369.856 3.576 20 0 FHADHM C[C@@H](NC(=O)[C@@H](C)Cc1ccccc1Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000824458280 607819215 /nfs/dbraw/zinc/81/92/15/607819215.db2.gz VATOZVMCMVQYOW-QWHCGFSZSA-N -1 3 369.856 3.576 20 0 FHADHM O[C@@H](CSc1ccc(-c2nnn[n-]2)cc1Cl)c1c(F)cccc1F ZINC000826505348 607843285 /nfs/dbraw/zinc/84/32/85/607843285.db2.gz TVKVOJLPWRNVMM-LBPRGKRZSA-N -1 3 368.796 3.624 20 0 FHADHM O[C@@H](CSc1ccc(-c2nn[n-]n2)cc1Cl)c1c(F)cccc1F ZINC000826505348 607843286 /nfs/dbraw/zinc/84/32/86/607843286.db2.gz TVKVOJLPWRNVMM-LBPRGKRZSA-N -1 3 368.796 3.624 20 0 FHADHM Cn1c(CSc2ccc(-c3nnn[n-]3)cc2Cl)nc2ccccc21 ZINC000826355780 607846053 /nfs/dbraw/zinc/84/60/53/607846053.db2.gz NABLCRDPYAWXOS-UHFFFAOYSA-N -1 3 356.842 3.699 20 0 FHADHM Cn1c(CSc2ccc(-c3nn[n-]n3)cc2Cl)nc2ccccc21 ZINC000826355780 607846054 /nfs/dbraw/zinc/84/60/54/607846054.db2.gz NABLCRDPYAWXOS-UHFFFAOYSA-N -1 3 356.842 3.699 20 0 FHADHM Cc1cccc(C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)c1Cl ZINC000826296342 607854780 /nfs/dbraw/zinc/85/47/80/607854780.db2.gz SJZCIDXAAMEWNK-UHFFFAOYSA-N -1 3 369.856 3.879 20 0 FHADHM Cc1cccc(C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)c1Cl ZINC000826296342 607854781 /nfs/dbraw/zinc/85/47/81/607854781.db2.gz SJZCIDXAAMEWNK-UHFFFAOYSA-N -1 3 369.856 3.879 20 0 FHADHM CC1(NC(=O)Nc2cccc(Oc3ccc(-c4nnn[n-]4)cc3)c2)CCC1 ZINC000824829625 607856185 /nfs/dbraw/zinc/85/61/85/607856185.db2.gz GBQQKYCJJCINJG-UHFFFAOYSA-N -1 3 364.409 3.723 20 0 FHADHM CC1(NC(=O)Nc2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)CCC1 ZINC000824829625 607856186 /nfs/dbraw/zinc/85/61/86/607856186.db2.gz GBQQKYCJJCINJG-UHFFFAOYSA-N -1 3 364.409 3.723 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cccc(C)c1Cl ZINC000825331882 607862086 /nfs/dbraw/zinc/86/20/86/607862086.db2.gz BREVVXMZXFUYRD-UHFFFAOYSA-N -1 3 370.844 3.903 20 0 FHADHM CCN(C(=O)c1cc2ccccc2o1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825379198 607878027 /nfs/dbraw/zinc/87/80/27/607878027.db2.gz CDIFWECMUXTWSB-UHFFFAOYSA-N -1 3 367.796 3.933 20 0 FHADHM CCN(C(=O)c1cc2ccccc2o1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825379198 607878028 /nfs/dbraw/zinc/87/80/28/607878028.db2.gz CDIFWECMUXTWSB-UHFFFAOYSA-N -1 3 367.796 3.933 20 0 FHADHM CCN(C(=O)CCc1ccccc1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825371960 607878805 /nfs/dbraw/zinc/87/88/05/607878805.db2.gz ORTNADWWQPBJBA-UHFFFAOYSA-N -1 3 355.829 3.506 20 0 FHADHM CCN(C(=O)CCc1ccccc1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825371960 607878806 /nfs/dbraw/zinc/87/88/06/607878806.db2.gz ORTNADWWQPBJBA-UHFFFAOYSA-N -1 3 355.829 3.506 20 0 FHADHM C[C@H](NC(=O)[C@@H]1CC[C@H]2CCCC[C@@H]2C1)c1cccc(-c2nnn[n-]2)c1 ZINC000824472814 607905864 /nfs/dbraw/zinc/90/58/64/607905864.db2.gz XCEDWERQKMVVFL-GARXJVFOSA-N -1 3 353.470 3.650 20 0 FHADHM C[C@H](NC(=O)[C@@H]1CC[C@H]2CCCC[C@@H]2C1)c1cccc(-c2nn[n-]n2)c1 ZINC000824472814 607905865 /nfs/dbraw/zinc/90/58/65/607905865.db2.gz XCEDWERQKMVVFL-GARXJVFOSA-N -1 3 353.470 3.650 20 0 FHADHM O=C(NC1(c2cccc(-c3nnn[n-]3)c2)CC1)[C@@H]1CC[C@H]2CCCC[C@@H]2C1 ZINC000826428322 607909529 /nfs/dbraw/zinc/90/95/29/607909529.db2.gz YKLZDHPWRFMANP-BFYDXBDKSA-N -1 3 365.481 3.579 20 0 FHADHM O=C(NC1(c2cccc(-c3nn[n-]n3)c2)CC1)[C@@H]1CC[C@H]2CCCC[C@@H]2C1 ZINC000826428322 607909530 /nfs/dbraw/zinc/90/95/30/607909530.db2.gz YKLZDHPWRFMANP-BFYDXBDKSA-N -1 3 365.481 3.579 20 0 FHADHM CS[C@H](C)CC(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000826224690 607938039 /nfs/dbraw/zinc/93/80/39/607938039.db2.gz KCMMITGNNUOXKK-GFCCVEGCSA-N -1 3 369.450 3.739 20 0 FHADHM CS[C@H](C)CC(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000826224690 607938040 /nfs/dbraw/zinc/93/80/40/607938040.db2.gz KCMMITGNNUOXKK-GFCCVEGCSA-N -1 3 369.450 3.739 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@H]2C(=O)N2CCc3ccc(-c4nnn[n-]4)cc32)cc1 ZINC000824347841 607947999 /nfs/dbraw/zinc/94/79/99/607947999.db2.gz PGERBONHADNMTK-RBUKOAKNSA-N -1 3 373.460 3.683 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@H]2C(=O)N2CCc3ccc(-c4nn[n-]n4)cc32)cc1 ZINC000824347841 607948000 /nfs/dbraw/zinc/94/80/00/607948000.db2.gz PGERBONHADNMTK-RBUKOAKNSA-N -1 3 373.460 3.683 20 0 FHADHM CCc1nc2sccc2c(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)n1 ZINC000825750702 607964947 /nfs/dbraw/zinc/96/49/47/607964947.db2.gz VTICIBALQDEINQ-SNVBAGLBSA-N -1 3 351.439 3.607 20 0 FHADHM CCc1nc2sccc2c(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)n1 ZINC000825750702 607964948 /nfs/dbraw/zinc/96/49/48/607964948.db2.gz VTICIBALQDEINQ-SNVBAGLBSA-N -1 3 351.439 3.607 20 0 FHADHM CCn1c2ccc(-c3nnn[n-]3)cc2nc1-c1ccccc1Br ZINC000825782310 607975180 /nfs/dbraw/zinc/97/51/80/607975180.db2.gz CASZIDAKADYOQG-UHFFFAOYSA-N -1 3 369.226 3.666 20 0 FHADHM CCn1c2ccc(-c3nn[n-]n3)cc2nc1-c1ccccc1Br ZINC000825782310 607975181 /nfs/dbraw/zinc/97/51/81/607975181.db2.gz CASZIDAKADYOQG-UHFFFAOYSA-N -1 3 369.226 3.666 20 0 FHADHM CCN(C(=O)C1CCC(F)(F)CC1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825366850 607978541 /nfs/dbraw/zinc/97/85/41/607978541.db2.gz GZBPVXOMNZWDOD-GFCCVEGCSA-N -1 3 363.412 3.602 20 0 FHADHM CCN(C(=O)C1CCC(F)(F)CC1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825366850 607978542 /nfs/dbraw/zinc/97/85/42/607978542.db2.gz GZBPVXOMNZWDOD-GFCCVEGCSA-N -1 3 363.412 3.602 20 0 FHADHM COCC[C@@H](Sc1nc(C)cc(C)c1-c1nnn[n-]1)c1ccccc1 ZINC000826154953 608014263 /nfs/dbraw/zinc/01/42/63/608014263.db2.gz BCAHWLPVCUVNOB-OAHLLOKOSA-N -1 3 355.467 3.748 20 0 FHADHM COCC[C@@H](Sc1nc(C)cc(C)c1-c1nn[n-]n1)c1ccccc1 ZINC000826154953 608014264 /nfs/dbraw/zinc/01/42/64/608014264.db2.gz BCAHWLPVCUVNOB-OAHLLOKOSA-N -1 3 355.467 3.748 20 0 FHADHM CC(C)Cn1ncc(Nc2cccc(F)c2-c2nnn[n-]2)c1C(F)F ZINC000824284175 608017413 /nfs/dbraw/zinc/01/74/13/608017413.db2.gz CUVRVLUVCSRFLT-UHFFFAOYSA-N -1 3 351.336 3.540 20 0 FHADHM CC(C)Cn1ncc(Nc2cccc(F)c2-c2nn[n-]n2)c1C(F)F ZINC000824284175 608017414 /nfs/dbraw/zinc/01/74/14/608017414.db2.gz CUVRVLUVCSRFLT-UHFFFAOYSA-N -1 3 351.336 3.540 20 0 FHADHM CC(C)(C)NC(=O)c1ccc(Oc2ccccc2-c2nnn[n-]2)c(Cl)c1 ZINC000824094042 608051767 /nfs/dbraw/zinc/05/17/67/608051767.db2.gz PXMNLEPRMMXYDA-UHFFFAOYSA-N -1 3 371.828 3.841 20 0 FHADHM CC(C)(C)NC(=O)c1ccc(Oc2ccccc2-c2nn[n-]n2)c(Cl)c1 ZINC000824094042 608051768 /nfs/dbraw/zinc/05/17/68/608051768.db2.gz PXMNLEPRMMXYDA-UHFFFAOYSA-N -1 3 371.828 3.841 20 0 FHADHM CCC(CC)[C@@H](C)C(=O)Oc1c(Cl)cc(-c2nnn[n-]2)cc1OC ZINC000825096991 608059591 /nfs/dbraw/zinc/05/95/91/608059591.db2.gz RUJFXVCZORYOQJ-SECBINFHSA-N -1 3 352.822 3.506 20 0 FHADHM CCC(CC)[C@@H](C)C(=O)Oc1c(Cl)cc(-c2nn[n-]n2)cc1OC ZINC000825096991 608059592 /nfs/dbraw/zinc/05/95/92/608059592.db2.gz RUJFXVCZORYOQJ-SECBINFHSA-N -1 3 352.822 3.506 20 0 FHADHM C[C@@H](OC(=O)CCCc1cc(F)ccc1F)c1cccc(-c2nnn[n-]2)c1 ZINC000824713493 608075469 /nfs/dbraw/zinc/07/54/69/608075469.db2.gz IUKRWYIBOLHPJY-GFCCVEGCSA-N -1 3 372.375 3.772 20 0 FHADHM C[C@@H](OC(=O)CCCc1cc(F)ccc1F)c1cccc(-c2nn[n-]n2)c1 ZINC000824713493 608075470 /nfs/dbraw/zinc/07/54/70/608075470.db2.gz IUKRWYIBOLHPJY-GFCCVEGCSA-N -1 3 372.375 3.772 20 0 FHADHM COc1ccccc1[C@H]1CCCCN1c1ncc(-c2nnn[n-]2)cc1Cl ZINC000826218817 608124319 /nfs/dbraw/zinc/12/43/19/608124319.db2.gz LLADKPPEATZFRQ-OAHLLOKOSA-N -1 3 370.844 3.655 20 0 FHADHM COc1ccccc1[C@H]1CCCCN1c1ncc(-c2nn[n-]n2)cc1Cl ZINC000826218817 608124320 /nfs/dbraw/zinc/12/43/20/608124320.db2.gz LLADKPPEATZFRQ-OAHLLOKOSA-N -1 3 370.844 3.655 20 0 FHADHM CC(C)(C)[C@H]1C[C@@H](Nc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)CCO1 ZINC000824078606 608149418 /nfs/dbraw/zinc/14/94/18/608149418.db2.gz JIJJKERAWCPQDY-SMDDNHRTSA-N -1 3 369.391 3.891 20 0 FHADHM CC(C)(C)[C@@H]1C[C@@H](Nc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)CCO1 ZINC000824080474 608149815 /nfs/dbraw/zinc/14/98/15/608149815.db2.gz XXNPLGNLMGLIRN-FZMZJTMJSA-N -1 3 369.391 3.891 20 0 FHADHM CC(C)(C)[C@@H]1C[C@@H](Nc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)CCO1 ZINC000824080474 608149816 /nfs/dbraw/zinc/14/98/16/608149816.db2.gz XXNPLGNLMGLIRN-FZMZJTMJSA-N -1 3 369.391 3.891 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)c2cc(F)c(Cl)cc2F)s1 ZINC000825694390 608154987 /nfs/dbraw/zinc/15/49/87/608154987.db2.gz PDNKDNCDGLXPDB-UHFFFAOYSA-N -1 3 369.784 3.675 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)c2cc(F)c(Cl)cc2F)s1 ZINC000825694390 608154988 /nfs/dbraw/zinc/15/49/88/608154988.db2.gz PDNKDNCDGLXPDB-UHFFFAOYSA-N -1 3 369.784 3.675 20 0 FHADHM Cc1nsc(Nc2ccc(Oc3ccccc3-c3nnn[n-]3)cc2)n1 ZINC000826340366 608179517 /nfs/dbraw/zinc/17/95/17/608179517.db2.gz VMGCSCTZFQRDEN-UHFFFAOYSA-N -1 3 351.395 3.563 20 0 FHADHM Cc1nsc(Nc2ccc(Oc3ccccc3-c3nn[n-]n3)cc2)n1 ZINC000826340366 608179518 /nfs/dbraw/zinc/17/95/18/608179518.db2.gz VMGCSCTZFQRDEN-UHFFFAOYSA-N -1 3 351.395 3.563 20 0 FHADHM C[C@H](OC(=O)[C@@H]1SCCc2sccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000824716608 608181739 /nfs/dbraw/zinc/18/17/39/608181739.db2.gz YUIZSWCGOFSIQH-ZUZCIYMTSA-N -1 3 372.475 3.563 20 0 FHADHM C[C@H](OC(=O)[C@@H]1SCCc2sccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000824716608 608181741 /nfs/dbraw/zinc/18/17/41/608181741.db2.gz YUIZSWCGOFSIQH-ZUZCIYMTSA-N -1 3 372.475 3.563 20 0 FHADHM C[C@H](OC(=O)[C@@H]1CCCc2sccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000824714966 608181841 /nfs/dbraw/zinc/18/18/41/608181841.db2.gz PSJMOYGMWMCPDV-XHDPSFHLSA-N -1 3 354.435 3.653 20 0 FHADHM C[C@H](OC(=O)[C@@H]1CCCc2sccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000824714966 608181842 /nfs/dbraw/zinc/18/18/42/608181842.db2.gz PSJMOYGMWMCPDV-XHDPSFHLSA-N -1 3 354.435 3.653 20 0 FHADHM C[C@H](OC(=O)C(C)(C)c1cccc(F)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824706213 608183227 /nfs/dbraw/zinc/18/32/27/608183227.db2.gz HNMPGCMMDDOEMK-LBPRGKRZSA-N -1 3 354.385 3.588 20 0 FHADHM C[C@H](OC(=O)C(C)(C)c1cccc(F)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824706213 608183229 /nfs/dbraw/zinc/18/32/29/608183229.db2.gz HNMPGCMMDDOEMK-LBPRGKRZSA-N -1 3 354.385 3.588 20 0 FHADHM CC(C)Oc1cccc(CNc2ccc3cc(-c4nnn[n-]4)ccc3n2)c1 ZINC000824332983 608223190 /nfs/dbraw/zinc/22/31/90/608223190.db2.gz BSIKWAAHHQZSLD-UHFFFAOYSA-N -1 3 360.421 3.814 20 0 FHADHM CC(C)Oc1cccc(CNc2ccc3cc(-c4nn[n-]n4)ccc3n2)c1 ZINC000824332983 608223191 /nfs/dbraw/zinc/22/31/91/608223191.db2.gz BSIKWAAHHQZSLD-UHFFFAOYSA-N -1 3 360.421 3.814 20 0 FHADHM COc1ccc(F)cc1[C@@H](C)Nc1ccc2cc(-c3nnn[n-]3)ccc2n1 ZINC000826209398 608223904 /nfs/dbraw/zinc/22/39/04/608223904.db2.gz ZZZUKZROLCTJIZ-LLVKDONJSA-N -1 3 364.384 3.736 20 0 FHADHM COc1ccc(F)cc1[C@@H](C)Nc1ccc2cc(-c3nn[n-]n3)ccc2n1 ZINC000826209398 608223905 /nfs/dbraw/zinc/22/39/05/608223905.db2.gz ZZZUKZROLCTJIZ-LLVKDONJSA-N -1 3 364.384 3.736 20 0 FHADHM CCOc1cccc([C@@H](C)Nc2ccc3cc(-c4nnn[n-]4)ccc3n2)c1 ZINC000825649835 608224728 /nfs/dbraw/zinc/22/47/28/608224728.db2.gz ZEJMRRXQNDEAGN-CYBMUJFWSA-N -1 3 360.421 3.987 20 0 FHADHM CCOc1cccc([C@@H](C)Nc2ccc3cc(-c4nn[n-]n4)ccc3n2)c1 ZINC000825649835 608224729 /nfs/dbraw/zinc/22/47/29/608224729.db2.gz ZEJMRRXQNDEAGN-CYBMUJFWSA-N -1 3 360.421 3.987 20 0 FHADHM CCOc1ccccc1[C@H](C)Nc1ccc2cc(-c3nnn[n-]3)ccc2n1 ZINC000825654321 608225073 /nfs/dbraw/zinc/22/50/73/608225073.db2.gz WZMOHMZFWWWCKI-ZDUSSCGKSA-N -1 3 360.421 3.987 20 0 FHADHM CCOc1ccccc1[C@H](C)Nc1ccc2cc(-c3nn[n-]n3)ccc2n1 ZINC000825654321 608225074 /nfs/dbraw/zinc/22/50/74/608225074.db2.gz WZMOHMZFWWWCKI-ZDUSSCGKSA-N -1 3 360.421 3.987 20 0 FHADHM CCOc1cccc([C@H](C)Nc2ccc3cc(-c4nnn[n-]4)ccc3n2)c1 ZINC000825649836 608225080 /nfs/dbraw/zinc/22/50/80/608225080.db2.gz ZEJMRRXQNDEAGN-ZDUSSCGKSA-N -1 3 360.421 3.987 20 0 FHADHM CCOc1cccc([C@H](C)Nc2ccc3cc(-c4nn[n-]n4)ccc3n2)c1 ZINC000825649836 608225081 /nfs/dbraw/zinc/22/50/81/608225081.db2.gz ZEJMRRXQNDEAGN-ZDUSSCGKSA-N -1 3 360.421 3.987 20 0 FHADHM c1ccc([C@@H](Nc2ccc3cc(-c4nnn[n-]4)ccc3n2)[C@@H]2CCCO2)cc1 ZINC000826521054 608226265 /nfs/dbraw/zinc/22/62/65/608226265.db2.gz YGTCFVDESOJLHJ-AZUAARDMSA-N -1 3 372.432 3.747 20 0 FHADHM c1ccc([C@@H](Nc2ccc3cc(-c4nn[n-]n4)ccc3n2)[C@@H]2CCCO2)cc1 ZINC000826521054 608226266 /nfs/dbraw/zinc/22/62/66/608226266.db2.gz YGTCFVDESOJLHJ-AZUAARDMSA-N -1 3 372.432 3.747 20 0 FHADHM CC(C)(C)Oc1cc(F)ccc1NCc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000824119514 608226948 /nfs/dbraw/zinc/22/69/48/608226948.db2.gz KBYPGBVISBTFSB-UHFFFAOYSA-N -1 3 359.380 3.934 20 0 FHADHM CC(C)(C)Oc1cc(F)ccc1NCc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000824119514 608226949 /nfs/dbraw/zinc/22/69/49/608226949.db2.gz KBYPGBVISBTFSB-UHFFFAOYSA-N -1 3 359.380 3.934 20 0 FHADHM O=C(C=Cc1ccc2[nH]ccc2c1)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000826400741 608229502 /nfs/dbraw/zinc/22/95/02/608229502.db2.gz GUHZOJZFNXOGAG-QHHAFSJGSA-N -1 3 364.796 3.653 20 0 FHADHM O=C(C=Cc1ccc2[nH]ccc2c1)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000826400741 608229504 /nfs/dbraw/zinc/22/95/04/608229504.db2.gz GUHZOJZFNXOGAG-QHHAFSJGSA-N -1 3 364.796 3.653 20 0 FHADHM CC(C)CN(C(=O)c1ccc(Cl)c(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824255572 608237251 /nfs/dbraw/zinc/23/72/51/608237251.db2.gz OKZOJBFZPYYZNP-UHFFFAOYSA-N -1 3 373.819 3.962 20 0 FHADHM CC(C)CN(C(=O)c1ccc(Cl)c(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824255572 608237254 /nfs/dbraw/zinc/23/72/54/608237254.db2.gz OKZOJBFZPYYZNP-UHFFFAOYSA-N -1 3 373.819 3.962 20 0 FHADHM Cc1cccc([C@@H](NCc2ccc(-c3nnn[n-]3)s2)c2ccccn2)c1 ZINC000826296985 608241410 /nfs/dbraw/zinc/24/14/10/608241410.db2.gz QJDJCWNFQTUODH-GOSISDBHSA-N -1 3 362.462 3.511 20 0 FHADHM Cc1cccc([C@@H](NCc2ccc(-c3nn[n-]n3)s2)c2ccccn2)c1 ZINC000826296985 608241412 /nfs/dbraw/zinc/24/14/12/608241412.db2.gz QJDJCWNFQTUODH-GOSISDBHSA-N -1 3 362.462 3.511 20 0 FHADHM CC(C)(C)c1ccc2c(c1)CCCN2C(=O)c1sccc1-c1nnn[n-]1 ZINC000824137278 608251515 /nfs/dbraw/zinc/25/15/15/608251515.db2.gz ZZCKDCJACUFLQB-UHFFFAOYSA-N -1 3 367.478 3.819 20 0 FHADHM CC(C)(C)c1ccc2c(c1)CCCN2C(=O)c1sccc1-c1nn[n-]n1 ZINC000824137278 608251517 /nfs/dbraw/zinc/25/15/17/608251517.db2.gz ZZCKDCJACUFLQB-UHFFFAOYSA-N -1 3 367.478 3.819 20 0 FHADHM C[C@@H]1CCC[C@H](OCCCCCC(=O)Nc2cccc(-c3nnn[n-]3)c2)C1 ZINC000160668495 608261820 /nfs/dbraw/zinc/26/18/20/608261820.db2.gz YFOIJXMWRCUGKV-QAPCUYQASA-N -1 3 371.485 3.961 20 0 FHADHM C[C@@H]1CCC[C@H](OCCCCCC(=O)Nc2cccc(-c3nn[n-]n3)c2)C1 ZINC000160668495 608261821 /nfs/dbraw/zinc/26/18/21/608261821.db2.gz YFOIJXMWRCUGKV-QAPCUYQASA-N -1 3 371.485 3.961 20 0 FHADHM CC(=O)c1ccc(NCc2ccc(-c3ccccc3-c3nnn[n-]3)cc2)nc1 ZINC000824024965 608293098 /nfs/dbraw/zinc/29/30/98/608293098.db2.gz RVYIBXCCLXHLNZ-UHFFFAOYSA-N -1 3 370.416 3.743 20 0 FHADHM CC(=O)c1ccc(NCc2ccc(-c3ccccc3-c3nn[n-]n3)cc2)nc1 ZINC000824024965 608293100 /nfs/dbraw/zinc/29/31/00/608293100.db2.gz RVYIBXCCLXHLNZ-UHFFFAOYSA-N -1 3 370.416 3.743 20 0 FHADHM Cc1cc(NCc2ccc(-c3ccccc3-c3nnn[n-]3)cc2)nc(C)n1 ZINC000826271561 608293910 /nfs/dbraw/zinc/29/39/10/608293910.db2.gz XCPLULPSVYHQEI-UHFFFAOYSA-N -1 3 357.421 3.553 20 0 FHADHM Cc1cc(NCc2ccc(-c3ccccc3-c3nn[n-]n3)cc2)nc(C)n1 ZINC000826271561 608293911 /nfs/dbraw/zinc/29/39/11/608293911.db2.gz XCPLULPSVYHQEI-UHFFFAOYSA-N -1 3 357.421 3.553 20 0 FHADHM C[C@@H](C(=O)NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1)c1ccco1 ZINC000824038891 608304881 /nfs/dbraw/zinc/30/48/81/608304881.db2.gz ABZCVOIITTYUBH-CQSZACIVSA-N -1 3 373.416 3.547 20 0 FHADHM C[C@@H](C(=O)NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1)c1ccco1 ZINC000824038891 608304883 /nfs/dbraw/zinc/30/48/83/608304883.db2.gz ABZCVOIITTYUBH-CQSZACIVSA-N -1 3 373.416 3.547 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H](c2ccccc2)C2CC2)c1-c1nnn[n-]1 ZINC000825688031 608305011 /nfs/dbraw/zinc/30/50/11/608305011.db2.gz QGQNFLQZXGXWLJ-OAHLLOKOSA-N -1 3 367.478 3.931 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H](c2ccccc2)C2CC2)c1-c1nn[n-]n1 ZINC000825688031 608305012 /nfs/dbraw/zinc/30/50/12/608305012.db2.gz QGQNFLQZXGXWLJ-OAHLLOKOSA-N -1 3 367.478 3.931 20 0 FHADHM O=C(C=Cc1ccc2[nH]ccc2c1)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000826401002 608311840 /nfs/dbraw/zinc/31/18/40/608311840.db2.gz MYLOIVMWHMTBJH-KXFIGUGUSA-N -1 3 364.796 3.653 20 0 FHADHM O=C(C=Cc1ccc2[nH]ccc2c1)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000826401002 608311842 /nfs/dbraw/zinc/31/18/42/608311842.db2.gz MYLOIVMWHMTBJH-KXFIGUGUSA-N -1 3 364.796 3.653 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CN(C)[C@@H](C)c1ccccc1Cl ZINC000826167487 608354302 /nfs/dbraw/zinc/35/43/02/608354302.db2.gz GJOLQHZZDJTCIN-LBPRGKRZSA-N -1 3 357.845 3.722 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CN(C)[C@@H](C)c1ccccc1Cl ZINC000826167487 608354304 /nfs/dbraw/zinc/35/43/04/608354304.db2.gz GJOLQHZZDJTCIN-LBPRGKRZSA-N -1 3 357.845 3.722 20 0 FHADHM Oc1cccc2c1CC[C@@H]2Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000826511268 608382052 /nfs/dbraw/zinc/38/20/52/608382052.db2.gz IWLCGTBCGQWJNU-AWEZNQCLSA-N -1 3 361.327 3.691 20 0 FHADHM Oc1cccc2c1CC[C@@H]2Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000826511268 608382054 /nfs/dbraw/zinc/38/20/54/608382054.db2.gz IWLCGTBCGQWJNU-AWEZNQCLSA-N -1 3 361.327 3.691 20 0 FHADHM Fc1c(CSc2nc(-c3ccccc3)c[nH]2)cccc1-c1nnn[n-]1 ZINC000826370714 608396342 /nfs/dbraw/zinc/39/63/42/608396342.db2.gz FGBRNQDRQZESRP-UHFFFAOYSA-N -1 3 352.398 3.688 20 0 FHADHM Fc1c(CSc2nc(-c3ccccc3)c[nH]2)cccc1-c1nn[n-]n1 ZINC000826370714 608396343 /nfs/dbraw/zinc/39/63/43/608396343.db2.gz FGBRNQDRQZESRP-UHFFFAOYSA-N -1 3 352.398 3.688 20 0 FHADHM C[C@H](NC(=O)N[C@@H](C)c1ccccc1Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000820352347 608417533 /nfs/dbraw/zinc/41/75/33/608417533.db2.gz UWPJJDUWTJOOHB-RYUDHWBXSA-N -1 3 370.844 3.642 20 0 FHADHM C[C@H](NC(=O)N[C@@H](C)c1ccccc1Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000820352347 608417535 /nfs/dbraw/zinc/41/75/35/608417535.db2.gz UWPJJDUWTJOOHB-RYUDHWBXSA-N -1 3 370.844 3.642 20 0 FHADHM Fc1c(CN(Cc2cccs2)CC(F)(F)F)cccc1-c1nnn[n-]1 ZINC000826370359 608419100 /nfs/dbraw/zinc/41/91/00/608419100.db2.gz ONKCBZIVGSKJFB-UHFFFAOYSA-N -1 3 371.363 3.632 20 0 FHADHM Fc1c(CN(Cc2cccs2)CC(F)(F)F)cccc1-c1nn[n-]n1 ZINC000826370359 608419102 /nfs/dbraw/zinc/41/91/02/608419102.db2.gz ONKCBZIVGSKJFB-UHFFFAOYSA-N -1 3 371.363 3.632 20 0 FHADHM CCCCCn1cc(CNc2cc(Cl)ccc2-c2nnn[n-]2)c(C)n1 ZINC000825282783 608445442 /nfs/dbraw/zinc/44/54/42/608445442.db2.gz ZYZXMTIVCORALO-UHFFFAOYSA-N -1 3 359.865 3.827 20 0 FHADHM CCCCCn1cc(CNc2cc(Cl)ccc2-c2nn[n-]n2)c(C)n1 ZINC000825282783 608445444 /nfs/dbraw/zinc/44/54/44/608445444.db2.gz ZYZXMTIVCORALO-UHFFFAOYSA-N -1 3 359.865 3.827 20 0 FHADHM Cc1ccccc1-c1cnc(CN[C@H](C)c2ccc(-c3nnn[n-]3)cc2)o1 ZINC000826304917 608461476 /nfs/dbraw/zinc/46/14/76/608461476.db2.gz DMUPZHTWSCOLOE-CQSZACIVSA-N -1 3 360.421 3.681 20 0 FHADHM Cc1ccccc1-c1cnc(CN[C@H](C)c2ccc(-c3nn[n-]n3)cc2)o1 ZINC000826304917 608461477 /nfs/dbraw/zinc/46/14/77/608461477.db2.gz DMUPZHTWSCOLOE-CQSZACIVSA-N -1 3 360.421 3.681 20 0 FHADHM c1ccc(CCNc2ccccc2Oc2ncccc2-c2nnn[n-]2)cc1 ZINC000826521127 608478283 /nfs/dbraw/zinc/47/82/83/608478283.db2.gz AGUNBBOOQUTYHJ-UHFFFAOYSA-N -1 3 358.405 3.709 20 0 FHADHM CSc1cccc(NC(=O)Nc2cc(-c3nnn[n-]3)ccc2C)c1C ZINC000826230767 608479270 /nfs/dbraw/zinc/47/92/70/608479270.db2.gz JJAVBKUDKPPDRT-UHFFFAOYSA-N -1 3 354.439 3.849 20 0 FHADHM CSc1cccc(NC(=O)Nc2cc(-c3nn[n-]n3)ccc2C)c1C ZINC000826230767 608479271 /nfs/dbraw/zinc/47/92/71/608479271.db2.gz JJAVBKUDKPPDRT-UHFFFAOYSA-N -1 3 354.439 3.849 20 0 FHADHM Fc1c(CNc2ccc(OC(F)(F)F)cc2)cccc1-c1nnn[n-]1 ZINC000826371061 608479649 /nfs/dbraw/zinc/47/96/49/608479649.db2.gz QROQBVTUDXHCCB-UHFFFAOYSA-N -1 3 353.279 3.517 20 0 FHADHM Fc1c(CNc2ccc(OC(F)(F)F)cc2)cccc1-c1nn[n-]n1 ZINC000826371061 608479650 /nfs/dbraw/zinc/47/96/50/608479650.db2.gz QROQBVTUDXHCCB-UHFFFAOYSA-N -1 3 353.279 3.517 20 0 FHADHM Cc1cc(C)c(C(=O)N2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)c(C)c1 ZINC000826263007 608486906 /nfs/dbraw/zinc/48/69/06/608486906.db2.gz HVEZJXKPCHZCCE-UHFFFAOYSA-N -1 3 373.460 3.721 20 0 FHADHM Cc1cc(C)c(C(=O)N2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)c(C)c1 ZINC000826263007 608486907 /nfs/dbraw/zinc/48/69/07/608486907.db2.gz HVEZJXKPCHZCCE-UHFFFAOYSA-N -1 3 373.460 3.721 20 0 FHADHM CC[C@@H](C(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1)c1ccccc1 ZINC000825038693 608487745 /nfs/dbraw/zinc/48/77/45/608487745.db2.gz GCVYRVJOGRJXPW-HXUWFJFHSA-N -1 3 373.460 3.676 20 0 FHADHM CC[C@@H](C(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1)c1ccccc1 ZINC000825038693 608487746 /nfs/dbraw/zinc/48/77/46/608487746.db2.gz GCVYRVJOGRJXPW-HXUWFJFHSA-N -1 3 373.460 3.676 20 0 FHADHM C[C@@H](c1nc2ccccc2s1)N(C)Cc1cc(-c2nnn[n-]2)cs1 ZINC000824776478 608503422 /nfs/dbraw/zinc/50/34/22/608503422.db2.gz BGCXPTAOSVJBEK-JTQLQIEISA-N -1 3 356.480 3.731 20 0 FHADHM C[C@@H](c1nc2ccccc2s1)N(C)Cc1cc(-c2nn[n-]n2)cs1 ZINC000824776478 608503424 /nfs/dbraw/zinc/50/34/24/608503424.db2.gz BGCXPTAOSVJBEK-JTQLQIEISA-N -1 3 356.480 3.731 20 0 FHADHM CCc1nc([C@@H](C)N[C@H]2CCCc3cc(-c4nn[n-]n4)ccc32)cs1 ZINC000825746162 608510569 /nfs/dbraw/zinc/51/05/69/608510569.db2.gz SJPHVJKLPSXUQC-ABAIWWIYSA-N -1 3 354.483 3.614 20 0 FHADHM Cc1ccc2nc(NC(=O)c3ccc(Cl)c(-c4nnn[n-]4)c3)sc2c1 ZINC000826295749 608574047 /nfs/dbraw/zinc/57/40/47/608574047.db2.gz WHWPAGVYOIICKR-UHFFFAOYSA-N -1 3 370.825 3.691 20 0 FHADHM Cc1ccc2nc(NC(=O)c3ccc(Cl)c(-c4nn[n-]n4)c3)sc2c1 ZINC000826295749 608574048 /nfs/dbraw/zinc/57/40/48/608574048.db2.gz WHWPAGVYOIICKR-UHFFFAOYSA-N -1 3 370.825 3.691 20 0 FHADHM O=C(Nc1ccc(C(F)(F)F)cc1)c1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000826453631 608574241 /nfs/dbraw/zinc/57/42/41/608574241.db2.gz SIDJBUWAFUTJJH-UHFFFAOYSA-N -1 3 367.718 3.791 20 0 FHADHM O=C(Nc1ccc(C(F)(F)F)cc1)c1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000826453631 608574243 /nfs/dbraw/zinc/57/42/43/608574243.db2.gz SIDJBUWAFUTJJH-UHFFFAOYSA-N -1 3 367.718 3.791 20 0 FHADHM CCc1cccc2c1N(C(=O)c1ccc(Cl)c(-c3nnn[n-]3)c1)CCC2 ZINC000825723177 608576601 /nfs/dbraw/zinc/57/66/01/608576601.db2.gz SYIOZIIXRGAADT-UHFFFAOYSA-N -1 3 367.840 3.676 20 0 FHADHM CCc1cccc2c1N(C(=O)c1ccc(Cl)c(-c3nn[n-]n3)c1)CCC2 ZINC000825723177 608576602 /nfs/dbraw/zinc/57/66/02/608576602.db2.gz SYIOZIIXRGAADT-UHFFFAOYSA-N -1 3 367.840 3.676 20 0 FHADHM CC(C)[C@@H](OC(=O)Cc1ccc(-c2nnn[n-]2)cc1)c1ccc(F)c(F)c1 ZINC000824207273 608596205 /nfs/dbraw/zinc/59/62/05/608596205.db2.gz SOCKRDWESCCLCL-GOSISDBHSA-N -1 3 372.375 3.628 20 0 FHADHM CC(C)[C@@H](OC(=O)Cc1ccc(-c2nn[n-]n2)cc1)c1ccc(F)c(F)c1 ZINC000824207273 608596209 /nfs/dbraw/zinc/59/62/09/608596209.db2.gz SOCKRDWESCCLCL-GOSISDBHSA-N -1 3 372.375 3.628 20 0 FHADHM Clc1ccc2[nH]c3c(c2c1)CN(Cc1cc(-c2nnn[n-]2)cs1)CC3 ZINC000826352427 608599605 /nfs/dbraw/zinc/59/96/05/608599605.db2.gz AFNDFQXVPSCWRP-UHFFFAOYSA-N -1 3 370.869 3.621 20 0 FHADHM Clc1ccc2[nH]c3c(c2c1)CN(Cc1cc(-c2nn[n-]n2)cs1)CC3 ZINC000826352427 608599608 /nfs/dbraw/zinc/59/96/08/608599608.db2.gz AFNDFQXVPSCWRP-UHFFFAOYSA-N -1 3 370.869 3.621 20 0 FHADHM CCCOc1ccc(NC(=O)Nc2cccc(-c3nnn[n-]3)c2C)cc1 ZINC000825338732 608607638 /nfs/dbraw/zinc/60/76/38/608607638.db2.gz GUQXDCVSDGSRCP-UHFFFAOYSA-N -1 3 352.398 3.608 20 0 FHADHM CCCOc1ccc(NC(=O)Nc2cccc(-c3nn[n-]n3)c2C)cc1 ZINC000825338732 608607640 /nfs/dbraw/zinc/60/76/40/608607640.db2.gz GUQXDCVSDGSRCP-UHFFFAOYSA-N -1 3 352.398 3.608 20 0 FHADHM Fc1cccc(CN(Cc2ccoc2)Cc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000826376964 608612681 /nfs/dbraw/zinc/61/26/81/608612681.db2.gz ZELGYQMBBAORDD-UHFFFAOYSA-N -1 3 363.396 3.801 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)Nc1cnc(-c2ccccc2)s1 ZINC000826402597 608637709 /nfs/dbraw/zinc/63/77/09/608637709.db2.gz XUZDRRAXTPDDJD-ZHACJKMWSA-N -1 3 374.429 3.642 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)Nc1cnc(-c2ccccc2)s1 ZINC000826402597 608637714 /nfs/dbraw/zinc/63/77/14/608637714.db2.gz XUZDRRAXTPDDJD-ZHACJKMWSA-N -1 3 374.429 3.642 20 0 FHADHM CCCCn1c(C)c(C)nc1SCc1cccc(-c2nnn[n-]2)c1F ZINC000825296897 608668316 /nfs/dbraw/zinc/66/83/16/608668316.db2.gz ZKVNOVSUPLNIOQ-UHFFFAOYSA-N -1 3 360.462 3.912 20 0 FHADHM CCCCn1c(C)c(C)nc1SCc1cccc(-c2nn[n-]n2)c1F ZINC000825296897 608668317 /nfs/dbraw/zinc/66/83/17/608668317.db2.gz ZKVNOVSUPLNIOQ-UHFFFAOYSA-N -1 3 360.462 3.912 20 0 FHADHM Fc1ccc(F)c(CN(Cc2ccc(-c3nnn[n-]3)o2)C2CCCC2)c1 ZINC000826374549 608745073 /nfs/dbraw/zinc/74/50/73/608745073.db2.gz DFIDPICSPGZXOG-UHFFFAOYSA-N -1 3 359.380 3.683 20 0 FHADHM Fc1ccc(F)c(CN(Cc2ccc(-c3nn[n-]n3)o2)C2CCCC2)c1 ZINC000826374549 608745075 /nfs/dbraw/zinc/74/50/75/608745075.db2.gz DFIDPICSPGZXOG-UHFFFAOYSA-N -1 3 359.380 3.683 20 0 FHADHM FC(F)(F)c1cccc([C@H](Nc2ccc(-c3nnn[n-]3)cn2)C2CC2)c1 ZINC000826369143 608800141 /nfs/dbraw/zinc/80/01/41/608800141.db2.gz ORDDIZOGCRKRBJ-OAHLLOKOSA-N -1 3 360.343 3.844 20 0 FHADHM FC(F)(F)c1cccc([C@H](Nc2ccc(-c3nn[n-]n3)cn2)C2CC2)c1 ZINC000826369143 608800144 /nfs/dbraw/zinc/80/01/44/608800144.db2.gz ORDDIZOGCRKRBJ-OAHLLOKOSA-N -1 3 360.343 3.844 20 0 FHADHM Cc1cc(CNc2ccc(-c3nn[n-]n3)cc2)ccc1Oc1cccnc1 ZINC000826266911 608868782 /nfs/dbraw/zinc/86/87/82/608868782.db2.gz HSCNCZGWPXCREI-UHFFFAOYSA-N -1 3 358.405 3.975 20 0 FHADHM Cn1nc(-c2ccccc2)c(CNc2cccc(-c3nnn[n-]3)c2)c1Cl ZINC000826366219 608869527 /nfs/dbraw/zinc/86/95/27/608869527.db2.gz XWVSLVKPSBTQSP-UHFFFAOYSA-N -1 3 365.828 3.533 20 0 FHADHM Cn1nc(-c2ccccc2)c(CNc2cccc(-c3nn[n-]n3)c2)c1Cl ZINC000826366219 608869529 /nfs/dbraw/zinc/86/95/29/608869529.db2.gz XWVSLVKPSBTQSP-UHFFFAOYSA-N -1 3 365.828 3.533 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@@H]2/C=C/c2ccccc2)cccc1-c1nnn[n-]1 ZINC000826241352 609159845 /nfs/dbraw/zinc/15/98/45/609159845.db2.gz ANGCVWHULUTBCV-GZKZCVOOSA-N -1 3 374.448 3.885 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@@H]2/C=C/c2ccccc2)cccc1-c1nn[n-]n1 ZINC000826241352 609159846 /nfs/dbraw/zinc/15/98/46/609159846.db2.gz ANGCVWHULUTBCV-GZKZCVOOSA-N -1 3 374.448 3.885 20 0 FHADHM C[C@H](Nc1ccc(OC(F)F)c(F)c1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824658415 609179927 /nfs/dbraw/zinc/17/99/27/609179927.db2.gz XALMXMJVFPXXCW-QMMMGPOBSA-N -1 3 367.306 3.919 20 0 FHADHM C[C@H](Nc1ccc(OC(F)F)c(F)c1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824658415 609179928 /nfs/dbraw/zinc/17/99/28/609179928.db2.gz XALMXMJVFPXXCW-QMMMGPOBSA-N -1 3 367.306 3.919 20 0 FHADHM Cc1csc(C2(N[C@@H](C)c3ccc(-c4nnn[n-]4)c(F)c3)CCC2)n1 ZINC000826320606 609187032 /nfs/dbraw/zinc/18/70/32/609187032.db2.gz XEBVSWRSTFULOD-NSHDSACASA-N -1 3 358.446 3.501 20 0 FHADHM Cc1csc(C2(N[C@@H](C)c3ccc(-c4nn[n-]n4)c(F)c3)CCC2)n1 ZINC000826320606 609187033 /nfs/dbraw/zinc/18/70/33/609187033.db2.gz XEBVSWRSTFULOD-NSHDSACASA-N -1 3 358.446 3.501 20 0 FHADHM Cn1c(CNc2ccc(Cl)c(-c3nnn[n-]3)c2)nc2ccc(Cl)cc21 ZINC000826354968 609200139 /nfs/dbraw/zinc/20/01/39/609200139.db2.gz DMJHXWDDEJRGEJ-UHFFFAOYSA-N -1 3 374.235 3.672 20 0 FHADHM Cn1c(CNc2ccc(Cl)c(-c3nn[n-]n3)c2)nc2ccc(Cl)cc21 ZINC000826354968 609200141 /nfs/dbraw/zinc/20/01/41/609200141.db2.gz DMJHXWDDEJRGEJ-UHFFFAOYSA-N -1 3 374.235 3.672 20 0 FHADHM C[C@@H](c1ccccc1)N(Cc1ccccc1)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC000824773017 609204017 /nfs/dbraw/zinc/20/40/17/609204017.db2.gz XQAVAXJAIIQRRF-HNNXBMFYSA-N -1 3 372.432 3.598 20 0 FHADHM C[C@@H](c1ccccc1)N(Cc1ccccc1)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC000824773017 609204018 /nfs/dbraw/zinc/20/40/18/609204018.db2.gz XQAVAXJAIIQRRF-HNNXBMFYSA-N -1 3 372.432 3.598 20 0 FHADHM C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC000824763275 609218701 /nfs/dbraw/zinc/21/87/01/609218701.db2.gz MMURLSKTRDZEGL-CQSZACIVSA-N -1 3 372.432 3.695 20 0 FHADHM C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC000824763275 609218702 /nfs/dbraw/zinc/21/87/02/609218702.db2.gz MMURLSKTRDZEGL-CQSZACIVSA-N -1 3 372.432 3.695 20 0 FHADHM COc1cc(N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)ccc1Br ZINC000826180732 609243637 /nfs/dbraw/zinc/24/36/37/609243637.db2.gz UOXHXZREEBXEFG-JTQLQIEISA-N -1 3 374.242 3.811 20 0 FHADHM COc1cc(N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)ccc1Br ZINC000826180732 609243639 /nfs/dbraw/zinc/24/36/39/609243639.db2.gz UOXHXZREEBXEFG-JTQLQIEISA-N -1 3 374.242 3.811 20 0 FHADHM Brc1cncc(N[C@H]2CCCc3cc(-c4nnn[n-]4)ccc32)c1 ZINC000823832424 609252549 /nfs/dbraw/zinc/25/25/49/609252549.db2.gz NUUJTGWARVKFHV-HNNXBMFYSA-N -1 3 371.242 3.514 20 0 FHADHM Brc1cncc(N[C@H]2CCCc3cc(-c4nn[n-]n4)ccc32)c1 ZINC000823832424 609252551 /nfs/dbraw/zinc/25/25/51/609252551.db2.gz NUUJTGWARVKFHV-HNNXBMFYSA-N -1 3 371.242 3.514 20 0 FHADHM CCOc1cc2c(cc1N[C@H](C)c1ccc(-c3nnn[n-]3)cc1)O[C@@H](C)C2 ZINC000825621504 609273779 /nfs/dbraw/zinc/27/37/79/609273779.db2.gz VFVGRDWTRVDBBL-QWHCGFSZSA-N -1 3 365.437 3.762 20 0 FHADHM CCOc1cc2c(cc1N[C@H](C)c1ccc(-c3nn[n-]n3)cc1)O[C@@H](C)C2 ZINC000825621504 609273781 /nfs/dbraw/zinc/27/37/81/609273781.db2.gz VFVGRDWTRVDBBL-QWHCGFSZSA-N -1 3 365.437 3.762 20 0 FHADHM C[C@@H](Nc1cccc(OCC(F)(F)F)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824663358 609274406 /nfs/dbraw/zinc/27/44/06/609274406.db2.gz YBURGDXAHUSIJZ-LLVKDONJSA-N -1 3 363.343 3.981 20 0 FHADHM C[C@@H](Nc1cccc(OCC(F)(F)F)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824663358 609274408 /nfs/dbraw/zinc/27/44/08/609274408.db2.gz YBURGDXAHUSIJZ-LLVKDONJSA-N -1 3 363.343 3.981 20 0 FHADHM C[C@@H](Nc1ccc(-n2ccnc2)c(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824658611 609277733 /nfs/dbraw/zinc/27/77/33/609277733.db2.gz YTIRNRZSFJLOEZ-GFCCVEGCSA-N -1 3 365.828 3.879 20 0 FHADHM C[C@@H](Nc1ccc(-n2ccnc2)c(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824658611 609277735 /nfs/dbraw/zinc/27/77/35/609277735.db2.gz YTIRNRZSFJLOEZ-GFCCVEGCSA-N -1 3 365.828 3.879 20 0 FHADHM COc1ccc(OC(C)C)c(N[C@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)c1 ZINC000826210102 609278756 /nfs/dbraw/zinc/27/87/56/609278756.db2.gz DOPBXIBHHNNAEY-GFCCVEGCSA-N -1 3 371.416 3.975 20 0 FHADHM COc1ccc(OC(C)C)c(N[C@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)c1 ZINC000826210102 609278758 /nfs/dbraw/zinc/27/87/58/609278758.db2.gz DOPBXIBHHNNAEY-GFCCVEGCSA-N -1 3 371.416 3.975 20 0 FHADHM C[C@@H](Nc1ccc2c(cnn2C(F)F)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824657906 609279146 /nfs/dbraw/zinc/27/91/46/609279146.db2.gz SJKXXRXOULLJDS-SNVBAGLBSA-N -1 3 355.352 3.785 20 0 FHADHM C[C@@H](Nc1ccc2c(cnn2C(F)F)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824657906 609279148 /nfs/dbraw/zinc/27/91/48/609279148.db2.gz SJKXXRXOULLJDS-SNVBAGLBSA-N -1 3 355.352 3.785 20 0 FHADHM Cc1cc(Br)ccc1CSc1ccc(-c2nnn[n-]2)cn1 ZINC000826256757 609308933 /nfs/dbraw/zinc/30/89/33/609308933.db2.gz YXMABHOFIQDOCF-UHFFFAOYSA-N -1 3 362.256 3.625 20 0 FHADHM Cc1cc(Br)ccc1CSc1ccc(-c2nn[n-]n2)cn1 ZINC000826256757 609308935 /nfs/dbraw/zinc/30/89/35/609308935.db2.gz YXMABHOFIQDOCF-UHFFFAOYSA-N -1 3 362.256 3.625 20 0 FHADHM Clc1ccc(C2=CCN(c3ncccc3-c3nnn[n-]3)CC2)cc1Cl ZINC000826351217 609312497 /nfs/dbraw/zinc/31/24/97/609312497.db2.gz CXHBIUCCUSZLHJ-UHFFFAOYSA-N -1 3 373.247 3.862 20 0 FHADHM Clc1ccc(C2=CCN(c3ncccc3-c3nn[n-]n3)CC2)cc1Cl ZINC000826351217 609312499 /nfs/dbraw/zinc/31/24/99/609312499.db2.gz CXHBIUCCUSZLHJ-UHFFFAOYSA-N -1 3 373.247 3.862 20 0 FHADHM COCC[C@H](Nc1ccc2cc(-c3nnn[n-]3)ccc2n1)c1ccc(C)o1 ZINC000826155220 609323053 /nfs/dbraw/zinc/32/30/53/609323053.db2.gz JZFJDENFCQFFOO-INIZCTEOSA-N -1 3 364.409 3.506 20 0 FHADHM COCC[C@H](Nc1ccc2cc(-c3nn[n-]n3)ccc2n1)c1ccc(C)o1 ZINC000826155220 609323055 /nfs/dbraw/zinc/32/30/55/609323055.db2.gz JZFJDENFCQFFOO-INIZCTEOSA-N -1 3 364.409 3.506 20 0 FHADHM CCOc1cc(C)ccc1CN[C@@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000825616100 609340262 /nfs/dbraw/zinc/34/02/62/609340262.db2.gz WLOWEWVJUJLATJ-ZDUSSCGKSA-N -1 3 355.417 3.564 20 0 FHADHM Cc1c(NCc2ccc(-c3nnn[n-]3)s2)cnn1-c1cc(C)ccc1C ZINC000826284311 609344642 /nfs/dbraw/zinc/34/46/42/609344642.db2.gz PZGVHRVRUHIODW-UHFFFAOYSA-N -1 3 365.466 3.651 20 0 FHADHM C[C@H](Nc1ccc(OCC2CC2)cc1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824656180 609347282 /nfs/dbraw/zinc/34/72/82/609347282.db2.gz IRSUHXDNSSKWDX-LBPRGKRZSA-N -1 3 353.401 3.968 20 0 FHADHM C[C@H](Nc1ccc(OCC2CC2)cc1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824656180 609347283 /nfs/dbraw/zinc/34/72/83/609347283.db2.gz IRSUHXDNSSKWDX-LBPRGKRZSA-N -1 3 353.401 3.968 20 0 FHADHM C[C@@H]1CC[C@]2(CCN(C(=O)Nc3ccc(-c4nnn[n-]4)c(Cl)c3)C2)C1 ZINC000824915734 609403307 /nfs/dbraw/zinc/40/33/07/609403307.db2.gz HXFXONZRHPTXRG-DIFFPNOSSA-N -1 3 360.849 3.564 20 0 FHADHM C[C@@H]1CC[C@]2(CCN(C(=O)Nc3ccc(-c4nn[n-]n4)c(Cl)c3)C2)C1 ZINC000824915734 609403308 /nfs/dbraw/zinc/40/33/08/609403308.db2.gz HXFXONZRHPTXRG-DIFFPNOSSA-N -1 3 360.849 3.564 20 0 FHADHM CC(=O)c1ccc(-c2nnn[n-]2)cc1N[C@@H](C)c1ccc(OC(F)F)cc1 ZINC000824019468 609419053 /nfs/dbraw/zinc/41/90/53/609419053.db2.gz BMFAPPVQYZIGCP-JTQLQIEISA-N -1 3 373.363 3.844 20 0 FHADHM CC(=O)c1ccc(-c2nn[n-]n2)cc1N[C@@H](C)c1ccc(OC(F)F)cc1 ZINC000824019468 609419054 /nfs/dbraw/zinc/41/90/54/609419054.db2.gz BMFAPPVQYZIGCP-JTQLQIEISA-N -1 3 373.363 3.844 20 0 FHADHM CC[C@@H](C)NC(=O)N[C@H](C)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000825068447 609441023 /nfs/dbraw/zinc/44/10/23/609441023.db2.gz RUDJLNHTPWKRIS-ZIAGYGMSSA-N -1 3 364.453 3.692 20 0 FHADHM CC[C@@H](C)NC(=O)N[C@H](C)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000825068447 609441026 /nfs/dbraw/zinc/44/10/26/609441026.db2.gz RUDJLNHTPWKRIS-ZIAGYGMSSA-N -1 3 364.453 3.692 20 0 FHADHM COc1cc(NCc2ccc(-c3nnn[n-]3)cc2)cc(OC)c1C(C)C ZINC000826180807 609446155 /nfs/dbraw/zinc/44/61/55/609446155.db2.gz XURYIVRKARXJJP-UHFFFAOYSA-N -1 3 353.426 3.619 20 0 FHADHM COc1cc(NCc2ccc(-c3nn[n-]n3)cc2)cc(OC)c1C(C)C ZINC000826180807 609446157 /nfs/dbraw/zinc/44/61/57/609446157.db2.gz XURYIVRKARXJJP-UHFFFAOYSA-N -1 3 353.426 3.619 20 0 FHADHM O=C1CCCCC[C@H]1Sc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000826480267 609453405 /nfs/dbraw/zinc/45/34/05/609453405.db2.gz WJRCYCASWAKFRI-CYBMUJFWSA-N -1 3 356.373 3.879 20 0 FHADHM O=C1CCCCC[C@H]1Sc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000826480267 609453406 /nfs/dbraw/zinc/45/34/06/609453406.db2.gz WJRCYCASWAKFRI-CYBMUJFWSA-N -1 3 356.373 3.879 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NCc1cccc(-c2ccccn2)c1 ZINC000825632539 609477246 /nfs/dbraw/zinc/47/72/46/609477246.db2.gz WFETVBSICMNOCR-UHFFFAOYSA-N -1 3 372.432 3.940 20 0 FHADHM Fc1ccc(NCc2cccc(-c3nnn[n-]3)c2F)cc1Br ZINC000826375336 609479315 /nfs/dbraw/zinc/47/93/15/609479315.db2.gz JGYCLKNKZPYJSE-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1ccc(NCc2cccc(-c3nn[n-]n3)c2F)cc1Br ZINC000826375336 609479316 /nfs/dbraw/zinc/47/93/16/609479316.db2.gz JGYCLKNKZPYJSE-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NCc1cnc(C2CCCC2)s1 ZINC000826186876 609482069 /nfs/dbraw/zinc/48/20/69/609482069.db2.gz NVYJJCQYROWXGD-UHFFFAOYSA-N -1 3 356.455 3.602 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NCc1cnc(C2CCCC2)s1 ZINC000826186876 609482072 /nfs/dbraw/zinc/48/20/72/609482072.db2.gz NVYJJCQYROWXGD-UHFFFAOYSA-N -1 3 356.455 3.602 20 0 FHADHM Cc1c(NCc2ccc(OCc3ccncc3)cc2)cccc1-c1nnn[n-]1 ZINC000826242439 609486134 /nfs/dbraw/zinc/48/61/34/609486134.db2.gz OVLFQSDKMONOEF-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM Cc1c(NCc2ccc(OCc3ccncc3)cc2)cccc1-c1nn[n-]n1 ZINC000826242439 609486137 /nfs/dbraw/zinc/48/61/37/609486137.db2.gz OVLFQSDKMONOEF-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM CC(C)Oc1ccc(NCc2nc3c(s2)CCCC3)cc1-c1nnn[n-]1 ZINC000824329973 609489971 /nfs/dbraw/zinc/48/99/71/609489971.db2.gz ZKYUFXVLEFMBHB-UHFFFAOYSA-N -1 3 370.482 3.601 20 0 FHADHM CC(C)Oc1ccc(NCc2nc3c(s2)CCCC3)cc1-c1nn[n-]n1 ZINC000824329973 609489974 /nfs/dbraw/zinc/48/99/74/609489974.db2.gz ZKYUFXVLEFMBHB-UHFFFAOYSA-N -1 3 370.482 3.601 20 0 FHADHM C[C@H]1CCC[C@@H]1C(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000824930050 609501458 /nfs/dbraw/zinc/50/14/58/609501458.db2.gz ZVNDRGNRNPPAKQ-WFASDCNBSA-N -1 3 367.478 3.648 20 0 FHADHM Cc1cc(NCc2cccc(-c3nn[n-]n3)c2)cnc1N1CCCC[C@H]1C ZINC000826271434 609512685 /nfs/dbraw/zinc/51/26/85/609512685.db2.gz RBMZIVHUTIGPBI-OAHLLOKOSA-N -1 3 363.469 3.561 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)C1C[C@@H](C)C[C@H](C)C1 ZINC000824875763 609521161 /nfs/dbraw/zinc/52/11/61/609521161.db2.gz OTAIXKFWSJCRIC-GJZGRUSLSA-N -1 3 355.486 3.676 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)C1C[C@@H](C)C[C@H](C)C1 ZINC000824875763 609521162 /nfs/dbraw/zinc/52/11/62/609521162.db2.gz OTAIXKFWSJCRIC-GJZGRUSLSA-N -1 3 355.486 3.676 20 0 FHADHM COc1ccc([C@@H]2CCCN2c2ncc(Cl)c(C)c2-c2nnn[n-]2)cc1 ZINC000826189761 609521815 /nfs/dbraw/zinc/52/18/15/609521815.db2.gz DNEKXSYFCICLIF-HNNXBMFYSA-N -1 3 370.844 3.574 20 0 FHADHM COc1ccc([C@@H]2CCCN2c2ncc(Cl)c(C)c2-c2nn[n-]n2)cc1 ZINC000826189761 609521818 /nfs/dbraw/zinc/52/18/18/609521818.db2.gz DNEKXSYFCICLIF-HNNXBMFYSA-N -1 3 370.844 3.574 20 0 FHADHM Cc1c(Cl)cnc(N[C@H]2CCSc3ccccc32)c1-c1nnn[n-]1 ZINC000826239826 609522425 /nfs/dbraw/zinc/52/24/25/609522425.db2.gz RGBIIXOBERXXDZ-LBPRGKRZSA-N -1 3 358.858 3.873 20 0 FHADHM Cc1c(Cl)cnc(N[C@H]2CCSc3ccccc32)c1-c1nn[n-]n1 ZINC000826239826 609522427 /nfs/dbraw/zinc/52/24/27/609522427.db2.gz RGBIIXOBERXXDZ-LBPRGKRZSA-N -1 3 358.858 3.873 20 0 FHADHM CC/C(C)=C(/C)C(=O)N(Cc1ccco1)c1ccccc1-c1nnn[n-]1 ZINC000825052211 609524745 /nfs/dbraw/zinc/52/47/45/609524745.db2.gz WAXZYYGADGJIMQ-YPKPFQOOSA-N -1 3 351.410 3.739 20 0 FHADHM CC/C(C)=C(/C)C(=O)N(Cc1ccco1)c1ccccc1-c1nn[n-]n1 ZINC000825052211 609524747 /nfs/dbraw/zinc/52/47/47/609524747.db2.gz WAXZYYGADGJIMQ-YPKPFQOOSA-N -1 3 351.410 3.739 20 0 FHADHM Cc1ccnc(N[C@H](C)c2ccc(-c3ccncc3)cc2)c1-c1nnn[n-]1 ZINC000826311672 609567406 /nfs/dbraw/zinc/56/74/06/609567406.db2.gz KRNYVEJJZAEAJP-CQSZACIVSA-N -1 3 357.421 3.805 20 0 FHADHM Cc1ccnc(N[C@H](C)c2ccc(-c3ccncc3)cc2)c1-c1nn[n-]n1 ZINC000826311672 609567408 /nfs/dbraw/zinc/56/74/08/609567408.db2.gz KRNYVEJJZAEAJP-CQSZACIVSA-N -1 3 357.421 3.805 20 0 FHADHM Fc1cccc([C@H](NCc2ccccc2-c2nnn[n-]2)C(F)(F)F)c1F ZINC000826376494 609608218 /nfs/dbraw/zinc/60/82/18/609608218.db2.gz GJKQYVGUGDJEDP-AWEZNQCLSA-N -1 3 369.297 3.538 20 0 FHADHM Fc1cccc([C@H](NCc2ccccc2-c2nn[n-]n2)C(F)(F)F)c1F ZINC000826376494 609608219 /nfs/dbraw/zinc/60/82/19/609608219.db2.gz GJKQYVGUGDJEDP-AWEZNQCLSA-N -1 3 369.297 3.538 20 0 FHADHM CCCOc1ccc(Br)cc1CN=c1[n-]nc(C)n1C1CC1 ZINC000583014947 936368866 /nfs/dbraw/zinc/36/88/66/936368866.db2.gz MGNCCHHLPMJFAN-UHFFFAOYSA-N -1 3 365.275 3.507 20 0 FHADHM CCCCCOc1ccc(C(=O)Nc2ccc(Cc3nnn[n-]3)cc2)cc1 ZINC000427083335 945066465 /nfs/dbraw/zinc/06/64/65/945066465.db2.gz ZYUGSCYIMHTZEL-UHFFFAOYSA-N -1 3 365.437 3.612 20 0 FHADHM CCCCCOc1ccc(C(=O)Nc2ccc(Cc3nn[n-]n3)cc2)cc1 ZINC000427083335 945066479 /nfs/dbraw/zinc/06/64/79/945066479.db2.gz ZYUGSCYIMHTZEL-UHFFFAOYSA-N -1 3 365.437 3.612 20 0 FHADHM CCSCC[C@H](C)[N-]S(=O)(=O)c1sc(C)cc1Br ZINC000437702583 944045461 /nfs/dbraw/zinc/04/54/61/944045461.db2.gz JBDPXFVYBDYURN-QMMMGPOBSA-N -1 3 372.375 3.629 20 0 FHADHM Cc1sc2[n-]c([C@H](C)OC(=O)c3ccc(C)nc3C)nc(=O)c2c1C ZINC000052107923 937132483 /nfs/dbraw/zinc/13/24/83/937132483.db2.gz KXCDPLKTWQTVJT-NSHDSACASA-N -1 3 357.435 3.531 20 0 FHADHM Fc1cc(-c2noc(-c3cc(Cl)n[n-]3)n2)cc(F)c1Br ZINC001213500655 927220677 /nfs/dbraw/zinc/22/06/77/927220677.db2.gz NUWMRIOXRRCCSW-UHFFFAOYSA-N -1 3 361.533 3.821 20 0 FHADHM CCS(=O)(=O)[N-]c1ccc(NC(=O)C[C@H]2CCC[C@@H](C)C2)cc1OC ZINC000153911228 937147333 /nfs/dbraw/zinc/14/73/33/937147333.db2.gz IXTFBEFPQUQMGY-KGLIPLIRSA-N -1 3 368.499 3.612 20 0 FHADHM CC[C@H]([N-]S(=O)(=O)c1cc(Cl)ccc1C(F)(F)F)[C@@H]1CCCO1 ZINC000510047541 927404738 /nfs/dbraw/zinc/40/47/38/927404738.db2.gz AGQLRDBVZJBJIU-RYUDHWBXSA-N -1 3 371.808 3.595 20 0 FHADHM O=C(NCc1ncccc1[O-])Nc1ccc(Oc2ccc(Cl)cn2)cc1 ZINC000467963135 927439743 /nfs/dbraw/zinc/43/97/43/927439743.db2.gz 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CCCCc1nc(NC(=O)Cc2coc3ccccc23)c(C(=O)OCC)[n-]1 ZINC000584255794 938661260 /nfs/dbraw/zinc/66/12/60/938661260.db2.gz XNMXXBQVPMVYNY-UHFFFAOYSA-N -1 3 369.421 3.856 20 0 FHADHM CCOCCC1(CNc2ccc(-c3nc(CC)cc(=O)[n-]3)cn2)CCCC1 ZINC000151832582 938692855 /nfs/dbraw/zinc/69/28/55/938692855.db2.gz IPEOQDSIKMIRDI-UHFFFAOYSA-N -1 3 370.497 3.793 20 0 FHADHM CCO[C@H]1C[C@@H](N(C)Cc2oc(-c3ccccc3)nc2C(=O)[O-])C1(C)C ZINC000518201062 945197495 /nfs/dbraw/zinc/19/74/95/945197495.db2.gz QZYRCIUJANKJDB-CVEARBPZSA-N -1 3 358.438 3.675 20 0 FHADHM O=C(c1ccccc1[O-])N1CCN(c2ccnc3ccc(Cl)cc32)CC1 ZINC000089589086 938866465 /nfs/dbraw/zinc/86/64/65/938866465.db2.gz OXPSNVDVXNIJKP-UHFFFAOYSA-N -1 3 367.836 3.556 20 0 FHADHM CC(C)c1ccc(C(=O)N[N-]C(=O)c2ccc(Cl)cc2Cl)cn1 ZINC000161239178 938887560 /nfs/dbraw/zinc/88/75/60/938887560.db2.gz KGILZGPXLAHKPA-UHFFFAOYSA-N -1 3 352.221 3.587 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N3CCC[C@H]3c3cccc(F)c3)nc2)n1 ZINC000091454726 938901491 /nfs/dbraw/zinc/90/14/91/938901491.db2.gz ROSOXLACRARBKB-SFHVURJKSA-N -1 3 364.424 3.875 20 0 FHADHM O=C(C[C@@H]1C=CCCC1)N[N-]C(=O)c1ccc(Br)cc1Cl ZINC000187591830 938917474 /nfs/dbraw/zinc/91/74/74/938917474.db2.gz GKYARGFGROVORM-SNVBAGLBSA-N -1 3 371.662 3.610 20 0 FHADHM CC(C)(O)[C@H]1CCCN1C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000092929790 938923418 /nfs/dbraw/zinc/92/34/18/938923418.db2.gz KUSBLDJQBHTROZ-HXUWFJFHSA-N -1 3 353.462 3.553 20 0 FHADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CCOCC12CCC2 ZINC000093097563 938925951 /nfs/dbraw/zinc/92/59/51/938925951.db2.gz VJUHVDNXBFCUSQ-UHFFFAOYSA-N -1 3 351.446 3.573 20 0 FHADHM Cc1cc(Br)cc(S(=O)(=O)[N-]c2cc(F)ccc2F)c1 ZINC000096170943 938936195 /nfs/dbraw/zinc/93/61/95/938936195.db2.gz XLNLQCRGBFNVML-UHFFFAOYSA-N -1 3 362.195 3.837 20 0 FHADHM CCCN(CCc1cccc(F)c1)C(=O)c1cc(OC)c([O-])c(OC)c1 ZINC000157800150 938965317 /nfs/dbraw/zinc/96/53/17/938965317.db2.gz LIZOSBJHQXCRCN-UHFFFAOYSA-N -1 3 361.413 3.643 20 0 FHADHM C[C@@H](NC(=O)c1cc(F)cc2n[n-]nc21)c1ccc(Cl)cc1Cl ZINC000431572153 938979116 /nfs/dbraw/zinc/97/91/16/938979116.db2.gz UZYQXVOMNKUPIX-SSDOTTSWSA-N -1 3 353.184 3.895 20 0 FHADHM CCOCCC1(C[N-]S(=O)(=O)c2cc(C)c(F)cc2F)CCCC1 ZINC000472343335 939001348 /nfs/dbraw/zinc/00/13/48/939001348.db2.gz CXCHNKSVARAPCD-UHFFFAOYSA-N -1 3 361.454 3.539 20 0 FHADHM C[C@@H]1CC[C@@H](C[N-]S(=O)(=O)c2cc(Cl)ccc2Br)C1 ZINC001211734467 939018785 /nfs/dbraw/zinc/01/87/85/939018785.db2.gz LSYAMAJOMHHLRF-NXEZZACHSA-N -1 3 366.708 3.817 20 0 FHADHM CC(=O)c1ccc(C(=O)N2CCCCC[C@H]2[C@H]2CCCCC2=O)cc1[O-] ZINC000612133557 939125046 /nfs/dbraw/zinc/12/50/46/939125046.db2.gz UDINNDNFDURMAJ-MSOLQXFVSA-N -1 3 357.450 3.739 20 0 FHADHM O=S(=O)([N-]Cc1cc2ccccc2[nH]1)c1csc(-c2ccccc2)n1 ZINC000500431473 945231965 /nfs/dbraw/zinc/23/19/65/945231965.db2.gz XRBDSQRHZCQZRK-UHFFFAOYSA-N -1 3 369.471 3.770 20 0 FHADHM Cc1ccc(S(=O)(=O)[N-]CC(C)(C)c2ccc(C(F)(F)F)cc2)o1 ZINC000468834094 945242917 /nfs/dbraw/zinc/24/29/17/945242917.db2.gz FCAWASILWNLUQF-UHFFFAOYSA-N -1 3 361.385 3.863 20 0 FHADHM c1ccc(-n2nc(CSc3ccccc3-c3nnn[n-]3)c3c2CCC3)cc1 ZINC000738425233 945266285 /nfs/dbraw/zinc/26/62/85/945266285.db2.gz MKLFEOOHTQLHBL-UHFFFAOYSA-N -1 3 374.473 3.833 20 0 FHADHM c1ccc(-n2nc(CSc3ccccc3-c3nn[n-]n3)c3c2CCC3)cc1 ZINC000738425233 945266296 /nfs/dbraw/zinc/26/62/96/945266296.db2.gz MKLFEOOHTQLHBL-UHFFFAOYSA-N -1 3 374.473 3.833 20 0 FHADHM CCCC(=CC(=O)N[C@@]1(C(=O)[O-])CCCN(Cc2ccccc2)C1)CCC ZINC001123277540 939819264 /nfs/dbraw/zinc/81/92/64/939819264.db2.gz KKJJIZGASLAMLB-QFIPXVFZSA-N -1 3 372.509 3.749 20 0 FHADHM CC[C@@H](CC(=O)N[C@]1(C(=O)[O-])CCCN(Cc2ccccc2)C1)C(C)(C)C ZINC001123379446 939823995 /nfs/dbraw/zinc/82/39/95/939823995.db2.gz VYXFQUZCTMZTMT-PGRDOPGGSA-N -1 3 374.525 3.684 20 0 FHADHM CN(C(=O)c1ccco1)c1ccccc1C(=O)Nc1cc(F)ccc1[O-] ZINC000179651300 939909865 /nfs/dbraw/zinc/90/98/65/939909865.db2.gz UHARRZMLDCFXHX-UHFFFAOYSA-N -1 3 354.337 3.653 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000819772236 945284201 /nfs/dbraw/zinc/28/42/01/945284201.db2.gz BCBOMVXYRPDSHN-HHQWOOOKSA-N -1 3 352.369 3.714 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000819772236 945284208 /nfs/dbraw/zinc/28/42/08/945284208.db2.gz BCBOMVXYRPDSHN-HHQWOOOKSA-N -1 3 352.369 3.714 20 0 FHADHM O=C(N=c1cc2ccc(Br)cn2[n-]1)c1coc2ccccc12 ZINC000511339756 939986539 /nfs/dbraw/zinc/98/65/39/939986539.db2.gz WFIGPWBPRCGXBE-UHFFFAOYSA-N -1 3 356.179 3.517 20 0 FHADHM O=C(/C=C\c1ccc(Cl)nc1)NCc1ccc([O-])c(Br)c1 ZINC000255865336 940051675 /nfs/dbraw/zinc/05/16/75/940051675.db2.gz QKXLWASHPUMINU-UTCJRWHESA-N -1 3 367.630 3.533 20 0 FHADHM COc1ccc([C@@H](Cc2ccccc2)NC(=O)c2cccc3n[n-]nc32)cc1 ZINC000570024456 940092976 /nfs/dbraw/zinc/09/29/76/940092976.db2.gz ISKXOCVBCWIOKQ-HXUWFJFHSA-N -1 3 372.428 3.680 20 0 FHADHM CCCCN(CC)c1ccc(C(=O)Nc2n[n-]c(-c3ccco3)n2)cc1 ZINC000511369291 940242513 /nfs/dbraw/zinc/24/25/13/940242513.db2.gz AVYLGCSXJRXPMF-UHFFFAOYSA-N -1 3 353.426 3.943 20 0 FHADHM COc1cc(C(=O)N2CCC[C@@H]2Cc2ccc(C)cc2)cc(OC)c1[O-] ZINC000163351068 940273050 /nfs/dbraw/zinc/27/30/50/940273050.db2.gz FXZINMMYIWJCST-QGZVFWFLSA-N -1 3 355.434 3.565 20 0 FHADHM Cc1ccc(CC(=O)[N-]OCc2ccccc2OCC(F)(F)F)cc1 ZINC000177578947 940291200 /nfs/dbraw/zinc/29/12/00/940291200.db2.gz KUBPNKXMYSOBCH-UHFFFAOYSA-N -1 3 353.340 3.727 20 0 FHADHM Cc1nc(C)c(CC(=O)O[C@H](Cc2ccccc2)C2CCCCC2)c(=O)[n-]1 ZINC000066232934 940341204 /nfs/dbraw/zinc/34/12/04/940341204.db2.gz JKQULDKLSLJLHH-HXUWFJFHSA-N -1 3 368.477 3.664 20 0 FHADHM CSc1ccc([O-])c(C(=O)N(Cc2ccccc2)[C@@H](CO)C2CC2)c1 ZINC000613230995 940488871 /nfs/dbraw/zinc/48/88/71/940488871.db2.gz VTKIUGOOWFVNIZ-SFHVURJKSA-N -1 3 357.475 3.527 20 0 FHADHM O=C(c1cc([O-])ccc1Cl)N(CCO)Cc1ccc(Cl)c(Cl)c1 ZINC000431810417 940627299 /nfs/dbraw/zinc/62/72/99/940627299.db2.gz HCNNSSWJIUMPDL-UHFFFAOYSA-N -1 3 374.651 3.987 20 0 FHADHM Cc1nc(C[N-]S(=O)(=O)Cc2cc(Cl)sc2Cl)sc1C ZINC000651585211 945336763 /nfs/dbraw/zinc/33/67/63/945336763.db2.gz KGPOAPQTSIFGSS-UHFFFAOYSA-N -1 3 371.336 3.748 20 0 FHADHM Cc1cc(Br)c(C(=O)[N-]c2nnc([C@H]3CCCO3)s2)s1 ZINC000636359502 940705209 /nfs/dbraw/zinc/70/52/09/940705209.db2.gz YPPNNYGNPQMBNZ-MRVPVSSYSA-N -1 3 374.285 3.774 20 0 FHADHM COC(=O)c1cccc2[n-]c(NC(=O)C3(c4ccccc4C)CCC3)nc21 ZINC000472557820 940790062 /nfs/dbraw/zinc/79/00/62/940790062.db2.gz FTWCSGVRYJRKMO-UHFFFAOYSA-N -1 3 363.417 3.718 20 0 FHADHM Cc1cc(S(=O)(=O)[N-][C@@H](c2ccccc2)c2ccncc2)c(F)cc1F ZINC000175789512 940929119 /nfs/dbraw/zinc/92/91/19/940929119.db2.gz JWRFZODYOKRZQU-IBGZPJMESA-N -1 3 374.412 3.736 20 0 FHADHM Cc1ncc(Cl)c(C(=O)[N-]c2nnc(-c3ccc(Cl)cc3)s2)n1 ZINC000134260303 940954900 /nfs/dbraw/zinc/95/49/00/940954900.db2.gz LRKUYJVFDBEMOS-UHFFFAOYSA-N -1 3 366.233 3.863 20 0 FHADHM O=C(Nc1ccc2c(c1)C(=O)[N-]C2=O)Nc1cccc(NC2CCCC2)c1 ZINC000176340307 941027766 /nfs/dbraw/zinc/02/77/66/941027766.db2.gz YUMGUZJLNPMGKT-UHFFFAOYSA-N -1 3 364.405 3.569 20 0 FHADHM O=C(CCCOc1ccccc1Br)[N-]OCCC(F)(F)F ZINC000162607911 941047095 /nfs/dbraw/zinc/04/70/95/941047095.db2.gz JVYUQXVGTGIPED-UHFFFAOYSA-N -1 3 370.165 3.608 20 0 FHADHM C=Cc1ccc(S(=O)(=O)[N-]c2ccc(O[C@@H]3CCCC[C@@H]3O)cc2)cc1 ZINC000414371553 941062641 /nfs/dbraw/zinc/06/26/41/941062641.db2.gz IYRVJDRIFAYTPG-VQTJNVASSA-N -1 3 373.474 3.813 20 0 FHADHM COC(C)(C)CS(=O)(=O)[N-]c1cccc(OCc2cccc(F)c2)c1 ZINC000414379306 941071743 /nfs/dbraw/zinc/07/17/43/941071743.db2.gz IKMLBRHSGPBYCY-UHFFFAOYSA-N -1 3 367.442 3.571 20 0 FHADHM Cc1cc(=O)[n-]c(-c2cccc(NC(=O)c3cccnc3OC(C)C)c2)n1 ZINC000376603053 941314787 /nfs/dbraw/zinc/31/47/87/941314787.db2.gz WJFXIJXUTAZUNA-UHFFFAOYSA-N -1 3 364.405 3.592 20 0 FHADHM Cc1oncc1C(=O)Nc1ccc([O-])c(C(=O)N(C)[C@@H]2CCCC[C@@H]2C)c1 ZINC000179416673 941344421 /nfs/dbraw/zinc/34/44/21/941344421.db2.gz JRTBYPDXOUUBRU-YVEFUNNKSA-N -1 3 371.437 3.592 20 0 FHADHM O=C(Nc1ccccc1-c1nnc(-c2ccccc2)[nH]1)c1ccc(O)cc1[O-] ZINC000179440903 941344813 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Cc1cc(=O)[n-]c(-c2cccc(OC(=O)C[C@H]3CCC4(CCC4)O3)c2)n1 ZINC000892737057 941501844 /nfs/dbraw/zinc/50/18/44/941501844.db2.gz WKQSYMOWCWWKCC-MRXNPFEDSA-N -1 3 354.406 3.555 20 0 FHADHM CSc1ccc(C(=O)N2CCn3c(C4CCCC4)nnc3[C@@H]2C)c([O-])c1 ZINC000377101032 941521504 /nfs/dbraw/zinc/52/15/04/941521504.db2.gz RWYXRYAJMXUBRF-LBPRGKRZSA-N -1 3 372.494 3.580 20 0 FHADHM C[C@H](CC1CC1)NC(=O)C[C@@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000183778673 941546836 /nfs/dbraw/zinc/54/68/36/941546836.db2.gz PPSLUKXNEBSSDQ-FOIQADDNSA-N -1 3 366.461 3.558 20 0 FHADHM COc1cc(CN(C)C(=O)NCc2ccc([O-])c(F)c2)ccc1SC ZINC000163705410 941588871 /nfs/dbraw/zinc/58/88/71/941588871.db2.gz QZKTVMQEPQPPLY-UHFFFAOYSA-N -1 3 364.442 3.603 20 0 FHADHM O=C(c1c[n-]c2cc(F)c(F)cc2c1=O)N1CCC[C@@H]1C1CCCCC1 ZINC000892914510 941679335 /nfs/dbraw/zinc/67/93/35/941679335.db2.gz SFHLNALDHQNLKV-GOSISDBHSA-N -1 3 360.404 3.991 20 0 FHADHM CCCNC(=O)Nc1cccc(OC(=O)c2cc(-c3ccc(C)o3)[n-]n2)c1 ZINC000729213125 941695259 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3.920 20 0 FHADHM Cc1ccc(C(=O)N2CCN([C@@H](C)c3ccc(Cl)cc3)CC2)c([O-])c1 ZINC000436592784 944438092 /nfs/dbraw/zinc/43/80/92/944438092.db2.gz YWBQVCYJHPMXHO-HNNXBMFYSA-N -1 3 358.869 3.873 20 0 FHADHM C[C@@H]1Cc2cc(S(=O)(=O)[N-]c3ccc(C(F)(F)F)cc3)ccc2O1 ZINC000518492612 944439105 /nfs/dbraw/zinc/43/91/05/944439105.db2.gz GCTYBJQQMFENGQ-SNVBAGLBSA-N -1 3 357.353 3.830 20 0 FHADHM O=C(NCCc1nc2ccccc2[nH]1)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436595904 944439732 /nfs/dbraw/zinc/43/97/32/944439732.db2.gz OFZCSMVIAUYMRH-UHFFFAOYSA-N -1 3 371.440 3.832 20 0 FHADHM [O-]c1cc2ccccc2cc1-c1nc(-c2cnc(OCC(F)F)cn2)no1 ZINC000436598206 944442783 /nfs/dbraw/zinc/44/27/83/944442783.db2.gz YJEUZBWHRDTRAY-UHFFFAOYSA-N -1 3 370.315 3.696 20 0 FHADHM CC(=O)c1ccc(C(=O)Nc2cc(NC(=O)C3CC3)ccc2C)cc1[O-] ZINC000436579963 944444410 /nfs/dbraw/zinc/44/44/10/944444410.db2.gz WAQUHFCYJCBHEQ-UHFFFAOYSA-N -1 3 352.390 3.504 20 0 FHADHM CC(=O)c1ccc(C(=O)NCc2cccc(NC(=O)CC(C)C)c2)cc1[O-] ZINC000436618514 944452053 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CCOc1ccc(CCC2CCN(C(=O)c3c([O-])cccc3O)CC2)cc1 ZINC000436645062 944491872 /nfs/dbraw/zinc/49/18/72/944491872.db2.gz ALRRJHDFRCFFEZ-UHFFFAOYSA-N -1 3 369.461 3.982 20 0 FHADHM CC(=O)c1ccc(C(=O)Nc2nc(-c3ccc(O)cc3)cs2)cc1[O-] ZINC000436646113 944494800 /nfs/dbraw/zinc/49/48/00/944494800.db2.gz FGVKTWUIEBKGHF-UHFFFAOYSA-N -1 3 354.387 3.676 20 0 FHADHM O=C(c1c([O-])cccc1O)N1CCC[C@@H](c2nc(C(F)(F)F)cs2)C1 ZINC000436648046 944495500 /nfs/dbraw/zinc/49/55/00/944495500.db2.gz PANJONRVLXWDCW-SECBINFHSA-N -1 3 372.368 3.593 20 0 FHADHM O=C(CCOCc1ccccc1)Nc1ccc(Br)cc1[O-] ZINC000516097569 944496469 /nfs/dbraw/zinc/49/64/69/944496469.db2.gz MTKXEMZJTBJOPH-UHFFFAOYSA-N -1 3 350.212 3.700 20 0 FHADHM CC[C@@H](C)NC(=O)c1cccc(CNC(=O)c2ccc(C(C)C)cc2[O-])c1 ZINC000436648314 944496884 /nfs/dbraw/zinc/49/68/84/944496884.db2.gz PJCYZIDKVDCYJW-OAHLLOKOSA-N -1 3 368.477 3.974 20 0 FHADHM O=C(Nc1ccc(Cn2cnc3ccccc32)cc1)c1c([O-])cccc1O ZINC000436648187 944496973 /nfs/dbraw/zinc/49/69/73/944496973.db2.gz MLVGNQFBDFSLMJ-UHFFFAOYSA-N -1 3 359.385 3.748 20 0 FHADHM O=C([O-])c1ccccc1CCNCc1csc(-c2ccc(F)cc2)n1 ZINC000426669622 944504984 /nfs/dbraw/zinc/50/49/84/944504984.db2.gz NNKNOFUCUQIVGF-UHFFFAOYSA-N -1 3 356.422 3.980 20 0 FHADHM O=C([O-])C[C@@H](NCc1ccc(Br)c(F)c1)c1ccsc1 ZINC000426671014 944505139 /nfs/dbraw/zinc/50/51/39/944505139.db2.gz JVSCQXOLIBLNDU-CYBMUJFWSA-N -1 3 358.232 3.955 20 0 FHADHM CC(C)Sc1ccc(CN2CCN(C(=O)c3ccccc3[O-])CC2)cc1 ZINC000436659985 944509992 /nfs/dbraw/zinc/50/99/92/944509992.db2.gz SVQZVGSUYIYWJG-UHFFFAOYSA-N -1 3 370.518 3.851 20 0 FHADHM CCc1ccc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2[O-])cc1Cl ZINC000436676647 944514110 /nfs/dbraw/zinc/51/41/10/944514110.db2.gz RKHCHMFFUXSQJR-QGZVFWFLSA-N -1 3 372.852 3.851 20 0 FHADHM Cn1cc2c(n1)CCC[C@@H]2NC(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436679339 944518700 /nfs/dbraw/zinc/51/87/00/944518700.db2.gz GIEJWZCGMNCISE-SFHVURJKSA-N -1 3 363.417 3.725 20 0 FHADHM CCc1ccc([O-])c(C(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1 ZINC000101956695 944527125 /nfs/dbraw/zinc/52/71/25/944527125.db2.gz DLEDMDGRGXRQEB-UHFFFAOYSA-N -1 3 370.424 3.585 20 0 FHADHM CCOc1ccc(-c2noc(-c3cc(OC)c([O-])c(OC)c3)n2)cc1F ZINC000436688878 944527768 /nfs/dbraw/zinc/52/77/68/944527768.db2.gz PHPLYAGAUYHJHZ-UHFFFAOYSA-N -1 3 360.341 3.664 20 0 FHADHM CC(C)(C)c1ccc(CN2CCN(C(=O)c3ccccc3[O-])CC2)s1 ZINC000436697407 944536887 /nfs/dbraw/zinc/53/68/87/944536887.db2.gz MPFGJXFASKSEFW-UHFFFAOYSA-N -1 3 358.507 3.709 20 0 FHADHM O=C(N[C@@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1)c1ccccc1[O-] ZINC000436704261 944545186 /nfs/dbraw/zinc/54/51/86/944545186.db2.gz JSTAOFQWSGNDEC-GOSISDBHSA-N -1 3 365.351 3.543 20 0 FHADHM CC[C@@H](C)N[C@@H](CNC(=O)c1cc(F)cc(Cl)c1[O-])c1ccco1 ZINC000436721015 944559755 /nfs/dbraw/zinc/55/97/55/944559755.db2.gz KUQQEHGPPKSREF-YGRLFVJLSA-N -1 3 354.809 3.637 20 0 FHADHM O=C(NCc1cnc(-c2ccc(Cl)cc2)s1)c1ccc(O)cc1[O-] ZINC000436724681 944564168 /nfs/dbraw/zinc/56/41/68/944564168.db2.gz QFTKRQSWQCQECI-UHFFFAOYSA-N -1 3 360.822 3.805 20 0 FHADHM CCc1ccc(C(=O)Nc2ccc(N(C(C)=O)[C@@H]3C[C@H]3C)cc2)c([O-])c1 ZINC000436735832 944565565 /nfs/dbraw/zinc/56/55/65/944565565.db2.gz DOIWKUOKNXLDCZ-BFUOFWGJSA-N -1 3 352.434 3.968 20 0 FHADHM O=C(c1c([O-])cccc1O)N1CC[C@@](F)(c2cccc(C(F)(F)F)c2)C1 ZINC000436741530 944571433 /nfs/dbraw/zinc/57/14/33/944571433.db2.gz CJYCHIFBJRWZFG-KRWDZBQOSA-N -1 3 369.314 3.828 20 0 FHADHM Cc1c(C(=O)[N-]c2n[nH]c(-c3ccc(Cl)cc3)n2)oc2c1C(=O)CCC2 ZINC000517746364 944572618 /nfs/dbraw/zinc/57/26/18/944572618.db2.gz GTWLIJUNLHCBHP-UHFFFAOYSA-N -1 3 370.796 3.798 20 0 FHADHM C[C@@H](C[N-]S(=O)(=O)c1cccc(Cl)c1Cl)Oc1ccccc1 ZINC000506220839 944573702 /nfs/dbraw/zinc/57/37/02/944573702.db2.gz CLNQRJQUDQNEIG-NSHDSACASA-N -1 3 360.262 3.739 20 0 FHADHM C[C@H]1c2cccc(Br)c2CCN1C(=O)c1ccc(O)cc1[O-] ZINC000436729522 944576423 /nfs/dbraw/zinc/57/64/23/944576423.db2.gz RTYKGWDMGDZRFQ-JTQLQIEISA-N -1 3 362.223 3.620 20 0 FHADHM COc1ccc(C(=O)NCc2ccnc(Oc3ccccc3F)c2)c([O-])c1 ZINC000436732281 944577939 /nfs/dbraw/zinc/57/79/39/944577939.db2.gz PZBARWNIXPLWLT-UHFFFAOYSA-N -1 3 368.364 3.657 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(C(=O)Nc3cccnc3)cc2)c([O-])c1C ZINC000436757538 944580709 /nfs/dbraw/zinc/58/07/09/944580709.db2.gz ILHNZMPQEVXKGU-UHFFFAOYSA-N -1 3 361.401 3.909 20 0 FHADHM COCCN(Cc1cc(Br)cs1)Cc1nc(C)ccc1[O-] ZINC000426373527 944583721 /nfs/dbraw/zinc/58/37/21/944583721.db2.gz SRUVQBXFDKAUFN-UHFFFAOYSA-N -1 3 371.300 3.568 20 0 FHADHM COc1ccc(C(=O)NC2(c3cccc(C(F)(F)F)c3)CC2)c([O-])c1 ZINC000436751680 944591750 /nfs/dbraw/zinc/59/17/50/944591750.db2.gz UQSRVPFWBYOLRY-UHFFFAOYSA-N -1 3 351.324 3.839 20 0 FHADHM CN(C)[C@H](CNC(=O)c1c([O-])cc(Cl)cc1Cl)c1ccccc1 ZINC000436756749 944599666 /nfs/dbraw/zinc/59/96/66/944599666.db2.gz PTSXRWCVRGHDKF-CQSZACIVSA-N -1 3 353.249 3.732 20 0 FHADHM Cc1nn(C)c(C)c1NC(=O)c1cc(OCc2ccccc2)ccc1[O-] ZINC000436756387 944600310 /nfs/dbraw/zinc/60/03/10/944600310.db2.gz CVRJBMKHBUUTLN-UHFFFAOYSA-N -1 3 351.406 3.574 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)c1cc(-c2ccc(Cl)cc2)c[nH]1 ZINC000492057424 944633259 /nfs/dbraw/zinc/63/32/59/944633259.db2.gz AYJBFUACCDQQQR-UHFFFAOYSA-N -1 3 364.796 3.768 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)c1cc(-c2ccc(Cl)cc2)c[nH]1 ZINC000492057424 944633266 /nfs/dbraw/zinc/63/32/66/944633266.db2.gz AYJBFUACCDQQQR-UHFFFAOYSA-N -1 3 364.796 3.768 20 0 FHADHM C[C@@H](Cc1ccccc1C(F)(F)F)N(C)C(=O)c1ccc(O)cc1[O-] ZINC000436788047 944635014 /nfs/dbraw/zinc/63/50/14/944635014.db2.gz AOWXOMUQZXDPGZ-NSHDSACASA-N -1 3 353.340 3.820 20 0 FHADHM CC[C@H](C)N(CC(=O)Nc1cccc(C)c1C)C(=O)c1ccccc1[O-] ZINC000436794970 944647441 /nfs/dbraw/zinc/64/74/41/944647441.db2.gz DGYZXRXFUHCNMC-HNNXBMFYSA-N -1 3 354.450 3.888 20 0 FHADHM C[C@H]1C[C@@H](CC(=O)N2CCN(C(=O)c3ccccc3[O-])CC2)CC(C)(C)C1 ZINC000436795635 944648474 /nfs/dbraw/zinc/64/84/74/944648474.db2.gz ZRDUJFHSDDQERU-IRXDYDNUSA-N -1 3 372.509 3.529 20 0 FHADHM CCN(CCOc1ccc(Br)cc1)C(=O)c1ccccc1[O-] ZINC000436795856 944648565 /nfs/dbraw/zinc/64/85/65/944648565.db2.gz RVNNETORDYCNGY-UHFFFAOYSA-N -1 3 364.239 3.696 20 0 FHADHM CCc1ccc(C(=O)N2CCN(Cc3ccc(Cl)s3)CC2)c([O-])c1 ZINC000436803732 944658055 /nfs/dbraw/zinc/65/80/55/944658055.db2.gz RDVZKDSNMNDWAK-UHFFFAOYSA-N -1 3 364.898 3.628 20 0 FHADHM O=C(Nc1ccc(N2CCCC2=O)cc1)c1cc2c(cc1[O-])CCCC2 ZINC000436829025 944674708 /nfs/dbraw/zinc/67/47/08/944674708.db2.gz RPCXUKVFFMTCQM-UHFFFAOYSA-N -1 3 350.418 3.650 20 0 FHADHM COc1cccc([C@@H]2C[C@@H](C)CN2C(=O)c2cc(NC(C)=O)ccc2[O-])c1 ZINC000436829490 944677031 /nfs/dbraw/zinc/67/70/31/944677031.db2.gz BFQUEBVXXHBISS-YJYMSZOUSA-N -1 3 368.433 3.583 20 0 FHADHM O=C([O-])C[C@@H](NCc1ccc(OC[C@H]2CCCO2)cc1)c1ccsc1 ZINC000426682852 944679276 /nfs/dbraw/zinc/67/92/76/944679276.db2.gz MHZWKNXRTLQGLC-QZTJIDSGSA-N -1 3 361.463 3.612 20 0 FHADHM CCc1ccc(C(=O)N(C)[C@H](c2cnn(C)c2)c2cccc(F)c2)c([O-])c1 ZINC000436821657 944690538 /nfs/dbraw/zinc/69/05/38/944690538.db2.gz QAJKSNFBYUXLMA-FQEVSTJZSA-N -1 3 367.424 3.689 20 0 FHADHM COC[C@H](C)Oc1ccc(Cl)cc1NC(=O)c1cc(OC)ccc1[O-] ZINC000436822788 944691992 /nfs/dbraw/zinc/69/19/92/944691992.db2.gz XCNZLKUCGACOGC-NSHDSACASA-N -1 3 365.813 3.720 20 0 FHADHM CCCCc1ccc(C(=O)CCC(=O)N=c2cc([C@@H]3CCCO3)[n-][nH]2)cc1 ZINC000473847378 944692641 /nfs/dbraw/zinc/69/26/41/944692641.db2.gz CCGTVVPTESIFEG-IBGZPJMESA-N -1 3 369.465 3.627 20 0 FHADHM CCc1ccc(C(=O)NC[C@H](NCc2ccccc2)c2ccco2)c([O-])c1 ZINC000436856616 944707589 /nfs/dbraw/zinc/70/75/89/944707589.db2.gz MSDRVNKNIROMHR-IBGZPJMESA-N -1 3 364.445 3.809 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@@H]1C[C@H]1C1CCCCC1 ZINC000735873554 944709575 /nfs/dbraw/zinc/70/95/75/944709575.db2.gz CBEYIWIILHXUMS-RBUKOAKNSA-N -1 3 367.497 3.820 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@@H]1C[C@H]1C1CCCCC1 ZINC000735873554 944709582 /nfs/dbraw/zinc/70/95/82/944709582.db2.gz CBEYIWIILHXUMS-RBUKOAKNSA-N -1 3 367.497 3.820 20 0 FHADHM O=S(=O)(Cc1c(F)cccc1F)[N-]c1ccc(SC(F)F)nc1 ZINC000194617830 944711470 /nfs/dbraw/zinc/71/14/70/944711470.db2.gz ONYKRQXMYWGUMU-UHFFFAOYSA-N -1 3 366.361 3.616 20 0 FHADHM CCc1ccc(-c2nc(CN(C(=O)c3ccccc3)C3CC3)no2)c([O-])c1 ZINC000436860285 944724053 /nfs/dbraw/zinc/72/40/53/944724053.db2.gz NSSGPZZNHICZLF-UHFFFAOYSA-N -1 3 363.417 3.809 20 0 FHADHM C[C@H](C(=O)[O-])[C@H](NCc1cnn(-c2ccc(F)cc2)c1)c1ccccc1 ZINC000426722539 944724811 /nfs/dbraw/zinc/72/48/11/944724811.db2.gz HWZZCVRZIDKQPY-LIRRHRJNSA-N -1 3 353.397 3.563 20 0 FHADHM COc1cc(CN[C@H](c2ccccc2)[C@H](C)C(=O)[O-])cc(Cl)c1OC ZINC000426723569 944725366 /nfs/dbraw/zinc/72/53/66/944725366.db2.gz MPQCBCCRBGREHL-SJCJKPOMSA-N -1 3 363.841 3.909 20 0 FHADHM O=C([O-])[C@@H](CSCCc1ccccc1)NCc1ccsc1Cl ZINC000426735486 944747349 /nfs/dbraw/zinc/74/73/49/944747349.db2.gz FRWCZDBYLYBAAW-CQSZACIVSA-N -1 3 355.912 3.920 20 0 FHADHM COc1cc(CN[C@@H](C(=O)[O-])c2cccc(Cl)c2)ccc1SC ZINC000426736314 944748589 /nfs/dbraw/zinc/74/85/89/944748589.db2.gz XDNAORMVAQTBOD-MRXNPFEDSA-N -1 3 351.855 3.986 20 0 FHADHM COc1cc2c(c(CN[C@H](C(=O)[O-])c3cccc(C)c3C)c1)O[C@@H](C)C2 ZINC000426740613 944753903 /nfs/dbraw/zinc/75/39/03/944753903.db2.gz BQMFVYKQWCELLS-DJJJIMSYSA-N -1 3 355.434 3.551 20 0 FHADHM C[C@H](Sc1ccccc1-c1nnn[n-]1)c1nc(-c2cccs2)no1 ZINC000736193485 944758304 /nfs/dbraw/zinc/75/83/04/944758304.db2.gz RVOVGNLSYCSTMK-VIFPVBQESA-N -1 3 356.436 3.832 20 0 FHADHM C[C@H](Sc1ccccc1-c1nn[n-]n1)c1nc(-c2cccs2)no1 ZINC000736193485 944758307 /nfs/dbraw/zinc/75/83/07/944758307.db2.gz RVOVGNLSYCSTMK-VIFPVBQESA-N -1 3 356.436 3.832 20 0 FHADHM CC(C)c1ccc(-c2nc(-c3ccc(Cn4cncn4)cc3)no2)c([O-])c1 ZINC000436887431 944763816 /nfs/dbraw/zinc/76/38/16/944763816.db2.gz JTOMMRCLJHJAFT-UHFFFAOYSA-N -1 3 361.405 3.872 20 0 FHADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1C[C@@H](CO)c2ccccc21 ZINC000436891716 944767313 /nfs/dbraw/zinc/76/73/13/944767313.db2.gz HALKMRQSXMFKQP-IBGZPJMESA-N -1 3 373.452 3.914 20 0 FHADHM COc1cc(CN[C@H](C(=O)[O-])c2cccc(Cl)c2)cc(Cl)c1OC ZINC000426748527 944767983 /nfs/dbraw/zinc/76/79/83/944767983.db2.gz YFCSZICFGHRCIQ-HNNXBMFYSA-N -1 3 370.232 3.926 20 0 FHADHM CN(C[C@@H]1CCCC[C@@H]1O)C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436904164 944771021 /nfs/dbraw/zinc/77/10/21/944771021.db2.gz KLJISEYRQWVFSA-FPOVZHCZSA-N -1 3 367.489 3.801 20 0 FHADHM Cc1ccc(C(=O)N(Cc2cnn(C)c2)Cc2ccc(Cl)cc2)c([O-])c1 ZINC000436908265 944775071 /nfs/dbraw/zinc/77/50/71/944775071.db2.gz VFKJCVSVCITWCD-UHFFFAOYSA-N -1 3 369.852 3.930 20 0 FHADHM C[C@@H](NC(=O)c1cc(F)c([O-])c(Cl)c1)[C@@H](c1ccccc1)N(C)C ZINC000436908981 944776402 /nfs/dbraw/zinc/77/64/02/944776402.db2.gz XDXSYSCKDASMCS-BZNIZROVSA-N -1 3 350.821 3.606 20 0 FHADHM CC(C)[C@H](C)N(C)C(=O)C[C@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436908779 944777743 /nfs/dbraw/zinc/77/77/43/944777743.db2.gz JZFXJPVJGTYIRE-JXFKEZNVSA-N -1 3 368.477 3.756 20 0 FHADHM CC(C)(C)CCNC(=O)C[C@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436911428 944781063 /nfs/dbraw/zinc/78/10/63/944781063.db2.gz QKCDQKKLCLMTGW-IBGZPJMESA-N -1 3 368.477 3.806 20 0 FHADHM COC(=O)c1ccc(-c2nc(-c3cccc(-c4csc(C)n4)c3)no2)[n-]1 ZINC000426430206 944782014 /nfs/dbraw/zinc/78/20/14/944782014.db2.gz OHLKYJMKKUELFN-UHFFFAOYSA-N -1 3 366.402 3.950 20 0 FHADHM Cc1ccc(-c2nc(Cc3cc(Cl)c4c(c3)OCCO4)no2)c([O-])c1 ZINC000436897015 944784143 /nfs/dbraw/zinc/78/41/43/944784143.db2.gz POKZPMUJHLLELN-UHFFFAOYSA-N -1 3 358.781 3.766 20 0 FHADHM CCC(=CC(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1)c1ccc(C)cc1 ZINC000736304924 944794255 /nfs/dbraw/zinc/79/42/55/944794255.db2.gz SCPXQMKQFHGYRB-GHRIWEEISA-N -1 3 361.449 3.627 20 0 FHADHM CCC(=CC(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1)c1ccc(C)cc1 ZINC000736304924 944794262 /nfs/dbraw/zinc/79/42/62/944794262.db2.gz SCPXQMKQFHGYRB-GHRIWEEISA-N -1 3 361.449 3.627 20 0 FHADHM CN(CC(C)(C)C)C(=O)C[C@@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436932113 944795494 /nfs/dbraw/zinc/79/54/94/944795494.db2.gz MQTAUMKRZQYVKG-LJQANCHMSA-N -1 3 368.477 3.758 20 0 FHADHM O=C(c1c([O-])cccc1O)N1CC2(CCC2)c2cc(Br)ccc21 ZINC000436914831 944796594 /nfs/dbraw/zinc/79/65/94/944796594.db2.gz MVXZEROHZWLPKB-UHFFFAOYSA-N -1 3 374.234 3.942 20 0 FHADHM CC(C)CCCNC(=O)C[C@@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436914496 944796652 /nfs/dbraw/zinc/79/66/52/944796652.db2.gz ZEMNCNMRVQLEEX-HXUWFJFHSA-N -1 3 368.477 3.806 20 0 FHADHM CCC[C@H](C)N(C)C(=O)C[C@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436914551 944796736 /nfs/dbraw/zinc/79/67/36/944796736.db2.gz ZOQOGYSXPKLFMX-JXFKEZNVSA-N -1 3 368.477 3.900 20 0 FHADHM CCCc1cccc(CN[C@@H](CC(=O)[O-])c2ccc(OC)c(OC)c2)c1 ZINC000426781459 944798470 /nfs/dbraw/zinc/79/84/70/944798470.db2.gz CCQFRGWKXWEMNW-SFHVURJKSA-N -1 3 357.450 3.962 20 0 FHADHM COc1cccc([C@@H](CC(=O)[O-])NCc2cc(C)c(C)cc2C)c1OC ZINC000426807082 944808353 /nfs/dbraw/zinc/80/83/53/944808353.db2.gz MCJNTHAMZWMBLR-GOSISDBHSA-N -1 3 357.450 3.935 20 0 FHADHM CCOc1cc(CN[C@H](C(=O)[O-])c2ccc(F)cc2)cc(Cl)c1OC ZINC000426807725 944809446 /nfs/dbraw/zinc/80/94/46/944809446.db2.gz OWLYRHCZAZLIQR-INIZCTEOSA-N -1 3 367.804 3.802 20 0 FHADHM Cc1ccc(NC(=O)c2ccc3c(c2[O-])CCCC3)cc1NC(=O)N(C)C ZINC000436925971 944811993 /nfs/dbraw/zinc/81/19/93/944811993.db2.gz IBFYIQCJLPYJLN-UHFFFAOYSA-N -1 3 367.449 3.925 20 0 FHADHM COc1ccc([C@@H](CC(=O)[O-])NCc2ccc(Cl)cc2C)cc1OC ZINC000426790069 944812289 /nfs/dbraw/zinc/81/22/89/944812289.db2.gz AEVAJPVDGLDVJP-MRXNPFEDSA-N -1 3 363.841 3.971 20 0 FHADHM CCN(Cc1ccccc1Br)C(=O)c1ccc(O)cc1[O-] ZINC000436927998 944813621 /nfs/dbraw/zinc/81/36/21/944813621.db2.gz VEBYSAZNSURHQM-UHFFFAOYSA-N -1 3 350.212 3.523 20 0 FHADHM CCN(C(=O)CCNC(=O)c1ccc(C)cc1[O-])[C@@H](C)c1ccc(F)cc1 ZINC000436951368 944818276 /nfs/dbraw/zinc/81/82/76/944818276.db2.gz RLLDTLIBNAPJQM-HNNXBMFYSA-N -1 3 372.440 3.569 20 0 FHADHM CN(Cc1noc(-c2cc3ccccc3cc2[O-])n1)C(=O)c1ccccc1 ZINC000436932927 944819080 /nfs/dbraw/zinc/81/90/80/944819080.db2.gz FUERQKUBEQOPQW-UHFFFAOYSA-N -1 3 359.385 3.868 20 0 FHADHM O=C([O-])[C@H](NCc1ccc(OC(F)F)c(Cl)c1)c1ccc(O)cc1 ZINC000426798970 944820879 /nfs/dbraw/zinc/82/08/79/944820879.db2.gz JVDMUXJVYQOQQB-CQSZACIVSA-N -1 3 357.740 3.563 20 0 FHADHM COc1cccc(-c2nc(-c3cc(N(C)C)nc4ccccc43)no2)c1[O-] ZINC000436942021 944828440 /nfs/dbraw/zinc/82/84/40/944828440.db2.gz SVCJPWXTUPSIQR-UHFFFAOYSA-N -1 3 362.389 3.732 20 0 FHADHM COc1ccc([O-])c(-c2nc(CCc3ccc(OC(F)F)cc3)no2)c1 ZINC000436941729 944828548 /nfs/dbraw/zinc/82/85/48/944828548.db2.gz RWMKOTIEJHOYRW-UHFFFAOYSA-N -1 3 362.332 3.837 20 0 FHADHM CCC[C@H](NC(=O)c1ccccc1)c1noc(-c2cccc(OC)c2[O-])n1 ZINC000436942836 944831253 /nfs/dbraw/zinc/83/12/53/944831253.db2.gz JHGZMBCLGOEAKM-HNNXBMFYSA-N -1 3 367.405 3.722 20 0 FHADHM CC(C)c1ccc([C@H](CC(=O)[O-])NCc2ccc3c(c2)OCCO3)cc1 ZINC000426811696 944833317 /nfs/dbraw/zinc/83/33/17/944833317.db2.gz VIKUCHQUPDTEEF-SFHVURJKSA-N -1 3 355.434 3.887 20 0 FHADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(OCc3ccncc3)cc2)cc1 ZINC000517925810 944843584 /nfs/dbraw/zinc/84/35/84/944843584.db2.gz XUCNHXMARCPQLS-UHFFFAOYSA-N -1 3 354.431 3.770 20 0 FHADHM COc1cccc(CN[C@@H](CC(=O)[O-])c2cccc(Br)c2)c1 ZINC000426821961 944844095 /nfs/dbraw/zinc/84/40/95/944844095.db2.gz YRCHYHOJRPLIMG-INIZCTEOSA-N -1 3 364.239 3.763 20 0 FHADHM COc1ccc([O-])c(-c2nc(-c3cnc(Oc4ccccc4)cn3)no2)c1 ZINC000436954075 944849347 /nfs/dbraw/zinc/84/93/47/944849347.db2.gz TXBWWLKXQFYUNO-UHFFFAOYSA-N -1 3 362.345 3.700 20 0 FHADHM CN1CC[C@H]2CCN(C(=O)c3cc(-c4ccccc4)cc(Cl)c3[O-])[C@@H]2C1 ZINC000436968807 944850641 /nfs/dbraw/zinc/85/06/41/944850641.db2.gz VNUKCBGDZPGEGZ-HNAYVOBHSA-N -1 3 370.880 3.879 20 0 FHADHM O=C(CNC(=O)c1cc(Oc2ccccc2)ccc1[O-])Nc1ccccc1 ZINC000436954819 944850883 /nfs/dbraw/zinc/85/08/83/944850883.db2.gz XUYZSWHGHSXQTL-UHFFFAOYSA-N -1 3 362.385 3.553 20 0 FHADHM Cc1nnc([C@@H](C)NC(=O)c2cc(Oc3ccccc3)ccc2[O-])s1 ZINC000436957343 944852131 /nfs/dbraw/zinc/85/21/31/944852131.db2.gz XAXVEERTTPUNEQ-LLVKDONJSA-N -1 3 355.419 3.835 20 0 FHADHM Cc1nnc([C@H](C)NC(=O)c2cc(Cc3ccccc3)ccc2[O-])s1 ZINC000436956557 944853136 /nfs/dbraw/zinc/85/31/36/944853136.db2.gz SFTSGSLHYFSSLM-LBPRGKRZSA-N -1 3 353.447 3.634 20 0 FHADHM Cc1ccc(C(=O)NCCC(=O)Nc2ccccc2OC(C)(C)C)c([O-])c1 ZINC000436971051 944857357 /nfs/dbraw/zinc/85/73/57/944857357.db2.gz NHSZHWWEIKIDMJ-UHFFFAOYSA-N -1 3 370.449 3.637 20 0 FHADHM Cc1ccc(-c2nc(NC(=O)C(C)(C)COCc3ccccc3)n[n-]2)o1 ZINC000507005980 944873526 /nfs/dbraw/zinc/87/35/26/944873526.db2.gz SQFHKTDKVPICRK-UHFFFAOYSA-N -1 3 354.410 3.555 20 0 FHADHM CCCCOc1ccc(C(=O)N2CCC(c3cc(C)n[nH]3)CC2)c([O-])c1 ZINC000436989377 944880972 /nfs/dbraw/zinc/88/09/72/944880972.db2.gz OKPCOUYYAGTELI-UHFFFAOYSA-N -1 3 357.454 3.622 20 0 FHADHM CCCCOc1ccc(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)c([O-])c1 ZINC000436989066 944882151 /nfs/dbraw/zinc/88/21/51/944882151.db2.gz LMKUHYUDCAHWJW-QFIPXVFZSA-N -1 3 367.445 3.843 20 0 FHADHM CC(C)(C)OC(=O)CCc1cccc(NC(=O)c2c([O-])cccc2O)c1 ZINC000436996111 944891372 /nfs/dbraw/zinc/89/13/72/944891372.db2.gz BDZNZJFGSBXWOL-UHFFFAOYSA-N -1 3 357.406 3.624 20 0 FHADHM CN(Cc1ccccc1)c1c(-c2nnn[n-]2)cnc2ccc(Cl)cc21 ZINC000736829143 944897749 /nfs/dbraw/zinc/89/77/49/944897749.db2.gz ZBCQLPFLKLOSNJ-UHFFFAOYSA-N -1 3 350.813 3.705 20 0 FHADHM CN(Cc1ccccc1)c1c(-c2nn[n-]n2)cnc2ccc(Cl)cc21 ZINC000736829143 944897753 /nfs/dbraw/zinc/89/77/53/944897753.db2.gz ZBCQLPFLKLOSNJ-UHFFFAOYSA-N -1 3 350.813 3.705 20 0 FHADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1CC[C@H]([C@H]2CCOC2)C1 ZINC000366659089 944912155 /nfs/dbraw/zinc/91/21/55/944912155.db2.gz UZLPAYKPFGWKOX-HOTGVXAUSA-N -1 3 353.418 3.683 20 0 FHADHM C[C@H](CO)N(CC1CCC1)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000437000659 944918873 /nfs/dbraw/zinc/91/88/73/944918873.db2.gz OXLDNCQGABJXSL-OAHLLOKOSA-N -1 3 355.434 3.808 20 0 FHADHM Cc1cc(S(=O)(=O)[N-][C@@H]2CCOc3ccc(F)cc32)sc1Cl ZINC000473851526 944934819 /nfs/dbraw/zinc/93/48/19/944934819.db2.gz CKHRWKVLHYSJBI-LLVKDONJSA-N -1 3 361.847 3.651 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2ccc(F)c(Br)c2)c(C)c1 ZINC000438726487 944973876 /nfs/dbraw/zinc/97/38/76/944973876.db2.gz QMDYEEZVAYXKMV-UHFFFAOYSA-N -1 3 374.231 3.706 20 0 FHADHM CCOC(=O)c1ccc(NC(=O)c2c[nH]cc2-c2ccccc2F)c([O-])c1 ZINC000426989433 944980316 /nfs/dbraw/zinc/98/03/16/944980316.db2.gz BRWVRGFOFSYAPN-UHFFFAOYSA-N -1 3 368.364 3.955 20 0 FHADHM O=C(N=c1cc(-c2ccncc2)[n-][nH]1)[C@H]1C[C@@H]1c1cccc2ccccc21 ZINC000518085784 945005971 /nfs/dbraw/zinc/00/59/71/945005971.db2.gz RRWXYTJGGYUXAY-MOPGFXCFSA-N -1 3 354.413 3.789 20 0 FHADHM CS(=O)(=O)[N-]c1ccccc1NC(=O)C[C@H]1CCCc2ccccc21 ZINC000519400087 945376625 /nfs/dbraw/zinc/37/66/25/945376625.db2.gz USMUNMMRBVTOSC-OAHLLOKOSA-N -1 3 358.463 3.507 20 0 FHADHM COc1cc(C)c(S(=O)(=O)[N-]c2ccc(F)c(C(C)=O)c2)cc1Cl ZINC000507617026 945379356 /nfs/dbraw/zinc/37/93/56/945379356.db2.gz NFHLGWGSHNQGBQ-UHFFFAOYSA-N -1 3 371.817 3.800 20 0 FHADHM O=C(C[S@@](=O)c1ccc([O-])cc1)N(c1ccccc1)C1CCCCC1 ZINC000519415540 945401562 /nfs/dbraw/zinc/40/15/62/945401562.db2.gz OTNPWTMTKORQOJ-RUZDIDTESA-N -1 3 357.475 3.866 20 0 FHADHM CO[C@H](c1ccccc1F)[C@H](C)[N-]S(=O)(=O)c1ccc(Cl)s1 ZINC000519444788 945414545 /nfs/dbraw/zinc/41/45/45/945414545.db2.gz YGIBHRHCQLJNFH-XPTSAGLGSA-N -1 3 363.863 3.595 20 0 FHADHM C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)C)CC1)c1cccc(-c2nnn[n-]2)c1 ZINC000820353093 945427616 /nfs/dbraw/zinc/42/76/16/945427616.db2.gz YBGXKKCKXJSDPI-RHSMWYFYSA-N -1 3 370.501 3.786 20 0 FHADHM C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)C)CC1)c1cccc(-c2nn[n-]n2)c1 ZINC000820353093 945427621 /nfs/dbraw/zinc/42/76/21/945427621.db2.gz YBGXKKCKXJSDPI-RHSMWYFYSA-N -1 3 370.501 3.786 20 0 FHADHM C=CCN1C(=O)/C(=C/c2cc(Cl)c([O-])c(OCC)c2)SC1=S ZINC000007156108 945427661 /nfs/dbraw/zinc/42/76/61/945427661.db2.gz WVKOAVZPYOSPOZ-WQLSENKSSA-N -1 3 355.868 3.832 20 0 FHADHM Cc1ccccc1C[C@H](CNCc1csc(-c2ccccn2)n1)C(=O)[O-] ZINC000426638081 945432004 /nfs/dbraw/zinc/43/20/04/945432004.db2.gz HWSGUZDYKUJNPC-MRXNPFEDSA-N -1 3 367.474 3.547 20 0 FHADHM Cc1cccnc1C(F)(F)C(=O)[N-][C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1 ZINC000280934400 945468190 /nfs/dbraw/zinc/46/81/90/945468190.db2.gz FRRJELYKOXPJEP-GXFFZTMASA-N -1 3 356.294 3.571 20 0 FHADHM Cc1cc(S(=O)(=O)[N-][C@@H]2CCSc3ccccc32)c(F)cc1F ZINC000440405166 945510671 /nfs/dbraw/zinc/51/06/71/945510671.db2.gz VMDJZSYKPDTUPJ-CQSZACIVSA-N -1 3 355.431 3.789 20 0 FHADHM CCOCCC1(C[N-]S(=O)(=O)c2cc(C)c(Cl)s2)CCCC1 ZINC000473866921 945513210 /nfs/dbraw/zinc/51/32/10/945513210.db2.gz RLKAPMNQRQENIS-UHFFFAOYSA-N -1 3 365.948 3.975 20 0 FHADHM C[C@H]1CCN(C(=O)Nc2cccc(-c3nnn[n-]3)c2)[C@@H]1c1cccc(F)c1 ZINC000820717206 945535333 /nfs/dbraw/zinc/53/53/33/945535333.db2.gz OWZKQVILSGUFIL-SJCJKPOMSA-N -1 3 366.400 3.621 20 0 FHADHM C[C@H]1CCN(C(=O)Nc2cccc(-c3nn[n-]n3)c2)[C@@H]1c1cccc(F)c1 ZINC000820717206 945535347 /nfs/dbraw/zinc/53/53/47/945535347.db2.gz OWZKQVILSGUFIL-SJCJKPOMSA-N -1 3 366.400 3.621 20 0 FHADHM CCC1CCC(N(C)C(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)CC1 ZINC000820973607 945603269 /nfs/dbraw/zinc/60/32/69/945603269.db2.gz YIJWQBJKOGADID-TUBUQKNSSA-N -1 3 356.474 3.538 20 0 FHADHM CCC1CCC(N(C)C(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)CC1 ZINC000820973607 945603274 /nfs/dbraw/zinc/60/32/74/945603274.db2.gz YIJWQBJKOGADID-TUBUQKNSSA-N -1 3 356.474 3.538 20 0 FHADHM CCCN(CC1CCCCC1)C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821094666 945633960 /nfs/dbraw/zinc/63/39/60/945633960.db2.gz NQRZMGGYSSODCH-OAHLLOKOSA-N -1 3 370.501 3.930 20 0 FHADHM CCCN(CC1CCCCC1)C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821094666 945633968 /nfs/dbraw/zinc/63/39/68/945633968.db2.gz NQRZMGGYSSODCH-OAHLLOKOSA-N -1 3 370.501 3.930 20 0 FHADHM Cc1ccccc1C[C@@H](CNCc1coc(-c2ccccc2)n1)C(=O)[O-] ZINC000426656662 945635450 /nfs/dbraw/zinc/63/54/50/945635450.db2.gz JKLBQNUACZQHSZ-SFHVURJKSA-N -1 3 350.418 3.683 20 0 FHADHM O=C(NCc1ncccc1[O-])[C@@H](Oc1ccc(Cl)cc1)c1ccccc1 ZINC000473634361 945636962 /nfs/dbraw/zinc/63/69/62/945636962.db2.gz SMNDTJIBNUUJRH-IBGZPJMESA-N -1 3 368.820 3.877 20 0 FHADHM O=C(NCc1ncccc1[O-])c1csc(-c2ccc(Cl)s2)n1 ZINC000473632665 945646421 /nfs/dbraw/zinc/64/64/21/945646421.db2.gz CODABDIFIBRXBP-UHFFFAOYSA-N -1 3 351.840 3.556 20 0 FHADHM CC1(C)[C@@H](C(F)(F)F)CCN1C(=O)c1c[n-]c2c(F)cc(F)cc2c1=O ZINC000408160484 945710017 /nfs/dbraw/zinc/71/00/17/945710017.db2.gz JGRMANJNEAHIHX-LBPRGKRZSA-N -1 3 374.309 3.609 20 0 FHADHM COCc1ccccc1S(=O)(=O)[N-]c1cccc(CN2CCCCC2)c1 ZINC000444035697 945742421 /nfs/dbraw/zinc/74/24/21/945742421.db2.gz RJSBMANEIGTILT-UHFFFAOYSA-N -1 3 374.506 3.620 20 0 FHADHM C[C@@]1(C2CC2)CN(Cc2nc(=O)c3c(-c4ccco4)csc3[n-]2)CCO1 ZINC000661168840 945811764 /nfs/dbraw/zinc/81/17/64/945811764.db2.gz QMXWWBGIELYEKV-IBGZPJMESA-N -1 3 371.462 3.658 20 0 FHADHM COc1cc(C(=O)N2C[C@H](c3ccc(C)cc3)C[C@H]2C)cc(OC)c1[O-] ZINC000428327704 945885607 /nfs/dbraw/zinc/88/56/07/945885607.db2.gz UXBWUTCFPCIANL-RHSMWYFYSA-N -1 3 355.434 3.736 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NCCc3nc(C)c(C)s3)nc2)n1 ZINC000301657330 945896985 /nfs/dbraw/zinc/89/69/85/945896985.db2.gz IMXKKCUFEOOJMD-UHFFFAOYSA-N -1 3 355.467 3.535 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H]3C[C@@H](OC)C3(CC)CC)nc2)n1 ZINC000301710801 945927011 /nfs/dbraw/zinc/92/70/11/945927011.db2.gz KIECNNPJMQVLGL-JKSUJKDBSA-N -1 3 356.470 3.812 20 0 FHADHM CSc1ccc([O-])c(C(=O)N2CCNC[C@@H]2c2cccc(Cl)c2)c1 ZINC000662772058 945936442 /nfs/dbraw/zinc/93/64/42/945936442.db2.gz DGRKAJPTFBNFCJ-MRXNPFEDSA-N -1 3 362.882 3.554 20 0 FHADHM O=C([N-]C[C@H]1CCCN(Cc2ccc(C(F)F)c(F)c2)C1)C(F)(F)F ZINC000894546075 945982746 /nfs/dbraw/zinc/98/27/46/945982746.db2.gz AMWPOIBREWZZNW-LLVKDONJSA-N -1 3 368.321 3.654 20 0 FHADHM Cc1cc(F)cc2c1ncc(-c1nnn[n-]1)c2N1CCC[C@H]1c1ccco1 ZINC000822204694 945991830 /nfs/dbraw/zinc/99/18/30/945991830.db2.gz XQUZAQAOENPTTH-HNNXBMFYSA-N -1 3 364.384 3.797 20 0 FHADHM Cc1cc(F)cc2c1ncc(-c1nn[n-]n1)c2N1CCC[C@H]1c1ccco1 ZINC000822204694 945991843 /nfs/dbraw/zinc/99/18/43/945991843.db2.gz XQUZAQAOENPTTH-HNNXBMFYSA-N -1 3 364.384 3.797 20 0 FHADHM Cc1nc(C)c(CC(=O)N2CCCCC[C@@H]2/C=C\c2ccccc2)c(=O)[n-]1 ZINC000440876751 946003769 /nfs/dbraw/zinc/00/37/69/946003769.db2.gz PZDHOMZIRVVQFL-SYGIOELKSA-N -1 3 365.477 3.826 20 0 FHADHM C[C@@H]1CCC[C@H](C)N1C(=O)c1c[n-]c2ccc(Br)cc2c1=O ZINC000444181075 946037673 /nfs/dbraw/zinc/03/76/73/946037673.db2.gz IXZPROCVCODCCP-PHIMTYICSA-N -1 3 363.255 3.694 20 0 FHADHM CCCOc1ccc([N-]S(=O)(=O)c2ccc(N)c(Cl)c2)cc1F ZINC001211667820 946085392 /nfs/dbraw/zinc/08/53/92/946085392.db2.gz HGWYOVUHJKRVIW-UHFFFAOYSA-N -1 3 358.822 3.651 20 0 FHADHM O=S(=O)([N-]CCc1ccc2ccccc2n1)c1ccc(Cl)cc1F ZINC000520104851 946128024 /nfs/dbraw/zinc/12/80/24/946128024.db2.gz MDPMUDUADNEYOM-UHFFFAOYSA-N -1 3 364.829 3.548 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N3C[C@@H](C)C[C@@H]3c3cccnc3)nc2)n1 ZINC000302145761 946143491 /nfs/dbraw/zinc/14/34/91/946143491.db2.gz RARWQZUKHUWCJL-KBXCAEBGSA-N -1 3 361.449 3.789 20 0 FHADHM CC[C@@]1(C)CCN(C(=O)c2c[n-]c3ccc(Br)cc3c2=O)C1 ZINC000444313683 946208977 /nfs/dbraw/zinc/20/89/77/946208977.db2.gz VREHTWDTHHKHBL-KRWDZBQOSA-N -1 3 363.255 3.553 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N3CCc4c(C)cc(C)cc4C3)nc2)n1 ZINC000302387060 946215887 /nfs/dbraw/zinc/21/58/87/946215887.db2.gz FFNNCWMRKXNMNY-UHFFFAOYSA-N -1 3 360.461 3.986 20 0 FHADHM Cc1csc([C@H](C)[N-]S(=O)(=O)c2cc(C(F)(F)F)ccc2F)n1 ZINC000103160399 946226017 /nfs/dbraw/zinc/22/60/17/946226017.db2.gz SHUIBTMULSSPDK-QMMMGPOBSA-N -1 3 368.377 3.649 20 0 FHADHM CC[C@@H]1CCCC[C@@H]1[N-]S(=O)(=O)c1ccc(Br)s1 ZINC000042254300 946226111 /nfs/dbraw/zinc/22/61/11/946226111.db2.gz TXBVFWZPMMGDCP-ZJUUUORDSA-N -1 3 352.319 3.758 20 0 FHADHM CC[C@@H]1CCN(C(=O)C[C@@H](NC(=O)c2ccc([O-])cc2)c2ccccc2)C1 ZINC000184170909 946242649 /nfs/dbraw/zinc/24/26/49/946242649.db2.gz YVTLMHMAHKPOEB-OXQOHEQNSA-N -1 3 366.461 3.512 20 0 FHADHM CCN(Cc1ccc(OC)c(OC)c1)C(=O)c1cc(SC)ccc1[O-] ZINC000665584899 946281287 /nfs/dbraw/zinc/28/12/87/946281287.db2.gz PXGWGYQHFYTZRJ-UHFFFAOYSA-N -1 3 361.463 3.794 20 0 FHADHM O=C(N[C@@H](c1ccc(Cl)cc1)C(F)(F)F)c1cc(=O)[n-]c(C2CC2)n1 ZINC000520251567 946321704 /nfs/dbraw/zinc/32/17/04/946321704.db2.gz GMNMXQGCDIHNQY-ZDUSSCGKSA-N -1 3 371.746 3.746 20 0 FHADHM CC(C)COc1ccccc1C(=O)OCc1noc(-c2ccccc2[O-])n1 ZINC000783589974 946350060 /nfs/dbraw/zinc/35/00/60/946350060.db2.gz PDKTULUWDVIFGW-UHFFFAOYSA-N -1 3 368.389 3.834 20 0 FHADHM O=C(NCc1ccc(-c2nnn[n-]2)cc1)c1ccc(Oc2ccccc2)cc1 ZINC000520305358 946377093 /nfs/dbraw/zinc/37/70/93/946377093.db2.gz BQUSMOQVMYYTBO-UHFFFAOYSA-N -1 3 371.400 3.589 20 0 FHADHM O=C(NCc1ccc(-c2nn[n-]n2)cc1)c1ccc(Oc2ccccc2)cc1 ZINC000520305358 946377101 /nfs/dbraw/zinc/37/71/01/946377101.db2.gz BQUSMOQVMYYTBO-UHFFFAOYSA-N -1 3 371.400 3.589 20 0 FHADHM CCc1nnc([N-]C(=O)c2cc(F)c(F)cc2C(=O)c2ccccc2)s1 ZINC000475111668 946422695 /nfs/dbraw/zinc/42/26/95/946422695.db2.gz PJZYLKTXDXHVRD-UHFFFAOYSA-N -1 3 373.384 3.862 20 0 FHADHM C[C@@H]1CC[C@@H](N(C)C(=O)c2c[n-]c3ccc(Br)cc3c2=O)C1 ZINC000444402525 946460241 /nfs/dbraw/zinc/46/02/41/946460241.db2.gz JJQLQFULOBUHSH-ZYHUDNBSSA-N -1 3 363.255 3.551 20 0 FHADHM CC(=O)c1ccc(-c2nnn[n-]2)c(NCCCO[C@@H](C)c2ccccc2)c1 ZINC000824014054 946544561 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ZINC000826230395 947675568 /nfs/dbraw/zinc/67/55/68/947675568.db2.gz QYQGYBMFTUZOCM-UHFFFAOYSA-N -1 3 354.439 3.849 20 0 FHADHM CSc1ccc(C)c(NC(=O)Nc2cccc(-c3nn[n-]n3)c2C)c1 ZINC000826230395 947675573 /nfs/dbraw/zinc/67/55/73/947675573.db2.gz QYQGYBMFTUZOCM-UHFFFAOYSA-N -1 3 354.439 3.849 20 0 FHADHM Cc1c(C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)cnn1C1CCOCC1 ZINC000128381976 947693190 /nfs/dbraw/zinc/69/31/90/947693190.db2.gz UBNBVAXBUOKTIJ-UHFFFAOYSA-N -1 3 369.343 3.520 20 0 FHADHM CC(=CC(=O)Nc1sc2c(c1-c1nnn[n-]1)C(C)(C)CC2)c1ccco1 ZINC001573362001 947699172 /nfs/dbraw/zinc/69/91/72/947699172.db2.gz GYTXCTQNYTUSHK-MDZDMXLPSA-N -1 3 369.450 3.787 20 0 FHADHM CC(=CC(=O)Nc1sc2c(c1-c1nn[n-]n1)C(C)(C)CC2)c1ccco1 ZINC001573362001 947699177 /nfs/dbraw/zinc/69/91/77/947699177.db2.gz GYTXCTQNYTUSHK-MDZDMXLPSA-N -1 3 369.450 3.787 20 0 FHADHM Cc1c(N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cnn1-c1ccccc1F ZINC000826242400 947720307 /nfs/dbraw/zinc/72/03/07/947720307.db2.gz NDIUERQQGKBEEH-GFCCVEGCSA-N -1 3 363.400 3.673 20 0 FHADHM Cc1c(N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cnn1-c1ccccc1F ZINC000826242400 947720317 /nfs/dbraw/zinc/72/03/17/947720317.db2.gz NDIUERQQGKBEEH-GFCCVEGCSA-N -1 3 363.400 3.673 20 0 FHADHM Cc1c(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cnn1-c1ccccc1F ZINC000826242388 947721107 /nfs/dbraw/zinc/72/11/07/947721107.db2.gz MUAOAWMVVBJBPR-GFCCVEGCSA-N -1 3 363.400 3.673 20 0 FHADHM Cc1c(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cnn1-c1ccccc1F ZINC000826242388 947721111 /nfs/dbraw/zinc/72/11/11/947721111.db2.gz MUAOAWMVVBJBPR-GFCCVEGCSA-N -1 3 363.400 3.673 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)N(C)c1ccc(-c2nnn[n-]2)cc1F ZINC001573365775 947733746 /nfs/dbraw/zinc/73/37/46/947733746.db2.gz NOWWNFMSYIGCCU-DHZHZOJOSA-N -1 3 371.803 3.726 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)N(C)c1ccc(-c2nn[n-]n2)cc1F ZINC001573365775 947733753 /nfs/dbraw/zinc/73/37/53/947733753.db2.gz NOWWNFMSYIGCCU-DHZHZOJOSA-N -1 3 371.803 3.726 20 0 FHADHM CC(=Cc1ccc(C)cc1)C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC001573367165 947754471 /nfs/dbraw/zinc/75/44/71/947754471.db2.gz YIILOLSNCQOEEN-UVTDQMKNSA-N -1 3 364.453 3.774 20 0 FHADHM CC(=Cc1ccc(C)cc1)C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC001573367165 947754476 /nfs/dbraw/zinc/75/44/76/947754476.db2.gz YIILOLSNCQOEEN-UVTDQMKNSA-N -1 3 364.453 3.774 20 0 FHADHM Cc1cc(C)c(C(=O)NCc2ccc(-c3ccccc3-c3nnn[n-]3)cc2)o1 ZINC000826263355 947762638 /nfs/dbraw/zinc/76/26/38/947762638.db2.gz WXNHRINIYKKWNW-UHFFFAOYSA-N -1 3 373.416 3.674 20 0 FHADHM Cc1cc(C)c(C(=O)NCc2ccc(-c3ccccc3-c3nn[n-]n3)cc2)o1 ZINC000826263355 947762640 /nfs/dbraw/zinc/76/26/40/947762640.db2.gz WXNHRINIYKKWNW-UHFFFAOYSA-N -1 3 373.416 3.674 20 0 FHADHM Cc1cc(CNc2ccn(-c3ccc(-c4nn[n-]n4)cc3Cl)n2)c(C)o1 ZINC000826267212 947771142 /nfs/dbraw/zinc/77/11/42/947771142.db2.gz WKMAHUWZCSFSAJ-UHFFFAOYSA-N -1 3 369.816 3.528 20 0 FHADHM Cc1cccc2c(=O)c(C(=O)Nc3cc4c(cc3F)NC(=O)CC4)c[n-]c12 ZINC000189637854 947775120 /nfs/dbraw/zinc/77/51/20/947775120.db2.gz PWNWVVYPNYRMQJ-UHFFFAOYSA-N -1 3 365.364 3.525 20 0 FHADHM COc1cc([N-]S(=O)(=O)C[C@H]2CCCCO2)c(C2CC2)cc1Cl ZINC000655602467 947808456 /nfs/dbraw/zinc/80/84/56/947808456.db2.gz CMDLBJCCDBZPHI-GFCCVEGCSA-N -1 3 359.875 3.537 20 0 FHADHM Cc1ccnc(N[C@H](C)c2ccc(-c3cccc(-c4nnn[n-]4)c3)cc2)n1 ZINC000826311531 947902025 /nfs/dbraw/zinc/90/20/25/947902025.db2.gz HGJCYTJHSWTXSF-CQSZACIVSA-N -1 3 357.421 3.805 20 0 FHADHM Cc1ccnc(N[C@H](C)c2ccc(-c3cccc(-c4nn[n-]n4)c3)cc2)n1 ZINC000826311531 947902031 /nfs/dbraw/zinc/90/20/31/947902031.db2.gz HGJCYTJHSWTXSF-CQSZACIVSA-N -1 3 357.421 3.805 20 0 FHADHM Cc1ccnc(NCc2ccc(OC3CCCC3)cc2)c1-c1nnn[n-]1 ZINC000826314471 947917550 /nfs/dbraw/zinc/91/75/50/947917550.db2.gz YFWXAYADYYIEDG-UHFFFAOYSA-N -1 3 350.426 3.504 20 0 FHADHM Cc1ccnc(NCc2ccc(OC3CCCC3)cc2)c1-c1nn[n-]n1 ZINC000826314471 947917557 /nfs/dbraw/zinc/91/75/57/947917557.db2.gz YFWXAYADYYIEDG-UHFFFAOYSA-N -1 3 350.426 3.504 20 0 FHADHM Cc1nc(C(C)C)sc1[C@@H](C)OC(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000826323395 947945689 /nfs/dbraw/zinc/94/56/89/947945689.db2.gz CIHJVXARVFFHAF-LLVKDONJSA-N -1 3 357.439 3.673 20 0 FHADHM Cc1nc(C(C)C)sc1[C@@H](C)OC(=O)c1cccc(-c2nn[n-]n2)c1 ZINC000826323395 947945691 /nfs/dbraw/zinc/94/56/91/947945691.db2.gz CIHJVXARVFFHAF-LLVKDONJSA-N -1 3 357.439 3.673 20 0 FHADHM CCOc1ccc([C@H]2CCCN2C(=O)c2ccc(C(C)=O)c([O-])c2)cc1 ZINC000662698500 947989352 /nfs/dbraw/zinc/98/93/52/947989352.db2.gz BOTJTDQZQDPBJW-LJQANCHMSA-N -1 3 353.418 3.971 20 0 FHADHM CCOc1ccc([C@@H]2CCCN2C(=O)c2ccc(C(C)=O)c([O-])c2)cc1 ZINC000662698499 947989435 /nfs/dbraw/zinc/98/94/35/947989435.db2.gz BOTJTDQZQDPBJW-IBGZPJMESA-N -1 3 353.418 3.971 20 0 FHADHM Clc1cccc(SCc2nnc(-c3ccccc3)o2)c1-c1nnn[n-]1 ZINC000826353241 948105024 /nfs/dbraw/zinc/10/50/24/948105024.db2.gz HHNTXQRFDNPRMN-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1cccc(SCc2nnc(-c3ccccc3)o2)c1-c1nn[n-]n1 ZINC000826353241 948105028 /nfs/dbraw/zinc/10/50/28/948105028.db2.gz HHNTXQRFDNPRMN-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Cn1c(CSc2cccc(Cl)c2-c2nnn[n-]2)nc2ccccc21 ZINC000826355934 948108055 /nfs/dbraw/zinc/10/80/55/948108055.db2.gz UAMXLFOLCMVUAY-UHFFFAOYSA-N -1 3 356.842 3.699 20 0 FHADHM Cn1c(CSc2cccc(Cl)c2-c2nn[n-]n2)nc2ccccc21 ZINC000826355934 948108061 /nfs/dbraw/zinc/10/80/61/948108061.db2.gz UAMXLFOLCMVUAY-UHFFFAOYSA-N -1 3 356.842 3.699 20 0 FHADHM CCc1ccc([O-])c(C(=O)N2CCC[C@@H](n3ccc(C(F)(F)F)n3)C2)c1 ZINC000180767516 948129157 /nfs/dbraw/zinc/12/91/57/948129157.db2.gz STLZOWAPCQGMSP-CYBMUJFWSA-N -1 3 367.371 3.647 20 0 FHADHM Fc1cc2nc(C(Cl)=Cc3ccccc3-c3nnn[n-]3)[nH]c2cc1F ZINC000826372645 948157389 /nfs/dbraw/zinc/15/73/89/948157389.db2.gz GMGRHJZEGXYXDH-YHYXMXQVSA-N -1 3 358.739 3.758 20 0 FHADHM Fc1cc2nc(C(Cl)=Cc3ccccc3-c3nn[n-]n3)[nH]c2cc1F ZINC000826372645 948157392 /nfs/dbraw/zinc/15/73/92/948157392.db2.gz GMGRHJZEGXYXDH-YHYXMXQVSA-N -1 3 358.739 3.758 20 0 FHADHM Fc1ccc(CN[C@H](c2cccc(-c3nnn[n-]3)c2)C(F)(F)F)cc1F ZINC000826374536 948161590 /nfs/dbraw/zinc/16/15/90/948161590.db2.gz CPLVCIFSXWPFTN-CQSZACIVSA-N -1 3 369.297 3.538 20 0 FHADHM Fc1ccc(CN[C@H](c2cccc(-c3nn[n-]n3)c2)C(F)(F)F)cc1F ZINC000826374536 948161594 /nfs/dbraw/zinc/16/15/94/948161594.db2.gz CPLVCIFSXWPFTN-CQSZACIVSA-N -1 3 369.297 3.538 20 0 FHADHM Fc1ccc(C2=CCN(c3cccc(Cl)c3-c3nnn[n-]3)CC2)cc1 ZINC000826373958 948161630 /nfs/dbraw/zinc/16/16/30/948161630.db2.gz GSXIASKHYZJUAU-UHFFFAOYSA-N -1 3 355.804 3.953 20 0 FHADHM Fc1ccc(C2=CCN(c3cccc(Cl)c3-c3nn[n-]n3)CC2)cc1 ZINC000826373958 948161634 /nfs/dbraw/zinc/16/16/34/948161634.db2.gz GSXIASKHYZJUAU-UHFFFAOYSA-N -1 3 355.804 3.953 20 0 FHADHM Fc1cccc([C@@H](NCc2cccc(-c3nnn[n-]3)c2)C(F)(F)F)c1F ZINC000826376554 948164479 /nfs/dbraw/zinc/16/44/79/948164479.db2.gz IXAYJZDALVHRCD-CQSZACIVSA-N -1 3 369.297 3.538 20 0 FHADHM Fc1cccc([C@@H](NCc2cccc(-c3nn[n-]n3)c2)C(F)(F)F)c1F ZINC000826376554 948164487 /nfs/dbraw/zinc/16/44/87/948164487.db2.gz IXAYJZDALVHRCD-CQSZACIVSA-N -1 3 369.297 3.538 20 0 FHADHM CCCCOc1ccc(C(=O)N2CCO[C@@H](c3ccsc3)C2)c([O-])c1 ZINC000190629188 948184197 /nfs/dbraw/zinc/18/41/97/948184197.db2.gz KJTOGSSDKWECJY-GOSISDBHSA-N -1 3 361.463 3.846 20 0 FHADHM O=C(CC1CCC(C(F)(F)F)CC1)Nc1sccc1-c1nnn[n-]1 ZINC000826404142 948231317 /nfs/dbraw/zinc/23/13/17/948231317.db2.gz PIJURUCDQYYTPO-UHFFFAOYSA-N -1 3 359.377 3.626 20 0 FHADHM O=C(CC1CCC(C(F)(F)F)CC1)Nc1sccc1-c1nn[n-]n1 ZINC000826404142 948231328 /nfs/dbraw/zinc/23/13/28/948231328.db2.gz PIJURUCDQYYTPO-UHFFFAOYSA-N -1 3 359.377 3.626 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)C3(c4cccc(C)c4)CC3)c2)n1 ZINC000053060905 948316199 /nfs/dbraw/zinc/31/61/99/948316199.db2.gz PEANSFIMJGKOHC-UHFFFAOYSA-N -1 3 373.456 3.978 20 0 FHADHM CCC[C@@H](C)[N-]S(=O)(=O)c1ccc(Br)cc1C(F)(F)F ZINC000614597901 948327248 /nfs/dbraw/zinc/32/72/48/948327248.db2.gz CYUNDLKBYZENPI-MRVPVSSYSA-N -1 3 374.222 3.935 20 0 FHADHM CC(=O)Nc1cc(NC(=O)c2ccc3c(c2[O-])OC(C)(C)C3)ccc1C ZINC000094014943 948338326 /nfs/dbraw/zinc/33/83/26/948338326.db2.gz BHJPQNLMFSOESF-UHFFFAOYSA-N -1 3 354.406 3.625 20 0 FHADHM CO[C@H](CNCc1ccc(-c2cccc(Cl)c2Cl)o1)CC(=O)[O-] ZINC000417639848 948387602 /nfs/dbraw/zinc/38/76/02/948387602.db2.gz USSQAEZUGZKZGI-NSHDSACASA-N -1 3 358.221 3.833 20 0 FHADHM COc1ccc(CNCc2ccc(C(=O)[O-])c(C)c2)cc1OC(F)F ZINC000417665379 948418994 /nfs/dbraw/zinc/41/89/94/948418994.db2.gz CJLVKNPYHPAZHA-UHFFFAOYSA-N -1 3 351.349 3.593 20 0 FHADHM Cc1ccc(-c2nc(CC(=O)N=c3cc(-c4ccccc4)[n-][nH]3)cs2)o1 ZINC000520632856 948454220 /nfs/dbraw/zinc/45/42/20/948454220.db2.gz BXXQTQIXTQJXOZ-UHFFFAOYSA-N -1 3 364.430 3.705 20 0 FHADHM CCC[C@@H](C(=O)NCc1ccc(-c2nnn[n-]2)cc1)c1cccc(Cl)c1 ZINC001292977952 948499958 /nfs/dbraw/zinc/49/99/58/948499958.db2.gz QAKSOQOKSVDJLO-QGZVFWFLSA-N -1 3 369.856 3.720 20 0 FHADHM CCC[C@@H](C(=O)NCc1ccc(-c2nn[n-]n2)cc1)c1cccc(Cl)c1 ZINC001292977952 948499961 /nfs/dbraw/zinc/49/99/61/948499961.db2.gz QAKSOQOKSVDJLO-QGZVFWFLSA-N -1 3 369.856 3.720 20 0 FHADHM C[C@H](CC(=O)Nc1cc(-c2nnn[n-]2)ccc1F)Cc1ccc(Cl)cc1 ZINC001528093352 948541585 /nfs/dbraw/zinc/54/15/85/948541585.db2.gz FYLVYVPUBNLWRO-NSHDSACASA-N -1 3 373.819 3.867 20 0 FHADHM C[C@H](CC(=O)Nc1cc(-c2nn[n-]n2)ccc1F)Cc1ccc(Cl)cc1 ZINC001528093352 948541597 /nfs/dbraw/zinc/54/15/97/948541597.db2.gz FYLVYVPUBNLWRO-NSHDSACASA-N -1 3 373.819 3.867 20 0 FHADHM COc1cccc(NC(=S)N[N-]C(=O)c2ccc(Cl)cc2Cl)c1 ZINC000006570912 948569413 /nfs/dbraw/zinc/56/94/13/948569413.db2.gz QHKLMURZDYOZRS-UHFFFAOYSA-N -1 3 370.261 3.633 20 0 FHADHM CCOC(=O)c1nc([C@@H](CC(C)C)NCc2cc3cc(F)ccc3o2)n[n-]1 ZINC000895104344 948580621 /nfs/dbraw/zinc/58/06/21/948580621.db2.gz JSLFEPAPNFAMBC-OAHLLOKOSA-N -1 3 374.416 3.744 20 0 FHADHM CCOC(=O)c1nnc([C@@H](CC(C)C)NCc2cc3cc(F)ccc3o2)[n-]1 ZINC000895104344 948580622 /nfs/dbraw/zinc/58/06/22/948580622.db2.gz JSLFEPAPNFAMBC-OAHLLOKOSA-N -1 3 374.416 3.744 20 0 FHADHM CCOC(=O)c1n[n-]c([C@@H](CC(C)C)NCc2cc3cc(F)ccc3o2)n1 ZINC000895104344 948580630 /nfs/dbraw/zinc/58/06/30/948580630.db2.gz JSLFEPAPNFAMBC-OAHLLOKOSA-N -1 3 374.416 3.744 20 0 FHADHM Cc1ccc2[nH]c([N-]S(=O)(=O)Cc3cc(Cl)ccc3F)nc2c1 ZINC000427627094 948666190 /nfs/dbraw/zinc/66/61/90/948666190.db2.gz WWFZNUZPDQXVFP-UHFFFAOYSA-N -1 3 353.806 3.606 20 0 FHADHM Cc1ccc2nc([N-]S(=O)(=O)Cc3cc(Cl)ccc3F)[nH]c2c1 ZINC000427627094 948666195 /nfs/dbraw/zinc/66/61/95/948666195.db2.gz WWFZNUZPDQXVFP-UHFFFAOYSA-N -1 3 353.806 3.606 20 0 FHADHM C[C@@H]([N-]S(=O)(=O)c1cccc(F)c1F)c1nc(C(C)(C)C)cs1 ZINC000106893056 948710313 /nfs/dbraw/zinc/71/03/13/948710313.db2.gz ANOZDDVSQNKPAR-SECBINFHSA-N -1 3 360.451 3.758 20 0 FHADHM C[C@@H]([N-]S(=O)(=O)c1cc(F)cc(F)c1)c1nc(C(C)(C)C)cs1 ZINC000106893485 948710451 /nfs/dbraw/zinc/71/04/51/948710451.db2.gz BYQHXCHHANJXMA-SECBINFHSA-N -1 3 360.451 3.758 20 0 FHADHM C[C@H]([N-]S(=O)(=O)c1cccc(F)c1F)c1nc(C(C)(C)C)cs1 ZINC000106893055 948710488 /nfs/dbraw/zinc/71/04/88/948710488.db2.gz ANOZDDVSQNKPAR-VIFPVBQESA-N -1 3 360.451 3.758 20 0 FHADHM O=C(NCc1ccc(C(=O)Nc2ccccc2[O-])cc1)c1cccs1 ZINC000045012284 205115807 /nfs/dbraw/zinc/11/58/07/205115807.db2.gz QYEFEONURBBTTO-UHFFFAOYSA-N -1 3 352.415 3.636 20 0 FHADHM C[C@H](Sc1ccc(Br)cc1)C(=O)Nc1ncccc1[O-] ZINC000048513800 205164682 /nfs/dbraw/zinc/16/46/82/205164682.db2.gz VCVAHQRWHMGGGE-VIFPVBQESA-N -1 3 353.241 3.669 20 0 FHADHM CC(=O)Nc1ccc(F)c([N-]S(=O)(=O)c2ccc(C)c(Cl)c2)c1 ZINC000055582972 205221951 /nfs/dbraw/zinc/22/19/51/205221951.db2.gz FDESGDKCVAWZOL-UHFFFAOYSA-N -1 3 356.806 3.547 20 0 FHADHM O=C(NC[C@@H]1CCN(c2ccccc2)C1)c1cc2c(cc1[O-])CCCC2 ZINC000109189562 206047982 /nfs/dbraw/zinc/04/79/82/206047982.db2.gz ZTIIFZWVNUWMEO-INIZCTEOSA-N -1 3 350.462 3.527 20 0 FHADHM COc1ccc(O[C@@H](C)C(=O)Nc2ccc(Br)cc2[O-])cc1 ZINC000126007843 206118126 /nfs/dbraw/zinc/11/81/26/206118126.db2.gz MSAOSXAATMGYBA-JTQLQIEISA-N -1 3 366.211 3.569 20 0 FHADHM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2ccc3c(c2)CCN3C(C)=O)cc1 ZINC000022274510 220381804 /nfs/dbraw/zinc/38/18/04/220381804.db2.gz GOSOOMYRQNLJIV-AWEZNQCLSA-N -1 3 372.490 3.910 20 0 FHADHM CCCCCc1n[n-]c(=NC(=O)NC[C@@H](C)N2CCC[C@@H](C)C2)s1 ZINC000503142146 514932671 /nfs/dbraw/zinc/93/26/71/514932671.db2.gz AUHUDNRIQHYNGB-ZIAGYGMSSA-N -1 3 353.536 3.513 20 0 FHADHM C[C@@H](CSCc1ccccc1)C(=O)N=c1cc(OC(F)F)n(C)[n-]1 ZINC000490940726 515337227 /nfs/dbraw/zinc/33/72/27/515337227.db2.gz HIFXZBAMZUYDLV-NSHDSACASA-N -1 3 355.410 3.530 20 0 FHADHM C[C@H](CSc1ccc(F)cc1)C(=O)N=c1cc(OC(F)F)n(C)[n-]1 ZINC000490944411 515340078 /nfs/dbraw/zinc/34/00/78/515340078.db2.gz VOHCQHVZTHRKKG-SECBINFHSA-N -1 3 359.373 3.528 20 0 FHADHM Cc1cc(C)cc(-c2cc(=NC(=O)[C@H](C)N(C)CC(F)(F)F)[nH][n-]2)c1 ZINC000493950650 515695204 /nfs/dbraw/zinc/69/52/04/515695204.db2.gz RBIYNXQPFAZPDN-LBPRGKRZSA-N -1 3 354.376 3.515 20 0 FHADHM CCN(C(=O)N=c1[n-]nc(C)s1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000473687109 515716465 /nfs/dbraw/zinc/71/64/65/515716465.db2.gz PKOUMHIDPHNMBR-BBRMVZONSA-N -1 3 359.499 3.536 20 0 FHADHM CC(=O)c1cccc(C(=O)N=c2cc3ccc(Br)cn3[n-]2)c1 ZINC000511354603 515875737 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O=C(Nc1ccc2c(c1)CCC(=O)N2)c1cc([O-])ccc1C(F)(F)F ZINC000188591664 567975221 /nfs/dbraw/zinc/97/52/21/567975221.db2.gz DXTPKYLQOJEVHO-UHFFFAOYSA-N -1 3 350.296 3.548 20 0 FHADHM COc1ccc(C(=O)N(C)C[C@@H]2CCCO[C@@H]2c2ccccc2)c([O-])c1 ZINC000051468117 567979581 /nfs/dbraw/zinc/97/95/81/567979581.db2.gz BGPIVMIDEDQYRH-OXJNMPFZSA-N -1 3 355.434 3.641 20 0 FHADHM Cc1csc(C2([N-]S(=O)(=O)c3ccc(F)c(Cl)c3)CCCC2)n1 ZINC000602895447 568014140 /nfs/dbraw/zinc/01/41/40/568014140.db2.gz LJEWVJDHTRUARV-UHFFFAOYSA-N -1 3 374.890 3.992 20 0 FHADHM C[C@@H]1CCC[C@H](NC(=O)c2cc(=O)c3cc(Br)ccc3[n-]2)C1 ZINC000602740838 568020942 /nfs/dbraw/zinc/02/09/42/568020942.db2.gz WEJVQHIZUQZBDU-PWSUYJOCSA-N -1 3 363.255 3.599 20 0 FHADHM C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2C(=O)c2cc([O-])c3ccccc3c2)C1 ZINC000408223661 568032426 /nfs/dbraw/zinc/03/24/26/568032426.db2.gz CDMSHCUVQYMVJE-YGBSJELFSA-N -1 3 353.462 3.947 20 0 FHADHM CC(C)C[C@H]1COCCN1C(=O)c1ccc(C(=O)c2cccc([O-])c2)cc1 ZINC000186981790 568035079 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ZINC000390850848 568343612 /nfs/dbraw/zinc/34/36/12/568343612.db2.gz GVTJRIJSAKTLBL-ZDUSSCGKSA-N -1 3 370.444 3.691 20 0 FHADHM CC[C@H](Cc1ccc(Cl)cc1)NC(=O)c1c[n-]c2ccccc2c1=O ZINC000604755767 568364856 /nfs/dbraw/zinc/36/48/56/568364856.db2.gz CXTXLERZBVWJOA-OAHLLOKOSA-N -1 3 354.837 3.933 20 0 FHADHM COc1ccccc1-c1cc(=NC(=O)CCSc2ccccc2F)[nH][n-]1 ZINC000604789295 568367205 /nfs/dbraw/zinc/36/72/05/568367205.db2.gz VLDPJHJBLFMORG-UHFFFAOYSA-N -1 3 371.437 3.767 20 0 FHADHM O=C(c1cc(=O)c2ccccc2[n-]1)N(CCc1ccc(F)cc1)C1CC1 ZINC000604876112 568383038 /nfs/dbraw/zinc/38/30/38/568383038.db2.gz YOASEYJDYNPATD-UHFFFAOYSA-N -1 3 350.393 3.515 20 0 FHADHM COc1cc(CSc2n[n-]c(-c3ccccn3)n2)ccc1OC(F)F ZINC000604933194 568395404 /nfs/dbraw/zinc/39/54/04/568395404.db2.gz KDONCYSQQCLZKD-UHFFFAOYSA-N -1 3 364.377 3.769 20 0 FHADHM CCCCOc1ccc(C(=O)N2CCn3c(C(C)C)nnc3[C@@H]2C)c([O-])c1 ZINC000365289367 568426404 /nfs/dbraw/zinc/42/64/04/568426404.db2.gz AWJULARHFXUXDR-AWEZNQCLSA-N -1 3 372.469 3.503 20 0 FHADHM Cc1oc(-c2ccccc2)nc1C(=O)[N-]c1nncn1Cc1ccccc1 ZINC000605117990 568573391 /nfs/dbraw/zinc/57/33/91/568573391.db2.gz HNWAUKDQNIOSBU-UHFFFAOYSA-N -1 3 359.389 3.542 20 0 FHADHM O=C(NCc1ccc([O-])c(F)c1)N[C@@H](c1ccc(F)cc1)c1cccnc1 ZINC000365454534 568726171 /nfs/dbraw/zinc/72/61/71/568726171.db2.gz IVEXMXHEKZDUJW-IBGZPJMESA-N -1 3 369.371 3.654 20 0 FHADHM CC[C@@H](OC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1ccc(F)cc1F ZINC000736380385 598823395 /nfs/dbraw/zinc/82/33/95/598823395.db2.gz FSGOFWMESZQYEN-PYUISTEWSA-N -1 3 370.359 3.853 20 0 FHADHM CC[C@@H](OC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1ccc(F)cc1F ZINC000736380385 598823396 /nfs/dbraw/zinc/82/33/96/598823396.db2.gz FSGOFWMESZQYEN-PYUISTEWSA-N -1 3 370.359 3.853 20 0 FHADHM Cc1csc(-c2cccc(C(=O)Oc3ccc(-c4nn[n-]n4)cc3)c2)n1 ZINC000737447951 598828144 /nfs/dbraw/zinc/82/81/44/598828144.db2.gz HXXYSXPQSRECJA-UHFFFAOYSA-N -1 3 363.402 3.518 20 0 FHADHM CC/C=C(/C)C(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000736408568 598833648 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CCSc1cccc(NC(=O)Nc2cc(-c3nn[n-]n3)ccc2OC)c1 ZINC000736667386 598879589 /nfs/dbraw/zinc/87/95/89/598879589.db2.gz PEGNJEUHPDACEL-UHFFFAOYSA-N -1 3 370.438 3.631 20 0 FHADHM CCCCCNC(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000736451804 598889324 /nfs/dbraw/zinc/88/93/24/598889324.db2.gz RHMPHDDQVZTAND-UHFFFAOYSA-N -1 3 370.482 3.585 20 0 FHADHM CC(C)[C@H](Cc1ccccc1)C(=O)OCc1cc(-c2nnn[n-]2)ccc1F ZINC000735710290 598901559 /nfs/dbraw/zinc/90/15/59/598901559.db2.gz NQIZVWBSIDJOOI-KRWDZBQOSA-N -1 3 368.412 3.564 20 0 FHADHM CC(C)[C@H](Cc1ccccc1)C(=O)OCc1cc(-c2nn[n-]n2)ccc1F ZINC000735710290 598901561 /nfs/dbraw/zinc/90/15/61/598901561.db2.gz NQIZVWBSIDJOOI-KRWDZBQOSA-N -1 3 368.412 3.564 20 0 FHADHM C[C@@H](CC1CCCC1)C(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000735984991 598903091 /nfs/dbraw/zinc/90/30/91/598903091.db2.gz IBDHLLFXUGUXTQ-AWEZNQCLSA-N -1 3 353.470 3.574 20 0 FHADHM C[C@@H](CC1CCCC1)C(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000735984991 598903092 /nfs/dbraw/zinc/90/30/92/598903092.db2.gz IBDHLLFXUGUXTQ-AWEZNQCLSA-N -1 3 353.470 3.574 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@H]2C(=O)Nc2sccc2-c2nnn[n-]2)cc1 ZINC000735922037 598911022 /nfs/dbraw/zinc/91/10/22/598911022.db2.gz AHMULZLEZMHDFL-HUUCEWRRSA-N -1 3 353.451 3.794 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@H]2C(=O)Nc2sccc2-c2nn[n-]n2)cc1 ZINC000735922037 598911023 /nfs/dbraw/zinc/91/10/23/598911023.db2.gz AHMULZLEZMHDFL-HUUCEWRRSA-N -1 3 353.451 3.794 20 0 FHADHM CCOc1cc(CNc2ccc(Cl)cc2-c2nnn[n-]2)ccc1OC ZINC000736624825 598914097 /nfs/dbraw/zinc/91/40/97/598914097.db2.gz IIEDWLTZTQVJAN-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM CCOc1cc(CNc2ccc(Cl)cc2-c2nn[n-]n2)ccc1OC ZINC000736624825 598914098 /nfs/dbraw/zinc/91/40/98/598914098.db2.gz IIEDWLTZTQVJAN-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM CC(C)CC(=O)Nc1ccc(Nc2ncc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000735755889 598936818 /nfs/dbraw/zinc/93/68/18/598936818.db2.gz JGCNKQOXKXGIPE-UHFFFAOYSA-N -1 3 371.832 3.643 20 0 FHADHM CC(C)CC(=O)Nc1ccc(Nc2ncc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000735755889 598936820 /nfs/dbraw/zinc/93/68/20/598936820.db2.gz JGCNKQOXKXGIPE-UHFFFAOYSA-N -1 3 371.832 3.643 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1Oc1cccc(Oc2ccccn2)c1 ZINC000737557663 598937383 /nfs/dbraw/zinc/93/73/83/598937383.db2.gz GXSBBRCIFJMBNI-UHFFFAOYSA-N -1 3 366.768 3.895 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1Oc1cccc(Oc2ccccn2)c1 ZINC000737557663 598937384 /nfs/dbraw/zinc/93/73/84/598937384.db2.gz GXSBBRCIFJMBNI-UHFFFAOYSA-N -1 3 366.768 3.895 20 0 FHADHM c1ccc2c(c1)CC(SCCCOc1ccc(-c3nn[n-]n3)cc1)=N2 ZINC000738438143 598940496 /nfs/dbraw/zinc/94/04/96/598940496.db2.gz XQIFEUXPWAOHAL-UHFFFAOYSA-N -1 3 351.435 3.655 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1N[C@@H](c1ccccc1)c1cccnc1 ZINC000737557685 598941545 /nfs/dbraw/zinc/94/15/45/598941545.db2.gz HLLFZUIVEMOERZ-INIZCTEOSA-N -1 3 363.812 3.512 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1N[C@@H](c1ccccc1)c1cccnc1 ZINC000737557685 598941547 /nfs/dbraw/zinc/94/15/47/598941547.db2.gz HLLFZUIVEMOERZ-INIZCTEOSA-N -1 3 363.812 3.512 20 0 FHADHM C[C@@H]1C[C@H](C)CN1C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736228597 598951715 /nfs/dbraw/zinc/95/17/15/598951715.db2.gz OITBXSIGUYELLH-UONOGXRCSA-N -1 3 363.421 3.530 20 0 FHADHM C[C@@H]1C[C@H](C)CN1C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736228597 598951717 /nfs/dbraw/zinc/95/17/17/598951717.db2.gz OITBXSIGUYELLH-UONOGXRCSA-N -1 3 363.421 3.530 20 0 FHADHM Cc1cccc([C@@H](C)NC(=S)Nc2ccccc2-c2nnn[n-]2)c1C ZINC000737391236 599015076 /nfs/dbraw/zinc/01/50/76/599015076.db2.gz YLFDMBDTBOMYGX-CYBMUJFWSA-N -1 3 352.467 3.531 20 0 FHADHM Cc1cccc([C@@H](C)NC(=S)Nc2ccccc2-c2nn[n-]n2)c1C ZINC000737391236 599015078 /nfs/dbraw/zinc/01/50/78/599015078.db2.gz YLFDMBDTBOMYGX-CYBMUJFWSA-N -1 3 352.467 3.531 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@@H]2C(=O)OCc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000735924049 599016786 /nfs/dbraw/zinc/01/67/86/599016786.db2.gz ORQKAXDIUPLRHP-MOPGFXCFSA-N -1 3 362.433 3.837 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@@H]2C(=O)OCc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000735924049 599016788 /nfs/dbraw/zinc/01/67/88/599016788.db2.gz ORQKAXDIUPLRHP-MOPGFXCFSA-N -1 3 362.433 3.837 20 0 FHADHM CC[C@@H](OC(=O)CCc1ccc(-c2nnn[n-]2)cc1)c1cccc(OC)c1 ZINC000736383697 599027907 /nfs/dbraw/zinc/02/79/07/599027907.db2.gz UAPJTWYVJYZJHI-GOSISDBHSA-N -1 3 366.421 3.502 20 0 FHADHM CC[C@@H](OC(=O)CCc1ccc(-c2nn[n-]n2)cc1)c1cccc(OC)c1 ZINC000736383697 599027909 /nfs/dbraw/zinc/02/79/09/599027909.db2.gz UAPJTWYVJYZJHI-GOSISDBHSA-N -1 3 366.421 3.502 20 0 FHADHM CC[C@H](OC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1cccc(OC)c1 ZINC000736379708 599027931 /nfs/dbraw/zinc/02/79/31/599027931.db2.gz CVYRBBKVRQUKOV-JYBLJSLWSA-N -1 3 364.405 3.583 20 0 FHADHM CC[C@H](OC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1cccc(OC)c1 ZINC000736379708 599027933 /nfs/dbraw/zinc/02/79/33/599027933.db2.gz CVYRBBKVRQUKOV-JYBLJSLWSA-N -1 3 364.405 3.583 20 0 FHADHM C[C@@H]1CN(c2ccc(Cl)cc2-c2nnn[n-]2)C[C@@H](c2ccc(F)cc2)O1 ZINC000820778453 599039656 /nfs/dbraw/zinc/03/96/56/599039656.db2.gz WYVOVYJEBQTLDO-DIFFPNOSSA-N -1 3 373.819 3.626 20 0 FHADHM C[C@@H]1CN(c2ccc(Cl)cc2-c2nn[n-]n2)C[C@@H](c2ccc(F)cc2)O1 ZINC000820778453 599039659 /nfs/dbraw/zinc/03/96/59/599039659.db2.gz WYVOVYJEBQTLDO-DIFFPNOSSA-N -1 3 373.819 3.626 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N[C@@H]2CC[C@@H]3CCC[C@@H]3C2)n1 ZINC000822723870 599055382 /nfs/dbraw/zinc/05/53/82/599055382.db2.gz RPWNDTREHNDGJE-HBNTYKKESA-N -1 3 352.364 3.661 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N[C@@H]2CC[C@@H]3CCC[C@@H]3C2)n1 ZINC000822723870 599055385 /nfs/dbraw/zinc/05/53/85/599055385.db2.gz RPWNDTREHNDGJE-HBNTYKKESA-N -1 3 352.364 3.661 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(NC2CC(c3ccccc3)C2)n1 ZINC000737633629 599055551 /nfs/dbraw/zinc/05/55/51/599055551.db2.gz TXHPYFHFXPTEHR-UHFFFAOYSA-N -1 3 360.343 3.639 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(NC2CC(c3ccccc3)C2)n1 ZINC000737633629 599055554 /nfs/dbraw/zinc/05/55/54/599055554.db2.gz TXHPYFHFXPTEHR-UHFFFAOYSA-N -1 3 360.343 3.639 20 0 FHADHM Cc1nnc(N[C@H](c2ccc(Cl)cc2)[C@H]2C[C@@H]2C)c(-c2nnn[n-]2)c1C ZINC000822510114 599055738 /nfs/dbraw/zinc/05/57/38/599055738.db2.gz JMSCHOIDRFFRSH-AUYAEMIRSA-N -1 3 369.860 3.736 20 0 FHADHM Cc1nnc(N[C@H](c2ccc(Cl)cc2)[C@H]2C[C@@H]2C)c(-c2nn[n-]n2)c1C ZINC000822510114 599055739 /nfs/dbraw/zinc/05/57/39/599055739.db2.gz JMSCHOIDRFFRSH-AUYAEMIRSA-N -1 3 369.860 3.736 20 0 FHADHM C[C@@H](OC(=O)c1sccc1-c1nnn[n-]1)c1ncc(-c2ccccc2)o1 ZINC000736165166 599056311 /nfs/dbraw/zinc/05/63/11/599056311.db2.gz SEWNIMLNAXGDQM-SNVBAGLBSA-N -1 3 367.390 3.501 20 0 FHADHM C[C@H](CNc1c(F)cc(-c2nnn[n-]2)cc1F)Oc1ccccc1Cl ZINC000820275397 599064154 /nfs/dbraw/zinc/06/41/54/599064154.db2.gz PQXPRCGJZOQRMK-SECBINFHSA-N -1 3 365.771 3.678 20 0 FHADHM C[C@H](CNc1c(F)cc(-c2nn[n-]n2)cc1F)Oc1ccccc1Cl ZINC000820275397 599064157 /nfs/dbraw/zinc/06/41/57/599064157.db2.gz PQXPRCGJZOQRMK-SECBINFHSA-N -1 3 365.771 3.678 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)cc1CNc1ccc(C(F)(F)F)c(Cl)n1 ZINC000822761441 599069896 /nfs/dbraw/zinc/06/98/96/599069896.db2.gz MRAIKTRNRGFDRD-UHFFFAOYSA-N -1 3 372.713 3.685 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CNc1ccc(C(F)(F)F)c(Cl)n1 ZINC000822761441 599069899 /nfs/dbraw/zinc/06/98/99/599069899.db2.gz MRAIKTRNRGFDRD-UHFFFAOYSA-N -1 3 372.713 3.685 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N2CCC(C3CCCC3)CC2)n1 ZINC000822723715 599081799 /nfs/dbraw/zinc/08/17/99/599081799.db2.gz LVDFAOIELFZIBC-UHFFFAOYSA-N -1 3 366.391 3.687 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N2CCC(C3CCCC3)CC2)n1 ZINC000822723715 599081801 /nfs/dbraw/zinc/08/18/01/599081801.db2.gz LVDFAOIELFZIBC-UHFFFAOYSA-N -1 3 366.391 3.687 20 0 FHADHM CC(C)(C)OC(=O)c1ccc(CNc2ccc(F)cc2-c2nnn[n-]2)cc1 ZINC000819946420 599082633 /nfs/dbraw/zinc/08/26/33/599082633.db2.gz JJAVABZUBAXQDT-UHFFFAOYSA-N -1 3 369.400 3.573 20 0 FHADHM CC(C)(C)OC(=O)c1ccc(CNc2ccc(F)cc2-c2nn[n-]n2)cc1 ZINC000819946420 599082635 /nfs/dbraw/zinc/08/26/35/599082635.db2.gz JJAVABZUBAXQDT-UHFFFAOYSA-N -1 3 369.400 3.573 20 0 FHADHM CN(CCc1cccs1)c1ccc(-c2nn[n-]n2)cc1C(F)(F)F ZINC000821607579 599088225 /nfs/dbraw/zinc/08/82/25/599088225.db2.gz VAQIKKNQUKBMQH-UHFFFAOYSA-N -1 3 353.373 3.626 20 0 FHADHM Cc1cccc2c1ncc(-c1nnn[n-]1)c2N1CCC(C(F)(F)F)CC1 ZINC000822332448 599090694 /nfs/dbraw/zinc/09/06/94/599090694.db2.gz PZIMBNUTEHSHPB-UHFFFAOYSA-N -1 3 362.359 3.502 20 0 FHADHM Cc1cccc2c1ncc(-c1nn[n-]n1)c2N1CCC(C(F)(F)F)CC1 ZINC000822332448 599090697 /nfs/dbraw/zinc/09/06/97/599090697.db2.gz PZIMBNUTEHSHPB-UHFFFAOYSA-N -1 3 362.359 3.502 20 0 FHADHM CC(C)[C@H]1CN(c2c(-c3nnn[n-]3)cnc3ccc(Cl)cc32)CCS1 ZINC000820046621 599097077 /nfs/dbraw/zinc/09/70/77/599097077.db2.gz SSJJZTSSWIVEHD-OAHLLOKOSA-N -1 3 374.901 3.646 20 0 FHADHM CC(C)[C@H]1CN(c2c(-c3nn[n-]n3)cnc3ccc(Cl)cc32)CCS1 ZINC000820046621 599097079 /nfs/dbraw/zinc/09/70/79/599097079.db2.gz SSJJZTSSWIVEHD-OAHLLOKOSA-N -1 3 374.901 3.646 20 0 FHADHM CC(C)(NC(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1)C1CC1 ZINC000735678510 599103483 /nfs/dbraw/zinc/10/34/83/599103483.db2.gz RYWAVPRLUIQRNV-UHFFFAOYSA-N -1 3 362.437 3.529 20 0 FHADHM Cc1cccc([C@H]2CCCN2C(=O)C=Cc2ccccc2-c2nnn[n-]2)c1C ZINC000737389618 599103565 /nfs/dbraw/zinc/10/35/65/599103565.db2.gz LKBMHDWFCJHKAT-GHYICZDASA-N -1 3 373.460 3.860 20 0 FHADHM Cc1cccc([C@H]2CCCN2C(=O)C=Cc2ccccc2-c2nn[n-]n2)c1C ZINC000737389618 599103567 /nfs/dbraw/zinc/10/35/67/599103567.db2.gz LKBMHDWFCJHKAT-GHYICZDASA-N -1 3 373.460 3.860 20 0 FHADHM FC(F)(F)c1csc(CCNc2c(Cl)cccc2-c2nnn[n-]2)n1 ZINC000822728923 599105399 /nfs/dbraw/zinc/10/53/99/599105399.db2.gz NFZUVRLKTFVEEJ-UHFFFAOYSA-N -1 3 374.779 3.650 20 0 FHADHM FC(F)(F)c1csc(CCNc2c(Cl)cccc2-c2nn[n-]n2)n1 ZINC000822728923 599105401 /nfs/dbraw/zinc/10/54/01/599105401.db2.gz NFZUVRLKTFVEEJ-UHFFFAOYSA-N -1 3 374.779 3.650 20 0 FHADHM Cc1ccc([C@@H]2OCCC[C@@H]2CNc2ccc(F)cc2-c2nnn[n-]2)cc1 ZINC000822233076 599108628 /nfs/dbraw/zinc/10/86/28/599108628.db2.gz HPRGOWCWSRLSKX-BEFAXECRSA-N -1 3 367.428 3.894 20 0 FHADHM Cc1ccc([C@@H]2OCCC[C@@H]2CNc2ccc(F)cc2-c2nn[n-]n2)cc1 ZINC000822233076 599108629 /nfs/dbraw/zinc/10/86/29/599108629.db2.gz HPRGOWCWSRLSKX-BEFAXECRSA-N -1 3 367.428 3.894 20 0 FHADHM C[C@@H](Sc1ccccc1-c1nnn[n-]1)C(=O)Nc1cccc(Cl)c1 ZINC000736193337 599109232 /nfs/dbraw/zinc/10/92/32/599109232.db2.gz PBWWECYISPYKJI-SNVBAGLBSA-N -1 3 359.842 3.639 20 0 FHADHM C[C@@H](Sc1ccccc1-c1nn[n-]n1)C(=O)Nc1cccc(Cl)c1 ZINC000736193337 599109234 /nfs/dbraw/zinc/10/92/34/599109234.db2.gz PBWWECYISPYKJI-SNVBAGLBSA-N -1 3 359.842 3.639 20 0 FHADHM CCc1ccc(-c2ccc(C(=O)Nc3cccc(-c4nnn[n-]4)c3)o2)cc1 ZINC000463299604 599132088 /nfs/dbraw/zinc/13/20/88/599132088.db2.gz JYFOMPRAHQPQJK-UHFFFAOYSA-N -1 3 359.389 3.941 20 0 FHADHM CCc1ccc(-c2ccc(C(=O)Nc3cccc(-c4nn[n-]n4)c3)o2)cc1 ZINC000463299604 599132090 /nfs/dbraw/zinc/13/20/90/599132090.db2.gz JYFOMPRAHQPQJK-UHFFFAOYSA-N -1 3 359.389 3.941 20 0 FHADHM CCc1nc(C)c([C@H](C)N(C)Cc2ccc(-c3nnn[n-]3)cc2F)s1 ZINC000736697924 599135067 /nfs/dbraw/zinc/13/50/67/599135067.db2.gz DHUCTZSZSFEFRT-NSHDSACASA-N -1 3 360.462 3.526 20 0 FHADHM CCc1nc(C)c([C@H](C)N(C)Cc2ccc(-c3nn[n-]n3)cc2F)s1 ZINC000736697924 599135069 /nfs/dbraw/zinc/13/50/69/599135069.db2.gz DHUCTZSZSFEFRT-NSHDSACASA-N -1 3 360.462 3.526 20 0 FHADHM CCN(C(=O)c1cccc(F)c1Cl)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821159891 599143321 /nfs/dbraw/zinc/14/33/21/599143321.db2.gz CVDIPESEGLJKRP-LLVKDONJSA-N -1 3 373.819 3.883 20 0 FHADHM CCN(C(=O)c1cccc(F)c1Cl)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821159891 599143324 /nfs/dbraw/zinc/14/33/24/599143324.db2.gz CVDIPESEGLJKRP-LLVKDONJSA-N -1 3 373.819 3.883 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N1C[C@H](c2ccccc2)C[C@@H]1C ZINC000737293068 599146156 /nfs/dbraw/zinc/14/61/56/599146156.db2.gz ZUBZWOVXVQXVCW-WMLDXEAASA-N -1 3 362.437 3.585 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N1C[C@H](c2ccccc2)C[C@@H]1C ZINC000737293068 599146158 /nfs/dbraw/zinc/14/61/58/599146158.db2.gz ZUBZWOVXVQXVCW-WMLDXEAASA-N -1 3 362.437 3.585 20 0 FHADHM Cc1cc2cc(C(=O)Nc3ccc(F)c(-c4nnn[n-]4)c3)oc2cc1C ZINC000822212919 599150994 /nfs/dbraw/zinc/15/09/94/599150994.db2.gz NDDKTLARTKAEFT-UHFFFAOYSA-N -1 3 351.341 3.621 20 0 FHADHM Cc1cc2cc(C(=O)Nc3ccc(F)c(-c4nn[n-]n4)c3)oc2cc1C ZINC000822212919 599150998 /nfs/dbraw/zinc/15/09/98/599150998.db2.gz NDDKTLARTKAEFT-UHFFFAOYSA-N -1 3 351.341 3.621 20 0 FHADHM C[C@H](CC(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1cccc(F)c1 ZINC000735974828 599159651 /nfs/dbraw/zinc/15/96/51/599159651.db2.gz JTENFNHTZCGOQB-SNVBAGLBSA-N -1 3 359.792 3.792 20 0 FHADHM C[C@H](CC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1cccc(F)c1 ZINC000735974828 599159654 /nfs/dbraw/zinc/15/96/54/599159654.db2.gz JTENFNHTZCGOQB-SNVBAGLBSA-N -1 3 359.792 3.792 20 0 FHADHM Cc1ccc([C@@H]2CCC[C@@H]2N(C)C(=O)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000822233027 599161769 /nfs/dbraw/zinc/16/17/69/599161769.db2.gz GMHFPGFLOKURAD-OALUTQOASA-N -1 3 361.449 3.583 20 0 FHADHM Cc1ccc([C@@H]2CCC[C@@H]2N(C)C(=O)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000822233027 599161771 /nfs/dbraw/zinc/16/17/71/599161771.db2.gz GMHFPGFLOKURAD-OALUTQOASA-N -1 3 361.449 3.583 20 0 FHADHM CCO[C@@H](C)c1nc(CSc2ccc(-c3nnn[n-]3)cc2F)cs1 ZINC000736619725 599169625 /nfs/dbraw/zinc/16/96/25/599169625.db2.gz ZCFVYOZUEJGRFS-VIFPVBQESA-N -1 3 365.459 3.852 20 0 FHADHM CCO[C@@H](C)c1nc(CSc2ccc(-c3nn[n-]n3)cc2F)cs1 ZINC000736619725 599169626 /nfs/dbraw/zinc/16/96/26/599169626.db2.gz ZCFVYOZUEJGRFS-VIFPVBQESA-N -1 3 365.459 3.852 20 0 FHADHM CCOc1ccc(C(C)=O)cc1CSc1ccc(-c2nnn[n-]2)cc1F ZINC000736638381 599171337 /nfs/dbraw/zinc/17/13/37/599171337.db2.gz WXQNKJUCXYCBFW-UHFFFAOYSA-N -1 3 372.425 3.899 20 0 FHADHM CCOc1ccc(C(C)=O)cc1CSc1ccc(-c2nn[n-]n2)cc1F ZINC000736638381 599171338 /nfs/dbraw/zinc/17/13/38/599171338.db2.gz WXQNKJUCXYCBFW-UHFFFAOYSA-N -1 3 372.425 3.899 20 0 FHADHM CCCCCC[C@@H](C)NC(=O)CSc1ccc(-c2nnn[n-]2)cc1F ZINC000736448398 599172593 /nfs/dbraw/zinc/17/25/93/599172593.db2.gz YEGGGJYESYLZPX-GFCCVEGCSA-N -1 3 365.478 3.573 20 0 FHADHM CCCCCC[C@@H](C)NC(=O)CSc1ccc(-c2nn[n-]n2)cc1F ZINC000736448398 599172594 /nfs/dbraw/zinc/17/25/94/599172594.db2.gz YEGGGJYESYLZPX-GFCCVEGCSA-N -1 3 365.478 3.573 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)[C@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1 ZINC000460694664 599177251 /nfs/dbraw/zinc/17/72/51/599177251.db2.gz PPAQZTGXTHVQSY-CABCVRRESA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)[C@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1 ZINC000460694664 599177255 /nfs/dbraw/zinc/17/72/55/599177255.db2.gz PPAQZTGXTHVQSY-CABCVRRESA-N -1 3 374.231 3.916 20 0 FHADHM CC(=CC(=O)Nc1ccc(-c2nnn[n-]2)cc1)c1ccccc1C(F)(F)F ZINC000735447089 599177667 /nfs/dbraw/zinc/17/76/67/599177667.db2.gz IQJUOWRYQMUJIT-KHPPLWFESA-N -1 3 373.338 3.928 20 0 FHADHM CC(=CC(=O)Nc1ccc(-c2nn[n-]n2)cc1)c1ccccc1C(F)(F)F ZINC000735447089 599177669 /nfs/dbraw/zinc/17/76/69/599177669.db2.gz IQJUOWRYQMUJIT-KHPPLWFESA-N -1 3 373.338 3.928 20 0 FHADHM O=C(Nc1ccccc1-c1nnn[n-]1)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1 ZINC000738190328 599178538 /nfs/dbraw/zinc/17/85/38/599178538.db2.gz CSUOFBDOTWXAMF-ZIAGYGMSSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1ccccc1-c1nn[n-]n1)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1 ZINC000738190328 599178540 /nfs/dbraw/zinc/17/85/40/599178540.db2.gz CSUOFBDOTWXAMF-ZIAGYGMSSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)[C@@H]1CCSc2ccccc21 ZINC000738146384 599180806 /nfs/dbraw/zinc/18/08/06/599180806.db2.gz XIGFELNJKZDPBB-GFCCVEGCSA-N -1 3 371.853 3.738 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)[C@@H]1CCSc2ccccc21 ZINC000738146384 599180809 /nfs/dbraw/zinc/18/08/09/599180809.db2.gz XIGFELNJKZDPBB-GFCCVEGCSA-N -1 3 371.853 3.738 20 0 FHADHM C[C@@H](C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C)c1cccc(Cl)c1 ZINC000735552344 599183560 /nfs/dbraw/zinc/18/35/60/599183560.db2.gz XTRJQQYFWYMODV-LLVKDONJSA-N -1 3 372.860 3.819 20 0 FHADHM C[C@@H](C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C)c1cccc(Cl)c1 ZINC000735552344 599183563 /nfs/dbraw/zinc/18/35/63/599183563.db2.gz XTRJQQYFWYMODV-LLVKDONJSA-N -1 3 372.860 3.819 20 0 FHADHM Cc1ccncc1C(=O)Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1 ZINC000737442000 599185543 /nfs/dbraw/zinc/18/55/43/599185543.db2.gz DYTHSWXGDXLPBH-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1ccncc1C(=O)Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1 ZINC000737442000 599185545 /nfs/dbraw/zinc/18/55/45/599185545.db2.gz DYTHSWXGDXLPBH-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM CC(C)CCC[C@H](C)N(CCC(C)C)C(=O)c1ccc(-c2nnn[n-]2)cn1 ZINC000820073137 599189546 /nfs/dbraw/zinc/18/95/46/599189546.db2.gz QVIQZINMGURHMM-INIZCTEOSA-N -1 3 372.517 3.965 20 0 FHADHM CC(C)CCC[C@H](C)N(CCC(C)C)C(=O)c1ccc(-c2nn[n-]n2)cn1 ZINC000820073137 599189547 /nfs/dbraw/zinc/18/95/47/599189547.db2.gz QVIQZINMGURHMM-INIZCTEOSA-N -1 3 372.517 3.965 20 0 FHADHM C[C@H](OC(=O)[C@@H]1C[C@@H]1c1c(F)cccc1F)c1cccc(-c2nnn[n-]2)c1 ZINC000736147959 599190176 /nfs/dbraw/zinc/19/01/76/599190176.db2.gz BINYDZLKTZYJDT-LEWSCRJBSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@@H]1C[C@@H]1c1c(F)cccc1F)c1cccc(-c2nn[n-]n2)c1 ZINC000736147959 599190179 /nfs/dbraw/zinc/19/01/79/599190179.db2.gz BINYDZLKTZYJDT-LEWSCRJBSA-N -1 3 370.359 3.553 20 0 FHADHM O=C(NC1CCC1)c1cccc(Oc2ccc(Cl)cc2-c2nnn[n-]2)c1 ZINC000738024544 599203305 /nfs/dbraw/zinc/20/33/05/599203305.db2.gz KMWPZUGWFILMRV-UHFFFAOYSA-N -1 3 369.812 3.595 20 0 FHADHM O=C(NC1CCC1)c1cccc(Oc2ccc(Cl)cc2-c2nn[n-]n2)c1 ZINC000738024544 599203307 /nfs/dbraw/zinc/20/33/07/599203307.db2.gz KMWPZUGWFILMRV-UHFFFAOYSA-N -1 3 369.812 3.595 20 0 FHADHM CC1(C)CCN(C(=O)c2cccc(Oc3ccc(-c4nnn[n-]4)cc3)c2)C1 ZINC000820594803 599203388 /nfs/dbraw/zinc/20/33/88/599203388.db2.gz CMCJPAKSTJDFAD-UHFFFAOYSA-N -1 3 363.421 3.531 20 0 FHADHM CC1(C)CCN(C(=O)c2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)C1 ZINC000820594803 599203390 /nfs/dbraw/zinc/20/33/90/599203390.db2.gz CMCJPAKSTJDFAD-UHFFFAOYSA-N -1 3 363.421 3.531 20 0 FHADHM CC[C@@H](C)N(Cc1ccccc1)C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000736327992 599218693 /nfs/dbraw/zinc/21/86/93/599218693.db2.gz UQMSKKFXCSRFQG-CYBMUJFWSA-N -1 3 368.416 3.838 20 0 FHADHM CC[C@@H](C)N(Cc1ccccc1)C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000736327992 599218695 /nfs/dbraw/zinc/21/86/95/599218695.db2.gz UQMSKKFXCSRFQG-CYBMUJFWSA-N -1 3 368.416 3.838 20 0 FHADHM O=C(Nc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1)C1CCCC1 ZINC000823356858 599220441 /nfs/dbraw/zinc/22/04/41/599220441.db2.gz PHNCBDFZEOBMIL-UHFFFAOYSA-N -1 3 367.384 3.927 20 0 FHADHM O=C(Nc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1)C1CCCC1 ZINC000823356858 599220442 /nfs/dbraw/zinc/22/04/42/599220442.db2.gz PHNCBDFZEOBMIL-UHFFFAOYSA-N -1 3 367.384 3.927 20 0 FHADHM C[C@@H]1CN(C(=O)C=Cc2ccccc2-c2nnn[n-]2)CC[C@H]1c1ccccc1 ZINC000736278837 599222854 /nfs/dbraw/zinc/22/28/54/599222854.db2.gz IVZCXRHRNZZKGZ-GXXWZAHFSA-N -1 3 373.460 3.532 20 0 FHADHM C[C@@H]1CN(C(=O)C=Cc2ccccc2-c2nn[n-]n2)CC[C@H]1c1ccccc1 ZINC000736278837 599222856 /nfs/dbraw/zinc/22/28/56/599222856.db2.gz IVZCXRHRNZZKGZ-GXXWZAHFSA-N -1 3 373.460 3.532 20 0 FHADHM C[C@@H](SCc1nnc(-c2ccccc2)o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820548683 599224591 /nfs/dbraw/zinc/22/45/91/599224591.db2.gz FIDBXUOHARFDRJ-GFCCVEGCSA-N -1 3 364.434 3.911 20 0 FHADHM C[C@@H](SCc1nnc(-c2ccccc2)o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820548683 599224592 /nfs/dbraw/zinc/22/45/92/599224592.db2.gz FIDBXUOHARFDRJ-GFCCVEGCSA-N -1 3 364.434 3.911 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)N[C@@H](CC1CC1)c1ccccc1 ZINC000737795579 599224755 /nfs/dbraw/zinc/22/47/55/599224755.db2.gz ASURKNCXVSFSBG-HYSAVQALSA-N -1 3 359.433 3.538 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)N[C@@H](CC1CC1)c1ccccc1 ZINC000737795579 599224757 /nfs/dbraw/zinc/22/47/57/599224757.db2.gz ASURKNCXVSFSBG-HYSAVQALSA-N -1 3 359.433 3.538 20 0 FHADHM O=C(c1ccccc1-c1ccccc1-c1nnn[n-]1)N1CCC[C@H]2CCC[C@H]21 ZINC000738277889 599225888 /nfs/dbraw/zinc/22/58/88/599225888.db2.gz HAUOPFHGVMWRST-FOIQADDNSA-N -1 3 373.460 3.938 20 0 FHADHM O=C(c1ccccc1-c1ccccc1-c1nn[n-]n1)N1CCC[C@H]2CCC[C@H]21 ZINC000738277889 599225891 /nfs/dbraw/zinc/22/58/91/599225891.db2.gz HAUOPFHGVMWRST-FOIQADDNSA-N -1 3 373.460 3.938 20 0 FHADHM CC[C@H](Cc1ccc(C)cc1)N(CC)C(=O)c1sccc1-c1nnn[n-]1 ZINC000736351273 599232773 /nfs/dbraw/zinc/23/27/73/599232773.db2.gz FCBTYBQFIKQROZ-OAHLLOKOSA-N -1 3 369.494 3.720 20 0 FHADHM CC[C@H](Cc1ccc(C)cc1)N(CC)C(=O)c1sccc1-c1nn[n-]n1 ZINC000736351273 599232774 /nfs/dbraw/zinc/23/27/74/599232774.db2.gz FCBTYBQFIKQROZ-OAHLLOKOSA-N -1 3 369.494 3.720 20 0 FHADHM CCc1cccc(C)c1NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821492107 599236212 /nfs/dbraw/zinc/23/62/12/599236212.db2.gz HIUVVYGZWMDBGO-CYBMUJFWSA-N -1 3 350.426 3.620 20 0 FHADHM CCc1cccc(C)c1NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821492107 599236214 /nfs/dbraw/zinc/23/62/14/599236214.db2.gz HIUVVYGZWMDBGO-CYBMUJFWSA-N -1 3 350.426 3.620 20 0 FHADHM Cc1c(NC(=O)[C@H]2C[C@H]2c2cccc(Cl)c2)cccc1-c1nnn[n-]1 ZINC000822061515 607266919 /nfs/dbraw/zinc/26/69/19/607266919.db2.gz OSQBQYYURPYYRH-GJZGRUSLSA-N -1 3 353.813 3.571 20 0 FHADHM Cc1c(NC(=O)[C@H]2C[C@H]2c2cccc(Cl)c2)cccc1-c1nn[n-]n1 ZINC000822061515 607266920 /nfs/dbraw/zinc/26/69/20/607266920.db2.gz OSQBQYYURPYYRH-GJZGRUSLSA-N -1 3 353.813 3.571 20 0 FHADHM Cc1ccc(C)c(NC(=S)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000822232269 599239720 /nfs/dbraw/zinc/23/97/20/599239720.db2.gz ZGSVJBUGVFDJKO-CYBMUJFWSA-N -1 3 352.467 3.531 20 0 FHADHM Cc1ccc(C)c(NC(=S)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000822232269 599239722 /nfs/dbraw/zinc/23/97/22/599239722.db2.gz ZGSVJBUGVFDJKO-CYBMUJFWSA-N -1 3 352.467 3.531 20 0 FHADHM Cc1cc(CCCC(=O)Nc2cccc(-c3nnn[n-]3)c2C)c(C)s1 ZINC000822200108 607270991 /nfs/dbraw/zinc/27/09/91/607270991.db2.gz UYUVYUHJUHEGLU-UHFFFAOYSA-N -1 3 355.467 3.815 20 0 FHADHM Cc1cc(CCCC(=O)Nc2cccc(-c3nn[n-]n3)c2C)c(C)s1 ZINC000822200108 607270992 /nfs/dbraw/zinc/27/09/92/607270992.db2.gz UYUVYUHJUHEGLU-UHFFFAOYSA-N -1 3 355.467 3.815 20 0 FHADHM Cc1ccc(Cl)cc1NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000822240020 599248435 /nfs/dbraw/zinc/24/84/35/599248435.db2.gz ORQXVWYBYVWXKJ-LLVKDONJSA-N -1 3 356.817 3.711 20 0 FHADHM Cc1ccc(Cl)cc1NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000822240020 599248437 /nfs/dbraw/zinc/24/84/37/599248437.db2.gz ORQXVWYBYVWXKJ-LLVKDONJSA-N -1 3 356.817 3.711 20 0 FHADHM Cc1c(NC(=O)NCc2ccc(-c3ccccc3)o2)cccc1-c1nnn[n-]1 ZINC000822102889 607280879 /nfs/dbraw/zinc/28/08/79/607280879.db2.gz DVRFLEPEMRQWGA-UHFFFAOYSA-N -1 3 374.404 3.757 20 0 FHADHM Cc1c(NC(=O)NCc2ccc(-c3ccccc3)o2)cccc1-c1nn[n-]n1 ZINC000822102889 607280880 /nfs/dbraw/zinc/28/08/80/607280880.db2.gz DVRFLEPEMRQWGA-UHFFFAOYSA-N -1 3 374.404 3.757 20 0 FHADHM CN(Cc1ccc(Cl)cc1)c1c(-c2nnn[n-]2)cnc2ccccc21 ZINC000736817435 599254674 /nfs/dbraw/zinc/25/46/74/599254674.db2.gz YZFINWJEBXNARQ-UHFFFAOYSA-N -1 3 350.813 3.705 20 0 FHADHM CN(Cc1ccc(Cl)cc1)c1c(-c2nn[n-]n2)cnc2ccccc21 ZINC000736817435 599254675 /nfs/dbraw/zinc/25/46/75/599254675.db2.gz YZFINWJEBXNARQ-UHFFFAOYSA-N -1 3 350.813 3.705 20 0 FHADHM Cc1ccc([C@@H](NC(=O)Nc2cccc(-c3nnn[n-]3)c2C)C2CC2)cc1 ZINC000822231024 607289420 /nfs/dbraw/zinc/28/94/20/607289420.db2.gz XXFWGHPILAZKNB-GOSISDBHSA-N -1 3 362.437 3.756 20 0 FHADHM Cc1ccc([C@@H](NC(=O)Nc2cccc(-c3nn[n-]n3)c2C)C2CC2)cc1 ZINC000822231024 607289421 /nfs/dbraw/zinc/28/94/21/607289421.db2.gz XXFWGHPILAZKNB-GOSISDBHSA-N -1 3 362.437 3.756 20 0 FHADHM Cc1cccc([C@H]2CCCCCN2C(=O)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737389698 599261992 /nfs/dbraw/zinc/26/19/92/599261992.db2.gz NMGFQHSXPBUIPS-LJQANCHMSA-N -1 3 361.449 3.933 20 0 FHADHM Cc1cccc([C@H]2CCCCCN2C(=O)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737389698 599261994 /nfs/dbraw/zinc/26/19/94/599261994.db2.gz NMGFQHSXPBUIPS-LJQANCHMSA-N -1 3 361.449 3.933 20 0 FHADHM Cc1ccc(NC(=O)Nc2cccc(-c3nnn[n-]3)c2C)cc1OC(F)F ZINC000822248420 607290228 /nfs/dbraw/zinc/29/02/28/607290228.db2.gz FPLCTXBJQFVLAT-UHFFFAOYSA-N -1 3 374.351 3.729 20 0 FHADHM Cc1ccc(NC(=O)Nc2cccc(-c3nn[n-]n3)c2C)cc1OC(F)F ZINC000822248420 607290229 /nfs/dbraw/zinc/29/02/29/607290229.db2.gz FPLCTXBJQFVLAT-UHFFFAOYSA-N -1 3 374.351 3.729 20 0 FHADHM CCc1ccc([C@@H]2CCCN2C(=O)Nc2cccc(-c3nnn[n-]3)c2C)o1 ZINC000821481756 607292234 /nfs/dbraw/zinc/29/22/34/607292234.db2.gz NFLRNMVEZNZPRE-INIZCTEOSA-N -1 3 366.425 3.700 20 0 FHADHM CCc1ccc([C@@H]2CCCN2C(=O)Nc2cccc(-c3nn[n-]n3)c2C)o1 ZINC000821481756 607292235 /nfs/dbraw/zinc/29/22/35/607292235.db2.gz NFLRNMVEZNZPRE-INIZCTEOSA-N -1 3 366.425 3.700 20 0 FHADHM C[C@H](NC(=O)N1CCC(C2CCCC2)CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820342918 599259657 /nfs/dbraw/zinc/25/96/57/599259657.db2.gz YQVNEWPNXCZADZ-AWEZNQCLSA-N -1 3 368.485 3.540 20 0 FHADHM C[C@H](NC(=O)N1CCC(C2CCCC2)CC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820342918 599259658 /nfs/dbraw/zinc/25/96/58/599259658.db2.gz YQVNEWPNXCZADZ-AWEZNQCLSA-N -1 3 368.485 3.540 20 0 FHADHM Cc1ccc(Br)cc1NCc1ccc(-c2nnn[n-]2)s1 ZINC000822225232 607308293 /nfs/dbraw/zinc/30/82/93/607308293.db2.gz UFAWTGJPYODXGA-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM CC(C)(C)OC(=O)Nc1ccc(NCc2ccc(-c3nnn[n-]3)s2)cc1 ZINC000819946474 607311136 /nfs/dbraw/zinc/31/11/36/607311136.db2.gz LRQOJXZKVIGOAS-UHFFFAOYSA-N -1 3 372.454 3.887 20 0 FHADHM Cc1nc(-c2cccc(NCc3cc(-c4nnn[n-]4)cs3)c2)oc1C ZINC000822419655 607313444 /nfs/dbraw/zinc/31/34/44/607313444.db2.gz RXMSIYWLUZKFOP-UHFFFAOYSA-N -1 3 352.423 3.812 20 0 FHADHM Cc1nc(-c2cccc(NCc3cc(-c4nn[n-]n4)cs3)c2)oc1C ZINC000822419655 607313445 /nfs/dbraw/zinc/31/34/45/607313445.db2.gz RXMSIYWLUZKFOP-UHFFFAOYSA-N -1 3 352.423 3.812 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)C[C@H](C)c1ccccc1 ZINC000736487872 599275503 /nfs/dbraw/zinc/27/55/03/599275503.db2.gz MQPWBIIUAZYJLM-AWEZNQCLSA-N -1 3 364.453 3.821 20 0 FHADHM C[C@@H](NC(=O)Nc1cc(F)ccc1Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000820373945 599276433 /nfs/dbraw/zinc/27/64/33/599276433.db2.gz LUZKDALOMNVPON-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM C[C@@H](NC(=O)Nc1cc(F)ccc1Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000820373945 599276434 /nfs/dbraw/zinc/27/64/34/599276434.db2.gz LUZKDALOMNVPON-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM CCn1c(S[C@H](C)c2ccc(-c3nnn[n-]3)cc2)nnc1-c1ccco1 ZINC000736713692 599286050 /nfs/dbraw/zinc/28/60/50/599286050.db2.gz LMOLAVFLYPVWBP-LLVKDONJSA-N -1 3 367.438 3.591 20 0 FHADHM CCn1c(S[C@H](C)c2ccc(-c3nn[n-]n3)cc2)nnc1-c1ccco1 ZINC000736713692 599286051 /nfs/dbraw/zinc/28/60/51/599286051.db2.gz LMOLAVFLYPVWBP-LLVKDONJSA-N -1 3 367.438 3.591 20 0 FHADHM COc1ccc2[nH]c(S[C@H](C)c3ccc(-c4nn[n-]n4)cc3)nc2c1 ZINC000737120178 599286077 /nfs/dbraw/zinc/28/60/77/599286077.db2.gz LJANQNHEOBIHMD-SNVBAGLBSA-N -1 3 352.423 3.605 20 0 FHADHM C[C@H](Sc1nc2cc(F)c(F)cc2[nH]1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736194048 599289373 /nfs/dbraw/zinc/28/93/73/599289373.db2.gz XIUVVQPEGXVHHV-QMMMGPOBSA-N -1 3 358.377 3.875 20 0 FHADHM C[C@H](Sc1nc2cc(F)c(F)cc2[nH]1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736194048 599289375 /nfs/dbraw/zinc/28/93/75/599289375.db2.gz XIUVVQPEGXVHHV-QMMMGPOBSA-N -1 3 358.377 3.875 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H]2CSc3ccccc32)c1-c1nnn[n-]1 ZINC000736670747 599291938 /nfs/dbraw/zinc/29/19/38/599291938.db2.gz QGMWTKACVDFZIS-GFCCVEGCSA-N -1 3 371.491 3.627 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H]2CSc3ccccc32)c1-c1nn[n-]n1 ZINC000736670747 599291939 /nfs/dbraw/zinc/29/19/39/599291939.db2.gz QGMWTKACVDFZIS-GFCCVEGCSA-N -1 3 371.491 3.627 20 0 FHADHM C[C@@H](Cc1nc2ccccc2s1)Nc1cccc(F)c1-c1nnn[n-]1 ZINC000820307514 607329323 /nfs/dbraw/zinc/32/93/23/607329323.db2.gz MWPBTHCSDQHOEI-JTQLQIEISA-N -1 3 354.414 3.659 20 0 FHADHM C[C@@H](Cc1nc2ccccc2s1)Nc1cccc(F)c1-c1nn[n-]n1 ZINC000820307514 607329324 /nfs/dbraw/zinc/32/93/24/607329324.db2.gz MWPBTHCSDQHOEI-JTQLQIEISA-N -1 3 354.414 3.659 20 0 FHADHM O=C([O-])c1cccc(CNCc2cccc(NC(=O)C3CCCC3)c2)c1 ZINC000263511743 598202683 /nfs/dbraw/zinc/20/26/83/598202683.db2.gz ZAIFSANIRJMION-UHFFFAOYSA-N -1 3 352.434 3.803 20 0 FHADHM CCOc1ccc([C@@H](C)Nc2ccc(-c3nn[n-]n3)cc2F)cc1OCC ZINC000736635986 598234558 /nfs/dbraw/zinc/23/45/58/598234558.db2.gz GFJVQJCLUOOSAB-GFCCVEGCSA-N -1 3 371.416 3.976 20 0 FHADHM CCCOc1ccc([C@@H](C)Nc2ccc(-c3nn[n-]n3)cc2F)cc1OC ZINC000736490418 598239481 /nfs/dbraw/zinc/23/94/81/598239481.db2.gz LKQGUGSYTUMWQB-GFCCVEGCSA-N -1 3 371.416 3.976 20 0 FHADHM CCn1c2ccccc2nc1[C@@H](C)Nc1cccc(F)c1-c1nnn[n-]1 ZINC000736719399 598242984 /nfs/dbraw/zinc/24/29/84/598242984.db2.gz DCYXAHWQETXAJV-LLVKDONJSA-N -1 3 351.389 3.549 20 0 FHADHM CCn1c2ccccc2nc1[C@@H](C)Nc1cccc(F)c1-c1nn[n-]n1 ZINC000736719399 598242986 /nfs/dbraw/zinc/24/29/86/598242986.db2.gz DCYXAHWQETXAJV-LLVKDONJSA-N -1 3 351.389 3.549 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1NCCc1c[nH]c2cc(Cl)ccc12 ZINC000737641956 598243744 /nfs/dbraw/zinc/24/37/44/598243744.db2.gz ZSYIULMGQUJVGP-UHFFFAOYSA-N -1 3 356.792 3.795 20 0 FHADHM CCC[C@@H](NC(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccccn1 ZINC000736431550 598263529 /nfs/dbraw/zinc/26/35/29/598263529.db2.gz MLMJLGLXTRAIBR-OAHLLOKOSA-N -1 3 371.832 3.578 20 0 FHADHM CCC[C@@H](NC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccccn1 ZINC000736431550 598263531 /nfs/dbraw/zinc/26/35/31/598263531.db2.gz MLMJLGLXTRAIBR-OAHLLOKOSA-N -1 3 371.832 3.578 20 0 FHADHM CCN(C(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)C(C)C ZINC000736506282 598267422 /nfs/dbraw/zinc/26/74/22/598267422.db2.gz SJAUBYMQEATVRI-UHFFFAOYSA-N -1 3 366.425 3.921 20 0 FHADHM CCN(C(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)C(C)C ZINC000736506282 598267423 /nfs/dbraw/zinc/26/74/23/598267423.db2.gz SJAUBYMQEATVRI-UHFFFAOYSA-N -1 3 366.425 3.921 20 0 FHADHM FC(F)Oc1ccc(CNc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1 ZINC000737639782 598275711 /nfs/dbraw/zinc/27/57/11/598275711.db2.gz WWVCPKUJBIFKAM-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM FC(F)Oc1ccc(CNc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1 ZINC000737639782 598275712 /nfs/dbraw/zinc/27/57/12/598275712.db2.gz WWVCPKUJBIFKAM-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)C[C@@H](CC)C(C)C ZINC000736629687 598277850 /nfs/dbraw/zinc/27/78/50/598277850.db2.gz ZLXIMHFTUWPRIX-LLVKDONJSA-N -1 3 366.849 3.897 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)C[C@@H](CC)C(C)C ZINC000736629687 598277851 /nfs/dbraw/zinc/27/78/51/598277851.db2.gz ZLXIMHFTUWPRIX-LLVKDONJSA-N -1 3 366.849 3.897 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)NC1(c2ccc(F)cc2)CCCC1 ZINC000738152050 598283207 /nfs/dbraw/zinc/28/32/07/598283207.db2.gz QJFPDTKXFAWMKI-UHFFFAOYSA-N -1 3 366.400 3.597 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)NC1(c2ccc(F)cc2)CCCC1 ZINC000738152050 598283209 /nfs/dbraw/zinc/28/32/09/598283209.db2.gz QJFPDTKXFAWMKI-UHFFFAOYSA-N -1 3 366.400 3.597 20 0 FHADHM C[C@H](NC(=O)N(C)CCC1CCCCC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736110245 598283480 /nfs/dbraw/zinc/28/34/80/598283480.db2.gz GRZNZMZVRLSHNK-AWEZNQCLSA-N -1 3 356.474 3.540 20 0 FHADHM C[C@H](NC(=O)N(C)CCC1CCCCC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736110245 598283481 /nfs/dbraw/zinc/28/34/81/598283481.db2.gz GRZNZMZVRLSHNK-AWEZNQCLSA-N -1 3 356.474 3.540 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1COc1cccc(OCC(F)(F)F)c1 ZINC000737640808 598283803 /nfs/dbraw/zinc/28/38/03/598283803.db2.gz QTQRXESNJROOEC-UHFFFAOYSA-N -1 3 368.290 3.526 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1COc1cccc(OCC(F)(F)F)c1 ZINC000737640808 598283806 /nfs/dbraw/zinc/28/38/06/598283806.db2.gz QTQRXESNJROOEC-UHFFFAOYSA-N -1 3 368.290 3.526 20 0 FHADHM Fc1ccc(COc2cccc(OCC(F)(F)F)c2)c(-c2nnn[n-]2)c1 ZINC000737651310 598283895 /nfs/dbraw/zinc/28/38/95/598283895.db2.gz VSNLJPLCBQMZMB-UHFFFAOYSA-N -1 3 368.290 3.526 20 0 FHADHM Fc1ccc(COc2cccc(OCC(F)(F)F)c2)c(-c2nn[n-]n2)c1 ZINC000737651310 598283896 /nfs/dbraw/zinc/28/38/96/598283896.db2.gz VSNLJPLCBQMZMB-UHFFFAOYSA-N -1 3 368.290 3.526 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N(Cc1cccc(F)c1)C(C)C ZINC000737291783 598292966 /nfs/dbraw/zinc/29/29/66/598292966.db2.gz PWQYOUKNSIQHCU-UHFFFAOYSA-N -1 3 368.416 3.757 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N(Cc1cccc(F)c1)C(C)C ZINC000737291783 598292967 /nfs/dbraw/zinc/29/29/67/598292967.db2.gz PWQYOUKNSIQHCU-UHFFFAOYSA-N -1 3 368.416 3.757 20 0 FHADHM CCCCc1ccc(CC(=O)N(C)c2ccc(-c3nnn[n-]3)cc2F)cc1 ZINC000736466045 598309651 /nfs/dbraw/zinc/30/96/51/598309651.db2.gz IIBPOBOIAWTFAN-UHFFFAOYSA-N -1 3 367.428 3.554 20 0 FHADHM CCCCc1ccc(CC(=O)N(C)c2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000736466045 598309653 /nfs/dbraw/zinc/30/96/53/598309653.db2.gz IIBPOBOIAWTFAN-UHFFFAOYSA-N -1 3 367.428 3.554 20 0 FHADHM Cc1cc(C)c(-c2nnn[n-]2)c(SCc2ccc(OC(C)C)cc2)n1 ZINC000737239315 598315922 /nfs/dbraw/zinc/31/59/22/598315922.db2.gz CKYZXJZNKHPNIE-UHFFFAOYSA-N -1 3 355.467 3.958 20 0 FHADHM Cc1cc(C)c(-c2nn[n-]n2)c(SCc2ccc(OC(C)C)cc2)n1 ZINC000737239315 598315923 /nfs/dbraw/zinc/31/59/23/598315923.db2.gz CKYZXJZNKHPNIE-UHFFFAOYSA-N -1 3 355.467 3.958 20 0 FHADHM Cc1cccc(NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c1C ZINC000737399132 598316102 /nfs/dbraw/zinc/31/61/02/598316102.db2.gz IBDMAHVTXJBHLV-UHFFFAOYSA-N -1 3 358.858 3.946 20 0 FHADHM Cc1cccc(NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c1C ZINC000737399132 598316104 /nfs/dbraw/zinc/31/61/04/598316104.db2.gz IBDMAHVTXJBHLV-UHFFFAOYSA-N -1 3 358.858 3.946 20 0 FHADHM CCc1cccc(NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c1 ZINC000736696825 598317079 /nfs/dbraw/zinc/31/70/79/598317079.db2.gz BGPKMKGEEBRPQN-UHFFFAOYSA-N -1 3 358.858 3.891 20 0 FHADHM CCc1cccc(NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c1 ZINC000736696825 598317080 /nfs/dbraw/zinc/31/70/80/598317080.db2.gz BGPKMKGEEBRPQN-UHFFFAOYSA-N -1 3 358.858 3.891 20 0 FHADHM Fc1ccc(NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1F ZINC000737660280 598317710 /nfs/dbraw/zinc/31/77/10/598317710.db2.gz PPRVGOXFSNFXMZ-UHFFFAOYSA-N -1 3 366.784 3.607 20 0 FHADHM Fc1ccc(NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1F ZINC000737660280 598317712 /nfs/dbraw/zinc/31/77/12/598317712.db2.gz PPRVGOXFSNFXMZ-UHFFFAOYSA-N -1 3 366.784 3.607 20 0 FHADHM C[C@@H]1CCCC[C@@H]1N(C)C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736270262 598318484 /nfs/dbraw/zinc/31/84/84/598318484.db2.gz IUAGKSCDPVHOGB-YGRLFVJLSA-N -1 3 364.906 3.727 20 0 FHADHM C[C@@H]1CCCC[C@@H]1N(C)C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736270262 598318486 /nfs/dbraw/zinc/31/84/86/598318486.db2.gz IUAGKSCDPVHOGB-YGRLFVJLSA-N -1 3 364.906 3.727 20 0 FHADHM S=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)N1CC[C@@H]1c1ccccc1 ZINC000738401812 598321343 /nfs/dbraw/zinc/32/13/43/598321343.db2.gz UNVAKUABDVHUSI-OAHLLOKOSA-N -1 3 370.869 3.664 20 0 FHADHM S=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)N1CC[C@@H]1c1ccccc1 ZINC000738401812 598321345 /nfs/dbraw/zinc/32/13/45/598321345.db2.gz UNVAKUABDVHUSI-OAHLLOKOSA-N -1 3 370.869 3.664 20 0 FHADHM CC(C)N(C(=S)N[C@H](C)c1cccs1)c1cccc(-c2nnn[n-]2)c1 ZINC000736128525 598323749 /nfs/dbraw/zinc/32/37/49/598323749.db2.gz XWZREFAEXPPKCV-GFCCVEGCSA-N -1 3 372.523 3.779 20 0 FHADHM CC(C)N(C(=S)N[C@H](C)c1cccs1)c1cccc(-c2nn[n-]n2)c1 ZINC000736128525 598323750 /nfs/dbraw/zinc/32/37/50/598323750.db2.gz XWZREFAEXPPKCV-GFCCVEGCSA-N -1 3 372.523 3.779 20 0 FHADHM CC[C@H](NC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccccc1 ZINC000736370058 598323943 /nfs/dbraw/zinc/32/39/43/598323943.db2.gz KQAGFPJYUIVCHT-HNNXBMFYSA-N -1 3 372.885 3.958 20 0 FHADHM CC[C@H](NC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccccc1 ZINC000736370058 598323944 /nfs/dbraw/zinc/32/39/44/598323944.db2.gz KQAGFPJYUIVCHT-HNNXBMFYSA-N -1 3 372.885 3.958 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NC(=O)c1ccc(C(F)F)cc1 ZINC000735904773 598327048 /nfs/dbraw/zinc/32/70/48/598327048.db2.gz BEROZARLMVRPAE-UHFFFAOYSA-N -1 3 373.363 3.844 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NC(=O)c1ccc(C(F)F)cc1 ZINC000735904773 598327050 /nfs/dbraw/zinc/32/70/50/598327050.db2.gz BEROZARLMVRPAE-UHFFFAOYSA-N -1 3 373.363 3.844 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)[C@H]1CCCc2sccc21 ZINC000819971226 607350205 /nfs/dbraw/zinc/35/02/05/607350205.db2.gz FOWYIBXKKGHORC-ZDUSSCGKSA-N -1 3 370.482 3.543 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)[C@H]1CCCc2sccc21 ZINC000819971226 607350207 /nfs/dbraw/zinc/35/02/07/607350207.db2.gz FOWYIBXKKGHORC-ZDUSSCGKSA-N -1 3 370.482 3.543 20 0 FHADHM CC[C@@H](Oc1ccccc1C(C)C)C(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000592035467 598358331 /nfs/dbraw/zinc/35/83/31/598358331.db2.gz ZAKIYMVBLUAVPE-QGZVFWFLSA-N -1 3 365.437 3.786 20 0 FHADHM CC[C@@H](Oc1ccccc1C(C)C)C(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000592035467 598358333 /nfs/dbraw/zinc/35/83/33/598358333.db2.gz ZAKIYMVBLUAVPE-QGZVFWFLSA-N -1 3 365.437 3.786 20 0 FHADHM CC[C@H](Oc1ccccc1C(C)C)C(=O)Nc1ccccc1-c1nnn[n-]1 ZINC000736392884 598358793 /nfs/dbraw/zinc/35/87/93/598358793.db2.gz UGAIZARJLAOHIQ-KRWDZBQOSA-N -1 3 365.437 3.786 20 0 FHADHM CC[C@H](Oc1ccccc1C(C)C)C(=O)Nc1ccccc1-c1nn[n-]n1 ZINC000736392884 598358795 /nfs/dbraw/zinc/35/87/95/598358795.db2.gz UGAIZARJLAOHIQ-KRWDZBQOSA-N -1 3 365.437 3.786 20 0 FHADHM CC[C@H](Oc1ccccc1C(C)C)C(=O)Oc1ccc(-c2nnn[n-]2)cc1 ZINC000736391327 598359024 /nfs/dbraw/zinc/35/90/24/598359024.db2.gz MPPZUTLIXWGUKH-KRWDZBQOSA-N -1 3 366.421 3.753 20 0 FHADHM CC[C@H](Oc1ccccc1C(C)C)C(=O)Oc1ccc(-c2nn[n-]n2)cc1 ZINC000736391327 598359026 /nfs/dbraw/zinc/35/90/26/598359026.db2.gz MPPZUTLIXWGUKH-KRWDZBQOSA-N -1 3 366.421 3.753 20 0 FHADHM C[C@H](NC(=O)Cc1ccc(-c2nnn[n-]2)cc1)c1csc2ccccc21 ZINC000736113093 598360016 /nfs/dbraw/zinc/36/00/16/598360016.db2.gz WSOOUMVSHHOVTM-LBPRGKRZSA-N -1 3 363.446 3.501 20 0 FHADHM C[C@H](NC(=O)Cc1ccc(-c2nn[n-]n2)cc1)c1csc2ccccc21 ZINC000736113093 598360018 /nfs/dbraw/zinc/36/00/18/598360018.db2.gz WSOOUMVSHHOVTM-LBPRGKRZSA-N -1 3 363.446 3.501 20 0 FHADHM COc1cc2nc(C)sc2cc1NCc1ccc(-c2nnn[n-]2)cc1F ZINC000737055219 598369861 /nfs/dbraw/zinc/36/98/61/598369861.db2.gz KVABAJIFEGUTDB-UHFFFAOYSA-N -1 3 370.413 3.545 20 0 FHADHM COc1cc2nc(C)sc2cc1NCc1ccc(-c2nn[n-]n2)cc1F ZINC000737055219 598369863 /nfs/dbraw/zinc/36/98/63/598369863.db2.gz KVABAJIFEGUTDB-UHFFFAOYSA-N -1 3 370.413 3.545 20 0 FHADHM CC(C)(C)c1ccc(C=C2N=C(c3ccc(-c4nnn[n-]4)cc3)OC2=O)cc1 ZINC000735649949 598379689 /nfs/dbraw/zinc/37/96/89/598379689.db2.gz MMEAQWCPOMZPIF-ATVHPVEESA-N -1 3 373.416 3.509 20 0 FHADHM CC(C)(C)c1ccc(C=C2N=C(c3ccc(-c4nn[n-]n4)cc3)OC2=O)cc1 ZINC000735649949 598379692 /nfs/dbraw/zinc/37/96/92/598379692.db2.gz MMEAQWCPOMZPIF-ATVHPVEESA-N -1 3 373.416 3.509 20 0 FHADHM Cc1ccccc1Oc1ccccc1CNc1ncccc1-c1nnn[n-]1 ZINC000737431971 598386637 /nfs/dbraw/zinc/38/66/37/598386637.db2.gz OOOBPQGAUHFQOR-UHFFFAOYSA-N -1 3 358.405 3.975 20 0 FHADHM Cc1ccccc1Oc1ccccc1CNc1ncccc1-c1nn[n-]n1 ZINC000737431971 598386638 /nfs/dbraw/zinc/38/66/38/598386638.db2.gz OOOBPQGAUHFQOR-UHFFFAOYSA-N -1 3 358.405 3.975 20 0 FHADHM CC(C)(C)OCc1cccc(CNc2ncc(-c3nnn[n-]3)cc2Cl)c1 ZINC000735639673 598393196 /nfs/dbraw/zinc/39/31/96/598393196.db2.gz MLPOCMSQNBFICD-UHFFFAOYSA-N -1 3 372.860 3.842 20 0 FHADHM CC(C)(C)OCc1cccc(CNc2ncc(-c3nn[n-]n3)cc2Cl)c1 ZINC000735639673 598393198 /nfs/dbraw/zinc/39/31/98/598393198.db2.gz MLPOCMSQNBFICD-UHFFFAOYSA-N -1 3 372.860 3.842 20 0 FHADHM Cc1ccc(F)c(C(=O)N(CC(C)C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737342016 598417219 /nfs/dbraw/zinc/41/72/19/598417219.db2.gz DHWABDKQSBHOJY-UHFFFAOYSA-N -1 3 353.401 3.617 20 0 FHADHM Cc1ccc(F)c(C(=O)N(CC(C)C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737342016 598417220 /nfs/dbraw/zinc/41/72/20/598417220.db2.gz DHWABDKQSBHOJY-UHFFFAOYSA-N -1 3 353.401 3.617 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1sccc1SC ZINC000736480798 598420652 /nfs/dbraw/zinc/42/06/52/598420652.db2.gz NKJCVGLIHMSRNA-UHFFFAOYSA-N -1 3 373.507 3.703 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1sccc1SC ZINC000736480798 598420654 /nfs/dbraw/zinc/42/06/54/598420654.db2.gz NKJCVGLIHMSRNA-UHFFFAOYSA-N -1 3 373.507 3.703 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)c1sccc1SC(F)F ZINC000738165296 598421973 /nfs/dbraw/zinc/42/19/73/598421973.db2.gz IZUROEWCXKBUDJ-UHFFFAOYSA-N -1 3 371.369 3.634 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)c1sccc1SC(F)F ZINC000738165296 598421975 /nfs/dbraw/zinc/42/19/75/598421975.db2.gz IZUROEWCXKBUDJ-UHFFFAOYSA-N -1 3 371.369 3.634 20 0 FHADHM Cc1ccc(NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)cc1C ZINC000737357407 598426693 /nfs/dbraw/zinc/42/66/93/598426693.db2.gz PWNKYDUQLHZRSV-UHFFFAOYSA-N -1 3 364.453 3.926 20 0 FHADHM Cc1ccc(NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)cc1C ZINC000737357407 598426695 /nfs/dbraw/zinc/42/66/95/598426695.db2.gz PWNKYDUQLHZRSV-UHFFFAOYSA-N -1 3 364.453 3.926 20 0 FHADHM Cc1cc(C)cc(NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)c1 ZINC000737250879 598426850 /nfs/dbraw/zinc/42/68/50/598426850.db2.gz QBFBMKAQPSOGOG-UHFFFAOYSA-N -1 3 364.453 3.926 20 0 FHADHM Cc1cc(C)cc(NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)c1 ZINC000737250879 598426852 /nfs/dbraw/zinc/42/68/52/598426852.db2.gz QBFBMKAQPSOGOG-UHFFFAOYSA-N -1 3 364.453 3.926 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)[C@@H]1C[C@H]1c1cccc2ccccc21 ZINC000107542733 598435382 /nfs/dbraw/zinc/43/53/82/598435382.db2.gz FKHVVGCUUVTSIL-RBUKOAKNSA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)[C@@H]1C[C@H]1c1cccc2ccccc21 ZINC000107542733 598435383 /nfs/dbraw/zinc/43/53/83/598435383.db2.gz FKHVVGCUUVTSIL-RBUKOAKNSA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)[C@H]1C[C@H]1c1cccc2ccccc21 ZINC000107583945 598435449 /nfs/dbraw/zinc/43/54/49/598435449.db2.gz JRIDAOCVIGCARV-OALUTQOASA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)[C@H]1C[C@H]1c1cccc2ccccc21 ZINC000107583945 598435450 /nfs/dbraw/zinc/43/54/50/598435450.db2.gz JRIDAOCVIGCARV-OALUTQOASA-N -1 3 355.401 3.762 20 0 FHADHM C[C@H]1C[C@@H](CC(=O)N(C)Cc2cccc(-c3nnn[n-]3)c2)CC(C)(C)C1 ZINC000736227579 598442490 /nfs/dbraw/zinc/44/24/90/598442490.db2.gz LNKATRZDDZPTAD-HOCLYGCPSA-N -1 3 355.486 3.678 20 0 FHADHM C[C@H]1C[C@@H](CC(=O)N(C)Cc2cccc(-c3nn[n-]n3)c2)CC(C)(C)C1 ZINC000736227579 598442491 /nfs/dbraw/zinc/44/24/91/598442491.db2.gz LNKATRZDDZPTAD-HOCLYGCPSA-N -1 3 355.486 3.678 20 0 FHADHM CC(=CC(=O)N(C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1Cl ZINC000735448911 598443689 /nfs/dbraw/zinc/44/36/89/598443689.db2.gz MTCZZQRVODIIRC-BENRWUELSA-N -1 3 353.813 3.586 20 0 FHADHM CC(=CC(=O)N(C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1Cl ZINC000735448911 598443692 /nfs/dbraw/zinc/44/36/92/598443692.db2.gz MTCZZQRVODIIRC-BENRWUELSA-N -1 3 353.813 3.586 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)C=C(C)c1ccccc1Cl ZINC000737058442 598444866 /nfs/dbraw/zinc/44/48/66/598444866.db2.gz LRWCGTLQKAQJSG-PKNBQFBNSA-N -1 3 369.812 3.571 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)C=C(C)c1ccccc1Cl ZINC000737058442 598444868 /nfs/dbraw/zinc/44/48/68/598444868.db2.gz LRWCGTLQKAQJSG-PKNBQFBNSA-N -1 3 369.812 3.571 20 0 FHADHM Cc1cccc(C)c1NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000737388026 598475131 /nfs/dbraw/zinc/47/51/31/598475131.db2.gz ACIGLGJMYLWGGH-UHFFFAOYSA-N -1 3 362.437 3.680 20 0 FHADHM Cc1cccc(C)c1NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000737388026 598475133 /nfs/dbraw/zinc/47/51/33/598475133.db2.gz ACIGLGJMYLWGGH-UHFFFAOYSA-N -1 3 362.437 3.680 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)NC(C)(C)CCc1ccccc1 ZINC000737293047 598476945 /nfs/dbraw/zinc/47/69/45/598476945.db2.gz YYXALXHUBRPUJH-UHFFFAOYSA-N -1 3 364.453 3.708 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)NC(C)(C)CCc1ccccc1 ZINC000737293047 598476946 /nfs/dbraw/zinc/47/69/46/598476946.db2.gz YYXALXHUBRPUJH-UHFFFAOYSA-N -1 3 364.453 3.708 20 0 FHADHM C[C@H](OC(=O)c1csc(C(C)(C)C)n1)c1cccc(-c2nnn[n-]2)c1 ZINC000736163081 598483205 /nfs/dbraw/zinc/48/32/05/598483205.db2.gz LWYXKQHLJVBEIP-JTQLQIEISA-N -1 3 357.439 3.539 20 0 FHADHM C[C@H](OC(=O)c1csc(C(C)(C)C)n1)c1cccc(-c2nn[n-]n2)c1 ZINC000736163081 598483206 /nfs/dbraw/zinc/48/32/06/598483206.db2.gz LWYXKQHLJVBEIP-JTQLQIEISA-N -1 3 357.439 3.539 20 0 FHADHM Cc1ccc(Cl)c(OCC(=O)O[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000737341937 598492303 /nfs/dbraw/zinc/49/23/03/598492303.db2.gz BSSMTPFYPNQHQT-GFCCVEGCSA-N -1 3 372.812 3.512 20 0 FHADHM Cc1ccc(Cl)c(OCC(=O)O[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000737341937 598492304 /nfs/dbraw/zinc/49/23/04/598492304.db2.gz BSSMTPFYPNQHQT-GFCCVEGCSA-N -1 3 372.812 3.512 20 0 FHADHM Cc1sc(NC(=O)c2csc(-c3ccoc3)n2)c(-c2nnn[n-]2)c1C ZINC000737560882 598493520 /nfs/dbraw/zinc/49/35/20/598493520.db2.gz DNQFEVGLWBUNLX-UHFFFAOYSA-N -1 3 372.435 3.514 20 0 FHADHM Cc1sc(NC(=O)c2csc(-c3ccoc3)n2)c(-c2nn[n-]n2)c1C ZINC000737560882 598493522 /nfs/dbraw/zinc/49/35/22/598493522.db2.gz DNQFEVGLWBUNLX-UHFFFAOYSA-N -1 3 372.435 3.514 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@H]1NC(=S)Nc1ccccc1-c1nnn[n-]1 ZINC000735796792 598513086 /nfs/dbraw/zinc/51/30/86/598513086.db2.gz IISRYOZEXBAYAA-DZGCQCFKSA-N -1 3 358.515 3.758 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@H]1NC(=S)Nc1ccccc1-c1nn[n-]n1 ZINC000735796792 598513088 /nfs/dbraw/zinc/51/30/88/598513088.db2.gz IISRYOZEXBAYAA-DZGCQCFKSA-N -1 3 358.515 3.758 20 0 FHADHM CCS[C@H](C(=O)Nc1sc(C)c(CC)c1-c1nnn[n-]1)C(C)C ZINC000736664050 598514199 /nfs/dbraw/zinc/51/41/99/598514199.db2.gz HSJOESWYYSUGDV-LBPRGKRZSA-N -1 3 353.517 3.515 20 0 FHADHM CCS[C@H](C(=O)Nc1sc(C)c(CC)c1-c1nn[n-]n1)C(C)C ZINC000736664050 598514200 /nfs/dbraw/zinc/51/42/00/598514200.db2.gz HSJOESWYYSUGDV-LBPRGKRZSA-N -1 3 353.517 3.515 20 0 FHADHM CCSc1cc(C(=O)Nc2sc(C)c(CC)c2-c2nnn[n-]2)ccn1 ZINC000736667953 598514938 /nfs/dbraw/zinc/51/49/38/598514938.db2.gz UXHKMULUUHKDQD-UHFFFAOYSA-N -1 3 374.495 3.558 20 0 FHADHM CCSc1cc(C(=O)Nc2sc(C)c(CC)c2-c2nn[n-]n2)ccn1 ZINC000736667953 598514940 /nfs/dbraw/zinc/51/49/40/598514940.db2.gz UXHKMULUUHKDQD-UHFFFAOYSA-N -1 3 374.495 3.558 20 0 FHADHM CCc1c(C)sc(NC(=O)C=C(C)c2ccc(F)cc2)c1-c1nnn[n-]1 ZINC000736669306 598515119 /nfs/dbraw/zinc/51/51/19/598515119.db2.gz CWSPSMKWRDCKHE-MDZDMXLPSA-N -1 3 371.441 3.980 20 0 FHADHM CCc1c(C)sc(NC(=O)C=C(C)c2ccc(F)cc2)c1-c1nn[n-]n1 ZINC000736669306 598515121 /nfs/dbraw/zinc/51/51/21/598515121.db2.gz CWSPSMKWRDCKHE-MDZDMXLPSA-N -1 3 371.441 3.980 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccnc3ccccc32)c1-c1nnn[n-]1 ZINC000736674177 598516712 /nfs/dbraw/zinc/51/67/12/598516712.db2.gz AKVODYJGSVJJMW-UHFFFAOYSA-N -1 3 364.434 3.600 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccnc3ccccc32)c1-c1nn[n-]n1 ZINC000736674177 598516713 /nfs/dbraw/zinc/51/67/13/598516713.db2.gz AKVODYJGSVJJMW-UHFFFAOYSA-N -1 3 364.434 3.600 20 0 FHADHM CCCC[C@@H]1CCC[C@@H]1NC(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000736441746 598519830 /nfs/dbraw/zinc/51/98/30/598519830.db2.gz UEOUPACUCMLZLD-WBVHZDCISA-N -1 3 373.526 3.575 20 0 FHADHM CCCC[C@@H]1CCC[C@@H]1NC(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000736441746 598519831 /nfs/dbraw/zinc/51/98/31/598519831.db2.gz UEOUPACUCMLZLD-WBVHZDCISA-N -1 3 373.526 3.575 20 0 FHADHM CCCC[C@@H]1CCC[C@H]1NC(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736442260 598528447 /nfs/dbraw/zinc/52/84/47/598528447.db2.gz WDYXBRAXRRWGPY-FRFSOERESA-N -1 3 356.474 3.586 20 0 FHADHM CCCC[C@@H]1CCC[C@H]1NC(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736442260 598528449 /nfs/dbraw/zinc/52/84/49/598528449.db2.gz WDYXBRAXRRWGPY-FRFSOERESA-N -1 3 356.474 3.586 20 0 FHADHM CCCC[C@@H]1CCC[C@H]1NC(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736442278 598528632 /nfs/dbraw/zinc/52/86/32/598528632.db2.gz WDYXBRAXRRWGPY-YSVLISHTSA-N -1 3 356.474 3.586 20 0 FHADHM CCCC[C@@H]1CCC[C@H]1NC(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736442278 598528633 /nfs/dbraw/zinc/52/86/33/598528633.db2.gz WDYXBRAXRRWGPY-YSVLISHTSA-N -1 3 356.474 3.586 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)[C@@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000108710227 598532608 /nfs/dbraw/zinc/53/26/08/598532608.db2.gz MJFWMUZGRPGURZ-RBUKOAKNSA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)[C@@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000108710227 598532610 /nfs/dbraw/zinc/53/26/10/598532610.db2.gz MJFWMUZGRPGURZ-RBUKOAKNSA-N -1 3 355.401 3.762 20 0 FHADHM CN(C(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1)c1cccc(-c2nnn[n-]2)c1 ZINC000736733485 598533348 /nfs/dbraw/zinc/53/33/48/598533348.db2.gz VXWDQFUYCTZNNZ-WOJBJXKFSA-N -1 3 369.428 3.786 20 0 FHADHM CN(C(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1)c1cccc(-c2nn[n-]n2)c1 ZINC000736733485 598533350 /nfs/dbraw/zinc/53/33/50/598533350.db2.gz VXWDQFUYCTZNNZ-WOJBJXKFSA-N -1 3 369.428 3.786 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)c1cccc(OC2CCCC2)c1 ZINC000738165304 598534038 /nfs/dbraw/zinc/53/40/38/598534038.db2.gz BOLAGGHQOJCNGD-UHFFFAOYSA-N -1 3 367.384 3.580 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)c1cccc(OC2CCCC2)c1 ZINC000738165304 598534040 /nfs/dbraw/zinc/53/40/40/598534040.db2.gz BOLAGGHQOJCNGD-UHFFFAOYSA-N -1 3 367.384 3.580 20 0 FHADHM CC=CC=CC(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736301649 598543296 /nfs/dbraw/zinc/54/32/96/598543296.db2.gz BTWYQNACUPDMSX-CRBCFSCISA-N -1 3 361.405 3.517 20 0 FHADHM CC=CC=CC(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736301649 598543298 /nfs/dbraw/zinc/54/32/98/598543298.db2.gz BTWYQNACUPDMSX-CRBCFSCISA-N -1 3 361.405 3.517 20 0 FHADHM Fc1cc(OCc2ccc(Cl)c3cccnc23)ccc1-c1nnn[n-]1 ZINC000737648724 598547883 /nfs/dbraw/zinc/54/78/83/598547883.db2.gz BMOZMODMGURZAJ-UHFFFAOYSA-N -1 3 355.760 3.786 20 0 FHADHM Fc1cc(OCc2ccc(Cl)c3cccnc23)ccc1-c1nn[n-]n1 ZINC000737648724 598547884 /nfs/dbraw/zinc/54/78/84/598547884.db2.gz BMOZMODMGURZAJ-UHFFFAOYSA-N -1 3 355.760 3.786 20 0 FHADHM Fc1cc(OCc2cc(Cl)cc3cccnc32)ccc1-c1nnn[n-]1 ZINC000737654051 598548237 /nfs/dbraw/zinc/54/82/37/598548237.db2.gz XPDSCCNCMDEMQO-UHFFFAOYSA-N -1 3 355.760 3.786 20 0 FHADHM Fc1cc(OCc2cc(Cl)cc3cccnc32)ccc1-c1nn[n-]n1 ZINC000737654051 598548238 /nfs/dbraw/zinc/54/82/38/598548238.db2.gz XPDSCCNCMDEMQO-UHFFFAOYSA-N -1 3 355.760 3.786 20 0 FHADHM Cc1oc(-c2cccs2)nc1COc1ccc(-c2nnn[n-]2)c(F)c1 ZINC000737548640 598552116 /nfs/dbraw/zinc/55/21/16/598552116.db2.gz PSRSKHJQNJZPNU-UHFFFAOYSA-N -1 3 357.370 3.610 20 0 FHADHM Cc1oc(-c2cccs2)nc1COc1ccc(-c2nn[n-]n2)c(F)c1 ZINC000737548640 598552117 /nfs/dbraw/zinc/55/21/17/598552117.db2.gz PSRSKHJQNJZPNU-UHFFFAOYSA-N -1 3 357.370 3.610 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@H](C)c1ccccc1F ZINC000736481190 598552929 /nfs/dbraw/zinc/55/29/29/598552929.db2.gz WBKBFPSTFOCIAA-CQSZACIVSA-N -1 3 367.428 3.548 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@H](C)c1ccccc1F ZINC000736481190 598552930 /nfs/dbraw/zinc/55/29/30/598552930.db2.gz WBKBFPSTFOCIAA-CQSZACIVSA-N -1 3 367.428 3.548 20 0 FHADHM Fc1ccc(Cn2ccc(-c3ccc(-c4nnn[n-]4)cc3)n2)c(Cl)c1 ZINC000737660173 598568078 /nfs/dbraw/zinc/56/80/78/598568078.db2.gz OFZCUSBXLHMBQS-UHFFFAOYSA-N -1 3 354.776 3.571 20 0 FHADHM Fc1ccc(Cn2ccc(-c3ccc(-c4nn[n-]n4)cc3)n2)c(Cl)c1 ZINC000737660173 598568079 /nfs/dbraw/zinc/56/80/79/598568079.db2.gz OFZCUSBXLHMBQS-UHFFFAOYSA-N -1 3 354.776 3.571 20 0 FHADHM O=C(CCC(=O)c1ccc2ccccc2c1)Nc1cccc(-c2nnn[n-]2)c1 ZINC000514983588 598569292 /nfs/dbraw/zinc/56/92/92/598569292.db2.gz XDNIYYVFGYZELZ-UHFFFAOYSA-N -1 3 371.400 3.622 20 0 FHADHM O=C(CCC(=O)c1ccc2ccccc2c1)Nc1cccc(-c2nn[n-]n2)c1 ZINC000514983588 598569295 /nfs/dbraw/zinc/56/92/95/598569295.db2.gz XDNIYYVFGYZELZ-UHFFFAOYSA-N -1 3 371.400 3.622 20 0 FHADHM CC(C)Oc1ccc(Cl)cc1C(=O)Nc1ccccc1-c1nnn[n-]1 ZINC000735913360 598571958 /nfs/dbraw/zinc/57/19/58/598571958.db2.gz BNBIJXCIHJDPES-UHFFFAOYSA-N -1 3 357.801 3.560 20 0 FHADHM CC(C)Oc1ccc(Cl)cc1C(=O)Nc1ccccc1-c1nn[n-]n1 ZINC000735913360 598571959 /nfs/dbraw/zinc/57/19/59/598571959.db2.gz BNBIJXCIHJDPES-UHFFFAOYSA-N -1 3 357.801 3.560 20 0 FHADHM O=C(Nc1ccccc1-c1nnn[n-]1)[C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000738192831 598572610 /nfs/dbraw/zinc/57/26/10/598572610.db2.gz XIIBVXKUVUMIHP-VXGBXAGGSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1ccccc1-c1nn[n-]n1)[C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000738192831 598572611 /nfs/dbraw/zinc/57/26/11/598572611.db2.gz XIIBVXKUVUMIHP-VXGBXAGGSA-N -1 3 374.231 3.916 20 0 FHADHM Fc1ccccc1-c1nc(COc2cccc(-c3nnn[n-]3)c2)cs1 ZINC000737664862 598581225 /nfs/dbraw/zinc/58/12/25/598581225.db2.gz PMZOCEKPWSEHML-UHFFFAOYSA-N -1 3 353.382 3.708 20 0 FHADHM Fc1ccccc1-c1nc(COc2cccc(-c3nn[n-]n3)c2)cs1 ZINC000737664862 598581226 /nfs/dbraw/zinc/58/12/26/598581226.db2.gz PMZOCEKPWSEHML-UHFFFAOYSA-N -1 3 353.382 3.708 20 0 FHADHM CCCC[C@@H](CC)CNC(=S)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000736436200 598582041 /nfs/dbraw/zinc/58/20/41/598582041.db2.gz BFFNQFZHRCSUCS-LLVKDONJSA-N -1 3 350.467 3.509 20 0 FHADHM CCCC[C@@H](CC)CNC(=S)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000736436200 598582042 /nfs/dbraw/zinc/58/20/42/598582042.db2.gz BFFNQFZHRCSUCS-LLVKDONJSA-N -1 3 350.467 3.509 20 0 FHADHM CC[C@@H](OC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1ccc(OC)cc1 ZINC000736379794 598584761 /nfs/dbraw/zinc/58/47/61/598584761.db2.gz DMYQKFKEPSNHNW-ADYSOMBNSA-N -1 3 364.405 3.583 20 0 FHADHM CC[C@@H](OC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1ccc(OC)cc1 ZINC000736379794 598584763 /nfs/dbraw/zinc/58/47/63/598584763.db2.gz DMYQKFKEPSNHNW-ADYSOMBNSA-N -1 3 364.405 3.583 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)ccc1OCc1ccc(SC)c(OC)c1 ZINC000736628780 598584965 /nfs/dbraw/zinc/58/49/65/598584965.db2.gz XAWSHVNQWBXSFY-UHFFFAOYSA-N -1 3 372.450 3.575 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)ccc1OCc1ccc(SC)c(OC)c1 ZINC000736628780 598584967 /nfs/dbraw/zinc/58/49/67/598584967.db2.gz XAWSHVNQWBXSFY-UHFFFAOYSA-N -1 3 372.450 3.575 20 0 FHADHM CC[C@H](C)[C@@H](C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccccc1 ZINC000736335680 598590471 /nfs/dbraw/zinc/59/04/71/598590471.db2.gz ZKPPYQNMVPFDOU-YVEFUNNKSA-N -1 3 353.401 3.774 20 0 FHADHM CC[C@H](C)[C@@H](C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccccc1 ZINC000736335680 598590473 /nfs/dbraw/zinc/59/04/73/598590473.db2.gz ZKPPYQNMVPFDOU-YVEFUNNKSA-N -1 3 353.401 3.774 20 0 FHADHM O=C(Cc1ccc(-c2ccccc2)cc1)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000737953804 598592637 /nfs/dbraw/zinc/59/26/37/598592637.db2.gz BPXBWBXRUHIXDC-UHFFFAOYSA-N -1 3 373.391 3.854 20 0 FHADHM O=C(Cc1ccc(-c2ccccc2)cc1)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000737953804 598592639 /nfs/dbraw/zinc/59/26/39/598592639.db2.gz BPXBWBXRUHIXDC-UHFFFAOYSA-N -1 3 373.391 3.854 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1N[C@@H](c1ccccc1)c1ccccn1 ZINC000737558930 598592711 /nfs/dbraw/zinc/59/27/11/598592711.db2.gz SBTOSPHMXIBKTG-INIZCTEOSA-N -1 3 363.812 3.512 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1N[C@@H](c1ccccc1)c1ccccn1 ZINC000737558930 598592712 /nfs/dbraw/zinc/59/27/12/598592712.db2.gz SBTOSPHMXIBKTG-INIZCTEOSA-N -1 3 363.812 3.512 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1NCC1(Sc2ccccc2)CC1 ZINC000737558664 598594135 /nfs/dbraw/zinc/59/41/35/598594135.db2.gz PXSPRXGJZBWDRX-UHFFFAOYSA-N -1 3 358.858 3.652 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1NCC1(Sc2ccccc2)CC1 ZINC000737558664 598594136 /nfs/dbraw/zinc/59/41/36/598594136.db2.gz PXSPRXGJZBWDRX-UHFFFAOYSA-N -1 3 358.858 3.652 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)c1cc2c(ccc3ccccc23)[nH]1 ZINC000738168283 598601602 /nfs/dbraw/zinc/60/16/02/598601602.db2.gz YCNXCTNLQGJYPY-UHFFFAOYSA-N -1 3 372.363 3.893 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)c1cc2c(ccc3ccccc23)[nH]1 ZINC000738168283 598601604 /nfs/dbraw/zinc/60/16/04/598601604.db2.gz YCNXCTNLQGJYPY-UHFFFAOYSA-N -1 3 372.363 3.893 20 0 FHADHM C[C@H](Oc1ccccc1-c1nnn[n-]1)c1nc(-c2ccc(Cl)cc2)no1 ZINC000736190571 598608507 /nfs/dbraw/zinc/60/85/07/598608507.db2.gz WHZQFXWINBRJNH-JTQLQIEISA-N -1 3 368.784 3.710 20 0 FHADHM C[C@H](Oc1ccccc1-c1nn[n-]n1)c1nc(-c2ccc(Cl)cc2)no1 ZINC000736190571 598608508 /nfs/dbraw/zinc/60/85/08/598608508.db2.gz WHZQFXWINBRJNH-JTQLQIEISA-N -1 3 368.784 3.710 20 0 FHADHM CCC[C@@H]1CCCC[C@H]1NC(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736435457 598617382 /nfs/dbraw/zinc/61/73/82/598617382.db2.gz LTKYZUIUXOQLDR-YSVLISHTSA-N -1 3 356.474 3.586 20 0 FHADHM CCC[C@@H]1CCCC[C@H]1NC(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736435457 598617384 /nfs/dbraw/zinc/61/73/84/598617384.db2.gz LTKYZUIUXOQLDR-YSVLISHTSA-N -1 3 356.474 3.586 20 0 FHADHM CC1(C)CN(C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)[C@@H]1c1ccccc1 ZINC000736212617 598624263 /nfs/dbraw/zinc/62/42/63/598624263.db2.gz BSSCAXDLVGBORK-MRXNPFEDSA-N -1 3 366.400 3.621 20 0 FHADHM CC1(C)CN(C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)[C@@H]1c1ccccc1 ZINC000736212617 598624266 /nfs/dbraw/zinc/62/42/66/598624266.db2.gz BSSCAXDLVGBORK-MRXNPFEDSA-N -1 3 366.400 3.621 20 0 FHADHM C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000736202307 598624270 /nfs/dbraw/zinc/62/42/70/598624270.db2.gz ZVZYUXJOSFLJNQ-JTQLQIEISA-N -1 3 374.807 3.884 20 0 FHADHM C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000736202307 598624272 /nfs/dbraw/zinc/62/42/72/598624272.db2.gz ZVZYUXJOSFLJNQ-JTQLQIEISA-N -1 3 374.807 3.884 20 0 FHADHM CC[C@@H](NC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccc(C)cc1 ZINC000736360270 598624576 /nfs/dbraw/zinc/62/45/76/598624576.db2.gz AYOHKSSGHUCLEP-MRXNPFEDSA-N -1 3 354.389 3.587 20 0 FHADHM CC[C@@H](NC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccc(C)cc1 ZINC000736360270 598624578 /nfs/dbraw/zinc/62/45/78/598624578.db2.gz AYOHKSSGHUCLEP-MRXNPFEDSA-N -1 3 354.389 3.587 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)N1CCC[C@@H]1C1CCCCC1 ZINC000738164048 598630195 /nfs/dbraw/zinc/63/01/95/598630195.db2.gz WUBAERUKHGWARK-MRXNPFEDSA-N -1 3 358.421 3.582 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)N1CCC[C@@H]1C1CCCCC1 ZINC000738164048 598630197 /nfs/dbraw/zinc/63/01/97/598630197.db2.gz WUBAERUKHGWARK-MRXNPFEDSA-N -1 3 358.421 3.582 20 0 FHADHM CC[C@@H](NC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccc(Cl)cc1 ZINC000736363220 598630526 /nfs/dbraw/zinc/63/05/26/598630526.db2.gz MVYSPBSVSIPCAE-OAHLLOKOSA-N -1 3 374.807 3.932 20 0 FHADHM CC[C@@H](NC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccc(Cl)cc1 ZINC000736363220 598630528 /nfs/dbraw/zinc/63/05/28/598630528.db2.gz MVYSPBSVSIPCAE-OAHLLOKOSA-N -1 3 374.807 3.932 20 0 FHADHM CC(C)[C@H](NC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccccc1 ZINC000735722623 598632119 /nfs/dbraw/zinc/63/21/19/598632119.db2.gz VLKIWAIZVCJXRG-INIZCTEOSA-N -1 3 354.389 3.525 20 0 FHADHM CC(C)[C@H](NC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccccc1 ZINC000735722623 598632122 /nfs/dbraw/zinc/63/21/22/598632122.db2.gz VLKIWAIZVCJXRG-INIZCTEOSA-N -1 3 354.389 3.525 20 0 FHADHM O=C(c1ccccc1)C1CCN(c2ccc(-c3nnn[n-]3)c(Cl)c2)CC1 ZINC000738277333 598638207 /nfs/dbraw/zinc/63/82/07/598638207.db2.gz BNFSQCPQIVCELP-UHFFFAOYSA-N -1 3 367.840 3.619 20 0 FHADHM O=C(c1ccccc1)C1CCN(c2ccc(-c3nn[n-]n3)c(Cl)c2)CC1 ZINC000738277333 598638209 /nfs/dbraw/zinc/63/82/09/598638209.db2.gz BNFSQCPQIVCELP-UHFFFAOYSA-N -1 3 367.840 3.619 20 0 FHADHM CCOc1ccc2[nH]c(SCc3ccc(F)cc3-c3nn[n-]n3)nc2c1 ZINC000736652308 598642357 /nfs/dbraw/zinc/64/23/57/598642357.db2.gz XAAOQITWGQUOOI-UHFFFAOYSA-N -1 3 370.413 3.573 20 0 FHADHM O=C(CCSCCCc1ccccc1)Nc1cccc(-c2nnn[n-]2)c1 ZINC000737850393 598644345 /nfs/dbraw/zinc/64/43/45/598644345.db2.gz WOBWFFUPATVPSL-UHFFFAOYSA-N -1 3 367.478 3.561 20 0 FHADHM O=C(CCSCCCc1ccccc1)Nc1cccc(-c2nn[n-]n2)c1 ZINC000737850393 598644346 /nfs/dbraw/zinc/64/43/46/598644346.db2.gz WOBWFFUPATVPSL-UHFFFAOYSA-N -1 3 367.478 3.561 20 0 FHADHM O=C(C[C@H](c1ccccc1)C(F)(F)F)Nc1cccc(-c2nnn[n-]2)c1 ZINC000103065626 598646874 /nfs/dbraw/zinc/64/68/74/598646874.db2.gz HEEYYERNZGKNQM-CQSZACIVSA-N -1 3 361.327 3.541 20 0 FHADHM O=C(C[C@H](c1ccccc1)C(F)(F)F)Nc1cccc(-c2nn[n-]n2)c1 ZINC000103065626 598646876 /nfs/dbraw/zinc/64/68/76/598646876.db2.gz HEEYYERNZGKNQM-CQSZACIVSA-N -1 3 361.327 3.541 20 0 FHADHM CC(C)c1ccc(NC(=O)CSc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000735928109 598647582 /nfs/dbraw/zinc/64/75/82/598647582.db2.gz FPNKDDBVYBZTRG-UHFFFAOYSA-N -1 3 353.451 3.721 20 0 FHADHM CC(C)c1ccc(NC(=O)CSc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000735928109 598647583 /nfs/dbraw/zinc/64/75/83/598647583.db2.gz FPNKDDBVYBZTRG-UHFFFAOYSA-N -1 3 353.451 3.721 20 0 FHADHM CCC[C@H](NC(=O)CSc1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000736430483 598648565 /nfs/dbraw/zinc/64/85/65/598648565.db2.gz MMNIFVXHEAOXCA-KRWDZBQOSA-N -1 3 367.478 3.616 20 0 FHADHM CCC[C@H](NC(=O)CSc1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000736430483 598648567 /nfs/dbraw/zinc/64/85/67/598648567.db2.gz MMNIFVXHEAOXCA-KRWDZBQOSA-N -1 3 367.478 3.616 20 0 FHADHM COc1ccccc1[C@@H](C)CC(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000737142736 598649118 /nfs/dbraw/zinc/64/91/18/598649118.db2.gz PHVHOKZERXVBAG-NSHDSACASA-N -1 3 371.828 3.661 20 0 FHADHM COc1ccccc1[C@@H](C)CC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000737142736 598649120 /nfs/dbraw/zinc/64/91/20/598649120.db2.gz PHVHOKZERXVBAG-NSHDSACASA-N -1 3 371.828 3.661 20 0 FHADHM CCN(C(=O)CSc1ccc(-c2nnn[n-]2)cc1)c1ccc(Cl)cc1 ZINC000736505679 598651974 /nfs/dbraw/zinc/65/19/74/598651974.db2.gz QPDLMQUIJRQVGD-UHFFFAOYSA-N -1 3 373.869 3.665 20 0 FHADHM CCN(C(=O)CSc1ccc(-c2nn[n-]n2)cc1)c1ccc(Cl)cc1 ZINC000736505679 598651975 /nfs/dbraw/zinc/65/19/75/598651975.db2.gz QPDLMQUIJRQVGD-UHFFFAOYSA-N -1 3 373.869 3.665 20 0 FHADHM CCC[C@H](C)N(C)C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736421377 598653354 /nfs/dbraw/zinc/65/33/54/598653354.db2.gz BCIHQCFSVHFNFB-AWEZNQCLSA-N -1 3 365.437 3.920 20 0 FHADHM CCC[C@H](C)N(C)C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736421377 598653356 /nfs/dbraw/zinc/65/33/56/598653356.db2.gz BCIHQCFSVHFNFB-AWEZNQCLSA-N -1 3 365.437 3.920 20 0 FHADHM CC[C@@H](C)[C@@H](C)NC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736328300 598656511 /nfs/dbraw/zinc/65/65/11/598656511.db2.gz HCOBTYCXSMHLHN-ZIAGYGMSSA-N -1 3 365.437 3.823 20 0 FHADHM CC[C@@H](C)[C@@H](C)NC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736328300 598656512 /nfs/dbraw/zinc/65/65/12/598656512.db2.gz HCOBTYCXSMHLHN-ZIAGYGMSSA-N -1 3 365.437 3.823 20 0 FHADHM CCCC[C@@H](NC(=O)c1sccc1-c1nnn[n-]1)c1ccc(OC)cc1 ZINC000736438985 598661737 /nfs/dbraw/zinc/66/17/37/598661737.db2.gz QIFWUOMRJXYIOT-OAHLLOKOSA-N -1 3 371.466 3.598 20 0 FHADHM CCCC[C@@H](NC(=O)c1sccc1-c1nn[n-]n1)c1ccc(OC)cc1 ZINC000736438985 598661738 /nfs/dbraw/zinc/66/17/38/598661738.db2.gz QIFWUOMRJXYIOT-OAHLLOKOSA-N -1 3 371.466 3.598 20 0 FHADHM CC[C@@H](c1ccccc1)N(CC(C)C)C(=O)c1ccc(-c2nnn[n-]2)cn1 ZINC000736392348 598671949 /nfs/dbraw/zinc/67/19/49/598671949.db2.gz QUCWIECXMIQHBB-SFHVURJKSA-N -1 3 364.453 3.511 20 0 FHADHM CC[C@@H](c1ccccc1)N(CC(C)C)C(=O)c1ccc(-c2nn[n-]n2)cn1 ZINC000736392348 598671953 /nfs/dbraw/zinc/67/19/53/598671953.db2.gz QUCWIECXMIQHBB-SFHVURJKSA-N -1 3 364.453 3.511 20 0 FHADHM CN(Cc1ccc(Cl)cc1Cl)Cc1ccc(F)cc1-c1nnn[n-]1 ZINC000736816964 598678338 /nfs/dbraw/zinc/67/83/38/598678338.db2.gz RKBGHVRJTYCSFZ-UHFFFAOYSA-N -1 3 366.227 3.945 20 0 FHADHM CN(Cc1ccc(Cl)cc1Cl)Cc1ccc(F)cc1-c1nn[n-]n1 ZINC000736816964 598678340 /nfs/dbraw/zinc/67/83/40/598678340.db2.gz RKBGHVRJTYCSFZ-UHFFFAOYSA-N -1 3 366.227 3.945 20 0 FHADHM Fc1ccc(CSCCCOCCc2ccccc2)c(-c2nnn[n-]2)c1 ZINC000737648223 598696731 /nfs/dbraw/zinc/69/67/31/598696731.db2.gz HJXBTXVWTCKFGF-UHFFFAOYSA-N -1 3 372.469 3.888 20 0 FHADHM Fc1ccc(CSCCCOCCc2ccccc2)c(-c2nn[n-]n2)c1 ZINC000737648223 598696733 /nfs/dbraw/zinc/69/67/33/598696733.db2.gz HJXBTXVWTCKFGF-UHFFFAOYSA-N -1 3 372.469 3.888 20 0 FHADHM Cc1ccc2cccc(OCCCOc3ccc(-c4nn[n-]n4)cc3)c2n1 ZINC000737374247 598698751 /nfs/dbraw/zinc/69/87/51/598698751.db2.gz MTBHEIOSFJBIDV-UHFFFAOYSA-N -1 3 361.405 3.571 20 0 FHADHM O=c1[nH]c2ccccc2cc1CSCc1ccc(F)cc1-c1nnn[n-]1 ZINC000738370262 598713319 /nfs/dbraw/zinc/71/33/19/598713319.db2.gz ADAKRUJJWPZYHG-UHFFFAOYSA-N -1 3 367.409 3.693 20 0 FHADHM O=c1[nH]c2ccccc2cc1CSCc1ccc(F)cc1-c1nn[n-]n1 ZINC000738370262 598713321 /nfs/dbraw/zinc/71/33/21/598713321.db2.gz ADAKRUJJWPZYHG-UHFFFAOYSA-N -1 3 367.409 3.693 20 0 FHADHM O=c1[nH]c2ccccc2cc1CSCc1ccc(-c2nnn[n-]2)cc1F ZINC000738372998 598713563 /nfs/dbraw/zinc/71/35/63/598713563.db2.gz ZGAAOLHHCQIXKL-UHFFFAOYSA-N -1 3 367.409 3.693 20 0 FHADHM O=c1[nH]c2ccccc2cc1CSCc1ccc(-c2nn[n-]n2)cc1F ZINC000738372998 598713565 /nfs/dbraw/zinc/71/35/65/598713565.db2.gz ZGAAOLHHCQIXKL-UHFFFAOYSA-N -1 3 367.409 3.693 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)N(C)C1CCC(CC)CC1 ZINC000736636079 598724639 /nfs/dbraw/zinc/72/46/39/598724639.db2.gz JNZMGURDZWDSCU-UHFFFAOYSA-N -1 3 372.473 3.698 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)N(C)C1CCC(CC)CC1 ZINC000736636079 598724641 /nfs/dbraw/zinc/72/46/41/598724641.db2.gz JNZMGURDZWDSCU-UHFFFAOYSA-N -1 3 372.473 3.698 20 0 FHADHM Cc1[nH]c2c(cc(C)cc2CNc2nc(C)cc(C)c2-c2nnn[n-]2)c1C ZINC000737265024 598746609 /nfs/dbraw/zinc/74/66/09/598746609.db2.gz RCOPXPSCXUTWAD-UHFFFAOYSA-N -1 3 361.453 3.897 20 0 FHADHM Cc1[nH]c2c(cc(C)cc2CNc2nc(C)cc(C)c2-c2nn[n-]n2)c1C ZINC000737265024 598746610 /nfs/dbraw/zinc/74/66/10/598746610.db2.gz RCOPXPSCXUTWAD-UHFFFAOYSA-N -1 3 361.453 3.897 20 0 FHADHM CCS[C@H]1CCCCN(c2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)C1 ZINC000736668229 598749321 /nfs/dbraw/zinc/74/93/21/598749321.db2.gz YYRUYZJXUAFOEL-LBPRGKRZSA-N -1 3 371.432 3.998 20 0 FHADHM CCS[C@H]1CCCCN(c2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)C1 ZINC000736668229 598749322 /nfs/dbraw/zinc/74/93/22/598749322.db2.gz YYRUYZJXUAFOEL-LBPRGKRZSA-N -1 3 371.432 3.998 20 0 FHADHM Cc1ccccc1[C@@H](NC(=O)CCc1ccc(-c2nnn[n-]2)cc1)C(C)C ZINC000737424045 598754961 /nfs/dbraw/zinc/75/49/61/598754961.db2.gz UJVCGTBYTJMBMF-FQEVSTJZSA-N -1 3 363.465 3.621 20 0 FHADHM Cc1ccccc1[C@@H](NC(=O)CCc1ccc(-c2nn[n-]n2)cc1)C(C)C ZINC000737424045 598754963 /nfs/dbraw/zinc/75/49/63/598754963.db2.gz UJVCGTBYTJMBMF-FQEVSTJZSA-N -1 3 363.465 3.621 20 0 FHADHM COCCSc1ccc([C@@H](C)Nc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000737014807 598755702 /nfs/dbraw/zinc/75/57/02/598755702.db2.gz RWOVHZIGFXWKQI-CYBMUJFWSA-N -1 3 355.467 3.778 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1N[C@@H](c1nccs1)c1ccccc1 ZINC000737639453 598758095 /nfs/dbraw/zinc/75/80/95/598758095.db2.gz BTTDYRSFTPCQTM-OAHLLOKOSA-N -1 3 352.398 3.664 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1cccc(C(F)F)c1 ZINC000735873573 598789914 /nfs/dbraw/zinc/78/99/14/598789914.db2.gz HBQZZIDNPCNBFB-UHFFFAOYSA-N -1 3 371.391 3.855 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1cccc(C(F)F)c1 ZINC000735873573 598789916 /nfs/dbraw/zinc/78/99/16/598789916.db2.gz HBQZZIDNPCNBFB-UHFFFAOYSA-N -1 3 371.391 3.855 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cccc(C(F)F)c2)c1-c1nnn[n-]1 ZINC000736677123 598791761 /nfs/dbraw/zinc/79/17/61/598791761.db2.gz ZUAIBHMGXXWPHC-UHFFFAOYSA-N -1 3 363.393 3.989 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cccc(C(F)F)c2)c1-c1nn[n-]n1 ZINC000736677123 598791762 /nfs/dbraw/zinc/79/17/62/598791762.db2.gz ZUAIBHMGXXWPHC-UHFFFAOYSA-N -1 3 363.393 3.989 20 0 FHADHM Oc1ccc(C2=CCN(c3ccc(Cl)cc3-c3nnn[n-]3)CC2)cc1 ZINC000738398520 598792540 /nfs/dbraw/zinc/79/25/40/598792540.db2.gz WTIBNHYVRGFZTG-UHFFFAOYSA-N -1 3 353.813 3.519 20 0 FHADHM Oc1ccc(C2=CCN(c3ccc(Cl)cc3-c3nn[n-]n3)CC2)cc1 ZINC000738398520 598792542 /nfs/dbraw/zinc/79/25/42/598792542.db2.gz WTIBNHYVRGFZTG-UHFFFAOYSA-N -1 3 353.813 3.519 20 0 FHADHM Clc1ccc(NCCCc2nc3c(s2)CCCC3)c(-c2nnn[n-]2)c1 ZINC000737576171 598795966 /nfs/dbraw/zinc/79/59/66/598795966.db2.gz XBDDPVPDFCNVIW-UHFFFAOYSA-N -1 3 374.901 3.900 20 0 FHADHM Clc1ccc(NCCCc2nc3c(s2)CCCC3)c(-c2nn[n-]n2)c1 ZINC000737576171 598795967 /nfs/dbraw/zinc/79/59/67/598795967.db2.gz XBDDPVPDFCNVIW-UHFFFAOYSA-N -1 3 374.901 3.900 20 0 FHADHM Fc1ccc([C@@H]2CCCN2Cc2ccc(-c3nnn[n-]3)cc2F)cc1F ZINC000737648676 598797179 /nfs/dbraw/zinc/79/71/79/598797179.db2.gz IPQVBHGTUDVRKA-KRWDZBQOSA-N -1 3 359.355 3.621 20 0 FHADHM Fc1ccc([C@@H]2CCCN2Cc2ccc(-c3nn[n-]n3)cc2F)cc1F ZINC000737648676 598797180 /nfs/dbraw/zinc/79/71/80/598797180.db2.gz IPQVBHGTUDVRKA-KRWDZBQOSA-N -1 3 359.355 3.621 20 0 FHADHM CC(C)[C@@H](c1ccccc1)N(C)C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000735735254 598801052 /nfs/dbraw/zinc/80/10/52/598801052.db2.gz NAKJQOOJLUSPQE-KRWDZBQOSA-N -1 3 368.416 3.867 20 0 FHADHM CC(C)[C@@H](c1ccccc1)N(C)C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000735735254 598801054 /nfs/dbraw/zinc/80/10/54/598801054.db2.gz NAKJQOOJLUSPQE-KRWDZBQOSA-N -1 3 368.416 3.867 20 0 FHADHM CC[C@@H](OC1CCCC1)C(=O)N(CC)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736380638 598802456 /nfs/dbraw/zinc/80/24/56/598802456.db2.gz XNSYTLYJNINDIM-KBXCAEBGSA-N -1 3 371.485 3.514 20 0 FHADHM CC[C@@H](OC1CCCC1)C(=O)N(CC)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736380638 598802457 /nfs/dbraw/zinc/80/24/57/598802457.db2.gz XNSYTLYJNINDIM-KBXCAEBGSA-N -1 3 371.485 3.514 20 0 FHADHM O=C(Nc1ccc(Cl)cc1-n1cccc1)c1cccc(-c2nnn[n-]2)c1 ZINC000738162399 598807549 /nfs/dbraw/zinc/80/75/49/598807549.db2.gz DOYFOLDORUWLIK-UHFFFAOYSA-N -1 3 364.796 3.563 20 0 FHADHM O=C(Nc1ccc(Cl)cc1-n1cccc1)c1cccc(-c2nn[n-]n2)c1 ZINC000738162399 598807550 /nfs/dbraw/zinc/80/75/50/598807550.db2.gz DOYFOLDORUWLIK-UHFFFAOYSA-N -1 3 364.796 3.563 20 0 FHADHM CCC(CC)N(C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C)C1CC1 ZINC000736345610 598812583 /nfs/dbraw/zinc/81/25/83/598812583.db2.gz JNZNAMUYTHHENI-UHFFFAOYSA-N -1 3 359.478 3.608 20 0 FHADHM CCC(CC)N(C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C)C1CC1 ZINC000736345610 598812585 /nfs/dbraw/zinc/81/25/85/598812585.db2.gz JNZNAMUYTHHENI-UHFFFAOYSA-N -1 3 359.478 3.608 20 0 FHADHM CCc1cc(Nc2ccc(OCc3cccc(-c4nnn[n-]4)c3)cc2)ncn1 ZINC000736677368 598816328 /nfs/dbraw/zinc/81/63/28/598816328.db2.gz IQHDEOSCFJELAA-UHFFFAOYSA-N -1 3 373.420 3.542 20 0 FHADHM CCc1cc(Nc2ccc(OCc3cccc(-c4nn[n-]n4)c3)cc2)ncn1 ZINC000736677368 598816330 /nfs/dbraw/zinc/81/63/30/598816330.db2.gz IQHDEOSCFJELAA-UHFFFAOYSA-N -1 3 373.420 3.542 20 0 FHADHM CCC[C@H](CC1CCCC1)C(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000736421558 598821518 /nfs/dbraw/zinc/82/15/18/598821518.db2.gz BUTIQGKBYVAUPU-GOSISDBHSA-N -1 3 355.486 3.822 20 0 FHADHM CCC[C@H](CC1CCCC1)C(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000736421558 598821519 /nfs/dbraw/zinc/82/15/19/598821519.db2.gz BUTIQGKBYVAUPU-GOSISDBHSA-N -1 3 355.486 3.822 20 0 FHADHM CN(C(=O)c1cccc(Oc2ccccc2)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736741926 599308015 /nfs/dbraw/zinc/30/80/15/599308015.db2.gz VUUPYSBDLBRKRF-UHFFFAOYSA-N -1 3 371.400 3.936 20 0 FHADHM CN(C(=O)c1cccc(Oc2ccccc2)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736741926 599308017 /nfs/dbraw/zinc/30/80/17/599308017.db2.gz VUUPYSBDLBRKRF-UHFFFAOYSA-N -1 3 371.400 3.936 20 0 FHADHM CCN(C(=O)Cc1ccc2ccccc2c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736505871 599308815 /nfs/dbraw/zinc/30/88/15/599308815.db2.gz TZUASNLFIUILPX-UHFFFAOYSA-N -1 3 357.417 3.616 20 0 FHADHM CCN(C(=O)Cc1ccc2ccccc2c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736505871 599308818 /nfs/dbraw/zinc/30/88/18/599308818.db2.gz TZUASNLFIUILPX-UHFFFAOYSA-N -1 3 357.417 3.616 20 0 FHADHM CCN(C(=O)Cc1cccc2ccccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000736504509 599312042 /nfs/dbraw/zinc/31/20/42/599312042.db2.gz FMQZUPGEEUHBMX-UHFFFAOYSA-N -1 3 357.417 3.616 20 0 FHADHM CCN(C(=O)Cc1cccc2ccccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000736504509 599312045 /nfs/dbraw/zinc/31/20/45/599312045.db2.gz FMQZUPGEEUHBMX-UHFFFAOYSA-N -1 3 357.417 3.616 20 0 FHADHM CC(=O)Nc1c(C)ccc(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1C ZINC000735482947 599323273 /nfs/dbraw/zinc/32/32/73/599323273.db2.gz XLYFCYWFORIPLS-CYBMUJFWSA-N -1 3 350.426 3.615 20 0 FHADHM CC(=O)Nc1c(C)ccc(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1C ZINC000735482947 599323275 /nfs/dbraw/zinc/32/32/75/599323275.db2.gz XLYFCYWFORIPLS-CYBMUJFWSA-N -1 3 350.426 3.615 20 0 FHADHM C[C@@H](SC[C@@H]1OCCc2ccccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000736187424 599325215 /nfs/dbraw/zinc/32/52/15/599325215.db2.gz AIXDRRRFUXBIPB-ACJLOTCBSA-N -1 3 352.463 3.975 20 0 FHADHM C[C@@H](SC[C@@H]1OCCc2ccccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000736187424 599325217 /nfs/dbraw/zinc/32/52/17/599325217.db2.gz AIXDRRRFUXBIPB-ACJLOTCBSA-N -1 3 352.463 3.975 20 0 FHADHM Clc1ccc(Br)cc1CNc1ccc(-c2nn[n-]n2)cc1 ZINC000737570996 599325960 /nfs/dbraw/zinc/32/59/60/599325960.db2.gz PDGPTDRAXPRTRY-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM FC(F)Oc1ccc(CNc2ccc(Cl)c(-c3nnn[n-]3)c2)cc1 ZINC000737638055 599326718 /nfs/dbraw/zinc/32/67/18/599326718.db2.gz CAEUAXQLIAVOEY-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM FC(F)Oc1ccc(CNc2ccc(Cl)c(-c3nn[n-]n3)c2)cc1 ZINC000737638055 599326720 /nfs/dbraw/zinc/32/67/20/599326720.db2.gz CAEUAXQLIAVOEY-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM COCCOc1c(Cl)cccc1N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000737011490 599326848 /nfs/dbraw/zinc/32/68/48/599326848.db2.gz UTBGRQADUUDFRY-GFCCVEGCSA-N -1 3 373.844 3.718 20 0 FHADHM COCCOc1c(Cl)cccc1N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000737011490 599326852 /nfs/dbraw/zinc/32/68/52/599326852.db2.gz UTBGRQADUUDFRY-GFCCVEGCSA-N -1 3 373.844 3.718 20 0 FHADHM C[C@@H](SCc1nc(-c2cccs2)no1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736193972 599327038 /nfs/dbraw/zinc/32/70/38/599327038.db2.gz VZKNPOLTJALFCV-SNVBAGLBSA-N -1 3 370.463 3.973 20 0 FHADHM C[C@@H](SCc1nc(-c2cccs2)no1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736193972 599327042 /nfs/dbraw/zinc/32/70/42/599327042.db2.gz VZKNPOLTJALFCV-SNVBAGLBSA-N -1 3 370.463 3.973 20 0 FHADHM C[C@@H](SCCC(=O)Nc1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736188511 599327588 /nfs/dbraw/zinc/32/75/88/599327588.db2.gz KNKITXVMIAQNJT-CYBMUJFWSA-N -1 3 353.451 3.690 20 0 FHADHM C[C@@H](SCCC(=O)Nc1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736188511 599327589 /nfs/dbraw/zinc/32/75/89/599327589.db2.gz KNKITXVMIAQNJT-CYBMUJFWSA-N -1 3 353.451 3.690 20 0 FHADHM C[C@@H](SCC(=O)NCCC1=CCCCC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736191092 599328279 /nfs/dbraw/zinc/32/82/79/599328279.db2.gz VUGTYCJPKXQJDG-CQSZACIVSA-N -1 3 371.510 3.668 20 0 FHADHM C[C@@H](SCC(=O)NCCC1=CCCCC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736191092 599328282 /nfs/dbraw/zinc/32/82/82/599328282.db2.gz VUGTYCJPKXQJDG-CQSZACIVSA-N -1 3 371.510 3.668 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NCc1cccc(OCC(F)(F)F)c1 ZINC000737296300 599328270 /nfs/dbraw/zinc/32/82/70/599328270.db2.gz JAHHGNMDVPYHJP-UHFFFAOYSA-N -1 3 363.343 3.728 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NCc1cccc(OCC(F)(F)F)c1 ZINC000737296300 599328274 /nfs/dbraw/zinc/32/82/74/599328274.db2.gz JAHHGNMDVPYHJP-UHFFFAOYSA-N -1 3 363.343 3.728 20 0 FHADHM C[C@@H](SCC(=O)NC1CCCCCCC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736191843 599328744 /nfs/dbraw/zinc/32/87/44/599328744.db2.gz XDJFPIARKCULGD-CQSZACIVSA-N -1 3 373.526 3.890 20 0 FHADHM C[C@@H](SCC(=O)NC1CCCCCCC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736191843 599328747 /nfs/dbraw/zinc/32/87/47/599328747.db2.gz XDJFPIARKCULGD-CQSZACIVSA-N -1 3 373.526 3.890 20 0 FHADHM Cc1cccc(NC(=O)[C@@H](C)S[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737398644 599329341 /nfs/dbraw/zinc/32/93/41/599329341.db2.gz JANGOWSKAHZASS-UONOGXRCSA-N -1 3 367.478 3.997 20 0 FHADHM Cc1cccc(NC(=O)[C@@H](C)S[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737398644 599329344 /nfs/dbraw/zinc/32/93/44/599329344.db2.gz JANGOWSKAHZASS-UONOGXRCSA-N -1 3 367.478 3.997 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1CNc1ccccc1CC(F)(F)F ZINC000737641187 599331099 /nfs/dbraw/zinc/33/10/99/599331099.db2.gz UKORCABQGJVTNM-UHFFFAOYSA-N -1 3 351.307 3.723 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CNc1ccccc1CC(F)(F)F ZINC000737641187 599331102 /nfs/dbraw/zinc/33/11/02/599331102.db2.gz UKORCABQGJVTNM-UHFFFAOYSA-N -1 3 351.307 3.723 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1CNc1cccc(CC(F)(F)F)c1 ZINC000737640759 599334026 /nfs/dbraw/zinc/33/40/26/599334026.db2.gz PFINEHOVTSPNHB-UHFFFAOYSA-N -1 3 351.307 3.723 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CNc1cccc(CC(F)(F)F)c1 ZINC000737640759 599334028 /nfs/dbraw/zinc/33/40/28/599334028.db2.gz PFINEHOVTSPNHB-UHFFFAOYSA-N -1 3 351.307 3.723 20 0 FHADHM Cc1cc(C)cc(NC(=O)[C@@H](C)Sc2ccccc2-c2nnn[n-]2)c1 ZINC000822196687 599351111 /nfs/dbraw/zinc/35/11/11/599351111.db2.gz SQKNDJIUIVQVKX-CYBMUJFWSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1cc(C)cc(NC(=O)[C@@H](C)Sc2ccccc2-c2nn[n-]n2)c1 ZINC000822196687 599351116 /nfs/dbraw/zinc/35/11/16/599351116.db2.gz SQKNDJIUIVQVKX-CYBMUJFWSA-N -1 3 353.451 3.603 20 0 FHADHM C[C@@H](Nc1nc(C(F)F)nc2ccccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000820461612 599351793 /nfs/dbraw/zinc/35/17/93/599351793.db2.gz NVIJFCOYPGUVET-SNVBAGLBSA-N -1 3 367.363 3.921 20 0 FHADHM C[C@@H](Nc1nc(C(F)F)nc2ccccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000820461612 599351795 /nfs/dbraw/zinc/35/17/95/599351795.db2.gz NVIJFCOYPGUVET-SNVBAGLBSA-N -1 3 367.363 3.921 20 0 FHADHM Cc1sc2nc(C)nc(N[C@@H](C)c3cccc(-c4nnn[n-]4)c3)c2c1C ZINC000822453541 599356152 /nfs/dbraw/zinc/35/61/52/599356152.db2.gz LHQLEXBERLINFY-JTQLQIEISA-N -1 3 365.466 3.970 20 0 FHADHM Cc1sc2nc(C)nc(N[C@@H](C)c3cccc(-c4nn[n-]n4)c3)c2c1C ZINC000822453541 599356156 /nfs/dbraw/zinc/35/61/56/599356156.db2.gz LHQLEXBERLINFY-JTQLQIEISA-N -1 3 365.466 3.970 20 0 FHADHM C[C@H](Nc1ccc(NC(=O)c2ccco2)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820456036 599365006 /nfs/dbraw/zinc/36/50/06/599365006.db2.gz PFMGSMIXWMJINP-ZDUSSCGKSA-N -1 3 374.404 3.885 20 0 FHADHM C[C@H](Nc1ccc(NC(=O)c2ccco2)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820456036 599365010 /nfs/dbraw/zinc/36/50/10/599365010.db2.gz PFMGSMIXWMJINP-ZDUSSCGKSA-N -1 3 374.404 3.885 20 0 FHADHM Cc1sc(NC(=O)C(C)(C)c2cccc(F)c2)c(-c2nnn[n-]2)c1C ZINC000737559909 599370888 /nfs/dbraw/zinc/37/08/88/599370888.db2.gz DBYVMZPREZEWGG-UHFFFAOYSA-N -1 3 359.430 3.600 20 0 FHADHM Cc1sc(NC(=O)C(C)(C)c2cccc(F)c2)c(-c2nn[n-]n2)c1C ZINC000737559909 599370891 /nfs/dbraw/zinc/37/08/91/599370891.db2.gz DBYVMZPREZEWGG-UHFFFAOYSA-N -1 3 359.430 3.600 20 0 FHADHM CCc1c(C)sc(NC(=O)C(C)(C)c2cccc(F)c2)c1-c1nnn[n-]1 ZINC000736669275 599374331 /nfs/dbraw/zinc/37/43/31/599374331.db2.gz BYPQTUXGZHEAEW-UHFFFAOYSA-N -1 3 373.457 3.854 20 0 FHADHM CCc1c(C)sc(NC(=O)C(C)(C)c2cccc(F)c2)c1-c1nn[n-]n1 ZINC000736669275 599374333 /nfs/dbraw/zinc/37/43/33/599374333.db2.gz BYPQTUXGZHEAEW-UHFFFAOYSA-N -1 3 373.457 3.854 20 0 FHADHM c1ccc2c(c1)cccc2OCc1nnc(-c2cccc(-c3nnn[n-]3)c2)o1 ZINC000823738658 599383490 /nfs/dbraw/zinc/38/34/90/599383490.db2.gz XXMCVRMWRCYLLO-UHFFFAOYSA-N -1 3 370.372 3.649 20 0 FHADHM c1ccc2c(c1)cccc2OCc1nnc(-c2cccc(-c3nn[n-]n3)c2)o1 ZINC000823738658 599383492 /nfs/dbraw/zinc/38/34/92/599383492.db2.gz XXMCVRMWRCYLLO-UHFFFAOYSA-N -1 3 370.372 3.649 20 0 FHADHM CCOc1ccc(C(C)=O)cc1COc1c(C)cc(-c2nn[n-]n2)cc1C ZINC000821417227 599386563 /nfs/dbraw/zinc/38/65/63/599386563.db2.gz JOWMWHCKJJEBMH-UHFFFAOYSA-N -1 3 366.421 3.664 20 0 FHADHM c1[nH]c2ccccc2c1CCNc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000738433034 599394171 /nfs/dbraw/zinc/39/41/71/599394171.db2.gz MNIVHNWJDHEDSV-UHFFFAOYSA-N -1 3 355.405 3.551 20 0 FHADHM c1[nH]c2ccccc2c1CCNc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000738433034 599394174 /nfs/dbraw/zinc/39/41/74/599394174.db2.gz MNIVHNWJDHEDSV-UHFFFAOYSA-N -1 3 355.405 3.551 20 0 FHADHM CCc1ccc([C@@H](C)NC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000821483079 599399314 /nfs/dbraw/zinc/39/93/14/599399314.db2.gz WZYNFJJXXMATNS-KGLIPLIRSA-N -1 3 364.453 3.551 20 0 FHADHM CCc1ccc([C@@H](C)NC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000821483079 599399317 /nfs/dbraw/zinc/39/93/17/599399317.db2.gz WZYNFJJXXMATNS-KGLIPLIRSA-N -1 3 364.453 3.551 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(NCc2ccc(Br)s2)c1 ZINC000737570986 599404831 /nfs/dbraw/zinc/40/48/31/599404831.db2.gz OTEPOWWZZDOAQJ-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(NCc2ccc(Br)s2)c1 ZINC000737570986 599404832 /nfs/dbraw/zinc/40/48/32/599404832.db2.gz OTEPOWWZZDOAQJ-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM c1ccc(COCCCCNc2cc(-c3nnn[n-]3)c3ccccc3n2)cc1 ZINC000738432250 599423806 /nfs/dbraw/zinc/42/38/06/599423806.db2.gz FWDGTHZYCXBMTM-UHFFFAOYSA-N -1 3 374.448 3.824 20 0 FHADHM c1ccc(COCCCCNc2cc(-c3nn[n-]n3)c3ccccc3n2)cc1 ZINC000738432250 599423807 /nfs/dbraw/zinc/42/38/07/599423807.db2.gz FWDGTHZYCXBMTM-UHFFFAOYSA-N -1 3 374.448 3.824 20 0 FHADHM CC(C)CC(CC(C)C)NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820055969 599435211 /nfs/dbraw/zinc/43/52/11/599435211.db2.gz MCWIGVWMMKWVFY-AWEZNQCLSA-N -1 3 358.490 3.688 20 0 FHADHM CC(C)CC(CC(C)C)NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820055969 599435214 /nfs/dbraw/zinc/43/52/14/599435214.db2.gz MCWIGVWMMKWVFY-AWEZNQCLSA-N -1 3 358.490 3.688 20 0 FHADHM C[C@@H](Nc1ncc(-c2nnn[n-]2)cc1Cl)c1ccc(F)cc1Cl ZINC000736138829 599440636 /nfs/dbraw/zinc/44/06/36/599440636.db2.gz RWDYQKFJFUGDBR-SSDOTTSWSA-N -1 3 353.188 3.881 20 0 FHADHM C[C@@H](Nc1ncc(-c2nn[n-]n2)cc1Cl)c1ccc(F)cc1Cl ZINC000736138829 599440638 /nfs/dbraw/zinc/44/06/38/599440638.db2.gz RWDYQKFJFUGDBR-SSDOTTSWSA-N -1 3 353.188 3.881 20 0 FHADHM CCCCc1noc([C@H](C)SCc2ccc(F)cc2-c2nnn[n-]2)n1 ZINC000736466526 599451133 /nfs/dbraw/zinc/45/11/33/599451133.db2.gz MGDRJMJIGYDQHN-JTQLQIEISA-N -1 3 362.434 3.726 20 0 FHADHM CCCCc1noc([C@H](C)SCc2ccc(F)cc2-c2nn[n-]n2)n1 ZINC000736466526 599451135 /nfs/dbraw/zinc/45/11/35/599451135.db2.gz MGDRJMJIGYDQHN-JTQLQIEISA-N -1 3 362.434 3.726 20 0 FHADHM CC[C@@H](C)C[C@@H](C)NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)CC(C)C ZINC000820870783 599459091 /nfs/dbraw/zinc/45/90/91/599459091.db2.gz ZHXXLXKLJBMKSY-HZPDHXFCSA-N -1 3 372.517 3.859 20 0 FHADHM CC[C@@H](C)C[C@@H](C)NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)CC(C)C ZINC000820870783 599459094 /nfs/dbraw/zinc/45/90/94/599459094.db2.gz ZHXXLXKLJBMKSY-HZPDHXFCSA-N -1 3 372.517 3.859 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CNCc1ccc(-c2ccccc2F)o1 ZINC000822761769 599459169 /nfs/dbraw/zinc/45/91/69/599459169.db2.gz SFHWLLUYZDPGFD-UHFFFAOYSA-N -1 3 367.359 3.695 20 0 FHADHM Fc1ccc(NCc2ccc(OC(F)(F)F)cc2)c(-c2nnn[n-]2)c1 ZINC000822782849 599468501 /nfs/dbraw/zinc/46/85/01/599468501.db2.gz JMLZNHDDKJHDCC-UHFFFAOYSA-N -1 3 353.279 3.517 20 0 FHADHM Fc1ccc(NCc2ccc(OC(F)(F)F)cc2)c(-c2nn[n-]n2)c1 ZINC000822782849 599468502 /nfs/dbraw/zinc/46/85/02/599468502.db2.gz JMLZNHDDKJHDCC-UHFFFAOYSA-N -1 3 353.279 3.517 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1NCc1csc(Br)c1 ZINC000822586252 599475032 /nfs/dbraw/zinc/47/50/32/599475032.db2.gz VJMPRRJRKKVCOC-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1NCc1csc(Br)c1 ZINC000822586252 599475034 /nfs/dbraw/zinc/47/50/34/599475034.db2.gz VJMPRRJRKKVCOC-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM Fc1ccc(NCCOc2cccc(C(F)(F)F)c2)c(-c2nnn[n-]2)c1 ZINC000822778925 599483559 /nfs/dbraw/zinc/48/35/59/599483559.db2.gz OKQDVMRIIKJMKH-UHFFFAOYSA-N -1 3 367.306 3.516 20 0 FHADHM Fc1ccc(NCCOc2cccc(C(F)(F)F)c2)c(-c2nn[n-]n2)c1 ZINC000822778925 599483561 /nfs/dbraw/zinc/48/35/61/599483561.db2.gz OKQDVMRIIKJMKH-UHFFFAOYSA-N -1 3 367.306 3.516 20 0 FHADHM CC(C)(C(=O)OCc1cc(-c2nnn[n-]2)ccc1F)c1cccc(Cl)c1 ZINC000735583365 599498771 /nfs/dbraw/zinc/49/87/71/599498771.db2.gz XFNYCDFQUCYWDE-UHFFFAOYSA-N -1 3 374.803 3.680 20 0 FHADHM CC(C)(C(=O)OCc1cc(-c2nn[n-]n2)ccc1F)c1cccc(Cl)c1 ZINC000735583365 599498774 /nfs/dbraw/zinc/49/87/74/599498774.db2.gz XFNYCDFQUCYWDE-UHFFFAOYSA-N -1 3 374.803 3.680 20 0 FHADHM C[C@@H](NC(=O)C(C)(C)c1cccc(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820316034 599499259 /nfs/dbraw/zinc/49/92/59/599499259.db2.gz RJVOIKLXTRAPCC-GFCCVEGCSA-N -1 3 369.856 3.675 20 0 FHADHM C[C@@H](NC(=O)C(C)(C)c1cccc(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820316034 599499261 /nfs/dbraw/zinc/49/92/61/599499261.db2.gz RJVOIKLXTRAPCC-GFCCVEGCSA-N -1 3 369.856 3.675 20 0 FHADHM CCCCOc1ccc(C(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000821077656 599506851 /nfs/dbraw/zinc/50/68/51/599506851.db2.gz PCZZTYBQSHWOEB-AWEZNQCLSA-N -1 3 365.437 3.537 20 0 FHADHM CCCCOc1ccc(C(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000821077656 599506852 /nfs/dbraw/zinc/50/68/52/599506852.db2.gz PCZZTYBQSHWOEB-AWEZNQCLSA-N -1 3 365.437 3.537 20 0 FHADHM Cc1csc([C@@H]2CCCN(c3ccc(-c4nnn[n-]4)c(Cl)c3)C2)n1 ZINC000822408724 599509030 /nfs/dbraw/zinc/50/90/30/599509030.db2.gz HLLQNPNRWGSXAU-LLVKDONJSA-N -1 3 360.874 3.669 20 0 FHADHM Cc1csc([C@@H]2CCCN(c3ccc(-c4nn[n-]n4)c(Cl)c3)C2)n1 ZINC000822408724 599509032 /nfs/dbraw/zinc/50/90/32/599509032.db2.gz HLLQNPNRWGSXAU-LLVKDONJSA-N -1 3 360.874 3.669 20 0 FHADHM C[C@H](S[C@@H](C)c1cccs1)C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000736188477 599521596 /nfs/dbraw/zinc/52/15/96/599521596.db2.gz KENWTXNKDSUCST-QWRGUYRKSA-N -1 3 359.480 3.750 20 0 FHADHM C[C@H](S[C@@H](C)c1cccs1)C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000736188477 599521599 /nfs/dbraw/zinc/52/15/99/599521599.db2.gz KENWTXNKDSUCST-QWRGUYRKSA-N -1 3 359.480 3.750 20 0 FHADHM C[C@@H](Nc1ccc(-c2nn[n-]n2)cc1C(F)(F)F)c1nc2ccccc2[nH]1 ZINC000736136944 599521622 /nfs/dbraw/zinc/52/16/22/599521622.db2.gz IAIQDWPLPSTHMI-SECBINFHSA-N -1 3 373.342 3.935 20 0 FHADHM FC(F)(F)c1cc(-c2nn[n-]n2)ccc1NCc1cc2ccccc2[nH]1 ZINC000737626779 599523133 /nfs/dbraw/zinc/52/31/33/599523133.db2.gz LGQXNLPJIPMOKI-UHFFFAOYSA-N -1 3 358.327 3.979 20 0 FHADHM C[C@@H](S[C@@H](C)c1cccs1)C(=O)Nc1ccccc1-c1nnn[n-]1 ZINC000736188209 599524228 /nfs/dbraw/zinc/52/42/28/599524228.db2.gz JBQGLTZBYRMFRD-WDEREUQCSA-N -1 3 359.480 3.750 20 0 FHADHM C[C@@H](S[C@@H](C)c1cccs1)C(=O)Nc1ccccc1-c1nn[n-]n1 ZINC000736188209 599524231 /nfs/dbraw/zinc/52/42/31/599524231.db2.gz JBQGLTZBYRMFRD-WDEREUQCSA-N -1 3 359.480 3.750 20 0 FHADHM Cc1cc(C)c(C=CC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1C ZINC000822194162 599532485 /nfs/dbraw/zinc/53/24/85/599532485.db2.gz LFJKRXYMTLVCAK-ROJDOSBLSA-N -1 3 361.449 3.683 20 0 FHADHM Cc1cc(C)c(C=CC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1C ZINC000822194162 599532486 /nfs/dbraw/zinc/53/24/86/599532486.db2.gz LFJKRXYMTLVCAK-ROJDOSBLSA-N -1 3 361.449 3.683 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCC2)c1cccs1 ZINC000735571167 599539572 /nfs/dbraw/zinc/53/95/72/599539572.db2.gz SXQARKAOZWXVMO-SECBINFHSA-N -1 3 359.480 3.611 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCC2)c1cccs1 ZINC000735571167 599539574 /nfs/dbraw/zinc/53/95/74/599539574.db2.gz SXQARKAOZWXVMO-SECBINFHSA-N -1 3 359.480 3.611 20 0 FHADHM CCc1ccc([C@@H](C)CC(=O)N(C)Cc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736687665 599542081 /nfs/dbraw/zinc/54/20/81/599542081.db2.gz OLNYOQHFPYSYCP-HNNXBMFYSA-N -1 3 363.465 3.581 20 0 FHADHM CCc1ccc([C@@H](C)CC(=O)N(C)Cc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736687665 599542083 /nfs/dbraw/zinc/54/20/83/599542083.db2.gz OLNYOQHFPYSYCP-HNNXBMFYSA-N -1 3 363.465 3.581 20 0 FHADHM CCN(C(=O)[C@@H](C)c1ccsc1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736502573 599542526 /nfs/dbraw/zinc/54/25/26/599542526.db2.gz NYBPIOUCMYCSPL-STQMWFEESA-N -1 3 355.467 3.641 20 0 FHADHM CCN(C(=O)[C@@H](C)c1ccsc1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736502573 599542527 /nfs/dbraw/zinc/54/25/27/599542527.db2.gz NYBPIOUCMYCSPL-STQMWFEESA-N -1 3 355.467 3.641 20 0 FHADHM CC(C)c1ccc([C@H](C)CC(=O)Nc2ccc(-c3nnn[n-]3)cn2)cc1 ZINC000735923043 599544100 /nfs/dbraw/zinc/54/41/00/599544100.db2.gz JBEAMQVMNQAYFG-CYBMUJFWSA-N -1 3 350.426 3.517 20 0 FHADHM CC(C)c1ccc([C@H](C)CC(=O)Nc2ccc(-c3nn[n-]n3)cn2)cc1 ZINC000735923043 599544102 /nfs/dbraw/zinc/54/41/02/599544102.db2.gz JBEAMQVMNQAYFG-CYBMUJFWSA-N -1 3 350.426 3.517 20 0 FHADHM CCc1ccc([C@H](C)CC(=O)Nc2cc(-c3nnn[n-]3)ccc2OC)cc1 ZINC000736685554 599545016 /nfs/dbraw/zinc/54/50/16/599545016.db2.gz GHQZKXRAAWLMRE-CYBMUJFWSA-N -1 3 365.437 3.570 20 0 FHADHM CCc1ccc([C@H](C)CC(=O)Nc2cc(-c3nn[n-]n3)ccc2OC)cc1 ZINC000736685554 599545018 /nfs/dbraw/zinc/54/50/18/599545018.db2.gz GHQZKXRAAWLMRE-CYBMUJFWSA-N -1 3 365.437 3.570 20 0 FHADHM C[C@@H](NC(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C)C1CCCCC1 ZINC000820374645 599549377 /nfs/dbraw/zinc/54/93/77/599549377.db2.gz POQPRYOXGXQENQ-GFCCVEGCSA-N -1 3 359.478 3.514 20 0 FHADHM C[C@@H](NC(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C)C1CCCCC1 ZINC000820374645 599549379 /nfs/dbraw/zinc/54/93/79/599549379.db2.gz POQPRYOXGXQENQ-GFCCVEGCSA-N -1 3 359.478 3.514 20 0 FHADHM CCc1ccc([C@@H]2CCCCN2C(=O)Nc2cccc(-c3nnn[n-]3)c2)o1 ZINC000821482207 599550363 /nfs/dbraw/zinc/55/03/63/599550363.db2.gz RHXUKOIFTGORAM-INIZCTEOSA-N -1 3 366.425 3.781 20 0 FHADHM CCc1ccc([C@@H]2CCCCN2C(=O)Nc2cccc(-c3nn[n-]n3)c2)o1 ZINC000821482207 599550365 /nfs/dbraw/zinc/55/03/65/599550365.db2.gz RHXUKOIFTGORAM-INIZCTEOSA-N -1 3 366.425 3.781 20 0 FHADHM CCS[C@H]1CCCCN(c2c(-c3nnn[n-]3)cnc3c(C)cccc32)C1 ZINC000821455020 599553426 /nfs/dbraw/zinc/55/34/26/599553426.db2.gz IKICOEATLFIKMP-AWEZNQCLSA-N -1 3 368.510 3.835 20 0 FHADHM CCS[C@H]1CCCCN(c2c(-c3nn[n-]n3)cnc3c(C)cccc32)C1 ZINC000821455020 599553428 /nfs/dbraw/zinc/55/34/28/599553428.db2.gz IKICOEATLFIKMP-AWEZNQCLSA-N -1 3 368.510 3.835 20 0 FHADHM Cc1ccc([C@@H]2[C@H](C)CCCN2C(=O)c2sccc2-c2nnn[n-]2)cc1 ZINC000737332854 599558050 /nfs/dbraw/zinc/55/80/50/599558050.db2.gz WQZAFBBDIWOIGS-CJNGLKHVSA-N -1 3 367.478 3.850 20 0 FHADHM Cc1ccc([C@@H]2[C@H](C)CCCN2C(=O)c2sccc2-c2nn[n-]n2)cc1 ZINC000737332854 599558051 /nfs/dbraw/zinc/55/80/51/599558051.db2.gz WQZAFBBDIWOIGS-CJNGLKHVSA-N -1 3 367.478 3.850 20 0 FHADHM Cc1ccc([C@H]2[C@@H](C)CCCN2C(=O)c2sccc2-c2nnn[n-]2)cc1 ZINC000737332856 599558133 /nfs/dbraw/zinc/55/81/33/599558133.db2.gz WQZAFBBDIWOIGS-XJKSGUPXSA-N -1 3 367.478 3.850 20 0 FHADHM Cc1ccc([C@H]2[C@@H](C)CCCN2C(=O)c2sccc2-c2nn[n-]n2)cc1 ZINC000737332856 599558135 /nfs/dbraw/zinc/55/81/35/599558135.db2.gz WQZAFBBDIWOIGS-XJKSGUPXSA-N -1 3 367.478 3.850 20 0 FHADHM Cc1ccc([C@@H]2CCCCCN2C(=O)c2ccc(-c3nnn[n-]3)cc2)o1 ZINC000737327747 599560288 /nfs/dbraw/zinc/56/02/88/599560288.db2.gz ABMKULFEKCHALB-INIZCTEOSA-N -1 3 351.410 3.526 20 0 FHADHM Cc1ccc([C@@H]2CCCCCN2C(=O)c2ccc(-c3nn[n-]n3)cc2)o1 ZINC000737327747 599560291 /nfs/dbraw/zinc/56/02/91/599560291.db2.gz ABMKULFEKCHALB-INIZCTEOSA-N -1 3 351.410 3.526 20 0 FHADHM C[C@@H]1CCCCN1C(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736265457 599561738 /nfs/dbraw/zinc/56/17/38/599561738.db2.gz BACJFYKNFRGOET-CQSZACIVSA-N -1 3 362.437 3.625 20 0 FHADHM C[C@@H]1CCC[C@H]1NC(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736264318 599569227 /nfs/dbraw/zinc/56/92/27/599569227.db2.gz VSACEOSCTPLTGG-FZKQIMNGSA-N -1 3 362.437 3.529 20 0 FHADHM O=C(c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1)N1CCC2(CC2)CC1 ZINC000738272865 599570794 /nfs/dbraw/zinc/57/07/94/599570794.db2.gz GJQXWBCSPZPOPJ-UHFFFAOYSA-N -1 3 374.448 3.627 20 0 FHADHM Cc1cccc([C@@H]2CCCN2c2ncc(-c3nnn[n-]3)cc2Cl)c1C ZINC000822299892 599577760 /nfs/dbraw/zinc/57/77/60/599577760.db2.gz YNHJVAUOZKITNT-INIZCTEOSA-N -1 3 354.845 3.873 20 0 FHADHM Cc1cccc([C@@H]2CCCN2c2ncc(-c3nn[n-]n3)cc2Cl)c1C ZINC000822299892 599577762 /nfs/dbraw/zinc/57/77/62/599577762.db2.gz YNHJVAUOZKITNT-INIZCTEOSA-N -1 3 354.845 3.873 20 0 FHADHM c1ccc(COCc2ccc(Nc3ccc(-c4nnn[n-]4)cn3)cc2)cc1 ZINC000823787332 599588499 /nfs/dbraw/zinc/58/84/99/599588499.db2.gz LHVNRANEPRDZEE-UHFFFAOYSA-N -1 3 358.405 3.722 20 0 FHADHM c1ccc(COCc2ccc(Nc3ccc(-c4nn[n-]n4)cn3)cc2)cc1 ZINC000823787332 599588500 /nfs/dbraw/zinc/58/85/00/599588500.db2.gz LHVNRANEPRDZEE-UHFFFAOYSA-N -1 3 358.405 3.722 20 0 FHADHM CC[C@H](SCC(=O)Nc1cccc(-c2nnn[n-]2)c1)c1ccc(F)cc1 ZINC000736393337 599598658 /nfs/dbraw/zinc/59/86/58/599598658.db2.gz XCZDDLDQVREQDI-INIZCTEOSA-N -1 3 371.441 3.829 20 0 FHADHM CC[C@H](SCC(=O)Nc1cccc(-c2nn[n-]n2)c1)c1ccc(F)cc1 ZINC000736393337 599598661 /nfs/dbraw/zinc/59/86/61/599598661.db2.gz XCZDDLDQVREQDI-INIZCTEOSA-N -1 3 371.441 3.829 20 0 FHADHM CC[C@H](CC(=O)OCc1cccc(-c2nnn[n-]2)c1)c1ccc(C)cc1 ZINC000736335847 599605336 /nfs/dbraw/zinc/60/53/36/599605336.db2.gz WCZBQJGQTRPTBZ-MRXNPFEDSA-N -1 3 350.422 3.802 20 0 FHADHM CC[C@H](CC(=O)OCc1cccc(-c2nn[n-]n2)c1)c1ccc(C)cc1 ZINC000736335847 599605338 /nfs/dbraw/zinc/60/53/38/599605338.db2.gz WCZBQJGQTRPTBZ-MRXNPFEDSA-N -1 3 350.422 3.802 20 0 FHADHM CC[C@H](C)[C@H]1CCCCN1C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736335665 599608495 /nfs/dbraw/zinc/60/84/95/599608495.db2.gz ZIMTYRDSRFRHGM-GRDNDAEWSA-N -1 3 356.474 3.538 20 0 FHADHM CC[C@H](C)[C@H]1CCCCN1C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736335665 599608496 /nfs/dbraw/zinc/60/84/96/599608496.db2.gz ZIMTYRDSRFRHGM-GRDNDAEWSA-N -1 3 356.474 3.538 20 0 FHADHM C[C@H](C(=O)Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1)C(F)(F)F ZINC000819875644 599630327 /nfs/dbraw/zinc/63/03/27/599630327.db2.gz AUQBPWGCCLXJHB-MRVPVSSYSA-N -1 3 367.356 3.732 20 0 FHADHM C[C@H](C(=O)Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1)C(F)(F)F ZINC000819875644 599630328 /nfs/dbraw/zinc/63/03/28/599630328.db2.gz AUQBPWGCCLXJHB-MRVPVSSYSA-N -1 3 367.356 3.732 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)cc1F ZINC000822226101 599632952 /nfs/dbraw/zinc/63/29/52/599632952.db2.gz CMXBFXMLPLAXFW-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)cc1F ZINC000822226101 599632953 /nfs/dbraw/zinc/63/29/53/599632953.db2.gz CMXBFXMLPLAXFW-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM CCC(C)(C)CC(=O)Nc1ncc(Cc2ccc(-c3nnn[n-]3)cc2)s1 ZINC000820848353 599648164 /nfs/dbraw/zinc/64/81/64/599648164.db2.gz VQQSCOUWMYKHSQ-UHFFFAOYSA-N -1 3 370.482 3.679 20 0 FHADHM CCC(C)(C)CC(=O)Nc1ncc(Cc2ccc(-c3nn[n-]n3)cc2)s1 ZINC000820848353 599648165 /nfs/dbraw/zinc/64/81/65/599648165.db2.gz VQQSCOUWMYKHSQ-UHFFFAOYSA-N -1 3 370.482 3.679 20 0 FHADHM CN(C(=O)CN1CCC[C@H](c2ccccc2)CC1)c1ccccc1C(=O)[O-] ZINC000737323788 599709337 /nfs/dbraw/zinc/70/93/37/599709337.db2.gz HQNOHKRTLFWLCF-SFHVURJKSA-N -1 3 366.461 3.617 20 0 FHADHM O=C([O-])c1sccc1NC(=O)CNC1(c2ccc(F)cc2)CCCC1 ZINC000739310217 599713630 /nfs/dbraw/zinc/71/36/30/599713630.db2.gz YIXVKWHCDIDJRI-UHFFFAOYSA-N -1 3 362.426 3.583 20 0 FHADHM Cc1[nH]c(C(=O)[C@H](C)N2CC[C@@H](c3ccccc3C)C2)c(C)c1C(=O)[O-] ZINC000738768681 599718334 /nfs/dbraw/zinc/71/83/34/599718334.db2.gz MSTHZEQGOZJWOK-JKSUJKDBSA-N -1 3 354.450 3.699 20 0 FHADHM Cc1cscc1NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)CC(C)C ZINC000826321012 607396741 /nfs/dbraw/zinc/39/67/41/607396741.db2.gz NNTSGXYHWSARIQ-UHFFFAOYSA-N -1 3 370.482 3.927 20 0 FHADHM Cc1cscc1NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)CC(C)C ZINC000826321012 607396743 /nfs/dbraw/zinc/39/67/43/607396743.db2.gz NNTSGXYHWSARIQ-UHFFFAOYSA-N -1 3 370.482 3.927 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1COC(=O)c1cncc(-c2ccccc2)c1 ZINC000826254674 607407761 /nfs/dbraw/zinc/40/77/61/607407761.db2.gz WHEHSZXJUYZVMP-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1COC(=O)c1cncc(-c2ccccc2)c1 ZINC000826254674 607407763 /nfs/dbraw/zinc/40/77/63/607407763.db2.gz WHEHSZXJUYZVMP-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1COC(=O)C[C@H](C)c1ccc(F)cc1 ZINC000826253640 607407819 /nfs/dbraw/zinc/40/78/19/607407819.db2.gz XTLGFRQFFHDOFG-ZDUSSCGKSA-N -1 3 354.385 3.551 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1COC(=O)C[C@H](C)c1ccc(F)cc1 ZINC000826253640 607407820 /nfs/dbraw/zinc/40/78/20/607407820.db2.gz XTLGFRQFFHDOFG-ZDUSSCGKSA-N -1 3 354.385 3.551 20 0 FHADHM C[C@@H](C(=O)[O-])N1CCN([C@@H](c2ccccc2)c2ccccc2Cl)CC1 ZINC000237528139 599951753 /nfs/dbraw/zinc/95/17/53/599951753.db2.gz QRKFLISBANSTPF-KXBFYZLASA-N -1 3 358.869 3.520 20 0 FHADHM COc1cc2c(cc1OC)[C@H](CC(=O)[O-])N(Cc1cccc(C)c1)CC2 ZINC000517750408 599984608 /nfs/dbraw/zinc/98/46/08/599984608.db2.gz HYFBZQKXWRCHBE-SFHVURJKSA-N -1 3 355.434 3.586 20 0 FHADHM O=C([O-])c1ccc(CN(CCCO)C(c2ccccc2)c2ccccc2)o1 ZINC000740123327 600014557 /nfs/dbraw/zinc/01/45/57/600014557.db2.gz GFLPJNBARAFJAF-UHFFFAOYSA-N -1 3 365.429 3.952 20 0 FHADHM O=C([O-])c1ccccc1NC(=O)CN[C@@H](c1ccc(Cl)cc1)C1CC1 ZINC000739306618 600049099 /nfs/dbraw/zinc/04/90/99/600049099.db2.gz GOQXKSWUEDHEKI-GOSISDBHSA-N -1 3 358.825 3.718 20 0 FHADHM CC(=O)N1CCCCC[C@H]1C1CCN([C@@H](C)c2ccc(C(=O)[O-])o2)CC1 ZINC000736136198 600077187 /nfs/dbraw/zinc/07/71/87/600077187.db2.gz VFWSDBYUOXGBQO-YOEHRIQHSA-N -1 3 362.470 3.542 20 0 FHADHM CC(C)(C)c1ccc(C(=O)NC2(c3cccc(-c4nnn[n-]4)c3)CC2)s1 ZINC000824136393 607419046 /nfs/dbraw/zinc/41/90/46/607419046.db2.gz PFFSJNWCOQWRMN-UHFFFAOYSA-N -1 3 367.478 3.645 20 0 FHADHM CC(C)(C)c1ccc(C(=O)NC2(c3cccc(-c4nn[n-]n4)c3)CC2)s1 ZINC000824136393 607419047 /nfs/dbraw/zinc/41/90/47/607419047.db2.gz PFFSJNWCOQWRMN-UHFFFAOYSA-N -1 3 367.478 3.645 20 0 FHADHM O=C(NC1(c2cccc(-c3nnn[n-]3)c2)CC1)c1cc(Cl)cc(Cl)c1 ZINC000826428108 607424493 /nfs/dbraw/zinc/42/44/93/607424493.db2.gz OZJGRZZXRDYKIN-UHFFFAOYSA-N -1 3 374.231 3.593 20 0 FHADHM O=C(NC1(c2cccc(-c3nn[n-]n3)c2)CC1)c1cc(Cl)cc(Cl)c1 ZINC000826428108 607424494 /nfs/dbraw/zinc/42/44/94/607424494.db2.gz OZJGRZZXRDYKIN-UHFFFAOYSA-N -1 3 374.231 3.593 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)CCCc2sccc2C)s1 ZINC000825693730 607429965 /nfs/dbraw/zinc/42/99/65/607429965.db2.gz BQJAZALZXUUKJM-UHFFFAOYSA-N -1 3 361.496 3.822 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)CCCc2sccc2C)s1 ZINC000825693730 607429966 /nfs/dbraw/zinc/42/99/66/607429966.db2.gz BQJAZALZXUUKJM-UHFFFAOYSA-N -1 3 361.496 3.822 20 0 FHADHM C[C@H]1CCCC[C@]1(CNC(=O)OC(C)(C)C)NCc1ccc(C(=O)[O-])o1 ZINC000387861909 600315780 /nfs/dbraw/zinc/31/57/80/600315780.db2.gz NIKCDFKUWWACBM-ORAYPTAESA-N -1 3 366.458 3.541 20 0 FHADHM C[C@H](Sc1ccccc1Cl)C(=O)N(C)c1ccc(-c2nnn[n-]2)cc1 ZINC000824762632 607433297 /nfs/dbraw/zinc/43/32/97/607433297.db2.gz IAPUGFDBYBZXEC-NSHDSACASA-N -1 3 373.869 3.664 20 0 FHADHM C[C@H](Sc1ccccc1Cl)C(=O)N(C)c1ccc(-c2nn[n-]n2)cc1 ZINC000824762632 607433299 /nfs/dbraw/zinc/43/32/99/607433299.db2.gz IAPUGFDBYBZXEC-NSHDSACASA-N -1 3 373.869 3.664 20 0 FHADHM C[C@H](C(=O)Nc1ccccc1Sc1ccccc1)N(C)C[C@H](C)C(=O)[O-] ZINC000263124812 600363440 /nfs/dbraw/zinc/36/34/40/600363440.db2.gz COKQHEAPYPJPBK-LSDHHAIUSA-N -1 3 372.490 3.817 20 0 FHADHM CCCCCC(=O)NC1CCN([C@@H](C(=O)[O-])c2cccc(Cl)c2)CC1 ZINC000736984509 600402574 /nfs/dbraw/zinc/40/25/74/600402574.db2.gz KZBNEADTMGRVHK-GOSISDBHSA-N -1 3 366.889 3.627 20 0 FHADHM CCOc1cc(CN[C@@H](C(=O)[O-])c2ccc(F)cc2)ccc1OC(F)F ZINC000737192091 600425314 /nfs/dbraw/zinc/42/53/14/600425314.db2.gz RMHWVERQRWGTCD-MRXNPFEDSA-N -1 3 369.339 3.741 20 0 FHADHM CCOc1ccc(CN[C@H](C(=O)[O-])c2ccc(Br)cc2)cc1 ZINC000426810295 600428475 /nfs/dbraw/zinc/42/84/75/600428475.db2.gz YOSUVYGWWWOMST-INIZCTEOSA-N -1 3 364.239 3.763 20 0 FHADHM O=C([O-])c1cc(Cl)cc(Cl)c1NC(=O)CN(CC1CC1)CC1CC1 ZINC000739272602 600630638 /nfs/dbraw/zinc/63/06/38/600630638.db2.gz DKCKQRCGXHRPGG-UHFFFAOYSA-N -1 3 371.264 3.752 20 0 FHADHM Cc1cccc([C@H](C)N[C@H]2CCN(c3sccc3C(=O)[O-])C2=O)c1C ZINC000832966299 600694116 /nfs/dbraw/zinc/69/41/16/600694116.db2.gz MJFQFCCSVGSUNH-BBRMVZONSA-N -1 3 358.463 3.519 20 0 FHADHM O=C([O-])[C@H](NCCOc1ccc(C(F)(F)F)cc1)c1ccccc1F ZINC000833165286 600739893 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CCCc1c(C(=O)Nc2cc(CN(C)C)ccc2C)[nH]c(C)c1C(=O)[O-] ZINC000829562581 601148329 /nfs/dbraw/zinc/14/83/29/601148329.db2.gz LFIPCOPWFJKWFK-UHFFFAOYSA-N -1 3 357.454 3.596 20 0 FHADHM Cc1cncc(NCc2cccc(OCc3cccc(-c4nnn[n-]4)c3)c2)c1 ZINC000822399528 607493112 /nfs/dbraw/zinc/49/31/12/607493112.db2.gz ISCBARDTIQUMHM-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM Cc1cncc(NCc2cccc(OCc3cccc(-c4nn[n-]n4)c3)c2)c1 ZINC000822399528 607493113 /nfs/dbraw/zinc/49/31/13/607493113.db2.gz ISCBARDTIQUMHM-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM C[C@@H](C(=O)[O-])[C@H](NCC(=O)N[C@@H](C)c1ccc(Cl)cc1)c1ccccc1 ZINC000827637900 601201861 /nfs/dbraw/zinc/20/18/61/601201861.db2.gz XKTDHIRNUXJTFQ-TYILLQQXSA-N -1 3 374.868 3.569 20 0 FHADHM Cc1ccc(NC(=O)CN[C@@H](c2ccccc2)[C@H](C)C(=O)[O-])c(Cl)c1 ZINC000832943563 601206469 /nfs/dbraw/zinc/20/64/69/601206469.db2.gz GUXDXHWMVRHMKU-SCLBCKFNSA-N -1 3 360.841 3.639 20 0 FHADHM Cc1ccc(C)c(NC(=O)[C@H](c2ccccc2)N2C[C@H](C)[C@H](C(=O)[O-])C2)c1 ZINC000832926640 601538515 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CN(C[C@H](O)c1cccc(Cl)c1)[C@H](C(=O)[O-])c1cc(F)c(F)c(F)c1 ZINC000830714816 601902603 /nfs/dbraw/zinc/90/26/03/601902603.db2.gz YXRGYSKBISPHNG-HOCLYGCPSA-N -1 3 373.758 3.548 20 0 FHADHM C[C@H](c1nnc(-c2ccc(Cl)cc2Cl)o1)N1CC[C@@](C)(C(=O)[O-])C1 ZINC000827966708 601919625 /nfs/dbraw/zinc/91/96/25/601919625.db2.gz UEDICSLEMRFLIX-JDNHERCYSA-N -1 3 370.236 3.901 20 0 FHADHM C[C@]1(C(=O)[O-])CCN([C@H](C(=O)c2c[nH]c3ccccc23)c2ccccc2)C1 ZINC000263571873 601920980 /nfs/dbraw/zinc/92/09/80/601920980.db2.gz KAHRSHUUIQYWCV-UGKGYDQZSA-N -1 3 362.429 3.889 20 0 FHADHM CCCCc1noc([C@@H](C)SCc2ccc(OC)c(-c3nnn[n-]3)c2)n1 ZINC000825296758 607536061 /nfs/dbraw/zinc/53/60/61/607536061.db2.gz VBUIQMFWYBQNPR-LLVKDONJSA-N -1 3 374.470 3.595 20 0 FHADHM CCCCc1noc([C@@H](C)SCc2ccc(OC)c(-c3nn[n-]n3)c2)n1 ZINC000825296758 607536063 /nfs/dbraw/zinc/53/60/63/607536063.db2.gz VBUIQMFWYBQNPR-LLVKDONJSA-N -1 3 374.470 3.595 20 0 FHADHM O=C([O-])[C@@H](NCc1ccc2c(c1)OCO2)c1cc(Cl)cc(Cl)c1 ZINC000833169855 601971981 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COC(=O)CCC1CCN([C@@H](C(=O)[O-])c2cc(Cl)cc(Cl)c2)CC1 ZINC000831151757 602049763 /nfs/dbraw/zinc/04/97/63/602049763.db2.gz BZJVGRKUSRXJBX-MRXNPFEDSA-N -1 3 374.264 3.784 20 0 FHADHM Cc1cc(C)n(-c2ccccc2CN[C@@H](C(=O)[O-])c2ccc(F)cc2)n1 ZINC000832880101 602131699 /nfs/dbraw/zinc/13/16/99/602131699.db2.gz OCOCAFSGANAPFQ-LJQANCHMSA-N -1 3 353.397 3.544 20 0 FHADHM COc1ccc(CNc2ccc3c4c(cccc42)CC3)cc1-c1nnn[n-]1 ZINC000826203762 607547385 /nfs/dbraw/zinc/54/73/85/607547385.db2.gz FGIGNRJIVJGFBT-UHFFFAOYSA-N -1 3 357.417 3.739 20 0 FHADHM COc1ccc(CNc2ccc3c4c(cccc42)CC3)cc1-c1nn[n-]n1 ZINC000826203762 607547386 /nfs/dbraw/zinc/54/73/86/607547386.db2.gz FGIGNRJIVJGFBT-UHFFFAOYSA-N -1 3 357.417 3.739 20 0 FHADHM COc1cc(OC)cc([C@@H](NCc2ccc(OC(C)(C)C)cc2)C(=O)[O-])c1 ZINC000832058070 602168760 /nfs/dbraw/zinc/16/87/60/602168760.db2.gz VEXBBWRYPBCXPA-LJQANCHMSA-N -1 3 373.449 3.797 20 0 FHADHM O=C([O-])N1CCC(CCN[C@H](c2ccc(F)cc2)c2ccccn2)CC1 ZINC000740503284 602184747 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C[C@H](Cc1nc(-c2cccc(-c3nn[n-]n3)c2)cs1)n1cc(Cl)cn1 ZINC000824466813 607643659 /nfs/dbraw/zinc/64/36/59/607643659.db2.gz ZCXHFFZKJSIRAU-SNVBAGLBSA-N -1 3 371.857 3.644 20 0 FHADHM COc1ccccc1CNc1nc(-c2cccc(-c3nnn[n-]3)c2)cs1 ZINC000826220309 607644271 /nfs/dbraw/zinc/64/42/71/607644271.db2.gz JKTOEQQLXFTTBG-UHFFFAOYSA-N -1 3 364.434 3.611 20 0 FHADHM COc1ccccc1CNc1nc(-c2cccc(-c3nn[n-]n3)c2)cs1 ZINC000826220309 607644273 /nfs/dbraw/zinc/64/42/73/607644273.db2.gz JKTOEQQLXFTTBG-UHFFFAOYSA-N -1 3 364.434 3.611 20 0 FHADHM O=C(CSc1nc2ccc(Cl)cc2o1)c1cccc(-c2nnn[n-]2)c1 ZINC000826421036 607655851 /nfs/dbraw/zinc/65/58/51/607655851.db2.gz OAFRFXPGBHMZIT-UHFFFAOYSA-N -1 3 371.809 3.636 20 0 FHADHM O=C(CSc1nc2ccc(Cl)cc2o1)c1cccc(-c2nn[n-]n2)c1 ZINC000826421036 607655852 /nfs/dbraw/zinc/65/58/52/607655852.db2.gz OAFRFXPGBHMZIT-UHFFFAOYSA-N -1 3 371.809 3.636 20 0 FHADHM CN(C(=O)c1ccc(NC(=O)[O-])cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000827938557 603885696 /nfs/dbraw/zinc/88/56/96/603885696.db2.gz NCWIMMPINAHUMY-LJQANCHMSA-N -1 3 367.449 3.513 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N(C)[C@@H](C)c1ccc(Cl)cc1 ZINC000826243279 607660089 /nfs/dbraw/zinc/66/00/89/607660089.db2.gz BJXQRPHPCQHMME-LBPRGKRZSA-N -1 3 355.829 3.662 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N(C)[C@@H](C)c1ccc(Cl)cc1 ZINC000826243279 607660090 /nfs/dbraw/zinc/66/00/90/607660090.db2.gz BJXQRPHPCQHMME-LBPRGKRZSA-N -1 3 355.829 3.662 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1CCC[C@H]1c1ccccc1Cl ZINC000826244914 607666608 /nfs/dbraw/zinc/66/66/08/607666608.db2.gz HQKZIXSVSOVVOS-KRWDZBQOSA-N -1 3 367.840 3.806 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1CCC[C@H]1c1ccccc1Cl ZINC000826244914 607666610 /nfs/dbraw/zinc/66/66/10/607666610.db2.gz HQKZIXSVSOVVOS-KRWDZBQOSA-N -1 3 367.840 3.806 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1CCC[C@@H]1c1ccccc1Cl ZINC000826244915 607666962 /nfs/dbraw/zinc/66/69/62/607666962.db2.gz HQKZIXSVSOVVOS-QGZVFWFLSA-N -1 3 367.840 3.806 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1CCC[C@@H]1c1ccccc1Cl ZINC000826244915 607666964 /nfs/dbraw/zinc/66/69/64/607666964.db2.gz HQKZIXSVSOVVOS-QGZVFWFLSA-N -1 3 367.840 3.806 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N(C1CC1)[C@@H]1CCCc2ccccc21 ZINC000826243843 607680226 /nfs/dbraw/zinc/68/02/26/607680226.db2.gz XLKVDAYXNJLVEN-HXUWFJFHSA-N -1 3 373.460 3.857 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N(C1CC1)[C@@H]1CCCc2ccccc21 ZINC000826243843 607680228 /nfs/dbraw/zinc/68/02/28/607680228.db2.gz XLKVDAYXNJLVEN-HXUWFJFHSA-N -1 3 373.460 3.857 20 0 FHADHM Cc1cccc(Oc2ccccc2NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)c1 ZINC000826301018 607682795 /nfs/dbraw/zinc/68/27/95/607682795.db2.gz OXVUYTDAABKWOA-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM Cc1cccc(Oc2ccccc2NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)c1 ZINC000826301018 607682796 /nfs/dbraw/zinc/68/27/96/607682796.db2.gz OXVUYTDAABKWOA-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM Cc1c([C@H](C)N[C@@H]2CCCN(C(=O)[O-])C2)cnn1-c1cc(C)ccc1C ZINC000832923688 604286451 /nfs/dbraw/zinc/28/64/51/604286451.db2.gz AOXMBNBSPMCDCP-DOTOQJQBSA-N -1 3 356.470 3.591 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1cccc(SC(F)F)c1 ZINC000826250450 607683838 /nfs/dbraw/zinc/68/38/38/607683838.db2.gz BQEVBUHFWPKKIH-UHFFFAOYSA-N -1 3 361.377 3.742 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1cccc(SC(F)F)c1 ZINC000826250450 607683840 /nfs/dbraw/zinc/68/38/40/607683840.db2.gz BQEVBUHFWPKKIH-UHFFFAOYSA-N -1 3 361.377 3.742 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1scnc1-c1ccccc1 ZINC000826251217 607683918 /nfs/dbraw/zinc/68/39/18/607683918.db2.gz ITVQAYOVTPHGBR-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1scnc1-c1ccccc1 ZINC000826251217 607683919 /nfs/dbraw/zinc/68/39/19/607683919.db2.gz ITVQAYOVTPHGBR-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM O=C([O-])c1cc(NC(=O)N2CCN(C3CCCCC3)CC2)ccc1Cl ZINC000833300542 604320968 /nfs/dbraw/zinc/32/09/68/604320968.db2.gz LRTDHJNRQMTDSC-UHFFFAOYSA-N -1 3 365.861 3.520 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1ccccc1OC(C)(C)C ZINC000826250866 607692819 /nfs/dbraw/zinc/69/28/19/607692819.db2.gz WJZHALNYPMHTBV-UHFFFAOYSA-N -1 3 351.410 3.605 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1ccccc1OC(C)(C)C ZINC000826250866 607692820 /nfs/dbraw/zinc/69/28/20/607692820.db2.gz WJZHALNYPMHTBV-UHFFFAOYSA-N -1 3 351.410 3.605 20 0 FHADHM C[C@@H](Oc1ccc(CN2CCC(OCc3ccccc3)CC2)cc1)C(=O)[O-] ZINC000833539892 604523164 /nfs/dbraw/zinc/52/31/64/604523164.db2.gz HVURCEGBGHQEIU-QGZVFWFLSA-N -1 3 369.461 3.720 20 0 FHADHM CCCN1CCN(c2ccccc2CNc2cccc(NC(=O)[O-])c2)CC1 ZINC000829507959 604643512 /nfs/dbraw/zinc/64/35/12/604643512.db2.gz LZHJWPQXVHCLQY-UHFFFAOYSA-N -1 3 368.481 3.921 20 0 FHADHM c1sc(CNC2(c3cccc(-c4nn[n-]n4)c3)CC2)nc1-c1ccccc1 ZINC000826518900 607706506 /nfs/dbraw/zinc/70/65/06/607706506.db2.gz BUYONZCLHQJTIA-UHFFFAOYSA-N -1 3 374.473 3.769 20 0 FHADHM CC[C@H](CC(=O)OCc1ccccc1-c1nnn[n-]1)c1ccc(OC)cc1 ZINC000825082187 607715006 /nfs/dbraw/zinc/71/50/06/607715006.db2.gz 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Cc1ccccc1-c1noc([C@H](C)N2CCC[C@@H](C(C)(C)C(=O)[O-])C2)n1 ZINC000652499842 604931873 /nfs/dbraw/zinc/93/18/73/604931873.db2.gz ORJASZSHVSIUPI-LSDHHAIUSA-N -1 3 357.454 3.929 20 0 FHADHM C[C@H](NCc1ccc(CCNC(=O)[O-])cc1)c1ccc2c(c1)OCCCO2 ZINC000825503818 604942984 /nfs/dbraw/zinc/94/29/84/604942984.db2.gz XQGCYIQBLRBDFX-HNNXBMFYSA-N -1 3 370.449 3.509 20 0 FHADHM O=C([O-])NCCc1ccc(CN[C@@H]2CCSc3c(F)cccc32)cc1 ZINC000832672433 604943110 /nfs/dbraw/zinc/94/31/10/604943110.db2.gz QFQJALQDPJEFRJ-QGZVFWFLSA-N -1 3 360.454 3.963 20 0 FHADHM CC(C)(C(=O)[O-])[C@@H]1CCCN(CC(=O)Nc2ccc3ccccc3c2)C1 ZINC000833421574 604953618 /nfs/dbraw/zinc/95/36/18/604953618.db2.gz RWFUIAXBROOAKX-QGZVFWFLSA-N -1 3 354.450 3.601 20 0 FHADHM COc1cc([C@H](C)N[C@H](C(=O)[O-])c2cccnc2)ccc1OC1CCCC1 ZINC000831955545 604993049 /nfs/dbraw/zinc/99/30/49/604993049.db2.gz LDFITVYHEQYBDX-XOBRGWDASA-N -1 3 370.449 3.888 20 0 FHADHM C[C@@]1(NCc2csc(COc3ccccc3)n2)CCCC[C@@H]1C(=O)[O-] ZINC000833568904 605059995 /nfs/dbraw/zinc/05/99/95/605059995.db2.gz IGTJVCHVBMJAAK-VQIMIIECSA-N -1 3 360.479 3.845 20 0 FHADHM CC(C)C[C@@H](NCC(=O)NCc1ccc(NC(=O)[O-])cc1)c1ccccc1 ZINC000833484870 605062460 /nfs/dbraw/zinc/06/24/60/605062460.db2.gz STAHZQQUIPPBML-LJQANCHMSA-N -1 3 369.465 3.770 20 0 FHADHM COc1cccc(CN(Cc2ccccc2CC(=O)[O-])C[C@H]2CCCO2)c1 ZINC000833735848 605065953 /nfs/dbraw/zinc/06/59/53/605065953.db2.gz ZCSRFDMPWOVPGW-OAQYLSRUSA-N -1 3 369.461 3.504 20 0 FHADHM CC(=O)Nc1cccc([C@@H](C)NCc2ccc([C@H](C)NC(=O)[O-])cc2)c1 ZINC000823618625 605114908 /nfs/dbraw/zinc/11/49/08/605114908.db2.gz YNZFDLGDIPWXPM-KGLIPLIRSA-N -1 3 355.438 3.824 20 0 FHADHM COc1ccc([C@H](C)NCc2ccc([C@H](C)NC(=O)[O-])cc2)cc1OC ZINC000829301298 605119977 /nfs/dbraw/zinc/11/99/77/605119977.db2.gz BNEDLAQMJZSUOK-KBPBESRZSA-N -1 3 358.438 3.883 20 0 FHADHM CC(C)N(C(=O)CN[C@@H](c1ccccc1)C(C)(C)C(=O)[O-])C1CCCC1 ZINC000833495585 605175908 /nfs/dbraw/zinc/17/59/08/605175908.db2.gz JNMYCJFSNWPTGT-IBGZPJMESA-N -1 3 360.498 3.608 20 0 FHADHM COCc1cccc(CN[C@H](C(=O)[O-])c2cccc(Br)c2)c1 ZINC000683175357 605180912 /nfs/dbraw/zinc/18/09/12/605180912.db2.gz VWXBEUXVARVZEH-INIZCTEOSA-N -1 3 364.239 3.511 20 0 FHADHM C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC000824764928 607743875 /nfs/dbraw/zinc/74/38/75/607743875.db2.gz ZYWKUMFSYZODIS-CQSZACIVSA-N -1 3 372.432 3.695 20 0 FHADHM C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC000824764928 607743876 /nfs/dbraw/zinc/74/38/76/607743876.db2.gz ZYWKUMFSYZODIS-CQSZACIVSA-N -1 3 372.432 3.695 20 0 FHADHM COc1cc(F)cc(CN[C@@H](C(=O)[O-])c2ccccc2C(F)(F)F)c1 ZINC000833730044 605262481 /nfs/dbraw/zinc/26/24/81/605262481.db2.gz ZNUMSHLMCHVYRZ-OAHLLOKOSA-N -1 3 357.303 3.769 20 0 FHADHM Cc1oc(-c2ccccc2)nc1CN1C[C@@H]2CCC[C@H](NC(=O)[O-])[C@H]2C1 ZINC000833937384 605449814 /nfs/dbraw/zinc/44/98/14/605449814.db2.gz WFROTDUTQWDZED-ULQDDVLXSA-N -1 3 355.438 3.518 20 0 FHADHM C[C@@H](NC(=O)[O-])[C@@H]1CCCN(Cc2ccc(-c3ccncc3)cc2F)C1 ZINC000833811451 605596194 /nfs/dbraw/zinc/59/61/94/605596194.db2.gz CPHNOKRDEYGQHH-RHSMWYFYSA-N -1 3 357.429 3.756 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N1CC[C@@H]1c1cccc(F)c1 ZINC000826452956 607764972 /nfs/dbraw/zinc/76/49/72/607764972.db2.gz PJIZIOVNAAMWPJ-OAHLLOKOSA-N -1 3 372.791 3.638 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N1CC[C@@H]1c1cccc(F)c1 ZINC000826452956 607764973 /nfs/dbraw/zinc/76/49/73/607764973.db2.gz PJIZIOVNAAMWPJ-OAHLLOKOSA-N -1 3 372.791 3.638 20 0 FHADHM C[C@H](NC(=O)[O-])[C@H]1CCCN(Cc2ccccc2OCc2cccnc2)C1 ZINC000833813540 605601356 /nfs/dbraw/zinc/60/13/56/605601356.db2.gz PSUCHVWFKNSSPO-WMZOPIPTSA-N -1 3 369.465 3.529 20 0 FHADHM O=C([O-])Nc1ccc(CN2CCCCC[C@H]2C[C@@H](O)c2ccco2)cn1 ZINC000834260853 605675201 /nfs/dbraw/zinc/67/52/01/605675201.db2.gz ZSJSBECSPUYXGE-JKSUJKDBSA-N -1 3 359.426 3.633 20 0 FHADHM O=C(Nc1nc(-c2cccc(-c3nnn[n-]3)c2)cs1)[C@H]1CC12CCCC2 ZINC000826459722 607769893 /nfs/dbraw/zinc/76/98/93/607769893.db2.gz XBFIEVOHHILTIZ-CYBMUJFWSA-N -1 3 366.450 3.509 20 0 FHADHM O=C(Nc1nc(-c2cccc(-c3nn[n-]n3)c2)cs1)[C@H]1CC12CCCC2 ZINC000826459722 607769894 /nfs/dbraw/zinc/76/98/94/607769894.db2.gz XBFIEVOHHILTIZ-CYBMUJFWSA-N -1 3 366.450 3.509 20 0 FHADHM CCC(CC)CC(=O)Nc1nc(-c2cccc(-c3nnn[n-]3)c2)cs1 ZINC000825108617 607770255 /nfs/dbraw/zinc/77/02/55/607770255.db2.gz XZOZBLUVFYPEIM-UHFFFAOYSA-N -1 3 356.455 3.755 20 0 FHADHM CCC(CC)CC(=O)Nc1nc(-c2cccc(-c3nn[n-]n3)c2)cs1 ZINC000825108617 607770256 /nfs/dbraw/zinc/77/02/56/607770256.db2.gz XZOZBLUVFYPEIM-UHFFFAOYSA-N -1 3 356.455 3.755 20 0 FHADHM Cc1cc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)ccc1NC(=O)[O-] ZINC000829944401 605874145 /nfs/dbraw/zinc/87/41/45/605874145.db2.gz BCAAYEUFMDNQHH-IBGZPJMESA-N -1 3 367.449 3.652 20 0 FHADHM O=C([O-])Nc1cccc(CN2CCC[C@H](n3ccc(C(F)(F)F)n3)C2)c1 ZINC000834269109 605970283 /nfs/dbraw/zinc/97/02/83/605970283.db2.gz PAZGDLDEOPOHSN-AWEZNQCLSA-N -1 3 368.359 3.829 20 0 FHADHM Cc1cncc(CN[C@H](c2ccc(F)cc2)C2CCN(C(=O)[O-])CC2)c1 ZINC000833912612 605983512 /nfs/dbraw/zinc/98/35/12/605983512.db2.gz QKXZRPYCAQBYPK-LJQANCHMSA-N -1 3 357.429 3.750 20 0 FHADHM FC(F)(F)[C@@H]1CCC[C@@H](Nc2nc3ccccc3cc2-c2nnn[n-]2)C1 ZINC000822713916 606034817 /nfs/dbraw/zinc/03/48/17/606034817.db2.gz BMMBSPXICBGAMH-VXGBXAGGSA-N -1 3 362.359 3.948 20 0 FHADHM FC(F)(F)[C@@H]1CCC[C@@H](Nc2nc3ccccc3cc2-c2nn[n-]n2)C1 ZINC000822713916 606034821 /nfs/dbraw/zinc/03/48/21/606034821.db2.gz BMMBSPXICBGAMH-VXGBXAGGSA-N -1 3 362.359 3.948 20 0 FHADHM CC[C@H]1CN(c2ncc(-c3nnn[n-]3)cc2Cl)CC[C@@H]1c1ccccc1 ZINC000820995455 606038408 /nfs/dbraw/zinc/03/84/08/606038408.db2.gz ROKAIUYJZLVQBL-BBRMVZONSA-N -1 3 368.872 3.935 20 0 FHADHM CC[C@H]1CN(c2ncc(-c3nn[n-]n3)cc2Cl)CC[C@@H]1c1ccccc1 ZINC000820995455 606038416 /nfs/dbraw/zinc/03/84/16/606038416.db2.gz ROKAIUYJZLVQBL-BBRMVZONSA-N -1 3 368.872 3.935 20 0 FHADHM CN(Cc1nc(C(F)(F)F)cs1)c1c(Cl)cccc1-c1nnn[n-]1 ZINC000821617031 606044334 /nfs/dbraw/zinc/04/43/34/606044334.db2.gz TVDDSEYVCOWXER-UHFFFAOYSA-N -1 3 374.779 3.632 20 0 FHADHM CN(Cc1nc(C(F)(F)F)cs1)c1c(Cl)cccc1-c1nn[n-]n1 ZINC000821617031 606044340 /nfs/dbraw/zinc/04/43/40/606044340.db2.gz TVDDSEYVCOWXER-UHFFFAOYSA-N -1 3 374.779 3.632 20 0 FHADHM O=C([O-])N1CCC[C@H](N[C@@H](c2cccc(Cl)c2)c2ccccn2)CC1 ZINC000834100071 606044530 /nfs/dbraw/zinc/04/45/30/606044530.db2.gz RUGHVGGYZZEFSJ-WMZOPIPTSA-N -1 3 359.857 3.947 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)C/C=C\c2cccc(F)c2)s1 ZINC000821465469 606125959 /nfs/dbraw/zinc/12/59/59/606125959.db2.gz IKLFZJUEIQRTEZ-XQRVVYSFSA-N -1 3 357.414 3.672 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)C/C=C\c2cccc(F)c2)s1 ZINC000821465469 606125960 /nfs/dbraw/zinc/12/59/60/606125960.db2.gz IKLFZJUEIQRTEZ-XQRVVYSFSA-N -1 3 357.414 3.672 20 0 FHADHM C[C@@H](C(=O)OCc1ccc(-c2nnn[n-]2)cc1F)c1ccc(Cl)s1 ZINC000819882932 606149814 /nfs/dbraw/zinc/14/98/14/606149814.db2.gz CZCYOTAVHPGJKM-MRVPVSSYSA-N -1 3 366.805 3.568 20 0 FHADHM C[C@@H](C(=O)OCc1ccc(-c2nn[n-]n2)cc1F)c1ccc(Cl)s1 ZINC000819882932 606149816 /nfs/dbraw/zinc/14/98/16/606149816.db2.gz CZCYOTAVHPGJKM-MRVPVSSYSA-N -1 3 366.805 3.568 20 0 FHADHM C[C@H](SCC(=O)N(C)C1CCC(C)CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820689708 606179243 /nfs/dbraw/zinc/17/92/43/606179243.db2.gz BQTSWWQQJNLECS-UUCFBXCCSA-N -1 3 373.526 3.698 20 0 FHADHM C[C@H](SCC(=O)N(C)C1CCC(C)CC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820689708 606179244 /nfs/dbraw/zinc/17/92/44/606179244.db2.gz BQTSWWQQJNLECS-UUCFBXCCSA-N -1 3 373.526 3.698 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)c2ccc(OC(C)(C)C)cc2)s1 ZINC000821466298 606185425 /nfs/dbraw/zinc/18/54/25/606185425.db2.gz VQXJDGKNQRMKMR-UHFFFAOYSA-N -1 3 371.466 3.920 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)c2ccc(OC(C)(C)C)cc2)s1 ZINC000821466298 606185427 /nfs/dbraw/zinc/18/54/27/606185427.db2.gz VQXJDGKNQRMKMR-UHFFFAOYSA-N -1 3 371.466 3.920 20 0 FHADHM Cc1cncc(NC(=O)c2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)c1 ZINC000822399547 606188405 /nfs/dbraw/zinc/18/84/05/606188405.db2.gz JEKVMCXNPOUXRG-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccc2nc(C3CC3)cc(C(=O)Nc3ccccc3-c3nnn[n-]3)c2c1 ZINC000822280442 606207501 /nfs/dbraw/zinc/20/75/01/606207501.db2.gz NTBVAWIGZWLWEW-UHFFFAOYSA-N -1 3 370.416 3.853 20 0 FHADHM Cc1ccc2nc(C3CC3)cc(C(=O)Nc3ccccc3-c3nn[n-]n3)c2c1 ZINC000822280442 606207503 /nfs/dbraw/zinc/20/75/03/606207503.db2.gz NTBVAWIGZWLWEW-UHFFFAOYSA-N -1 3 370.416 3.853 20 0 FHADHM CC(C)[C@H](CNc1nc2ccccc2cc1-c1nnn[n-]1)c1cccnc1 ZINC000820021474 606229255 /nfs/dbraw/zinc/22/92/55/606229255.db2.gz USRMRHPILUBVKD-KRWDZBQOSA-N -1 3 359.437 3.662 20 0 FHADHM CC(C)[C@H](CNc1nc2ccccc2cc1-c1nn[n-]n1)c1cccnc1 ZINC000820021474 606229256 /nfs/dbraw/zinc/22/92/56/606229256.db2.gz USRMRHPILUBVKD-KRWDZBQOSA-N -1 3 359.437 3.662 20 0 FHADHM CCCN1C(=O)c2ccc(Cl)cc2N[C@H]1c1cc(-c2nnn[n-]2)cs1 ZINC000821110277 606243564 /nfs/dbraw/zinc/24/35/64/606243564.db2.gz ZBXNWZNWXDKEIR-OAHLLOKOSA-N -1 3 374.857 3.558 20 0 FHADHM CCCN1C(=O)c2ccc(Cl)cc2N[C@H]1c1cc(-c2nn[n-]n2)cs1 ZINC000821110277 606243565 /nfs/dbraw/zinc/24/35/65/606243565.db2.gz ZBXNWZNWXDKEIR-OAHLLOKOSA-N -1 3 374.857 3.558 20 0 FHADHM Cn1cc(-c2nnn[n-]2)cc1-c1nc(-c2ccc(-c3ccccc3)cc2)no1 ZINC000822623214 606251930 /nfs/dbraw/zinc/25/19/30/606251930.db2.gz RPSNXFBHQVZFLH-UHFFFAOYSA-N -1 3 369.388 3.589 20 0 FHADHM Cn1cc(-c2nn[n-]n2)cc1-c1nc(-c2ccc(-c3ccccc3)cc2)no1 ZINC000822623214 606251932 /nfs/dbraw/zinc/25/19/32/606251932.db2.gz RPSNXFBHQVZFLH-UHFFFAOYSA-N -1 3 369.388 3.589 20 0 FHADHM CCCCN(C(=O)c1cc(-c2nnn[n-]2)cn1C)[C@H](CC)c1ccccc1 ZINC000821062179 606253332 /nfs/dbraw/zinc/25/33/32/606253332.db2.gz VGCHUENQAKDIFO-QGZVFWFLSA-N -1 3 366.469 3.599 20 0 FHADHM CCCCN(C(=O)c1cc(-c2nn[n-]n2)cn1C)[C@H](CC)c1ccccc1 ZINC000821062179 606253333 /nfs/dbraw/zinc/25/33/33/606253333.db2.gz VGCHUENQAKDIFO-QGZVFWFLSA-N -1 3 366.469 3.599 20 0 FHADHM CC(=CC(=O)Nc1ccc(F)cc1-c1nnn[n-]1)c1cccc(Cl)c1 ZINC000819765719 606262742 /nfs/dbraw/zinc/26/27/42/606262742.db2.gz QOVMVGAAWPOYLP-YFHOEESVSA-N -1 3 357.776 3.701 20 0 FHADHM CC(=CC(=O)Nc1ccc(F)cc1-c1nn[n-]n1)c1cccc(Cl)c1 ZINC000819765719 606262744 /nfs/dbraw/zinc/26/27/44/606262744.db2.gz QOVMVGAAWPOYLP-YFHOEESVSA-N -1 3 357.776 3.701 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)c1cc2cc(Cl)ccc2o1 ZINC000823343612 606262856 /nfs/dbraw/zinc/26/28/56/606262856.db2.gz AZMSJEUCEAWGCJ-UHFFFAOYSA-N -1 3 357.732 3.658 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)c1cc2cc(Cl)ccc2o1 ZINC000823343612 606262858 /nfs/dbraw/zinc/26/28/58/606262858.db2.gz AZMSJEUCEAWGCJ-UHFFFAOYSA-N -1 3 357.732 3.658 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)c1cc2c(cccc2F)s1 ZINC000823344603 606263639 /nfs/dbraw/zinc/26/36/39/606263639.db2.gz YRHITLNBLYWFQS-UHFFFAOYSA-N -1 3 357.345 3.612 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)c1cc2c(cccc2F)s1 ZINC000823344603 606263641 /nfs/dbraw/zinc/26/36/41/606263641.db2.gz YRHITLNBLYWFQS-UHFFFAOYSA-N -1 3 357.345 3.612 20 0 FHADHM CC(C)c1cccc(O[C@H](C)C(=O)Nc2ccc(F)cc2-c2nnn[n-]2)c1 ZINC000820536820 606269560 /nfs/dbraw/zinc/26/95/60/606269560.db2.gz XTEFCNYDCKJTJL-GFCCVEGCSA-N -1 3 369.400 3.535 20 0 FHADHM CC(C)c1cccc(O[C@H](C)C(=O)Nc2ccc(F)cc2-c2nn[n-]n2)c1 ZINC000820536820 606269561 /nfs/dbraw/zinc/26/95/61/606269561.db2.gz XTEFCNYDCKJTJL-GFCCVEGCSA-N -1 3 369.400 3.535 20 0 FHADHM Fc1cc2nc(C(Cl)=Cc3cc(-c4nnn[n-]4)cs3)[nH]c2cc1F ZINC000822753584 606305919 /nfs/dbraw/zinc/30/59/19/606305919.db2.gz OMGPQJWQZUFAJO-KRXBUXKQSA-N -1 3 364.768 3.820 20 0 FHADHM Fc1cc2nc(C(Cl)=Cc3cc(-c4nn[n-]n4)cs3)[nH]c2cc1F ZINC000822753584 606305921 /nfs/dbraw/zinc/30/59/21/606305921.db2.gz OMGPQJWQZUFAJO-KRXBUXKQSA-N -1 3 364.768 3.820 20 0 FHADHM CCCC(CCC)S[C@H]1CCN(c2sccc2-c2nnn[n-]2)C1=O ZINC000821014433 606312599 /nfs/dbraw/zinc/31/25/99/606312599.db2.gz HCIYYVWPQDHOOS-ZDUSSCGKSA-N -1 3 365.528 3.736 20 0 FHADHM CCCC(CCC)S[C@H]1CCN(c2sccc2-c2nn[n-]n2)C1=O ZINC000821014433 606312601 /nfs/dbraw/zinc/31/26/01/606312601.db2.gz HCIYYVWPQDHOOS-ZDUSSCGKSA-N -1 3 365.528 3.736 20 0 FHADHM C[C@@H](c1ccc2ccccc2c1)N(C(=O)c1cc(-c2nnn[n-]2)c[nH]1)C1CC1 ZINC000820563531 606316148 /nfs/dbraw/zinc/31/61/48/606316148.db2.gz RTALESKHBAIJMY-ZDUSSCGKSA-N -1 3 372.432 3.714 20 0 FHADHM C[C@@H](c1ccc2ccccc2c1)N(C(=O)c1cc(-c2nn[n-]n2)c[nH]1)C1CC1 ZINC000820563531 606316150 /nfs/dbraw/zinc/31/61/50/606316150.db2.gz RTALESKHBAIJMY-ZDUSSCGKSA-N -1 3 372.432 3.714 20 0 FHADHM C[C@H](Sc1cccc(-c2nnn[n-]2)c1)C(=O)Nc1ccc(Cl)cc1 ZINC000820554897 606324834 /nfs/dbraw/zinc/32/48/34/606324834.db2.gz AYJKZXPRVFZEPN-JTQLQIEISA-N -1 3 359.842 3.639 20 0 FHADHM C[C@H](Sc1cccc(-c2nn[n-]n2)c1)C(=O)Nc1ccc(Cl)cc1 ZINC000820554897 606324836 /nfs/dbraw/zinc/32/48/36/606324836.db2.gz AYJKZXPRVFZEPN-JTQLQIEISA-N -1 3 359.842 3.639 20 0 FHADHM C[C@H](Sc1cccc(-c2nnn[n-]2)c1)C(=O)Nc1cccc(Cl)c1 ZINC000820557020 606325502 /nfs/dbraw/zinc/32/55/02/606325502.db2.gz XHHKKXQSZVMYEZ-JTQLQIEISA-N -1 3 359.842 3.639 20 0 FHADHM C[C@H](Sc1cccc(-c2nn[n-]n2)c1)C(=O)Nc1cccc(Cl)c1 ZINC000820557020 606325504 /nfs/dbraw/zinc/32/55/04/606325504.db2.gz XHHKKXQSZVMYEZ-JTQLQIEISA-N -1 3 359.842 3.639 20 0 FHADHM C[C@H](Sc1cccc(-c2nnn[n-]2)c1)C(=O)Nc1ccccc1Cl ZINC000820554899 606326670 /nfs/dbraw/zinc/32/66/70/606326670.db2.gz AYQAVONQVQWZII-JTQLQIEISA-N -1 3 359.842 3.639 20 0 FHADHM C[C@H](Sc1cccc(-c2nn[n-]n2)c1)C(=O)Nc1ccccc1Cl ZINC000820554899 606326673 /nfs/dbraw/zinc/32/66/73/606326673.db2.gz AYQAVONQVQWZII-JTQLQIEISA-N -1 3 359.842 3.639 20 0 FHADHM Cc1ccc(NC(=O)CSc2cccc(-c3nnn[n-]3)c2)cc1Cl ZINC000822249000 606327566 /nfs/dbraw/zinc/32/75/66/606327566.db2.gz XQLXFSLCCOFFLS-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1ccc(NC(=O)CSc2cccc(-c3nn[n-]n3)c2)cc1Cl ZINC000822249000 606327568 /nfs/dbraw/zinc/32/75/68/606327568.db2.gz XQLXFSLCCOFFLS-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM C[C@H](OC(=O)C(C)(C)c1cccc(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820481286 606340325 /nfs/dbraw/zinc/34/03/25/606340325.db2.gz UMYQPBVMUORUJJ-LBPRGKRZSA-N -1 3 354.385 3.588 20 0 FHADHM C[C@H](OC(=O)C(C)(C)c1cccc(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820481286 606340327 /nfs/dbraw/zinc/34/03/27/606340327.db2.gz UMYQPBVMUORUJJ-LBPRGKRZSA-N -1 3 354.385 3.588 20 0 FHADHM C[C@@H](OC(=O)[C@H]1SCCc2sccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488837 606340485 /nfs/dbraw/zinc/34/04/85/606340485.db2.gz VIKGGWXHABYOOF-BMIGLBTASA-N -1 3 372.475 3.563 20 0 FHADHM C[C@@H](OC(=O)[C@H]1SCCc2sccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488837 606340487 /nfs/dbraw/zinc/34/04/87/606340487.db2.gz VIKGGWXHABYOOF-BMIGLBTASA-N -1 3 372.475 3.563 20 0 FHADHM C[C@H](OC(=O)[C@H]1SCCc2sccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488838 606340649 /nfs/dbraw/zinc/34/06/49/606340649.db2.gz VIKGGWXHABYOOF-BONVTDFDSA-N -1 3 372.475 3.563 20 0 FHADHM C[C@H](OC(=O)[C@H]1SCCc2sccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488838 606340651 /nfs/dbraw/zinc/34/06/51/606340651.db2.gz VIKGGWXHABYOOF-BONVTDFDSA-N -1 3 372.475 3.563 20 0 FHADHM COc1ccccc1[C@@H](C)CC(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821882475 606341449 /nfs/dbraw/zinc/34/14/49/606341449.db2.gz BXWSRZVOQLMZLF-KBPBESRZSA-N -1 3 366.421 3.673 20 0 FHADHM COc1ccccc1[C@@H](C)CC(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821882475 606341450 /nfs/dbraw/zinc/34/14/50/606341450.db2.gz BXWSRZVOQLMZLF-KBPBESRZSA-N -1 3 366.421 3.673 20 0 FHADHM COc1ccccc1[C@H](C)CC(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821882476 606341674 /nfs/dbraw/zinc/34/16/74/606341674.db2.gz BXWSRZVOQLMZLF-KGLIPLIRSA-N -1 3 366.421 3.673 20 0 FHADHM COc1ccccc1[C@H](C)CC(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821882476 606341675 /nfs/dbraw/zinc/34/16/75/606341675.db2.gz BXWSRZVOQLMZLF-KGLIPLIRSA-N -1 3 366.421 3.673 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CC[C@@H](c2ccccc2)[C@@H]1C ZINC000822218195 606344996 /nfs/dbraw/zinc/34/49/96/606344996.db2.gz ZNDQFJRMTNYJJL-WMLDXEAASA-N -1 3 362.437 3.585 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CC[C@@H](c2ccccc2)[C@@H]1C ZINC000822218195 606344998 /nfs/dbraw/zinc/34/49/98/606344998.db2.gz ZNDQFJRMTNYJJL-WMLDXEAASA-N -1 3 362.437 3.585 20 0 FHADHM C[C@@H](OC(=O)[C@H]1SCCc2ccccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488141 606350413 /nfs/dbraw/zinc/35/04/13/606350413.db2.gz LOPQJKCFJRCUEZ-PXAZEXFGSA-N -1 3 366.446 3.502 20 0 FHADHM C[C@@H](OC(=O)[C@H]1SCCc2ccccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488141 606350414 /nfs/dbraw/zinc/35/04/14/606350414.db2.gz LOPQJKCFJRCUEZ-PXAZEXFGSA-N -1 3 366.446 3.502 20 0 FHADHM C[C@H](OC(=O)C1(c2ccc(F)cc2)CCC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488656 606352340 /nfs/dbraw/zinc/35/23/40/606352340.db2.gz RFJHINPWQAYQIS-ZDUSSCGKSA-N -1 3 366.396 3.732 20 0 FHADHM C[C@H](OC(=O)C1(c2ccc(F)cc2)CCC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488656 606352341 /nfs/dbraw/zinc/35/23/41/606352341.db2.gz RFJHINPWQAYQIS-ZDUSSCGKSA-N -1 3 366.396 3.732 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccc(Cl)s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488988 606357451 /nfs/dbraw/zinc/35/74/51/606357451.db2.gz XPVGTNFCWMWWBO-UJICNMFASA-N -1 3 360.826 3.899 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccc(Cl)s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488988 606357453 /nfs/dbraw/zinc/35/74/53/606357453.db2.gz XPVGTNFCWMWWBO-UJICNMFASA-N -1 3 360.826 3.899 20 0 FHADHM CCCSCC(=O)Oc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000821139381 606361153 /nfs/dbraw/zinc/36/11/53/606361153.db2.gz WNRYABJBPIHOST-UHFFFAOYSA-N -1 3 370.434 3.708 20 0 FHADHM CCCSCC(=O)Oc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000821139381 606361154 /nfs/dbraw/zinc/36/11/54/606361154.db2.gz WNRYABJBPIHOST-UHFFFAOYSA-N -1 3 370.434 3.708 20 0 FHADHM Cc1cc(C(=O)N(CC(C)C)c2ccc(-c3nnn[n-]3)cc2)c(F)cc1F ZINC000822167772 606363567 /nfs/dbraw/zinc/36/35/67/606363567.db2.gz IPCSZLPGJPSWNV-UHFFFAOYSA-N -1 3 371.391 3.756 20 0 FHADHM Cc1cc(C(=O)N(CC(C)C)c2ccc(-c3nn[n-]n3)cc2)c(F)cc1F ZINC000822167772 606363568 /nfs/dbraw/zinc/36/35/68/606363568.db2.gz IPCSZLPGJPSWNV-UHFFFAOYSA-N -1 3 371.391 3.756 20 0 FHADHM COc1cccc(C(C)=CC(=O)O[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000821859205 606409462 /nfs/dbraw/zinc/40/94/62/606409462.db2.gz MIOJAESWQDJIME-ZVHGMHCTSA-N -1 3 364.405 3.583 20 0 FHADHM COc1cccc(C(C)=CC(=O)O[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000821859205 606409464 /nfs/dbraw/zinc/40/94/64/606409464.db2.gz MIOJAESWQDJIME-ZVHGMHCTSA-N -1 3 364.405 3.583 20 0 FHADHM CN(C(=O)c1ccc(Cl)cc1F)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821573374 606412459 /nfs/dbraw/zinc/41/24/59/606412459.db2.gz NTJLYARPNUFXIR-UHFFFAOYSA-N -1 3 366.183 3.589 20 0 FHADHM CN(C(=O)c1ccc(Cl)cc1F)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821573374 606412461 /nfs/dbraw/zinc/41/24/61/606412461.db2.gz NTJLYARPNUFXIR-UHFFFAOYSA-N -1 3 366.183 3.589 20 0 FHADHM Fc1ccc([C@@H](NCc2ccc(-c3nnn[n-]3)s2)c2ccccc2)cc1 ZINC000822766120 606413217 /nfs/dbraw/zinc/41/32/17/606413217.db2.gz DTJURXIPDAWHNY-SFHVURJKSA-N -1 3 365.437 3.947 20 0 FHADHM C[C@H](NC(=O)Nc1ccc(-c2nnn[n-]2)cc1)c1c(F)cccc1Cl ZINC000820372541 606437508 /nfs/dbraw/zinc/43/75/08/606437508.db2.gz ANVYXUZKDXLXMH-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM C[C@H](NC(=O)Nc1ccc(-c2nn[n-]n2)cc1)c1c(F)cccc1Cl ZINC000820372541 606437509 /nfs/dbraw/zinc/43/75/09/606437509.db2.gz ANVYXUZKDXLXMH-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM C[C@@H]1CCCN1C(=O)c1ccccc1Sc1ccccc1-c1nnn[n-]1 ZINC000820709726 606438091 /nfs/dbraw/zinc/43/80/91/606438091.db2.gz LMEUMFSFEHKVFJ-CYBMUJFWSA-N -1 3 365.462 3.642 20 0 FHADHM C[C@@H]1CCCN1C(=O)c1ccccc1Sc1ccccc1-c1nn[n-]n1 ZINC000820709726 606438093 /nfs/dbraw/zinc/43/80/93/606438093.db2.gz LMEUMFSFEHKVFJ-CYBMUJFWSA-N -1 3 365.462 3.642 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)N1CCCC[C@H]1c1ccc(F)cc1 ZINC000823359912 606439684 /nfs/dbraw/zinc/43/96/84/606439684.db2.gz UORVGISNJQJMKV-KRWDZBQOSA-N -1 3 366.400 3.765 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)N1CCCC[C@H]1c1ccc(F)cc1 ZINC000823359912 606439685 /nfs/dbraw/zinc/43/96/85/606439685.db2.gz UORVGISNJQJMKV-KRWDZBQOSA-N -1 3 366.400 3.765 20 0 FHADHM Cc1cccc2c1ncc(-c1nnn[n-]1)c2N1CCc2sccc2[C@H]1C ZINC000822334501 606443897 /nfs/dbraw/zinc/44/38/97/606443897.db2.gz DRCVJZXRNQLECM-GFCCVEGCSA-N -1 3 362.462 3.909 20 0 FHADHM Cc1cccc2c1ncc(-c1nn[n-]n1)c2N1CCc2sccc2[C@H]1C ZINC000822334501 606443898 /nfs/dbraw/zinc/44/38/98/606443898.db2.gz DRCVJZXRNQLECM-GFCCVEGCSA-N -1 3 362.462 3.909 20 0 FHADHM Clc1cccc(Cl)c1-c1noc(-c2cc(-c3nnn[n-]3)cs2)n1 ZINC000822586160 606470801 /nfs/dbraw/zinc/47/08/01/606470801.db2.gz SLWOWPSMWHMIDD-UHFFFAOYSA-N -1 3 365.205 3.952 20 0 FHADHM Clc1cccc(Cl)c1-c1noc(-c2cc(-c3nn[n-]n3)cs2)n1 ZINC000822586160 606470803 /nfs/dbraw/zinc/47/08/03/606470803.db2.gz SLWOWPSMWHMIDD-UHFFFAOYSA-N -1 3 365.205 3.952 20 0 FHADHM Cc1ccc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CC[C@H](C)C3)c(F)c1 ZINC000822227246 606489364 /nfs/dbraw/zinc/48/93/64/606489364.db2.gz AXRGBCDWBOGJEY-JTQLQIEISA-N -1 3 371.441 3.753 20 0 FHADHM Cc1ccc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CC[C@H](C)C3)c(F)c1 ZINC000822227246 606489366 /nfs/dbraw/zinc/48/93/66/606489366.db2.gz AXRGBCDWBOGJEY-JTQLQIEISA-N -1 3 371.441 3.753 20 0 FHADHM C[C@H](c1ccc(Cl)cc1)N(C(=O)c1cc(-c2nnn[n-]2)cs1)C1CC1 ZINC000820564115 606490088 /nfs/dbraw/zinc/49/00/88/606490088.db2.gz YQXTXUQJSPBZBL-SNVBAGLBSA-N -1 3 373.869 3.947 20 0 FHADHM C[C@H](c1ccc(Cl)cc1)N(C(=O)c1cc(-c2nn[n-]n2)cs1)C1CC1 ZINC000820564115 606490089 /nfs/dbraw/zinc/49/00/89/606490089.db2.gz YQXTXUQJSPBZBL-SNVBAGLBSA-N -1 3 373.869 3.947 20 0 FHADHM O=C(c1cc(-c2nnn[n-]2)cs1)N(C1CC1)[C@H]1CCCc2ccccc21 ZINC000823466704 606492565 /nfs/dbraw/zinc/49/25/65/606492565.db2.gz OIRSNGIMKYDSSI-INIZCTEOSA-N -1 3 365.462 3.610 20 0 FHADHM O=C(c1cc(-c2nn[n-]n2)cs1)N(C1CC1)[C@H]1CCCc2ccccc21 ZINC000823466704 606492566 /nfs/dbraw/zinc/49/25/66/606492566.db2.gz OIRSNGIMKYDSSI-INIZCTEOSA-N -1 3 365.462 3.610 20 0 FHADHM CCCC[C@@H](NC(=O)c1cc(-c2nnn[n-]2)cs1)c1ccc(OC)cc1 ZINC000821042533 606506811 /nfs/dbraw/zinc/50/68/11/606506811.db2.gz DIWVKTQGIMEOFS-OAHLLOKOSA-N -1 3 371.466 3.598 20 0 FHADHM CCCC[C@@H](NC(=O)c1cc(-c2nn[n-]n2)cs1)c1ccc(OC)cc1 ZINC000821042533 606506813 /nfs/dbraw/zinc/50/68/13/606506813.db2.gz DIWVKTQGIMEOFS-OAHLLOKOSA-N -1 3 371.466 3.598 20 0 FHADHM O=C(Nc1ccc(COC2CCCC2)cc1)c1cc(-c2nnn[n-]2)cs1 ZINC000823323408 606516898 /nfs/dbraw/zinc/51/68/98/606516898.db2.gz MZMMORIQTJZBAL-UHFFFAOYSA-N -1 3 369.450 3.640 20 0 FHADHM O=C(Nc1ccc(COC2CCCC2)cc1)c1cc(-c2nn[n-]n2)cs1 ZINC000823323408 606516901 /nfs/dbraw/zinc/51/69/01/606516901.db2.gz MZMMORIQTJZBAL-UHFFFAOYSA-N -1 3 369.450 3.640 20 0 FHADHM CCCCOc1ccc(NC(=O)Cc2cccc(-c3nnn[n-]3)c2)c(C)c1 ZINC000821077534 606528905 /nfs/dbraw/zinc/52/89/05/606528905.db2.gz KERTXKGMSJGSIK-UHFFFAOYSA-N -1 3 365.437 3.535 20 0 FHADHM CCCCOc1ccc(NC(=O)Cc2cccc(-c3nn[n-]n3)c2)c(C)c1 ZINC000821077534 606528906 /nfs/dbraw/zinc/52/89/06/606528906.db2.gz KERTXKGMSJGSIK-UHFFFAOYSA-N -1 3 365.437 3.535 20 0 FHADHM CCN(C(=O)Cc1cccc(-c2nnn[n-]2)c1)c1ccc2ccccc2c1 ZINC000821155161 606540332 /nfs/dbraw/zinc/54/03/32/606540332.db2.gz XASQDUQMUDWUAC-UHFFFAOYSA-N -1 3 357.417 3.616 20 0 FHADHM CCN(C(=O)Cc1cccc(-c2nn[n-]n2)c1)c1ccc2ccccc2c1 ZINC000821155161 606540334 /nfs/dbraw/zinc/54/03/34/606540334.db2.gz XASQDUQMUDWUAC-UHFFFAOYSA-N -1 3 357.417 3.616 20 0 FHADHM Cc1ccccc1[C@@H](C(C)C)N(C)C(=O)Cc1cccc(-c2nnn[n-]2)c1 ZINC000822344842 606560476 /nfs/dbraw/zinc/56/04/76/606560476.db2.gz BJNALSUHJFYDOW-HXUWFJFHSA-N -1 3 363.465 3.573 20 0 FHADHM Cc1ccccc1[C@@H](C(C)C)N(C)C(=O)Cc1cccc(-c2nn[n-]n2)c1 ZINC000822344842 606560478 /nfs/dbraw/zinc/56/04/78/606560478.db2.gz BJNALSUHJFYDOW-HXUWFJFHSA-N -1 3 363.465 3.573 20 0 FHADHM C[C@@H](N(C)C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)C1(C)CC1 ZINC000820308837 606577145 /nfs/dbraw/zinc/57/71/45/606577145.db2.gz ZGAAYZCCMZDNPY-SECBINFHSA-N -1 3 368.363 3.538 20 0 FHADHM C[C@@H](N(C)C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)C1(C)CC1 ZINC000820308837 606577147 /nfs/dbraw/zinc/57/71/47/606577147.db2.gz ZGAAYZCCMZDNPY-SECBINFHSA-N -1 3 368.363 3.538 20 0 FHADHM FC(F)(F)[C@@H]1CCC[C@@H](CNc2ncc(-c3nnn[n-]3)cc2Cl)C1 ZINC000822714480 606595575 /nfs/dbraw/zinc/59/55/75/606595575.db2.gz NVSLEEUAVXDXMN-PSASIEDQSA-N -1 3 360.771 3.696 20 0 FHADHM FC(F)(F)[C@@H]1CCC[C@@H](CNc2ncc(-c3nn[n-]n3)cc2Cl)C1 ZINC000822714480 606595577 /nfs/dbraw/zinc/59/55/77/606595577.db2.gz NVSLEEUAVXDXMN-PSASIEDQSA-N -1 3 360.771 3.696 20 0 FHADHM O=C(CCc1ccoc1)Oc1ccc(-c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000822983901 606601660 /nfs/dbraw/zinc/60/16/60/606601660.db2.gz WUWKPEXWQBRLIH-UHFFFAOYSA-N -1 3 360.373 3.665 20 0 FHADHM O=C(CCc1ccoc1)Oc1ccc(-c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000822983901 606601661 /nfs/dbraw/zinc/60/16/61/606601661.db2.gz WUWKPEXWQBRLIH-UHFFFAOYSA-N -1 3 360.373 3.665 20 0 FHADHM C[C@@H](NC(=O)c1cc2cccc(Cl)c2o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820390311 606602262 /nfs/dbraw/zinc/60/22/62/606602262.db2.gz GXQMFXAOZOXILY-SNVBAGLBSA-N -1 3 367.796 3.757 20 0 FHADHM C[C@@H](NC(=O)c1cc2cccc(Cl)c2o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820390311 606602263 /nfs/dbraw/zinc/60/22/63/606602263.db2.gz GXQMFXAOZOXILY-SNVBAGLBSA-N -1 3 367.796 3.757 20 0 FHADHM COc1cccc([C@H](C)CC(=O)O[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000821859367 606613100 /nfs/dbraw/zinc/61/31/00/606613100.db2.gz NNIOMBGPHXHERI-ZIAGYGMSSA-N -1 3 366.421 3.673 20 0 FHADHM COc1cccc([C@H](C)CC(=O)O[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000821859367 606613101 /nfs/dbraw/zinc/61/31/01/606613101.db2.gz NNIOMBGPHXHERI-ZIAGYGMSSA-N -1 3 366.421 3.673 20 0 FHADHM C[C@H](OC(=O)C/C=C\c1ccc(F)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000820486775 606626467 /nfs/dbraw/zinc/62/64/67/606626467.db2.gz CUIIUJSLAKSWDH-LSYFEZSPSA-N -1 3 352.369 3.714 20 0 FHADHM C[C@H](OC(=O)C/C=C\c1ccc(F)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000820486775 606626469 /nfs/dbraw/zinc/62/64/69/606626469.db2.gz CUIIUJSLAKSWDH-LSYFEZSPSA-N -1 3 352.369 3.714 20 0 FHADHM O=C(c1ccc(-c2nnn[n-]2)cc1)N1CCCCC[C@H]1/C=C\c1ccccc1 ZINC000823478793 606626724 /nfs/dbraw/zinc/62/67/24/606626724.db2.gz SPEHDSZVOIKFQQ-ZRGSNEMSSA-N -1 3 373.460 3.965 20 0 FHADHM O=C(c1ccc(-c2nn[n-]n2)cc1)N1CCCCC[C@H]1/C=C\c1ccccc1 ZINC000823478793 606626726 /nfs/dbraw/zinc/62/67/26/606626726.db2.gz SPEHDSZVOIKFQQ-ZRGSNEMSSA-N -1 3 373.460 3.965 20 0 FHADHM Cc1cccn2cc(CSc3ccc(Cl)cc3-c3nnn[n-]3)nc12 ZINC000822366502 606629058 /nfs/dbraw/zinc/62/90/58/606629058.db2.gz KMKVVYGPTFDFJU-UHFFFAOYSA-N -1 3 356.842 3.769 20 0 FHADHM Cc1cccn2cc(CSc3ccc(Cl)cc3-c3nn[n-]n3)nc12 ZINC000822366502 606629060 /nfs/dbraw/zinc/62/90/60/606629060.db2.gz KMKVVYGPTFDFJU-UHFFFAOYSA-N -1 3 356.842 3.769 20 0 FHADHM CCCC[C@@H](CCC)CNC(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1 ZINC000821040919 606632824 /nfs/dbraw/zinc/63/28/24/606632824.db2.gz VIYCMQQHKNOZDY-OAHLLOKOSA-N -1 3 358.490 3.615 20 0 FHADHM CCCC[C@@H](CCC)CNC(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1 ZINC000821040919 606632825 /nfs/dbraw/zinc/63/28/25/606632825.db2.gz VIYCMQQHKNOZDY-OAHLLOKOSA-N -1 3 358.490 3.615 20 0 FHADHM CC[C@@H](C)c1ccc(C(=O)Nc2cc(-c3nnn[n-]3)ccc2OC)cc1 ZINC000820882638 606675326 /nfs/dbraw/zinc/67/53/26/606675326.db2.gz WJJLRGNMKLRAET-GFCCVEGCSA-N -1 3 351.410 3.641 20 0 FHADHM CC[C@@H](C)c1ccc(C(=O)Nc2cc(-c3nn[n-]n3)ccc2OC)cc1 ZINC000820882638 606675327 /nfs/dbraw/zinc/67/53/27/606675327.db2.gz WJJLRGNMKLRAET-GFCCVEGCSA-N -1 3 351.410 3.641 20 0 FHADHM O=C(C=C1CCC1)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1 ZINC000822917116 606683734 /nfs/dbraw/zinc/68/37/34/606683734.db2.gz NSQZPQJFNRXVBP-UHFFFAOYSA-N -1 3 365.368 3.847 20 0 FHADHM O=C(C=C1CCC1)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1 ZINC000822917116 606683735 /nfs/dbraw/zinc/68/37/35/606683735.db2.gz NSQZPQJFNRXVBP-UHFFFAOYSA-N -1 3 365.368 3.847 20 0 FHADHM CCC1(CC)CCN(C(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(C)C)C1 ZINC000820956710 606696491 /nfs/dbraw/zinc/69/64/91/606696491.db2.gz JXJOUPPPMNSFSQ-UHFFFAOYSA-N -1 3 372.473 3.698 20 0 FHADHM CCC1(CC)CCN(C(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(C)C)C1 ZINC000820956710 606696492 /nfs/dbraw/zinc/69/64/92/606696492.db2.gz JXJOUPPPMNSFSQ-UHFFFAOYSA-N -1 3 372.473 3.698 20 0 FHADHM Cc1cc(C)c(-c2nnn[n-]2)c(SCc2nc(C(C)(C)C)cs2)n1 ZINC000822193153 606702362 /nfs/dbraw/zinc/70/23/62/606702362.db2.gz MYKJEQYZNMVRAT-UHFFFAOYSA-N -1 3 360.512 3.925 20 0 FHADHM Cc1cc(C)c(-c2nn[n-]n2)c(SCc2nc(C(C)(C)C)cs2)n1 ZINC000822193153 606702363 /nfs/dbraw/zinc/70/23/63/606702363.db2.gz MYKJEQYZNMVRAT-UHFFFAOYSA-N -1 3 360.512 3.925 20 0 FHADHM CCc1noc(CC)c1CNc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000821558662 606724757 /nfs/dbraw/zinc/72/47/57/606724757.db2.gz CYDRVUQPDQRSDY-UHFFFAOYSA-N -1 3 366.347 3.610 20 0 FHADHM CCc1noc(CC)c1CNc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000821558662 606724758 /nfs/dbraw/zinc/72/47/58/606724758.db2.gz CYDRVUQPDQRSDY-UHFFFAOYSA-N -1 3 366.347 3.610 20 0 FHADHM C[C@H](Nc1c(F)cc(-c2nnn[n-]2)cc1F)c1cccc(N2CCCC2)c1 ZINC000820450431 606732780 /nfs/dbraw/zinc/73/27/80/606732780.db2.gz KMRQYYRHAGIYTL-LBPRGKRZSA-N -1 3 370.407 3.918 20 0 FHADHM C[C@H](Nc1c(F)cc(-c2nn[n-]n2)cc1F)c1cccc(N2CCCC2)c1 ZINC000820450431 606732781 /nfs/dbraw/zinc/73/27/81/606732781.db2.gz KMRQYYRHAGIYTL-LBPRGKRZSA-N -1 3 370.407 3.918 20 0 FHADHM C[C@H](Nc1ccc(F)cc1-c1nnn[n-]1)c1cccc(N2CCCC2)c1 ZINC000820455644 606733019 /nfs/dbraw/zinc/73/30/19/606733019.db2.gz KCQWIVVEJDDXQZ-ZDUSSCGKSA-N -1 3 352.417 3.779 20 0 FHADHM C[C@H](Nc1ccc(F)cc1-c1nn[n-]n1)c1cccc(N2CCCC2)c1 ZINC000820455644 606733022 /nfs/dbraw/zinc/73/30/22/606733022.db2.gz KCQWIVVEJDDXQZ-ZDUSSCGKSA-N -1 3 352.417 3.779 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1cc(F)cc(Cl)c1 ZINC000821104517 606782934 /nfs/dbraw/zinc/78/29/34/606782934.db2.gz HDOZUAJKVHCXSC-UHFFFAOYSA-N -1 3 373.819 3.712 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1cc(F)cc(Cl)c1 ZINC000821104517 606782935 /nfs/dbraw/zinc/78/29/35/606782935.db2.gz HDOZUAJKVHCXSC-UHFFFAOYSA-N -1 3 373.819 3.712 20 0 FHADHM CCCC[C@H](NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)C1CCC1 ZINC000821043686 606794787 /nfs/dbraw/zinc/79/47/87/606794787.db2.gz SPIWEMWHEQWDHB-DYVFJYSZSA-N -1 3 356.474 3.586 20 0 FHADHM CCCC[C@H](NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)C1CCC1 ZINC000821043686 606794789 /nfs/dbraw/zinc/79/47/89/606794789.db2.gz SPIWEMWHEQWDHB-DYVFJYSZSA-N -1 3 356.474 3.586 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1Oc1ccc(C(=O)N2CCC[C@@H]2C)cc1 ZINC000822137735 606796756 /nfs/dbraw/zinc/79/67/56/606796756.db2.gz WPGBYFLVCDGHTI-AWEZNQCLSA-N -1 3 363.421 3.592 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1Oc1ccc(C(=O)N2CCC[C@@H]2C)cc1 ZINC000822137735 606796757 /nfs/dbraw/zinc/79/67/57/606796757.db2.gz WPGBYFLVCDGHTI-AWEZNQCLSA-N -1 3 363.421 3.592 20 0 FHADHM Cc1sc(NC(=O)Cc2ccc(C)cc2Cl)c(-c2nnn[n-]2)c1C ZINC000822235119 606809773 /nfs/dbraw/zinc/80/97/73/606809773.db2.gz UDNWOJFCNUYCBA-UHFFFAOYSA-N -1 3 361.858 3.688 20 0 FHADHM Cc1sc(NC(=O)Cc2ccc(C)cc2Cl)c(-c2nn[n-]n2)c1C ZINC000822235119 606809774 /nfs/dbraw/zinc/80/97/74/606809774.db2.gz UDNWOJFCNUYCBA-UHFFFAOYSA-N -1 3 361.858 3.688 20 0 FHADHM O=C(Nc1ccccc1CCC(F)(F)F)c1sccc1-c1nnn[n-]1 ZINC000823373133 606816645 /nfs/dbraw/zinc/81/66/45/606816645.db2.gz REMYBOASIBIVEF-UHFFFAOYSA-N -1 3 367.356 3.675 20 0 FHADHM O=C(Nc1ccccc1CCC(F)(F)F)c1sccc1-c1nn[n-]n1 ZINC000823373133 606816647 /nfs/dbraw/zinc/81/66/47/606816647.db2.gz REMYBOASIBIVEF-UHFFFAOYSA-N -1 3 367.356 3.675 20 0 FHADHM C[C@H](SCC(=O)N(C)[C@H]1CCCC[C@@H]1C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820549116 606827727 /nfs/dbraw/zinc/82/77/27/606827727.db2.gz KLRVRXQCQQKKHF-ZQIUZPCESA-N -1 3 373.526 3.698 20 0 FHADHM C[C@H](SCC(=O)N(C)[C@H]1CCCC[C@@H]1C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820549116 606827728 /nfs/dbraw/zinc/82/77/28/606827728.db2.gz KLRVRXQCQQKKHF-ZQIUZPCESA-N -1 3 373.526 3.698 20 0 FHADHM C[C@@H](SCc1ccc(-c2nnn[n-]2)cc1)c1nc(-c2ccccc2)no1 ZINC000820549863 606828058 /nfs/dbraw/zinc/82/80/58/606828058.db2.gz SREHOIDTCKOVJQ-GFCCVEGCSA-N -1 3 364.434 3.911 20 0 FHADHM C[C@@H](SCc1ccc(-c2nn[n-]n2)cc1)c1nc(-c2ccccc2)no1 ZINC000820549863 606828059 /nfs/dbraw/zinc/82/80/59/606828059.db2.gz SREHOIDTCKOVJQ-GFCCVEGCSA-N -1 3 364.434 3.911 20 0 FHADHM ClC1(Cl)C[C@@H]1CSCCCOc1cccc(-c2nnn[n-]2)c1 ZINC000822564263 606841365 /nfs/dbraw/zinc/84/13/65/606841365.db2.gz XYRFXZISQHUTJD-LLVKDONJSA-N -1 3 359.282 3.563 20 0 FHADHM ClC1(Cl)C[C@@H]1CSCCCOc1cccc(-c2nn[n-]n2)c1 ZINC000822564263 606841366 /nfs/dbraw/zinc/84/13/66/606841366.db2.gz XYRFXZISQHUTJD-LLVKDONJSA-N -1 3 359.282 3.563 20 0 FHADHM Cc1sc(NC(=O)c2cc(F)cc(Cl)c2)c(-c2nnn[n-]2)c1C ZINC000822564202 606842526 /nfs/dbraw/zinc/84/25/26/606842526.db2.gz WBHGDCAPSBSHBQ-UHFFFAOYSA-N -1 3 351.794 3.590 20 0 FHADHM Cc1sc(NC(=O)c2cc(F)cc(Cl)c2)c(-c2nn[n-]n2)c1C ZINC000822564202 606842529 /nfs/dbraw/zinc/84/25/29/606842529.db2.gz WBHGDCAPSBSHBQ-UHFFFAOYSA-N -1 3 351.794 3.590 20 0 FHADHM COc1ccc(C=O)cc1CSc1ccc(-c2nnn[n-]2)cc1Cl ZINC000821787127 606851681 /nfs/dbraw/zinc/85/16/81/606851681.db2.gz OMDLOBAEUCCGPB-UHFFFAOYSA-N -1 3 360.826 3.634 20 0 FHADHM COc1ccc(C=O)cc1CSc1ccc(-c2nn[n-]n2)cc1Cl ZINC000821787127 606851682 /nfs/dbraw/zinc/85/16/82/606851682.db2.gz OMDLOBAEUCCGPB-UHFFFAOYSA-N -1 3 360.826 3.634 20 0 FHADHM O[C@@H](CNc1ccc(-c2nnn[n-]2)c(Cl)c1)c1cc2ccccc2s1 ZINC000823689702 606878244 /nfs/dbraw/zinc/87/82/44/606878244.db2.gz IRXJFGBOPGUTOR-AWEZNQCLSA-N -1 3 371.853 3.880 20 0 FHADHM O[C@@H](CNc1ccc(-c2nn[n-]n2)c(Cl)c1)c1cc2ccccc2s1 ZINC000823689702 606878245 /nfs/dbraw/zinc/87/82/45/606878245.db2.gz IRXJFGBOPGUTOR-AWEZNQCLSA-N -1 3 371.853 3.880 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1N[C@H]1CC2(CCC2)Oc2ccccc21 ZINC000822744031 606880013 /nfs/dbraw/zinc/88/00/13/606880013.db2.gz KGCXJUWJLSGTIT-INIZCTEOSA-N -1 3 351.385 3.864 20 0 FHADHM Cc1cc(Br)cnc1N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000822162263 606921489 /nfs/dbraw/zinc/92/14/89/606921489.db2.gz ZNCAIMPSPNBTTQ-SNVBAGLBSA-N -1 3 359.231 3.506 20 0 FHADHM Cc1cc(Br)cnc1N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000822162263 606921490 /nfs/dbraw/zinc/92/14/90/606921490.db2.gz ZNCAIMPSPNBTTQ-SNVBAGLBSA-N -1 3 359.231 3.506 20 0 FHADHM CCc1nnc(S[C@@H](C)c2ccc(F)cc2)c(-c2nnn[n-]2)c1CC ZINC000821547712 606925788 /nfs/dbraw/zinc/92/57/88/606925788.db2.gz ANPMNYIJGLAMIW-JTQLQIEISA-N -1 3 358.446 3.774 20 0 FHADHM CCc1nnc(S[C@@H](C)c2ccc(F)cc2)c(-c2nn[n-]n2)c1CC ZINC000821547712 606925790 /nfs/dbraw/zinc/92/57/90/606925790.db2.gz ANPMNYIJGLAMIW-JTQLQIEISA-N -1 3 358.446 3.774 20 0 FHADHM Fc1ccc(CSC[C@H]2OCCc3ccccc32)cc1-c1nnn[n-]1 ZINC000822774165 606928438 /nfs/dbraw/zinc/92/84/38/606928438.db2.gz GAZIYOBUFVHXJM-QGZVFWFLSA-N -1 3 356.426 3.553 20 0 FHADHM Fc1ccc(CSC[C@H]2OCCc3ccccc32)cc1-c1nn[n-]n1 ZINC000822774165 606928440 /nfs/dbraw/zinc/92/84/40/606928440.db2.gz GAZIYOBUFVHXJM-QGZVFWFLSA-N -1 3 356.426 3.553 20 0 FHADHM CCCO[C@@H]1CCCN(c2ccc(C(F)(F)F)cc2-c2nnn[n-]2)CC1 ZINC000821128456 606933163 /nfs/dbraw/zinc/93/31/63/606933163.db2.gz ULRCYUJFLXPLRS-CYBMUJFWSA-N -1 3 369.391 3.671 20 0 FHADHM CCCO[C@@H]1CCCN(c2ccc(C(F)(F)F)cc2-c2nn[n-]n2)CC1 ZINC000821128456 606933165 /nfs/dbraw/zinc/93/31/65/606933165.db2.gz ULRCYUJFLXPLRS-CYBMUJFWSA-N -1 3 369.391 3.671 20 0 FHADHM C[C@H](NC(=O)Nc1cc(F)cc(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820375147 606954753 /nfs/dbraw/zinc/95/47/53/606954753.db2.gz YSQJDIJCLVGCFI-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM C[C@H](NC(=O)Nc1cc(F)cc(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820375147 606954755 /nfs/dbraw/zinc/95/47/55/606954755.db2.gz YSQJDIJCLVGCFI-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM CCCC1(CNC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)CCC1 ZINC000821034710 606958511 /nfs/dbraw/zinc/95/85/11/606958511.db2.gz RRCNIUXHNPENEJ-UHFFFAOYSA-N -1 3 371.485 3.502 20 0 FHADHM CCCC1(CNC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)CCC1 ZINC000821034710 606958513 /nfs/dbraw/zinc/95/85/13/606958513.db2.gz RRCNIUXHNPENEJ-UHFFFAOYSA-N -1 3 371.485 3.502 20 0 FHADHM C[C@@H](CC(=O)N(C)c1cc(Cl)ccc1-c1nnn[n-]1)c1cccc(F)c1 ZINC000820219461 606960023 /nfs/dbraw/zinc/96/00/23/606960023.db2.gz GVTHCSGHLATZRQ-NSHDSACASA-N -1 3 373.819 3.816 20 0 FHADHM C[C@@H](CC(=O)N(C)c1cc(Cl)ccc1-c1nn[n-]n1)c1cccc(F)c1 ZINC000820219461 606960024 /nfs/dbraw/zinc/96/00/24/606960024.db2.gz GVTHCSGHLATZRQ-NSHDSACASA-N -1 3 373.819 3.816 20 0 FHADHM Cc1ccc2oc(C(=O)N(C)c3cc(Cl)ccc3-c3nnn[n-]3)cc2c1 ZINC000822283742 606961533 /nfs/dbraw/zinc/96/15/33/606961533.db2.gz BVZRFAJGGPZUMH-UHFFFAOYSA-N -1 3 367.796 3.851 20 0 FHADHM Cc1ccc2oc(C(=O)N(C)c3cc(Cl)ccc3-c3nn[n-]n3)cc2c1 ZINC000822283742 606961535 /nfs/dbraw/zinc/96/15/35/606961535.db2.gz BVZRFAJGGPZUMH-UHFFFAOYSA-N -1 3 367.796 3.851 20 0 FHADHM Cc1cccc2cc(C(=O)N(C)c3cc(Cl)ccc3-c3nnn[n-]3)oc21 ZINC000822341048 606961689 /nfs/dbraw/zinc/96/16/89/606961689.db2.gz RZTNMTXYIHFUEW-UHFFFAOYSA-N -1 3 367.796 3.851 20 0 FHADHM Cc1cccc2cc(C(=O)N(C)c3cc(Cl)ccc3-c3nn[n-]n3)oc21 ZINC000822341048 606961690 /nfs/dbraw/zinc/96/16/90/606961690.db2.gz RZTNMTXYIHFUEW-UHFFFAOYSA-N -1 3 367.796 3.851 20 0 FHADHM C[C@H](Cc1ccc(F)cc1)C(=O)N(C)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000820292420 606962159 /nfs/dbraw/zinc/96/21/59/606962159.db2.gz FRMSWFPTZGFAPQ-LLVKDONJSA-N -1 3 373.819 3.501 20 0 FHADHM C[C@H](Cc1ccc(F)cc1)C(=O)N(C)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000820292420 606962161 /nfs/dbraw/zinc/96/21/61/606962161.db2.gz FRMSWFPTZGFAPQ-LLVKDONJSA-N -1 3 373.819 3.501 20 0 FHADHM O=C(CC/C=C\c1ccccc1)OCc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000822955306 607000645 /nfs/dbraw/zinc/00/06/45/607000645.db2.gz PHTWWDIJGOPINB-YWEYNIOJSA-N -1 3 352.369 3.543 20 0 FHADHM O=C(CC/C=C\c1ccccc1)OCc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000822955306 607000647 /nfs/dbraw/zinc/00/06/47/607000647.db2.gz PHTWWDIJGOPINB-YWEYNIOJSA-N -1 3 352.369 3.543 20 0 FHADHM C[C@@H](C(=O)OCc1ccc(F)c(-c2nnn[n-]2)c1)c1ccc(Cl)s1 ZINC000819884428 607001163 /nfs/dbraw/zinc/00/11/63/607001163.db2.gz WRTYIOZQGMJJLU-MRVPVSSYSA-N -1 3 366.805 3.568 20 0 FHADHM C[C@@H](C(=O)OCc1ccc(F)c(-c2nn[n-]n2)c1)c1ccc(Cl)s1 ZINC000819884428 607001165 /nfs/dbraw/zinc/00/11/65/607001165.db2.gz WRTYIOZQGMJJLU-MRVPVSSYSA-N -1 3 366.805 3.568 20 0 FHADHM Cc1ccccc1[C@H](C)NC(=O)[C@@H](C)Sc1cccc(-c2nnn[n-]2)c1 ZINC000822345733 607010311 /nfs/dbraw/zinc/01/03/11/607010311.db2.gz QDZMLUYDZGQASG-UONOGXRCSA-N -1 3 367.478 3.533 20 0 FHADHM Cc1ccccc1[C@H](C)NC(=O)[C@@H](C)Sc1cccc(-c2nn[n-]n2)c1 ZINC000822345733 607010312 /nfs/dbraw/zinc/01/03/12/607010312.db2.gz QDZMLUYDZGQASG-UONOGXRCSA-N -1 3 367.478 3.533 20 0 FHADHM CCOc1ccc(C(C)=O)cc1CSc1cccc(-c2nnn[n-]2)c1 ZINC000821416572 607011662 /nfs/dbraw/zinc/01/16/62/607011662.db2.gz AUSRACCMBTZMOF-UHFFFAOYSA-N -1 3 354.435 3.760 20 0 FHADHM CCOc1ccc(C(C)=O)cc1CSc1cccc(-c2nn[n-]n2)c1 ZINC000821416572 607011664 /nfs/dbraw/zinc/01/16/64/607011664.db2.gz AUSRACCMBTZMOF-UHFFFAOYSA-N -1 3 354.435 3.760 20 0 FHADHM C[C@H](Sc1ncccc1-c1nnn[n-]1)c1cccc(Br)c1 ZINC000820554924 607012516 /nfs/dbraw/zinc/01/25/16/607012516.db2.gz BPWFPMVYCZLQQV-VIFPVBQESA-N -1 3 362.256 3.878 20 0 FHADHM C[C@H](Sc1ncccc1-c1nn[n-]n1)c1cccc(Br)c1 ZINC000820554924 607012517 /nfs/dbraw/zinc/01/25/17/607012517.db2.gz BPWFPMVYCZLQQV-VIFPVBQESA-N -1 3 362.256 3.878 20 0 FHADHM CC(C)[C@H](Sc1cccc(-c2nnn[n-]2)c1)C(=O)Nc1ccccc1F ZINC000820031475 607016577 /nfs/dbraw/zinc/01/65/77/607016577.db2.gz FQFANPRPJBQWRF-INIZCTEOSA-N -1 3 371.441 3.761 20 0 FHADHM CC(C)[C@H](Sc1cccc(-c2nn[n-]n2)c1)C(=O)Nc1ccccc1F ZINC000820031475 607016579 /nfs/dbraw/zinc/01/65/79/607016579.db2.gz FQFANPRPJBQWRF-INIZCTEOSA-N -1 3 371.441 3.761 20 0 FHADHM CSc1cccc(NC(=O)[C@H](C)Sc2cccc(-c3nnn[n-]3)c2)c1 ZINC000821984884 607016721 /nfs/dbraw/zinc/01/67/21/607016721.db2.gz VXTACPQKPXUABS-NSHDSACASA-N -1 3 371.491 3.708 20 0 FHADHM CSc1cccc(NC(=O)[C@H](C)Sc2cccc(-c3nn[n-]n3)c2)c1 ZINC000821984884 607016722 /nfs/dbraw/zinc/01/67/22/607016722.db2.gz VXTACPQKPXUABS-NSHDSACASA-N -1 3 371.491 3.708 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1OCc1ncc(-c2ccccc2F)o1 ZINC000822221125 607027712 /nfs/dbraw/zinc/02/77/12/607027712.db2.gz BIMXSZKZFZXBHK-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1OCc1ncc(-c2ccccc2F)o1 ZINC000822221125 607027713 /nfs/dbraw/zinc/02/77/13/607027713.db2.gz BIMXSZKZFZXBHK-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM Cc1cc(C)n(-c2ccc([C@@H](C)Nc3ccc(-c4nn[n-]n4)cc3)cc2)n1 ZINC000822197566 607027795 /nfs/dbraw/zinc/02/77/95/607027795.db2.gz GCZQZAKOUINYSR-OAHLLOKOSA-N -1 3 359.437 3.842 20 0 FHADHM Cc1nc2ccccc2nc1CSCc1cc(F)ccc1-c1nnn[n-]1 ZINC000822462262 607033233 /nfs/dbraw/zinc/03/32/33/607033233.db2.gz FMQQNKUTHBKVBE-UHFFFAOYSA-N -1 3 366.425 3.691 20 0 FHADHM Cc1nc2ccccc2nc1CSCc1cc(F)ccc1-c1nn[n-]n1 ZINC000822462262 607033234 /nfs/dbraw/zinc/03/32/34/607033234.db2.gz FMQQNKUTHBKVBE-UHFFFAOYSA-N -1 3 366.425 3.691 20 0 FHADHM CC[C@H](Cc1ccccc1)N(CC)C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000820913705 607036152 /nfs/dbraw/zinc/03/61/52/607036152.db2.gz JQJDDUFNOHLIIK-GOSISDBHSA-N -1 3 364.453 3.742 20 0 FHADHM CC[C@H](Cc1ccccc1)N(CC)C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000820913705 607036154 /nfs/dbraw/zinc/03/61/54/607036154.db2.gz JQJDDUFNOHLIIK-GOSISDBHSA-N -1 3 364.453 3.742 20 0 FHADHM Cc1nc2ccccc2nc1SCc1cc(F)ccc1-c1nnn[n-]1 ZINC000822463575 607040079 /nfs/dbraw/zinc/04/00/79/607040079.db2.gz TXVBHBLVMUZJEI-UHFFFAOYSA-N -1 3 352.398 3.550 20 0 FHADHM Cc1nc2ccccc2nc1SCc1cc(F)ccc1-c1nn[n-]n1 ZINC000822463575 607040081 /nfs/dbraw/zinc/04/00/81/607040081.db2.gz TXVBHBLVMUZJEI-UHFFFAOYSA-N -1 3 352.398 3.550 20 0 FHADHM CC1(C)C[C@H](NCc2ccc(-c3nn[n-]n3)cc2F)c2ccc(F)cc2O1 ZINC000820590497 607057012 /nfs/dbraw/zinc/05/70/12/607057012.db2.gz VCHFFYNSPPTADM-INIZCTEOSA-N -1 3 371.391 3.537 20 0 FHADHM Cc1cc(C(=O)Nc2cc(-c3nnn[n-]3)cn2C(C)(C)C)ccc1Cl ZINC000822175967 607066205 /nfs/dbraw/zinc/06/62/05/607066205.db2.gz CJLSEVFDZHNKKH-UHFFFAOYSA-N -1 3 358.833 3.637 20 0 FHADHM Cc1cc(C(=O)Nc2cc(-c3nn[n-]n3)cn2C(C)(C)C)ccc1Cl ZINC000822175967 607066206 /nfs/dbraw/zinc/06/62/06/607066206.db2.gz CJLSEVFDZHNKKH-UHFFFAOYSA-N -1 3 358.833 3.637 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NC(=O)C[C@@H](C)c1ccccc1F ZINC000821292839 607100467 /nfs/dbraw/zinc/10/04/67/607100467.db2.gz FHXARNCFRPBMFA-GFCCVEGCSA-N -1 3 368.416 3.570 20 0 FHADHM Cc1ccn(-c2ccccc2CNc2ccc(-c3nnn[n-]3)c(Cl)c2)n1 ZINC000822369137 607126154 /nfs/dbraw/zinc/12/61/54/607126154.db2.gz BGUQKZYEGQVBHG-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM Cc1ccn(-c2ccccc2CNc2ccc(-c3nn[n-]n3)c(Cl)c2)n1 ZINC000822369137 607126156 /nfs/dbraw/zinc/12/61/56/607126156.db2.gz BGUQKZYEGQVBHG-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM COc1cc(-c2nnn[n-]2)cc(Cl)c1OCc1cc2ccccc2o1 ZINC000821699679 607132249 /nfs/dbraw/zinc/13/22/49/607132249.db2.gz ZAPWVKBOQNGPAN-UHFFFAOYSA-N -1 3 356.769 3.854 20 0 FHADHM COc1cc(-c2nn[n-]n2)cc(Cl)c1OCc1cc2ccccc2o1 ZINC000821699679 607132250 /nfs/dbraw/zinc/13/22/50/607132250.db2.gz ZAPWVKBOQNGPAN-UHFFFAOYSA-N -1 3 356.769 3.854 20 0 FHADHM O=C(Oc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1)[C@@H]1CC12CCC2 ZINC000823453857 607132539 /nfs/dbraw/zinc/13/25/39/607132539.db2.gz CEEQNUSKVJHWOV-KRWDZBQOSA-N -1 3 362.389 3.755 20 0 FHADHM O=C(Oc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1)[C@@H]1CC12CCC2 ZINC000823453857 607132541 /nfs/dbraw/zinc/13/25/41/607132541.db2.gz CEEQNUSKVJHWOV-KRWDZBQOSA-N -1 3 362.389 3.755 20 0 FHADHM O=C([C@@H]1CC12CCC2)N(Cc1ccccc1)c1ccccc1-c1nnn[n-]1 ZINC000822916901 607144800 /nfs/dbraw/zinc/14/48/00/607144800.db2.gz HYEVYQQDSBFEFC-KRWDZBQOSA-N -1 3 359.433 3.590 20 0 FHADHM O=C([C@@H]1CC12CCC2)N(Cc1ccccc1)c1ccccc1-c1nn[n-]n1 ZINC000822916901 607144801 /nfs/dbraw/zinc/14/48/01/607144801.db2.gz HYEVYQQDSBFEFC-KRWDZBQOSA-N -1 3 359.433 3.590 20 0 FHADHM O=C(Nc1sc2c(c1-c1nnn[n-]1)CCCCCC2)[C@H]1CC12CCC2 ZINC000823387071 607144849 /nfs/dbraw/zinc/14/48/49/607144849.db2.gz BZQOKWGZWIJRKN-GFCCVEGCSA-N -1 3 357.483 3.716 20 0 FHADHM O=C(Nc1sc2c(c1-c1nn[n-]n1)CCCCCC2)[C@H]1CC12CCC2 ZINC000823387071 607144851 /nfs/dbraw/zinc/14/48/51/607144851.db2.gz BZQOKWGZWIJRKN-GFCCVEGCSA-N -1 3 357.483 3.716 20 0 FHADHM C[C@H](OC1CCCCCC1)C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000820519341 607152234 /nfs/dbraw/zinc/15/22/34/607152234.db2.gz RVWUWJKVLMZIKP-NSHDSACASA-N -1 3 363.849 3.587 20 0 FHADHM C[C@H](OC1CCCCCC1)C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000820519341 607152236 /nfs/dbraw/zinc/15/22/36/607152236.db2.gz RVWUWJKVLMZIKP-NSHDSACASA-N -1 3 363.849 3.587 20 0 FHADHM CCC[C@H](C)[C@H]1CCCN1C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821015449 607153562 /nfs/dbraw/zinc/15/35/62/607153562.db2.gz QEQVDOJRPPORJR-GRDNDAEWSA-N -1 3 356.474 3.538 20 0 FHADHM CCC[C@H](C)[C@H]1CCCN1C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821015449 607153563 /nfs/dbraw/zinc/15/35/63/607153563.db2.gz QEQVDOJRPPORJR-GRDNDAEWSA-N -1 3 356.474 3.538 20 0 FHADHM CCCCC[C@H]1CCCN1C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821048599 607153577 /nfs/dbraw/zinc/15/35/77/607153577.db2.gz CZTIIMKYLBVAFL-PBHICJAKSA-N -1 3 356.474 3.682 20 0 FHADHM CCCCC[C@H]1CCCN1C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821048599 607153578 /nfs/dbraw/zinc/15/35/78/607153578.db2.gz CZTIIMKYLBVAFL-PBHICJAKSA-N -1 3 356.474 3.682 20 0 FHADHM CCCCC[C@H]1CCCN1C(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000821049980 607164973 /nfs/dbraw/zinc/16/49/73/607164973.db2.gz OROAKVIBUUYAIK-KRWDZBQOSA-N -1 3 373.526 3.671 20 0 FHADHM CCCCC[C@H]1CCCN1C(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000821049980 607164976 /nfs/dbraw/zinc/16/49/76/607164976.db2.gz OROAKVIBUUYAIK-KRWDZBQOSA-N -1 3 373.526 3.671 20 0 FHADHM C[C@H](CC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccc(F)cc1 ZINC000820226593 607189846 /nfs/dbraw/zinc/18/98/46/607189846.db2.gz VWTCTIMPGTYVTR-SNVBAGLBSA-N -1 3 359.792 3.792 20 0 FHADHM C[C@H](CC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccc(F)cc1 ZINC000820226593 607189847 /nfs/dbraw/zinc/18/98/47/607189847.db2.gz VWTCTIMPGTYVTR-SNVBAGLBSA-N -1 3 359.792 3.792 20 0 FHADHM CC[C@H](Cc1ccccc1)NC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820914285 607196509 /nfs/dbraw/zinc/19/65/09/607196509.db2.gz NKFQTDVUMVCAKF-CQSZACIVSA-N -1 3 370.844 3.663 20 0 FHADHM CC[C@H](Cc1ccccc1)NC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820914285 607196510 /nfs/dbraw/zinc/19/65/10/607196510.db2.gz NKFQTDVUMVCAKF-CQSZACIVSA-N -1 3 370.844 3.663 20 0 FHADHM C[C@H](c1ccccc1F)N(C)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820570760 607196874 /nfs/dbraw/zinc/19/68/74/607196874.db2.gz QUIOBSFOPNCNGV-SNVBAGLBSA-N -1 3 374.807 3.884 20 0 FHADHM C[C@H](c1ccccc1F)N(C)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820570760 607196875 /nfs/dbraw/zinc/19/68/75/607196875.db2.gz QUIOBSFOPNCNGV-SNVBAGLBSA-N -1 3 374.807 3.884 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000822228596 607197730 /nfs/dbraw/zinc/19/77/30/607197730.db2.gz ACAPQVQZGIZFBR-NSHDSACASA-N -1 3 356.817 3.711 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000822228596 607197731 /nfs/dbraw/zinc/19/77/31/607197731.db2.gz ACAPQVQZGIZFBR-NSHDSACASA-N -1 3 356.817 3.711 20 0 FHADHM CCSCC[C@@H](C)N(C)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000821455943 607199970 /nfs/dbraw/zinc/19/99/70/607199970.db2.gz MVQAEEQMYOFTCL-SNVBAGLBSA-N -1 3 368.894 3.516 20 0 FHADHM CCSCC[C@@H](C)N(C)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000821455943 607199971 /nfs/dbraw/zinc/19/99/71/607199971.db2.gz MVQAEEQMYOFTCL-SNVBAGLBSA-N -1 3 368.894 3.516 20 0 FHADHM C[C@@H]1c2ccccc2CCN1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820827889 607201058 /nfs/dbraw/zinc/20/10/58/607201058.db2.gz YNRCNFJRLUGZKJ-LLVKDONJSA-N -1 3 368.828 3.671 20 0 FHADHM C[C@@H]1c2ccccc2CCN1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820827889 607201059 /nfs/dbraw/zinc/20/10/59/607201059.db2.gz YNRCNFJRLUGZKJ-LLVKDONJSA-N -1 3 368.828 3.671 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N[C@@H](c1ccccc1)C1CC1 ZINC000823319373 607201354 /nfs/dbraw/zinc/20/13/54/607201354.db2.gz SSWWNQDREXKELH-INIZCTEOSA-N -1 3 368.828 3.793 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N[C@@H](c1ccccc1)C1CC1 ZINC000823319373 607201355 /nfs/dbraw/zinc/20/13/55/607201355.db2.gz SSWWNQDREXKELH-INIZCTEOSA-N -1 3 368.828 3.793 20 0 FHADHM C[C@@H](c1ccco1)N(C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)C1CC1 ZINC000820570835 607203240 /nfs/dbraw/zinc/20/32/40/607203240.db2.gz RIGURSCQEITTFU-JTQLQIEISA-N -1 3 372.816 3.871 20 0 FHADHM C[C@@H](c1ccco1)N(C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)C1CC1 ZINC000820570835 607203241 /nfs/dbraw/zinc/20/32/41/607203241.db2.gz RIGURSCQEITTFU-JTQLQIEISA-N -1 3 372.816 3.871 20 0 FHADHM C[C@@H]1c2cc(Cl)cc(Cl)c2CCN1c1ccc(-c2nnn[n-]2)nc1 ZINC000820819916 607234810 /nfs/dbraw/zinc/23/48/10/607234810.db2.gz LKXOWCVBFILNOU-SECBINFHSA-N -1 3 361.236 3.692 20 0 FHADHM C[C@@H]1c2cc(Cl)cc(Cl)c2CCN1c1ccc(-c2nn[n-]n2)nc1 ZINC000820819916 607234811 /nfs/dbraw/zinc/23/48/11/607234811.db2.gz LKXOWCVBFILNOU-SECBINFHSA-N -1 3 361.236 3.692 20 0 FHADHM CC(C)(Oc1ccc(-c2nnn[n-]2)cc1)C(=O)Nc1cccc2ccccc21 ZINC000820001552 607235051 /nfs/dbraw/zinc/23/50/51/607235051.db2.gz SATATBXDOMDLBD-UHFFFAOYSA-N -1 3 373.416 3.816 20 0 FHADHM CC(C)(Oc1ccc(-c2nn[n-]n2)cc1)C(=O)Nc1cccc2ccccc21 ZINC000820001552 607235052 /nfs/dbraw/zinc/23/50/52/607235052.db2.gz SATATBXDOMDLBD-UHFFFAOYSA-N -1 3 373.416 3.816 20 0 FHADHM CN(C(=O)c1ccc(F)c(Cl)c1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821574431 607238739 /nfs/dbraw/zinc/23/87/39/607238739.db2.gz GNQYPZBWOUUIAY-UHFFFAOYSA-N -1 3 366.183 3.589 20 0 FHADHM CN(C(=O)c1ccc(F)c(Cl)c1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821574431 607238740 /nfs/dbraw/zinc/23/87/40/607238740.db2.gz GNQYPZBWOUUIAY-UHFFFAOYSA-N -1 3 366.183 3.589 20 0 FHADHM CC(C)(C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1cccc(F)c1 ZINC000819891574 607241236 /nfs/dbraw/zinc/24/12/36/607241236.db2.gz BEMZXURDVOISJU-UHFFFAOYSA-N -1 3 359.792 3.576 20 0 FHADHM CC(C)(C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1cccc(F)c1 ZINC000819891574 607241237 /nfs/dbraw/zinc/24/12/37/607241237.db2.gz BEMZXURDVOISJU-UHFFFAOYSA-N -1 3 359.792 3.576 20 0 FHADHM C[C@H](C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccc(Cl)s1 ZINC000819868501 607242226 /nfs/dbraw/zinc/24/22/26/607242226.db2.gz ZFGLRLQUQJQALD-ZETCQYMHSA-N -1 3 368.249 3.977 20 0 FHADHM C[C@H](C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccc(Cl)s1 ZINC000819868501 607242227 /nfs/dbraw/zinc/24/22/27/607242227.db2.gz ZFGLRLQUQJQALD-ZETCQYMHSA-N -1 3 368.249 3.977 20 0 FHADHM C[C@H](C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1cccc(Cl)c1 ZINC000819867917 607242712 /nfs/dbraw/zinc/24/27/12/607242712.db2.gz VHTVHDUJWSCANA-VIFPVBQESA-N -1 3 362.220 3.916 20 0 FHADHM C[C@H](C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1cccc(Cl)c1 ZINC000819867917 607242713 /nfs/dbraw/zinc/24/27/13/607242713.db2.gz VHTVHDUJWSCANA-VIFPVBQESA-N -1 3 362.220 3.916 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)C12CC3CC(CC(C3)C1)C2 ZINC000823313544 607242724 /nfs/dbraw/zinc/24/27/24/607242724.db2.gz DYQDQFJTMJJBIP-UHFFFAOYSA-N -1 3 357.845 3.675 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)C12CC3CC(CC(C3)C1)C2 ZINC000823313544 607242725 /nfs/dbraw/zinc/24/27/25/607242725.db2.gz DYQDQFJTMJJBIP-UHFFFAOYSA-N -1 3 357.845 3.675 20 0 FHADHM Cc1c(NC(=S)Nc2ccc(F)c(Cl)c2)cccc1-c1nnn[n-]1 ZINC000822115310 607252049 /nfs/dbraw/zinc/25/20/49/607252049.db2.gz AYCXGZSCFYJJEC-UHFFFAOYSA-N -1 3 362.821 3.777 20 0 FHADHM Cc1c(NC(=S)Nc2ccc(F)c(Cl)c2)cccc1-c1nn[n-]n1 ZINC000822115310 607252050 /nfs/dbraw/zinc/25/20/50/607252050.db2.gz AYCXGZSCFYJJEC-UHFFFAOYSA-N -1 3 362.821 3.777 20 0 FHADHM C[C@@H](CC(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccc(F)cc1F ZINC000824385606 607778875 /nfs/dbraw/zinc/77/88/75/607778875.db2.gz XNKWHXQTKAOPOA-RYUDHWBXSA-N -1 3 372.375 3.943 20 0 FHADHM C[C@@H](CC(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccc(F)cc1F ZINC000824385606 607778876 /nfs/dbraw/zinc/77/88/76/607778876.db2.gz XNKWHXQTKAOPOA-RYUDHWBXSA-N -1 3 372.375 3.943 20 0 FHADHM C[C@@H]1CC[C@H](NC(=S)Nc2ccccc2-c2nnn[n-]2)c2ccccc21 ZINC000824917337 607783695 /nfs/dbraw/zinc/78/36/95/607783695.db2.gz NQYCKVVNEWICRG-PXAZEXFGSA-N -1 3 364.478 3.792 20 0 FHADHM C[C@@H]1CC[C@H](NC(=S)Nc2ccccc2-c2nn[n-]n2)c2ccccc21 ZINC000824917337 607783696 /nfs/dbraw/zinc/78/36/96/607783696.db2.gz NQYCKVVNEWICRG-PXAZEXFGSA-N -1 3 364.478 3.792 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@@H](C)c2ccc(F)cc2)cc1-c1nnn[n-]1 ZINC000825544567 607784661 /nfs/dbraw/zinc/78/46/61/607784661.db2.gz CKWTWVPEZLOLOI-NSHDSACASA-N -1 3 370.388 3.747 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@@H](C)c2ccc(F)cc2)cc1-c1nn[n-]n1 ZINC000825544567 607784662 /nfs/dbraw/zinc/78/46/62/607784662.db2.gz CKWTWVPEZLOLOI-NSHDSACASA-N -1 3 370.388 3.747 20 0 FHADHM Cc1ccc(C(=O)Nc2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)nc1 ZINC000826282363 607794174 /nfs/dbraw/zinc/79/41/74/607794174.db2.gz KMAKQHHKPQFSSA-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM CCN(C(=O)CCc1cc(Cl)cs1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825372450 607796535 /nfs/dbraw/zinc/79/65/35/607796535.db2.gz YZWINUYBZGOIDY-UHFFFAOYSA-N -1 3 361.858 3.567 20 0 FHADHM CCN(C(=O)CCc1cc(Cl)cs1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825372450 607796536 /nfs/dbraw/zinc/79/65/36/607796536.db2.gz YZWINUYBZGOIDY-UHFFFAOYSA-N -1 3 361.858 3.567 20 0 FHADHM CCN(C(=O)c1cc2cccc(Cl)c2o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825380768 607797490 /nfs/dbraw/zinc/79/74/90/607797490.db2.gz STUTURXBQLVSRH-UHFFFAOYSA-N -1 3 367.796 3.933 20 0 FHADHM CCN(C(=O)c1cc2cccc(Cl)c2o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825380768 607797491 /nfs/dbraw/zinc/79/74/91/607797491.db2.gz STUTURXBQLVSRH-UHFFFAOYSA-N -1 3 367.796 3.933 20 0 FHADHM CCN(C(=O)c1ccc(C(C)(C)C)s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825379142 607798378 /nfs/dbraw/zinc/79/83/78/607798378.db2.gz AXZWPAPTEYCQLF-UHFFFAOYSA-N -1 3 355.467 3.892 20 0 FHADHM CCN(C(=O)c1ccc(C(C)(C)C)s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825379142 607798379 /nfs/dbraw/zinc/79/83/79/607798379.db2.gz AXZWPAPTEYCQLF-UHFFFAOYSA-N -1 3 355.467 3.892 20 0 FHADHM CCN(C(=O)c1cc2sccc2s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825380558 607799248 /nfs/dbraw/zinc/79/92/48/607799248.db2.gz QTLQPTGQWGPOKY-UHFFFAOYSA-N -1 3 355.448 3.810 20 0 FHADHM CCN(C(=O)c1cc2sccc2s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825380558 607799249 /nfs/dbraw/zinc/79/92/49/607799249.db2.gz QTLQPTGQWGPOKY-UHFFFAOYSA-N -1 3 355.448 3.810 20 0 FHADHM CCN(C(=O)CCc1c[nH]c2ccc(C)cc12)c1ccc(-c2nnn[n-]2)cc1 ZINC000825371230 607800834 /nfs/dbraw/zinc/80/08/34/607800834.db2.gz DYCDNNOKXWALDX-UHFFFAOYSA-N -1 3 374.448 3.642 20 0 FHADHM CCN(C(=O)CCc1c[nH]c2ccc(C)cc12)c1ccc(-c2nn[n-]n2)cc1 ZINC000825371230 607800835 /nfs/dbraw/zinc/80/08/35/607800835.db2.gz DYCDNNOKXWALDX-UHFFFAOYSA-N -1 3 374.448 3.642 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)CCCSC(C)(C)C)s1 ZINC000825694663 607827117 /nfs/dbraw/zinc/82/71/17/607827117.db2.gz YPBMQNYOXBCGLL-UHFFFAOYSA-N -1 3 353.517 3.741 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)CCCSC(C)(C)C)s1 ZINC000825694663 607827118 /nfs/dbraw/zinc/82/71/18/607827118.db2.gz YPBMQNYOXBCGLL-UHFFFAOYSA-N -1 3 353.517 3.741 20 0 FHADHM c1ccc(C2CCN(c3ccc4cc(-c5nnn[n-]5)ccc4n3)CC2)cc1 ZINC000826520134 607840050 /nfs/dbraw/zinc/84/00/50/607840050.db2.gz BEPOFJHHYGQCQW-UHFFFAOYSA-N -1 3 356.433 3.799 20 0 FHADHM c1ccc(C2CCN(c3ccc4cc(-c5nn[n-]n5)ccc4n3)CC2)cc1 ZINC000826520134 607840051 /nfs/dbraw/zinc/84/00/51/607840051.db2.gz BEPOFJHHYGQCQW-UHFFFAOYSA-N -1 3 356.433 3.799 20 0 FHADHM Cc1cccc(C)c1NC(=O)CSc1ccc(-c2nnn[n-]2)cc1Cl ZINC000826296834 607844699 /nfs/dbraw/zinc/84/46/99/607844699.db2.gz KQJHGNBJOYLYAU-UHFFFAOYSA-N -1 3 373.869 3.868 20 0 FHADHM Cc1cccc(C)c1NC(=O)CSc1ccc(-c2nn[n-]n2)cc1Cl ZINC000826296834 607844700 /nfs/dbraw/zinc/84/47/00/607844700.db2.gz KQJHGNBJOYLYAU-UHFFFAOYSA-N -1 3 373.869 3.868 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@H]1CCCC(C)(C)C1 ZINC000824293401 607888246 /nfs/dbraw/zinc/88/82/46/607888246.db2.gz KLJPYDDWRMTWHJ-KRWDZBQOSA-N -1 3 355.486 3.820 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@H]1CCCC(C)(C)C1 ZINC000824293401 607888247 /nfs/dbraw/zinc/88/82/47/607888247.db2.gz KLJPYDDWRMTWHJ-KRWDZBQOSA-N -1 3 355.486 3.820 20 0 FHADHM CC(C)c1cccc(C(C)C)c1NC(=O)Cn1ccc(-c2nnn[n-]2)c1 ZINC000824347803 607890828 /nfs/dbraw/zinc/89/08/28/607890828.db2.gz OMBHCNZMELXKQM-UHFFFAOYSA-N -1 3 352.442 3.554 20 0 FHADHM CC(C)c1cccc(C(C)C)c1NC(=O)Cn1ccc(-c2nn[n-]n2)c1 ZINC000824347803 607890829 /nfs/dbraw/zinc/89/08/29/607890829.db2.gz OMBHCNZMELXKQM-UHFFFAOYSA-N -1 3 352.442 3.554 20 0 FHADHM O=C(NC1(c2cccc(-c3nnn[n-]3)c2)CC1)[C@@H]1CC[C@H]2CCCC[C@H]2C1 ZINC000826428323 607909538 /nfs/dbraw/zinc/90/95/38/607909538.db2.gz YKLZDHPWRFMANP-HLLBOEOZSA-N -1 3 365.481 3.579 20 0 FHADHM O=C(NC1(c2cccc(-c3nn[n-]n3)c2)CC1)[C@@H]1CC[C@H]2CCCC[C@H]2C1 ZINC000826428323 607909539 /nfs/dbraw/zinc/90/95/39/607909539.db2.gz YKLZDHPWRFMANP-HLLBOEOZSA-N -1 3 365.481 3.579 20 0 FHADHM FC(F)(F)C1=CCN(c2ccc(-c3nn[n-]n3)cc2C(F)(F)F)CC1 ZINC000826367110 607935697 /nfs/dbraw/zinc/93/56/97/607935697.db2.gz MFCWOCHINYRXJS-UHFFFAOYSA-N -1 3 363.265 3.584 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000823943143 607969284 /nfs/dbraw/zinc/96/92/84/607969284.db2.gz ONCKMIIXHVSYIA-XZHRJIJLSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000823943143 607969285 /nfs/dbraw/zinc/96/92/85/607969285.db2.gz ONCKMIIXHVSYIA-XZHRJIJLSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000823944020 607986006 /nfs/dbraw/zinc/98/60/06/607986006.db2.gz WXIQPJSOPRZNJS-UKVQZPPCSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000823944020 607986007 /nfs/dbraw/zinc/98/60/07/607986007.db2.gz WXIQPJSOPRZNJS-UKVQZPPCSA-N -1 3 367.840 3.801 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N1Cc2ccccc2C(C)(C)C1 ZINC000826278056 608007279 /nfs/dbraw/zinc/00/72/79/608007279.db2.gz PYHLUNAPCYFQSU-UHFFFAOYSA-N -1 3 362.437 3.500 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N1Cc2ccccc2C(C)(C)C1 ZINC000826278056 608007280 /nfs/dbraw/zinc/00/72/80/608007280.db2.gz PYHLUNAPCYFQSU-UHFFFAOYSA-N -1 3 362.437 3.500 20 0 FHADHM CCO[C@@H](C)c1nccn1Cc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000825575971 608013916 /nfs/dbraw/zinc/01/39/16/608013916.db2.gz AXVSUNFKBKBOOL-HNNXBMFYSA-N -1 3 374.448 3.876 20 0 FHADHM CCO[C@@H](C)c1nccn1Cc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000825575971 608013917 /nfs/dbraw/zinc/01/39/17/608013917.db2.gz AXVSUNFKBKBOOL-HNNXBMFYSA-N -1 3 374.448 3.876 20 0 FHADHM FC(F)(F)c1cc(N2CCc3ccsc3C2)ccc1-c1nnn[n-]1 ZINC000826368441 608018969 /nfs/dbraw/zinc/01/89/69/608018969.db2.gz PRSYEWPHAWVYJM-UHFFFAOYSA-N -1 3 351.357 3.510 20 0 FHADHM FC(F)(F)c1cc(N2CCc3ccsc3C2)ccc1-c1nn[n-]n1 ZINC000826368441 608018970 /nfs/dbraw/zinc/01/89/70/608018970.db2.gz PRSYEWPHAWVYJM-UHFFFAOYSA-N -1 3 351.357 3.510 20 0 FHADHM FC(F)(F)c1ccc(N2CCc3ccsc3C2)c(-c2nnn[n-]2)c1 ZINC000826368980 608018974 /nfs/dbraw/zinc/01/89/74/608018974.db2.gz IJDDSIRNHAIBEU-UHFFFAOYSA-N -1 3 351.357 3.510 20 0 FHADHM FC(F)(F)c1ccc(N2CCc3ccsc3C2)c(-c2nn[n-]n2)c1 ZINC000826368980 608018975 /nfs/dbraw/zinc/01/89/75/608018975.db2.gz IJDDSIRNHAIBEU-UHFFFAOYSA-N -1 3 351.357 3.510 20 0 FHADHM Brc1cc(-c2nn[n-]n2)ccc1N[C@@H]1CCOc2ccccc21 ZINC000823826134 608047007 /nfs/dbraw/zinc/04/70/07/608047007.db2.gz DBEIDQBPTSAORM-CYBMUJFWSA-N -1 3 372.226 3.565 20 0 FHADHM Cc1cc2c(ncnc2SCc2ccc(F)cc2-c2nnn[n-]2)s1 ZINC000826272914 608055701 /nfs/dbraw/zinc/05/57/01/608055701.db2.gz HFRAQIQYPJZVIM-UHFFFAOYSA-N -1 3 358.427 3.611 20 0 FHADHM Cc1cc2c(ncnc2SCc2ccc(F)cc2-c2nn[n-]n2)s1 ZINC000826272914 608055702 /nfs/dbraw/zinc/05/57/02/608055702.db2.gz HFRAQIQYPJZVIM-UHFFFAOYSA-N -1 3 358.427 3.611 20 0 FHADHM O=C(NC1CCC1)c1ccc(Oc2ccccc2-c2nnn[n-]2)c(Cl)c1 ZINC000826430128 608058635 /nfs/dbraw/zinc/05/86/35/608058635.db2.gz UVTRFXSMEHMCLC-UHFFFAOYSA-N -1 3 369.812 3.595 20 0 FHADHM O=C(NC1CCC1)c1ccc(Oc2ccccc2-c2nn[n-]n2)c(Cl)c1 ZINC000826430128 608058636 /nfs/dbraw/zinc/05/86/36/608058636.db2.gz UVTRFXSMEHMCLC-UHFFFAOYSA-N -1 3 369.812 3.595 20 0 FHADHM C[C@@H](c1cccc(Cl)c1)N1CCO[C@@H](c2cccc(-c3nnn[n-]3)c2)C1 ZINC000824770484 608066074 /nfs/dbraw/zinc/06/60/74/608066074.db2.gz KZGIFQWYUYDXRE-SCLBCKFNSA-N -1 3 369.856 3.655 20 0 FHADHM C[C@@H](c1cccc(Cl)c1)N1CCO[C@@H](c2cccc(-c3nn[n-]n3)c2)C1 ZINC000824770484 608066075 /nfs/dbraw/zinc/06/60/75/608066075.db2.gz KZGIFQWYUYDXRE-SCLBCKFNSA-N -1 3 369.856 3.655 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1c(F)cccc1F ZINC000824046560 608158983 /nfs/dbraw/zinc/15/89/83/608158983.db2.gz TXIDUPNPQIIHGX-MRVPVSSYSA-N -1 3 363.755 3.541 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1c(F)cccc1F ZINC000824046560 608158985 /nfs/dbraw/zinc/15/89/85/608158985.db2.gz TXIDUPNPQIIHGX-MRVPVSSYSA-N -1 3 363.755 3.541 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1CNCc1cc(Cl)sc1Cl ZINC000826371300 608162567 /nfs/dbraw/zinc/16/25/67/608162567.db2.gz AUJXEBOZUYLBRS-UHFFFAOYSA-N -1 3 358.229 3.664 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CNCc1cc(Cl)sc1Cl ZINC000826371300 608162569 /nfs/dbraw/zinc/16/25/69/608162569.db2.gz AUJXEBOZUYLBRS-UHFFFAOYSA-N -1 3 358.229 3.664 20 0 FHADHM Cc1c(NC(=O)C2(Cc3ccc(Cl)cc3)CC2)cccc1-c1nnn[n-]1 ZINC000826240842 608162650 /nfs/dbraw/zinc/16/26/50/608162650.db2.gz IRVCAEVRPNNKHM-UHFFFAOYSA-N -1 3 367.840 3.790 20 0 FHADHM Cc1c(NC(=O)C2(Cc3ccc(Cl)cc3)CC2)cccc1-c1nn[n-]n1 ZINC000826240842 608162651 /nfs/dbraw/zinc/16/26/51/608162651.db2.gz IRVCAEVRPNNKHM-UHFFFAOYSA-N -1 3 367.840 3.790 20 0 FHADHM CC(C)Oc1ccccc1C(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000824333098 608181257 /nfs/dbraw/zinc/18/12/57/608181257.db2.gz DJFAFJAGKVFILR-ZDUSSCGKSA-N -1 3 352.394 3.572 20 0 FHADHM CC(C)Oc1ccccc1C(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000824333098 608181259 /nfs/dbraw/zinc/18/12/59/608181259.db2.gz DJFAFJAGKVFILR-ZDUSSCGKSA-N -1 3 352.394 3.572 20 0 FHADHM C[C@@H](OC(=O)c1sccc1-c1nnn[n-]1)c1ccc(F)cc1Cl ZINC000826232025 608186220 /nfs/dbraw/zinc/18/62/20/608186220.db2.gz FJYVATUMKQLHFD-SSDOTTSWSA-N -1 3 352.778 3.639 20 0 FHADHM CCCCc1nc(CSc2cccc(Cl)c2-c2nnn[n-]2)no1 ZINC000825296683 608205745 /nfs/dbraw/zinc/20/57/45/608205745.db2.gz SHTASHZSHWEGNU-UHFFFAOYSA-N -1 3 350.835 3.538 20 0 FHADHM CCCCc1nc(CSc2cccc(Cl)c2-c2nn[n-]n2)no1 ZINC000825296683 608205746 /nfs/dbraw/zinc/20/57/46/608205746.db2.gz SHTASHZSHWEGNU-UHFFFAOYSA-N -1 3 350.835 3.538 20 0 FHADHM FC(F)Oc1ccc(CNc2ccc3cc(-c4nnn[n-]4)ccc3n2)cc1 ZINC000826369931 608221654 /nfs/dbraw/zinc/22/16/54/608221654.db2.gz VULZHKINHCAYKL-UHFFFAOYSA-N -1 3 368.347 3.628 20 0 FHADHM FC(F)Oc1ccc(CNc2ccc3cc(-c4nn[n-]n4)ccc3n2)cc1 ZINC000826369931 608221656 /nfs/dbraw/zinc/22/16/56/608221656.db2.gz VULZHKINHCAYKL-UHFFFAOYSA-N -1 3 368.347 3.628 20 0 FHADHM c1ccc(Oc2ccc(CSc3ccc(-c4nnn[n-]4)cc3)nn2)cc1 ZINC000826522565 608231349 /nfs/dbraw/zinc/23/13/49/608231349.db2.gz GYMJOAFCLPEBEO-UHFFFAOYSA-N -1 3 362.418 3.741 20 0 FHADHM c1ccc(Oc2ccc(CSc3ccc(-c4nn[n-]n4)cc3)nn2)cc1 ZINC000826522565 608231350 /nfs/dbraw/zinc/23/13/50/608231350.db2.gz GYMJOAFCLPEBEO-UHFFFAOYSA-N -1 3 362.418 3.741 20 0 FHADHM Fc1cccc([C@H](Nc2ccc(-c3nn[n-]n3)cc2F)c2ccccn2)c1 ZINC000826376889 608234471 /nfs/dbraw/zinc/23/44/71/608234471.db2.gz WXSMXMUORWKBDL-SFHVURJKSA-N -1 3 364.359 3.741 20 0 FHADHM COc1ccc([C@@H](OC)[C@@H](C)Nc2cc(Cl)ccc2-c2nnn[n-]2)cc1 ZINC000826190164 608239948 /nfs/dbraw/zinc/23/99/48/608239948.db2.gz RRCQHELBMUDSBF-DIFFPNOSSA-N -1 3 373.844 3.717 20 0 FHADHM COc1ccc([C@@H](OC)[C@@H](C)Nc2cc(Cl)ccc2-c2nn[n-]n2)cc1 ZINC000826190164 608239949 /nfs/dbraw/zinc/23/99/49/608239949.db2.gz RRCQHELBMUDSBF-DIFFPNOSSA-N -1 3 373.844 3.717 20 0 FHADHM CC(C)[C@@H]1C[C@H](Nc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)CCO1 ZINC000824215010 608242157 /nfs/dbraw/zinc/24/21/57/608242157.db2.gz JITUFMHQFKXHJX-RISCZKNCSA-N -1 3 355.364 3.501 20 0 FHADHM CC(C)[C@@H]1C[C@H](Nc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)CCO1 ZINC000824215010 608242158 /nfs/dbraw/zinc/24/21/58/608242158.db2.gz JITUFMHQFKXHJX-RISCZKNCSA-N -1 3 355.364 3.501 20 0 FHADHM C[C@H](CC(=O)Nc1sccc1-c1nnn[n-]1)Cc1ccc(Cl)cc1 ZINC000824385588 608257947 /nfs/dbraw/zinc/25/79/47/608257947.db2.gz XDXFFAJGDGAIPQ-JTQLQIEISA-N -1 3 361.858 3.789 20 0 FHADHM C[C@H](CC(=O)Nc1sccc1-c1nn[n-]n1)Cc1ccc(Cl)cc1 ZINC000824385588 608257949 /nfs/dbraw/zinc/25/79/49/608257949.db2.gz XDXFFAJGDGAIPQ-JTQLQIEISA-N -1 3 361.858 3.789 20 0 FHADHM Cc1sc(NC(=O)[C@H](c2ccccc2)C2CC2)c(-c2nnn[n-]2)c1C ZINC000826349435 608265052 /nfs/dbraw/zinc/26/50/52/608265052.db2.gz HSZHJJHBCFIITJ-OAHLLOKOSA-N -1 3 353.451 3.677 20 0 FHADHM Cc1sc(NC(=O)[C@H](c2ccccc2)C2CC2)c(-c2nn[n-]n2)c1C ZINC000826349435 608265053 /nfs/dbraw/zinc/26/50/53/608265053.db2.gz HSZHJJHBCFIITJ-OAHLLOKOSA-N -1 3 353.451 3.677 20 0 FHADHM CC[C@@H](OC(=O)c1cc(-c2nnn[n-]2)cs1)c1cc(C)ccc1OC ZINC000825153488 608272308 /nfs/dbraw/zinc/27/23/08/608272308.db2.gz HURODSYKYLCIEO-CYBMUJFWSA-N -1 3 358.423 3.553 20 0 FHADHM CC[C@@H](OC(=O)c1cc(-c2nn[n-]n2)cs1)c1cc(C)ccc1OC ZINC000825153488 608272309 /nfs/dbraw/zinc/27/23/09/608272309.db2.gz HURODSYKYLCIEO-CYBMUJFWSA-N -1 3 358.423 3.553 20 0 FHADHM Cc1ccc2c(c1)CCN2C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000826293771 608289631 /nfs/dbraw/zinc/28/96/31/608289631.db2.gz AUVVOACVAMLLSK-UHFFFAOYSA-N -1 3 370.869 3.588 20 0 FHADHM Cc1ccc2c(c1)CCN2C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000826293771 608289633 /nfs/dbraw/zinc/28/96/33/608289633.db2.gz AUVVOACVAMLLSK-UHFFFAOYSA-N -1 3 370.869 3.588 20 0 FHADHM C[C@@H](Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1)c1cccc(F)c1F ZINC000824662047 608304494 /nfs/dbraw/zinc/30/44/94/608304494.db2.gz BASQIAOCYLSXFJ-SSDOTTSWSA-N -1 3 370.285 3.732 20 0 FHADHM C[C@@H](Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1)c1cccc(F)c1F ZINC000824662047 608304496 /nfs/dbraw/zinc/30/44/96/608304496.db2.gz BASQIAOCYLSXFJ-SSDOTTSWSA-N -1 3 370.285 3.732 20 0 FHADHM O=C(NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1)C1CCCCC1 ZINC000826440336 608305897 /nfs/dbraw/zinc/30/58/97/608305897.db2.gz JGWHIQDSMKKRSE-UHFFFAOYSA-N -1 3 361.449 3.730 20 0 FHADHM O=C(NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1)C1CCCCC1 ZINC000826440336 608305898 /nfs/dbraw/zinc/30/58/98/608305898.db2.gz JGWHIQDSMKKRSE-UHFFFAOYSA-N -1 3 361.449 3.730 20 0 FHADHM CCCCc1noc([C@H](C)SCc2ccc(-c3nnn[n-]3)cc2OC)n1 ZINC000825296537 608321891 /nfs/dbraw/zinc/32/18/91/608321891.db2.gz NKQKSLHHDWDWAP-NSHDSACASA-N -1 3 374.470 3.595 20 0 FHADHM CCCCc1noc([C@H](C)SCc2ccc(-c3nn[n-]n3)cc2OC)n1 ZINC000825296537 608321893 /nfs/dbraw/zinc/32/18/93/608321893.db2.gz NKQKSLHHDWDWAP-NSHDSACASA-N -1 3 374.470 3.595 20 0 FHADHM C/C(=C/C(=O)NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1)C1CC1 ZINC000823942481 608328700 /nfs/dbraw/zinc/32/87/00/608328700.db2.gz CUAVTGHZQBYNCT-OWBHPGMISA-N -1 3 359.433 3.506 20 0 FHADHM C/C(=C/C(=O)NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1)C1CC1 ZINC000823942481 608328701 /nfs/dbraw/zinc/32/87/01/608328701.db2.gz CUAVTGHZQBYNCT-OWBHPGMISA-N -1 3 359.433 3.506 20 0 FHADHM C/C(=C\C(=O)NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1)C1CC1 ZINC000823942482 608328715 /nfs/dbraw/zinc/32/87/15/608328715.db2.gz CUAVTGHZQBYNCT-WYMLVPIESA-N -1 3 359.433 3.506 20 0 FHADHM C/C(=C\C(=O)NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1)C1CC1 ZINC000823942482 608328716 /nfs/dbraw/zinc/32/87/16/608328716.db2.gz CUAVTGHZQBYNCT-WYMLVPIESA-N -1 3 359.433 3.506 20 0 FHADHM CCN(C(=O)c1ccc2cc[nH]c2c1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825385345 608342246 /nfs/dbraw/zinc/34/22/46/608342246.db2.gz CSTFXQFXMVAEEN-UHFFFAOYSA-N -1 3 366.812 3.668 20 0 FHADHM CCN(C(=O)c1ccc2cc[nH]c2c1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825385345 608342247 /nfs/dbraw/zinc/34/22/47/608342247.db2.gz CSTFXQFXMVAEEN-UHFFFAOYSA-N -1 3 366.812 3.668 20 0 FHADHM CCc1ccc(CC(=O)N(CC)c2ccc(-c3nnn[n-]3)c(Cl)c2)cc1 ZINC000825704634 608344405 /nfs/dbraw/zinc/34/44/05/608344405.db2.gz LFHFSOGZLROUCE-UHFFFAOYSA-N -1 3 369.856 3.678 20 0 FHADHM CCc1ccc(CC(=O)N(CC)c2ccc(-c3nn[n-]n3)c(Cl)c2)cc1 ZINC000825704634 608344406 /nfs/dbraw/zinc/34/44/06/608344406.db2.gz LFHFSOGZLROUCE-UHFFFAOYSA-N -1 3 369.856 3.678 20 0 FHADHM CCN(C(=O)[C@@H](C)c1cccc(C)c1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825361066 608346765 /nfs/dbraw/zinc/34/67/65/608346765.db2.gz ATCIDKXDQVQXLI-ZDUSSCGKSA-N -1 3 369.856 3.985 20 0 FHADHM CCN(C(=O)[C@@H](C)c1cccc(C)c1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825361066 608346766 /nfs/dbraw/zinc/34/67/66/608346766.db2.gz ATCIDKXDQVQXLI-ZDUSSCGKSA-N -1 3 369.856 3.985 20 0 FHADHM C[C@@H](O)c1ccc(CNc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)cc1 ZINC000824707531 608372712 /nfs/dbraw/zinc/37/27/12/608372712.db2.gz SHKDXROGFVZZGQ-SNVBAGLBSA-N -1 3 363.343 3.551 20 0 FHADHM C[C@@H](O)c1ccc(CNc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)cc1 ZINC000824707531 608372714 /nfs/dbraw/zinc/37/27/14/608372714.db2.gz SHKDXROGFVZZGQ-SNVBAGLBSA-N -1 3 363.343 3.551 20 0 FHADHM Clc1cc(NCc2nc(-c3ccccc3)c[nH]2)ccc1-c1nnn[n-]1 ZINC000826350958 608376201 /nfs/dbraw/zinc/37/62/01/608376201.db2.gz RINURTYNPGSWDR-UHFFFAOYSA-N -1 3 351.801 3.522 20 0 FHADHM Clc1cc(NCc2nc(-c3ccccc3)c[nH]2)ccc1-c1nn[n-]n1 ZINC000826350958 608376203 /nfs/dbraw/zinc/37/62/03/608376203.db2.gz RINURTYNPGSWDR-UHFFFAOYSA-N -1 3 351.801 3.522 20 0 FHADHM CC(C)(C)CN(CC(C)(C)C)C(=S)Nc1ccccc1-c1nnn[n-]1 ZINC000824085096 608385427 /nfs/dbraw/zinc/38/54/27/608385427.db2.gz AXQDTJFSDDQULT-UHFFFAOYSA-N -1 3 360.531 3.958 20 0 FHADHM CC(C)(C)CN(CC(C)(C)C)C(=S)Nc1ccccc1-c1nn[n-]n1 ZINC000824085096 608385429 /nfs/dbraw/zinc/38/54/29/608385429.db2.gz AXQDTJFSDDQULT-UHFFFAOYSA-N -1 3 360.531 3.958 20 0 FHADHM CCC(CC)n1ccc(CSCc2cccc(-c3nnn[n-]3)c2F)n1 ZINC000825114753 608403953 /nfs/dbraw/zinc/40/39/53/608403953.db2.gz PNSHQVFEJCANFK-UHFFFAOYSA-N -1 3 360.462 3.997 20 0 FHADHM CCC(CC)n1ccc(CSCc2cccc(-c3nn[n-]n3)c2F)n1 ZINC000825114753 608403954 /nfs/dbraw/zinc/40/39/54/608403954.db2.gz PNSHQVFEJCANFK-UHFFFAOYSA-N -1 3 360.462 3.997 20 0 FHADHM Fc1ccc2ccc(N3CC=C(c4ccc(-c5nnn[n-]5)cc4)CC3)nc2c1 ZINC000826376250 608442650 /nfs/dbraw/zinc/44/26/50/608442650.db2.gz UYIJGWZZHVKNAP-UHFFFAOYSA-N -1 3 372.407 3.848 20 0 FHADHM Fc1ccc2ccc(N3CC=C(c4ccc(-c5nn[n-]n5)cc4)CC3)nc2c1 ZINC000826376250 608442652 /nfs/dbraw/zinc/44/26/52/608442652.db2.gz UYIJGWZZHVKNAP-UHFFFAOYSA-N -1 3 372.407 3.848 20 0 FHADHM Cc1ccc(NCc2cc(-c3nnn[n-]3)cs2)c(Br)c1 ZINC000826291611 608449951 /nfs/dbraw/zinc/44/99/51/608449951.db2.gz NOBWKOCPWLFPQM-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM Cc1ccc(NCc2cc(-c3nn[n-]n3)cs2)c(Br)c1 ZINC000826291611 608449953 /nfs/dbraw/zinc/44/99/53/608449953.db2.gz NOBWKOCPWLFPQM-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM C[C@@H](CC1CCCC1)C(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000824392444 608478107 /nfs/dbraw/zinc/47/81/07/608478107.db2.gz OCFOAPDXTGJPGT-HNNXBMFYSA-N -1 3 365.481 3.699 20 0 FHADHM C[C@@H](CC1CCCC1)C(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000824392444 608478109 /nfs/dbraw/zinc/47/81/09/608478109.db2.gz OCFOAPDXTGJPGT-HNNXBMFYSA-N -1 3 365.481 3.699 20 0 FHADHM O=C(C1CCCCCCC1)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000826399116 608489419 /nfs/dbraw/zinc/48/94/19/608489419.db2.gz NASYFDJYVFSGFE-UHFFFAOYSA-N -1 3 365.481 3.843 20 0 FHADHM O=C(C1CCCCCCC1)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000826399116 608489420 /nfs/dbraw/zinc/48/94/20/608489420.db2.gz NASYFDJYVFSGFE-UHFFFAOYSA-N -1 3 365.481 3.843 20 0 FHADHM Cc1ccc(-c2nc(CN[C@H](C)c3cccc(-c4nn[n-]n4)c3)cs2)o1 ZINC000826273392 608491272 /nfs/dbraw/zinc/49/12/72/608491272.db2.gz BRTUWBLLYUNYDB-GFCCVEGCSA-N -1 3 366.450 3.742 20 0 FHADHM CSc1cccc(NC(=O)Nc2ccc(F)cc2-c2nnn[n-]2)c1C ZINC000826230636 608493998 /nfs/dbraw/zinc/49/39/98/608493998.db2.gz CEQMFKAWXPLFQI-UHFFFAOYSA-N -1 3 358.402 3.680 20 0 FHADHM CSc1cccc(NC(=O)Nc2ccc(F)cc2-c2nn[n-]n2)c1C ZINC000826230636 608493999 /nfs/dbraw/zinc/49/39/99/608493999.db2.gz CEQMFKAWXPLFQI-UHFFFAOYSA-N -1 3 358.402 3.680 20 0 FHADHM c1coc(CN(Cc2cccs2)Cc2cc(-c3nnn[n-]3)cs2)c1 ZINC000826526300 608498897 /nfs/dbraw/zinc/49/88/97/608498897.db2.gz TUGPNXZNKFMJTH-UHFFFAOYSA-N -1 3 357.464 3.785 20 0 FHADHM c1coc(CN(Cc2cccs2)Cc2cc(-c3nn[n-]n3)cs2)c1 ZINC000826526300 608498899 /nfs/dbraw/zinc/49/88/99/608498899.db2.gz TUGPNXZNKFMJTH-UHFFFAOYSA-N -1 3 357.464 3.785 20 0 FHADHM CCc1ccc(NC(=O)N(C)Cc2ccc(-c3nnn[n-]3)cc2)cc1CC ZINC000825711820 608507323 /nfs/dbraw/zinc/50/73/23/608507323.db2.gz GUHPGBOYHQLXND-UHFFFAOYSA-N -1 3 364.453 3.655 20 0 FHADHM CCc1ccc(NC(=O)N(C)Cc2ccc(-c3nn[n-]n3)cc2)cc1CC ZINC000825711820 608507325 /nfs/dbraw/zinc/50/73/25/608507325.db2.gz GUHPGBOYHQLXND-UHFFFAOYSA-N -1 3 364.453 3.655 20 0 FHADHM C[C@@H](c1ccc(Cl)cc1Cl)N(C)Cc1ccc(-c2nn[n-]n2)o1 ZINC000824762616 608526163 /nfs/dbraw/zinc/52/61/63/608526163.db2.gz HVQOAWCSVVVKDH-VIFPVBQESA-N -1 3 352.225 3.960 20 0 FHADHM Clc1cccc(Cl)c1CNC1(c2cccc(-c3nn[n-]n3)c2)CC1 ZINC000826353189 608532709 /nfs/dbraw/zinc/53/27/09/608532709.db2.gz FMBULYRCGNYINW-UHFFFAOYSA-N -1 3 360.248 3.952 20 0 FHADHM O=C(NCc1cccc(-c2nnn[n-]2)c1)N(c1ccccc1)c1ccccc1 ZINC000826442085 608569253 /nfs/dbraw/zinc/56/92/53/608569253.db2.gz IHAZVTFIVUKHTH-UHFFFAOYSA-N -1 3 370.416 3.915 20 0 FHADHM O=C(NCc1cccc(-c2nn[n-]n2)c1)N(c1ccccc1)c1ccccc1 ZINC000826442085 608569255 /nfs/dbraw/zinc/56/92/55/608569255.db2.gz IHAZVTFIVUKHTH-UHFFFAOYSA-N -1 3 370.416 3.915 20 0 FHADHM CC[C@H](C)N(Cc1ccccc1)C(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000825068594 608573171 /nfs/dbraw/zinc/57/31/71/608573171.db2.gz UGDLVULYIGQAET-ZDUSSCGKSA-N -1 3 369.856 3.961 20 0 FHADHM CC[C@H](C)N(Cc1ccccc1)C(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000825068594 608573172 /nfs/dbraw/zinc/57/31/72/608573172.db2.gz UGDLVULYIGQAET-ZDUSSCGKSA-N -1 3 369.856 3.961 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccc(F)c(Cl)c1F ZINC000826452306 608574053 /nfs/dbraw/zinc/57/40/53/608574053.db2.gz OKVYLIHODSMFSL-UHFFFAOYSA-N -1 3 370.146 3.704 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccc(F)c(Cl)c1F ZINC000826452306 608574054 /nfs/dbraw/zinc/57/40/54/608574054.db2.gz OKVYLIHODSMFSL-UHFFFAOYSA-N -1 3 370.146 3.704 20 0 FHADHM Cc1c2ccccc2nc(-c2ccccc2OC(F)F)c1-c1nnn[n-]1 ZINC000826233553 608581397 /nfs/dbraw/zinc/58/13/97/608581397.db2.gz MBAOSAZNRDAIHV-UHFFFAOYSA-N -1 3 353.332 3.992 20 0 FHADHM Cc1c2ccccc2nc(-c2ccccc2OC(F)F)c1-c1nn[n-]n1 ZINC000826233553 608581399 /nfs/dbraw/zinc/58/13/99/608581399.db2.gz MBAOSAZNRDAIHV-UHFFFAOYSA-N -1 3 353.332 3.992 20 0 FHADHM CN(Cc1cccc(-c2nnn[n-]2)c1F)Cc1ccccc1C(F)(F)F ZINC000825980686 608644663 /nfs/dbraw/zinc/64/46/63/608644663.db2.gz GSVXOJHOCWBWNP-UHFFFAOYSA-N -1 3 365.334 3.657 20 0 FHADHM CN(Cc1cccc(-c2nn[n-]n2)c1F)Cc1ccccc1C(F)(F)F ZINC000825980686 608644666 /nfs/dbraw/zinc/64/46/66/608644666.db2.gz GSVXOJHOCWBWNP-UHFFFAOYSA-N -1 3 365.334 3.657 20 0 FHADHM CCc1nnc(Oc2ccc(-c3ccccc3)nc2)c(-c2nnn[n-]2)c1CC ZINC000825771605 608796090 /nfs/dbraw/zinc/79/60/90/608796090.db2.gz NASCOESARCCEET-UHFFFAOYSA-N -1 3 373.420 3.636 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)N1CCC[C@@H]1/C=C/c1ccccc1 ZINC000826402066 609138241 /nfs/dbraw/zinc/13/82/41/609138241.db2.gz MKMMEYHKTIXCBR-BSJXMRLOSA-N -1 3 371.444 3.584 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)N1CCC[C@@H]1/C=C/c1ccccc1 ZINC000826402066 609138242 /nfs/dbraw/zinc/13/82/42/609138242.db2.gz MKMMEYHKTIXCBR-BSJXMRLOSA-N -1 3 371.444 3.584 20 0 FHADHM COc1cc(C)c(N[C@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)cc1OC ZINC000826178033 609157665 /nfs/dbraw/zinc/15/76/65/609157665.db2.gz HCLIWMPMVNELEJ-LLVKDONJSA-N -1 3 357.389 3.505 20 0 FHADHM COc1cc(C)c(N[C@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)cc1OC ZINC000826178033 609157666 /nfs/dbraw/zinc/15/76/66/609157666.db2.gz HCLIWMPMVNELEJ-LLVKDONJSA-N -1 3 357.389 3.505 20 0 FHADHM C[C@H](Nc1cccc(Br)c1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824663173 609160653 /nfs/dbraw/zinc/16/06/53/609160653.db2.gz WFFWCISPYSKYNP-VIFPVBQESA-N -1 3 362.206 3.941 20 0 FHADHM C[C@H](Nc1cccc(Br)c1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824663173 609160654 /nfs/dbraw/zinc/16/06/54/609160654.db2.gz WFFWCISPYSKYNP-VIFPVBQESA-N -1 3 362.206 3.941 20 0 FHADHM Cc1c(C)n(-c2ccccc2)c(NC(=O)[C@H]2CC=CCC2)c1-c1nnn[n-]1 ZINC000826233632 609165403 /nfs/dbraw/zinc/16/54/03/609165403.db2.gz POGYCEPAQJFKAY-HNNXBMFYSA-N -1 3 362.437 3.569 20 0 FHADHM Cc1c(C)n(-c2ccccc2)c(NC(=O)[C@H]2CC=CCC2)c1-c1nn[n-]n1 ZINC000826233632 609165404 /nfs/dbraw/zinc/16/54/04/609165404.db2.gz POGYCEPAQJFKAY-HNNXBMFYSA-N -1 3 362.437 3.569 20 0 FHADHM CCOc1ccc(N[C@H]2CCCc3cc(-c4nnn[n-]4)ccc32)cc1F ZINC000825643705 609180050 /nfs/dbraw/zinc/18/00/50/609180050.db2.gz RVRWULDEGXGSDB-KRWDZBQOSA-N -1 3 353.401 3.894 20 0 FHADHM CCOc1ccc(N[C@H]2CCCc3cc(-c4nn[n-]n4)ccc32)cc1F ZINC000825643705 609180051 /nfs/dbraw/zinc/18/00/51/609180051.db2.gz RVRWULDEGXGSDB-KRWDZBQOSA-N -1 3 353.401 3.894 20 0 FHADHM COc1c(C)cnc(CS[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1C ZINC000826167258 609183356 /nfs/dbraw/zinc/18/33/56/609183356.db2.gz WHQNFBPPDVUSOH-ZDUSSCGKSA-N -1 3 355.467 3.882 20 0 FHADHM COc1c(C)cnc(CS[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1C ZINC000826167258 609183357 /nfs/dbraw/zinc/18/33/57/609183357.db2.gz WHQNFBPPDVUSOH-ZDUSSCGKSA-N -1 3 355.467 3.882 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1OCCSCc1ccc(CF)cc1 ZINC000826176692 609185162 /nfs/dbraw/zinc/18/51/62/609185162.db2.gz ZILVSKWEMNJXKF-UHFFFAOYSA-N -1 3 374.441 3.657 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1OCCSCc1ccc(CF)cc1 ZINC000826176692 609185163 /nfs/dbraw/zinc/18/51/63/609185163.db2.gz ZILVSKWEMNJXKF-UHFFFAOYSA-N -1 3 374.441 3.657 20 0 FHADHM O=C(Nc1ccc(Oc2ccccc2-c2nnn[n-]2)cc1)c1cccc(O)c1 ZINC000826455484 609211327 /nfs/dbraw/zinc/21/13/27/609211327.db2.gz PZCPRXSQYFJJIK-UHFFFAOYSA-N -1 3 373.372 3.617 20 0 FHADHM O=C(Nc1ccc(Oc2ccccc2-c2nn[n-]n2)cc1)c1cccc(O)c1 ZINC000826455484 609211328 /nfs/dbraw/zinc/21/13/28/609211328.db2.gz PZCPRXSQYFJJIK-UHFFFAOYSA-N -1 3 373.372 3.617 20 0 FHADHM C[C@@H](Nc1ccc(F)cc1OCC1CC1)c1cccc(-c2nnn[n-]2)c1 ZINC000824656497 609238685 /nfs/dbraw/zinc/23/86/85/609238685.db2.gz KYVBBTFLGZSTQY-GFCCVEGCSA-N -1 3 353.401 3.968 20 0 FHADHM C[C@@H](Nc1ccc(F)cc1OCC1CC1)c1cccc(-c2nn[n-]n2)c1 ZINC000824656497 609238686 /nfs/dbraw/zinc/23/86/86/609238686.db2.gz KYVBBTFLGZSTQY-GFCCVEGCSA-N -1 3 353.401 3.968 20 0 FHADHM COCCOc1c(Cl)cccc1N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000826160663 609247476 /nfs/dbraw/zinc/24/74/76/609247476.db2.gz AKWITYYWDMMGBS-GFCCVEGCSA-N -1 3 373.844 3.718 20 0 FHADHM COCCOc1c(Cl)cccc1N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000826160663 609247478 /nfs/dbraw/zinc/24/74/78/609247478.db2.gz AKWITYYWDMMGBS-GFCCVEGCSA-N -1 3 373.844 3.718 20 0 FHADHM C[C@@H](Nc1cnn(-c2ccccc2Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824662165 609251660 /nfs/dbraw/zinc/25/16/60/609251660.db2.gz DYMSROBYBWYTPU-GFCCVEGCSA-N -1 3 365.828 3.879 20 0 FHADHM C[C@@H](Nc1cnn(-c2ccccc2Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824662165 609251661 /nfs/dbraw/zinc/25/16/61/609251661.db2.gz DYMSROBYBWYTPU-GFCCVEGCSA-N -1 3 365.828 3.879 20 0 FHADHM CCc1c(N[C@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)cnn1CC(C)C ZINC000825694173 609252910 /nfs/dbraw/zinc/25/29/10/609252910.db2.gz MOAAHRIZWTYNQG-GFCCVEGCSA-N -1 3 357.437 3.594 20 0 FHADHM CCc1c(N[C@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)cnn1CC(C)C ZINC000825694173 609252912 /nfs/dbraw/zinc/25/29/12/609252912.db2.gz MOAAHRIZWTYNQG-GFCCVEGCSA-N -1 3 357.437 3.594 20 0 FHADHM COc1cc(F)c(N[C@H]2CCCc3cc(-c4nnn[n-]4)ccc32)cc1OC ZINC000826180086 609254811 /nfs/dbraw/zinc/25/48/11/609254811.db2.gz RNEGCRXONBAPAL-HNNXBMFYSA-N -1 3 369.400 3.513 20 0 FHADHM COc1cc(F)c(N[C@H]2CCCc3cc(-c4nn[n-]n4)ccc32)cc1OC ZINC000826180086 609254813 /nfs/dbraw/zinc/25/48/13/609254813.db2.gz RNEGCRXONBAPAL-HNNXBMFYSA-N -1 3 369.400 3.513 20 0 FHADHM O=C(Cc1ccc(-c2nnn[n-]2)cc1)Nc1ccccc1Nc1ccccc1 ZINC000826421850 609260527 /nfs/dbraw/zinc/26/05/27/609260527.db2.gz BYAUIHQFVLXNGN-UHFFFAOYSA-N -1 3 370.416 3.792 20 0 FHADHM O=C(Cc1ccc(-c2nn[n-]n2)cc1)Nc1ccccc1Nc1ccccc1 ZINC000826421850 609260529 /nfs/dbraw/zinc/26/05/29/609260529.db2.gz BYAUIHQFVLXNGN-UHFFFAOYSA-N -1 3 370.416 3.792 20 0 FHADHM Cc1cc2oc(NCc3cc(-c4nnn[n-]4)cs3)nc2c(C)c1Cl ZINC000826273293 609266396 /nfs/dbraw/zinc/26/63/96/609266396.db2.gz XLFCOVGZDDHFTM-UHFFFAOYSA-N -1 3 360.830 3.952 20 0 FHADHM Cc1cc2oc(NCc3cc(-c4nn[n-]n4)cs3)nc2c(C)c1Cl ZINC000826273293 609266398 /nfs/dbraw/zinc/26/63/98/609266398.db2.gz XLFCOVGZDDHFTM-UHFFFAOYSA-N -1 3 360.830 3.952 20 0 FHADHM c1cc(-c2nnn[n-]2)sc1CNc1nnc(CC2CCCCC2)s1 ZINC000826514917 609266621 /nfs/dbraw/zinc/26/66/21/609266621.db2.gz HGUASYRKHXOMRZ-UHFFFAOYSA-N -1 3 361.500 3.515 20 0 FHADHM Cc1ccc(C(C)C)cc1O[C@@H](C)C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000641980290 609282826 /nfs/dbraw/zinc/28/28/26/609282826.db2.gz NVGCMUFKPMVHRI-AWEZNQCLSA-N -1 3 365.437 3.705 20 0 FHADHM Cc1ccc(C(C)C)cc1O[C@@H](C)C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000641980290 609282828 /nfs/dbraw/zinc/28/28/28/609282828.db2.gz NVGCMUFKPMVHRI-AWEZNQCLSA-N -1 3 365.437 3.705 20 0 FHADHM COCCC[C@@H](C)C(=O)Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1 ZINC000826155483 609314876 /nfs/dbraw/zinc/31/48/76/609314876.db2.gz RKMICKQIOFUAHL-GFCCVEGCSA-N -1 3 371.466 3.596 20 0 FHADHM COCCC[C@@H](C)C(=O)Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1 ZINC000826155483 609314878 /nfs/dbraw/zinc/31/48/78/609314878.db2.gz RKMICKQIOFUAHL-GFCCVEGCSA-N -1 3 371.466 3.596 20 0 FHADHM CC(C)Oc1ccccc1CN[C@@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000824333064 609327227 /nfs/dbraw/zinc/32/72/27/609327227.db2.gz CWDWSRYUGAPUMA-ZDUSSCGKSA-N -1 3 355.417 3.644 20 0 FHADHM Brc1cc(-c2nnn[n-]2)ccc1COc1ccc2[nH]ccc2c1 ZINC000823820527 609328348 /nfs/dbraw/zinc/32/83/48/609328348.db2.gz GPMJYHJJQONLIH-UHFFFAOYSA-N -1 3 370.210 3.690 20 0 FHADHM Brc1cc(-c2nn[n-]n2)ccc1COc1ccc2[nH]ccc2c1 ZINC000823820527 609328350 /nfs/dbraw/zinc/32/83/50/609328350.db2.gz GPMJYHJJQONLIH-UHFFFAOYSA-N -1 3 370.210 3.690 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1COc1cccc(Oc2cccnc2)c1 ZINC000826372393 609329217 /nfs/dbraw/zinc/32/92/17/609329217.db2.gz UJLLYSWZSGYRIV-UHFFFAOYSA-N -1 3 363.352 3.772 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1COc1cccc(Oc2cccnc2)c1 ZINC000826372393 609329219 /nfs/dbraw/zinc/32/92/19/609329219.db2.gz UJLLYSWZSGYRIV-UHFFFAOYSA-N -1 3 363.352 3.772 20 0 FHADHM C[C@H](N[C@@H]1CCOc2c(Cl)cccc21)c1ccc(-c2nn[n-]n2)cc1F ZINC000824554321 609330072 /nfs/dbraw/zinc/33/00/72/609330072.db2.gz OTKLZEIDAQZZII-MGPLVRAMSA-N -1 3 373.819 3.834 20 0 FHADHM C[C@@H](N[C@H]1CCOc2c(Cl)cccc21)c1ccc(-c2nn[n-]n2)cc1F ZINC000824554320 609330279 /nfs/dbraw/zinc/33/02/79/609330279.db2.gz OTKLZEIDAQZZII-HWPZZCPQSA-N -1 3 373.819 3.834 20 0 FHADHM COc1ccc(Cl)cc1CN[C@H](C)c1ccc(-c2nnn[n-]2)cc1F ZINC000826208443 609331081 /nfs/dbraw/zinc/33/10/81/609331081.db2.gz KOXDLVSFCNLMFT-SNVBAGLBSA-N -1 3 361.808 3.519 20 0 FHADHM COc1ccc(Cl)cc1CN[C@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000826208443 609331083 /nfs/dbraw/zinc/33/10/83/609331083.db2.gz KOXDLVSFCNLMFT-SNVBAGLBSA-N -1 3 361.808 3.519 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1COC(=O)c1c(Cl)cccc1Cl ZINC000826254118 609331341 /nfs/dbraw/zinc/33/13/41/609331341.db2.gz VDVDVRHBWBNUNM-UHFFFAOYSA-N -1 3 363.204 3.839 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1COC(=O)c1c(Cl)cccc1Cl ZINC000826254118 609331345 /nfs/dbraw/zinc/33/13/45/609331345.db2.gz VDVDVRHBWBNUNM-UHFFFAOYSA-N -1 3 363.204 3.839 20 0 FHADHM C[C@@H](N[C@H](c1ccccc1)c1cccnc1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824540295 609333019 /nfs/dbraw/zinc/33/30/19/609333019.db2.gz VNACIGQTNPVRIV-JLTOFOAXSA-N -1 3 374.423 3.841 20 0 FHADHM C[C@@H](N[C@H](c1ccccc1)c1cccnc1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824540295 609333021 /nfs/dbraw/zinc/33/30/21/609333021.db2.gz VNACIGQTNPVRIV-JLTOFOAXSA-N -1 3 374.423 3.841 20 0 FHADHM CCCCCn1cc(CN[C@@H](C)c2ccc(-c3nn[n-]n3)cc2F)c(C)n1 ZINC000825276396 609345519 /nfs/dbraw/zinc/34/55/19/609345519.db2.gz XBYQPHOCGLEOPS-AWEZNQCLSA-N -1 3 371.464 3.552 20 0 FHADHM Cc1csc(C2(N[C@@H](C)c3ccc(-c4nnn[n-]4)cc3F)CCC2)n1 ZINC000826320404 609348389 /nfs/dbraw/zinc/34/83/89/609348389.db2.gz PHDHQUUUGGNRKX-NSHDSACASA-N -1 3 358.446 3.501 20 0 FHADHM Cc1csc(C2(N[C@@H](C)c3ccc(-c4nn[n-]n4)cc3F)CCC2)n1 ZINC000826320404 609348391 /nfs/dbraw/zinc/34/83/91/609348391.db2.gz PHDHQUUUGGNRKX-NSHDSACASA-N -1 3 358.446 3.501 20 0 FHADHM COc1ccc(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2F)c2cccnc12 ZINC000826210607 609349576 /nfs/dbraw/zinc/34/95/76/609349576.db2.gz XVJQQFDIBAXZER-LLVKDONJSA-N -1 3 364.384 3.736 20 0 FHADHM COc1ccc(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2F)c2cccnc12 ZINC000826210607 609349577 /nfs/dbraw/zinc/34/95/77/609349577.db2.gz XVJQQFDIBAXZER-LLVKDONJSA-N -1 3 364.384 3.736 20 0 FHADHM COCCCOc1ccccc1N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1F ZINC000826157469 609349798 /nfs/dbraw/zinc/34/97/98/609349798.db2.gz WUMYNISMRAPXOY-ZDUSSCGKSA-N -1 3 371.416 3.594 20 0 FHADHM COCCCOc1ccccc1N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000826157469 609349799 /nfs/dbraw/zinc/34/97/99/609349799.db2.gz WUMYNISMRAPXOY-ZDUSSCGKSA-N -1 3 371.416 3.594 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N[C@@H](CC(C)(C)C)C(F)(F)F ZINC000826278159 609382420 /nfs/dbraw/zinc/38/24/20/609382420.db2.gz SLPUWVHUDOYXFM-LBPRGKRZSA-N -1 3 370.379 3.664 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N[C@@H](CC(C)(C)C)C(F)(F)F ZINC000826278159 609382421 /nfs/dbraw/zinc/38/24/21/609382421.db2.gz SLPUWVHUDOYXFM-LBPRGKRZSA-N -1 3 370.379 3.664 20 0 FHADHM c1[nH]c(-c2nnn[n-]2)cc1-c1nc(-c2ccc(-c3ccccc3)cc2)no1 ZINC000826519042 609411990 /nfs/dbraw/zinc/41/19/90/609411990.db2.gz HTEMXWMLWPOLLY-UHFFFAOYSA-N -1 3 355.361 3.579 20 0 FHADHM c1[nH]c(-c2nn[n-]n2)cc1-c1nc(-c2ccc(-c3ccccc3)cc2)no1 ZINC000826519042 609411991 /nfs/dbraw/zinc/41/19/91/609411991.db2.gz HTEMXWMLWPOLLY-UHFFFAOYSA-N -1 3 355.361 3.579 20 0 FHADHM CC(=O)c1ccc(-c2nnn[n-]2)cc1N[C@H](C)c1ccc(OC(F)F)cc1 ZINC000824019469 609419582 /nfs/dbraw/zinc/41/95/82/609419582.db2.gz BMFAPPVQYZIGCP-SNVBAGLBSA-N -1 3 373.363 3.844 20 0 FHADHM CC(=O)c1ccc(-c2nn[n-]n2)cc1N[C@H](C)c1ccc(OC(F)F)cc1 ZINC000824019469 609419583 /nfs/dbraw/zinc/41/95/83/609419583.db2.gz BMFAPPVQYZIGCP-SNVBAGLBSA-N -1 3 373.363 3.844 20 0 FHADHM CC(=O)c1ccc(-c2nnn[n-]2)cc1N[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000824019797 609419872 /nfs/dbraw/zinc/41/98/72/609419872.db2.gz OXAKYSBQJDUYEO-NEPJUHHUSA-N -1 3 353.348 3.602 20 0 FHADHM CC(=O)c1ccc(-c2nn[n-]n2)cc1N[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000824019797 609419874 /nfs/dbraw/zinc/41/98/74/609419874.db2.gz OXAKYSBQJDUYEO-NEPJUHHUSA-N -1 3 353.348 3.602 20 0 FHADHM CC(C)(C)Oc1c(F)cc(NCc2cccc(-c3nnn[n-]3)c2)cc1F ZINC000824120121 609445239 /nfs/dbraw/zinc/44/52/39/609445239.db2.gz ZFMRBRDKWWVZOF-UHFFFAOYSA-N -1 3 359.380 3.934 20 0 FHADHM CC(C)(C)Oc1c(F)cc(NCc2cccc(-c3nn[n-]n3)c2)cc1F ZINC000824120121 609445241 /nfs/dbraw/zinc/44/52/41/609445241.db2.gz ZFMRBRDKWWVZOF-UHFFFAOYSA-N -1 3 359.380 3.934 20 0 FHADHM Clc1cc2ncc(NCc3cccc(-c4nnn[n-]4)c3)nc2cc1Cl ZINC000826351632 609462096 /nfs/dbraw/zinc/46/20/96/609462096.db2.gz TYRWLCCVCSVWDW-UHFFFAOYSA-N -1 3 372.219 3.729 20 0 FHADHM Clc1cc2ncc(NCc3cccc(-c4nn[n-]n4)c3)nc2cc1Cl ZINC000826351632 609462098 /nfs/dbraw/zinc/46/20/98/609462098.db2.gz TYRWLCCVCSVWDW-UHFFFAOYSA-N -1 3 372.219 3.729 20 0 FHADHM Cc1ccoc1CNc1ccc(OCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000826315562 609484651 /nfs/dbraw/zinc/48/46/51/609484651.db2.gz MSKQNSPEONGXCW-UHFFFAOYSA-N -1 3 361.405 3.959 20 0 FHADHM Cc1ccoc1CNc1ccc(OCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000826315562 609484654 /nfs/dbraw/zinc/48/46/54/609484654.db2.gz MSKQNSPEONGXCW-UHFFFAOYSA-N -1 3 361.405 3.959 20 0 FHADHM c1sc(CNc2cccc(Oc3ccccn3)c2)cc1-c1nnn[n-]1 ZINC000826523039 609487305 /nfs/dbraw/zinc/48/73/05/609487305.db2.gz YHKPJPYBBVFPMC-UHFFFAOYSA-N -1 3 350.407 3.728 20 0 FHADHM c1sc(CNc2cccc(Oc3ccccn3)c2)cc1-c1nn[n-]n1 ZINC000826523039 609487308 /nfs/dbraw/zinc/48/73/08/609487308.db2.gz YHKPJPYBBVFPMC-UHFFFAOYSA-N -1 3 350.407 3.728 20 0 FHADHM c1c(CC2CC2)nn(-c2ccccc2)c1NCc1ccc(-c2nnn[n-]2)cc1 ZINC000826519742 609491182 /nfs/dbraw/zinc/49/11/82/609491182.db2.gz LZZBVKJYWJTBSJ-UHFFFAOYSA-N -1 3 371.448 3.617 20 0 FHADHM c1c(CC2CC2)nn(-c2ccccc2)c1NCc1ccc(-c2nn[n-]n2)cc1 ZINC000826519742 609491183 /nfs/dbraw/zinc/49/11/83/609491183.db2.gz LZZBVKJYWJTBSJ-UHFFFAOYSA-N -1 3 371.448 3.617 20 0 FHADHM Cc1cc(C)cc([C@@H]2CCN(C(=O)Nc3cccc(-c4nnn[n-]4)c3)C2)c1 ZINC000826264210 609497197 /nfs/dbraw/zinc/49/71/97/609497197.db2.gz GBALPFLJIDLYRO-MRXNPFEDSA-N -1 3 362.437 3.505 20 0 FHADHM Cc1cc(C)cc([C@@H]2CCN(C(=O)Nc3cccc(-c4nn[n-]n4)c3)C2)c1 ZINC000826264210 609497198 /nfs/dbraw/zinc/49/71/98/609497198.db2.gz GBALPFLJIDLYRO-MRXNPFEDSA-N -1 3 362.437 3.505 20 0 FHADHM O=C(c1sccc1-c1nnn[n-]1)N1CC=C(c2cccc3ccccc32)C1 ZINC000826475535 609501999 /nfs/dbraw/zinc/50/19/99/609501999.db2.gz JDJSAOHNCONTSM-UHFFFAOYSA-N -1 3 373.441 3.621 20 0 FHADHM O=C(c1sccc1-c1nn[n-]n1)N1CC=C(c2cccc3ccccc32)C1 ZINC000826475535 609502000 /nfs/dbraw/zinc/50/20/00/609502000.db2.gz JDJSAOHNCONTSM-UHFFFAOYSA-N -1 3 373.441 3.621 20 0 FHADHM CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)C3=CCC3)c2-c2nnn[n-]2)C1 ZINC000824077488 609510064 /nfs/dbraw/zinc/51/00/64/609510064.db2.gz BPPZCOUEXJIKPZ-LLVKDONJSA-N -1 3 357.483 3.738 20 0 FHADHM CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)C3=CCC3)c2-c2nn[n-]n2)C1 ZINC000824077488 609510065 /nfs/dbraw/zinc/51/00/65/609510065.db2.gz BPPZCOUEXJIKPZ-LLVKDONJSA-N -1 3 357.483 3.738 20 0 FHADHM Cc1ccnc(N[C@H](C)c2ccc(Br)cc2)c1-c1nnn[n-]1 ZINC000826311964 609520819 /nfs/dbraw/zinc/52/08/19/609520819.db2.gz RQFFZAGQGSMQAP-SNVBAGLBSA-N -1 3 359.231 3.506 20 0 FHADHM Cc1ccnc(N[C@H](C)c2ccc(Br)cc2)c1-c1nn[n-]n1 ZINC000826311964 609520820 /nfs/dbraw/zinc/52/08/20/609520820.db2.gz RQFFZAGQGSMQAP-SNVBAGLBSA-N -1 3 359.231 3.506 20 0 FHADHM CC[C@H](C)[C@@H](C)C(=O)N(Cc1ccco1)c1ccccc1-c1nnn[n-]1 ZINC000825051835 609525109 /nfs/dbraw/zinc/52/51/09/609525109.db2.gz SPYAVQOGUMMUSD-UONOGXRCSA-N -1 3 353.426 3.675 20 0 FHADHM CC[C@H](C)[C@@H](C)C(=O)N(Cc1ccco1)c1ccccc1-c1nn[n-]n1 ZINC000825051835 609525112 /nfs/dbraw/zinc/52/51/12/609525112.db2.gz SPYAVQOGUMMUSD-UONOGXRCSA-N -1 3 353.426 3.675 20 0 FHADHM CC/C(C)=C(/C)C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)nc1 ZINC000825050095 609527223 /nfs/dbraw/zinc/52/72/23/609527223.db2.gz GSXWMINSWCNCIP-SEYXRHQNSA-N -1 3 364.409 3.739 20 0 FHADHM CC/C(C)=C(/C)C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)nc1 ZINC000825050095 609527225 /nfs/dbraw/zinc/52/72/25/609527225.db2.gz GSXWMINSWCNCIP-SEYXRHQNSA-N -1 3 364.409 3.739 20 0 FHADHM Cc1ccnc(N[C@@H](C)c2ccccc2Br)c1-c1nnn[n-]1 ZINC000826312041 609527557 /nfs/dbraw/zinc/52/75/57/609527557.db2.gz UOPCTXDLWBOMFC-JTQLQIEISA-N -1 3 359.231 3.506 20 0 FHADHM Cc1ccnc(N[C@@H](C)c2ccccc2Br)c1-c1nn[n-]n1 ZINC000826312041 609527559 /nfs/dbraw/zinc/52/75/59/609527559.db2.gz UOPCTXDLWBOMFC-JTQLQIEISA-N -1 3 359.231 3.506 20 0 FHADHM CC[C@H](C)[C@H](C)C(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)nc1 ZINC000825049395 609529816 /nfs/dbraw/zinc/52/98/16/609529816.db2.gz BRGPCIGRYDIWAJ-STQMWFEESA-N -1 3 366.425 3.675 20 0 FHADHM Cc1ccnc(N[C@@H](C)c2ccc(OC(F)(F)F)cc2)c1-c1nnn[n-]1 ZINC000826311879 609532157 /nfs/dbraw/zinc/53/21/57/609532157.db2.gz QDKVKSTWESQVON-JTQLQIEISA-N -1 3 364.331 3.642 20 0 FHADHM Cc1ccnc(N[C@@H](C)c2ccc(OC(F)(F)F)cc2)c1-c1nn[n-]n1 ZINC000826311879 609532159 /nfs/dbraw/zinc/53/21/59/609532159.db2.gz QDKVKSTWESQVON-JTQLQIEISA-N -1 3 364.331 3.642 20 0 FHADHM Cc1nc(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)ccc1Br ZINC000826326719 609533119 /nfs/dbraw/zinc/53/31/19/609533119.db2.gz BDOLKYRMOPCRRH-SECBINFHSA-N -1 3 359.231 3.506 20 0 FHADHM Cc1nc(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)ccc1Br ZINC000826326719 609533121 /nfs/dbraw/zinc/53/31/21/609533121.db2.gz BDOLKYRMOPCRRH-SECBINFHSA-N -1 3 359.231 3.506 20 0 FHADHM CSc1ccc(F)cc1CNc1ncc(Cl)c(C)c1-c1nnn[n-]1 ZINC000826231143 609565840 /nfs/dbraw/zinc/56/58/40/609565840.db2.gz YZRQDPHFJJHBSR-UHFFFAOYSA-N -1 3 364.837 3.697 20 0 FHADHM CSc1ccc(F)cc1CNc1ncc(Cl)c(C)c1-c1nn[n-]n1 ZINC000826231143 609565843 /nfs/dbraw/zinc/56/58/43/609565843.db2.gz YZRQDPHFJJHBSR-UHFFFAOYSA-N -1 3 364.837 3.697 20 0 FHADHM COc1cccc([C@H]2C[C@H](C)CN2c2cccc(F)c2-c2nnn[n-]2)c1 ZINC000826215190 609593099 /nfs/dbraw/zinc/59/30/99/609593099.db2.gz ITHPBXHFDUTPPJ-YVEFUNNKSA-N -1 3 353.401 3.602 20 0 FHADHM COc1cccc([C@H]2C[C@H](C)CN2c2cccc(F)c2-c2nn[n-]n2)c1 ZINC000826215190 609593100 /nfs/dbraw/zinc/59/31/00/609593100.db2.gz ITHPBXHFDUTPPJ-YVEFUNNKSA-N -1 3 353.401 3.602 20 0 FHADHM c1cc(CNc2cccc(C3SCCS3)c2)cc(-c2nnn[n-]2)c1 ZINC000826516294 609620725 /nfs/dbraw/zinc/62/07/25/609620725.db2.gz FKNNXRWUXWYFKC-UHFFFAOYSA-N -1 3 355.492 3.957 20 0 FHADHM c1cc(CNc2cccc(C3SCCS3)c2)cc(-c2nn[n-]n2)c1 ZINC000826516294 609620726 /nfs/dbraw/zinc/62/07/26/609620726.db2.gz FKNNXRWUXWYFKC-UHFFFAOYSA-N -1 3 355.492 3.957 20 0 FHADHM Cc1nc(C)c(CC(=O)NC[C@@H](c2ccc(Cl)cc2)C(C)C)c(=O)[n-]1 ZINC000583015832 936370683 /nfs/dbraw/zinc/37/06/83/936370683.db2.gz GNHUHPRFWIIVKI-QGZVFWFLSA-N -1 3 361.873 3.551 20 0 FHADHM O=C([O-])c1cccc(CCNCc2csc(-c3ccc(F)cc3)n2)c1 ZINC000426694646 937118217 /nfs/dbraw/zinc/11/82/17/937118217.db2.gz JLCSLHABSTWURQ-UHFFFAOYSA-N -1 3 356.422 3.980 20 0 FHADHM O=S(=O)([N-][C@@H]1CC[C@@H](Cc2ccccc2)C1)c1cc(F)c(F)c(F)c1 ZINC001211566475 937130114 /nfs/dbraw/zinc/13/01/14/937130114.db2.gz JMVZQJMUNGJSKQ-UONOGXRCSA-N -1 3 369.408 3.794 20 0 FHADHM CC(=O)c1cc(C(=O)Nc2ccc(Br)cc2[O-])c(C)nc1C ZINC000547619985 927124188 /nfs/dbraw/zinc/12/41/88/927124188.db2.gz TYTLQDCRKZWWEN-UHFFFAOYSA-N -1 3 363.211 3.621 20 0 FHADHM CCCOc1ccc(C(F)(F)F)cc1NC(=O)NCc1ncccc1[O-] ZINC000471113579 927451149 /nfs/dbraw/zinc/45/11/49/927451149.db2.gz BOOSKEVKZFABJW-UHFFFAOYSA-N -1 3 369.343 3.917 20 0 FHADHM O=C(c1cc([O-])c2ccccc2c1)N(Cc1ccco1)C[C@@H]1CCCO1 ZINC000426878243 937183624 /nfs/dbraw/zinc/18/36/24/937183624.db2.gz FJLFWFABBTUWQI-SFHVURJKSA-N -1 3 351.402 3.960 20 0 FHADHM O=C([O-])[C@@H](NCc1ccc(F)c(F)c1)c1cccc(Br)c1 ZINC000683174839 927777438 /nfs/dbraw/zinc/77/74/38/927777438.db2.gz QXKJEKVWWAZWKC-AWEZNQCLSA-N -1 3 356.166 3.643 20 0 FHADHM Cc1nc(C)c(CC(=O)N[C@@H]2CCc3ccc(-c4ccccc4)cc32)c(=O)[n-]1 ZINC000547662322 927854336 /nfs/dbraw/zinc/85/43/36/927854336.db2.gz FWQDCEWJHWQWMI-OAQYLSRUSA-N -1 3 373.456 3.812 20 0 FHADHM COc1ccc(C(=O)N2C[C@H](c3cccc(Cl)c3)OC[C@@H]2C)c([O-])c1 ZINC000187094286 928027014 /nfs/dbraw/zinc/02/70/14/928027014.db2.gz IDJPXGUZPWWVJT-KPZWWZAWSA-N -1 3 361.825 3.656 20 0 FHADHM Cc1cc(S(=O)(=O)[N-][C@H](C)c2ccsc2)sc1Br ZINC000126360390 937220681 /nfs/dbraw/zinc/22/06/81/937220681.db2.gz GJKMWCGBDZWVCN-MRVPVSSYSA-N -1 3 366.327 3.920 20 0 FHADHM Cc1cccc(C)c1CN(CC(C)C)C(=O)c1cc(=O)[n-]c(C2CC2)n1 ZINC000655156467 928371433 /nfs/dbraw/zinc/37/14/33/928371433.db2.gz DDGIFYWBGMTTDK-UHFFFAOYSA-N -1 3 353.466 3.975 20 0 FHADHM [O-]c1ccc(F)c(CN2CCOc3cc(Br)ccc3C2)c1F ZINC001206789881 928401826 /nfs/dbraw/zinc/40/18/26/928401826.db2.gz RVSMJNXLTNUSGV-UHFFFAOYSA-N -1 3 370.193 3.828 20 0 FHADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)[C@H](C)c3c(F)cccc3F)cc2)n1 ZINC000154785017 937254807 /nfs/dbraw/zinc/25/48/07/937254807.db2.gz JBCLETWFSOPAGE-GFCCVEGCSA-N -1 3 369.371 3.766 20 0 FHADHM CCOC(=O)CS[C@@H](C)c1nc(=O)c2c(-c3ccco3)csc2[n-]1 ZINC000011148356 928712292 /nfs/dbraw/zinc/71/22/92/928712292.db2.gz 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COCC[C@@H]([N-]C(=O)C(F)(F)c1cc(Cl)ccc1OC)c1ccco1 ZINC001266569043 930188453 /nfs/dbraw/zinc/18/84/53/930188453.db2.gz LIDZIAWKAZWOFD-CYBMUJFWSA-N -1 3 373.783 3.927 20 0 FHADHM O=C([O-])[C@]1(NCc2cccc(-c3ccccn3)c2)CCc2c1cccc2F ZINC000583395943 937404511 /nfs/dbraw/zinc/40/45/11/937404511.db2.gz TUXYXSFXCYFWTM-QFIPXVFZSA-N -1 3 362.404 3.904 20 0 FHADHM Cc1noc([N-]C(=O)c2cc(-c3cccs3)n(-c3ccccc3)n2)n1 ZINC000087158435 930289844 /nfs/dbraw/zinc/28/98/44/930289844.db2.gz PXHODPBPWJJIJZ-UHFFFAOYSA-N -1 3 351.391 3.545 20 0 FHADHM O=S(=O)([N-][C@H]1CCC[C@H](F)C1)c1cc(Cl)ccc1Br ZINC000580187099 930340893 /nfs/dbraw/zinc/34/08/93/930340893.db2.gz ABRNHKLJLNZGFB-UWVGGRQHSA-N -1 3 370.671 3.662 20 0 FHADHM COc1nnc([N-]C(=O)c2sc(-c3ccc(Cl)cc3)nc2C)s1 ZINC000683905089 930564927 /nfs/dbraw/zinc/56/49/27/930564927.db2.gz WXZCPHZZVGVGCM-UHFFFAOYSA-N -1 3 366.855 3.884 20 0 FHADHM Cc1c(C(=O)[O-])cnn1C1CCN(Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000580456949 930696706 /nfs/dbraw/zinc/69/67/06/930696706.db2.gz 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CC(C)[C@H](NC(=O)c1cccs1)C(=O)Nc1cc(Cl)ccc1[O-] ZINC000070887205 931685401 /nfs/dbraw/zinc/68/54/01/931685401.db2.gz AGJKXGULWAPHTR-AWEZNQCLSA-N -1 3 352.843 3.500 20 0 FHADHM C[C@@H](C(=O)Nc1cc(I)ccc1[O-])c1cccs1 ZINC000610490604 931766267 /nfs/dbraw/zinc/76/62/67/931766267.db2.gz RZMXGPIXKYFXQA-MRVPVSSYSA-N -1 3 373.215 3.801 20 0 FHADHM CCOC(=O)c1cc(NC(=O)c2ccc(Cl)cc2SCC)[n-]n1 ZINC000128630327 931769503 /nfs/dbraw/zinc/76/95/03/931769503.db2.gz FWWYLVLXFFZMEC-UHFFFAOYSA-N -1 3 353.831 3.604 20 0 FHADHM CCOC(=O)c1cc(NC(=O)c2ccc(Cl)cc2SCC)n[n-]1 ZINC000128630327 931769509 /nfs/dbraw/zinc/76/95/09/931769509.db2.gz FWWYLVLXFFZMEC-UHFFFAOYSA-N -1 3 353.831 3.604 20 0 FHADHM CCC[C@H](CC)S(=O)(=O)Nc1cccc(-c2nc(CC)cc(=O)[n-]2)c1 ZINC000581289068 931787412 /nfs/dbraw/zinc/78/74/12/931787412.db2.gz XBMXPRBHFMDAFL-INIZCTEOSA-N -1 3 363.483 3.732 20 0 FHADHM Cc1csc(Nc2ccc(C(=O)NCc3ccc([O-])c(F)c3)cc2)n1 ZINC000581303281 931806944 /nfs/dbraw/zinc/80/69/44/931806944.db2.gz 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FHADHM O=C([O-])c1cccc(Cl)c1CN(CCc1ccccc1)[C@H]1CCOC1 ZINC000583818285 938428452 /nfs/dbraw/zinc/42/84/52/938428452.db2.gz VDWCCGQUYBKDRN-INIZCTEOSA-N -1 3 359.853 3.872 20 0 FHADHM CCCCOc1ccc(NC(=O)c2c(C)[n-]c(=O)nc2SC)c(C)c1 ZINC000518189728 945177824 /nfs/dbraw/zinc/17/78/24/945177824.db2.gz JPTNREBEYSVKFL-UHFFFAOYSA-N -1 3 361.467 3.952 20 0 FHADHM Cc1cccc(OCCC[N-]S(=O)(=O)c2cc(F)ccc2Cl)c1 ZINC000728578959 938449622 /nfs/dbraw/zinc/44/96/22/938449622.db2.gz DGAKRSCHKDTICK-UHFFFAOYSA-N -1 3 357.834 3.535 20 0 FHADHM CN(C)[C@H]1CCOc2c([N-]S(=O)(=O)c3ccc(C4CC4)cc3)cccc21 ZINC000583853310 938451588 /nfs/dbraw/zinc/45/15/88/938451588.db2.gz WJKXMWABCZBMRV-IBGZPJMESA-N -1 3 372.490 3.750 20 0 FHADHM Cc1cnc(C2CCN(C(=O)c3c[n-]c4ccccc4c3=O)CC2)s1 ZINC000278467709 938457062 /nfs/dbraw/zinc/45/70/62/938457062.db2.gz JPFAAGUFOFISPS-UHFFFAOYSA-N -1 3 353.447 3.725 20 0 FHADHM CCOCCC1(C[N-]S(=O)(=O)c2cc(F)ccc2Cl)CCCC1 ZINC000472308568 938482870 /nfs/dbraw/zinc/48/28/70/938482870.db2.gz 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FHADHM CC(C)CCOc1ccccc1CNC(=O)NCc1ccc([O-])c(F)c1 ZINC000584379152 938781703 /nfs/dbraw/zinc/78/17/03/938781703.db2.gz NXUJINBWZRSYAR-UHFFFAOYSA-N -1 3 360.429 3.956 20 0 FHADHM CCc1cccc(C(=O)N[C@H](C)c2nc(-c3ccccc3OC)no2)c1[O-] ZINC000081793302 938802973 /nfs/dbraw/zinc/80/29/73/938802973.db2.gz QIMZHKJACPYTEF-GFCCVEGCSA-N -1 3 367.405 3.504 20 0 FHADHM CCc1cccc(C(=O)N2CCC(C(=O)c3ccc(OC)cc3)CC2)c1[O-] ZINC000081937054 938810131 /nfs/dbraw/zinc/81/01/31/938810131.db2.gz HRRONIUKFVQSAM-UHFFFAOYSA-N -1 3 367.445 3.698 20 0 FHADHM COC(=O)c1ccc(C(=O)Nc2cnn(-c3ccc(C)cc3)c2C(C)C)[n-]1 ZINC000506433934 945211756 /nfs/dbraw/zinc/21/17/56/945211756.db2.gz SCDUBHBYZYMBFI-UHFFFAOYSA-N -1 3 366.421 3.671 20 0 FHADHM CC1(C)C(C[N-]S(=O)(=O)c2cc(F)ccc2Br)C1(C)C ZINC001211620176 938903655 /nfs/dbraw/zinc/90/36/55/938903655.db2.gz VDLNRDAGLKOLMP-UHFFFAOYSA-N -1 3 364.280 3.549 20 0 FHADHM CC(=O)Nc1ccc(C)cc1NC(=O)c1ccc2c(c1[O-])OC(C)(C)C2 ZINC000094101514 938934971 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CC(=O)c1ccc(C(=O)N2CCC[C@@H]2CC(=O)c2cccs2)cc1[O-] ZINC000612044338 939025249 /nfs/dbraw/zinc/02/52/49/939025249.db2.gz LMTOSVZGFPCSFF-CQSZACIVSA-N -1 3 357.431 3.534 20 0 FHADHM CC(C)[C@H](C[N-]S(=O)(=O)c1cnc(Cl)c(Cl)c1)c1cccnc1 ZINC000177020025 939044620 /nfs/dbraw/zinc/04/46/20/939044620.db2.gz CWIYWZMHTXPHEH-ZDUSSCGKSA-N -1 3 374.293 3.502 20 0 FHADHM CSc1nsc([N-]C(=O)c2csc(CCc3ccccc3)n2)n1 ZINC000440083246 945227774 /nfs/dbraw/zinc/22/77/74/945227774.db2.gz SUJUSEGSQBICTI-UHFFFAOYSA-N -1 3 362.505 3.754 20 0 FHADHM Cc1noc(C)c1S(=O)(=O)[N-][C@H](C)c1cc(F)c(Cl)cc1Cl ZINC000007306939 945231204 /nfs/dbraw/zinc/23/12/04/945231204.db2.gz XVLCKDBPDTUYHW-ZCFIWIBFSA-N -1 3 367.229 3.777 20 0 FHADHM CC(C)Cn1cc(C(=O)N=c2cc([C@H]3CCCO3)[n-][nH]2)c2ccccc21 ZINC000473856332 945247582 /nfs/dbraw/zinc/24/75/82/945247582.db2.gz OVHULILIDZCGHT-GOSISDBHSA-N -1 3 352.438 3.546 20 0 FHADHM C[C@H](CC(=O)N=c1cc([C@@H]2CCCO2)[n-][nH]1)c1ccc(C(F)(F)F)cc1 ZINC000473856400 945251102 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CC[C@H](NCc1csc(-c2cccc(Br)c2)n1)C(=O)[O-] ZINC000647466715 939938497 /nfs/dbraw/zinc/93/84/97/939938497.db2.gz XZFNOXYBYFLVBG-LBPRGKRZSA-N -1 3 355.257 3.525 20 0 FHADHM O=C(Cc1ccc(F)cc1)N[N-]C(=O)c1sccc1-c1ccc(F)cc1 ZINC000065835462 939941422 /nfs/dbraw/zinc/94/14/22/939941422.db2.gz KCADXARQFHJNGK-UHFFFAOYSA-N -1 3 372.396 3.697 20 0 FHADHM O=C(N=c1cc2ccc(Br)cn2[n-]1)c1cccc2ccsc21 ZINC000511340562 939997880 /nfs/dbraw/zinc/99/78/80/939997880.db2.gz LVPLLNNHRYZXDG-UHFFFAOYSA-N -1 3 372.247 3.986 20 0 FHADHM O=C(N=c1cc([C@H]2CCCO2)[n-][nH]1)C1c2ccccc2Oc2ccccc21 ZINC000473859046 945289866 /nfs/dbraw/zinc/28/98/66/945289866.db2.gz TYVBEANHLROEGF-GOSISDBHSA-N -1 3 361.401 3.559 20 0 FHADHM CN(C)[C@H](CNC(=O)c1cc([O-])ccc1Cl)c1ccccc1Cl ZINC000431655448 940060802 /nfs/dbraw/zinc/06/08/02/940060802.db2.gz YJEPXDNSZUQNPT-MRXNPFEDSA-N -1 3 353.249 3.732 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)NC[C@H](C)CC(F)(F)F)cc2)cc(=O)[n-]1 ZINC000413740508 940069522 /nfs/dbraw/zinc/06/95/22/940069522.db2.gz 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CC(C)(C)c1ccncc1C[N-]S(=O)(=O)c1c(F)cccc1Cl ZINC000416600426 943006121 /nfs/dbraw/zinc/00/61/21/943006121.db2.gz VHUISVJIGWFHRB-UHFFFAOYSA-N -1 3 356.850 3.650 20 0 FHADHM COc1ccc2nc(C3CC3)cc(C(=O)NCc3ccc([O-])c(F)c3)c2c1 ZINC000505578163 943070884 /nfs/dbraw/zinc/07/08/84/943070884.db2.gz FDMLMILPHIUNJU-UHFFFAOYSA-N -1 3 366.392 3.896 20 0 FHADHM O=C(NC1(c2cccc(C(F)(F)F)c2)CC1)c1cc(F)cc2n[n-]nc21 ZINC000503334390 943125502 /nfs/dbraw/zinc/12/55/02/943125502.db2.gz GBVOZCYYBRLFQA-UHFFFAOYSA-N -1 3 364.302 3.535 20 0 FHADHM CCOC(=O)c1ccc(C)c(S(=O)(=O)[N-]c2cc(Cl)ccc2F)c1 ZINC000503531506 943227272 /nfs/dbraw/zinc/22/72/72/943227272.db2.gz ZXNBNOXMORTHTJ-UHFFFAOYSA-N -1 3 371.817 3.765 20 0 FHADHM CC(C)CNC(=O)c1ccc(NCc2cc(=O)[n-]c(C3CC3)n2)cc1Cl ZINC000417004536 943286161 /nfs/dbraw/zinc/28/61/61/943286161.db2.gz CNRWECXBAPBRAS-UHFFFAOYSA-N -1 3 374.872 3.711 20 0 FHADHM Cc1cc(-c2csc(NC(=O)c3cc(F)cc4n[n-]nc43)n2)ccc1F ZINC000503671294 943323381 /nfs/dbraw/zinc/32/33/81/943323381.db2.gz 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C[C@@](O)(CCc1ccccc1)C(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000513809755 943507592 /nfs/dbraw/zinc/50/75/92/943507592.db2.gz PLKQTRHOHCWKOZ-QGZVFWFLSA-N -1 3 353.340 3.733 20 0 FHADHM Cc1nnc([N-]C(=O)c2ccc(Br)c(Cl)c2F)s1 ZINC000435634747 943521853 /nfs/dbraw/zinc/52/18/53/943521853.db2.gz CSOFKGUEDIQLMZ-UHFFFAOYSA-N -1 3 350.600 3.654 20 0 FHADHM CCc1ccnc(C[N-]S(=O)(=O)c2c(Cl)cc(F)cc2Cl)c1 ZINC000435645912 943535517 /nfs/dbraw/zinc/53/55/17/943535517.db2.gz NXSTYTWHSKZAJY-UHFFFAOYSA-N -1 3 363.241 3.568 20 0 FHADHM C[C@H](C1CC1)n1cc([N-]S(=O)(=O)/C=C/c2cccc(Cl)c2)cn1 ZINC000187726970 943536564 /nfs/dbraw/zinc/53/65/64/943536564.db2.gz QGUXRTVUKVTMBL-ABZNLYFFSA-N -1 3 351.859 3.920 20 0 FHADHM Cc1nn(C)c2sc(C(=O)[N-]c3nc(-c4ccsc4)ns3)cc12 ZINC000109111437 943645158 /nfs/dbraw/zinc/64/51/58/943645158.db2.gz OPHIXJOZEALHMR-UHFFFAOYSA-N -1 3 361.477 3.776 20 0 FHADHM O=S(=O)([N-][C@H]1CCCOc2ccccc21)c1cccc(Cl)c1F ZINC000504528197 943655850 /nfs/dbraw/zinc/65/58/50/943655850.db2.gz 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ZINC000417564531 943716608 /nfs/dbraw/zinc/71/66/08/943716608.db2.gz FRGWRFRLPDSSSL-UQBPGWFLSA-N -1 3 359.491 3.853 20 0 FHADHM CC(C)c1ccc([C@@H](CC(=O)[O-])NCc2cnn(CC(F)F)c2)cc1 ZINC000417578340 943723031 /nfs/dbraw/zinc/72/30/31/943723031.db2.gz YDWXJHTXLDFOHQ-MRXNPFEDSA-N -1 3 351.397 3.577 20 0 FHADHM C[C@@H](OC(C)(C)C)[C@H](NCc1cc(C(F)(F)F)ccc1F)C(=O)[O-] ZINC000417579918 943724474 /nfs/dbraw/zinc/72/44/74/943724474.db2.gz CBCLLLBNBRHUJF-RNCFNFMXSA-N -1 3 351.340 3.591 20 0 FHADHM O=C([O-])[C@@H]1C[C@@H](NCc2ccc(OC(F)F)c(F)c2)c2ccccc21 ZINC000417631255 943769625 /nfs/dbraw/zinc/76/96/25/943769625.db2.gz RVURBSSXCQKQEO-UKRRQHHQSA-N -1 3 351.324 3.830 20 0 FHADHM Cc1cc(CNC[C@H](CC(=O)[O-])C(F)(F)F)c(OC(F)F)cc1C ZINC000417633474 943771611 /nfs/dbraw/zinc/77/16/11/943771611.db2.gz ULANFWXUELSFBB-NSHDSACASA-N -1 3 355.303 3.648 20 0 FHADHM O=C([O-])CSCCNCc1ccc(-c2ccc(Br)cc2)o1 ZINC000417627337 943777611 /nfs/dbraw/zinc/77/76/11/943777611.db2.gz UTABWZMIXRHEBG-UHFFFAOYSA-N -1 3 370.268 3.617 20 0 FHADHM COc1cc(CN[C@@H]2C[C@@H](C(=O)[O-])c3ccccc32)ccc1OC(C)C ZINC000417628386 943778941 /nfs/dbraw/zinc/77/89/41/943778941.db2.gz WDSBMBMJDCLUPN-QZTJIDSGSA-N -1 3 355.434 3.885 20 0 FHADHM O=C(CCCc1ccccn1)[N-]OCc1ccc(F)cc1Br ZINC000188912887 943785859 /nfs/dbraw/zinc/78/58/59/943785859.db2.gz OTMQAHMTSPNPTM-UHFFFAOYSA-N -1 3 367.218 3.554 20 0 FHADHM O=C([O-])CC[C@@H]1CCCCN1Cc1nn(-c2ccc(F)cc2)c2c1CCC2 ZINC000424249354 943805045 /nfs/dbraw/zinc/80/50/45/943805045.db2.gz AMZATYOYHKSKSE-INIZCTEOSA-N -1 3 371.456 3.719 20 0 FHADHM COc1cc(C(=O)N[C@]2(c3ccc(Cl)cc3)C[C@H]2C)cc(OC)c1[O-] ZINC000505738339 943918246 /nfs/dbraw/zinc/91/82/46/943918246.db2.gz QFVRRJHIIRMNFS-NSPYISDASA-N -1 3 361.825 3.728 20 0 FHADHM CC(C)c1c(NC(=O)c2cc(F)cc3n[n-]nc32)cnn1-c1ccccc1 ZINC000505076717 944020047 /nfs/dbraw/zinc/02/00/47/944020047.db2.gz RRRNDZHTEPOOSB-UHFFFAOYSA-N -1 3 364.384 3.658 20 0 FHADHM O=S(=O)([N-]Cc1ccc(-c2cccnc2)cc1)c1ccc(F)cc1F ZINC000437697909 944041700 /nfs/dbraw/zinc/04/17/00/944041700.db2.gz UWGGYOFCNKVDMQ-UHFFFAOYSA-N -1 3 360.385 3.505 20 0 FHADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)[C@H](c3cccnc3)C(C)C)cc2)n1 ZINC000436137881 944049940 /nfs/dbraw/zinc/04/99/40/944049940.db2.gz APBFAQRLTMMRFK-IBGZPJMESA-N -1 3 362.433 3.519 20 0 FHADHM CCSCC[C@@H](C)[N-]S(=O)(=O)c1csc(-c2ccccc2)n1 ZINC000437714451 944060992 /nfs/dbraw/zinc/06/09/92/944060992.db2.gz CRVNPGWLFIQYPH-GFCCVEGCSA-N -1 3 356.538 3.620 20 0 FHADHM Cc1cn2cc(C(=O)[N-]c3nnc(Cc4ccc(C)cc4)s3)sc2n1 ZINC000505201248 944132188 /nfs/dbraw/zinc/13/21/88/944132188.db2.gz OKCJIGCFVSKSCE-UHFFFAOYSA-N -1 3 369.475 3.707 20 0 FHADHM COC(=O)c1[n-]cnc1NC(=O)Cc1coc2cc(C)c(C(C)C)cc12 ZINC000517248917 944144990 /nfs/dbraw/zinc/14/49/90/944144990.db2.gz HXHJZDZGYGHAGV-UHFFFAOYSA-N -1 3 355.394 3.556 20 0 FHADHM COC(=O)c1nc[n-]c1NC(=O)Cc1coc2cc(C)c(C(C)C)cc12 ZINC000517248917 944144995 /nfs/dbraw/zinc/14/49/95/944144995.db2.gz HXHJZDZGYGHAGV-UHFFFAOYSA-N -1 3 355.394 3.556 20 0 FHADHM CC(C)Cn1cc(C(=O)Nc2cccc(-c3nnn[n-]3)c2)c2ccccc21 ZINC000515748269 944176361 /nfs/dbraw/zinc/17/63/61/944176361.db2.gz WIFOHFICDMHKOM-UHFFFAOYSA-N -1 3 360.421 3.730 20 0 FHADHM CC(C)Cn1cc(C(=O)Nc2cccc(-c3nn[n-]n3)c2)c2ccccc21 ZINC000515748269 944176366 /nfs/dbraw/zinc/17/63/66/944176366.db2.gz WIFOHFICDMHKOM-UHFFFAOYSA-N -1 3 360.421 3.730 20 0 FHADHM CCCc1c(NC([O-])=NO[C@@H]2CCCCO2)cnn1-c1ccc(F)cc1 ZINC000191945761 944254012 /nfs/dbraw/zinc/25/40/12/944254012.db2.gz UYWQZTSPGCVSNJ-QGZVFWFLSA-N -1 3 362.405 3.544 20 0 FHADHM CCCc1c(NC(=O)[N-]O[C@@H]2CCCCO2)cnn1-c1ccc(F)cc1 ZINC000191945761 944254018 /nfs/dbraw/zinc/25/40/18/944254018.db2.gz UYWQZTSPGCVSNJ-QGZVFWFLSA-N -1 3 362.405 3.544 20 0 FHADHM Cc1cc(=O)[n-]c(C=Cc2cn(Cc3ccccc3)nc2-c2cccnc2)n1 ZINC000550011731 944274760 /nfs/dbraw/zinc/27/47/60/944274760.db2.gz IUIKNRFGXTWETF-MDZDMXLPSA-N -1 3 369.428 3.968 20 0 FHADHM CC(C)(C)c1cccc(OCCCSc2nc3nncc-3c(O)[n-]2)c1 ZINC000511656601 944296881 /nfs/dbraw/zinc/29/68/81/944296881.db2.gz 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CC(C)(C)c1ccccc1S(=O)(=O)[N-]c1ccc(F)c(-c2nnc[nH]2)c1 ZINC000436479457 944344480 /nfs/dbraw/zinc/34/44/80/944344480.db2.gz UJSFEMUUXKBMTD-UHFFFAOYSA-N -1 3 374.441 3.709 20 0 FHADHM COc1ccc([O-])c(C(=O)Nc2ncc(Cc3ccccc3F)s2)c1 ZINC000500256555 944353767 /nfs/dbraw/zinc/35/37/67/944353767.db2.gz ZBAPZWGKHURDRV-UHFFFAOYSA-N -1 3 358.394 3.840 20 0 FHADHM CCOc1cc2c(cc1[C@@H]1C[C@H]1NC(=O)c1ccc(C)cc1[O-])O[C@H](C)C2 ZINC000436489960 944359106 /nfs/dbraw/zinc/35/91/06/944359106.db2.gz NYHFWSYSWUUBOV-RPVQJOFSSA-N -1 3 367.445 3.709 20 0 FHADHM COc1cccc([C@@H](C)C(=O)Nc2ccc(Br)cc2[O-])c1 ZINC000518436098 944379962 /nfs/dbraw/zinc/37/99/62/944379962.db2.gz OAODXYKIQKQUQH-SNVBAGLBSA-N -1 3 350.212 3.906 20 0 FHADHM CC(C)c1ccc(C(=O)N(C)CC(=O)N(C)[C@H](C)c2ccccc2)c([O-])c1 ZINC000436510987 944382704 /nfs/dbraw/zinc/38/27/04/944382704.db2.gz HFSCLDIVKHMHDM-MRXNPFEDSA-N -1 3 368.477 3.807 20 0 FHADHM Cc1noc(C)c1C[C@@H](C)NC(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436525439 944393087 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FHADHM Cc1ccc(C(=O)Nc2ccc(Oc3ccccc3C(N)=O)cc2)c([O-])c1 ZINC000436575834 944424753 /nfs/dbraw/zinc/42/47/53/944424753.db2.gz PHWPGDOWPAWALF-UHFFFAOYSA-N -1 3 362.385 3.844 20 0 FHADHM Cc1ccc(C(=O)Nc2cccc(C(=O)N3CCCCC3)c2)c([O-])c1C ZINC000436565758 944430231 /nfs/dbraw/zinc/43/02/31/944430231.db2.gz VYAKPHMWYGWAQN-UHFFFAOYSA-N -1 3 352.434 3.887 20 0 FHADHM COc1ccc(C(=O)Nc2cccc(C=Cc3nc(C)cc(=O)[n-]3)c2)cc1 ZINC000550014935 944431259 /nfs/dbraw/zinc/43/12/59/944431259.db2.gz QRBIQVOAULTKTM-IZZDOVSWSA-N -1 3 361.401 3.922 20 0 FHADHM CCS[C@H](C)c1noc(CN(C)C(=O)c2ccc(C(C)C)cc2[O-])n1 ZINC000436595059 944438968 /nfs/dbraw/zinc/43/89/68/944438968.db2.gz HNDKSUSWGZYLOS-GFCCVEGCSA-N -1 3 363.483 3.985 20 0 FHADHM COc1cccc(C=C2CCN(C(=O)c3ccc(OC)cc3[O-])CC2)c1 ZINC000436578554 944443570 /nfs/dbraw/zinc/44/35/70/944443570.db2.gz AERKLIOIUNQLHG-UHFFFAOYSA-N -1 3 353.418 3.729 20 0 FHADHM CC[C@H](c1ccc(F)cc1F)N1CCN(C(=O)c2ccc([O-])cc2)CC1 ZINC000436618699 944452156 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Cc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)CCO3)cc1C(F)(F)F ZINC000500301473 944455282 /nfs/dbraw/zinc/45/52/82/944455282.db2.gz HJCFEUYICFWIRZ-UHFFFAOYSA-N -1 3 357.353 3.750 20 0 FHADHM CC(C)c1ccc(C(=O)N[C@H](C)c2ccc3c(c2)CCC(=O)N3)c([O-])c1 ZINC000436609718 944459263 /nfs/dbraw/zinc/45/92/63/944459263.db2.gz WBFYTRWOHCLOKD-CYBMUJFWSA-N -1 3 352.434 3.891 20 0 FHADHM CC[C@@H](C(=O)N1CCN(C(=O)c2ccc([O-])cc2)CC1)C1CCC(C)CC1 ZINC000436612661 944461988 /nfs/dbraw/zinc/46/19/88/944461988.db2.gz RHXVJXBFPQVURP-LBXVMSDZSA-N -1 3 372.509 3.529 20 0 FHADHM C[C@H](COCC(F)(F)F)NC(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436613681 944462026 /nfs/dbraw/zinc/46/20/26/944462026.db2.gz WWJQZPAXRHFDRN-CYBMUJFWSA-N -1 3 367.367 3.680 20 0 FHADHM CC(C)[C@H]1CCN1C(=O)C[C@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436635879 944474669 /nfs/dbraw/zinc/47/46/69/944474669.db2.gz OXPMIXZELSEQPE-VQTJNVASSA-N -1 3 366.461 3.510 20 0 FHADHM CC(C)c1ccc(C(=O)N[C@@H](C)c2ccc(-n3cncn3)cc2)c([O-])c1 ZINC000436637791 944476135 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O=C(c1ccccc1[O-])N1CCN(Cc2ccc(C3CCC3)cc2)CC1 ZINC000436669587 944503802 /nfs/dbraw/zinc/50/38/02/944503802.db2.gz AJUKVFZXZCIUOY-UHFFFAOYSA-N -1 3 350.462 3.618 20 0 FHADHM COc1ccc(-c2nc(NC(=O)c3c([O-])cccc3O)sc2C)cc1 ZINC000436671602 944505557 /nfs/dbraw/zinc/50/55/57/944505557.db2.gz AVXHEHUTYPNWRP-UHFFFAOYSA-N -1 3 356.403 3.791 20 0 FHADHM O=C(c1cc2ccccc2cc1[O-])N1CCN[C@H](c2cccc(Cl)c2)C1 ZINC000436658995 944508987 /nfs/dbraw/zinc/50/89/87/944508987.db2.gz NGWXRTYOJNLRBK-IBGZPJMESA-N -1 3 366.848 3.986 20 0 FHADHM O=C(N[C@H]1CCO[C@@H](C2CC2)C1)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436657492 944509109 /nfs/dbraw/zinc/50/91/09/944509109.db2.gz QWKNKJUDTDUIJD-MGPUTAFESA-N -1 3 353.418 3.872 20 0 FHADHM CCc1ccc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2[O-])cc1C ZINC000436659378 944510967 /nfs/dbraw/zinc/51/09/67/944510967.db2.gz OPKSAYJJNVOASC-GOSISDBHSA-N -1 3 352.434 3.506 20 0 FHADHM COc1ccc([O-])c(C(=O)Nc2nnc(C(C)(C)c3ccccc3)s2)c1 ZINC000518574427 944514406 /nfs/dbraw/zinc/51/44/06/944514406.db2.gz 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944550245 /nfs/dbraw/zinc/55/02/45/944550245.db2.gz ABGFTOIGIRMURU-UHFFFAOYSA-N -1 3 365.454 3.969 20 0 FHADHM COc1cc(CN(C(=O)c2ccccc2[O-])C2CC2)ccc1OC(F)F ZINC000436715413 944554120 /nfs/dbraw/zinc/55/41/20/944554120.db2.gz KZTKZFAYVZEMEJ-UHFFFAOYSA-N -1 3 363.360 3.807 20 0 FHADHM COc1cccc(N2CC[C@H](NC(=O)c3ccc(C(C)C)cc3[O-])C2)c1 ZINC000436720976 944559511 /nfs/dbraw/zinc/55/95/11/944559511.db2.gz KQFNILYYUSHRJZ-INIZCTEOSA-N -1 3 354.450 3.533 20 0 FHADHM C[C@@H]1C[C@H](C(C)(C)C)CCN1C(=O)[C@@H]1CCCN1C(=O)c1ccccc1[O-] ZINC000436745866 944573831 /nfs/dbraw/zinc/57/38/31/944573831.db2.gz FCLXTZQBAOXIIO-NUJGCVRESA-N -1 3 372.509 3.670 20 0 FHADHM O=C(Nc1ccc(NC(=O)c2cc3c(cc2[O-])CCCC3)cc1)NC1CC1 ZINC000436757714 944580779 /nfs/dbraw/zinc/58/07/79/944580779.db2.gz WRNOQFJTWCDSMY-UHFFFAOYSA-N -1 3 365.433 3.807 20 0 FHADHM COc1ccc(CN[C@H](C(=O)[O-])c2ccc(C)cc2)cc1OC(F)F ZINC000426672955 944590146 /nfs/dbraw/zinc/59/01/46/944590146.db2.gz VAISMEAPVYDWKH-INIZCTEOSA-N -1 3 351.349 3.521 20 0 FHADHM CC[C@H](Cc1ccc(Cl)cc1)NC(=O)c1cc(OC)c([O-])c(OC)c1 ZINC000436781012 944612207 /nfs/dbraw/zinc/61/22/07/944612207.db2.gz AKKIHBDYTPTYFK-OAHLLOKOSA-N -1 3 363.841 3.814 20 0 FHADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1C[C@]2(CCCO2)[C@@H]1C1CC1 ZINC000436785676 944631519 /nfs/dbraw/zinc/63/15/19/944631519.db2.gz PZXFYBNCWOACGV-JTHBVZDNSA-N -1 3 363.457 3.767 20 0 FHADHM CC[C@H](Cc1ccc(Cl)cc1)NC(=O)c1cc(NC(C)=O)ccc1[O-] ZINC000436786474 944633828 /nfs/dbraw/zinc/63/38/28/944633828.db2.gz JGIVDBGWYLASFM-OAHLLOKOSA-N -1 3 360.841 3.755 20 0 FHADHM O=C(CC1CCC(C(F)(F)F)CC1)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000544003988 944636544 /nfs/dbraw/zinc/63/65/44/944636544.db2.gz NUDQEMPURGCKGD-UHFFFAOYSA-N -1 3 353.348 3.564 20 0 FHADHM O=C(CC1CCC(C(F)(F)F)CC1)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000544003988 944636550 /nfs/dbraw/zinc/63/65/50/944636550.db2.gz NUDQEMPURGCKGD-UHFFFAOYSA-N -1 3 353.348 3.564 20 0 FHADHM CCC[C@H](NC(=O)c1cc(NC(C)=O)ccc1[O-])c1ccc(F)cc1F ZINC000436788327 944637710 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CCCc1c(NC(=O)c2cccc(OC)c2[O-])cnn1-c1ccccc1 ZINC000436801705 944656561 /nfs/dbraw/zinc/65/65/61/944656561.db2.gz DSPUODSJUSSPLB-UHFFFAOYSA-N -1 3 351.406 3.791 20 0 FHADHM CCCCOc1ccccc1CN1CCN(C(=O)c2ccc([O-])cc2)CC1 ZINC000436809412 944665969 /nfs/dbraw/zinc/66/59/69/944665969.db2.gz ONBWZMDRGBGBGP-UHFFFAOYSA-N -1 3 368.477 3.529 20 0 FHADHM O=C(N[C@@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1)c1ccccc1[O-] ZINC000436816178 944673746 /nfs/dbraw/zinc/67/37/46/944673746.db2.gz CRWXONTWODPFAN-IBGZPJMESA-N -1 3 373.412 3.688 20 0 FHADHM O=C([O-])C[C@H](NCc1ccc(OC[C@H]2CCCO2)cc1)c1ccsc1 ZINC000426682851 944679495 /nfs/dbraw/zinc/67/94/95/944679495.db2.gz MHZWKNXRTLQGLC-MSOLQXFVSA-N -1 3 361.463 3.612 20 0 FHADHM O=c1cc(CNc2ccc3c(c2)CN(CC(F)(F)F)C3)nc(C2CC2)[n-]1 ZINC000518732965 944684694 /nfs/dbraw/zinc/68/46/94/944684694.db2.gz CLPQYBLBNNVWMF-UHFFFAOYSA-N -1 3 364.371 3.550 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)c3ccc(N(C)C)cc3)c2)n1 ZINC000500379499 944690628 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FHADHM O=C([O-])C[C@@H](CNCc1ccn(-c2ccccc2)n1)c1ccc(Cl)cc1 ZINC000426711604 944734719 /nfs/dbraw/zinc/73/47/19/944734719.db2.gz PPKNDAIEHYRANM-INIZCTEOSA-N -1 3 369.852 3.874 20 0 FHADHM CCc1ccc([C@H](CNC(=O)c2cc(F)c([O-])c(Cl)c2)N(C)C)cc1 ZINC000436858242 944745560 /nfs/dbraw/zinc/74/55/60/944745560.db2.gz MTFPXIVERUQVNB-KRWDZBQOSA-N -1 3 364.848 3.780 20 0 FHADHM CCCOc1cccnc1C(=O)Nc1cc(Br)ccc1[O-] ZINC000436877895 944749330 /nfs/dbraw/zinc/74/93/30/944749330.db2.gz CMFKEMOXNKLUJS-UHFFFAOYSA-N -1 3 351.200 3.591 20 0 FHADHM Cc1noc(C[C@H](NC(=O)c2ccc(C(C)C)cc2[O-])c2ccccc2)n1 ZINC000436880094 944751651 /nfs/dbraw/zinc/75/16/51/944751651.db2.gz INLOOYSBEOFNDP-SFHVURJKSA-N -1 3 365.433 3.921 20 0 FHADHM C[C@@H](Sc1ccccc1-c1nnn[n-]1)c1nc(-c2cccs2)no1 ZINC000736193484 944757962 /nfs/dbraw/zinc/75/79/62/944757962.db2.gz RVOVGNLSYCSTMK-SECBINFHSA-N -1 3 356.436 3.832 20 0 FHADHM C[C@@H](Sc1ccccc1-c1nn[n-]n1)c1nc(-c2cccs2)no1 ZINC000736193484 944757967 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350.821 3.606 20 0 FHADHM CC(C)[C@@H](C)N(C)C(=O)C[C@@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436908781 944777287 /nfs/dbraw/zinc/77/72/87/944777287.db2.gz JZFXJPVJGTYIRE-OXQOHEQNSA-N -1 3 368.477 3.756 20 0 FHADHM CCCN(CCC)C(=O)C[C@@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436910778 944779859 /nfs/dbraw/zinc/77/98/59/944779859.db2.gz DLNDUGFNTNIHOB-HXUWFJFHSA-N -1 3 368.477 3.902 20 0 FHADHM COc1ccc([O-])c(-c2nc(-c3cccc(NC(=O)NC(C)C)c3)no2)c1 ZINC000436910813 944779885 /nfs/dbraw/zinc/77/98/85/944779885.db2.gz DOJUSRUPORIOEY-UHFFFAOYSA-N -1 3 368.393 3.648 20 0 FHADHM C[C@@H]1CCc2c(sc(NC(=O)[C@@H]3CCC[C@H](C)C3)c2-c2nnn[n-]2)C1 ZINC000736279765 944784034 /nfs/dbraw/zinc/78/40/34/944784034.db2.gz MJJFEPKRYWQNPI-QJPTWQEYSA-N -1 3 359.499 3.818 20 0 FHADHM C[C@@H]1CCc2c(sc(NC(=O)[C@@H]3CCC[C@H](C)C3)c2-c2nn[n-]n2)C1 ZINC000736279765 944784039 /nfs/dbraw/zinc/78/40/39/944784039.db2.gz MJJFEPKRYWQNPI-QJPTWQEYSA-N -1 3 359.499 3.818 20 0 FHADHM CC[C@H]1CC[C@H](NC(=O)c2cc(NC(=O)c3cnoc3C)ccc2[O-])CC1 ZINC000436897111 944784324 /nfs/dbraw/zinc/78/43/24/944784324.db2.gz WCQJKVNMDBYJEZ-HDJSIYSDSA-N -1 3 371.437 3.640 20 0 FHADHM CCOc1cc(CN2CCC3(C2)Oc2ccccc2O3)cc(Cl)c1[O-] ZINC000517881437 944786835 /nfs/dbraw/zinc/78/68/35/944786835.db2.gz GPXSCEMBXUDBST-UHFFFAOYSA-N -1 3 361.825 3.818 20 0 FHADHM CN(C)C(=O)c1cccc(-c2noc(-c3cc4ccccc4cc3[O-])n2)c1 ZINC000436899154 944787941 /nfs/dbraw/zinc/78/79/41/944787941.db2.gz BTSSVUSZMDTRGA-UHFFFAOYSA-N -1 3 359.385 3.964 20 0 FHADHM O=C(Nc1cnn(CC(F)F)c1)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436901518 944790735 /nfs/dbraw/zinc/79/07/35/944790735.db2.gz QZVHBUAVAQLSSF-UHFFFAOYSA-N -1 3 371.387 3.891 20 0 FHADHM CC1(C)[C@H](NC(=O)c2cc(CCc3ccccc3)ccc2[O-])[C@@H]2CCO[C@H]21 ZINC000436902367 944792391 /nfs/dbraw/zinc/79/23/91/944792391.db2.gz SQAJQAZRMRNIHM-IOMROCGXSA-N -1 3 365.473 3.721 20 0 FHADHM CCC(=CC(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccc(C)cc1 ZINC000736304639 944794111 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COc1ccc([C@H](CC(=O)[O-])NCc2ccc(Cl)c(C)c2)cc1OC ZINC000426814680 944836174 /nfs/dbraw/zinc/83/61/74/944836174.db2.gz IBQRRWPFNKUIIV-INIZCTEOSA-N -1 3 363.841 3.971 20 0 FHADHM O=C([O-])[C@H](NCc1cccc(OCC(F)(F)F)c1)c1cccc(F)c1 ZINC000426820383 944843090 /nfs/dbraw/zinc/84/30/90/944843090.db2.gz LAUQJZYXNQVKEQ-OAHLLOKOSA-N -1 3 357.303 3.682 20 0 FHADHM O=C(CSc1cc(Cl)ccc1Cl)N=c1cc([C@@H]2CCCO2)[n-][nH]1 ZINC000473851162 944845238 /nfs/dbraw/zinc/84/52/38/944845238.db2.gz BBIPAHVBYFTMQN-LBPRGKRZSA-N -1 3 372.277 3.721 20 0 FHADHM CCc1ccc([C@@H](NCc2cnn(Cc3ccc(F)cc3)c2)C(=O)[O-])cc1 ZINC000426824110 944846639 /nfs/dbraw/zinc/84/66/39/944846639.db2.gz LGTROSKVLIQXLV-HXUWFJFHSA-N -1 3 367.424 3.548 20 0 FHADHM O=C(NCCc1cn2ccccc2n1)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436953458 944849181 /nfs/dbraw/zinc/84/91/81/944849181.db2.gz PPKCOMYDDSGESE-UHFFFAOYSA-N -1 3 373.412 3.805 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N[C@@H](C)c2cc3cccc(F)c3o2)c1 ZINC000436982171 944872827 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COC(=O)[C@H](C)N(C(=O)c1cc(Oc2ccccc2)ccc1[O-])C1CCC1 ZINC000437007551 944907550 /nfs/dbraw/zinc/90/75/50/944907550.db2.gz ZVXXLXAGWHIPLM-AWEZNQCLSA-N -1 3 369.417 3.741 20 0 FHADHM Cc1ccc([N-]S(=O)(=O)CCc2ccccc2)c(OCC(F)(F)F)c1 ZINC000511696521 944910255 /nfs/dbraw/zinc/91/02/55/944910255.db2.gz XLJNPPNRRGVZSZ-UHFFFAOYSA-N -1 3 373.396 3.921 20 0 FHADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1CC[C@H]([C@@H]2CCOC2)C1 ZINC000366659095 944912010 /nfs/dbraw/zinc/91/20/10/944912010.db2.gz UZLPAYKPFGWKOX-JKSUJKDBSA-N -1 3 353.418 3.683 20 0 FHADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1CC[C@@H]([C@@H]2CCOC2)C1 ZINC000366659093 944912496 /nfs/dbraw/zinc/91/24/96/944912496.db2.gz UZLPAYKPFGWKOX-HZPDHXFCSA-N -1 3 353.418 3.683 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)NCc3ccc(F)c(F)c3)cc2)cc(=O)[n-]1 ZINC000518909668 944912989 /nfs/dbraw/zinc/91/29/89/944912989.db2.gz WLJQCRJGFGTDHY-UHFFFAOYSA-N -1 3 370.359 3.758 20 0 FHADHM C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N=c1cc([C@@H]2CCCO2)[n-][nH]1 ZINC000473853138 944973096 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3.506 20 0 FHADHM COc1ccc(C(=O)N[C@@H]2COc3c2ccc(Cl)c3Cl)c([O-])c1 ZINC000440311065 945393302 /nfs/dbraw/zinc/39/33/02/945393302.db2.gz DLQXNFFTNOMQHW-GFCCVEGCSA-N -1 3 354.189 3.571 20 0 FHADHM C[C@H](NC(=O)N1CCC[C@H]1CC(C)(C)C)c1cccc(-c2nnn[n-]2)c1 ZINC000820348892 945423012 /nfs/dbraw/zinc/42/30/12/945423012.db2.gz GSRBZTAAQOTGEW-BBRMVZONSA-N -1 3 356.474 3.538 20 0 FHADHM C[C@H](NC(=O)N1CCC[C@H]1CC(C)(C)C)c1cccc(-c2nn[n-]n2)c1 ZINC000820348892 945423014 /nfs/dbraw/zinc/42/30/14/945423014.db2.gz GSRBZTAAQOTGEW-BBRMVZONSA-N -1 3 356.474 3.538 20 0 FHADHM CCNC(=O)CS[C@H](C)c1nc(=O)c2c(-c3ccco3)csc2[n-]1 ZINC000281024298 945499535 /nfs/dbraw/zinc/49/95/35/945499535.db2.gz MNDXKPAEZKQQKX-SECBINFHSA-N -1 3 363.464 3.587 20 0 FHADHM Cc1cc(S(=O)(=O)[N-]Cc2ccc(-c3cccnc3)cc2)c(F)cc1F ZINC000440397303 945504251 /nfs/dbraw/zinc/50/42/51/945504251.db2.gz KCKUIDRECZKDOK-UHFFFAOYSA-N -1 3 374.412 3.814 20 0 FHADHM Cc1nc2ccccc2n1CCC(=O)Nc1ccc(Br)cc1[O-] ZINC000543873880 945526924 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O=C([O-])[C@@H]1CCO[C@H]1C1CCN(Cc2ccc(Cl)c3cccnc23)CC1 ZINC000652505543 947244517 /nfs/dbraw/zinc/24/45/17/947244517.db2.gz FDIVYIBCTGHFPO-APWZRJJASA-N -1 3 374.868 3.590 20 0 FHADHM COc1ccc(-c2nc(CN3CCC[C@@H](C(C)(C)C(=O)[O-])C3)co2)cc1 ZINC000652500365 947249293 /nfs/dbraw/zinc/24/92/93/947249293.db2.gz OIBJLTBROXITRB-OAHLLOKOSA-N -1 3 358.438 3.673 20 0 FHADHM O=C(c1c[n-]c2ccccc2c1=O)N1CCC2(CCc3ccccc3C2)CC1 ZINC000652526381 947269288 /nfs/dbraw/zinc/26/92/88/947269288.db2.gz ACAOXHYWQVUHMA-UHFFFAOYSA-N -1 3 372.468 3.939 20 0 FHADHM CCc1cc(Br)ccc1NCc1cc(-c2nnn[n-]2)cs1 ZINC000825694131 947292064 /nfs/dbraw/zinc/29/20/64/947292064.db2.gz LCUSCUPOIVCRAN-UHFFFAOYSA-N -1 3 364.272 3.865 20 0 FHADHM CCc1cc(Br)ccc1NCc1cc(-c2nn[n-]n2)cs1 ZINC000825694131 947292068 /nfs/dbraw/zinc/29/20/68/947292068.db2.gz LCUSCUPOIVCRAN-UHFFFAOYSA-N -1 3 364.272 3.865 20 0 FHADHM CCc1ccccc1CN[C@@H](c1cccc(-c2nnn[n-]2)c1)C(F)(F)F ZINC000825723299 947300641 /nfs/dbraw/zinc/30/06/41/947300641.db2.gz 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ZINC000826230300 947674915 /nfs/dbraw/zinc/67/49/15/947674915.db2.gz MWLGTXUVENDQSG-LBPRGKRZSA-N -1 3 368.466 3.780 20 0 FHADHM CC(=CC(=O)N(C)Cc1cc(-c2nnn[n-]2)cs1)c1ccccc1Cl ZINC001573359215 947681650 /nfs/dbraw/zinc/68/16/50/947681650.db2.gz XFOHZAOSKHJAPY-YRNVUSSQSA-N -1 3 373.869 3.644 20 0 FHADHM CC(=CC(=O)N(C)Cc1cc(-c2nn[n-]n2)cs1)c1ccccc1Cl ZINC001573359215 947681660 /nfs/dbraw/zinc/68/16/60/947681660.db2.gz XFOHZAOSKHJAPY-YRNVUSSQSA-N -1 3 373.869 3.644 20 0 FHADHM CO[C@@H](CS(=O)(=O)[N-]c1c(C)c2ccccc2nc1SC)C(C)C ZINC000663300070 947692799 /nfs/dbraw/zinc/69/27/99/947692799.db2.gz PXFMPWJRDDWDGT-HNNXBMFYSA-N -1 3 368.524 3.678 20 0 FHADHM COc1cc(-c2nc(Cc3ccc4c(c3)CCC4)no2)cc(OC)c1[O-] ZINC000445306792 947694599 /nfs/dbraw/zinc/69/45/99/947694599.db2.gz BBMXGQHMVCIMHO-UHFFFAOYSA-N -1 3 352.390 3.539 20 0 FHADHM Cc1c(Cl)cnc(N[C@@H](C)c2cc(F)ccc2F)c1-c1nnn[n-]1 ZINC000826238423 947702470 /nfs/dbraw/zinc/70/24/70/947702470.db2.gz GCNCHZBCCBTNKM-QMMMGPOBSA-N -1 3 350.760 3.675 20 0 FHADHM Cc1c(Cl)cnc(N[C@@H](C)c2cc(F)ccc2F)c1-c1nn[n-]n1 ZINC000826238423 947702478 /nfs/dbraw/zinc/70/24/78/947702478.db2.gz GCNCHZBCCBTNKM-QMMMGPOBSA-N -1 3 350.760 3.675 20 0 FHADHM Cc1c(Cl)cnc(N[C@H](C)c2cc(F)ccc2F)c1-c1nnn[n-]1 ZINC000826238422 947703336 /nfs/dbraw/zinc/70/33/36/947703336.db2.gz GCNCHZBCCBTNKM-MRVPVSSYSA-N -1 3 350.760 3.675 20 0 FHADHM Cc1c(Cl)cnc(N[C@H](C)c2cc(F)ccc2F)c1-c1nn[n-]n1 ZINC000826238422 947703344 /nfs/dbraw/zinc/70/33/44/947703344.db2.gz GCNCHZBCCBTNKM-MRVPVSSYSA-N -1 3 350.760 3.675 20 0 FHADHM Cc1c(N[C@@H]2CCCc3cc(-c4nnn[n-]4)ccc32)cnn1-c1ccccc1 ZINC000826242295 947720523 /nfs/dbraw/zinc/72/05/23/947720523.db2.gz IYXPVJSCRQHSJU-LJQANCHMSA-N -1 3 371.448 3.850 20 0 FHADHM Cc1c(N[C@@H]2CCCc3cc(-c4nn[n-]n4)ccc32)cnn1-c1ccccc1 ZINC000826242295 947720533 /nfs/dbraw/zinc/72/05/33/947720533.db2.gz IYXPVJSCRQHSJU-LJQANCHMSA-N -1 3 371.448 3.850 20 0 FHADHM Cc1nc(C(C)C)sc1[C@H](C)OC(=O)c1ccc(-c2nnn[n-]2)cc1C ZINC000826251043 947729850 /nfs/dbraw/zinc/72/98/50/947729850.db2.gz CPKMZQQGIANPGX-LBPRGKRZSA-N -1 3 371.466 3.981 20 0 FHADHM Cc1nc(C(C)C)sc1[C@H](C)OC(=O)c1ccc(-c2nn[n-]n2)cc1C ZINC000826251043 947729859 /nfs/dbraw/zinc/72/98/59/947729859.db2.gz CPKMZQQGIANPGX-LBPRGKRZSA-N -1 3 371.466 3.981 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)Nc1ccc(-c2nnn[n-]2)c(F)c1 ZINC001573365781 947735414 /nfs/dbraw/zinc/73/54/14/947735414.db2.gz NPWULJUYSQLRJG-NTMALXAHSA-N -1 3 357.776 3.701 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)Nc1ccc(-c2nn[n-]n2)c(F)c1 ZINC001573365781 947735426 /nfs/dbraw/zinc/73/54/26/947735426.db2.gz NPWULJUYSQLRJG-NTMALXAHSA-N -1 3 357.776 3.701 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)Nc1cc(C)cc(-c2nnn[n-]2)c1 ZINC001573366926 947751118 /nfs/dbraw/zinc/75/11/18/947751118.db2.gz VMSWAVLRHJJDIQ-WQLSENKSSA-N -1 3 353.813 3.871 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)Nc1cc(C)cc(-c2nn[n-]n2)c1 ZINC001573366926 947751124 /nfs/dbraw/zinc/75/11/24/947751124.db2.gz VMSWAVLRHJJDIQ-WQLSENKSSA-N -1 3 353.813 3.871 20 0 FHADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(NC(=O)[C@H]3C[C@H]4C[C@H]4C3)cc2)cc1 ZINC000665055916 947775270 /nfs/dbraw/zinc/77/52/70/947775270.db2.gz BQXZZWCNXCCKBJ-ZSHCYNCHSA-N -1 3 370.474 3.780 20 0 FHADHM O=C(c1cc2c(cc1[O-])OCO2)N1CCC[C@@H]1Cc1ccccc1Cl ZINC000094039771 947782963 /nfs/dbraw/zinc/78/29/63/947782963.db2.gz RPIBTJXRIQTNNS-CYBMUJFWSA-N -1 3 359.809 3.622 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)c(N2CCC[C@@H](c3nc(C(C)C)cs3)C2)n1 ZINC000826274192 947794219 /nfs/dbraw/zinc/79/42/19/947794219.db2.gz JNTLRBXSVQNZOY-CYBMUJFWSA-N -1 3 369.498 3.534 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)c(N2CCC[C@@H](c3nc(C(C)C)cs3)C2)n1 ZINC000826274192 947794225 /nfs/dbraw/zinc/79/42/25/947794225.db2.gz JNTLRBXSVQNZOY-CYBMUJFWSA-N -1 3 369.498 3.534 20 0 FHADHM Cc1ccc(C(=O)N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c(Cl)c1C ZINC000826281799 947809763 /nfs/dbraw/zinc/80/97/63/947809763.db2.gz KKFXCRPZQYVUEW-GFCCVEGCSA-N -1 3 355.829 3.628 20 0 FHADHM Cc1ccc(C(=O)N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c(Cl)c1C ZINC000826281799 947809769 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ZINC000826316496 947924269 /nfs/dbraw/zinc/92/42/69/947924269.db2.gz PZZZEBZNBJMKDJ-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM Cc1ccsc1CNc1ccc(Br)cc1-c1nn[n-]n1 ZINC000826316496 947924275 /nfs/dbraw/zinc/92/42/75/947924275.db2.gz PZZZEBZNBJMKDJ-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM Cc1cnc(CN[C@H](C)c2ccc(-c3cccc(-c4nnn[n-]4)c3)cc2)o1 ZINC000826318758 947932135 /nfs/dbraw/zinc/93/21/35/947932135.db2.gz XTUCMQKOYNFXAV-CQSZACIVSA-N -1 3 360.421 3.681 20 0 FHADHM Cc1cnc(CN[C@H](C)c2ccc(-c3cccc(-c4nn[n-]n4)c3)cc2)o1 ZINC000826318758 947932143 /nfs/dbraw/zinc/93/21/43/947932143.db2.gz XTUCMQKOYNFXAV-CQSZACIVSA-N -1 3 360.421 3.681 20 0 FHADHM CCc1ccc(C(=O)NCc2cccc(NC(=O)N3CCCC3)c2)c([O-])c1 ZINC000190140224 947934965 /nfs/dbraw/zinc/93/49/65/947934965.db2.gz MFHVTMTXONOGME-UHFFFAOYSA-N -1 3 367.449 3.512 20 0 FHADHM C[C@H](C(=O)NC(C)(C)Cc1ccc(-c2nnn[n-]2)cc1)[C@H](C)C(C)(C)C ZINC001573652492 947940651 /nfs/dbraw/zinc/94/06/51/947940651.db2.gz CUUJADNLBBAFNQ-KBPBESRZSA-N -1 3 357.502 3.622 20 0 FHADHM C[C@H](C(=O)NC(C)(C)Cc1ccc(-c2nn[n-]n2)cc1)[C@H](C)C(C)(C)C ZINC001573652492 947940654 /nfs/dbraw/zinc/94/06/54/947940654.db2.gz CUUJADNLBBAFNQ-KBPBESRZSA-N -1 3 357.502 3.622 20 0 FHADHM Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)N[C@H](C)c1ccc(Cl)s1 ZINC000080545450 948065913 /nfs/dbraw/zinc/06/59/13/948065913.db2.gz DBGKEXSXWOBXLG-MRVPVSSYSA-N -1 3 353.875 3.582 20 0 FHADHM Cc1sc(NC(=O)[C@H]2CCc3c2cccc3Cl)c(-c2nnn[n-]2)c1C ZINC000826349252 948090091 /nfs/dbraw/zinc/09/00/91/948090091.db2.gz ATGGXZMLRWXQIM-LBPRGKRZSA-N -1 3 373.869 3.867 20 0 FHADHM Cc1sc(NC(=O)[C@H]2CCc3c2cccc3Cl)c(-c2nn[n-]n2)c1C ZINC000826349252 948090101 /nfs/dbraw/zinc/09/01/01/948090101.db2.gz ATGGXZMLRWXQIM-LBPRGKRZSA-N -1 3 373.869 3.867 20 0 FHADHM [O-]c1ccc(Cl)c(F)c1CNCc1ccnc(OCC(F)(F)F)c1 ZINC000190762934 948120169 /nfs/dbraw/zinc/12/01/69/948120169.db2.gz ZTUYYQOBJRMYAG-UHFFFAOYSA-N -1 3 364.726 3.811 20 0 FHADHM FC(F)(F)[C@H](NCc1ccccc1Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000826367286 948146706 /nfs/dbraw/zinc/14/67/06/948146706.db2.gz SMCRXZCXOGJDMI-CQSZACIVSA-N -1 3 367.762 3.913 20 0 FHADHM FC(F)(F)[C@H](NCc1ccccc1Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000826367286 948146709 /nfs/dbraw/zinc/14/67/09/948146709.db2.gz SMCRXZCXOGJDMI-CQSZACIVSA-N -1 3 367.762 3.913 20 0 FHADHM Fc1ccc(Oc2ccc(NCc3cccc(-c4nnn[n-]4)c3)cn2)cc1 ZINC000826376190 948165100 /nfs/dbraw/zinc/16/51/00/948165100.db2.gz SFNMTFFGRYCKKX-UHFFFAOYSA-N -1 3 362.368 3.805 20 0 FHADHM Fc1ccc(Oc2ccc(NCc3cccc(-c4nn[n-]n4)c3)cn2)cc1 ZINC000826376190 948165106 /nfs/dbraw/zinc/16/51/06/948165106.db2.gz SFNMTFFGRYCKKX-UHFFFAOYSA-N -1 3 362.368 3.805 20 0 FHADHM O=C(CCCc1ccsc1)OCc1ccc(Cl)cc1-c1nnn[n-]1 ZINC000826406547 948235805 /nfs/dbraw/zinc/23/58/05/948235805.db2.gz BSQTVOVLBTWOLU-UHFFFAOYSA-N -1 3 362.842 3.648 20 0 FHADHM O=C(CCCc1ccsc1)OCc1ccc(Cl)cc1-c1nn[n-]n1 ZINC000826406547 948235813 /nfs/dbraw/zinc/23/58/13/948235813.db2.gz BSQTVOVLBTWOLU-UHFFFAOYSA-N -1 3 362.842 3.648 20 0 FHADHM CCCCC[N-]S(=O)(=O)c1ccc(Br)cc1C(F)(F)F ZINC000614598767 948328664 /nfs/dbraw/zinc/32/86/64/948328664.db2.gz UQXKVUWYBFWEIR-UHFFFAOYSA-N -1 3 374.222 3.936 20 0 FHADHM COc1cc2c(c(CN[C@@H](CCC(=O)[O-])c3ccccc3)c1)O[C@H](C)C2 ZINC000417605999 948331349 /nfs/dbraw/zinc/33/13/49/948331349.db2.gz ZZZNKMZIHVMERT-KUHUBIRLSA-N -1 3 355.434 3.714 20 0 FHADHM O=C(/C=C/c1cnc2ccccc2n1)Nc1ccc(Br)cc1[O-] ZINC000125970545 948347497 /nfs/dbraw/zinc/34/74/97/948347497.db2.gz XUDDXEPLKZUGMA-SOFGYWHQSA-N -1 3 370.206 3.750 20 0 FHADHM O=C([O-])[C@@H]1C[C@@H](NCc2cc(Cl)c3c(c2)OCCCO3)c2ccccc21 ZINC000417627734 948361340 /nfs/dbraw/zinc/36/13/40/948361340.db2.gz VGTMAEQKSNDSOM-NVXWUHKLSA-N -1 3 373.836 3.904 20 0 FHADHM COc1ccc(CN[C@@H]2C[C@@H](C(=O)[O-])c3ccccc32)c(OC(F)F)c1 ZINC000417629488 948366354 /nfs/dbraw/zinc/36/63/54/948366354.db2.gz QHZWHPSNJIBCIH-HZPDHXFCSA-N -1 3 363.360 3.699 20 0 FHADHM O=S(=O)([N-][C@H]1C[C@@H]1c1ccccc1)c1c2ncsc2ccc1Cl ZINC001211699990 948374962 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FHADHM O=C(CCc1ccc2ccccc2c1)Nc1cc(-c2nnn[n-]2)ccc1F ZINC001436648244 948515807 /nfs/dbraw/zinc/51/58/07/948515807.db2.gz HTSYHCFZZQPQIM-UHFFFAOYSA-N -1 3 361.380 3.730 20 0 FHADHM O=C(CCc1ccc2ccccc2c1)Nc1cc(-c2nn[n-]n2)ccc1F ZINC001436648244 948515812 /nfs/dbraw/zinc/51/58/12/948515812.db2.gz HTSYHCFZZQPQIM-UHFFFAOYSA-N -1 3 361.380 3.730 20 0 FHADHM CCc1cc2c(CNc3ccc(OC)c(OC)c3)cc(=O)oc2cc1[O-] ZINC000007239668 948538572 /nfs/dbraw/zinc/53/85/72/948538572.db2.gz IKUOZUHYIJPIRN-UHFFFAOYSA-N -1 3 355.390 3.690 20 0 FHADHM C[C@@H](CC(=O)Nc1cc(-c2nnn[n-]2)ccc1F)c1c[nH]c2ccccc12 ZINC001535492131 948546214 /nfs/dbraw/zinc/54/62/14/948546214.db2.gz LEDVCLGZCGQEMW-NSHDSACASA-N -1 3 364.384 3.619 20 0 FHADHM C[C@@H](CC(=O)Nc1cc(-c2nn[n-]n2)ccc1F)c1c[nH]c2ccccc12 ZINC001535492131 948546221 /nfs/dbraw/zinc/54/62/21/948546221.db2.gz LEDVCLGZCGQEMW-NSHDSACASA-N -1 3 364.384 3.619 20 0 FHADHM CN(C)[C@H]1CCOc2c([N-]S(=O)(=O)c3cccc(Cl)c3)cccc21 ZINC000432483972 948558904 /nfs/dbraw/zinc/55/89/04/948558904.db2.gz CSXCFWWAYMCPON-INIZCTEOSA-N -1 3 366.870 3.526 20 0 FHADHM O=S(=O)([N-]c1ccc2c(c1)CCO2)c1ccc2c(c1)Cc1ccccc1-2 ZINC000520699900 948610320 /nfs/dbraw/zinc/61/03/20/948610320.db2.gz FMEVNFPTXSXUEY-UHFFFAOYSA-N -1 3 363.438 3.994 20 0 FHADHM CC(C)c1ccc(SCC(=O)Nc2ccc(-c3nnn[n-]3)c(F)c2)cc1 ZINC001574418097 948773695 /nfs/dbraw/zinc/77/36/95/948773695.db2.gz RKWPIRWDLDPCHE-UHFFFAOYSA-N -1 3 371.441 3.860 20 0 FHADHM CC(C)c1ccc(SCC(=O)Nc2ccc(-c3nn[n-]n3)c(F)c2)cc1 ZINC001574418097 948773707 /nfs/dbraw/zinc/77/37/07/948773707.db2.gz RKWPIRWDLDPCHE-UHFFFAOYSA-N -1 3 371.441 3.860 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N[C@H]2CC(C)(C)Oc3ccc(F)cc32)c1 ZINC000652818295 948777716 /nfs/dbraw/zinc/77/77/16/948777716.db2.gz CZOHOIOPXJYTAW-INIZCTEOSA-N -1 3 372.396 3.522 20 0 FHADHM CCOc1ccc(S(=O)(=O)[N-]c2ccc(C)cc2F)cc1OCC ZINC000007927786 204311633 /nfs/dbraw/zinc/31/16/33/204311633.db2.gz BAYDBUXRKAZWQF-UHFFFAOYSA-N -1 3 353.415 3.732 20 0 FHADHM Cc1cccc(S(=O)(=O)[N-]c2ccc(N3CCSCC3)cc2C)c1 ZINC000050534834 205178341 /nfs/dbraw/zinc/17/83/41/205178341.db2.gz RXOYQLXPFXYCLB-UHFFFAOYSA-N -1 3 362.520 3.657 20 0 FHADHM Cc1ccc(S(=O)(=O)[N-]c2ccc3nc([C@@H]4CCCO4)[nH]c3c2)cc1 ZINC000060062875 205284067 /nfs/dbraw/zinc/28/40/67/205284067.db2.gz RHDUTOMNDAUION-KRWDZBQOSA-N -1 3 357.435 3.524 20 0 FHADHM CC[C@@H](C)[C@@H](NC(=O)c1c[n-]c2ccccc2c1=O)c1nc2ccccc2[nH]1 ZINC000108855938 206039792 /nfs/dbraw/zinc/03/97/92/206039792.db2.gz PJGBRKMBVGLUCA-BFUOFWGJSA-N -1 3 374.444 3.922 20 0 FHADHM C[C@H]1C[C@@H](NC(=O)c2csc(=NC3CC3)[n-]2)CCN1Cc1ccccc1 ZINC000476563189 515103767 /nfs/dbraw/zinc/10/37/67/515103767.db2.gz JECREBCMMOLRGF-YOEHRIQHSA-N -1 3 370.522 3.500 20 0 FHADHM CC(C)c1cccc(O[C@H](C)C(=O)N=c2cc(OC(F)F)n(C)[n-]2)c1 ZINC000490938269 515337869 /nfs/dbraw/zinc/33/78/69/515337869.db2.gz KTNQLBQTRMNVHV-LLVKDONJSA-N -1 3 353.369 3.551 20 0 FHADHM CCCCCc1n[n-]c(=NC(=O)N[C@@H](C)CN2CCC[C@H](C)C2)s1 ZINC000510384185 515523727 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358.405 3.527 20 0 FHADHM COc1ccc([C@H]2CCN(C(=O)N=c3cc4ccccn4[n-]3)C2)cc1F ZINC000626562234 522285373 /nfs/dbraw/zinc/28/53/73/522285373.db2.gz SNUQVHXZIDIIBO-AWEZNQCLSA-N -1 3 354.385 3.503 20 0 FHADHM O=C(CCNC(=O)c1cccs1)N=c1cc(-c2cccc(Cl)c2)[n-][nH]1 ZINC000622893475 523535015 /nfs/dbraw/zinc/53/50/15/523535015.db2.gz BTRQJQZGLIBGIL-UHFFFAOYSA-N -1 3 374.853 3.550 20 0 FHADHM Cc1cccc(C)c1[N-]S(=O)(=O)c1ccc(NC(=O)C23CC(C2)C3)cc1 ZINC000636693457 567824498 /nfs/dbraw/zinc/82/44/98/567824498.db2.gz BIVFPOYQNFGZTR-UHFFFAOYSA-N -1 3 370.474 3.843 20 0 FHADHM COc1ccc(Cl)c(S(=O)(=O)[N-]CCCCc2ccccc2)c1 ZINC000602255545 567960268 /nfs/dbraw/zinc/96/02/68/567960268.db2.gz SEVXHLPXLUWWIK-UHFFFAOYSA-N -1 3 353.871 3.650 20 0 FHADHM Cc1cc([N-]C(=O)[C@H](C)Nc2cc(C)n(-c3cccc(Cl)c3)n2)on1 ZINC000188614218 567993854 /nfs/dbraw/zinc/99/38/54/567993854.db2.gz MGCQJHOWXOINCT-LBPRGKRZSA-N -1 3 359.817 3.570 20 0 FHADHM CC(C)(C)[S@](=O)Cc1cccc(NC(=O)c2cc(C(F)F)[n-]n2)c1 ZINC000602878074 568003480 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Cc1[n-]c(S(=O)(=O)CCc2ccc(C)cc2)nc1Cc1ccccc1 ZINC000605987980 568066384 /nfs/dbraw/zinc/06/63/84/568066384.db2.gz LKQPOGUJTRFWQN-UHFFFAOYSA-N -1 3 354.475 3.634 20 0 FHADHM C[C@H](SCCc1nnn[n-]1)c1nnc(-c2ccc(Cl)cc2Cl)o1 ZINC000603341024 568087112 /nfs/dbraw/zinc/08/71/12/568087112.db2.gz VYCKBJHEMURSFW-ZETCQYMHSA-N -1 3 371.253 3.593 20 0 FHADHM C[C@H](SCCc1nn[n-]n1)c1nnc(-c2ccc(Cl)cc2Cl)o1 ZINC000603341024 568087113 /nfs/dbraw/zinc/08/71/13/568087113.db2.gz VYCKBJHEMURSFW-ZETCQYMHSA-N -1 3 371.253 3.593 20 0 FHADHM CCN(Cc1nc(=O)c2c(-c3ccccc3)csc2[n-]1)C[C@@H]1CCOC1 ZINC000604052218 568206622 /nfs/dbraw/zinc/20/66/22/568206622.db2.gz HNDASPNXXWBTBI-AWEZNQCLSA-N -1 3 369.490 3.922 20 0 FHADHM Cc1ccc(C[C@@H]([N-]S(=O)(=O)c2ccccc2F)c2ccccn2)cc1 ZINC000604410901 568271930 /nfs/dbraw/zinc/27/19/30/568271930.db2.gz MIIRLIRRKLYJHX-LJQANCHMSA-N -1 3 370.449 3.791 20 0 FHADHM CS(=O)(=O)[N-]c1ccc(C(=O)N2CCCC3(CCCCC3)CC2)cc1 ZINC000408276771 568288004 /nfs/dbraw/zinc/28/80/04/568288004.db2.gz KXFASBGKIHLFFT-UHFFFAOYSA-N -1 3 364.511 3.635 20 0 FHADHM CC1(C)CN(Cc2ccccc2)CC[C@H]1N=c1[n-]nc(C(F)(F)F)s1 ZINC000390850842 568343650 /nfs/dbraw/zinc/34/36/50/568343650.db2.gz GVTJRIJSAKTLBL-CYBMUJFWSA-N -1 3 370.444 3.691 20 0 FHADHM CC[C@H](Cc1ccc(Cl)cc1)NC(=O)CCc1c(C)nc(C)[n-]c1=O ZINC000604735621 568358606 /nfs/dbraw/zinc/35/86/06/568358606.db2.gz JTAZEERPILFJOD-MRXNPFEDSA-N -1 3 361.873 3.523 20 0 FHADHM Cc1ccc2ncccc2c1S(=O)(=O)[N-]c1cc(F)cc(F)c1F ZINC000644851281 568359353 /nfs/dbraw/zinc/35/93/53/568359353.db2.gz VFLRZLQFQCURKQ-UHFFFAOYSA-N -1 3 352.337 3.761 20 0 FHADHM COc1ccc(-c2nc(Sc3cc(C)nc(C4CC4)n3)n[n-]2)c(OC)c1 ZINC000604758809 568360258 /nfs/dbraw/zinc/36/02/58/568360258.db2.gz ZOUSSPSNACGDIG-UHFFFAOYSA-N -1 3 369.450 3.616 20 0 FHADHM COc1ccc(-c2cc(CSc3n[n-]c(-c4ccccn4)n3)on2)cc1 ZINC000604932687 568395140 /nfs/dbraw/zinc/39/51/40/568395140.db2.gz BELQHXKOUBOTON-UHFFFAOYSA-N -1 3 365.418 3.823 20 0 FHADHM CCN(C(=O)c1csc(=O)[n-]1)[C@H](c1cccnc1)c1ccc(F)c(C)c1 ZINC000365297917 568442040 /nfs/dbraw/zinc/44/20/40/568442040.db2.gz JPEQMTMLEOACGT-KRWDZBQOSA-N -1 3 371.437 3.943 20 0 FHADHM Brc1cccc(-c2nnc(-c3noc([C@H]4CC45CC5)n3)[n-]2)c1 ZINC000643279757 568485712 /nfs/dbraw/zinc/48/57/12/568485712.db2.gz XFNURMLGSLCMNY-SNVBAGLBSA-N -1 3 358.199 3.552 20 0 FHADHM Brc1cccc(-c2n[n-]c(-c3noc([C@H]4CC45CC5)n3)n2)c1 ZINC000643279757 568485714 /nfs/dbraw/zinc/48/57/14/568485714.db2.gz XFNURMLGSLCMNY-SNVBAGLBSA-N -1 3 358.199 3.552 20 0 FHADHM Brc1cccc(-c2nc(-c3noc([C@H]4CC45CC5)n3)n[n-]2)c1 ZINC000643279757 568485716 /nfs/dbraw/zinc/48/57/16/568485716.db2.gz XFNURMLGSLCMNY-SNVBAGLBSA-N -1 3 358.199 3.552 20 0 FHADHM O=S(=O)([N-]CC1Cc2ccccc2C1)c1cc(Cl)ccc1Cl ZINC000605005040 568519270 /nfs/dbraw/zinc/51/92/70/568519270.db2.gz AOZXIXPNIVNKGY-UHFFFAOYSA-N -1 3 356.274 3.687 20 0 FHADHM O=C(N[C@@H]1CCc2c1ccc(Cl)c2Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000738037534 598824010 /nfs/dbraw/zinc/82/40/10/598824010.db2.gz WUHMTEKFRVHPBZ-CQSZACIVSA-N -1 3 374.231 3.591 20 0 FHADHM O=C(N[C@@H]1CCc2c1ccc(Cl)c2Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000738037534 598824011 /nfs/dbraw/zinc/82/40/11/598824011.db2.gz WUHMTEKFRVHPBZ-CQSZACIVSA-N -1 3 374.231 3.591 20 0 FHADHM CCN(C(=O)[C@@H](C)c1cccc(C)c1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736502443 598830277 /nfs/dbraw/zinc/83/02/77/598830277.db2.gz MWRNASORVJTDMQ-HOTGVXAUSA-N -1 3 363.465 3.888 20 0 FHADHM CCN(C(=O)[C@@H](C)c1cccc(C)c1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736502443 598830279 /nfs/dbraw/zinc/83/02/79/598830279.db2.gz MWRNASORVJTDMQ-HOTGVXAUSA-N -1 3 363.465 3.888 20 0 FHADHM Cc1cccc([C@@H](C)C(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(F)F)c1 ZINC000737385435 598832890 /nfs/dbraw/zinc/83/28/90/598832890.db2.gz SOCLBOYFFMZKNW-LLVKDONJSA-N -1 3 373.363 3.519 20 0 FHADHM Cc1cccc([C@@H](C)C(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(F)F)c1 ZINC000737385435 598832891 /nfs/dbraw/zinc/83/28/91/598832891.db2.gz SOCLBOYFFMZKNW-LLVKDONJSA-N -1 3 373.363 3.519 20 0 FHADHM CC(C)[C@H](C)C(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000735699647 598833692 /nfs/dbraw/zinc/83/36/92/598833692.db2.gz CHZYQDNPQMRJHP-LBPRGKRZSA-N -1 3 355.467 3.504 20 0 FHADHM CCc1ccc([C@@H]2CCCCCN2C(=O)c2sccc2-c2nnn[n-]2)o1 ZINC000736685032 598835629 /nfs/dbraw/zinc/83/56/29/598835629.db2.gz JSXGONWXANDZHO-AWEZNQCLSA-N -1 3 371.466 3.841 20 0 FHADHM CCc1ccc([C@@H]2CCCCCN2C(=O)c2sccc2-c2nn[n-]n2)o1 ZINC000736685032 598835631 /nfs/dbraw/zinc/83/56/31/598835631.db2.gz JSXGONWXANDZHO-AWEZNQCLSA-N -1 3 371.466 3.841 20 0 FHADHM CCCCCCC(=O)Nc1c(C)c(C)nn1-c1ccc(-c2nn[n-]n2)cc1 ZINC000736444143 598839257 /nfs/dbraw/zinc/83/92/57/598839257.db2.gz FEHWPZIRSPJSDT-UHFFFAOYSA-N -1 3 367.457 3.578 20 0 FHADHM CC[C@@H](OC(=O)CNc1ccc(-c2nn[n-]n2)cc1)c1ccc(Cl)cc1 ZINC000736383429 598843850 /nfs/dbraw/zinc/84/38/50/598843850.db2.gz RGJJXMJVKYDXHO-MRXNPFEDSA-N -1 3 371.828 3.627 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)Nc1cc(C)cc(C)c1 ZINC000736633664 598850292 /nfs/dbraw/zinc/85/02/92/598850292.db2.gz FENRYMFHWGGTHC-UHFFFAOYSA-N -1 3 352.398 3.526 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)Nc1cc(C)cc(C)c1 ZINC000736633664 598850294 /nfs/dbraw/zinc/85/02/94/598850294.db2.gz FENRYMFHWGGTHC-UHFFFAOYSA-N -1 3 352.398 3.526 20 0 FHADHM CCc1nc2ccccc2n1CCNc1cc(Cl)ccc1-c1nnn[n-]1 ZINC000736704690 598852866 /nfs/dbraw/zinc/85/28/66/598852866.db2.gz BBCNNLTXVAUAAA-UHFFFAOYSA-N -1 3 367.844 3.544 20 0 FHADHM CCc1nc2ccccc2n1CCNc1cc(Cl)ccc1-c1nn[n-]n1 ZINC000736704690 598852867 /nfs/dbraw/zinc/85/28/67/598852867.db2.gz BBCNNLTXVAUAAA-UHFFFAOYSA-N -1 3 367.844 3.544 20 0 FHADHM CCc1ccc(-c2noc([C@H](C)Oc3ccc(-c4nn[n-]n4)cc3)n2)cc1 ZINC000736677426 598859824 /nfs/dbraw/zinc/85/98/24/598859824.db2.gz KHNOODCEZRLXRJ-LBPRGKRZSA-N -1 3 362.393 3.619 20 0 FHADHM CCC(CC)NC(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000736346311 598888290 /nfs/dbraw/zinc/88/82/90/598888290.db2.gz XWAKJROXZARPOB-UHFFFAOYSA-N -1 3 370.482 3.583 20 0 FHADHM C[C@@H](CC1CCCC1)C(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(F)F ZINC000735987078 598905607 /nfs/dbraw/zinc/90/56/07/598905607.db2.gz WZCCVUJWTKUTFS-JTQLQIEISA-N -1 3 365.384 3.623 20 0 FHADHM C[C@@H](CC1CCCC1)C(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(F)F ZINC000735987078 598905609 /nfs/dbraw/zinc/90/56/09/598905609.db2.gz WZCCVUJWTKUTFS-JTQLQIEISA-N -1 3 365.384 3.623 20 0 FHADHM CC[C@H](NC(=O)c1sccc1-c1nnn[n-]1)c1ccc(Cl)s1 ZINC000736372255 598907291 /nfs/dbraw/zinc/90/72/91/598907291.db2.gz VNJJPNMNEACDHK-QMMMGPOBSA-N -1 3 353.860 3.524 20 0 FHADHM CC[C@H](NC(=O)c1sccc1-c1nn[n-]n1)c1ccc(Cl)s1 ZINC000736372255 598907293 /nfs/dbraw/zinc/90/72/93/598907293.db2.gz VNJJPNMNEACDHK-QMMMGPOBSA-N -1 3 353.860 3.524 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@@H]2C(=O)N(C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000735924809 598911108 /nfs/dbraw/zinc/91/11/08/598911108.db2.gz VGFNTNRJPGPELQ-OALUTQOASA-N -1 3 361.449 3.757 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@@H]2C(=O)N(C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000735924809 598911110 /nfs/dbraw/zinc/91/11/10/598911110.db2.gz VGFNTNRJPGPELQ-OALUTQOASA-N -1 3 361.449 3.757 20 0 FHADHM CC[C@@H](NC(=O)Nc1cccc(-c2nnn[n-]2)c1)c1ccc(Cl)s1 ZINC000736362980 598919897 /nfs/dbraw/zinc/91/98/97/598919897.db2.gz LPHSHYFBMALVBL-LLVKDONJSA-N -1 3 362.846 3.854 20 0 FHADHM CC[C@@H](NC(=O)Nc1cccc(-c2nn[n-]n2)c1)c1ccc(Cl)s1 ZINC000736362980 598919898 /nfs/dbraw/zinc/91/98/98/598919898.db2.gz LPHSHYFBMALVBL-LLVKDONJSA-N -1 3 362.846 3.854 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)N1CCC[C@@]2(CC=CCC2)C1 ZINC000738150751 598924077 /nfs/dbraw/zinc/92/40/77/598924077.db2.gz COLLUCFJWGQECM-SFHVURJKSA-N -1 3 372.860 3.874 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)N1CCC[C@@]2(CC=CCC2)C1 ZINC000738150751 598924078 /nfs/dbraw/zinc/92/40/78/598924078.db2.gz COLLUCFJWGQECM-SFHVURJKSA-N -1 3 372.860 3.874 20 0 FHADHM Clc1ccc2[nH]c(Sc3ncc(-c4nn[n-]n4)cc3Cl)nc2c1 ZINC000737573572 598934587 /nfs/dbraw/zinc/93/45/87/598934587.db2.gz MNFXSIRLQSTTMM-UHFFFAOYSA-N -1 3 364.221 3.596 20 0 FHADHM Fc1ccc2c(c1)[C@@H](Nc1ncc(-c3nnn[n-]3)cc1Cl)CCS2 ZINC000737668751 598936665 /nfs/dbraw/zinc/93/66/65/598936665.db2.gz XJYUDHWUMIOSGR-LBPRGKRZSA-N -1 3 362.821 3.703 20 0 FHADHM Fc1ccc2c(c1)[C@@H](Nc1ncc(-c3nn[n-]n3)cc1Cl)CCS2 ZINC000737668751 598936666 /nfs/dbraw/zinc/93/66/66/598936666.db2.gz XJYUDHWUMIOSGR-LBPRGKRZSA-N -1 3 362.821 3.703 20 0 FHADHM CC[C@@H](NC(=S)Nc1ccccc1-c1nnn[n-]1)c1cc(F)ccc1F ZINC000736372005 598939216 /nfs/dbraw/zinc/93/92/16/598939216.db2.gz UJVXQJDRKPNJMR-CQSZACIVSA-N -1 3 374.420 3.583 20 0 FHADHM CC[C@@H](NC(=S)Nc1ccccc1-c1nn[n-]n1)c1cc(F)ccc1F ZINC000736372005 598939218 /nfs/dbraw/zinc/93/92/18/598939218.db2.gz UJVXQJDRKPNJMR-CQSZACIVSA-N -1 3 374.420 3.583 20 0 FHADHM CC[C@@H]1CCC[C@H](NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)C1 ZINC000736401135 598939333 /nfs/dbraw/zinc/93/93/33/598939333.db2.gz VWWCODCSNWFYQC-MNOVXSKESA-N -1 3 364.906 3.775 20 0 FHADHM CC[C@@H]1CCC[C@H](NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)C1 ZINC000736401135 598939334 /nfs/dbraw/zinc/93/93/34/598939334.db2.gz VWWCODCSNWFYQC-MNOVXSKESA-N -1 3 364.906 3.775 20 0 FHADHM CC[C@H](NC(=S)Nc1ccccc1-c1nnn[n-]1)c1cc(F)ccc1F ZINC000736372003 598939508 /nfs/dbraw/zinc/93/95/08/598939508.db2.gz UJVXQJDRKPNJMR-AWEZNQCLSA-N -1 3 374.420 3.583 20 0 FHADHM CC[C@H](NC(=S)Nc1ccccc1-c1nn[n-]n1)c1cc(F)ccc1F ZINC000736372003 598939510 /nfs/dbraw/zinc/93/95/10/598939510.db2.gz UJVXQJDRKPNJMR-AWEZNQCLSA-N -1 3 374.420 3.583 20 0 FHADHM Fc1cccc(Cl)c1[C@H]1C[C@@H]1Nc1nc2c(cc1-c1nnn[n-]1)CCC2 ZINC000737659376 598972237 /nfs/dbraw/zinc/97/22/37/598972237.db2.gz CPVXMBOCNFIQMU-BONVTDFDSA-N -1 3 370.819 3.511 20 0 FHADHM Fc1cccc(Cl)c1[C@H]1C[C@@H]1Nc1nc2c(cc1-c1nn[n-]n1)CCC2 ZINC000737659376 598972239 /nfs/dbraw/zinc/97/22/39/598972239.db2.gz CPVXMBOCNFIQMU-BONVTDFDSA-N -1 3 370.819 3.511 20 0 FHADHM O=C(C[C@@H]1CCc2ccccc21)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000737817544 599016002 /nfs/dbraw/zinc/01/60/02/599016002.db2.gz BLAIAYAMFIRGMF-LBPRGKRZSA-N -1 3 353.813 3.579 20 0 FHADHM O=C(C[C@@H]1CCc2ccccc21)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000737817544 599016004 /nfs/dbraw/zinc/01/60/04/599016004.db2.gz BLAIAYAMFIRGMF-LBPRGKRZSA-N -1 3 353.813 3.579 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@@H]2C(=O)OCc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000735924050 599016390 /nfs/dbraw/zinc/01/63/90/599016390.db2.gz ORQKAXDIUPLRHP-OALUTQOASA-N -1 3 362.433 3.837 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@@H]2C(=O)OCc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000735924050 599016392 /nfs/dbraw/zinc/01/63/92/599016392.db2.gz ORQKAXDIUPLRHP-OALUTQOASA-N -1 3 362.433 3.837 20 0 FHADHM C[C@@H]1CN(c2cc(Cl)ccc2-c2nnn[n-]2)C[C@@H](c2ccc(F)cc2)O1 ZINC000820769683 599036274 /nfs/dbraw/zinc/03/62/74/599036274.db2.gz VPRNXLOABAUZSY-DIFFPNOSSA-N -1 3 373.819 3.626 20 0 FHADHM C[C@@H]1CN(c2cc(Cl)ccc2-c2nn[n-]n2)C[C@@H](c2ccc(F)cc2)O1 ZINC000820769683 599036276 /nfs/dbraw/zinc/03/62/76/599036276.db2.gz VPRNXLOABAUZSY-DIFFPNOSSA-N -1 3 373.819 3.626 20 0 FHADHM C[C@@H](c1ccc(F)cc1)N(C)c1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000736197690 599040673 /nfs/dbraw/zinc/04/06/73/599040673.db2.gz CKHAQWPWGMEXBK-VIFPVBQESA-N -1 3 366.322 3.617 20 0 FHADHM C[C@@H](c1ccc(F)cc1)N(C)c1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000736197690 599040676 /nfs/dbraw/zinc/04/06/76/599040676.db2.gz CKHAQWPWGMEXBK-VIFPVBQESA-N -1 3 366.322 3.617 20 0 FHADHM C[C@H](CNc1nc(C(F)(F)F)ccc1-c1nnn[n-]1)Cc1cccs1 ZINC000820280479 599041657 /nfs/dbraw/zinc/04/16/57/599041657.db2.gz HHPGKMKLTTVJQX-VIFPVBQESA-N -1 3 368.388 3.633 20 0 FHADHM C[C@H](CNc1nc(C(F)(F)F)ccc1-c1nn[n-]n1)Cc1cccs1 ZINC000820280479 599041659 /nfs/dbraw/zinc/04/16/59/599041659.db2.gz HHPGKMKLTTVJQX-VIFPVBQESA-N -1 3 368.388 3.633 20 0 FHADHM Cc1cccc([C@@H]2CCCN2c2nc(C(F)(F)F)ccc2-c2nnn[n-]2)c1 ZINC000737390160 599046956 /nfs/dbraw/zinc/04/69/56/599046956.db2.gz QTMYENQTNPKLCT-AWEZNQCLSA-N -1 3 374.370 3.930 20 0 FHADHM Cc1cccc([C@@H]2CCCN2c2nc(C(F)(F)F)ccc2-c2nn[n-]n2)c1 ZINC000737390160 599046959 /nfs/dbraw/zinc/04/69/59/599046959.db2.gz QTMYENQTNPKLCT-AWEZNQCLSA-N -1 3 374.370 3.930 20 0 FHADHM Fc1ccc2c(c1)CC[C@@H]2Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000737669032 599051126 /nfs/dbraw/zinc/05/11/26/599051126.db2.gz YITXLTBSNUWSBS-LBPRGKRZSA-N -1 3 364.306 3.519 20 0 FHADHM Fc1ccc2c(c1)CC[C@@H]2Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000737669032 599051127 /nfs/dbraw/zinc/05/11/27/599051127.db2.gz YITXLTBSNUWSBS-LBPRGKRZSA-N -1 3 364.306 3.519 20 0 FHADHM Cc1c2ccccc2oc1CNc1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000737212496 599058083 /nfs/dbraw/zinc/05/80/83/599058083.db2.gz QYNPQXLMTNNUEW-UHFFFAOYSA-N -1 3 374.326 3.947 20 0 FHADHM Cc1c2ccccc2oc1CNc1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000737212496 599058085 /nfs/dbraw/zinc/05/80/85/599058085.db2.gz QYNPQXLMTNNUEW-UHFFFAOYSA-N -1 3 374.326 3.947 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1NCCc1c[nH]c2ccc(Cl)cc12 ZINC000822748435 599067047 /nfs/dbraw/zinc/06/70/47/599067047.db2.gz YNUSLGLPYUBTQN-UHFFFAOYSA-N -1 3 356.792 3.795 20 0 FHADHM CCc1cnc(CCNc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)s1 ZINC000821496089 599083409 /nfs/dbraw/zinc/08/34/09/599083409.db2.gz BOWXNAHFJJVHTK-UHFFFAOYSA-N -1 3 368.388 3.559 20 0 FHADHM CO[C@H](CNc1ccc(-c2nnn[n-]2)c(Cl)c1)c1cccc(Cl)c1 ZINC000821676576 599090703 /nfs/dbraw/zinc/09/07/03/599090703.db2.gz AXLZNNUZWAEKFR-OAHLLOKOSA-N -1 3 364.236 3.973 20 0 FHADHM CO[C@H](CNc1ccc(-c2nn[n-]n2)c(Cl)c1)c1cccc(Cl)c1 ZINC000821676576 599090706 /nfs/dbraw/zinc/09/07/06/599090706.db2.gz AXLZNNUZWAEKFR-OAHLLOKOSA-N -1 3 364.236 3.973 20 0 FHADHM Cc1ccc([C@H]2OCCC[C@H]2CNc2ccc(F)cc2-c2nnn[n-]2)cc1 ZINC000822233078 599108814 /nfs/dbraw/zinc/10/88/14/599108814.db2.gz HPRGOWCWSRLSKX-HNAYVOBHSA-N -1 3 367.428 3.894 20 0 FHADHM Cc1ccc([C@H]2OCCC[C@H]2CNc2ccc(F)cc2-c2nn[n-]n2)cc1 ZINC000822233078 599108816 /nfs/dbraw/zinc/10/88/16/599108816.db2.gz HPRGOWCWSRLSKX-HNAYVOBHSA-N -1 3 367.428 3.894 20 0 FHADHM CSCCCSc1cc(C)c(-c2nnn[n-]2)c2nc3ccccc3n21 ZINC000821970884 599121360 /nfs/dbraw/zinc/12/13/60/599121360.db2.gz TWXBIGFDNGJPMR-UHFFFAOYSA-N -1 3 370.507 3.821 20 0 FHADHM CSCCCSc1cc(C)c(-c2nn[n-]n2)c2nc3ccccc3n21 ZINC000821970884 599121362 /nfs/dbraw/zinc/12/13/62/599121362.db2.gz TWXBIGFDNGJPMR-UHFFFAOYSA-N -1 3 370.507 3.821 20 0 FHADHM Fc1cc(OCc2ccccc2OCC(F)(F)F)ccc1-c1nnn[n-]1 ZINC000822753035 599126736 /nfs/dbraw/zinc/12/67/36/599126736.db2.gz ADOKHCRQRJJMIN-UHFFFAOYSA-N -1 3 368.290 3.526 20 0 FHADHM Fc1cc(OCc2ccccc2OCC(F)(F)F)ccc1-c1nn[n-]n1 ZINC000822753035 599126738 /nfs/dbraw/zinc/12/67/38/599126738.db2.gz ADOKHCRQRJJMIN-UHFFFAOYSA-N -1 3 368.290 3.526 20 0 FHADHM OCCCCCCCSc1nc(-c2ccccc2)ccc1-c1nnn[n-]1 ZINC000823718463 599128797 /nfs/dbraw/zinc/12/87/97/599128797.db2.gz VEYGUPZOPJSMTI-UHFFFAOYSA-N -1 3 369.494 3.964 20 0 FHADHM OCCCCCCCSc1nc(-c2ccccc2)ccc1-c1nn[n-]n1 ZINC000823718463 599128799 /nfs/dbraw/zinc/12/87/99/599128799.db2.gz VEYGUPZOPJSMTI-UHFFFAOYSA-N -1 3 369.494 3.964 20 0 FHADHM Cc1ccc([C@H]2CCC[C@@H]2N(C)C(=O)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000822233026 599161783 /nfs/dbraw/zinc/16/17/83/599161783.db2.gz GMHFPGFLOKURAD-MOPGFXCFSA-N -1 3 361.449 3.583 20 0 FHADHM Cc1ccc([C@H]2CCC[C@@H]2N(C)C(=O)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000822233026 599161785 /nfs/dbraw/zinc/16/17/85/599161785.db2.gz GMHFPGFLOKURAD-MOPGFXCFSA-N -1 3 361.449 3.583 20 0 FHADHM Cc1ccc([C@@H]2CCC[C@H]2N(C)C(=O)c2sccc2-c2nnn[n-]2)cc1 ZINC000822232849 599161812 /nfs/dbraw/zinc/16/18/12/599161812.db2.gz CGDRWHLMKCVTED-GOEBONIOSA-N -1 3 367.478 3.645 20 0 FHADHM Cc1ccc([C@@H]2CCC[C@H]2N(C)C(=O)c2sccc2-c2nn[n-]n2)cc1 ZINC000822232849 599161813 /nfs/dbraw/zinc/16/18/13/599161813.db2.gz CGDRWHLMKCVTED-GOEBONIOSA-N -1 3 367.478 3.645 20 0 FHADHM Cc1ccccc1SCc1nnc(-c2cccc(-c3nnn[n-]3)c2)o1 ZINC000737432077 599165140 /nfs/dbraw/zinc/16/51/40/599165140.db2.gz RJFROWVAOFEMJM-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM Cc1ccccc1SCc1nnc(-c2cccc(-c3nn[n-]n3)c2)o1 ZINC000737432077 599165142 /nfs/dbraw/zinc/16/51/42/599165142.db2.gz RJFROWVAOFEMJM-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM Cc1sc(NC(=O)CSc2ccc(-c3nnn[n-]3)cc2)c(C)c1C ZINC000737562411 599164491 /nfs/dbraw/zinc/16/44/91/599164491.db2.gz IULNSOJNXMCYKL-UHFFFAOYSA-N -1 3 359.480 3.584 20 0 FHADHM Cc1sc(NC(=O)CSc2ccc(-c3nn[n-]n3)cc2)c(C)c1C ZINC000737562411 599164494 /nfs/dbraw/zinc/16/44/94/599164494.db2.gz IULNSOJNXMCYKL-UHFFFAOYSA-N -1 3 359.480 3.584 20 0 FHADHM CC(C)C1CCN(C(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)CC1 ZINC000735747070 599174360 /nfs/dbraw/zinc/17/43/60/599174360.db2.gz ATZVCDJXOLMRED-UHFFFAOYSA-N -1 3 364.906 3.585 20 0 FHADHM CC(C)C1CCN(C(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)CC1 ZINC000735747070 599174362 /nfs/dbraw/zinc/17/43/62/599174362.db2.gz ATZVCDJXOLMRED-UHFFFAOYSA-N -1 3 364.906 3.585 20 0 FHADHM Clc1ccc([C@H]2CSCCN2Cc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000737570377 599176793 /nfs/dbraw/zinc/17/67/93/599176793.db2.gz GGQSHTYLCMXRSX-QGZVFWFLSA-N -1 3 371.897 3.810 20 0 FHADHM CC(=CC(=O)Nc1cccc(-c2nnn[n-]2)c1)c1ccccc1C(F)(F)F ZINC000735446611 599177185 /nfs/dbraw/zinc/17/71/85/599177185.db2.gz BRCVWHQFIVWKBA-PKNBQFBNSA-N -1 3 373.338 3.928 20 0 FHADHM CC(=CC(=O)Nc1cccc(-c2nn[n-]n2)c1)c1ccccc1C(F)(F)F ZINC000735446611 599177188 /nfs/dbraw/zinc/17/71/88/599177188.db2.gz BRCVWHQFIVWKBA-PKNBQFBNSA-N -1 3 373.338 3.928 20 0 FHADHM C[C@H](C(=O)Nc1sccc1-c1nnn[n-]1)c1ccccc1C(F)(F)F ZINC000735571448 599178982 /nfs/dbraw/zinc/17/89/82/599178982.db2.gz XFPJNIVNTLWYAJ-QMMMGPOBSA-N -1 3 367.356 3.689 20 0 FHADHM C[C@H](C(=O)Nc1sccc1-c1nn[n-]n1)c1ccccc1C(F)(F)F ZINC000735571448 599178985 /nfs/dbraw/zinc/17/89/85/599178985.db2.gz XFPJNIVNTLWYAJ-QMMMGPOBSA-N -1 3 367.356 3.689 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@@H](C)c1cccc(Cl)c1 ZINC000736636053 599184352 /nfs/dbraw/zinc/18/43/52/599184352.db2.gz NLSYWSXXICOWGZ-NSHDSACASA-N -1 3 371.828 3.661 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@@H](C)c1cccc(Cl)c1 ZINC000736636053 599184353 /nfs/dbraw/zinc/18/43/53/599184353.db2.gz NLSYWSXXICOWGZ-NSHDSACASA-N -1 3 371.828 3.661 20 0 FHADHM C[C@@H](C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1cccc(Cl)c1 ZINC000736094912 599182250 /nfs/dbraw/zinc/18/22/50/599182250.db2.gz AXMLJFHJMKGNAU-NEPJUHHUSA-N -1 3 355.829 3.501 20 0 FHADHM C[C@@H](C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1cccc(Cl)c1 ZINC000736094912 599182251 /nfs/dbraw/zinc/18/22/51/599182251.db2.gz AXMLJFHJMKGNAU-NEPJUHHUSA-N -1 3 355.829 3.501 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CCC(C(C)(C)C)CC1 ZINC000736635854 599187124 /nfs/dbraw/zinc/18/71/24/599187124.db2.gz ICDSRNHLTIKCFL-UHFFFAOYSA-N -1 3 372.473 3.555 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CCC(C(C)(C)C)CC1 ZINC000736635854 599187126 /nfs/dbraw/zinc/18/71/26/599187126.db2.gz ICDSRNHLTIKCFL-UHFFFAOYSA-N -1 3 372.473 3.555 20 0 FHADHM CC[C@@H](C)NC(=O)c1cccc(Oc2ccc(Cl)cc2-c2nnn[n-]2)c1 ZINC000736328398 599193122 /nfs/dbraw/zinc/19/31/22/599193122.db2.gz WSVNISCRVWCIBW-LLVKDONJSA-N -1 3 371.828 3.841 20 0 FHADHM CC[C@@H](C)NC(=O)c1cccc(Oc2ccc(Cl)cc2-c2nn[n-]n2)c1 ZINC000736328398 599193124 /nfs/dbraw/zinc/19/31/24/599193124.db2.gz WSVNISCRVWCIBW-LLVKDONJSA-N -1 3 371.828 3.841 20 0 FHADHM Cc1noc(-c2cccc(Oc3ccc(Cl)cc3-c3nnn[n-]3)c2)n1 ZINC000737535185 599194081 /nfs/dbraw/zinc/19/40/81/599194081.db2.gz WHKHQSRXPPEHAZ-UHFFFAOYSA-N -1 3 354.757 3.671 20 0 FHADHM Cc1noc(-c2cccc(Oc3ccc(Cl)cc3-c3nn[n-]n3)c2)n1 ZINC000737535185 599194082 /nfs/dbraw/zinc/19/40/82/599194082.db2.gz WHKHQSRXPPEHAZ-UHFFFAOYSA-N -1 3 354.757 3.671 20 0 FHADHM CC(C)N(C)C(=O)c1cccc(Oc2ccc(Cl)cc2-c2nnn[n-]2)c1 ZINC000735856919 599194346 /nfs/dbraw/zinc/19/43/46/599194346.db2.gz LHGIQLUQFXIHMQ-UHFFFAOYSA-N -1 3 371.828 3.793 20 0 FHADHM CC(C)N(C)C(=O)c1cccc(Oc2ccc(Cl)cc2-c2nn[n-]n2)c1 ZINC000735856919 599194349 /nfs/dbraw/zinc/19/43/49/599194349.db2.gz LHGIQLUQFXIHMQ-UHFFFAOYSA-N -1 3 371.828 3.793 20 0 FHADHM C[C@@H](SCc1nccn1CC(F)(F)F)c1ccc(-c2nnn[n-]2)cc1 ZINC000820550103 599222281 /nfs/dbraw/zinc/22/22/81/599222281.db2.gz UPNNKGIKBRQEDX-SNVBAGLBSA-N -1 3 368.388 3.620 20 0 FHADHM C[C@@H](SCc1nccn1CC(F)(F)F)c1ccc(-c2nn[n-]n2)cc1 ZINC000820550103 599222283 /nfs/dbraw/zinc/22/22/83/599222283.db2.gz UPNNKGIKBRQEDX-SNVBAGLBSA-N -1 3 368.388 3.620 20 0 FHADHM C[C@@H]1CN(C(=O)C=Cc2ccccc2-c2nnn[n-]2)CC[C@H]1c1ccccc1 ZINC000736278840 599222925 /nfs/dbraw/zinc/22/29/25/599222925.db2.gz IVZCXRHRNZZKGZ-URWYZWATSA-N -1 3 373.460 3.532 20 0 FHADHM C[C@@H]1CN(C(=O)C=Cc2ccccc2-c2nn[n-]n2)CC[C@H]1c1ccccc1 ZINC000736278840 599222927 /nfs/dbraw/zinc/22/29/27/599222927.db2.gz IVZCXRHRNZZKGZ-URWYZWATSA-N -1 3 373.460 3.532 20 0 FHADHM Cc1c(NC(=O)c2ccc(F)c(C(F)(F)F)c2)cccc1-c1nnn[n-]1 ZINC000822108328 607267162 /nfs/dbraw/zinc/26/71/62/607267162.db2.gz HQGLEAXLMPAFQQ-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM Cc1c(NC(=O)c2ccc(F)c(C(F)(F)F)c2)cccc1-c1nn[n-]n1 ZINC000822108328 607267163 /nfs/dbraw/zinc/26/71/63/607267163.db2.gz HQGLEAXLMPAFQQ-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM CC[C@H](NC(=S)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1cccs1 ZINC000820920314 599238795 /nfs/dbraw/zinc/23/87/95/599238795.db2.gz OWYZWJAGLGDPSE-FZMZJTMJSA-N -1 3 372.523 3.605 20 0 FHADHM CC[C@H](NC(=S)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1cccs1 ZINC000820920314 599238797 /nfs/dbraw/zinc/23/87/97/599238797.db2.gz OWYZWJAGLGDPSE-FZMZJTMJSA-N -1 3 372.523 3.605 20 0 FHADHM CC[C@H](C)c1ccccc1OCC(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000820882541 607267539 /nfs/dbraw/zinc/26/75/39/607267539.db2.gz SQZYSOMQQFSVLA-ZDUSSCGKSA-N -1 3 365.437 3.706 20 0 FHADHM CC[C@H](C)c1ccccc1OCC(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000820882541 607267540 /nfs/dbraw/zinc/26/75/40/607267540.db2.gz SQZYSOMQQFSVLA-ZDUSSCGKSA-N -1 3 365.437 3.706 20 0 FHADHM CC[C@@H](NC(=O)Nc1ccc(-c2nnn[n-]2)cc1)C(C)(C)c1ccccc1 ZINC000820920632 599243156 /nfs/dbraw/zinc/24/31/56/599243156.db2.gz RPZHPJDAPAFODB-QGZVFWFLSA-N -1 3 364.453 3.745 20 0 FHADHM CC[C@@H](NC(=O)Nc1ccc(-c2nn[n-]n2)cc1)C(C)(C)c1ccccc1 ZINC000820920632 599243157 /nfs/dbraw/zinc/24/31/57/599243157.db2.gz RPZHPJDAPAFODB-QGZVFWFLSA-N -1 3 364.453 3.745 20 0 FHADHM CCN(C(=O)/C=C/C1CCCCC1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736501491 599247681 /nfs/dbraw/zinc/24/76/81/599247681.db2.gz CTLRRGWJCQFJER-AAWPKVBNSA-N -1 3 353.470 3.913 20 0 FHADHM CCN(C(=O)/C=C/C1CCCCC1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736501491 599247683 /nfs/dbraw/zinc/24/76/83/599247683.db2.gz CTLRRGWJCQFJER-AAWPKVBNSA-N -1 3 353.470 3.913 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)/C=C/C1CCCCC1 ZINC000736478973 599247687 /nfs/dbraw/zinc/24/76/87/599247687.db2.gz HCDJFQYOABEBGZ-JLHYYAGUSA-N -1 3 353.470 3.742 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)/C=C/C1CCCCC1 ZINC000736478973 599247689 /nfs/dbraw/zinc/24/76/89/599247689.db2.gz HCDJFQYOABEBGZ-JLHYYAGUSA-N -1 3 353.470 3.742 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)c1cc2cc(F)ccc2o1 ZINC000735661536 599247957 /nfs/dbraw/zinc/24/79/57/599247957.db2.gz MWLXKKACHFEOHU-UHFFFAOYSA-N -1 3 368.372 3.561 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)c1cc2cc(F)ccc2o1 ZINC000735661536 599247959 /nfs/dbraw/zinc/24/79/59/599247959.db2.gz MWLXKKACHFEOHU-UHFFFAOYSA-N -1 3 368.372 3.561 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)N1CC[C@H]1c1ccc(Cl)cc1 ZINC000737795996 599252001 /nfs/dbraw/zinc/25/20/01/599252001.db2.gz DMTROVUQWFROND-JEJOPICUSA-N -1 3 365.824 3.507 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)N1CC[C@H]1c1ccc(Cl)cc1 ZINC000737795996 599252002 /nfs/dbraw/zinc/25/20/02/599252002.db2.gz DMTROVUQWFROND-JEJOPICUSA-N -1 3 365.824 3.507 20 0 FHADHM Cc1c(NC(=O)N[C@@H]2CCSc3ccccc32)cccc1-c1nnn[n-]1 ZINC000822092728 607281585 /nfs/dbraw/zinc/28/15/85/607281585.db2.gz YTIDMLSLRTTYMO-OAHLLOKOSA-N -1 3 366.450 3.534 20 0 FHADHM Cc1c(NC(=O)N[C@@H]2CCSc3ccccc32)cccc1-c1nn[n-]n1 ZINC000822092728 607281586 /nfs/dbraw/zinc/28/15/86/607281586.db2.gz YTIDMLSLRTTYMO-OAHLLOKOSA-N -1 3 366.450 3.534 20 0 FHADHM Cc1ccccc1CN(C(=O)Nc1cccc(-c2nnn[n-]2)c1C)C1CC1 ZINC000822355990 607287915 /nfs/dbraw/zinc/28/79/15/607287915.db2.gz FQOAIJDGWRNSTB-UHFFFAOYSA-N -1 3 362.437 3.680 20 0 FHADHM Cc1ccccc1CN(C(=O)Nc1cccc(-c2nn[n-]n2)c1C)C1CC1 ZINC000822355990 607287916 /nfs/dbraw/zinc/28/79/16/607287916.db2.gz FQOAIJDGWRNSTB-UHFFFAOYSA-N -1 3 362.437 3.680 20 0 FHADHM Cc1c(NC(=O)N2CCC(c3ccccc3)CC2)cccc1-c1nnn[n-]1 ZINC000822084666 607284820 /nfs/dbraw/zinc/28/48/20/607284820.db2.gz NIBKWNKCXYJRKT-UHFFFAOYSA-N -1 3 362.437 3.587 20 0 FHADHM Cc1c(NC(=O)N2CCC(c3ccccc3)CC2)cccc1-c1nn[n-]n1 ZINC000822084666 607284821 /nfs/dbraw/zinc/28/48/21/607284821.db2.gz NIBKWNKCXYJRKT-UHFFFAOYSA-N -1 3 362.437 3.587 20 0 FHADHM Cc1c(NC(=O)N(C)[C@H]2CCCc3ccccc32)cccc1-c1nnn[n-]1 ZINC000822076804 607285480 /nfs/dbraw/zinc/28/54/80/607285480.db2.gz RZBTWOCYTHFCOM-SFHVURJKSA-N -1 3 362.437 3.716 20 0 FHADHM Cc1c(NC(=O)N(C)[C@H]2CCCc3ccccc32)cccc1-c1nn[n-]n1 ZINC000822076804 607285481 /nfs/dbraw/zinc/28/54/81/607285481.db2.gz RZBTWOCYTHFCOM-SFHVURJKSA-N -1 3 362.437 3.716 20 0 FHADHM CC[C@@H](C)C[C@@H](C)NC(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(C)C ZINC000820869452 599264501 /nfs/dbraw/zinc/26/45/01/599264501.db2.gz HAZRWBQTEKLUIS-CHWSQXEVSA-N -1 3 360.462 3.600 20 0 FHADHM CC[C@@H](C)C[C@@H](C)NC(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(C)C ZINC000820869452 599264504 /nfs/dbraw/zinc/26/45/04/599264504.db2.gz HAZRWBQTEKLUIS-CHWSQXEVSA-N -1 3 360.462 3.600 20 0 FHADHM CCSc1ccc(CC(=O)O[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000825675166 607778996 /nfs/dbraw/zinc/77/89/96/607778996.db2.gz YRACNHGFLVSJCE-CYBMUJFWSA-N -1 3 368.462 3.826 20 0 FHADHM CCSc1ccc(CC(=O)O[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000825675166 607778997 /nfs/dbraw/zinc/77/89/97/607778997.db2.gz YRACNHGFLVSJCE-CYBMUJFWSA-N -1 3 368.462 3.826 20 0 FHADHM Clc1cc(NCc2cccc(-c3nnn[n-]3)c2)ccc1N1CCCC1 ZINC000822567937 607315248 /nfs/dbraw/zinc/31/52/48/607315248.db2.gz JELBPSPXDOWSKU-UHFFFAOYSA-N -1 3 354.845 3.732 20 0 FHADHM Clc1cc(NCc2cccc(-c3nn[n-]n3)c2)ccc1N1CCCC1 ZINC000822567937 607315249 /nfs/dbraw/zinc/31/52/49/607315249.db2.gz JELBPSPXDOWSKU-UHFFFAOYSA-N -1 3 354.845 3.732 20 0 FHADHM CCc1ccccc1C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCC2 ZINC000821492470 607304004 /nfs/dbraw/zinc/30/40/04/607304004.db2.gz NTXSCZMWZMFNRH-UHFFFAOYSA-N -1 3 353.451 3.622 20 0 FHADHM CCc1ccccc1C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCC2 ZINC000821492470 607304005 /nfs/dbraw/zinc/30/40/05/607304005.db2.gz NTXSCZMWZMFNRH-UHFFFAOYSA-N -1 3 353.451 3.622 20 0 FHADHM Cc1ccc(NCc2ccc(-c3nnn[n-]3)s2)cc1NC(=O)C(C)(C)C ZINC000822259324 607317138 /nfs/dbraw/zinc/31/71/38/607317138.db2.gz UMSIAGYKCJCMHF-UHFFFAOYSA-N -1 3 370.482 3.833 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cc2ccccc2o1 ZINC000736488950 599278195 /nfs/dbraw/zinc/27/81/95/599278195.db2.gz VQOBCSLKZQCQDL-UHFFFAOYSA-N -1 3 362.393 3.687 20 0 FHADHM O=C(NCCC1CC1)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000823182229 599282795 /nfs/dbraw/zinc/28/27/95/599282795.db2.gz JWLMLYFZRUDBMT-UHFFFAOYSA-N -1 3 364.409 3.581 20 0 FHADHM O=C(NCCC1CC1)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000823182229 599282798 /nfs/dbraw/zinc/28/27/98/599282798.db2.gz JWLMLYFZRUDBMT-UHFFFAOYSA-N -1 3 364.409 3.581 20 0 FHADHM C[C@@H](Sc1nnc(-c2ccccc2)o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736194029 599287460 /nfs/dbraw/zinc/28/74/60/599287460.db2.gz WTZDFRSHOPTFTO-LLVKDONJSA-N -1 3 350.407 3.770 20 0 FHADHM C[C@@H](Sc1nnc(-c2ccccc2)o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736194029 599287462 /nfs/dbraw/zinc/28/74/62/599287462.db2.gz WTZDFRSHOPTFTO-LLVKDONJSA-N -1 3 350.407 3.770 20 0 FHADHM C[C@H](Sc1nnc(-c2ccccc2)o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736194030 599287785 /nfs/dbraw/zinc/28/77/85/599287785.db2.gz WTZDFRSHOPTFTO-NSHDSACASA-N -1 3 350.407 3.770 20 0 FHADHM C[C@H](Sc1nnc(-c2ccccc2)o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736194030 599287787 /nfs/dbraw/zinc/28/77/87/599287787.db2.gz WTZDFRSHOPTFTO-NSHDSACASA-N -1 3 350.407 3.770 20 0 FHADHM COC(=O)c1ccc(CS[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000736947903 599290509 /nfs/dbraw/zinc/29/05/09/599290509.db2.gz NSOIXIGGRVMGMO-LBPRGKRZSA-N -1 3 354.435 3.648 20 0 FHADHM COC(=O)c1ccc(CS[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000736947903 599290511 /nfs/dbraw/zinc/29/05/11/599290511.db2.gz NSOIXIGGRVMGMO-LBPRGKRZSA-N -1 3 354.435 3.648 20 0 FHADHM Cc1ccc(C(=O)CSc2ccc(-c3nnn[n-]3)cc2Cl)s1 ZINC000826281348 607843912 /nfs/dbraw/zinc/84/39/12/607843912.db2.gz NSCYJAGPZKGBNE-UHFFFAOYSA-N -1 3 350.856 3.865 20 0 FHADHM Cc1ccc(C(=O)CSc2ccc(-c3nn[n-]n3)cc2Cl)s1 ZINC000826281348 607843913 /nfs/dbraw/zinc/84/39/13/607843913.db2.gz NSCYJAGPZKGBNE-UHFFFAOYSA-N -1 3 350.856 3.865 20 0 FHADHM CCC(CC)n1ccc(CNc2cc(-c3nnn[n-]3)ccc2OC(C)C)n1 ZINC000820898118 607332115 /nfs/dbraw/zinc/33/21/15/607332115.db2.gz UJPAAZGVVACEFI-UHFFFAOYSA-N -1 3 369.473 3.824 20 0 FHADHM CCC(CC)n1ccc(CNc2cc(-c3nn[n-]n3)ccc2OC(C)C)n1 ZINC000820898118 607332116 /nfs/dbraw/zinc/33/21/16/607332116.db2.gz UJPAAZGVVACEFI-UHFFFAOYSA-N -1 3 369.473 3.824 20 0 FHADHM Cc1ccc(C(=O)Nc2cccc(Oc3ccc(-c4nnn[n-]4)cc3)c2)cn1 ZINC000737314262 598232477 /nfs/dbraw/zinc/23/24/77/598232477.db2.gz AWJLAYIQVKLUER-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccc(C(=O)Nc2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)cn1 ZINC000737314262 598232478 /nfs/dbraw/zinc/23/24/78/598232478.db2.gz AWJLAYIQVKLUER-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM COc1cc([C@H](C)Nc2ccc(-c3nn[n-]n3)cc2F)ccc1OC(C)C ZINC000737040088 598238539 /nfs/dbraw/zinc/23/85/39/598238539.db2.gz DKLDHKQFNWOIRI-LBPRGKRZSA-N -1 3 371.416 3.975 20 0 FHADHM Fc1cccc(Nc2cccc(OCc3cccnc3)c2)c1-c1nnn[n-]1 ZINC000737665681 598240107 /nfs/dbraw/zinc/24/01/07/598240107.db2.gz UGLWALLUEJPJKJ-UHFFFAOYSA-N -1 3 362.368 3.723 20 0 FHADHM Fc1cccc(Nc2cccc(OCc3cccnc3)c2)c1-c1nn[n-]n1 ZINC000737665681 598240108 /nfs/dbraw/zinc/24/01/08/598240108.db2.gz UGLWALLUEJPJKJ-UHFFFAOYSA-N -1 3 362.368 3.723 20 0 FHADHM CC(C)(C)c1csc(CCNc2ccc(Cl)cc2-c2nnn[n-]2)n1 ZINC000735652604 598244464 /nfs/dbraw/zinc/24/44/64/598244464.db2.gz NREMITSQLLYBSI-UHFFFAOYSA-N -1 3 362.890 3.929 20 0 FHADHM CC(C)(C)c1csc(CCNc2ccc(Cl)cc2-c2nn[n-]n2)n1 ZINC000735652604 598244466 /nfs/dbraw/zinc/24/44/66/598244466.db2.gz NREMITSQLLYBSI-UHFFFAOYSA-N -1 3 362.890 3.929 20 0 FHADHM C[C@@H](CCc1ccco1)Nc1ccc(-c2nn[n-]n2)cc1C(F)(F)F ZINC000735992799 598274662 /nfs/dbraw/zinc/27/46/62/598274662.db2.gz NEJVERWQPSGOLC-JTQLQIEISA-N -1 3 351.332 3.912 20 0 FHADHM C[C@H](c1ccccc1)N(C)C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000736203376 598276163 /nfs/dbraw/zinc/27/61/63/598276163.db2.gz MXEPYOSXVNGQFH-CYBMUJFWSA-N -1 3 367.457 3.648 20 0 FHADHM C[C@H](c1ccccc1)N(C)C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000736203376 598276164 /nfs/dbraw/zinc/27/61/64/598276164.db2.gz MXEPYOSXVNGQFH-CYBMUJFWSA-N -1 3 367.457 3.648 20 0 FHADHM CCCc1sc(C(=O)N(C)c2ccc(-c3nnn[n-]3)cc2F)cc1CC ZINC000736501134 598281341 /nfs/dbraw/zinc/28/13/41/598281341.db2.gz YOSBHVPSKNQKOJ-UHFFFAOYSA-N -1 3 373.457 3.859 20 0 FHADHM CCCc1sc(C(=O)N(C)c2ccc(-c3nn[n-]n3)cc2F)cc1CC ZINC000736501134 598281342 /nfs/dbraw/zinc/28/13/42/598281342.db2.gz YOSBHVPSKNQKOJ-UHFFFAOYSA-N -1 3 373.457 3.859 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1CNc1ccc(C(F)(F)F)c(Cl)n1 ZINC000737640740 598310940 /nfs/dbraw/zinc/31/09/40/598310940.db2.gz OHBTYAZFOLDBBA-UHFFFAOYSA-N -1 3 372.713 3.685 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CNc1ccc(C(F)(F)F)c(Cl)n1 ZINC000737640740 598310941 /nfs/dbraw/zinc/31/09/41/598310941.db2.gz OHBTYAZFOLDBBA-UHFFFAOYSA-N -1 3 372.713 3.685 20 0 FHADHM CN(C(=O)c1cccc(Cl)c1Cl)c1ccc(-c2nnn[n-]2)cc1F ZINC000736741657 598311726 /nfs/dbraw/zinc/31/17/26/598311726.db2.gz HPXYZUCFQNVQAX-UHFFFAOYSA-N -1 3 366.183 3.589 20 0 FHADHM CN(C(=O)c1cccc(Cl)c1Cl)c1ccc(-c2nn[n-]n2)cc1F ZINC000736741657 598311728 /nfs/dbraw/zinc/31/17/28/598311728.db2.gz HPXYZUCFQNVQAX-UHFFFAOYSA-N -1 3 366.183 3.589 20 0 FHADHM C[C@@H](SCc1cccc(-c2nnn[n-]2)c1)c1nc(-c2cccs2)no1 ZINC000736189104 598313236 /nfs/dbraw/zinc/31/32/36/598313236.db2.gz ANTJBDMWGDQOOR-SNVBAGLBSA-N -1 3 370.463 3.973 20 0 FHADHM C[C@@H](SCc1cccc(-c2nn[n-]n2)c1)c1nc(-c2cccs2)no1 ZINC000736189104 598313238 /nfs/dbraw/zinc/31/32/38/598313238.db2.gz ANTJBDMWGDQOOR-SNVBAGLBSA-N -1 3 370.463 3.973 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)cc1CSCc1ccn(-c2ccccc2)n1 ZINC000737651132 598315717 /nfs/dbraw/zinc/31/57/17/598315717.db2.gz PWGBEYKOUZBPQZ-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CSCc1ccn(-c2ccccc2)n1 ZINC000737651132 598315720 /nfs/dbraw/zinc/31/57/20/598315720.db2.gz PWGBEYKOUZBPQZ-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM Cc1ccc(NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1C ZINC000737361132 598316155 /nfs/dbraw/zinc/31/61/55/598316155.db2.gz TYXMARNJDSPCIL-UHFFFAOYSA-N -1 3 358.858 3.946 20 0 FHADHM Cc1ccc(NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1C ZINC000737361132 598316157 /nfs/dbraw/zinc/31/61/57/598316157.db2.gz TYXMARNJDSPCIL-UHFFFAOYSA-N -1 3 358.858 3.946 20 0 FHADHM Cc1ccc([C@@H](C)NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1 ZINC000737318517 598320509 /nfs/dbraw/zinc/32/05/09/598320509.db2.gz AZGZLRYKIATZKZ-LLVKDONJSA-N -1 3 372.885 3.876 20 0 FHADHM Cc1ccc([C@@H](C)NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1 ZINC000737318517 598320511 /nfs/dbraw/zinc/32/05/11/598320511.db2.gz AZGZLRYKIATZKZ-LLVKDONJSA-N -1 3 372.885 3.876 20 0 FHADHM Cc1cccc(N(C)C(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c1C ZINC000737395867 598322360 /nfs/dbraw/zinc/32/23/60/598322360.db2.gz ACAPFGMFEXLGGO-UHFFFAOYSA-N -1 3 372.885 3.970 20 0 FHADHM Cc1cccc(N(C)C(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c1C ZINC000737395867 598322362 /nfs/dbraw/zinc/32/23/62/598322362.db2.gz ACAPFGMFEXLGGO-UHFFFAOYSA-N -1 3 372.885 3.970 20 0 FHADHM Cc1ccc(N(C)C(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c(C)c1 ZINC000737346448 598322409 /nfs/dbraw/zinc/32/24/09/598322409.db2.gz FQPBMDNEHGMCCU-UHFFFAOYSA-N -1 3 372.885 3.970 20 0 FHADHM Cc1ccc(N(C)C(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c(C)c1 ZINC000737346448 598322410 /nfs/dbraw/zinc/32/24/10/598322410.db2.gz FQPBMDNEHGMCCU-UHFFFAOYSA-N -1 3 372.885 3.970 20 0 FHADHM C[C@@H](OC(=O)[C@H]1CCCc2sccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488827 607351877 /nfs/dbraw/zinc/35/18/77/607351877.db2.gz VAEARSSHZFZQEI-ABAIWWIYSA-N -1 3 354.435 3.653 20 0 FHADHM C[C@@H](OC(=O)[C@H]1CCCc2sccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488827 607351879 /nfs/dbraw/zinc/35/18/79/607351879.db2.gz VAEARSSHZFZQEI-ABAIWWIYSA-N -1 3 354.435 3.653 20 0 FHADHM Cc1cccc(CC(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCCC3)c1 ZINC000737391619 598364982 /nfs/dbraw/zinc/36/49/82/598364982.db2.gz GQVACSNQNGIGLR-UHFFFAOYSA-N -1 3 367.478 3.687 20 0 FHADHM Cc1cccc(CC(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCCC3)c1 ZINC000737391619 598364983 /nfs/dbraw/zinc/36/49/83/598364983.db2.gz GQVACSNQNGIGLR-UHFFFAOYSA-N -1 3 367.478 3.687 20 0 FHADHM Cc1cccc(CC(=O)Nc2sc3c(c2-c2nnn[n-]2)CC[C@H](C)C3)c1 ZINC000737392139 598365127 /nfs/dbraw/zinc/36/51/27/598365127.db2.gz PAPNRJXWQLZWAF-LBPRGKRZSA-N -1 3 367.478 3.543 20 0 FHADHM Cc1cccc(CC(=O)Nc2sc3c(c2-c2nn[n-]n2)CC[C@H](C)C3)c1 ZINC000737392139 598365128 /nfs/dbraw/zinc/36/51/28/598365128.db2.gz PAPNRJXWQLZWAF-LBPRGKRZSA-N -1 3 367.478 3.543 20 0 FHADHM CC(C)Oc1ccccc1[C@H](C)Nc1ncc(-c2nnn[n-]2)cc1Cl ZINC000735914435 598389962 /nfs/dbraw/zinc/38/99/62/598389962.db2.gz SRENRXGKCUQMDR-NSHDSACASA-N -1 3 358.833 3.875 20 0 FHADHM CC(C)Oc1ccccc1[C@H](C)Nc1ncc(-c2nn[n-]n2)cc1Cl ZINC000735914435 598389963 /nfs/dbraw/zinc/38/99/63/598389963.db2.gz SRENRXGKCUQMDR-NSHDSACASA-N -1 3 358.833 3.875 20 0 FHADHM C[C@@H]1CCc2c(sc(NC(=O)CC3=CCCCC3)c2-c2nnn[n-]2)C1 ZINC000736279737 598393463 /nfs/dbraw/zinc/39/34/63/598393463.db2.gz MCZBLLPPXNIAHD-LLVKDONJSA-N -1 3 357.483 3.882 20 0 FHADHM C[C@@H]1CCc2c(sc(NC(=O)CC3=CCCCC3)c2-c2nn[n-]n2)C1 ZINC000736279737 598393464 /nfs/dbraw/zinc/39/34/64/598393464.db2.gz MCZBLLPPXNIAHD-LLVKDONJSA-N -1 3 357.483 3.882 20 0 FHADHM Cc1ccc(C[C@H]2CCCN(c3ncc(-c4nnn[n-]4)cc3Cl)C2)cc1 ZINC000737334610 598393755 /nfs/dbraw/zinc/39/37/55/598393755.db2.gz JRUWAQMLVYCGJM-OAHLLOKOSA-N -1 3 368.872 3.683 20 0 FHADHM Cc1ccc(C[C@H]2CCCN(c3ncc(-c4nn[n-]n4)cc3Cl)C2)cc1 ZINC000737334610 598393756 /nfs/dbraw/zinc/39/37/56/598393756.db2.gz JRUWAQMLVYCGJM-OAHLLOKOSA-N -1 3 368.872 3.683 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1OCc1cc(Cl)cc2cccnc21 ZINC000737221864 598394889 /nfs/dbraw/zinc/39/48/89/598394889.db2.gz QIRUODKZAKAXRP-UHFFFAOYSA-N -1 3 351.797 3.956 20 0 FHADHM Cc1cc(C)c(NC(=O)[C@H](C)Sc2ccc(-c3nnn[n-]3)cc2)c(C)c1 ZINC000737247650 598414625 /nfs/dbraw/zinc/41/46/25/598414625.db2.gz YUMZNWGAZRVHNW-AWEZNQCLSA-N -1 3 367.478 3.911 20 0 FHADHM Cc1cc(C)c(NC(=O)[C@H](C)Sc2ccc(-c3nn[n-]n3)cc2)c(C)c1 ZINC000737247650 598414627 /nfs/dbraw/zinc/41/46/27/598414627.db2.gz YUMZNWGAZRVHNW-AWEZNQCLSA-N -1 3 367.478 3.911 20 0 FHADHM C[C@@H](NC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccccc1 ZINC000736128075 598417607 /nfs/dbraw/zinc/41/76/07/598417607.db2.gz USBIAIPCYKABQR-SNVBAGLBSA-N -1 3 358.858 3.568 20 0 FHADHM C[C@@H](NC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccccc1 ZINC000736128075 598417608 /nfs/dbraw/zinc/41/76/08/598417608.db2.gz USBIAIPCYKABQR-SNVBAGLBSA-N -1 3 358.858 3.568 20 0 FHADHM O=C(Nc1ccccc1-c1nnn[n-]1)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl ZINC000738190932 598420327 /nfs/dbraw/zinc/42/03/27/598420327.db2.gz FRRCTSXNCDBTLU-OLZOCXBDSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1ccccc1-c1nn[n-]n1)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl ZINC000738190932 598420328 /nfs/dbraw/zinc/42/03/28/598420328.db2.gz FRRCTSXNCDBTLU-OLZOCXBDSA-N -1 3 374.231 3.916 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)NCC1CCC(C)CC1 ZINC000736237010 598429797 /nfs/dbraw/zinc/42/97/97/598429797.db2.gz NGYDNHDAMCAAIL-UHFFFAOYSA-N -1 3 370.501 3.613 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)NCC1CCC(C)CC1 ZINC000736237010 598429798 /nfs/dbraw/zinc/42/97/98/598429798.db2.gz NGYDNHDAMCAAIL-UHFFFAOYSA-N -1 3 370.501 3.613 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)NC[C@@H]1CCC[C@@H](C)C1 ZINC000736247312 598429903 /nfs/dbraw/zinc/42/99/03/598429903.db2.gz BKMCGXBNTLHDIG-NVXWUHKLSA-N -1 3 370.501 3.613 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)NC[C@@H]1CCC[C@@H](C)C1 ZINC000736247312 598429905 /nfs/dbraw/zinc/42/99/05/598429905.db2.gz BKMCGXBNTLHDIG-NVXWUHKLSA-N -1 3 370.501 3.613 20 0 FHADHM Cc1cc(C)cc([C@@H](C)NC(=O)N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737253961 598430340 /nfs/dbraw/zinc/43/03/40/598430340.db2.gz VKOQRFVRHLUPPZ-HUUCEWRRSA-N -1 3 364.453 3.605 20 0 FHADHM Cc1cc(C)cc([C@@H](C)NC(=O)N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737253961 598430342 /nfs/dbraw/zinc/43/03/42/598430342.db2.gz VKOQRFVRHLUPPZ-HUUCEWRRSA-N -1 3 364.453 3.605 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)[C@H]1C[C@@H]1c1cccc2ccccc21 ZINC000107583949 598435124 /nfs/dbraw/zinc/43/51/24/598435124.db2.gz JRIDAOCVIGCARV-MOPGFXCFSA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)[C@H]1C[C@@H]1c1cccc2ccccc21 ZINC000107583949 598435126 /nfs/dbraw/zinc/43/51/26/598435126.db2.gz JRIDAOCVIGCARV-MOPGFXCFSA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Oc1ccc(-c2nnn[n-]2)cc1)[C@@H]1C[C@H]1c1cccc2ccccc21 ZINC000738251893 598436591 /nfs/dbraw/zinc/43/65/91/598436591.db2.gz STUHRMLDURRKSZ-RBUKOAKNSA-N -1 3 356.385 3.729 20 0 FHADHM O=C(Oc1ccc(-c2nn[n-]n2)cc1)[C@@H]1C[C@H]1c1cccc2ccccc21 ZINC000738251893 598436592 /nfs/dbraw/zinc/43/65/92/598436592.db2.gz STUHRMLDURRKSZ-RBUKOAKNSA-N -1 3 356.385 3.729 20 0 FHADHM CC(C)(CCc1ccccc1)NC(=S)Nc1ccccc1-c1nnn[n-]1 ZINC000735665128 598440454 /nfs/dbraw/zinc/44/04/54/598440454.db2.gz DAVGHIDXIQAUID-UHFFFAOYSA-N -1 3 366.494 3.565 20 0 FHADHM CC(C)(CCc1ccccc1)NC(=S)Nc1ccccc1-c1nn[n-]n1 ZINC000735665128 598440455 /nfs/dbraw/zinc/44/04/55/598440455.db2.gz DAVGHIDXIQAUID-UHFFFAOYSA-N -1 3 366.494 3.565 20 0 FHADHM COc1ccccc1C(C)=CC(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000737143766 598441608 /nfs/dbraw/zinc/44/16/08/598441608.db2.gz ZIOZBWGZJFUBHD-LUAWRHEFSA-N -1 3 369.812 3.571 20 0 FHADHM COc1ccccc1C(C)=CC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000737143766 598441609 /nfs/dbraw/zinc/44/16/09/598441609.db2.gz ZIOZBWGZJFUBHD-LUAWRHEFSA-N -1 3 369.812 3.571 20 0 FHADHM CC(=CC(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccccc1Cl ZINC000735448850 598442134 /nfs/dbraw/zinc/44/21/34/598442134.db2.gz LOGPGALMLKHAJG-XZHRJIJLSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=CC(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccccc1Cl ZINC000735448850 598442135 /nfs/dbraw/zinc/44/21/35/598442135.db2.gz LOGPGALMLKHAJG-XZHRJIJLSA-N -1 3 367.840 3.801 20 0 FHADHM C[C@@H]1C[C@@H](CC(=O)N(C)Cc2cccc(-c3nnn[n-]3)c2)CC(C)(C)C1 ZINC000736227582 598442186 /nfs/dbraw/zinc/44/21/86/598442186.db2.gz LNKATRZDDZPTAD-ZBFHGGJFSA-N -1 3 355.486 3.678 20 0 FHADHM C[C@@H]1C[C@@H](CC(=O)N(C)Cc2cccc(-c3nn[n-]n3)c2)CC(C)(C)C1 ZINC000736227582 598442188 /nfs/dbraw/zinc/44/21/88/598442188.db2.gz LNKATRZDDZPTAD-ZBFHGGJFSA-N -1 3 355.486 3.678 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)C=C(C)c2ccccc2OC)s1 ZINC000736679714 598444029 /nfs/dbraw/zinc/44/40/29/598444029.db2.gz ZVGITGURGIKMMS-LUAWRHEFSA-N -1 3 369.450 3.541 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)C=C(C)c2ccccc2OC)s1 ZINC000736679714 598444031 /nfs/dbraw/zinc/44/40/31/598444031.db2.gz ZVGITGURGIKMMS-LUAWRHEFSA-N -1 3 369.450 3.541 20 0 FHADHM Cc1ccc(NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)cc1C ZINC000737357343 598475250 /nfs/dbraw/zinc/47/52/50/598475250.db2.gz PJBBSVLSOIWBGE-UHFFFAOYSA-N -1 3 362.437 3.680 20 0 FHADHM Cc1ccc(NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)cc1C ZINC000737357343 598475252 /nfs/dbraw/zinc/47/52/52/598475252.db2.gz PJBBSVLSOIWBGE-UHFFFAOYSA-N -1 3 362.437 3.680 20 0 FHADHM O=C(OCc1cccc(-c2nnn[n-]2)c1)[C@H]1C[C@H]1c1cccc2ccccc21 ZINC000738232601 598476138 /nfs/dbraw/zinc/47/61/38/598476138.db2.gz MNMAQYOQWSWQRJ-PMACEKPBSA-N -1 3 370.412 3.867 20 0 FHADHM O=C(OCc1cccc(-c2nn[n-]n2)c1)[C@H]1C[C@H]1c1cccc2ccccc21 ZINC000738232601 598476139 /nfs/dbraw/zinc/47/61/39/598476139.db2.gz MNMAQYOQWSWQRJ-PMACEKPBSA-N -1 3 370.412 3.867 20 0 FHADHM O=C(NC1CCCCCCC1)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000738022484 598477041 /nfs/dbraw/zinc/47/70/41/598477041.db2.gz DKQXLMBRSXHDTE-UHFFFAOYSA-N -1 3 368.485 3.654 20 0 FHADHM O=C(NC1CCCCCCC1)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000738022484 598477043 /nfs/dbraw/zinc/47/70/43/598477043.db2.gz DKQXLMBRSXHDTE-UHFFFAOYSA-N -1 3 368.485 3.654 20 0 FHADHM CCOc1ccc(CCC(=O)O[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736643350 598483726 /nfs/dbraw/zinc/48/37/26/598483726.db2.gz IAPUTFKTNOCKLA-CQSZACIVSA-N -1 3 366.421 3.502 20 0 FHADHM CCOc1ccc(CCC(=O)O[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736643350 598483728 /nfs/dbraw/zinc/48/37/28/598483728.db2.gz IAPUTFKTNOCKLA-CQSZACIVSA-N -1 3 366.421 3.502 20 0 FHADHM C[C@@H](OC(=O)CCc1ccc(Cl)s1)c1cccc(-c2nnn[n-]2)c1 ZINC000736149973 598484231 /nfs/dbraw/zinc/48/42/31/598484231.db2.gz LUHMLDGGAOYBPM-SNVBAGLBSA-N -1 3 362.842 3.819 20 0 FHADHM C[C@@H](OC(=O)CCc1ccc(Cl)s1)c1cccc(-c2nn[n-]n2)c1 ZINC000736149973 598484233 /nfs/dbraw/zinc/48/42/33/598484233.db2.gz LUHMLDGGAOYBPM-SNVBAGLBSA-N -1 3 362.842 3.819 20 0 FHADHM C[C@@H](SCc1ccccc1)C(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000736190049 598486689 /nfs/dbraw/zinc/48/66/89/598486689.db2.gz FHDXNVFZPPDLBQ-ZIAGYGMSSA-N -1 3 368.462 3.793 20 0 FHADHM C[C@@H](SCc1ccccc1)C(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000736190049 598486691 /nfs/dbraw/zinc/48/66/91/598486691.db2.gz FHDXNVFZPPDLBQ-ZIAGYGMSSA-N -1 3 368.462 3.793 20 0 FHADHM Cc1cc(Cl)ccc1OCC(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000737262660 598489687 /nfs/dbraw/zinc/48/96/87/598489687.db2.gz FJMOYFDNWWHWBF-LBPRGKRZSA-N -1 3 372.812 3.512 20 0 FHADHM Cc1cc(Cl)ccc1OCC(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000737262660 598489688 /nfs/dbraw/zinc/48/96/88/598489688.db2.gz FJMOYFDNWWHWBF-LBPRGKRZSA-N -1 3 372.812 3.512 20 0 FHADHM Cc1cccc2cc(C(=O)Nc3cc(-c4nnn[n-]4)cn3C(C)(C)C)oc21 ZINC000737411234 598490506 /nfs/dbraw/zinc/49/05/06/598490506.db2.gz XDUGDKBCMXVPCV-UHFFFAOYSA-N -1 3 364.409 3.730 20 0 FHADHM Cc1cccc2cc(C(=O)Nc3cc(-c4nn[n-]n4)cn3C(C)(C)C)oc21 ZINC000737411234 598490508 /nfs/dbraw/zinc/49/05/08/598490508.db2.gz XDUGDKBCMXVPCV-UHFFFAOYSA-N -1 3 364.409 3.730 20 0 FHADHM Cc1ccc(Cl)c(OCC(=O)O[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000737341939 598492306 /nfs/dbraw/zinc/49/23/06/598492306.db2.gz BSSMTPFYPNQHQT-LBPRGKRZSA-N -1 3 372.812 3.512 20 0 FHADHM Cc1ccc(Cl)c(OCC(=O)O[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000737341939 598492307 /nfs/dbraw/zinc/49/23/07/598492307.db2.gz BSSMTPFYPNQHQT-LBPRGKRZSA-N -1 3 372.812 3.512 20 0 FHADHM Cc1ccc(OCCCC(=O)O[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000737364896 598492396 /nfs/dbraw/zinc/49/23/96/598492396.db2.gz HFDONEACPNBBOT-HNNXBMFYSA-N -1 3 366.421 3.639 20 0 FHADHM Cc1ccc(OCCCC(=O)O[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000737364896 598492397 /nfs/dbraw/zinc/49/23/97/598492397.db2.gz HFDONEACPNBBOT-HNNXBMFYSA-N -1 3 366.421 3.639 20 0 FHADHM Cc1ncccc1C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCCCC2 ZINC000737503104 598493465 /nfs/dbraw/zinc/49/34/65/598493465.db2.gz SGLYILCRXHAWQQ-UHFFFAOYSA-N -1 3 368.466 3.543 20 0 FHADHM Cc1ncccc1C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCCCC2 ZINC000737503104 598493467 /nfs/dbraw/zinc/49/34/67/598493467.db2.gz SGLYILCRXHAWQQ-UHFFFAOYSA-N -1 3 368.466 3.543 20 0 FHADHM COc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)C[C@@H](C)CC(C)C ZINC000737025793 598494783 /nfs/dbraw/zinc/49/47/83/598494783.db2.gz NELZAGRVYOSQSM-JTQLQIEISA-N -1 3 352.822 3.506 20 0 FHADHM COc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)C[C@@H](C)CC(C)C ZINC000737025793 598494785 /nfs/dbraw/zinc/49/47/85/598494785.db2.gz NELZAGRVYOSQSM-JTQLQIEISA-N -1 3 352.822 3.506 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H](CC)c2c(C)noc2C)c1-c1nnn[n-]1 ZINC000736669332 598515191 /nfs/dbraw/zinc/51/51/91/598515191.db2.gz FCUPKFUCDOXLBX-LBPRGKRZSA-N -1 3 374.470 3.536 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H](CC)c2c(C)noc2C)c1-c1nn[n-]n1 ZINC000736669332 598515193 /nfs/dbraw/zinc/51/51/93/598515193.db2.gz FCUPKFUCDOXLBX-LBPRGKRZSA-N -1 3 374.470 3.536 20 0 FHADHM C[C@H](OC(=O)c1csc(-c2ccoc2)n1)c1cccc(-c2nnn[n-]2)c1 ZINC000736161714 598515540 /nfs/dbraw/zinc/51/55/40/598515540.db2.gz FDOUGFNOBOQJAC-JTQLQIEISA-N -1 3 367.390 3.501 20 0 FHADHM C[C@H](OC(=O)c1csc(-c2ccoc2)n1)c1cccc(-c2nn[n-]n2)c1 ZINC000736161714 598515543 /nfs/dbraw/zinc/51/55/43/598515543.db2.gz FDOUGFNOBOQJAC-JTQLQIEISA-N -1 3 367.390 3.501 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccc(C(F)F)cc2)c1-c1nnn[n-]1 ZINC000736675107 598515781 /nfs/dbraw/zinc/51/57/81/598515781.db2.gz FEWLALZGPPXNME-UHFFFAOYSA-N -1 3 363.393 3.989 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccc(C(F)F)cc2)c1-c1nn[n-]n1 ZINC000736675107 598515783 /nfs/dbraw/zinc/51/57/83/598515783.db2.gz FEWLALZGPPXNME-UHFFFAOYSA-N -1 3 363.393 3.989 20 0 FHADHM CCc1c(C)sc(NC(=O)C2(c3ccccc3)CCC2)c1-c1nnn[n-]1 ZINC000736669452 598516343 /nfs/dbraw/zinc/51/63/43/598516343.db2.gz HYHRRAWFYKIDIV-UHFFFAOYSA-N -1 3 367.478 3.859 20 0 FHADHM CCc1c(C)sc(NC(=O)C2(c3ccccc3)CCC2)c1-c1nn[n-]n1 ZINC000736669452 598516345 /nfs/dbraw/zinc/51/63/45/598516345.db2.gz HYHRRAWFYKIDIV-UHFFFAOYSA-N -1 3 367.478 3.859 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccc(Cl)cc2F)c1-c1nnn[n-]1 ZINC000736676283 598517517 /nfs/dbraw/zinc/51/75/17/598517517.db2.gz QMHQLDYRYOBDCZ-UHFFFAOYSA-N -1 3 365.821 3.844 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccc(Cl)cc2F)c1-c1nn[n-]n1 ZINC000736676283 598517519 /nfs/dbraw/zinc/51/75/19/598517519.db2.gz QMHQLDYRYOBDCZ-UHFFFAOYSA-N -1 3 365.821 3.844 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H](C)Oc2ccc(C)cc2)c1-c1nnn[n-]1 ZINC000736671309 598518642 /nfs/dbraw/zinc/51/86/42/598518642.db2.gz WRFVMYBCJJTGJI-LLVKDONJSA-N -1 3 371.466 3.513 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H](C)Oc2ccc(C)cc2)c1-c1nn[n-]n1 ZINC000736671309 598518643 /nfs/dbraw/zinc/51/86/43/598518643.db2.gz WRFVMYBCJJTGJI-LLVKDONJSA-N -1 3 371.466 3.513 20 0 FHADHM Cc1nc(-c2ccccc2)c(C(=O)Nc2cccc(-c3nnn[n-]3)c2)s1 ZINC000512161470 598533653 /nfs/dbraw/zinc/53/36/53/598533653.db2.gz GGWIPXIVOLQMTO-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1nc(-c2ccccc2)c(C(=O)Nc2cccc(-c3nn[n-]n3)c2)s1 ZINC000512161470 598533655 /nfs/dbraw/zinc/53/36/55/598533655.db2.gz GGWIPXIVOLQMTO-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM O=C(Oc1ccc(-c2nnn[n-]2)cc1)[C@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000738250176 598533896 /nfs/dbraw/zinc/53/38/96/598533896.db2.gz DNJRJQYIDFXUSM-OALUTQOASA-N -1 3 356.385 3.729 20 0 FHADHM O=C(Oc1ccc(-c2nn[n-]n2)cc1)[C@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000738250176 598533898 /nfs/dbraw/zinc/53/38/98/598533898.db2.gz DNJRJQYIDFXUSM-OALUTQOASA-N -1 3 356.385 3.729 20 0 FHADHM C[C@@H](Nc1nc(C(F)F)nc2ccccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000736138708 598536274 /nfs/dbraw/zinc/53/62/74/598536274.db2.gz QWCVBKVAWNMYGW-SNVBAGLBSA-N -1 3 367.363 3.921 20 0 FHADHM C[C@@H](Nc1nc(C(F)F)nc2ccccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000736138708 598536276 /nfs/dbraw/zinc/53/62/76/598536276.db2.gz QWCVBKVAWNMYGW-SNVBAGLBSA-N -1 3 367.363 3.921 20 0 FHADHM CCN(C(=O)Cc1cc(C)ccc1C)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736504172 598540596 /nfs/dbraw/zinc/54/05/96/598540596.db2.gz ASWSLZGBIYQSNX-MRXNPFEDSA-N -1 3 363.465 3.636 20 0 FHADHM CCN(C(=O)Cc1cc(C)ccc1C)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736504172 598540597 /nfs/dbraw/zinc/54/05/97/598540597.db2.gz ASWSLZGBIYQSNX-MRXNPFEDSA-N -1 3 363.465 3.636 20 0 FHADHM CC(C)CN(C(=O)[C@@H](C)c1ccccc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000735818619 598552902 /nfs/dbraw/zinc/55/29/02/598552902.db2.gz OTLBUTXFSQKNEO-AWEZNQCLSA-N -1 3 367.428 3.799 20 0 FHADHM CC(C)CN(C(=O)[C@@H](C)c1ccccc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000735818619 598552903 /nfs/dbraw/zinc/55/29/03/598552903.db2.gz OTLBUTXFSQKNEO-AWEZNQCLSA-N -1 3 367.428 3.799 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H](C)c2ccccc2F)c1-c1nnn[n-]1 ZINC000736669447 598553490 /nfs/dbraw/zinc/55/34/90/598553490.db2.gz HXLDZPDUTRIHAA-VIFPVBQESA-N -1 3 359.430 3.680 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H](C)c2ccccc2F)c1-c1nn[n-]n1 ZINC000736669447 598553492 /nfs/dbraw/zinc/55/34/92/598553492.db2.gz HXLDZPDUTRIHAA-VIFPVBQESA-N -1 3 359.430 3.680 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(Oc3cccc(-c4nnn[n-]4)c3)cc2)o1 ZINC000737316562 598555410 /nfs/dbraw/zinc/55/54/10/598555410.db2.gz YTVZOXAMWLUBKD-UHFFFAOYSA-N -1 3 361.361 3.813 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(Oc3cccc(-c4nn[n-]n4)c3)cc2)o1 ZINC000737316562 598555411 /nfs/dbraw/zinc/55/54/11/598555411.db2.gz YTVZOXAMWLUBKD-UHFFFAOYSA-N -1 3 361.361 3.813 20 0 FHADHM Cc1noc([C@@H](C)Nc2ccc(Oc3cccc(-c4nnn[n-]4)c3)cc2)n1 ZINC000737538819 598561092 /nfs/dbraw/zinc/56/10/92/598561092.db2.gz PTWXTWDYHFJNNO-LLVKDONJSA-N -1 3 363.381 3.524 20 0 FHADHM Cc1noc([C@@H](C)Nc2ccc(Oc3cccc(-c4nn[n-]n4)c3)cc2)n1 ZINC000737538819 598561094 /nfs/dbraw/zinc/56/10/94/598561094.db2.gz PTWXTWDYHFJNNO-LLVKDONJSA-N -1 3 363.381 3.524 20 0 FHADHM CC(C)CN(C)C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000735828006 598564327 /nfs/dbraw/zinc/56/43/27/598564327.db2.gz XMDPGJKHDXSMSI-UHFFFAOYSA-N -1 3 366.425 3.779 20 0 FHADHM CC(C)CN(C)C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000735828006 598564328 /nfs/dbraw/zinc/56/43/28/598564328.db2.gz XMDPGJKHDXSMSI-UHFFFAOYSA-N -1 3 366.425 3.779 20 0 FHADHM COCc1ccc(CNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)cc1 ZINC000737018683 598572825 /nfs/dbraw/zinc/57/28/25/598572825.db2.gz ZSLCXZFHPMQMQM-UHFFFAOYSA-N -1 3 363.343 3.644 20 0 FHADHM COCc1ccc(CNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)cc1 ZINC000737018683 598572826 /nfs/dbraw/zinc/57/28/26/598572826.db2.gz ZSLCXZFHPMQMQM-UHFFFAOYSA-N -1 3 363.343 3.644 20 0 FHADHM COc1cc(CNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)ccc1C ZINC000737048377 598576537 /nfs/dbraw/zinc/57/65/37/598576537.db2.gz ZMXAOTKHNUEHBF-UHFFFAOYSA-N -1 3 363.343 3.815 20 0 FHADHM COc1cc(CNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)ccc1C ZINC000737048377 598576539 /nfs/dbraw/zinc/57/65/39/598576539.db2.gz ZMXAOTKHNUEHBF-UHFFFAOYSA-N -1 3 363.343 3.815 20 0 FHADHM CCc1nc(CCNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)cs1 ZINC000736700131 598578882 /nfs/dbraw/zinc/57/88/82/598578882.db2.gz QOVNTDPDGSUYFF-UHFFFAOYSA-N -1 3 368.388 3.559 20 0 FHADHM CCc1nc(CCNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)cs1 ZINC000736700131 598578884 /nfs/dbraw/zinc/57/88/84/598578884.db2.gz QOVNTDPDGSUYFF-UHFFFAOYSA-N -1 3 368.388 3.559 20 0 FHADHM CC(C)c1cccc(O[C@@H](C)C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)c1 ZINC000736183462 598584478 /nfs/dbraw/zinc/58/44/78/598584478.db2.gz RVJLNHZWLNYGGP-LBPRGKRZSA-N -1 3 369.400 3.535 20 0 FHADHM CC(C)c1cccc(O[C@@H](C)C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)c1 ZINC000736183462 598584479 /nfs/dbraw/zinc/58/44/79/598584479.db2.gz RVJLNHZWLNYGGP-LBPRGKRZSA-N -1 3 369.400 3.535 20 0 FHADHM CC(C)c1ccc(CCC(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)cc1 ZINC000735924781 598584612 /nfs/dbraw/zinc/58/46/12/598584612.db2.gz UQKVLEVMBMTYOE-UHFFFAOYSA-N -1 3 353.401 3.701 20 0 FHADHM CC(C)c1ccc(CCC(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)cc1 ZINC000735924781 598584615 /nfs/dbraw/zinc/58/46/15/598584615.db2.gz UQKVLEVMBMTYOE-UHFFFAOYSA-N -1 3 353.401 3.701 20 0 FHADHM CC(C)(C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccc(Cl)cc1 ZINC000735580391 598584642 /nfs/dbraw/zinc/58/46/42/598584642.db2.gz FCLJOKVCJFUJIJ-UHFFFAOYSA-N -1 3 359.792 3.576 20 0 FHADHM CC(C)(C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccc(Cl)cc1 ZINC000735580391 598584644 /nfs/dbraw/zinc/58/46/44/598584644.db2.gz FCLJOKVCJFUJIJ-UHFFFAOYSA-N -1 3 359.792 3.576 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccccc1Cc1ccccc1 ZINC000738167195 598592728 /nfs/dbraw/zinc/59/27/28/598592728.db2.gz OGTHLHPFZKWBJW-UHFFFAOYSA-N -1 3 373.391 3.849 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccccc1Cc1ccccc1 ZINC000738167195 598592730 /nfs/dbraw/zinc/59/27/30/598592730.db2.gz OGTHLHPFZKWBJW-UHFFFAOYSA-N -1 3 373.391 3.849 20 0 FHADHM CC(C)CC(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)c(F)c1 ZINC000735757154 598593260 /nfs/dbraw/zinc/59/32/60/598593260.db2.gz UFEFTPUCMYBPSZ-UHFFFAOYSA-N -1 3 369.400 3.569 20 0 FHADHM CC(C)CC(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)c(F)c1 ZINC000735757154 598593262 /nfs/dbraw/zinc/59/32/62/598593262.db2.gz UFEFTPUCMYBPSZ-UHFFFAOYSA-N -1 3 369.400 3.569 20 0 FHADHM CCC[C@@H](NC(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1)C1CCCCC1 ZINC000736431425 598607452 /nfs/dbraw/zinc/60/74/52/598607452.db2.gz FJBFMFRDXYLCQB-GOSISDBHSA-N -1 3 370.501 3.757 20 0 FHADHM CCC[C@@H](NC(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1)C1CCCCC1 ZINC000736431425 598607453 /nfs/dbraw/zinc/60/74/53/598607453.db2.gz FJBFMFRDXYLCQB-GOSISDBHSA-N -1 3 370.501 3.757 20 0 FHADHM FC(F)(F)c1cccc(-c2noc(Cc3ccc(-c4nnn[n-]4)cc3)n2)c1 ZINC000737635063 598608870 /nfs/dbraw/zinc/60/88/70/598608870.db2.gz FDBXEDKIHJKSGL-UHFFFAOYSA-N -1 3 372.310 3.526 20 0 FHADHM FC(F)(F)c1cccc(-c2noc(Cc3ccc(-c4nn[n-]n4)cc3)n2)c1 ZINC000737635063 598608871 /nfs/dbraw/zinc/60/88/71/598608871.db2.gz FDBXEDKIHJKSGL-UHFFFAOYSA-N -1 3 372.310 3.526 20 0 FHADHM c1ccc2c(c1)cccc2-c1noc(CCc2ccc(-c3nn[n-]n3)cc2)n1 ZINC000738433017 598613506 /nfs/dbraw/zinc/61/35/06/598613506.db2.gz MCQBZXNYKQQMMB-UHFFFAOYSA-N -1 3 368.400 3.855 20 0 FHADHM CCC[C@@H]1CCCC[C@H]1NC(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736435449 598617234 /nfs/dbraw/zinc/61/72/34/598617234.db2.gz LTKYZUIUXOQLDR-FRFSOERESA-N -1 3 356.474 3.586 20 0 FHADHM CCC[C@@H]1CCCC[C@H]1NC(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736435449 598617236 /nfs/dbraw/zinc/61/72/36/598617236.db2.gz LTKYZUIUXOQLDR-FRFSOERESA-N -1 3 356.474 3.586 20 0 FHADHM C[C@H](NC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccc(Cl)cc1 ZINC000736116868 598624257 /nfs/dbraw/zinc/62/42/57/598624257.db2.gz OTOILQQBLSEZAR-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM C[C@H](NC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccc(Cl)cc1 ZINC000736116868 598624260 /nfs/dbraw/zinc/62/42/60/598624260.db2.gz OTOILQQBLSEZAR-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)N1CCC[C@H]1c1cccc(F)c1 ZINC000738162711 598625110 /nfs/dbraw/zinc/62/51/10/598625110.db2.gz LMMFOMDBXWBSAW-INIZCTEOSA-N -1 3 370.363 3.514 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)N1CCC[C@H]1c1cccc(F)c1 ZINC000738162711 598625112 /nfs/dbraw/zinc/62/51/12/598625112.db2.gz LMMFOMDBXWBSAW-INIZCTEOSA-N -1 3 370.363 3.514 20 0 FHADHM CCN(Cc1ccc(Cl)cc1)C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000736557790 598629173 /nfs/dbraw/zinc/62/91/73/598629173.db2.gz AWEQPMFAGNHWDI-UHFFFAOYSA-N -1 3 374.807 3.713 20 0 FHADHM CCN(Cc1ccc(Cl)cc1)C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000736557790 598629174 /nfs/dbraw/zinc/62/91/74/598629174.db2.gz AWEQPMFAGNHWDI-UHFFFAOYSA-N -1 3 374.807 3.713 20 0 FHADHM CC[C@H]1c2ccsc2CCN1C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000736413276 598632562 /nfs/dbraw/zinc/63/25/62/598632562.db2.gz XQMIMVBISHCSDT-AWEZNQCLSA-N -1 3 372.429 3.609 20 0 FHADHM CC[C@H]1c2ccsc2CCN1C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000736413276 598632564 /nfs/dbraw/zinc/63/25/64/598632564.db2.gz XQMIMVBISHCSDT-AWEZNQCLSA-N -1 3 372.429 3.609 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1NCc1cccnc1OC1CCCC1 ZINC000737576057 598633778 /nfs/dbraw/zinc/63/37/78/598633778.db2.gz SKBBUVPZFFRFGO-UHFFFAOYSA-N -1 3 370.844 3.849 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1NCc1cccnc1OC1CCCC1 ZINC000737576057 598633780 /nfs/dbraw/zinc/63/37/80/598633780.db2.gz SKBBUVPZFFRFGO-UHFFFAOYSA-N -1 3 370.844 3.849 20 0 FHADHM CN(C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)[C@@H]1CCCc2ccccc21 ZINC000736750234 598634217 /nfs/dbraw/zinc/63/42/17/598634217.db2.gz XKZPTXHLEGXVLY-QGZVFWFLSA-N -1 3 366.400 3.547 20 0 FHADHM CN(C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)[C@@H]1CCCc2ccccc21 ZINC000736750234 598634219 /nfs/dbraw/zinc/63/42/19/598634219.db2.gz XKZPTXHLEGXVLY-QGZVFWFLSA-N -1 3 366.400 3.547 20 0 FHADHM O=C(C[C@H](c1ccccc1)C(F)(F)F)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000104368045 598646979 /nfs/dbraw/zinc/64/69/79/598646979.db2.gz QHRHRETVQHUSSL-CQSZACIVSA-N -1 3 361.327 3.541 20 0 FHADHM O=C(C[C@H](c1ccccc1)C(F)(F)F)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000104368045 598646982 /nfs/dbraw/zinc/64/69/82/598646982.db2.gz QHRHRETVQHUSSL-CQSZACIVSA-N -1 3 361.327 3.541 20 0 FHADHM C[C@@H](CSc1ccccc1)C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000736047402 598647652 /nfs/dbraw/zinc/64/76/52/598647652.db2.gz PYCKIVLXNUGJED-NSHDSACASA-N -1 3 373.869 3.887 20 0 FHADHM C[C@@H](CSc1ccccc1)C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000736047402 598647654 /nfs/dbraw/zinc/64/76/54/598647654.db2.gz PYCKIVLXNUGJED-NSHDSACASA-N -1 3 373.869 3.887 20 0 FHADHM CCN(C(=O)CCCCOc1cccc(-c2nnn[n-]2)c1)C1CCCCC1 ZINC000736502081 598647690 /nfs/dbraw/zinc/64/76/90/598647690.db2.gz JMRABPGWDQISIS-UHFFFAOYSA-N -1 3 371.485 3.597 20 0 FHADHM CCN(C(=O)CCCCOc1cccc(-c2nn[n-]n2)c1)C1CCCCC1 ZINC000736502081 598647691 /nfs/dbraw/zinc/64/76/91/598647691.db2.gz JMRABPGWDQISIS-UHFFFAOYSA-N -1 3 371.485 3.597 20 0 FHADHM C[C@@H](Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccc2c(c1)CCC(=O)N2 ZINC000736137952 598652466 /nfs/dbraw/zinc/65/24/66/598652466.db2.gz MPYRYMJDHYHVFH-SNVBAGLBSA-N -1 3 368.828 3.578 20 0 FHADHM C[C@@H](Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccc2c(c1)CCC(=O)N2 ZINC000736137952 598652468 /nfs/dbraw/zinc/65/24/68/598652468.db2.gz MPYRYMJDHYHVFH-SNVBAGLBSA-N -1 3 368.828 3.578 20 0 FHADHM CC(C)[C@@H]1CC[C@@H](C)C[C@H]1NC(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000736236751 598653268 /nfs/dbraw/zinc/65/32/68/598653268.db2.gz MQJLRLVFUUNNLF-XOKHGSTOSA-N -1 3 373.526 3.536 20 0 FHADHM CC(C)[C@@H]1CC[C@@H](C)C[C@H]1NC(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000736236751 598653270 /nfs/dbraw/zinc/65/32/70/598653270.db2.gz MQJLRLVFUUNNLF-XOKHGSTOSA-N -1 3 373.526 3.536 20 0 FHADHM CC[C@@H](Sc1ccccc1)C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000736393455 598657128 /nfs/dbraw/zinc/65/71/28/598657128.db2.gz YXBXRYRUVBIFJU-OAHLLOKOSA-N -1 3 357.414 3.515 20 0 FHADHM CC[C@@H](Sc1ccccc1)C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000736393455 598657130 /nfs/dbraw/zinc/65/71/30/598657130.db2.gz YXBXRYRUVBIFJU-OAHLLOKOSA-N -1 3 357.414 3.515 20 0 FHADHM CC(C)N(C(=O)CSc1ccc(-c2nnn[n-]2)cc1)c1ccc(F)cc1 ZINC000735851517 598658176 /nfs/dbraw/zinc/65/81/76/598658176.db2.gz YFTBAZKWANNJSB-UHFFFAOYSA-N -1 3 371.441 3.540 20 0 FHADHM CC(C)N(C(=O)CSc1ccc(-c2nn[n-]n2)cc1)c1ccc(F)cc1 ZINC000735851517 598658178 /nfs/dbraw/zinc/65/81/78/598658178.db2.gz YFTBAZKWANNJSB-UHFFFAOYSA-N -1 3 371.441 3.540 20 0 FHADHM Fc1ccc(CSCCOc2ccccc2Cl)c(-c2nnn[n-]2)c1 ZINC000737651562 598695471 /nfs/dbraw/zinc/69/54/71/598695471.db2.gz XTFITMLJHCECJF-UHFFFAOYSA-N -1 3 364.833 3.971 20 0 FHADHM Fc1ccc(CSCCOc2ccccc2Cl)c(-c2nn[n-]n2)c1 ZINC000737651562 598695473 /nfs/dbraw/zinc/69/54/73/598695473.db2.gz XTFITMLJHCECJF-UHFFFAOYSA-N -1 3 364.833 3.971 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nnn[n-]1)[C@H]1C[C@@H]1c1cccc(Cl)c1 ZINC000738232100 598711536 /nfs/dbraw/zinc/71/15/36/598711536.db2.gz PBZALBGHACRAPD-ZBFHGGJFSA-N -1 3 372.787 3.506 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nn[n-]n1)[C@H]1C[C@@H]1c1cccc(Cl)c1 ZINC000738232100 598711538 /nfs/dbraw/zinc/71/15/38/598711538.db2.gz PBZALBGHACRAPD-ZBFHGGJFSA-N -1 3 372.787 3.506 20 0 FHADHM Cc1cc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CC[C@@H](C)C3)ccc1F ZINC000737238927 598735064 /nfs/dbraw/zinc/73/50/64/598735064.db2.gz UYBNVOFHOJMBHF-SECBINFHSA-N -1 3 371.441 3.753 20 0 FHADHM Cc1cc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CC[C@@H](C)C3)ccc1F ZINC000737238927 598735065 /nfs/dbraw/zinc/73/50/65/598735065.db2.gz UYBNVOFHOJMBHF-SECBINFHSA-N -1 3 371.441 3.753 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)C=C(CC)c1ccccc1 ZINC000736633790 598736113 /nfs/dbraw/zinc/73/61/13/598736113.db2.gz CWRHRXNTTJFJGW-BUHFOSPRSA-N -1 3 363.421 3.698 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)C=C(CC)c1ccccc1 ZINC000736633790 598736115 /nfs/dbraw/zinc/73/61/15/598736115.db2.gz CWRHRXNTTJFJGW-BUHFOSPRSA-N -1 3 363.421 3.698 20 0 FHADHM Cc1sc(NC(=O)C[C@@H]2CCc3ccccc3C2)c(-c2nnn[n-]2)c1C ZINC000737561680 598742480 /nfs/dbraw/zinc/74/24/80/598742480.db2.gz JZMZHFHHNOCEGG-CYBMUJFWSA-N -1 3 367.478 3.679 20 0 FHADHM Cc1sc(NC(=O)C[C@@H]2CCc3ccccc3C2)c(-c2nn[n-]n2)c1C ZINC000737561680 598742482 /nfs/dbraw/zinc/74/24/82/598742482.db2.gz JZMZHFHHNOCEGG-CYBMUJFWSA-N -1 3 367.478 3.679 20 0 FHADHM Clc1ccc(NCc2ccccc2N2CCCC2)c(-c2nnn[n-]2)c1 ZINC000737572904 598744707 /nfs/dbraw/zinc/74/47/07/598744707.db2.gz BESWNLWQAVGZNH-UHFFFAOYSA-N -1 3 354.845 3.732 20 0 FHADHM Clc1ccc(NCc2ccccc2N2CCCC2)c(-c2nn[n-]n2)c1 ZINC000737572904 598744709 /nfs/dbraw/zinc/74/47/09/598744709.db2.gz BESWNLWQAVGZNH-UHFFFAOYSA-N -1 3 354.845 3.732 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1N[C@H](c1nccs1)c1ccccc1 ZINC000737639452 598757627 /nfs/dbraw/zinc/75/76/27/598757627.db2.gz BTTDYRSFTPCQTM-HNNXBMFYSA-N -1 3 352.398 3.664 20 0 FHADHM CC(C)(C(=O)OCc1ccc(-c2nnn[n-]2)cc1F)c1ccccc1Cl ZINC000735581726 598778463 /nfs/dbraw/zinc/77/84/63/598778463.db2.gz BGTDGOPVUCCXJS-UHFFFAOYSA-N -1 3 374.803 3.680 20 0 FHADHM CC(C)(C(=O)OCc1ccc(-c2nn[n-]n2)cc1F)c1ccccc1Cl ZINC000735581726 598778464 /nfs/dbraw/zinc/77/84/64/598778464.db2.gz BGTDGOPVUCCXJS-UHFFFAOYSA-N -1 3 374.803 3.680 20 0 FHADHM CC(C)N(Cc1ccco1)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000735876149 598781379 /nfs/dbraw/zinc/78/13/79/598781379.db2.gz VNVVHWGKNWCELB-UHFFFAOYSA-N -1 3 360.805 3.556 20 0 FHADHM CC(C)N(Cc1ccco1)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000735876149 598781380 /nfs/dbraw/zinc/78/13/80/598781380.db2.gz VNVVHWGKNWCELB-UHFFFAOYSA-N -1 3 360.805 3.556 20 0 FHADHM CCCC(=O)Nc1ccc(CNc2ccc(Cl)cc2-c2nnn[n-]2)cc1 ZINC000736416443 598792866 /nfs/dbraw/zinc/79/28/66/598792866.db2.gz NMBRMQDGDOXWOB-UHFFFAOYSA-N -1 3 370.844 3.871 20 0 FHADHM CCCC(=O)Nc1ccc(CNc2ccc(Cl)cc2-c2nn[n-]n2)cc1 ZINC000736416443 598792868 /nfs/dbraw/zinc/79/28/68/598792868.db2.gz NMBRMQDGDOXWOB-UHFFFAOYSA-N -1 3 370.844 3.871 20 0 FHADHM CC(C)C(=O)N(Cc1ccccc1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000735684068 598806678 /nfs/dbraw/zinc/80/66/78/598806678.db2.gz ILVHMZGIPIRNKW-UHFFFAOYSA-N -1 3 355.829 3.709 20 0 FHADHM CC(C)C(=O)N(Cc1ccccc1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000735684068 598806679 /nfs/dbraw/zinc/80/66/79/598806679.db2.gz ILVHMZGIPIRNKW-UHFFFAOYSA-N -1 3 355.829 3.709 20 0 FHADHM C[C@@H]1C[C@@H]1C(=O)N(Cc1ccccc1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000736235645 598807154 /nfs/dbraw/zinc/80/71/54/598807154.db2.gz PCFDATMAQYMXMB-WBMJQRKESA-N -1 3 367.840 3.709 20 0 FHADHM C[C@@H]1C[C@@H]1C(=O)N(Cc1ccccc1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000736235645 598807156 /nfs/dbraw/zinc/80/71/56/598807156.db2.gz PCFDATMAQYMXMB-WBMJQRKESA-N -1 3 367.840 3.709 20 0 FHADHM C[C@@H]1C[C@H]1C(=O)N(Cc1ccccc1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000736235644 598807219 /nfs/dbraw/zinc/80/72/19/598807219.db2.gz PCFDATMAQYMXMB-MLGOLLRUSA-N -1 3 367.840 3.709 20 0 FHADHM C[C@@H]1C[C@H]1C(=O)N(Cc1ccccc1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000736235644 598807220 /nfs/dbraw/zinc/80/72/20/598807220.db2.gz PCFDATMAQYMXMB-MLGOLLRUSA-N -1 3 367.840 3.709 20 0 FHADHM CC(C)c1cnc(CSc2nc3c(cc2-c2nnn[n-]2)CCCC3)o1 ZINC000735932021 598819611 /nfs/dbraw/zinc/81/96/11/598819611.db2.gz JRHYRQRVBFPAOJ-UHFFFAOYSA-N -1 3 356.455 3.544 20 0 FHADHM CC(C)c1cnc(CSc2nc3c(cc2-c2nn[n-]n2)CCCC3)o1 ZINC000735932021 598819612 /nfs/dbraw/zinc/81/96/12/598819612.db2.gz JRHYRQRVBFPAOJ-UHFFFAOYSA-N -1 3 356.455 3.544 20 0 FHADHM CCOc1cc(C(=O)Nc2sc(C)c(C)c2-c2nnn[n-]2)ccc1C ZINC000736628360 598821920 /nfs/dbraw/zinc/82/19/20/598821920.db2.gz WRWAAECXQVWCFX-UHFFFAOYSA-N -1 3 357.439 3.504 20 0 FHADHM CCOc1cc(C(=O)Nc2sc(C)c(C)c2-c2nn[n-]n2)ccc1C ZINC000736628360 598821921 /nfs/dbraw/zinc/82/19/21/598821921.db2.gz WRWAAECXQVWCFX-UHFFFAOYSA-N -1 3 357.439 3.504 20 0 FHADHM Cc1sc(NC(=O)c2ccccc2OC2CCC2)c(-c2nnn[n-]2)c1C ZINC000737562668 599293094 /nfs/dbraw/zinc/29/30/94/599293094.db2.gz LGHWTQKITWHFNF-UHFFFAOYSA-N -1 3 369.450 3.729 20 0 FHADHM Cc1sc(NC(=O)c2ccccc2OC2CCC2)c(-c2nn[n-]n2)c1C ZINC000737562668 599293097 /nfs/dbraw/zinc/29/30/97/599293097.db2.gz LGHWTQKITWHFNF-UHFFFAOYSA-N -1 3 369.450 3.729 20 0 FHADHM O=C(NCc1ccc(-c2nnn[n-]2)cc1)c1cccc(Nc2ccccc2)c1 ZINC000522819596 599301877 /nfs/dbraw/zinc/30/18/77/599301877.db2.gz YIQBAFFIYWQKQM-UHFFFAOYSA-N -1 3 370.416 3.540 20 0 FHADHM O=C(NCc1ccc(-c2nn[n-]n2)cc1)c1cccc(Nc2ccccc2)c1 ZINC000522819596 599301880 /nfs/dbraw/zinc/30/18/80/599301880.db2.gz YIQBAFFIYWQKQM-UHFFFAOYSA-N -1 3 370.416 3.540 20 0 FHADHM O=C(c1cccc(-c2nnn[n-]2)c1)N(c1ccccc1F)C1CCCC1 ZINC000738267672 599303352 /nfs/dbraw/zinc/30/33/52/599303352.db2.gz LJRQKAVPMMOLFS-UHFFFAOYSA-N -1 3 351.385 3.595 20 0 FHADHM O=C(c1cccc(-c2nn[n-]n2)c1)N(c1ccccc1F)C1CCCC1 ZINC000738267672 599303355 /nfs/dbraw/zinc/30/33/55/599303355.db2.gz LJRQKAVPMMOLFS-UHFFFAOYSA-N -1 3 351.385 3.595 20 0 FHADHM CCN(C(=O)CCc1ccccc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000736505291 599311486 /nfs/dbraw/zinc/31/14/86/599311486.db2.gz KTKBQFHHEKAUDB-UHFFFAOYSA-N -1 3 355.829 3.506 20 0 FHADHM CCN(C(=O)CCc1ccccc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000736505291 599311489 /nfs/dbraw/zinc/31/14/89/599311489.db2.gz KTKBQFHHEKAUDB-UHFFFAOYSA-N -1 3 355.829 3.506 20 0 FHADHM C[C@@H](c1ccc(-c2nnn[n-]2)cc1)N1CCO[C@@H](c2ccccc2Cl)C1 ZINC000736201244 599314425 /nfs/dbraw/zinc/31/44/25/599314425.db2.gz WJIMRIVWZPHXSV-SCLBCKFNSA-N -1 3 369.856 3.655 20 0 FHADHM C[C@@H](c1ccc(-c2nn[n-]n2)cc1)N1CCO[C@@H](c2ccccc2Cl)C1 ZINC000736201244 599314428 /nfs/dbraw/zinc/31/44/28/599314428.db2.gz WJIMRIVWZPHXSV-SCLBCKFNSA-N -1 3 369.856 3.655 20 0 FHADHM C[C@H](SCCC(=O)Nc1ccccc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000736192312 599328297 /nfs/dbraw/zinc/32/82/97/599328297.db2.gz XYDLJYXFOFPNEX-LBPRGKRZSA-N -1 3 371.441 3.829 20 0 FHADHM C[C@H](SCCC(=O)Nc1ccccc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000736192312 599328299 /nfs/dbraw/zinc/32/82/99/599328299.db2.gz XYDLJYXFOFPNEX-LBPRGKRZSA-N -1 3 371.441 3.829 20 0 FHADHM CCc1ccc(NC(=O)CS[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000736692837 599328735 /nfs/dbraw/zinc/32/87/35/599328735.db2.gz ZFDSUXMCOCRHHN-ZDUSSCGKSA-N -1 3 367.478 3.862 20 0 FHADHM CCc1ccc(NC(=O)CS[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000736692837 599328739 /nfs/dbraw/zinc/32/87/39/599328739.db2.gz ZFDSUXMCOCRHHN-ZDUSSCGKSA-N -1 3 367.478 3.862 20 0 FHADHM Cc1ccccc1NC(=O)[C@@H](C)S[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000737433733 599329767 /nfs/dbraw/zinc/32/97/67/599329767.db2.gz BSEWRRKWFWQQMJ-ZIAGYGMSSA-N -1 3 367.478 3.997 20 0 FHADHM Cc1ccccc1NC(=O)[C@@H](C)S[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000737433733 599329770 /nfs/dbraw/zinc/32/97/70/599329770.db2.gz BSEWRRKWFWQQMJ-ZIAGYGMSSA-N -1 3 367.478 3.997 20 0 FHADHM CC(C)Oc1c(Cl)cccc1NC(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000735903462 599332363 /nfs/dbraw/zinc/33/23/63/599332363.db2.gz FVDYATVPRFFIGP-UHFFFAOYSA-N -1 3 372.816 3.951 20 0 FHADHM CC(C)Oc1c(Cl)cccc1NC(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000735903462 599332366 /nfs/dbraw/zinc/33/23/66/599332366.db2.gz FVDYATVPRFFIGP-UHFFFAOYSA-N -1 3 372.816 3.951 20 0 FHADHM COc1cc(CSc2ccccc2-c2nnn[n-]2)ccc1OC(F)F ZINC000821716986 599342903 /nfs/dbraw/zinc/34/29/03/599342903.db2.gz IVMQUXAFAZSQDQ-UHFFFAOYSA-N -1 3 364.377 3.769 20 0 FHADHM COc1cc(CSc2ccccc2-c2nn[n-]n2)ccc1OC(F)F ZINC000821716986 599342907 /nfs/dbraw/zinc/34/29/07/599342907.db2.gz IVMQUXAFAZSQDQ-UHFFFAOYSA-N -1 3 364.377 3.769 20 0 FHADHM CSc1ccccc1NC(=O)[C@@H](C)Sc1ccccc1-c1nnn[n-]1 ZINC000821983091 599351042 /nfs/dbraw/zinc/35/10/42/599351042.db2.gz DGPBPRSTXGCSGA-LLVKDONJSA-N -1 3 371.491 3.708 20 0 FHADHM CSc1ccccc1NC(=O)[C@@H](C)Sc1ccccc1-c1nn[n-]n1 ZINC000821983091 599351044 /nfs/dbraw/zinc/35/10/44/599351044.db2.gz DGPBPRSTXGCSGA-LLVKDONJSA-N -1 3 371.491 3.708 20 0 FHADHM C[C@H](Nc1nc(C(F)F)nc2ccccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000820461611 599352441 /nfs/dbraw/zinc/35/24/41/599352441.db2.gz NVIJFCOYPGUVET-JTQLQIEISA-N -1 3 367.363 3.921 20 0 FHADHM C[C@H](Nc1nc(C(F)F)nc2ccccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000820461611 599352442 /nfs/dbraw/zinc/35/24/42/599352442.db2.gz NVIJFCOYPGUVET-JTQLQIEISA-N -1 3 367.363 3.921 20 0 FHADHM Cc1sc2nc(C)nc(N[C@H](C)c3cccc(-c4nnn[n-]4)c3)c2c1C ZINC000822453543 599355626 /nfs/dbraw/zinc/35/56/26/599355626.db2.gz LHQLEXBERLINFY-SNVBAGLBSA-N -1 3 365.466 3.970 20 0 FHADHM Cc1sc2nc(C)nc(N[C@H](C)c3cccc(-c4nn[n-]n4)c3)c2c1C ZINC000822453543 599355629 /nfs/dbraw/zinc/35/56/29/599355629.db2.gz LHQLEXBERLINFY-SNVBAGLBSA-N -1 3 365.466 3.970 20 0 FHADHM Cc1cccc(CSc2nc(C)cc(C(F)(F)F)c2-c2nnn[n-]2)n1 ZINC000737396734 599367850 /nfs/dbraw/zinc/36/78/50/599367850.db2.gz MAIXJSRJKXXDNO-UHFFFAOYSA-N -1 3 366.372 3.585 20 0 FHADHM C[C@H](Nc1ccc(OC[C@@H]2CCCO2)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820455164 599368916 /nfs/dbraw/zinc/36/89/16/599368916.db2.gz FRLHXUSEWMJICC-LIRRHRJNSA-N -1 3 365.437 3.598 20 0 FHADHM C[C@H](Nc1ccc(OC[C@@H]2CCCO2)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820455164 599368919 /nfs/dbraw/zinc/36/89/19/599368919.db2.gz FRLHXUSEWMJICC-LIRRHRJNSA-N -1 3 365.437 3.598 20 0 FHADHM C[C@H](Nc1cccc(NC(=O)c2ccoc2)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820462537 599373919 /nfs/dbraw/zinc/37/39/19/599373919.db2.gz YLHWLEJHXOKKNQ-ZDUSSCGKSA-N -1 3 374.404 3.885 20 0 FHADHM C[C@H](Nc1cccc(NC(=O)c2ccoc2)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820462537 599373922 /nfs/dbraw/zinc/37/39/22/599373922.db2.gz YLHWLEJHXOKKNQ-ZDUSSCGKSA-N -1 3 374.404 3.885 20 0 FHADHM COc1ccc(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1Br ZINC000821835436 599376329 /nfs/dbraw/zinc/37/63/29/599376329.db2.gz KWKQPRZPWIPLET-SNVBAGLBSA-N -1 3 374.242 3.811 20 0 FHADHM COc1ccc(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1Br ZINC000821835436 599376332 /nfs/dbraw/zinc/37/63/32/599376332.db2.gz KWKQPRZPWIPLET-SNVBAGLBSA-N -1 3 374.242 3.811 20 0 FHADHM Cc1cccc(Cl)c1OC(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000737395871 599376746 /nfs/dbraw/zinc/37/67/46/599376746.db2.gz AFZJOOOTMUYNSS-UHFFFAOYSA-N -1 3 360.826 3.526 20 0 FHADHM Cc1cccc(Cl)c1OC(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000737395871 599376749 /nfs/dbraw/zinc/37/67/49/599376749.db2.gz AFZJOOOTMUYNSS-UHFFFAOYSA-N -1 3 360.826 3.526 20 0 FHADHM Cc1ccnc(-c2ccc(N[C@@H](C)c3ccc(-c4nnn[n-]4)cc3)cc2)n1 ZINC000822373960 599379298 /nfs/dbraw/zinc/37/92/98/599379298.db2.gz GUXPEHMQQCANCB-AWEZNQCLSA-N -1 3 357.421 3.805 20 0 FHADHM Cc1ccnc(-c2ccc(N[C@@H](C)c3ccc(-c4nn[n-]n4)cc3)cc2)n1 ZINC000822373960 599379300 /nfs/dbraw/zinc/37/93/00/599379300.db2.gz GUXPEHMQQCANCB-AWEZNQCLSA-N -1 3 357.421 3.805 20 0 FHADHM Cc1cc(-c2nn[n-]n2)cc(C)c1OCc1coc(-c2cccc(F)c2)n1 ZINC000822137937 599389485 /nfs/dbraw/zinc/38/94/85/599389485.db2.gz YHRVSYZOIXSASQ-UHFFFAOYSA-N -1 3 365.368 3.857 20 0 FHADHM CC(C)Oc1ccc(NCc2cccc3cccnc32)cc1-c1nnn[n-]1 ZINC000820174288 607372340 /nfs/dbraw/zinc/37/23/40/607372340.db2.gz QQGKVKNHFWBBGY-UHFFFAOYSA-N -1 3 360.421 3.814 20 0 FHADHM CC(C)Oc1ccc(NCc2cccc3cccnc32)cc1-c1nn[n-]n1 ZINC000820174288 607372342 /nfs/dbraw/zinc/37/23/42/607372342.db2.gz QQGKVKNHFWBBGY-UHFFFAOYSA-N -1 3 360.421 3.814 20 0 FHADHM Cc1nc(-c2ccc([C@@H](C)NCc3ccc(-c4nnn[n-]4)o3)cc2)cs1 ZINC000822419775 599399320 /nfs/dbraw/zinc/39/93/20/599399320.db2.gz VEKDRHATANYRGM-LLVKDONJSA-N -1 3 366.450 3.742 20 0 FHADHM CCOCc1ccc(CNc2cc(-c3nnn[n-]3)c3ccccc3n2)cc1 ZINC000736627534 599403493 /nfs/dbraw/zinc/40/34/93/599403493.db2.gz WUMCVIGEAUHRPK-UHFFFAOYSA-N -1 3 360.421 3.564 20 0 FHADHM CCOCc1ccc(CNc2cc(-c3nn[n-]n3)c3ccccc3n2)cc1 ZINC000736627534 599403496 /nfs/dbraw/zinc/40/34/96/599403496.db2.gz WUMCVIGEAUHRPK-UHFFFAOYSA-N -1 3 360.421 3.564 20 0 FHADHM c1ccc2c(c1)nc(Nc1ccc(N3CCCCC3)nc1)cc2-c1nnn[n-]1 ZINC000738433781 599403802 /nfs/dbraw/zinc/40/38/02/599403802.db2.gz WGOBDTLBUZIYFP-UHFFFAOYSA-N -1 3 372.436 3.544 20 0 FHADHM c1ccc2c(c1)nc(Nc1ccc(N3CCCCC3)nc1)cc2-c1nn[n-]n1 ZINC000738433781 599403804 /nfs/dbraw/zinc/40/38/04/599403804.db2.gz WGOBDTLBUZIYFP-UHFFFAOYSA-N -1 3 372.436 3.544 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(NCc2ccc(N3CCCCC3)nc2)c1 ZINC000737571190 599412492 /nfs/dbraw/zinc/41/24/92/599412492.db2.gz VRWLQPVAJBXYSG-UHFFFAOYSA-N -1 3 369.860 3.518 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(NCc2ccc(N3CCCCC3)nc2)c1 ZINC000737571190 599412496 /nfs/dbraw/zinc/41/24/96/599412496.db2.gz VRWLQPVAJBXYSG-UHFFFAOYSA-N -1 3 369.860 3.518 20 0 FHADHM COc1ccc2[nH]cc(CCNc3cc(Cl)ccc3-c3nnn[n-]3)c2c1 ZINC000737113732 599437103 /nfs/dbraw/zinc/43/71/03/599437103.db2.gz FOSZJVMOYHCLPU-UHFFFAOYSA-N -1 3 368.828 3.665 20 0 FHADHM COc1ccc2[nH]cc(CCNc3cc(Cl)ccc3-c3nn[n-]n3)c2c1 ZINC000737113732 599437105 /nfs/dbraw/zinc/43/71/05/599437105.db2.gz FOSZJVMOYHCLPU-UHFFFAOYSA-N -1 3 368.828 3.665 20 0 FHADHM CO[C@@H](c1ccc(Cl)cc1)[C@H](C)Nc1cccc(F)c1-c1nnn[n-]1 ZINC000736962444 599443124 /nfs/dbraw/zinc/44/31/24/599443124.db2.gz OUAJDNAAXCRGJO-MGPLVRAMSA-N -1 3 361.808 3.847 20 0 FHADHM CO[C@@H](c1ccc(Cl)cc1)[C@H](C)Nc1cccc(F)c1-c1nn[n-]n1 ZINC000736962444 599443127 /nfs/dbraw/zinc/44/31/27/599443127.db2.gz OUAJDNAAXCRGJO-MGPLVRAMSA-N -1 3 361.808 3.847 20 0 FHADHM CO[C@H](c1ccc(Cl)cc1)[C@@H](C)Nc1cccc(F)c1-c1nnn[n-]1 ZINC000736962440 599443494 /nfs/dbraw/zinc/44/34/94/599443494.db2.gz OUAJDNAAXCRGJO-HWPZZCPQSA-N -1 3 361.808 3.847 20 0 FHADHM CO[C@H](c1ccc(Cl)cc1)[C@@H](C)Nc1cccc(F)c1-c1nn[n-]n1 ZINC000736962440 599443498 /nfs/dbraw/zinc/44/34/98/599443498.db2.gz OUAJDNAAXCRGJO-HWPZZCPQSA-N -1 3 361.808 3.847 20 0 FHADHM O=C(CCc1cc(Cl)cs1)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000737850853 599466485 /nfs/dbraw/zinc/46/64/85/599466485.db2.gz ALGUOEOOKXWBSM-UHFFFAOYSA-N -1 3 368.249 3.806 20 0 FHADHM O=C(CCc1cc(Cl)cs1)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000737850853 599466487 /nfs/dbraw/zinc/46/64/87/599466487.db2.gz ALGUOEOOKXWBSM-UHFFFAOYSA-N -1 3 368.249 3.806 20 0 FHADHM O=C(CCc1cc(Cl)cs1)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000737851203 599466767 /nfs/dbraw/zinc/46/67/67/599466767.db2.gz FNNGBVCIHYZAFU-UHFFFAOYSA-N -1 3 368.249 3.806 20 0 FHADHM O=C(CCc1cc(Cl)cs1)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000737851203 599466768 /nfs/dbraw/zinc/46/67/68/599466768.db2.gz FNNGBVCIHYZAFU-UHFFFAOYSA-N -1 3 368.249 3.806 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)N1CCCCC[C@H]1c1ccco1 ZINC000737801807 599468579 /nfs/dbraw/zinc/46/85/79/599468579.db2.gz UPJAOQKIPIFFAA-CPFIRTDXSA-N -1 3 363.421 3.617 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)N1CCCCC[C@H]1c1ccco1 ZINC000737801807 599468581 /nfs/dbraw/zinc/46/85/81/599468581.db2.gz UPJAOQKIPIFFAA-CPFIRTDXSA-N -1 3 363.421 3.617 20 0 FHADHM C[C@@H](NC(=O)N1CCC[C@H]1C1CCCCC1)c1cccc(-c2nnn[n-]2)c1 ZINC000820352294 599485834 /nfs/dbraw/zinc/48/58/34/599485834.db2.gz TUJYAOMQXKKCQE-KDOFPFPSSA-N -1 3 368.485 3.682 20 0 FHADHM C[C@@H](NC(=O)N1CCC[C@H]1C1CCCCC1)c1cccc(-c2nn[n-]n2)c1 ZINC000820352294 599485836 /nfs/dbraw/zinc/48/58/36/599485836.db2.gz TUJYAOMQXKKCQE-KDOFPFPSSA-N -1 3 368.485 3.682 20 0 FHADHM C[C@H](NC(=O)N1CCC[C@H]1c1cccs1)c1cccc(-c2nnn[n-]2)c1 ZINC000820349882 599485857 /nfs/dbraw/zinc/48/58/57/599485857.db2.gz JXIMJNJSGTXCTD-WFASDCNBSA-N -1 3 368.466 3.536 20 0 FHADHM C[C@H](NC(=O)N1CCC[C@H]1c1cccs1)c1cccc(-c2nn[n-]n2)c1 ZINC000820349882 599485859 /nfs/dbraw/zinc/48/58/59/599485859.db2.gz JXIMJNJSGTXCTD-WFASDCNBSA-N -1 3 368.466 3.536 20 0 FHADHM C[C@@H](NC(=O)N1CCC[C@@H]1c1cccs1)c1cccc(-c2nnn[n-]2)c1 ZINC000820349880 599486060 /nfs/dbraw/zinc/48/60/60/599486060.db2.gz JXIMJNJSGTXCTD-IUODEOHRSA-N -1 3 368.466 3.536 20 0 FHADHM C[C@@H](NC(=O)N1CCC[C@@H]1c1cccs1)c1cccc(-c2nn[n-]n2)c1 ZINC000820349880 599486062 /nfs/dbraw/zinc/48/60/62/599486062.db2.gz JXIMJNJSGTXCTD-IUODEOHRSA-N -1 3 368.466 3.536 20 0 FHADHM Fc1ccc(N[C@H]2CCc3cc(Br)ccc32)c(-c2nnn[n-]2)c1 ZINC000822778942 599493385 /nfs/dbraw/zinc/49/33/85/599493385.db2.gz PATJEWRREOWCEI-AWEZNQCLSA-N -1 3 374.217 3.868 20 0 FHADHM Fc1ccc(N[C@H]2CCc3cc(Br)ccc32)c(-c2nn[n-]n2)c1 ZINC000822778942 599493386 /nfs/dbraw/zinc/49/33/86/599493386.db2.gz PATJEWRREOWCEI-AWEZNQCLSA-N -1 3 374.217 3.868 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)N1CCCCC[C@H]1c1ccco1 ZINC000738178135 599493486 /nfs/dbraw/zinc/49/34/86/599493486.db2.gz FKKQQWSKFQYAIY-HNNXBMFYSA-N -1 3 352.398 3.609 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)N1CCCCC[C@H]1c1ccco1 ZINC000738178135 599493488 /nfs/dbraw/zinc/49/34/88/599493488.db2.gz FKKQQWSKFQYAIY-HNNXBMFYSA-N -1 3 352.398 3.609 20 0 FHADHM CCC(CC)(C(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000820882059 599493715 /nfs/dbraw/zinc/49/37/15/599493715.db2.gz IUTRMFISSCRWNS-UHFFFAOYSA-N -1 3 363.465 3.583 20 0 FHADHM CCC(CC)(C(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000820882059 599493718 /nfs/dbraw/zinc/49/37/18/599493718.db2.gz IUTRMFISSCRWNS-UHFFFAOYSA-N -1 3 363.465 3.583 20 0 FHADHM CCC(CC)(C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccccc1 ZINC000820882365 599494703 /nfs/dbraw/zinc/49/47/03/599494703.db2.gz PSDQCZXVSBZZDE-UHFFFAOYSA-N -1 3 353.401 3.702 20 0 FHADHM CCC(CC)(C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccccc1 ZINC000820882365 599494706 /nfs/dbraw/zinc/49/47/06/599494706.db2.gz PSDQCZXVSBZZDE-UHFFFAOYSA-N -1 3 353.401 3.702 20 0 FHADHM CCC(=CC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(C)cc1 ZINC000820832770 599499772 /nfs/dbraw/zinc/49/97/72/599499772.db2.gz NPKMHRLSPFOWIY-WSTOHFRZSA-N -1 3 361.449 3.846 20 0 FHADHM CCC(=CC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(C)cc1 ZINC000820832770 599499775 /nfs/dbraw/zinc/49/97/75/599499775.db2.gz NPKMHRLSPFOWIY-WSTOHFRZSA-N -1 3 361.449 3.846 20 0 FHADHM C[C@@H](NC(=O)CCCc1c[nH]c2ccccc12)c1cccc(-c2nnn[n-]2)c1 ZINC000820321048 599503924 /nfs/dbraw/zinc/50/39/24/599503924.db2.gz BRSYXPLATKESJB-CQSZACIVSA-N -1 3 374.448 3.548 20 0 FHADHM C[C@@H](NC(=O)CCCc1c[nH]c2ccccc12)c1cccc(-c2nn[n-]n2)c1 ZINC000820321048 599503928 /nfs/dbraw/zinc/50/39/28/599503928.db2.gz BRSYXPLATKESJB-CQSZACIVSA-N -1 3 374.448 3.548 20 0 FHADHM Cc1cccc(N[C@@H](C)C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c1C ZINC000737398594 599504539 /nfs/dbraw/zinc/50/45/39/599504539.db2.gz CFOVIMOEDVWYFT-LBPRGKRZSA-N -1 3 370.844 3.576 20 0 FHADHM Cc1cccc(N[C@@H](C)C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c1C ZINC000737398594 599504542 /nfs/dbraw/zinc/50/45/42/599504542.db2.gz CFOVIMOEDVWYFT-LBPRGKRZSA-N -1 3 370.844 3.576 20 0 FHADHM C[C@@H](CCC(C)(C)C)NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000735984024 599505117 /nfs/dbraw/zinc/50/51/17/599505117.db2.gz AWVBTTXEWPENGB-AWEZNQCLSA-N -1 3 370.501 3.756 20 0 FHADHM C[C@@H](CCC(C)(C)C)NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000735984024 599505120 /nfs/dbraw/zinc/50/51/20/599505120.db2.gz AWVBTTXEWPENGB-AWEZNQCLSA-N -1 3 370.501 3.756 20 0 FHADHM C[C@@H](NC(=O)C[C@@H]1CCCc2ccccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000820321584 599516010 /nfs/dbraw/zinc/51/60/10/599516010.db2.gz IXFSRHVOWWJODC-PBHICJAKSA-N -1 3 361.449 3.554 20 0 FHADHM C[C@@H](NC(=O)C[C@@H]1CCCc2ccccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000820321584 599516012 /nfs/dbraw/zinc/51/60/12/599516012.db2.gz IXFSRHVOWWJODC-PBHICJAKSA-N -1 3 361.449 3.554 20 0 FHADHM Cc1c(Cl)cccc1OCC(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000737215535 599516976 /nfs/dbraw/zinc/51/69/76/599516976.db2.gz LCORUVFLOCJTGB-GFCCVEGCSA-N -1 3 372.812 3.512 20 0 FHADHM Cc1c(Cl)cccc1OCC(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000737215535 599516978 /nfs/dbraw/zinc/51/69/78/599516978.db2.gz LCORUVFLOCJTGB-GFCCVEGCSA-N -1 3 372.812 3.512 20 0 FHADHM CCc1nc(CCNc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)cs1 ZINC000736701121 599524156 /nfs/dbraw/zinc/52/41/56/599524156.db2.gz ZVZJQXUVMMRLBK-UHFFFAOYSA-N -1 3 368.388 3.559 20 0 FHADHM C[C@@H](S[C@@H](C)C(=O)Nc1ccccc1-c1nnn[n-]1)c1cccs1 ZINC000736188207 599524517 /nfs/dbraw/zinc/52/45/17/599524517.db2.gz JBQGLTZBYRMFRD-MNOVXSKESA-N -1 3 359.480 3.750 20 0 FHADHM C[C@@H](S[C@@H](C)C(=O)Nc1ccccc1-c1nn[n-]n1)c1cccs1 ZINC000736188207 599524520 /nfs/dbraw/zinc/52/45/20/599524520.db2.gz JBQGLTZBYRMFRD-MNOVXSKESA-N -1 3 359.480 3.750 20 0 FHADHM Cc1ccc(CCCCC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000822236403 599525170 /nfs/dbraw/zinc/52/51/70/599525170.db2.gz XXHSUYMRZSJUDJ-MRXNPFEDSA-N -1 3 363.465 3.765 20 0 FHADHM Cc1ccc(CCCCC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000822236403 599525173 /nfs/dbraw/zinc/52/51/73/599525173.db2.gz XXHSUYMRZSJUDJ-MRXNPFEDSA-N -1 3 363.465 3.765 20 0 FHADHM Cc1cc(Nc2cccc(F)c2-c2nnn[n-]2)ccc1OC1CCOCC1 ZINC000737281215 599535218 /nfs/dbraw/zinc/53/52/18/599535218.db2.gz RNAZUUYJCFFLFB-UHFFFAOYSA-N -1 3 369.400 3.616 20 0 FHADHM Cc1cc(Nc2cccc(F)c2-c2nn[n-]n2)ccc1OC1CCOCC1 ZINC000737281215 599535221 /nfs/dbraw/zinc/53/52/21/599535221.db2.gz RNAZUUYJCFFLFB-UHFFFAOYSA-N -1 3 369.400 3.616 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CC[C@H](C)C2)c1cccs1 ZINC000736280329 599539460 /nfs/dbraw/zinc/53/94/60/599539460.db2.gz QFDQNMKNXQTZLQ-UWVGGRQHSA-N -1 3 373.507 3.857 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CC[C@H](C)C2)c1cccs1 ZINC000736280329 599539462 /nfs/dbraw/zinc/53/94/62/599539462.db2.gz QFDQNMKNXQTZLQ-UWVGGRQHSA-N -1 3 373.507 3.857 20 0 FHADHM CCc1ccc([C@@H](C)CC(=O)Oc2ccc(-c3nnn[n-]3)cc2OC)cc1 ZINC000736685934 599540544 /nfs/dbraw/zinc/54/05/44/599540544.db2.gz MYBQMTJDRBBCQN-ZDUSSCGKSA-N -1 3 366.421 3.537 20 0 FHADHM CCc1ccc([C@@H](C)CC(=O)Oc2ccc(-c3nn[n-]n3)cc2OC)cc1 ZINC000736685934 599540546 /nfs/dbraw/zinc/54/05/46/599540546.db2.gz MYBQMTJDRBBCQN-ZDUSSCGKSA-N -1 3 366.421 3.537 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@@H](C)c1ccsc1 ZINC000735830181 599541276 /nfs/dbraw/zinc/54/12/76/599541276.db2.gz UATSVWHCPLEXIY-AWEZNQCLSA-N -1 3 369.494 3.717 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@@H](C)c1ccsc1 ZINC000735830181 599541277 /nfs/dbraw/zinc/54/12/77/599541277.db2.gz UATSVWHCPLEXIY-AWEZNQCLSA-N -1 3 369.494 3.717 20 0 FHADHM CC[C@H](Sc1ccccc1)C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820939850 599542322 /nfs/dbraw/zinc/54/23/22/599542322.db2.gz ZFOFUCBIGZSURS-GUYCJALGSA-N -1 3 367.478 3.615 20 0 FHADHM CC[C@H](Sc1ccccc1)C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820939850 599542324 /nfs/dbraw/zinc/54/23/24/599542324.db2.gz ZFOFUCBIGZSURS-GUYCJALGSA-N -1 3 367.478 3.615 20 0 FHADHM Fc1ccc(NCCOc2ccccc2C(F)(F)F)c(-c2nnn[n-]2)c1 ZINC000822778232 599543060 /nfs/dbraw/zinc/54/30/60/599543060.db2.gz GDCHSSVOSRQZIN-UHFFFAOYSA-N -1 3 367.306 3.516 20 0 FHADHM Fc1ccc(NCCOc2ccccc2C(F)(F)F)c(-c2nn[n-]n2)c1 ZINC000822778232 599543062 /nfs/dbraw/zinc/54/30/62/599543062.db2.gz GDCHSSVOSRQZIN-UHFFFAOYSA-N -1 3 367.306 3.516 20 0 FHADHM O=C(CC/C=C/c1ccccc1)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000737827627 599543365 /nfs/dbraw/zinc/54/33/65/599543365.db2.gz ZZOMGQJEHVOXAN-XBXARRHUSA-N -1 3 373.460 3.851 20 0 FHADHM O=C(CC/C=C/c1ccccc1)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000737827627 599543367 /nfs/dbraw/zinc/54/33/67/599543367.db2.gz ZZOMGQJEHVOXAN-XBXARRHUSA-N -1 3 373.460 3.851 20 0 FHADHM CC[C@H](C)[C@@H]1CCCCN1C(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000736326626 599548218 /nfs/dbraw/zinc/54/82/18/599548218.db2.gz BVECNAYVZKCXOA-YOEHRIQHSA-N -1 3 373.526 3.527 20 0 FHADHM CC[C@H](C)[C@@H]1CCCCN1C(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000736326626 599548219 /nfs/dbraw/zinc/54/82/19/599548219.db2.gz BVECNAYVZKCXOA-YOEHRIQHSA-N -1 3 373.526 3.527 20 0 FHADHM Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)C=Cc2ccccc2-c2nnn[n-]2)C1 ZINC000737424414 599549169 /nfs/dbraw/zinc/54/91/69/599549169.db2.gz YDNKULVHMMUJDN-OFHUKCQUSA-N -1 3 373.460 3.593 20 0 FHADHM Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)C=Cc2ccccc2-c2nn[n-]n2)C1 ZINC000737424414 599549171 /nfs/dbraw/zinc/54/91/71/599549171.db2.gz YDNKULVHMMUJDN-OFHUKCQUSA-N -1 3 373.460 3.593 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)Nc1ccc(C)s1 ZINC000821104990 599550472 /nfs/dbraw/zinc/55/04/72/599550472.db2.gz UNCWFGQTKCZJGO-UHFFFAOYSA-N -1 3 356.455 3.681 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)Nc1ccc(C)s1 ZINC000821104990 599550474 /nfs/dbraw/zinc/55/04/74/599550474.db2.gz UNCWFGQTKCZJGO-UHFFFAOYSA-N -1 3 356.455 3.681 20 0 FHADHM Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)Nc2ccc(-c3nnn[n-]3)cc2)o1 ZINC000822232879 599556085 /nfs/dbraw/zinc/55/60/85/599556085.db2.gz CTRSZTAVWFOAGZ-LRDDRELGSA-N -1 3 366.425 3.773 20 0 FHADHM Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)Nc2ccc(-c3nn[n-]n3)cc2)o1 ZINC000822232879 599556086 /nfs/dbraw/zinc/55/60/86/599556086.db2.gz CTRSZTAVWFOAGZ-LRDDRELGSA-N -1 3 366.425 3.773 20 0 FHADHM Cc1ccc([C@@H]2[C@H](C)CCCN2C(=O)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000737330354 599558219 /nfs/dbraw/zinc/55/82/19/599558219.db2.gz NJJASKYQYZEOOL-BEFAXECRSA-N -1 3 361.449 3.789 20 0 FHADHM Cc1ccc([C@@H]2[C@H](C)CCCN2C(=O)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000737330354 599558221 /nfs/dbraw/zinc/55/82/21/599558221.db2.gz NJJASKYQYZEOOL-BEFAXECRSA-N -1 3 361.449 3.789 20 0 FHADHM C[C@H]1C[C@H](c2ccccc2)CN1c1c(-c2nnn[n-]2)cnc2ccccc21 ZINC000820668296 599559442 /nfs/dbraw/zinc/55/94/42/599559442.db2.gz RHUICMHRPLBMMV-HOCLYGCPSA-N -1 3 356.433 3.797 20 0 FHADHM C[C@H]1C[C@H](c2ccccc2)CN1c1c(-c2nn[n-]n2)cnc2ccccc21 ZINC000820668296 599559445 /nfs/dbraw/zinc/55/94/45/599559445.db2.gz RHUICMHRPLBMMV-HOCLYGCPSA-N -1 3 356.433 3.797 20 0 FHADHM C[C@H]1C[C@@H](c2ccccc2)CN1c1c(-c2nnn[n-]2)cnc2ccccc21 ZINC000820668295 599559546 /nfs/dbraw/zinc/55/95/46/599559546.db2.gz RHUICMHRPLBMMV-GOEBONIOSA-N -1 3 356.433 3.797 20 0 FHADHM C[C@H]1C[C@@H](c2ccccc2)CN1c1c(-c2nn[n-]n2)cnc2ccccc21 ZINC000820668295 599559549 /nfs/dbraw/zinc/55/95/49/599559549.db2.gz RHUICMHRPLBMMV-GOEBONIOSA-N -1 3 356.433 3.797 20 0 FHADHM CC[C@@H]1CCCN(c2c(-c3nnn[n-]3)cnc3c(F)ccc(F)c32)CC1 ZINC000820979629 599561534 /nfs/dbraw/zinc/56/15/34/599561534.db2.gz IOGDQVZJHCITDV-LLVKDONJSA-N -1 3 358.396 3.710 20 0 FHADHM CC[C@@H]1CCCN(c2c(-c3nn[n-]n3)cnc3c(F)ccc(F)c32)CC1 ZINC000820979629 599561536 /nfs/dbraw/zinc/56/15/36/599561536.db2.gz IOGDQVZJHCITDV-LLVKDONJSA-N -1 3 358.396 3.710 20 0 FHADHM COc1ccc([C@@H](C)CCNc2ncc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000821778253 599588583 /nfs/dbraw/zinc/58/85/83/599588583.db2.gz XFUIXDJQHVGAQH-NSHDSACASA-N -1 3 358.833 3.529 20 0 FHADHM COc1ccc([C@@H](C)CCNc2ncc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000821778253 599588585 /nfs/dbraw/zinc/58/85/85/599588585.db2.gz XFUIXDJQHVGAQH-NSHDSACASA-N -1 3 358.833 3.529 20 0 FHADHM CC[C@@H](C)[C@@H]1CCCCN1C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000736330633 599599521 /nfs/dbraw/zinc/59/95/21/599599521.db2.gz NBXDFPDCTGRMAA-HIFRSBDPSA-N -1 3 373.505 3.856 20 0 FHADHM CC[C@@H](C)[C@@H]1CCCCN1C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000736330633 599599522 /nfs/dbraw/zinc/59/95/22/599599522.db2.gz NBXDFPDCTGRMAA-HIFRSBDPSA-N -1 3 373.505 3.856 20 0 FHADHM O=C(CC/C=C\c1ccccc1)OCc1ccc(-c2nnn[n-]2)cc1F ZINC000737825686 599606454 /nfs/dbraw/zinc/60/64/54/599606454.db2.gz NRZOWDTXUGBRLR-YWEYNIOJSA-N -1 3 352.369 3.543 20 0 FHADHM O=C(CC/C=C\c1ccccc1)OCc1ccc(-c2nn[n-]n2)cc1F ZINC000737825686 599606456 /nfs/dbraw/zinc/60/64/56/599606456.db2.gz NRZOWDTXUGBRLR-YWEYNIOJSA-N -1 3 352.369 3.543 20 0 FHADHM C[C@H](CCc1cccc(F)c1)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820253201 599629332 /nfs/dbraw/zinc/62/93/32/599629332.db2.gz GUITZRIJKAKKHD-LLVKDONJSA-N -1 3 373.819 3.867 20 0 FHADHM C[C@H](CCc1cccc(F)c1)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820253201 599629333 /nfs/dbraw/zinc/62/93/33/599629333.db2.gz GUITZRIJKAKKHD-LLVKDONJSA-N -1 3 373.819 3.867 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)c2ccc(OC3CCC3)cc2)s1 ZINC000821466261 599630448 /nfs/dbraw/zinc/63/04/48/599630448.db2.gz VJXPVRLWULMGHB-UHFFFAOYSA-N -1 3 369.450 3.674 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)c2ccc(OC3CCC3)cc2)s1 ZINC000821466261 599630449 /nfs/dbraw/zinc/63/04/49/599630449.db2.gz VJXPVRLWULMGHB-UHFFFAOYSA-N -1 3 369.450 3.674 20 0 FHADHM CCCCSCCC(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000821077505 599633610 /nfs/dbraw/zinc/63/36/10/599633610.db2.gz ISDWPRMQFLMZOR-UHFFFAOYSA-N -1 3 373.404 3.747 20 0 FHADHM CCCCSCCC(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000821077505 599633611 /nfs/dbraw/zinc/63/36/11/599633611.db2.gz ISDWPRMQFLMZOR-UHFFFAOYSA-N -1 3 373.404 3.747 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)c1cc(Oc2ccccc2)ccn1 ZINC000822220148 599649398 /nfs/dbraw/zinc/64/93/98/599649398.db2.gz FUCCHNMPIIFXOH-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cc(Oc2ccccc2)ccn1 ZINC000822220148 599649399 /nfs/dbraw/zinc/64/93/99/599649399.db2.gz FUCCHNMPIIFXOH-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccc2c(CCC(=O)Nc3cc(-c4nnn[n-]4)ccc3C)c[nH]c2c1 ZINC000822274574 599649813 /nfs/dbraw/zinc/64/98/13/599649813.db2.gz BMHYEXDCROMIKK-UHFFFAOYSA-N -1 3 360.421 3.536 20 0 FHADHM Cc1ccc2c(CCC(=O)Nc3cc(-c4nn[n-]n4)ccc3C)c[nH]c2c1 ZINC000822274574 599649814 /nfs/dbraw/zinc/64/98/14/599649814.db2.gz BMHYEXDCROMIKK-UHFFFAOYSA-N -1 3 360.421 3.536 20 0 FHADHM Cc1ccc(-c2nc(CN[C@H](C)c3ccc(-c4nn[n-]n4)cc3)co2)cc1 ZINC000822214086 599664891 /nfs/dbraw/zinc/66/48/91/599664891.db2.gz OVFFJWLGLWXOEG-CQSZACIVSA-N -1 3 360.421 3.681 20 0 FHADHM CC(C)N(Cc1cccs1)C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820339287 599680817 /nfs/dbraw/zinc/68/08/17/599680817.db2.gz BCQHPEVUYWYDRD-ZDUSSCGKSA-N -1 3 370.482 3.609 20 0 FHADHM CC(C)N(Cc1cccs1)C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820339287 599680818 /nfs/dbraw/zinc/68/08/18/599680818.db2.gz BCQHPEVUYWYDRD-ZDUSSCGKSA-N -1 3 370.482 3.609 20 0 FHADHM C[C@@H](NC(=O)N(C)C1CCCCCCC1)c1cccc(-c2nnn[n-]2)c1 ZINC000820339639 599681911 /nfs/dbraw/zinc/68/19/11/599681911.db2.gz FMJXWOHLAOEMNI-CQSZACIVSA-N -1 3 356.474 3.682 20 0 FHADHM C[C@@H](NC(=O)N(C)C1CCCCCCC1)c1cccc(-c2nn[n-]n2)c1 ZINC000820339639 599681912 /nfs/dbraw/zinc/68/19/12/599681912.db2.gz FMJXWOHLAOEMNI-CQSZACIVSA-N -1 3 356.474 3.682 20 0 FHADHM COc1ccc(C2CCN(c3c(Cl)cccc3-c3nnn[n-]3)CC2)cc1 ZINC000821786979 599686657 /nfs/dbraw/zinc/68/66/57/599686657.db2.gz MUOHCZCEBQMMRW-UHFFFAOYSA-N -1 3 369.856 3.913 20 0 FHADHM COc1ccc(C2CCN(c3c(Cl)cccc3-c3nn[n-]n3)CC2)cc1 ZINC000821786979 599686658 /nfs/dbraw/zinc/68/66/58/599686658.db2.gz MUOHCZCEBQMMRW-UHFFFAOYSA-N -1 3 369.856 3.913 20 0 FHADHM Cc1ccc(C(F)(F)F)cc1NCc1ccc(-c2nnn[n-]2)cc1F ZINC000822230922 599694939 /nfs/dbraw/zinc/69/49/39/599694939.db2.gz VFVGCQJNCUHVBO-UHFFFAOYSA-N -1 3 351.307 3.945 20 0 FHADHM Cc1ccc(C(F)(F)F)cc1NCc1ccc(-c2nn[n-]n2)cc1F ZINC000822230922 599694940 /nfs/dbraw/zinc/69/49/40/599694940.db2.gz VFVGCQJNCUHVBO-UHFFFAOYSA-N -1 3 351.307 3.945 20 0 FHADHM COc1ccc(OC2CCN([C@H](C(=O)[O-])c3ccc(F)cc3)CC2)cc1 ZINC000738047996 599710703 /nfs/dbraw/zinc/71/07/03/599710703.db2.gz NSOVSFNJJBLOTN-IBGZPJMESA-N -1 3 359.397 3.503 20 0 FHADHM O=C([O-])[C@@H](NCc1cccc(C(=O)Nc2ccccc2)c1)c1ccccc1 ZINC000738511670 599787646 /nfs/dbraw/zinc/78/76/46/599787646.db2.gz UQWAQQZFMXTTAS-FQEVSTJZSA-N -1 3 360.413 3.854 20 0 FHADHM CCCCS[C@H](C)C(=O)Nc1ccc(OC(C)C)c(-c2nnn[n-]2)c1 ZINC000821077386 607397207 /nfs/dbraw/zinc/39/72/07/607397207.db2.gz CZKYZUBBAJLOMP-GFCCVEGCSA-N -1 3 363.487 3.514 20 0 FHADHM CCCCS[C@H](C)C(=O)Nc1ccc(OC(C)C)c(-c2nn[n-]n2)c1 ZINC000821077386 607397209 /nfs/dbraw/zinc/39/72/09/607397209.db2.gz CZKYZUBBAJLOMP-GFCCVEGCSA-N -1 3 363.487 3.514 20 0 FHADHM O=C([O-])c1cc(F)ccc1CN1CCC([C@@H](O)c2ccc(F)cc2)CC1 ZINC000740079288 599867782 /nfs/dbraw/zinc/86/77/82/599867782.db2.gz OLTCOOBTZMXCOJ-IBGZPJMESA-N -1 3 361.388 3.609 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)O[C@H](CC(C)C)c1ccccn1 ZINC000826251335 607402925 /nfs/dbraw/zinc/40/29/25/607402925.db2.gz MIDYMHHXPJIPJN-QGZVFWFLSA-N -1 3 351.410 3.514 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)O[C@H](CC(C)C)c1ccccn1 ZINC000826251335 607402927 /nfs/dbraw/zinc/40/29/27/607402927.db2.gz MIDYMHHXPJIPJN-QGZVFWFLSA-N -1 3 351.410 3.514 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1COC(=O)[C@H](C)SCc1ccccc1 ZINC000826252365 607406177 /nfs/dbraw/zinc/40/61/77/607406177.db2.gz AKDHZQUTMACNOO-AWEZNQCLSA-N -1 3 368.462 3.540 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1COC(=O)[C@H](C)SCc1ccccc1 ZINC000826252365 607406179 /nfs/dbraw/zinc/40/61/79/607406179.db2.gz AKDHZQUTMACNOO-AWEZNQCLSA-N -1 3 368.462 3.540 20 0 FHADHM CNC(=O)c1ccc(CN(C)Cc2c3ccccc3sc2C(=O)[O-])cc1 ZINC000737544426 599937502 /nfs/dbraw/zinc/93/75/02/599937502.db2.gz IRYHNJWSOKRBBS-UHFFFAOYSA-N -1 3 368.458 3.591 20 0 FHADHM Cc1cccc(CN(CCN(C)C)C(=O)Nc2cc(C(=O)[O-])ccc2C)c1 ZINC000738709873 599987893 /nfs/dbraw/zinc/98/78/93/599987893.db2.gz ZHGLKVLQQZEXHL-UHFFFAOYSA-N -1 3 369.465 3.597 20 0 FHADHM C[C@H](c1ccc(C(=O)[O-])o1)N1CCC[C@@H](CN(C)C(=O)OC(C)(C)C)C1 ZINC000736716586 600025628 /nfs/dbraw/zinc/02/56/28/600025628.db2.gz HNGIXNLYEMLWIF-KGLIPLIRSA-N -1 3 366.458 3.618 20 0 FHADHM C[C@@H](c1ccc(C(=O)[O-])o1)N1CCC[C@H](CN(C)C(=O)OC(C)(C)C)C1 ZINC000736716587 600025683 /nfs/dbraw/zinc/02/56/83/600025683.db2.gz HNGIXNLYEMLWIF-UONOGXRCSA-N -1 3 366.458 3.618 20 0 FHADHM O=C([O-])c1cc(Cl)ccc1OC(=O)C1CCN(Cc2ccccc2)CC1 ZINC000740076378 600075187 /nfs/dbraw/zinc/07/51/87/600075187.db2.gz YINCXDONFMBFHL-UHFFFAOYSA-N -1 3 373.836 3.856 20 0 FHADHM CN(Cc1ccc(Br)cc1)Cc1ccc(F)cc1C(=O)[O-] ZINC000071265079 600082148 /nfs/dbraw/zinc/08/21/48/600082148.db2.gz FDBRPDLQJBMLNW-UHFFFAOYSA-N -1 3 352.203 3.918 20 0 FHADHM COc1ccc(C2(NCc3cc(C)c(OCC(=O)[O-])c(C)c3)CC2)cc1 ZINC000737981414 600085618 /nfs/dbraw/zinc/08/56/18/600085618.db2.gz KEQYSEGNDZKYCN-UHFFFAOYSA-N -1 3 355.434 3.554 20 0 FHADHM CC(C)[C@@H](NCC(=O)N1CCC(C(=O)[O-])CC1)c1ccc(C(C)(C)C)cc1 ZINC000736388767 600115359 /nfs/dbraw/zinc/11/53/59/600115359.db2.gz DXHSWUFRIWNJPN-HXUWFJFHSA-N -1 3 374.525 3.594 20 0 FHADHM O=C([O-])Nc1cc(NC(=O)c2cccc(CN3CCCC3)c2)ccc1F ZINC000740011503 600122888 /nfs/dbraw/zinc/12/28/88/600122888.db2.gz DVJVBAXJBFDLKV-UHFFFAOYSA-N -1 3 357.385 3.764 20 0 FHADHM CC[C@](NCc1cc(=O)oc2cc(C)c(C)cc12)(C(=O)[O-])c1ccccc1 ZINC000736918671 600127345 /nfs/dbraw/zinc/12/73/45/600127345.db2.gz VQQYOEUYKAVPOG-JOCHJYFZSA-N -1 3 365.429 3.890 20 0 FHADHM O=C([O-])c1occc1CN1CCC([C@@H]2C(=O)Nc3cc(Cl)ccc32)CC1 ZINC000740282422 600147176 /nfs/dbraw/zinc/14/71/76/600147176.db2.gz YIURNCROUNENFP-INIZCTEOSA-N -1 3 374.824 3.579 20 0 FHADHM CCC1(CC)CCN(C(=O)Nc2ccc(OC(C)C)c(-c3nnn[n-]3)c2)C1 ZINC000820958195 607428591 /nfs/dbraw/zinc/42/85/91/607428591.db2.gz SPDGJKDELKHHCV-UHFFFAOYSA-N -1 3 372.473 3.698 20 0 FHADHM CCC1(CC)CCN(C(=O)Nc2ccc(OC(C)C)c(-c3nn[n-]n3)c2)C1 ZINC000820958195 607428593 /nfs/dbraw/zinc/42/85/93/607428593.db2.gz SPDGJKDELKHHCV-UHFFFAOYSA-N -1 3 372.473 3.698 20 0 FHADHM C[C@@H](N[C@@H](C(=O)[O-])c1ccc(F)cc1)c1ccc(NC(=O)C2CC2)cc1 ZINC000736661273 600421559 /nfs/dbraw/zinc/42/15/59/600421559.db2.gz DPKJLQIQDCZVJQ-KZULUSFZSA-N -1 3 356.397 3.651 20 0 FHADHM CCN(CC)C(=O)c1ccc(CN[C@@H](C(=O)[O-])c2cccc(Cl)c2)cc1 ZINC000737083889 600422145 /nfs/dbraw/zinc/42/21/45/600422145.db2.gz BEIHRQRAWSAKHW-GOSISDBHSA-N -1 3 374.868 3.738 20 0 FHADHM O=C([O-])[C@H](NCc1cc(F)cc(Br)c1)c1ccc(F)cc1 ZINC000739499171 600427463 /nfs/dbraw/zinc/42/74/63/600427463.db2.gz GAQZEQJMWDTXJF-CQSZACIVSA-N -1 3 356.166 3.643 20 0 FHADHM COc1cccc2cc([C@H](C)NCc3ccc(-c4nn[n-]n4)cc3F)oc21 ZINC000821877456 607471183 /nfs/dbraw/zinc/47/11/83/607471183.db2.gz KMMMFQCGCPMZJO-NSHDSACASA-N -1 3 367.384 3.611 20 0 FHADHM Cc1oc(CN(CCc2ccc(C)cc2)C[C@@H]2CCCO2)cc1C(=O)[O-] ZINC000519599942 600847865 /nfs/dbraw/zinc/84/78/65/600847865.db2.gz FBOAOLPYZIFRSV-SFHVURJKSA-N -1 3 357.450 3.818 20 0 FHADHM C[C@H](NCc1cccc(OCC(=O)[O-])c1)c1cccc(Br)c1 ZINC000827741069 600864095 /nfs/dbraw/zinc/86/40/95/600864095.db2.gz HPYMBPHMJNZDDM-LBPRGKRZSA-N -1 3 364.239 3.763 20 0 FHADHM Clc1cc(NCc2ccc(-c3nnn[n-]3)cc2)ccc1Br ZINC000822568424 607473555 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/nfs/dbraw/zinc/71/16/19/607711619.db2.gz BSJRWPFAULKPOI-AWEZNQCLSA-N -1 3 365.437 3.706 20 0 FHADHM CC[C@@H](CC(=O)Nc1cc(-c2nn[n-]n2)ccc1C)c1ccc(OC)cc1 ZINC000825080729 607711621 /nfs/dbraw/zinc/71/16/21/607711621.db2.gz BSJRWPFAULKPOI-AWEZNQCLSA-N -1 3 365.437 3.706 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)C[C@H](C)c1ccc(F)cc1F ZINC000826277777 607711788 /nfs/dbraw/zinc/71/17/88/607711788.db2.gz GMIIARMOTURRCL-NSHDSACASA-N -1 3 357.364 3.586 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)C[C@H](C)c1ccc(F)cc1F ZINC000826277777 607711790 /nfs/dbraw/zinc/71/17/90/607711790.db2.gz GMIIARMOTURRCL-NSHDSACASA-N -1 3 357.364 3.586 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1OCc1coc(-c2c(F)cccc2F)n1 ZINC000826279201 607713537 /nfs/dbraw/zinc/71/35/37/607713537.db2.gz ISDNFUZPCRZNPM-UHFFFAOYSA-N -1 3 369.331 3.687 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1OCc1coc(-c2c(F)cccc2F)n1 ZINC000826279201 607713539 /nfs/dbraw/zinc/71/35/39/607713539.db2.gz ISDNFUZPCRZNPM-UHFFFAOYSA-N -1 3 369.331 3.687 20 0 FHADHM CC(C)c1ccccc1OCCC(=O)OCc1cccc(-c2nnn[n-]2)c1 ZINC000824353104 607718873 /nfs/dbraw/zinc/71/88/73/607718873.db2.gz XXCOYMSCGRJBAM-UHFFFAOYSA-N -1 3 366.421 3.502 20 0 FHADHM CC(C)c1ccccc1OCCC(=O)OCc1cccc(-c2nn[n-]n2)c1 ZINC000824353104 607718875 /nfs/dbraw/zinc/71/88/75/607718875.db2.gz XXCOYMSCGRJBAM-UHFFFAOYSA-N -1 3 366.421 3.502 20 0 FHADHM CC(C)(C(=O)[O-])[C@@H]1CCCN(Cc2nnc(-c3cccc(Cl)c3)o2)C1 ZINC000833420227 604937165 /nfs/dbraw/zinc/93/71/65/604937165.db2.gz PCFWSKRVYPCNIP-CYBMUJFWSA-N -1 3 363.845 3.713 20 0 FHADHM C[C@@H](NCc1ccc(CCNC(=O)[O-])cc1)c1ccc2c(c1)OCCCO2 ZINC000825503819 604942601 /nfs/dbraw/zinc/94/26/01/604942601.db2.gz XQGCYIQBLRBDFX-OAHLLOKOSA-N -1 3 370.449 3.509 20 0 FHADHM Cc1[nH]c2ccc(Cl)cc2c1C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000826233750 607724450 /nfs/dbraw/zinc/72/44/50/607724450.db2.gz UTXGKXUEEMYBIX-UHFFFAOYSA-N -1 3 370.775 3.701 20 0 FHADHM Cc1[nH]c2ccc(Cl)cc2c1C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000826233750 607724451 /nfs/dbraw/zinc/72/44/51/607724451.db2.gz UTXGKXUEEMYBIX-UHFFFAOYSA-N -1 3 370.775 3.701 20 0 FHADHM Cc1cccc(-c2nnc([C@@H](C)N3CCC[C@H](C(C)(C)C(=O)[O-])C3)o2)c1 ZINC000833752262 604946857 /nfs/dbraw/zinc/94/68/57/604946857.db2.gz ORJOYXWUHCAZKR-ZBFHGGJFSA-N -1 3 357.454 3.929 20 0 FHADHM CC(C)C[C@H](NC(=O)CN1CCC[C@@H](C(C)(C)C(=O)[O-])C1)c1ccccc1 ZINC000833478869 604953515 /nfs/dbraw/zinc/95/35/15/604953515.db2.gz VUUISUDNWPNZNU-MOPGFXCFSA-N -1 3 374.525 3.713 20 0 FHADHM COc1cc([C@H](C)N[C@H](C(=O)[O-])c2cccnc2)ccc1OCC(C)C ZINC000831956189 604991084 /nfs/dbraw/zinc/99/10/84/604991084.db2.gz RZCOHTNOPLIHNG-LIRRHRJNSA-N -1 3 358.438 3.602 20 0 FHADHM O=C([O-])[C@@H](NCc1ccc(COCc2ccccc2)cc1)c1cccnc1 ZINC000833165581 604993896 /nfs/dbraw/zinc/99/38/96/604993896.db2.gz KQIXLGPEDVNNOA-NRFANRHFSA-N -1 3 362.429 3.714 20 0 FHADHM O=C([O-])[C@H](NCc1ccccc1COCc1ccccc1)c1cccnc1 ZINC000833170098 604993926 /nfs/dbraw/zinc/99/39/26/604993926.db2.gz PARWMABXKDBWOT-OAQYLSRUSA-N -1 3 362.429 3.714 20 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DBSKKQUJUZOJRL-JTQLQIEISA-N -1 3 357.364 3.586 20 0 FHADHM Cc1c(NC(=O)C[C@H](C)c2ccc(F)cc2F)cccc1-c1nn[n-]n1 ZINC000826240667 607754443 /nfs/dbraw/zinc/75/44/43/607754443.db2.gz DBSKKQUJUZOJRL-JTQLQIEISA-N -1 3 357.364 3.586 20 0 FHADHM O=C([O-])N1CCC[C@@H]1[C@H]1CCCN(Cc2cnc(-c3ccncc3)s2)C1 ZINC000834103448 605468238 /nfs/dbraw/zinc/46/82/38/605468238.db2.gz BLECRELNOBUJSX-DOTOQJQBSA-N -1 3 372.494 3.560 20 0 FHADHM C[C@@H](NC(=O)Nc1cccc2ccsc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000824505833 607761724 /nfs/dbraw/zinc/76/17/24/607761724.db2.gz IDCBZIJMAGJTQG-LLVKDONJSA-N -1 3 364.434 3.964 20 0 FHADHM C[C@@H](NC(=O)Nc1cccc2ccsc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000824505833 607761725 /nfs/dbraw/zinc/76/17/25/607761725.db2.gz IDCBZIJMAGJTQG-LLVKDONJSA-N -1 3 364.434 3.964 20 0 FHADHM O=C([O-])N1CCC(N[C@H](c2cc3ccccc3o2)c2cccnc2)CC1 ZINC000834081720 605685269 /nfs/dbraw/zinc/68/52/69/605685269.db2.gz FAVDUVCCWILCJH-IBGZPJMESA-N -1 3 351.406 3.649 20 0 FHADHM O=C(CCC1CCC1)Nc1nc(-c2cccc(-c3nnn[n-]3)c2)cs1 ZINC000826405859 607770760 /nfs/dbraw/zinc/77/07/60/607770760.db2.gz WYEJDVPBUDBWPE-UHFFFAOYSA-N -1 3 354.439 3.509 20 0 FHADHM O=C(CCC1CCC1)Nc1nc(-c2cccc(-c3nn[n-]n3)c2)cs1 ZINC000826405859 607770761 /nfs/dbraw/zinc/77/07/61/607770761.db2.gz WYEJDVPBUDBWPE-UHFFFAOYSA-N -1 3 354.439 3.509 20 0 FHADHM O=C([O-])N[C@@H]1C[C@H](NCc2ccc(N3CCCCC3)nc2)c2ccccc21 ZINC000834159873 605792780 /nfs/dbraw/zinc/79/27/80/605792780.db2.gz ZDJFEGNICDSYIK-RBUKOAKNSA-N -1 3 366.465 3.615 20 0 FHADHM Cn1cc(CN[C@@H]2C[C@H](NC(=O)[O-])c3ccccc32)c(-c2ccccc2)n1 ZINC000833946737 605984014 /nfs/dbraw/zinc/98/40/14/605984014.db2.gz LVDRNFDCECRCOM-MOPGFXCFSA-N -1 3 362.433 3.630 20 0 FHADHM Cn1cc(CN[C@H]2C[C@H](NC(=O)[O-])c3ccccc32)c(-c2ccccc2)n1 ZINC000833946738 605984098 /nfs/dbraw/zinc/98/40/98/605984098.db2.gz LVDRNFDCECRCOM-OALUTQOASA-N -1 3 362.433 3.630 20 0 FHADHM c1ccc2nc(Nc3ccc(N4CCCCC4)nc3)c(-c3nnn[n-]3)cc2c1 ZINC000823802666 606036632 /nfs/dbraw/zinc/03/66/32/606036632.db2.gz XAXOCZZUGNSRCT-UHFFFAOYSA-N -1 3 372.436 3.544 20 0 FHADHM c1ccc2nc(Nc3ccc(N4CCCCC4)nc3)c(-c3nn[n-]n3)cc2c1 ZINC000823802666 606036638 /nfs/dbraw/zinc/03/66/38/606036638.db2.gz XAXOCZZUGNSRCT-UHFFFAOYSA-N -1 3 372.436 3.544 20 0 FHADHM CCOc1ccccc1[C@@H](CC(C)C)Nc1ncccc1-c1nnn[n-]1 ZINC000821431222 606041917 /nfs/dbraw/zinc/04/19/17/606041917.db2.gz MXULPRAKLDIORN-MRXNPFEDSA-N -1 3 352.442 3.860 20 0 FHADHM CCOc1ccccc1[C@@H](CC(C)C)Nc1ncccc1-c1nn[n-]n1 ZINC000821431222 606041920 /nfs/dbraw/zinc/04/19/20/606041920.db2.gz MXULPRAKLDIORN-MRXNPFEDSA-N -1 3 352.442 3.860 20 0 FHADHM c1ccc2c(c1)cccc2C1=CCN(c2ccc(-c3nnn[n-]3)nc2)CC1 ZINC000819718448 606063121 /nfs/dbraw/zinc/06/31/21/606063121.db2.gz HLDOZRFVCQYUCM-UHFFFAOYSA-N -1 3 354.417 3.709 20 0 FHADHM c1ccc2c(c1)cccc2C1=CCN(c2ccc(-c3nn[n-]n3)nc2)CC1 ZINC000819718448 606063125 /nfs/dbraw/zinc/06/31/25/606063125.db2.gz HLDOZRFVCQYUCM-UHFFFAOYSA-N -1 3 354.417 3.709 20 0 FHADHM CCS[C@H]1CCCCN(c2nc3ccccc3cc2-c2nnn[n-]2)C1 ZINC000821455738 606081697 /nfs/dbraw/zinc/08/16/97/606081697.db2.gz LPKWCLYMKUOWLN-AWEZNQCLSA-N -1 3 354.483 3.527 20 0 FHADHM CCS[C@H]1CCCCN(c2nc3ccccc3cc2-c2nn[n-]n2)C1 ZINC000821455738 606081700 /nfs/dbraw/zinc/08/17/00/606081700.db2.gz LPKWCLYMKUOWLN-AWEZNQCLSA-N -1 3 354.483 3.527 20 0 FHADHM Cc1ccc(CCC(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCCC3)o1 ZINC000822235213 606101993 /nfs/dbraw/zinc/10/19/93/606101993.db2.gz XOXXQJRVVVOOCY-UHFFFAOYSA-N -1 3 371.466 3.670 20 0 FHADHM Cc1ccc(CCC(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCCC3)o1 ZINC000822235213 606101994 /nfs/dbraw/zinc/10/19/94/606101994.db2.gz XOXXQJRVVVOOCY-UHFFFAOYSA-N -1 3 371.466 3.670 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)C[C@@H](C)c2ccc(OC)cc2)s1 ZINC000821465157 606126296 /nfs/dbraw/zinc/12/62/96/606126296.db2.gz CQLYQOUGABKHOP-LLVKDONJSA-N -1 3 371.466 3.632 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)C[C@@H](C)c2ccc(OC)cc2)s1 ZINC000821465157 606126297 /nfs/dbraw/zinc/12/62/97/606126297.db2.gz CQLYQOUGABKHOP-LLVKDONJSA-N -1 3 371.466 3.632 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)c2ccc(O[C@H](C)CC)cc2)s1 ZINC000821466385 606126903 /nfs/dbraw/zinc/12/69/03/606126903.db2.gz WDFAAZBYVBFCTR-LLVKDONJSA-N -1 3 371.466 3.920 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)c2ccc(O[C@H](C)CC)cc2)s1 ZINC000821466385 606126905 /nfs/dbraw/zinc/12/69/05/606126905.db2.gz WDFAAZBYVBFCTR-LLVKDONJSA-N -1 3 371.466 3.920 20 0 FHADHM CSc1ccc(NC(=O)c2sccc2-c2nnn[n-]2)cc1Cl ZINC000821984879 606150824 /nfs/dbraw/zinc/15/08/24/606150824.db2.gz VWXOHZMAAWMXLO-UHFFFAOYSA-N -1 3 351.844 3.556 20 0 FHADHM CSc1ccc(NC(=O)c2sccc2-c2nn[n-]n2)cc1Cl ZINC000821984879 606150825 /nfs/dbraw/zinc/15/08/25/606150825.db2.gz VWXOHZMAAWMXLO-UHFFFAOYSA-N -1 3 351.844 3.556 20 0 FHADHM c1ccc2nc(N3CCSC4(CCCCC4)C3)c(-c3nnn[n-]3)cc2c1 ZINC000823802042 606201151 /nfs/dbraw/zinc/20/11/51/606201151.db2.gz GANDFYWZNUDIJL-UHFFFAOYSA-N -1 3 366.494 3.671 20 0 FHADHM c1ccc2nc(N3CCSC4(CCCCC4)C3)c(-c3nn[n-]n3)cc2c1 ZINC000823802042 606201153 /nfs/dbraw/zinc/20/11/53/606201153.db2.gz GANDFYWZNUDIJL-UHFFFAOYSA-N -1 3 366.494 3.671 20 0 FHADHM Cc1ccc(CCCC(=O)O[C@H](C)c2cccc(-c3nnn[n-]3)c2)s1 ZINC000822235911 606206050 /nfs/dbraw/zinc/20/60/50/606206050.db2.gz BLIZSTOPWBYSGT-CYBMUJFWSA-N -1 3 356.451 3.864 20 0 FHADHM Cc1ccc(CCCC(=O)O[C@H](C)c2cccc(-c3nn[n-]n3)c2)s1 ZINC000822235911 606206052 /nfs/dbraw/zinc/20/60/52/606206052.db2.gz BLIZSTOPWBYSGT-CYBMUJFWSA-N -1 3 356.451 3.864 20 0 FHADHM O=C(Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1)[C@@H]1C[C@@H]1C1CC1 ZINC000823383802 606231627 /nfs/dbraw/zinc/23/16/27/606231627.db2.gz ZZHJIGXTTTWXRA-CHWSQXEVSA-N -1 3 351.435 3.580 20 0 FHADHM O=C(Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1)[C@@H]1C[C@@H]1C1CC1 ZINC000823383802 606231629 /nfs/dbraw/zinc/23/16/29/606231629.db2.gz ZZHJIGXTTTWXRA-CHWSQXEVSA-N -1 3 351.435 3.580 20 0 FHADHM c1sc(CCc2ccccc2)nc1CNc1ccc(-c2nn[n-]n2)cc1 ZINC000823779952 606233072 /nfs/dbraw/zinc/23/30/72/606233072.db2.gz LZTFLDWPVMXIJP-UHFFFAOYSA-N -1 3 362.462 3.721 20 0 FHADHM Clc1cnc(Oc2ccc(Oc3ccc(-c4nn[n-]n4)cc3)cc2)nc1 ZINC000822590059 606242125 /nfs/dbraw/zinc/24/21/25/606242125.db2.gz GXRHPQMBFXNCTH-UHFFFAOYSA-N -1 3 366.768 3.895 20 0 FHADHM CCCCN(C)C(=O)c1ccc(Sc2ccccc2-c2nnn[n-]2)cc1 ZINC000821060379 606249242 /nfs/dbraw/zinc/24/92/42/606249242.db2.gz COVJPWYCQILJCO-UHFFFAOYSA-N -1 3 367.478 3.890 20 0 FHADHM CCCCN(C)C(=O)c1ccc(Sc2ccccc2-c2nn[n-]n2)cc1 ZINC000821060379 606249244 /nfs/dbraw/zinc/24/92/44/606249244.db2.gz COVJPWYCQILJCO-UHFFFAOYSA-N -1 3 367.478 3.890 20 0 FHADHM Cc1cccc(Oc2ccc(NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)cc2)c1 ZINC000822331290 606249494 /nfs/dbraw/zinc/24/94/94/606249494.db2.gz BVWRFUMFNXKYMC-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM Cc1cccc(Oc2ccc(NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)cc2)c1 ZINC000822331290 606249497 /nfs/dbraw/zinc/24/94/97/606249497.db2.gz BVWRFUMFNXKYMC-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM CCN(C(=O)c1ccc(Sc2ccccc2-c2nnn[n-]2)cc1)C(C)C ZINC000821159485 606260554 /nfs/dbraw/zinc/26/05/54/606260554.db2.gz CEAYJPYDOXWMRS-UHFFFAOYSA-N -1 3 367.478 3.888 20 0 FHADHM CCN(C(=O)c1ccc(Sc2ccccc2-c2nn[n-]n2)cc1)C(C)C ZINC000821159485 606260556 /nfs/dbraw/zinc/26/05/56/606260556.db2.gz CEAYJPYDOXWMRS-UHFFFAOYSA-N -1 3 367.478 3.888 20 0 FHADHM CC[C@@H](C)Sc1ccc(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)c(C)c1 ZINC000820882309 606265050 /nfs/dbraw/zinc/26/50/50/606265050.db2.gz PDEBTRPDWZQOKV-LLVKDONJSA-N -1 3 356.455 3.646 20 0 FHADHM CC[C@@H](C)Sc1ccc(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)c(C)c1 ZINC000820882309 606265052 /nfs/dbraw/zinc/26/50/52/606265052.db2.gz PDEBTRPDWZQOKV-LLVKDONJSA-N -1 3 356.455 3.646 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1ccc(C(F)F)cc1 ZINC000821123718 606282159 /nfs/dbraw/zinc/28/21/59/606282159.db2.gz WFRMFRMNTCHEHT-UHFFFAOYSA-N -1 3 372.379 3.879 20 0 FHADHM CN(C(=O)c1ccc(Sc2ccccc2-c2nnn[n-]2)cc1)C1CCC1 ZINC000821574586 606285450 /nfs/dbraw/zinc/28/54/50/606285450.db2.gz NGUMJMANKSCVEQ-UHFFFAOYSA-N -1 3 365.462 3.642 20 0 FHADHM CN(C(=O)c1ccc(Sc2ccccc2-c2nn[n-]n2)cc1)C1CCC1 ZINC000821574586 606285451 /nfs/dbraw/zinc/28/54/51/606285451.db2.gz NGUMJMANKSCVEQ-UHFFFAOYSA-N -1 3 365.462 3.642 20 0 FHADHM Cc1ccc(Oc2ccccc2NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)cc1 ZINC000822266616 606312782 /nfs/dbraw/zinc/31/27/82/606312782.db2.gz FJMCFQUFWJWIBF-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM Cc1ccc(Oc2ccccc2NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)cc1 ZINC000822266616 606312783 /nfs/dbraw/zinc/31/27/83/606312783.db2.gz FJMCFQUFWJWIBF-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM O=C(Nc1ccccc1Sc1ccccc1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC000823373173 606314527 /nfs/dbraw/zinc/31/45/27/606314527.db2.gz SIDOUOHWBSEZJI-UHFFFAOYSA-N -1 3 362.418 3.598 20 0 FHADHM O=C(Nc1ccccc1Sc1ccccc1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC000823373173 606314528 /nfs/dbraw/zinc/31/45/28/606314528.db2.gz SIDOUOHWBSEZJI-UHFFFAOYSA-N -1 3 362.418 3.598 20 0 FHADHM Cc1cccc(C)c1Oc1ccccc1NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC000822299655 606317698 /nfs/dbraw/zinc/31/76/98/606317698.db2.gz QGNDCFGUUVARJK-UHFFFAOYSA-N -1 3 374.404 3.856 20 0 FHADHM Cc1cccc(C)c1Oc1ccccc1NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC000822299655 606317701 /nfs/dbraw/zinc/31/77/01/606317701.db2.gz QGNDCFGUUVARJK-UHFFFAOYSA-N -1 3 374.404 3.856 20 0 FHADHM Cc1cc(Cl)ccc1OCC(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000822202383 606341540 /nfs/dbraw/zinc/34/15/40/606341540.db2.gz XVGHWLQINAOSKA-LBPRGKRZSA-N -1 3 372.812 3.512 20 0 FHADHM Cc1cc(Cl)ccc1OCC(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000822202383 606341542 /nfs/dbraw/zinc/34/15/42/606341542.db2.gz XVGHWLQINAOSKA-LBPRGKRZSA-N -1 3 372.812 3.512 20 0 FHADHM C[C@H](OC(=O)[C@H]1C[C@@H]1c1c(F)cccc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000820487734 606342053 /nfs/dbraw/zinc/34/20/53/606342053.db2.gz IHCCIPJRVYCWNL-BPNCWPANSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@H]1C[C@@H]1c1c(F)cccc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000820487734 606342055 /nfs/dbraw/zinc/34/20/55/606342055.db2.gz IHCCIPJRVYCWNL-BPNCWPANSA-N -1 3 370.359 3.553 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CC[C@H](c2ccccc2)[C@H]1C ZINC000822218193 606345334 /nfs/dbraw/zinc/34/53/34/606345334.db2.gz ZNDQFJRMTNYJJL-PBHICJAKSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CC[C@H](c2ccccc2)[C@H]1C ZINC000822218193 606345336 /nfs/dbraw/zinc/34/53/36/606345336.db2.gz ZNDQFJRMTNYJJL-PBHICJAKSA-N -1 3 362.437 3.585 20 0 FHADHM C[C@@H](OC(=O)C12CC3CC(CC(C3)C1)C2)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488112 606346123 /nfs/dbraw/zinc/34/61/23/606346123.db2.gz LFNLJPLAFOFWFV-JSFDKUKPSA-N -1 3 352.438 3.687 20 0 FHADHM C[C@@H](OC(=O)C12CC3CC(CC(C3)C1)C2)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488112 606346126 /nfs/dbraw/zinc/34/61/26/606346126.db2.gz LFNLJPLAFOFWFV-JSFDKUKPSA-N -1 3 352.438 3.687 20 0 FHADHM C[C@@H](OC(=O)CCSc1ccc(F)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820495668 606357509 /nfs/dbraw/zinc/35/75/09/606357509.db2.gz IUUMCEWCMYKPAP-GFCCVEGCSA-N -1 3 372.425 3.792 20 0 FHADHM C[C@@H](OC(=O)CCSc1ccc(F)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820495668 606357511 /nfs/dbraw/zinc/35/75/11/606357511.db2.gz IUUMCEWCMYKPAP-GFCCVEGCSA-N -1 3 372.425 3.792 20 0 FHADHM C[C@H](OC(=O)Cc1coc2cc(F)ccc12)c1ccc(-c2nnn[n-]2)cc1 ZINC000820502242 606359417 /nfs/dbraw/zinc/35/94/17/606359417.db2.gz ONZZOIDLPFYOIR-NSHDSACASA-N -1 3 366.352 3.599 20 0 FHADHM C[C@H](OC(=O)Cc1coc2cc(F)ccc12)c1ccc(-c2nn[n-]n2)cc1 ZINC000820502242 606359419 /nfs/dbraw/zinc/35/94/19/606359419.db2.gz ONZZOIDLPFYOIR-NSHDSACASA-N -1 3 366.352 3.599 20 0 FHADHM C[C@H](OC(=O)[C@@H]1C[C@@H]1c1ccc(F)c(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488997 606359540 /nfs/dbraw/zinc/35/95/40/606359540.db2.gz XTLNRPFUAKFZJT-COLVAYQJSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@@H]1C[C@@H]1c1ccc(F)c(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488997 606359542 /nfs/dbraw/zinc/35/95/42/606359542.db2.gz XTLNRPFUAKFZJT-COLVAYQJSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@@H]1C[C@H]1c1ccc(F)c(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488999 606359571 /nfs/dbraw/zinc/35/95/71/606359571.db2.gz XTLNRPFUAKFZJT-NZVBXONLSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@@H]1C[C@H]1c1ccc(F)c(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488999 606359572 /nfs/dbraw/zinc/35/95/72/606359572.db2.gz XTLNRPFUAKFZJT-NZVBXONLSA-N -1 3 370.359 3.553 20 0 FHADHM CN(C(=O)c1ccc(F)cc1Cl)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821574681 606412434 /nfs/dbraw/zinc/41/24/34/606412434.db2.gz RQUUVDQXDYKPFX-UHFFFAOYSA-N -1 3 366.183 3.589 20 0 FHADHM CN(C(=O)c1ccc(F)cc1Cl)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821574681 606412436 /nfs/dbraw/zinc/41/24/36/606412436.db2.gz RQUUVDQXDYKPFX-UHFFFAOYSA-N -1 3 366.183 3.589 20 0 FHADHM Fc1ccc([C@H](NCc2ccc(-c3nnn[n-]3)s2)c2ccccc2)cc1 ZINC000822766116 606413226 /nfs/dbraw/zinc/41/32/26/606413226.db2.gz DTJURXIPDAWHNY-GOSISDBHSA-N -1 3 365.437 3.947 20 0 FHADHM Cc1ccnc(Oc2cc(Nc3ncccc3-c3nnn[n-]3)ccc2C)c1 ZINC000822378550 606433070 /nfs/dbraw/zinc/43/30/70/606433070.db2.gz BJFNVPGHJLQXKX-UHFFFAOYSA-N -1 3 359.393 3.809 20 0 FHADHM Cc1ccnc(Oc2cc(Nc3ncccc3-c3nn[n-]n3)ccc2C)c1 ZINC000822378550 606433071 /nfs/dbraw/zinc/43/30/71/606433071.db2.gz BJFNVPGHJLQXKX-UHFFFAOYSA-N -1 3 359.393 3.809 20 0 FHADHM Cc1ccc(NC(=O)c2cccc(Oc3ncccc3-c3nnn[n-]3)c2)cc1 ZINC000822254695 606433198 /nfs/dbraw/zinc/43/31/98/606433198.db2.gz OYQGZNOAMWIZRL-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM C[C@@H]1CCCN1C(=O)c1ccc(Sc2ccccc2-c2nnn[n-]2)cc1 ZINC000820710641 606436772 /nfs/dbraw/zinc/43/67/72/606436772.db2.gz RIMUQUXHWJHBIO-CYBMUJFWSA-N -1 3 365.462 3.642 20 0 FHADHM C[C@@H]1CCCN1C(=O)c1ccc(Sc2ccccc2-c2nn[n-]n2)cc1 ZINC000820710641 606436774 /nfs/dbraw/zinc/43/67/74/606436774.db2.gz RIMUQUXHWJHBIO-CYBMUJFWSA-N -1 3 365.462 3.642 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)cc1CNc1ccc(Br)cc1F ZINC000822761223 606442316 /nfs/dbraw/zinc/44/23/16/606442316.db2.gz CSVHRIFRGLORGA-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CNc1ccc(Br)cc1F ZINC000822761223 606442318 /nfs/dbraw/zinc/44/23/18/606442318.db2.gz CSVHRIFRGLORGA-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Cc1cc(C)c2ncc(-c3nnn[n-]3)c(N3CCC[C@@H]3c3cccnc3)c2c1 ZINC000822195220 606444464 /nfs/dbraw/zinc/44/44/64/606444464.db2.gz KLZDNCCLLZKGFT-GOSISDBHSA-N -1 3 371.448 3.768 20 0 FHADHM Cc1cc(C)c2ncc(-c3nn[n-]n3)c(N3CCC[C@@H]3c3cccnc3)c2c1 ZINC000822195220 606444465 /nfs/dbraw/zinc/44/44/65/606444465.db2.gz KLZDNCCLLZKGFT-GOSISDBHSA-N -1 3 371.448 3.768 20 0 FHADHM Cc1ccc(NCc2cc(-c3nnn[n-]3)ccc2F)cc1Br ZINC000822254414 606444751 /nfs/dbraw/zinc/44/47/51/606444751.db2.gz JDCLCSHWTUHAQN-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Cc1ccc(NCc2cc(-c3nn[n-]n3)ccc2F)cc1Br ZINC000822254414 606444753 /nfs/dbraw/zinc/44/47/53/606444753.db2.gz JDCLCSHWTUHAQN-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM O=C(c1ccccc1)c1cccc(NCc2cc(-c3nnn[n-]3)ccc2F)c1 ZINC000823493391 606456287 /nfs/dbraw/zinc/45/62/87/606456287.db2.gz NAGRCIOZPOUDQY-UHFFFAOYSA-N -1 3 373.391 3.849 20 0 FHADHM O=C(c1ccccc1)c1cccc(NCc2cc(-c3nn[n-]n3)ccc2F)c1 ZINC000823493391 606456288 /nfs/dbraw/zinc/45/62/88/606456288.db2.gz NAGRCIOZPOUDQY-UHFFFAOYSA-N -1 3 373.391 3.849 20 0 FHADHM O=C(Nc1cc(C(F)(F)F)ccc1Cl)c1cc(-c2nnn[n-]2)cs1 ZINC000823299224 606475982 /nfs/dbraw/zinc/47/59/82/606475982.db2.gz NAVGMODAHDPACM-UHFFFAOYSA-N -1 3 373.747 3.853 20 0 FHADHM O=C(Nc1cc(C(F)(F)F)ccc1Cl)c1cc(-c2nn[n-]n2)cs1 ZINC000823299224 606475984 /nfs/dbraw/zinc/47/59/84/606475984.db2.gz NAVGMODAHDPACM-UHFFFAOYSA-N -1 3 373.747 3.853 20 0 FHADHM Cc1cscc1C(=O)Nc1sc2c(c1-c1nnn[n-]1)CC[C@@H](C)C2 ZINC000822414518 606489429 /nfs/dbraw/zinc/48/94/29/606489429.db2.gz IYWDOCOCGHBNCB-MRVPVSSYSA-N -1 3 359.480 3.675 20 0 FHADHM Cc1cscc1C(=O)Nc1sc2c(c1-c1nn[n-]n1)CC[C@@H](C)C2 ZINC000822414518 606489430 /nfs/dbraw/zinc/48/94/30/606489430.db2.gz IYWDOCOCGHBNCB-MRVPVSSYSA-N -1 3 359.480 3.675 20 0 FHADHM CC(C)N(Cc1cccc(Cl)c1)C(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000820120623 606491853 /nfs/dbraw/zinc/49/18/53/606491853.db2.gz GLSWNMLVQDDRPI-UHFFFAOYSA-N -1 3 361.858 3.632 20 0 FHADHM CC(C)N(Cc1cccc(Cl)c1)C(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000820120623 606491855 /nfs/dbraw/zinc/49/18/55/606491855.db2.gz GLSWNMLVQDDRPI-UHFFFAOYSA-N -1 3 361.858 3.632 20 0 FHADHM O=C(c1cc(-c2nnn[n-]2)cs1)N(Cc1cccc(F)c1)C1CCCC1 ZINC000823466231 606492697 /nfs/dbraw/zinc/49/26/97/606492697.db2.gz HJUKYELOLIRNNV-UHFFFAOYSA-N -1 3 371.441 3.652 20 0 FHADHM O=C(c1cc(-c2nn[n-]n2)cs1)N(Cc1cccc(F)c1)C1CCCC1 ZINC000823466231 606492699 /nfs/dbraw/zinc/49/26/99/606492699.db2.gz HJUKYELOLIRNNV-UHFFFAOYSA-N -1 3 371.441 3.652 20 0 FHADHM CCC(CC)[C@H](NC(=O)c1cc(-c2nnn[n-]2)cs1)c1cccs1 ZINC000820893584 606497014 /nfs/dbraw/zinc/49/70/14/606497014.db2.gz RWCYYQAELFWVNJ-AWEZNQCLSA-N -1 3 361.496 3.897 20 0 FHADHM CCC(CC)[C@H](NC(=O)c1cc(-c2nn[n-]n2)cs1)c1cccs1 ZINC000820893584 606497016 /nfs/dbraw/zinc/49/70/16/606497016.db2.gz RWCYYQAELFWVNJ-AWEZNQCLSA-N -1 3 361.496 3.897 20 0 FHADHM CN(C(=O)c1cc(-c2nnn[n-]2)cs1)c1ccccc1-c1ccccc1 ZINC000821573626 606498937 /nfs/dbraw/zinc/49/89/37/606498937.db2.gz XYAFTHBBIGKANC-UHFFFAOYSA-N -1 3 361.430 3.872 20 0 FHADHM CN(C(=O)c1cc(-c2nn[n-]n2)cs1)c1ccccc1-c1ccccc1 ZINC000821573626 606498938 /nfs/dbraw/zinc/49/89/38/606498938.db2.gz XYAFTHBBIGKANC-UHFFFAOYSA-N -1 3 361.430 3.872 20 0 FHADHM CC(C)N(C(=O)c1cc(-c2nnn[n-]2)cs1)c1ccc(F)cc1Cl ZINC000820111624 606502095 /nfs/dbraw/zinc/50/20/95/606502095.db2.gz CNAPGTCFMHUPAT-UHFFFAOYSA-N -1 3 365.821 3.776 20 0 FHADHM CC(C)N(C(=O)c1cc(-c2nn[n-]n2)cs1)c1ccc(F)cc1Cl ZINC000820111624 606502097 /nfs/dbraw/zinc/50/20/97/606502097.db2.gz CNAPGTCFMHUPAT-UHFFFAOYSA-N -1 3 365.821 3.776 20 0 FHADHM Cc1cscc1C(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)CC(C)C ZINC000822414881 606505917 /nfs/dbraw/zinc/50/59/17/606505917.db2.gz YKQZREYFWXNQHC-UHFFFAOYSA-N -1 3 355.467 3.535 20 0 FHADHM Cc1cscc1C(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)CC(C)C ZINC000822414881 606505919 /nfs/dbraw/zinc/50/59/19/606505919.db2.gz YKQZREYFWXNQHC-UHFFFAOYSA-N -1 3 355.467 3.535 20 0 FHADHM O=C(Cc1cccc(-c2nnn[n-]2)c1)Nc1ccc(-c2ccccc2)cc1F ZINC000823103458 606507514 /nfs/dbraw/zinc/50/75/14/606507514.db2.gz HGIVZCAMJXYLCT-UHFFFAOYSA-N -1 3 373.391 3.854 20 0 FHADHM O=C(Cc1cccc(-c2nn[n-]n2)c1)Nc1ccc(-c2ccccc2)cc1F ZINC000823103458 606507516 /nfs/dbraw/zinc/50/75/16/606507516.db2.gz HGIVZCAMJXYLCT-UHFFFAOYSA-N -1 3 373.391 3.854 20 0 FHADHM O=C(Cc1cccc(-c2nnn[n-]2)c1)N1Cc2ccccc2-c2ccccc21 ZINC000823092904 606515624 /nfs/dbraw/zinc/51/56/24/606515624.db2.gz OGZRQYZLVUCLQY-UHFFFAOYSA-N -1 3 367.412 3.623 20 0 FHADHM O=C(Cc1cccc(-c2nn[n-]n2)c1)N1Cc2ccccc2-c2ccccc21 ZINC000823092904 606515627 /nfs/dbraw/zinc/51/56/27/606515627.db2.gz OGZRQYZLVUCLQY-UHFFFAOYSA-N -1 3 367.412 3.623 20 0 FHADHM O=C(c1cc(-c2nnn[n-]2)cs1)N1Cc2ccccc2-c2ccccc2C1 ZINC000823472460 606540338 /nfs/dbraw/zinc/54/03/38/606540338.db2.gz NIUFHJSNOHHOKK-UHFFFAOYSA-N -1 3 373.441 3.751 20 0 FHADHM O=C(c1cc(-c2nn[n-]n2)cs1)N1Cc2ccccc2-c2ccccc2C1 ZINC000823472460 606540340 /nfs/dbraw/zinc/54/03/40/606540340.db2.gz NIUFHJSNOHHOKK-UHFFFAOYSA-N -1 3 373.441 3.751 20 0 FHADHM C[C@H](NC(=O)Cc1cccc(-c2nnn[n-]2)c1)c1cc2ccccc2s1 ZINC000820334177 606555078 /nfs/dbraw/zinc/55/50/78/606555078.db2.gz KJKCXFBBPPNDEI-LBPRGKRZSA-N -1 3 363.446 3.501 20 0 FHADHM C[C@H](NC(=O)Cc1cccc(-c2nn[n-]n2)c1)c1cc2ccccc2s1 ZINC000820334177 606555081 /nfs/dbraw/zinc/55/50/81/606555081.db2.gz KJKCXFBBPPNDEI-LBPRGKRZSA-N -1 3 363.446 3.501 20 0 FHADHM C[C@H](OC(=O)c1cc(-c2nnn[n-]2)cs1)c1ncc(-c2ccccc2)o1 ZINC000820508474 606570102 /nfs/dbraw/zinc/57/01/02/606570102.db2.gz PKFUMYDYKNBROQ-JTQLQIEISA-N -1 3 367.390 3.501 20 0 FHADHM C[C@H](OC(=O)c1cc(-c2nn[n-]n2)cs1)c1ncc(-c2ccccc2)o1 ZINC000820508474 606570103 /nfs/dbraw/zinc/57/01/03/606570103.db2.gz PKFUMYDYKNBROQ-JTQLQIEISA-N -1 3 367.390 3.501 20 0 FHADHM C[C@@H]1CCCN1C(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)cc1 ZINC000820708961 606574150 /nfs/dbraw/zinc/57/41/50/606574150.db2.gz AXNURKIBHZXMJR-CYBMUJFWSA-N -1 3 364.409 3.675 20 0 FHADHM C[C@@H]1CCCN1C(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)cc1 ZINC000820708961 606574151 /nfs/dbraw/zinc/57/41/51/606574151.db2.gz AXNURKIBHZXMJR-CYBMUJFWSA-N -1 3 364.409 3.675 20 0 FHADHM FC(F)(F)[C@H]1CCC[C@H](CNc2ncc(-c3nnn[n-]3)cc2Cl)C1 ZINC000822714490 606595208 /nfs/dbraw/zinc/59/52/08/606595208.db2.gz NVSLEEUAVXDXMN-WPRPVWTQSA-N -1 3 360.771 3.696 20 0 FHADHM FC(F)(F)[C@H]1CCC[C@H](CNc2ncc(-c3nn[n-]n3)cc2Cl)C1 ZINC000822714490 606595209 /nfs/dbraw/zinc/59/52/09/606595209.db2.gz NVSLEEUAVXDXMN-WPRPVWTQSA-N -1 3 360.771 3.696 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NCc1ccc(SC(=O)N(C)C)cc1 ZINC000822221376 606597408 /nfs/dbraw/zinc/59/74/08/606597408.db2.gz MHMCVAZTJYOGNA-UHFFFAOYSA-N -1 3 368.466 3.561 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NCc1ccc(SC(=O)N(C)C)cc1 ZINC000822221376 606597409 /nfs/dbraw/zinc/59/74/09/606597409.db2.gz MHMCVAZTJYOGNA-UHFFFAOYSA-N -1 3 368.466 3.561 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)cc1CNc1c(F)cccc1Br ZINC000822762049 606597914 /nfs/dbraw/zinc/59/79/14/606597914.db2.gz YABSIWSGLDECOZ-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CNc1c(F)cccc1Br ZINC000822762049 606597916 /nfs/dbraw/zinc/59/79/16/606597916.db2.gz YABSIWSGLDECOZ-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM COCCCCCSCc1ccc(-c2nnn[n-]2)cc1OC(F)F ZINC000821687261 606599125 /nfs/dbraw/zinc/59/91/25/606599125.db2.gz WBDPNHUCBLQPBN-UHFFFAOYSA-N -1 3 358.414 3.518 20 0 FHADHM COCCCCCSCc1ccc(-c2nn[n-]n2)cc1OC(F)F ZINC000821687261 606599127 /nfs/dbraw/zinc/59/91/27/606599127.db2.gz WBDPNHUCBLQPBN-UHFFFAOYSA-N -1 3 358.414 3.518 20 0 FHADHM C[C@H](C(=O)N(C)c1cccc(-c2nnn[n-]2)c1)c1ccc2ccccc2c1 ZINC000819856665 606601680 /nfs/dbraw/zinc/60/16/80/606601680.db2.gz KCXCOYHEOWFZHL-AWEZNQCLSA-N -1 3 357.417 3.786 20 0 FHADHM C[C@H](C(=O)N(C)c1cccc(-c2nn[n-]n2)c1)c1ccc2ccccc2c1 ZINC000819856665 606601681 /nfs/dbraw/zinc/60/16/81/606601681.db2.gz KCXCOYHEOWFZHL-AWEZNQCLSA-N -1 3 357.417 3.786 20 0 FHADHM C[C@@H](C(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1)c1ccc2ccccc2c1 ZINC000819856308 606601733 /nfs/dbraw/zinc/60/17/33/606601733.db2.gz HPAKQDNTOWTRRH-OAHLLOKOSA-N -1 3 371.444 3.782 20 0 FHADHM C[C@@H](C(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1)c1ccc2ccccc2c1 ZINC000819856308 606601734 /nfs/dbraw/zinc/60/17/34/606601734.db2.gz HPAKQDNTOWTRRH-OAHLLOKOSA-N -1 3 371.444 3.782 20 0 FHADHM Fc1ccc(COc2ccc(Oc3nccs3)cc2)c(-c2nnn[n-]2)c1 ZINC000822771994 606617398 /nfs/dbraw/zinc/61/73/98/606617398.db2.gz OCIYNGVSCVGTSK-UHFFFAOYSA-N -1 3 369.381 3.834 20 0 FHADHM Fc1ccc(COc2ccc(Oc3nccs3)cc2)c(-c2nn[n-]n2)c1 ZINC000822771994 606617400 /nfs/dbraw/zinc/61/74/00/606617400.db2.gz OCIYNGVSCVGTSK-UHFFFAOYSA-N -1 3 369.381 3.834 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)C/C=C\c1ccc(C)cc1 ZINC000821406411 606619501 /nfs/dbraw/zinc/61/95/01/606619501.db2.gz DHIYOPMTINKNOO-PLNGDYQASA-N -1 3 363.421 3.616 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)C/C=C\c1ccc(C)cc1 ZINC000821406411 606619503 /nfs/dbraw/zinc/61/95/03/606619503.db2.gz DHIYOPMTINKNOO-PLNGDYQASA-N -1 3 363.421 3.616 20 0 FHADHM COC(=O)c1ccc([C@@H](C)Sc2ccc(Cl)cc2-c2nnn[n-]2)o1 ZINC000821668746 606630860 /nfs/dbraw/zinc/63/08/60/606630860.db2.gz GYEDEPLZJNXXSD-MRVPVSSYSA-N -1 3 364.814 3.753 20 0 FHADHM COC(=O)c1ccc([C@@H](C)Sc2ccc(Cl)cc2-c2nn[n-]n2)o1 ZINC000821668746 606630862 /nfs/dbraw/zinc/63/08/62/606630862.db2.gz GYEDEPLZJNXXSD-MRVPVSSYSA-N -1 3 364.814 3.753 20 0 FHADHM CC(C)c1cnc(CNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)o1 ZINC000820197051 606638378 /nfs/dbraw/zinc/63/83/78/606638378.db2.gz FLKAQOONPSJRGB-UHFFFAOYSA-N -1 3 352.320 3.609 20 0 FHADHM CC(C)c1cnc(CNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)o1 ZINC000820197051 606638379 /nfs/dbraw/zinc/63/83/79/606638379.db2.gz FLKAQOONPSJRGB-UHFFFAOYSA-N -1 3 352.320 3.609 20 0 FHADHM Fc1cc(Br)cc(F)c1NCc1ccc(-c2nnn[n-]2)cc1 ZINC000822748112 606656723 /nfs/dbraw/zinc/65/67/23/606656723.db2.gz IKAAKGODZDPSBM-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1cc(Br)cc(F)c1NCc1ccc(-c2nn[n-]n2)cc1 ZINC000822748112 606656724 /nfs/dbraw/zinc/65/67/24/606656724.db2.gz IKAAKGODZDPSBM-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N([C@@H](C)c1ccco1)C1CC1 ZINC000822217514 606657474 /nfs/dbraw/zinc/65/74/74/606657474.db2.gz GRRFHQWYPMLXDQ-LBPRGKRZSA-N -1 3 352.398 3.526 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N([C@@H](C)c1ccco1)C1CC1 ZINC000822217514 606657475 /nfs/dbraw/zinc/65/74/75/606657475.db2.gz GRRFHQWYPMLXDQ-LBPRGKRZSA-N -1 3 352.398 3.526 20 0 FHADHM O=C(Nc1cc(Cl)ccc1Cl)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000823299272 606663368 /nfs/dbraw/zinc/66/33/68/606663368.db2.gz PEVWUGYZALCFNY-UHFFFAOYSA-N -1 3 370.146 3.704 20 0 FHADHM O=C(Nc1cc(Cl)ccc1Cl)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000823299272 606663369 /nfs/dbraw/zinc/66/33/69/606663369.db2.gz PEVWUGYZALCFNY-UHFFFAOYSA-N -1 3 370.146 3.704 20 0 FHADHM CCCN(Cc1ccc(C)cc1)C(=O)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000821109843 606665998 /nfs/dbraw/zinc/66/59/98/606665998.db2.gz QYDVWOIEPJVRQV-UHFFFAOYSA-N -1 3 371.391 3.506 20 0 FHADHM CCCN(Cc1ccc(C)cc1)C(=O)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000821109843 606665999 /nfs/dbraw/zinc/66/59/99/606665999.db2.gz QYDVWOIEPJVRQV-UHFFFAOYSA-N -1 3 371.391 3.506 20 0 FHADHM CCCCCC(C)(C)CNC(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000821042400 606671728 /nfs/dbraw/zinc/67/17/28/606671728.db2.gz ALTVAXZXPODOAH-UHFFFAOYSA-N -1 3 358.490 3.615 20 0 FHADHM CCCCCC(C)(C)CNC(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000821042400 606671729 /nfs/dbraw/zinc/67/17/29/606671729.db2.gz ALTVAXZXPODOAH-UHFFFAOYSA-N -1 3 358.490 3.615 20 0 FHADHM CC(C)c1cccc(N(C)C(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)c1 ZINC000820197727 606673282 /nfs/dbraw/zinc/67/32/82/606673282.db2.gz MYKKYMAZZKRZDT-UHFFFAOYSA-N -1 3 357.364 3.545 20 0 FHADHM CC(C)c1cccc(N(C)C(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)c1 ZINC000820197727 606673283 /nfs/dbraw/zinc/67/32/83/606673283.db2.gz MYKKYMAZZKRZDT-UHFFFAOYSA-N -1 3 357.364 3.545 20 0 FHADHM CC[C@H](C)c1ccc(C(=O)N(C)c2ccc(-c3nnn[n-]3)cc2F)cc1 ZINC000820881818 606675852 /nfs/dbraw/zinc/67/58/52/606675852.db2.gz DIPIXOSVIXGEJJ-LBPRGKRZSA-N -1 3 353.401 3.796 20 0 FHADHM CC[C@H](C)c1ccc(C(=O)N(C)c2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000820881818 606675853 /nfs/dbraw/zinc/67/58/53/606675853.db2.gz DIPIXOSVIXGEJJ-LBPRGKRZSA-N -1 3 353.401 3.796 20 0 FHADHM O=C(c1c(F)cc(-c2nnn[n-]2)cc1F)N1CCCCCc2ccccc21 ZINC000823454677 606683172 /nfs/dbraw/zinc/68/31/72/606683172.db2.gz QQILXXAZSYSSES-UHFFFAOYSA-N -1 3 369.375 3.518 20 0 FHADHM O=C(c1c(F)cc(-c2nn[n-]n2)cc1F)N1CCCCCc2ccccc21 ZINC000823454677 606683173 /nfs/dbraw/zinc/68/31/73/606683173.db2.gz QQILXXAZSYSSES-UHFFFAOYSA-N -1 3 369.375 3.518 20 0 FHADHM C[C@@H](OC(=O)CCCc1ccc(F)c(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820495916 606684749 /nfs/dbraw/zinc/68/47/49/606684749.db2.gz KNTGPRYPNNZMEO-GFCCVEGCSA-N -1 3 372.375 3.772 20 0 FHADHM C[C@@H](OC(=O)CCCc1ccc(F)c(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820495916 606684750 /nfs/dbraw/zinc/68/47/50/606684750.db2.gz KNTGPRYPNNZMEO-GFCCVEGCSA-N -1 3 372.375 3.772 20 0 FHADHM C[C@@H](OC1CCCCCC1)C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820518678 606735465 /nfs/dbraw/zinc/73/54/65/606735465.db2.gz IWYYBXZFFTWULE-UONOGXRCSA-N -1 3 358.442 3.599 20 0 FHADHM C[C@@H](OC1CCCCCC1)C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820518678 606735467 /nfs/dbraw/zinc/73/54/67/606735467.db2.gz IWYYBXZFFTWULE-UONOGXRCSA-N -1 3 358.442 3.599 20 0 FHADHM CCn1c(COc2cc(Cl)ccc2-c2nnn[n-]2)nc2cc(F)ccc21 ZINC000821564063 606784883 /nfs/dbraw/zinc/78/48/83/606784883.db2.gz RSSONXNXISPSMA-UHFFFAOYSA-N -1 3 372.791 3.608 20 0 FHADHM CCn1c(COc2cc(Cl)ccc2-c2nn[n-]n2)nc2cc(F)ccc21 ZINC000821564063 606784884 /nfs/dbraw/zinc/78/48/84/606784884.db2.gz RSSONXNXISPSMA-UHFFFAOYSA-N -1 3 372.791 3.608 20 0 FHADHM Cc1ccc(C)c([C@H]2CCCN2c2ncc(-c3nnn[n-]3)cc2Cl)c1 ZINC000822232105 606788793 /nfs/dbraw/zinc/78/87/93/606788793.db2.gz TUSRRGXJYZDYOP-MRXNPFEDSA-N -1 3 354.845 3.873 20 0 FHADHM Cc1ccc(C)c([C@H]2CCCN2c2ncc(-c3nn[n-]n3)cc2Cl)c1 ZINC000822232105 606788795 /nfs/dbraw/zinc/78/87/95/606788795.db2.gz TUSRRGXJYZDYOP-MRXNPFEDSA-N -1 3 354.845 3.873 20 0 FHADHM CCCC[C@H](NC(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1)C1CCC1 ZINC000821043142 606789321 /nfs/dbraw/zinc/78/93/21/606789321.db2.gz LXCSDHLVYWORST-DYVFJYSZSA-N -1 3 356.474 3.586 20 0 FHADHM CCCC[C@H](NC(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1)C1CCC1 ZINC000821043142 606789323 /nfs/dbraw/zinc/78/93/23/606789323.db2.gz LXCSDHLVYWORST-DYVFJYSZSA-N -1 3 356.474 3.586 20 0 FHADHM Fc1cc2ncc(Oc3cc(Cl)ccc3-c3nnn[n-]3)nc2cc1F ZINC000822754260 606790674 /nfs/dbraw/zinc/79/06/74/606790674.db2.gz XVEQUJWJBPIDBW-UHFFFAOYSA-N -1 3 360.711 3.534 20 0 FHADHM Fc1cc2ncc(Oc3cc(Cl)ccc3-c3nn[n-]n3)nc2cc1F ZINC000822754260 606790676 /nfs/dbraw/zinc/79/06/76/606790676.db2.gz XVEQUJWJBPIDBW-UHFFFAOYSA-N -1 3 360.711 3.534 20 0 FHADHM O=C(Nc1ccccc1CCC(F)(F)F)c1ccc(-c2nnn[n-]2)cc1 ZINC000823372923 606816839 /nfs/dbraw/zinc/81/68/39/606816839.db2.gz NRFQRKCSFLYCJI-UHFFFAOYSA-N -1 3 361.327 3.614 20 0 FHADHM O=C(Nc1ccccc1CCC(F)(F)F)c1ccc(-c2nn[n-]n2)cc1 ZINC000823372923 606816841 /nfs/dbraw/zinc/81/68/41/606816841.db2.gz NRFQRKCSFLYCJI-UHFFFAOYSA-N -1 3 361.327 3.614 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)cc1CSCc1ccn(C2CCCC2)n1 ZINC000822761648 606841565 /nfs/dbraw/zinc/84/15/65/606841565.db2.gz QMURBFNACMMPDE-UHFFFAOYSA-N -1 3 358.446 3.751 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CSCc1ccn(C2CCCC2)n1 ZINC000822761648 606841567 /nfs/dbraw/zinc/84/15/67/606841567.db2.gz QMURBFNACMMPDE-UHFFFAOYSA-N -1 3 358.446 3.751 20 0 FHADHM COc1cccc(C(=O)CSc2ccc(-c3nnn[n-]3)cc2Cl)c1 ZINC000821854570 606851672 /nfs/dbraw/zinc/85/16/72/606851672.db2.gz NKCUCKRNXNORBN-UHFFFAOYSA-N -1 3 360.826 3.504 20 0 FHADHM COc1cccc(C(=O)CSc2ccc(-c3nn[n-]n3)cc2Cl)c1 ZINC000821854570 606851673 /nfs/dbraw/zinc/85/16/73/606851673.db2.gz NKCUCKRNXNORBN-UHFFFAOYSA-N -1 3 360.826 3.504 20 0 FHADHM Cc1ccc2nc(CSc3ccc(-c4nnn[n-]4)cc3Cl)cn2c1 ZINC000822280018 606853638 /nfs/dbraw/zinc/85/36/38/606853638.db2.gz HMNSXYBAIMZYBV-UHFFFAOYSA-N -1 3 356.842 3.769 20 0 FHADHM Cc1ccc2nc(CSc3ccc(-c4nn[n-]n4)cc3Cl)cn2c1 ZINC000822280018 606853639 /nfs/dbraw/zinc/85/36/39/606853639.db2.gz HMNSXYBAIMZYBV-UHFFFAOYSA-N -1 3 356.842 3.769 20 0 FHADHM CC(C)c1cnc(SC[C@@H](O)c2ccc(-c3nnn[n-]3)cc2)n1C(C)C ZINC000820197304 606861991 /nfs/dbraw/zinc/86/19/91/606861991.db2.gz IVDNOSBDNIVFOU-MRXNPFEDSA-N -1 3 372.498 3.593 20 0 FHADHM CC(C)c1cnc(SC[C@@H](O)c2ccc(-c3nn[n-]n3)cc2)n1C(C)C ZINC000820197304 606861993 /nfs/dbraw/zinc/86/19/93/606861993.db2.gz IVDNOSBDNIVFOU-MRXNPFEDSA-N -1 3 372.498 3.593 20 0 FHADHM CC(C)C[C@H]1CCCCN1C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820063788 606863867 /nfs/dbraw/zinc/86/38/67/606863867.db2.gz ZCAKTWUPELTIQM-WMLDXEAASA-N -1 3 356.474 3.538 20 0 FHADHM CC(C)C[C@H]1CCCCN1C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820063788 606863869 /nfs/dbraw/zinc/86/38/69/606863869.db2.gz ZCAKTWUPELTIQM-WMLDXEAASA-N -1 3 356.474 3.538 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cc(F)c(C)cc2F)c1-c1nnn[n-]1 ZINC000821465117 606864199 /nfs/dbraw/zinc/86/41/99/606864199.db2.gz BPJFJNYJDFQOIT-UHFFFAOYSA-N -1 3 363.393 3.638 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cc(F)c(C)cc2F)c1-c1nn[n-]n1 ZINC000821465117 606864201 /nfs/dbraw/zinc/86/42/01/606864201.db2.gz BPJFJNYJDFQOIT-UHFFFAOYSA-N -1 3 363.393 3.638 20 0 FHADHM Cc1ccc(-c2cncc(C(=O)Nc3ccc(F)c(-c4nnn[n-]4)c3)c2)cc1 ZINC000822213880 606865081 /nfs/dbraw/zinc/86/50/81/606865081.db2.gz FFZZMZNFQUIOJL-UHFFFAOYSA-N -1 3 374.379 3.629 20 0 FHADHM Cc1ccc(-c2cncc(C(=O)Nc3ccc(F)c(-c4nn[n-]n4)c3)c2)cc1 ZINC000822213880 606865082 /nfs/dbraw/zinc/86/50/82/606865082.db2.gz FFZZMZNFQUIOJL-UHFFFAOYSA-N -1 3 374.379 3.629 20 0 FHADHM CCOc1cc(Br)ccc1NCc1cccc(-c2nn[n-]n2)c1 ZINC000821394926 606866577 /nfs/dbraw/zinc/86/65/77/606866577.db2.gz QJFWQRVVACJGCI-UHFFFAOYSA-N -1 3 374.242 3.640 20 0 FHADHM CCOc1cc(Br)ccc1NCc1cccc(-c2nnn[n-]2)c1 ZINC000821394926 606866575 /nfs/dbraw/zinc/86/65/75/606866575.db2.gz QJFWQRVVACJGCI-UHFFFAOYSA-N -1 3 374.242 3.640 20 0 FHADHM COCc1ccc(SCCCOc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000821696122 606868619 /nfs/dbraw/zinc/86/86/19/606868619.db2.gz XPXMZINKGYRKKD-UHFFFAOYSA-N -1 3 356.451 3.574 20 0 FHADHM COCc1ccc(SCCCOc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000821696122 606868621 /nfs/dbraw/zinc/86/86/21/606868621.db2.gz XPXMZINKGYRKKD-UHFFFAOYSA-N -1 3 356.451 3.574 20 0 FHADHM CC1(C)CCCC[C@H]1NC(=O)CCCCOc1cccc(-c2nnn[n-]2)c1 ZINC000820596411 606873851 /nfs/dbraw/zinc/87/38/51/606873851.db2.gz PFYCBDQXTLEPRU-QGZVFWFLSA-N -1 3 371.485 3.501 20 0 FHADHM CC1(C)CCCC[C@H]1NC(=O)CCCCOc1cccc(-c2nn[n-]n2)c1 ZINC000820596411 606873853 /nfs/dbraw/zinc/87/38/53/606873853.db2.gz PFYCBDQXTLEPRU-QGZVFWFLSA-N -1 3 371.485 3.501 20 0 FHADHM C[C@H](NC(=O)OC(C)(C)C)c1nc(-c2ccc(-c3nnn[n-]3)cc2)cs1 ZINC000820385546 606876449 /nfs/dbraw/zinc/87/64/49/606876449.db2.gz UBBKIHJZVATXJA-JTQLQIEISA-N -1 3 372.454 3.576 20 0 FHADHM C[C@H](NC(=O)OC(C)(C)C)c1nc(-c2ccc(-c3nn[n-]n3)cc2)cs1 ZINC000820385546 606876450 /nfs/dbraw/zinc/87/64/50/606876450.db2.gz UBBKIHJZVATXJA-JTQLQIEISA-N -1 3 372.454 3.576 20 0 FHADHM O[C@H](CNc1c(Cl)cccc1-c1nnn[n-]1)c1cc2ccccc2s1 ZINC000823690773 606878218 /nfs/dbraw/zinc/87/82/18/606878218.db2.gz UCZHHYXWZMTMMR-CYBMUJFWSA-N -1 3 371.853 3.880 20 0 FHADHM O[C@H](CNc1c(Cl)cccc1-c1nn[n-]n1)c1cc2ccccc2s1 ZINC000823690773 606878220 /nfs/dbraw/zinc/87/82/20/606878220.db2.gz UCZHHYXWZMTMMR-CYBMUJFWSA-N -1 3 371.853 3.880 20 0 FHADHM C[C@@H]1CC[C@H](C)N1C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000820684768 606879066 /nfs/dbraw/zinc/87/90/66/606879066.db2.gz SABCDIZYEFWFCP-OKILXGFUSA-N -1 3 363.421 3.672 20 0 FHADHM C[C@@H]1CC[C@H](C)N1C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000820684768 606879067 /nfs/dbraw/zinc/87/90/67/606879067.db2.gz SABCDIZYEFWFCP-OKILXGFUSA-N -1 3 363.421 3.672 20 0 FHADHM FC(F)(F)c1ccc(N2CCC[C@H](C(F)(F)F)C2)c(-c2nnn[n-]2)c1 ZINC000822723232 606916308 /nfs/dbraw/zinc/91/63/08/606916308.db2.gz ASMOATRDCQUPDB-VIFPVBQESA-N -1 3 365.281 3.664 20 0 FHADHM FC(F)(F)c1ccc(N2CCC[C@H](C(F)(F)F)C2)c(-c2nn[n-]n2)c1 ZINC000822723232 606916309 /nfs/dbraw/zinc/91/63/09/606916309.db2.gz ASMOATRDCQUPDB-VIFPVBQESA-N -1 3 365.281 3.664 20 0 FHADHM Cc1cc([C@H]2CCCN2c2ccc(C(F)(F)F)cc2-c2nnn[n-]2)no1 ZINC000822199179 606919703 /nfs/dbraw/zinc/91/97/03/606919703.db2.gz ZGGXRYRTBHJYDF-CQSZACIVSA-N -1 3 364.331 3.523 20 0 FHADHM Cc1cc([C@H]2CCCN2c2ccc(C(F)(F)F)cc2-c2nn[n-]n2)no1 ZINC000822199179 606919705 /nfs/dbraw/zinc/91/97/05/606919705.db2.gz ZGGXRYRTBHJYDF-CQSZACIVSA-N -1 3 364.331 3.523 20 0 FHADHM CCC(=O)Nc1ccc(Cl)c(NCc2ccc(F)c(-c3nnn[n-]3)c2)c1 ZINC000820837246 606928724 /nfs/dbraw/zinc/92/87/24/606928724.db2.gz HHWCUVUQEVLYRO-UHFFFAOYSA-N -1 3 374.807 3.620 20 0 FHADHM CCC(=O)Nc1ccc(Cl)c(NCc2ccc(F)c(-c3nn[n-]n3)c2)c1 ZINC000820837246 606928725 /nfs/dbraw/zinc/92/87/25/606928725.db2.gz HHWCUVUQEVLYRO-UHFFFAOYSA-N -1 3 374.807 3.620 20 0 FHADHM CCc1nc(CCNc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)cs1 ZINC000821504733 606930791 /nfs/dbraw/zinc/93/07/91/606930791.db2.gz JJCHFTHSMJDMHK-UHFFFAOYSA-N -1 3 368.388 3.559 20 0 FHADHM CCc1nc(CCNc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)cs1 ZINC000821504733 606930792 /nfs/dbraw/zinc/93/07/92/606930792.db2.gz JJCHFTHSMJDMHK-UHFFFAOYSA-N -1 3 368.388 3.559 20 0 FHADHM CCCOc1cccc(C(=O)N(C)c2cc(Cl)ccc2-c2nnn[n-]2)c1 ZINC000821133850 606962401 /nfs/dbraw/zinc/96/24/01/606962401.db2.gz HKYIDCNGTYSNJM-UHFFFAOYSA-N -1 3 371.828 3.586 20 0 FHADHM CCCOc1cccc(C(=O)N(C)c2cc(Cl)ccc2-c2nn[n-]n2)c1 ZINC000821133850 606962402 /nfs/dbraw/zinc/96/24/02/606962402.db2.gz HKYIDCNGTYSNJM-UHFFFAOYSA-N -1 3 371.828 3.586 20 0 FHADHM CN(C(=O)c1cc2occc2s1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821573272 606964958 /nfs/dbraw/zinc/96/49/58/606964958.db2.gz ISTDMNQWAIDSDD-UHFFFAOYSA-N -1 3 359.798 3.604 20 0 FHADHM CN(C(=O)c1cc2occc2s1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821573272 606964960 /nfs/dbraw/zinc/96/49/60/606964960.db2.gz ISTDMNQWAIDSDD-UHFFFAOYSA-N -1 3 359.798 3.604 20 0 FHADHM CC(C)c1ccccc1NC(=O)CSc1cccc(-c2nnn[n-]2)c1 ZINC000820197076 607012750 /nfs/dbraw/zinc/01/27/50/607012750.db2.gz FWHMCCJOXMTWQZ-UHFFFAOYSA-N -1 3 353.451 3.721 20 0 FHADHM CC(C)c1ccccc1NC(=O)CSc1cccc(-c2nn[n-]n2)c1 ZINC000820197076 607012751 /nfs/dbraw/zinc/01/27/51/607012751.db2.gz FWHMCCJOXMTWQZ-UHFFFAOYSA-N -1 3 353.451 3.721 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1OCc1ncc(-c2cccc(F)c2)o1 ZINC000822221390 607027687 /nfs/dbraw/zinc/02/76/87/607027687.db2.gz MUJXZVPTPOBQPH-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1OCc1ncc(-c2cccc(F)c2)o1 ZINC000822221390 607027689 /nfs/dbraw/zinc/02/76/89/607027689.db2.gz MUJXZVPTPOBQPH-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NC(=O)C[C@H](C)c1ccccc1F ZINC000821292841 607100107 /nfs/dbraw/zinc/10/01/07/607100107.db2.gz FHXARNCFRPBMFA-LBPRGKRZSA-N -1 3 368.416 3.570 20 0 FHADHM C[C@@H]1CN(c2ccc(-c3nnn[n-]3)c(Cl)c2)C[C@@H](c2ccsc2)O1 ZINC000820768570 607115787 /nfs/dbraw/zinc/11/57/87/607115787.db2.gz ODCKUKXRWIDTNS-BMIGLBTASA-N -1 3 361.858 3.548 20 0 FHADHM C[C@@H]1CN(c2ccc(-c3nn[n-]n3)c(Cl)c2)C[C@@H](c2ccsc2)O1 ZINC000820768570 607115788 /nfs/dbraw/zinc/11/57/88/607115788.db2.gz ODCKUKXRWIDTNS-BMIGLBTASA-N -1 3 361.858 3.548 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1Oc1ccc(C(F)(F)F)c(Cl)n1 ZINC000822748395 607128981 /nfs/dbraw/zinc/12/89/81/607128981.db2.gz WXZHPKXTDQENGD-UHFFFAOYSA-N -1 3 359.670 3.865 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1Oc1ccc(C(F)(F)F)c(Cl)n1 ZINC000822748395 607128982 /nfs/dbraw/zinc/12/89/82/607128982.db2.gz WXZHPKXTDQENGD-UHFFFAOYSA-N -1 3 359.670 3.865 20 0 FHADHM C[C@@H](OC(=O)/C=C/SCc1ccco1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488898 607131379 /nfs/dbraw/zinc/13/13/79/607131379.db2.gz WGLDHCNHTQLKSP-ZJNQMXKESA-N -1 3 356.407 3.511 20 0 FHADHM C[C@@H](OC(=O)/C=C/SCc1ccco1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488898 607131381 /nfs/dbraw/zinc/13/13/81/607131381.db2.gz WGLDHCNHTQLKSP-ZJNQMXKESA-N -1 3 356.407 3.511 20 0 FHADHM CC[C@H](C)c1ccc(NC(=O)COc2ccc(-c3nnn[n-]3)cc2F)cc1 ZINC000820882670 607134109 /nfs/dbraw/zinc/13/41/09/607134109.db2.gz XFVQZQQNWLESSW-LBPRGKRZSA-N -1 3 369.400 3.537 20 0 FHADHM CC[C@H](C)c1ccc(NC(=O)COc2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000820882670 607134111 /nfs/dbraw/zinc/13/41/11/607134111.db2.gz XFVQZQQNWLESSW-LBPRGKRZSA-N -1 3 369.400 3.537 20 0 FHADHM Fc1cccc(CN(C/C=C\Cl)Cc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000822786319 607147125 /nfs/dbraw/zinc/14/71/25/607147125.db2.gz JRSJQOQMJNZBHU-MBXJOHMKSA-N -1 3 357.820 3.761 20 0 FHADHM Fc1cccc(CN(C/C=C\Cl)Cc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000822786319 607147127 /nfs/dbraw/zinc/14/71/27/607147127.db2.gz JRSJQOQMJNZBHU-MBXJOHMKSA-N -1 3 357.820 3.761 20 0 FHADHM Cc1cc(-c2noc(CSc3ccccc3-c3nnn[n-]3)n2)ccc1F ZINC000822154443 607169729 /nfs/dbraw/zinc/16/97/29/607169729.db2.gz XSNVAHUUNRVIPJ-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM Cc1cc(-c2noc(CSc3ccccc3-c3nn[n-]n3)n2)ccc1F ZINC000822154443 607169730 /nfs/dbraw/zinc/16/97/30/607169730.db2.gz XSNVAHUUNRVIPJ-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM Cc1cnc([C@@H](C)Nc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)s1 ZINC000822389252 607173901 /nfs/dbraw/zinc/17/39/01/607173901.db2.gz QAFYRWWBFCDGQA-MRVPVSSYSA-N -1 3 354.361 3.824 20 0 FHADHM Cc1cnc([C@@H](C)Nc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)s1 ZINC000822389252 607173902 /nfs/dbraw/zinc/17/39/02/607173902.db2.gz QAFYRWWBFCDGQA-MRVPVSSYSA-N -1 3 354.361 3.824 20 0 FHADHM Cc1cccc([C@@H]2CCCN2c2ccc(C(F)(F)F)cc2-c2nnn[n-]2)n1 ZINC000822299450 607174918 /nfs/dbraw/zinc/17/49/18/607174918.db2.gz JGGSYSBELLQUCR-INIZCTEOSA-N -1 3 374.370 3.930 20 0 FHADHM Cc1cccc([C@@H]2CCCN2c2ccc(C(F)(F)F)cc2-c2nn[n-]n2)n1 ZINC000822299450 607174919 /nfs/dbraw/zinc/17/49/19/607174919.db2.gz JGGSYSBELLQUCR-INIZCTEOSA-N -1 3 374.370 3.930 20 0 FHADHM Cc1ccc(OCCC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1C ZINC000822262535 607189102 /nfs/dbraw/zinc/18/91/02/607189102.db2.gz ASIRZEAKLKJKFO-UHFFFAOYSA-N -1 3 371.828 3.545 20 0 FHADHM Cc1ccc(OCCC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1C ZINC000822262535 607189103 /nfs/dbraw/zinc/18/91/03/607189103.db2.gz ASIRZEAKLKJKFO-UHFFFAOYSA-N -1 3 371.828 3.545 20 0 FHADHM O=C(Cc1ccc2ccccc2c1)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000823087186 607190413 /nfs/dbraw/zinc/19/04/13/607190413.db2.gz JSMDZYJIPYSBON-UHFFFAOYSA-N -1 3 363.808 3.855 20 0 FHADHM O=C(Cc1ccc2ccccc2c1)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000823087186 607190414 /nfs/dbraw/zinc/19/04/14/607190414.db2.gz JSMDZYJIPYSBON-UHFFFAOYSA-N -1 3 363.808 3.855 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)C1CCC(C)(C)CC1 ZINC000820115913 607192025 /nfs/dbraw/zinc/19/20/25/607192025.db2.gz BQVVTXBSZYWCMT-UHFFFAOYSA-N -1 3 355.486 3.820 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)C1CCC(C)(C)CC1 ZINC000820115913 607192026 /nfs/dbraw/zinc/19/20/26/607192026.db2.gz BQVVTXBSZYWCMT-UHFFFAOYSA-N -1 3 355.486 3.820 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N[C@@H]1CC[C@@H]2CCC[C@@H]2C1 ZINC000823319390 607197003 /nfs/dbraw/zinc/19/70/03/607197003.db2.gz TXORGEXYJPLEMP-DMDPSCGWSA-N -1 3 360.849 3.610 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N[C@@H]1CC[C@@H]2CCC[C@@H]2C1 ZINC000823319390 607197004 /nfs/dbraw/zinc/19/70/04/607197004.db2.gz TXORGEXYJPLEMP-DMDPSCGWSA-N -1 3 360.849 3.610 20 0 FHADHM CCC1CCC(N(C)C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)CC1 ZINC000820971316 607198234 /nfs/dbraw/zinc/19/82/34/607198234.db2.gz BGKVTAFFZWFNAG-UHFFFAOYSA-N -1 3 362.865 3.953 20 0 FHADHM CCC1CCC(N(C)C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)CC1 ZINC000820971316 607198235 /nfs/dbraw/zinc/19/82/35/607198235.db2.gz BGKVTAFFZWFNAG-UHFFFAOYSA-N -1 3 362.865 3.953 20 0 FHADHM Cc1cccc(C)c1CCNC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822293941 607198380 /nfs/dbraw/zinc/19/83/80/607198380.db2.gz RCRDODDOCIPBQC-UHFFFAOYSA-N -1 3 370.844 3.501 20 0 FHADHM Cc1cccc(C)c1CCNC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822293941 607198381 /nfs/dbraw/zinc/19/83/81/607198381.db2.gz RCRDODDOCIPBQC-UHFFFAOYSA-N -1 3 370.844 3.501 20 0 FHADHM CCC[C@@H]1[C@H](C)CCCN1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000821034804 607199012 /nfs/dbraw/zinc/19/90/12/607199012.db2.gz UIFOYZFAQWGTEP-IAQYHMDHSA-N -1 3 362.865 3.953 20 0 FHADHM CCC[C@@H]1[C@H](C)CCCN1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000821034804 607199013 /nfs/dbraw/zinc/19/90/13/607199013.db2.gz UIFOYZFAQWGTEP-IAQYHMDHSA-N -1 3 362.865 3.953 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)NC1CC(c2ccccc2)C1 ZINC000823319298 607203095 /nfs/dbraw/zinc/20/30/95/607203095.db2.gz RRSPCWWZOSFUIF-UHFFFAOYSA-N -1 3 368.828 3.588 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)NC1CC(c2ccccc2)C1 ZINC000823319298 607203096 /nfs/dbraw/zinc/20/30/96/607203096.db2.gz RRSPCWWZOSFUIF-UHFFFAOYSA-N -1 3 368.828 3.588 20 0 FHADHM CC[C@@H](NC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccccc1 ZINC000820921229 607203406 /nfs/dbraw/zinc/20/34/06/607203406.db2.gz XDRASLOPBBVCFY-CQSZACIVSA-N -1 3 356.817 3.793 20 0 FHADHM CC[C@@H](NC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccccc1 ZINC000820921229 607203407 /nfs/dbraw/zinc/20/34/07/607203407.db2.gz XDRASLOPBBVCFY-CQSZACIVSA-N -1 3 356.817 3.793 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)[C@H](C)c1ccccc1 ZINC000820374851 607204382 /nfs/dbraw/zinc/20/43/82/607204382.db2.gz ROGTVCORMXMVHE-NWDGAFQWSA-N -1 3 370.844 3.834 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)[C@H](C)c1ccccc1 ZINC000820374851 607204383 /nfs/dbraw/zinc/20/43/83/607204383.db2.gz ROGTVCORMXMVHE-NWDGAFQWSA-N -1 3 370.844 3.834 20 0 FHADHM O=C(c1sccc1-c1nnn[n-]1)N1CCC[C@H]1CCC1CCCCC1 ZINC000823498025 607225618 /nfs/dbraw/zinc/22/56/18/607225618.db2.gz DYQJBWYFYQXFGS-AWEZNQCLSA-N -1 3 359.499 3.893 20 0 FHADHM O=C(c1sccc1-c1nn[n-]n1)N1CCC[C@H]1CCC1CCCCC1 ZINC000823498025 607225619 /nfs/dbraw/zinc/22/56/19/607225619.db2.gz DYQJBWYFYQXFGS-AWEZNQCLSA-N -1 3 359.499 3.893 20 0 FHADHM CCc1cnc(CCNc2cc(-c3nnn[n-]3)ccc2C(F)(F)F)s1 ZINC000821497730 607228049 /nfs/dbraw/zinc/22/80/49/607228049.db2.gz YMGRBDNOAFBWGE-UHFFFAOYSA-N -1 3 368.388 3.559 20 0 FHADHM CCc1cnc(CCNc2cc(-c3nn[n-]n3)ccc2C(F)(F)F)s1 ZINC000821497730 607228050 /nfs/dbraw/zinc/22/80/50/607228050.db2.gz YMGRBDNOAFBWGE-UHFFFAOYSA-N -1 3 368.388 3.559 20 0 FHADHM COc1ccccc1[C@H](C)CC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000821882983 607241484 /nfs/dbraw/zinc/24/14/84/607241484.db2.gz OXQULUBRSMQJJH-LLVKDONJSA-N -1 3 371.828 3.661 20 0 FHADHM COc1ccccc1[C@H](C)CC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000821882983 607241485 /nfs/dbraw/zinc/24/14/85/607241485.db2.gz OXQULUBRSMQJJH-LLVKDONJSA-N -1 3 371.828 3.661 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)[C@H]1CCSc2ccccc21 ZINC000823315503 607241687 /nfs/dbraw/zinc/24/16/87/607241687.db2.gz YRMOHNKANNXIGH-LBPRGKRZSA-N -1 3 371.853 3.738 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)[C@H]1CCSc2ccccc21 ZINC000823315503 607241688 /nfs/dbraw/zinc/24/16/88/607241688.db2.gz YRMOHNKANNXIGH-LBPRGKRZSA-N -1 3 371.853 3.738 20 0 FHADHM O=C(CCc1ccccc1Cl)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822983158 607241785 /nfs/dbraw/zinc/24/17/85/607241785.db2.gz LPFAELBRVQMPJL-UHFFFAOYSA-N -1 3 362.220 3.745 20 0 FHADHM O=C(CCc1ccccc1Cl)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822983158 607241786 /nfs/dbraw/zinc/24/17/86/607241786.db2.gz LPFAELBRVQMPJL-UHFFFAOYSA-N -1 3 362.220 3.745 20 0 FHADHM Cc1ccc(CCCC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)s1 ZINC000822235984 607242938 /nfs/dbraw/zinc/24/29/38/607242938.db2.gz FIAXVAVBOVYBHF-UHFFFAOYSA-N -1 3 361.858 3.851 20 0 FHADHM Cc1ccc(CCCC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)s1 ZINC000822235984 607242939 /nfs/dbraw/zinc/24/29/39/607242939.db2.gz FIAXVAVBOVYBHF-UHFFFAOYSA-N -1 3 361.858 3.851 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)C1(c2cccc(F)c2)CCC1 ZINC000823315430 607244041 /nfs/dbraw/zinc/24/40/41/607244041.db2.gz YAJJJLZYZWXNAU-UHFFFAOYSA-N -1 3 371.803 3.720 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)C1(c2cccc(F)c2)CCC1 ZINC000823315430 607244042 /nfs/dbraw/zinc/24/40/42/607244042.db2.gz YAJJJLZYZWXNAU-UHFFFAOYSA-N -1 3 371.803 3.720 20 0 FHADHM C[C@@H]1CC[C@@H](NC(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)c2ccccc21 ZINC000824914972 607774982 /nfs/dbraw/zinc/77/49/82/607774982.db2.gz AUMYLQITTQICRB-QLJPJBMISA-N -1 3 369.375 3.513 20 0 FHADHM C[C@@H]1CC[C@@H](NC(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)c2ccccc21 ZINC000824914972 607774983 /nfs/dbraw/zinc/77/49/83/607774983.db2.gz AUMYLQITTQICRB-QLJPJBMISA-N -1 3 369.375 3.513 20 0 FHADHM C[C@H](CC(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccc(F)cc1F ZINC000824385604 607778831 /nfs/dbraw/zinc/77/88/31/607778831.db2.gz XNKWHXQTKAOPOA-NEPJUHHUSA-N -1 3 372.375 3.943 20 0 FHADHM C[C@H](CC(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccc(F)cc1F ZINC000824385604 607778832 /nfs/dbraw/zinc/77/88/32/607778832.db2.gz XNKWHXQTKAOPOA-NEPJUHHUSA-N -1 3 372.375 3.943 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@H](C)c2ccccc2)cc1-c1nnn[n-]1 ZINC000825553207 607784028 /nfs/dbraw/zinc/78/40/28/607784028.db2.gz MVHIPPPQZTXARX-GFCCVEGCSA-N -1 3 352.398 3.608 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@H](C)c2ccccc2)cc1-c1nn[n-]n1 ZINC000825553207 607784029 /nfs/dbraw/zinc/78/40/29/607784029.db2.gz MVHIPPPQZTXARX-GFCCVEGCSA-N -1 3 352.398 3.608 20 0 FHADHM S=C(Nc1cccc2ccsc21)Nc1ccccc1-c1nnn[n-]1 ZINC000826511952 607784379 /nfs/dbraw/zinc/78/43/79/607784379.db2.gz KHNNKNKSWJQPNW-UHFFFAOYSA-N -1 3 352.448 3.890 20 0 FHADHM S=C(Nc1cccc2ccsc21)Nc1ccccc1-c1nn[n-]n1 ZINC000826511952 607784380 /nfs/dbraw/zinc/78/43/80/607784380.db2.gz KHNNKNKSWJQPNW-UHFFFAOYSA-N -1 3 352.448 3.890 20 0 FHADHM FC(F)(F)c1csc(CSCc2ccc(-c3nnn[n-]3)cc2)n1 ZINC000826369157 607785973 /nfs/dbraw/zinc/78/59/73/607785973.db2.gz PMRHXCXCVHTHRQ-UHFFFAOYSA-N -1 3 357.386 3.775 20 0 FHADHM FC(F)(F)c1csc(CSCc2ccc(-c3nn[n-]n3)cc2)n1 ZINC000826369157 607785974 /nfs/dbraw/zinc/78/59/74/607785974.db2.gz PMRHXCXCVHTHRQ-UHFFFAOYSA-N -1 3 357.386 3.775 20 0 FHADHM CCN(C(=O)CCCc1ccc(F)c(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825371740 607797338 /nfs/dbraw/zinc/79/73/38/607797338.db2.gz JOUAFEFCLYNHRD-UHFFFAOYSA-N -1 3 371.391 3.521 20 0 FHADHM CCN(C(=O)CCCc1ccc(F)c(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825371740 607797339 /nfs/dbraw/zinc/79/73/39/607797339.db2.gz JOUAFEFCLYNHRD-UHFFFAOYSA-N -1 3 371.391 3.521 20 0 FHADHM Fc1cc(NCc2ccccc2-c2nnn[n-]2)c(F)cc1Br ZINC000826373014 607808178 /nfs/dbraw/zinc/80/81/78/607808178.db2.gz WEHGHMNDHZAIIV-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1cc(NCc2ccccc2-c2nn[n-]n2)c(F)cc1Br ZINC000826373014 607808179 /nfs/dbraw/zinc/80/81/79/607808179.db2.gz WEHGHMNDHZAIIV-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM CN(Cc1cccc(-c2nnn[n-]2)c1)C(=O)CCC(C)(C)c1ccccc1 ZINC000825971987 607816320 /nfs/dbraw/zinc/81/63/20/607816320.db2.gz QPIKOANHMNXOPH-UHFFFAOYSA-N -1 3 363.465 3.583 20 0 FHADHM CN(Cc1cccc(-c2nn[n-]n2)c1)C(=O)CCC(C)(C)c1ccccc1 ZINC000825971987 607816321 /nfs/dbraw/zinc/81/63/21/607816321.db2.gz QPIKOANHMNXOPH-UHFFFAOYSA-N -1 3 363.465 3.583 20 0 FHADHM CN(C(=O)CCC(C)(C)c1ccccc1)c1ccc(-c2nnn[n-]2)cc1F ZINC000825817681 607827199 /nfs/dbraw/zinc/82/71/99/607827199.db2.gz MTFXCWJQBGIBAJ-UHFFFAOYSA-N -1 3 367.428 3.727 20 0 FHADHM CN(C(=O)CCC(C)(C)c1ccccc1)c1ccc(-c2nn[n-]n2)cc1F ZINC000825817681 607827200 /nfs/dbraw/zinc/82/72/00/607827200.db2.gz MTFXCWJQBGIBAJ-UHFFFAOYSA-N -1 3 367.428 3.727 20 0 FHADHM C[C@@H](NC(=O)c1c(Cl)cc(-c2nnn[n-]2)cc1Cl)c1ccccc1 ZINC000824507434 607832016 /nfs/dbraw/zinc/83/20/16/607832016.db2.gz XLEPQIZTVDBYQZ-SECBINFHSA-N -1 3 362.220 3.665 20 0 FHADHM C[C@@H](NC(=O)c1c(Cl)cc(-c2nn[n-]n2)cc1Cl)c1ccccc1 ZINC000824507434 607832017 /nfs/dbraw/zinc/83/20/17/607832017.db2.gz XLEPQIZTVDBYQZ-SECBINFHSA-N -1 3 362.220 3.665 20 0 FHADHM Cc1ccc(NC(=O)c2c(Cl)cc(-c3nnn[n-]3)cc2Cl)cc1F ZINC000826291204 607832726 /nfs/dbraw/zinc/83/27/26/607832726.db2.gz UREHKWHLRZRZEO-UHFFFAOYSA-N -1 3 366.183 3.873 20 0 FHADHM Cc1ccc(NC(=O)c2c(Cl)cc(-c3nn[n-]n3)cc2Cl)cc1F ZINC000826291204 607832727 /nfs/dbraw/zinc/83/27/27/607832727.db2.gz UREHKWHLRZRZEO-UHFFFAOYSA-N -1 3 366.183 3.873 20 0 FHADHM COc1ccc(C)cc1[C@H](C)Nc1ccc2cc(-c3nnn[n-]3)ccc2n1 ZINC000826190051 607839087 /nfs/dbraw/zinc/83/90/87/607839087.db2.gz OBNXMIQZNFPOPF-ZDUSSCGKSA-N -1 3 360.421 3.905 20 0 FHADHM COc1ccc(C)cc1[C@H](C)Nc1ccc2cc(-c3nn[n-]n3)ccc2n1 ZINC000826190051 607839088 /nfs/dbraw/zinc/83/90/88/607839088.db2.gz OBNXMIQZNFPOPF-ZDUSSCGKSA-N -1 3 360.421 3.905 20 0 FHADHM CCOCc1ccc(CNc2ccc3cc(-c4nnn[n-]4)ccc3n2)cc1 ZINC000825604293 607839627 /nfs/dbraw/zinc/83/96/27/607839627.db2.gz HGZFFQXVVINKQD-UHFFFAOYSA-N -1 3 360.421 3.564 20 0 FHADHM CCOCc1ccc(CNc2ccc3cc(-c4nn[n-]n4)ccc3n2)cc1 ZINC000825604293 607839628 /nfs/dbraw/zinc/83/96/28/607839628.db2.gz HGZFFQXVVINKQD-UHFFFAOYSA-N -1 3 360.421 3.564 20 0 FHADHM CC(C)C[C@@H](C)N(C)C(=O)CSc1ccc(-c2nnn[n-]2)cc1Cl ZINC000824228610 607843649 /nfs/dbraw/zinc/84/36/49/607843649.db2.gz KBFNWBWKJXFRET-LLVKDONJSA-N -1 3 367.906 3.505 20 0 FHADHM CC(C)C[C@@H](C)N(C)C(=O)CSc1ccc(-c2nn[n-]n2)cc1Cl ZINC000824228610 607843650 /nfs/dbraw/zinc/84/36/50/607843650.db2.gz KBFNWBWKJXFRET-LLVKDONJSA-N -1 3 367.906 3.505 20 0 FHADHM Clc1cc(-c2nnn[n-]2)ccc1SCc1cccc2nsnc21 ZINC000826350735 607845532 /nfs/dbraw/zinc/84/55/32/607845532.db2.gz JBGTVPLVIUVRCK-UHFFFAOYSA-N -1 3 360.855 3.817 20 0 FHADHM Clc1cc(-c2nn[n-]n2)ccc1SCc1cccc2nsnc21 ZINC000826350735 607845533 /nfs/dbraw/zinc/84/55/33/607845533.db2.gz JBGTVPLVIUVRCK-UHFFFAOYSA-N -1 3 360.855 3.817 20 0 FHADHM CC1(NC(=O)Nc2ccc(Oc3cccc(-c4nnn[n-]4)c3)cc2)CCC1 ZINC000824832127 607856381 /nfs/dbraw/zinc/85/63/81/607856381.db2.gz RHXVQGIEAKGYAM-UHFFFAOYSA-N -1 3 364.409 3.723 20 0 FHADHM CC1(NC(=O)Nc2ccc(Oc3cccc(-c4nn[n-]n4)c3)cc2)CCC1 ZINC000824832127 607856382 /nfs/dbraw/zinc/85/63/82/607856382.db2.gz RHXVQGIEAKGYAM-UHFFFAOYSA-N -1 3 364.409 3.723 20 0 FHADHM CCOc1ccccc1C(=O)N(CC)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825654179 607879351 /nfs/dbraw/zinc/87/93/51/607879351.db2.gz QPDHKOCMHWMKNO-UHFFFAOYSA-N -1 3 371.828 3.586 20 0 FHADHM CCOc1ccccc1C(=O)N(CC)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825654179 607879352 /nfs/dbraw/zinc/87/93/52/607879352.db2.gz QPDHKOCMHWMKNO-UHFFFAOYSA-N -1 3 371.828 3.586 20 0 FHADHM FC(F)(F)c1cccc(OCCCCn2ccc(-c3nnn[n-]3)c2)c1 ZINC000826368769 607891005 /nfs/dbraw/zinc/89/10/05/607891005.db2.gz APBWUDJROIHKPN-UHFFFAOYSA-N -1 3 351.332 3.546 20 0 FHADHM FC(F)(F)c1cccc(OCCCCn2ccc(-c3nn[n-]n3)c2)c1 ZINC000826368769 607891006 /nfs/dbraw/zinc/89/10/06/607891006.db2.gz APBWUDJROIHKPN-UHFFFAOYSA-N -1 3 351.332 3.546 20 0 FHADHM c1ccc(-c2ccc(CSC3CCOCC3)cc2)c(-c2nnn[n-]2)c1 ZINC000826519733 607894271 /nfs/dbraw/zinc/89/42/71/607894271.db2.gz LQICLCCIWBNWCX-UHFFFAOYSA-N -1 3 352.463 3.946 20 0 FHADHM c1ccc(-c2ccc(CSC3CCOCC3)cc2)c(-c2nn[n-]n2)c1 ZINC000826519733 607894272 /nfs/dbraw/zinc/89/42/72/607894272.db2.gz LQICLCCIWBNWCX-UHFFFAOYSA-N -1 3 352.463 3.946 20 0 FHADHM CC[C@H](CC(=O)N1CCc2ccc(-c3nnn[n-]3)cc21)c1ccc(C)cc1 ZINC000825080862 607945992 /nfs/dbraw/zinc/94/59/92/607945992.db2.gz CDIUPZRZHVSPHL-OAHLLOKOSA-N -1 3 361.449 3.648 20 0 FHADHM CC[C@H](CC(=O)N1CCc2ccc(-c3nn[n-]n3)cc21)c1ccc(C)cc1 ZINC000825080862 607945993 /nfs/dbraw/zinc/94/59/93/607945993.db2.gz CDIUPZRZHVSPHL-OAHLLOKOSA-N -1 3 361.449 3.648 20 0 FHADHM Cc1nnc(SCc2cccc(-c3nnn[n-]3)c2)n1[C@H]1CCC[C@@H](C)C1 ZINC000826337724 607965965 /nfs/dbraw/zinc/96/59/65/607965965.db2.gz YWYRBVFRFZANRP-WBMJQRKESA-N -1 3 369.498 3.810 20 0 FHADHM Cc1nnc(SCc2cccc(-c3nn[n-]n3)c2)n1[C@H]1CCC[C@@H](C)C1 ZINC000826337724 607965966 /nfs/dbraw/zinc/96/59/66/607965966.db2.gz YWYRBVFRFZANRP-WBMJQRKESA-N -1 3 369.498 3.810 20 0 FHADHM CC1(C)CN(c2nc(C(F)(F)F)ccc2-c2nnn[n-]2)Cc2ccccc21 ZINC000824812153 607967395 /nfs/dbraw/zinc/96/73/95/607967395.db2.gz KBXVOEWMSMHCDG-UHFFFAOYSA-N -1 3 374.370 3.578 20 0 FHADHM CC1(C)CN(c2nc(C(F)(F)F)ccc2-c2nn[n-]n2)Cc2ccccc21 ZINC000824812153 607967396 /nfs/dbraw/zinc/96/73/96/607967396.db2.gz KBXVOEWMSMHCDG-UHFFFAOYSA-N -1 3 374.370 3.578 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1 ZINC000823943732 607970323 /nfs/dbraw/zinc/97/03/23/607970323.db2.gz RWYNAXOTJXEPDZ-JLHYYAGUSA-N -1 3 367.840 3.582 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1 ZINC000823943732 607970324 /nfs/dbraw/zinc/97/03/24/607970324.db2.gz RWYNAXOTJXEPDZ-JLHYYAGUSA-N -1 3 367.840 3.582 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1-c1nc2ccccc2n1CC(F)(F)F ZINC000826371433 607974442 /nfs/dbraw/zinc/97/44/42/607974442.db2.gz GHQLEDDBOSLCHY-UHFFFAOYSA-N -1 3 362.290 3.585 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1-c1nc2ccccc2n1CC(F)(F)F ZINC000826371433 607974443 /nfs/dbraw/zinc/97/44/43/607974443.db2.gz GHQLEDDBOSLCHY-UHFFFAOYSA-N -1 3 362.290 3.585 20 0 FHADHM CCCn1c2ccc(-c3nnn[n-]3)cc2nc1-c1ccc2ncccc2c1 ZINC000825352594 607974869 /nfs/dbraw/zinc/97/48/69/607974869.db2.gz NYPOXHBLMJBMFU-UHFFFAOYSA-N -1 3 355.405 3.842 20 0 FHADHM CCCn1c2ccc(-c3nn[n-]n3)cc2nc1-c1ccc2ncccc2c1 ZINC000825352594 607974870 /nfs/dbraw/zinc/97/48/70/607974870.db2.gz NYPOXHBLMJBMFU-UHFFFAOYSA-N -1 3 355.405 3.842 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1OC[C@H](O)c1ccc(Cl)cc1Cl ZINC000826278433 607981876 /nfs/dbraw/zinc/98/18/76/607981876.db2.gz BTEYBXOPCFPYGC-AWEZNQCLSA-N -1 3 365.220 3.594 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1OC[C@H](O)c1ccc(Cl)cc1Cl ZINC000826278433 607981877 /nfs/dbraw/zinc/98/18/77/607981877.db2.gz BTEYBXOPCFPYGC-AWEZNQCLSA-N -1 3 365.220 3.594 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1OC[C@@H](O)c1ccc(Cl)cc1Cl ZINC000826278434 607982018 /nfs/dbraw/zinc/98/20/18/607982018.db2.gz BTEYBXOPCFPYGC-CQSZACIVSA-N -1 3 365.220 3.594 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1OC[C@@H](O)c1ccc(Cl)cc1Cl ZINC000826278434 607982019 /nfs/dbraw/zinc/98/20/19/607982019.db2.gz BTEYBXOPCFPYGC-CQSZACIVSA-N -1 3 365.220 3.594 20 0 FHADHM Cc1cc([C@H](NC(=O)c2ccc(-c3nnn[n-]3)cc2C)C2CC2)ccc1F ZINC000826262210 608009428 /nfs/dbraw/zinc/00/94/28/608009428.db2.gz HZEDRQRIGQPOFD-GOSISDBHSA-N -1 3 365.412 3.504 20 0 FHADHM Cc1cc([C@H](NC(=O)c2ccc(-c3nn[n-]n3)cc2C)C2CC2)ccc1F ZINC000826262210 608009429 /nfs/dbraw/zinc/00/94/29/608009429.db2.gz HZEDRQRIGQPOFD-GOSISDBHSA-N -1 3 365.412 3.504 20 0 FHADHM Clc1ccc2ncc(-c3nnn[n-]3)c(N3CCc4ccsc4C3)c2c1 ZINC000826352991 608019206 /nfs/dbraw/zinc/01/92/06/608019206.db2.gz WYXQRJUDNBFMQJ-UHFFFAOYSA-N -1 3 368.853 3.693 20 0 FHADHM Clc1ccc2ncc(-c3nn[n-]n3)c(N3CCc4ccsc4C3)c2c1 ZINC000826352991 608019207 /nfs/dbraw/zinc/01/92/07/608019207.db2.gz WYXQRJUDNBFMQJ-UHFFFAOYSA-N -1 3 368.853 3.693 20 0 FHADHM O=C(c1ccc(Oc2ccccc2-c2nnn[n-]2)c(Cl)c1)N1CCCC1 ZINC000826472957 608046711 /nfs/dbraw/zinc/04/67/11/608046711.db2.gz DTIBTVBKWRKJFM-UHFFFAOYSA-N -1 3 369.812 3.548 20 0 FHADHM O=C(c1ccc(Oc2ccccc2-c2nn[n-]n2)c(Cl)c1)N1CCCC1 ZINC000826472957 608046712 /nfs/dbraw/zinc/04/67/12/608046712.db2.gz DTIBTVBKWRKJFM-UHFFFAOYSA-N -1 3 369.812 3.548 20 0 FHADHM Brc1cc(-c2nn[n-]n2)ccc1N[C@H]1CCOc2ccccc21 ZINC000823826135 608047081 /nfs/dbraw/zinc/04/70/81/608047081.db2.gz DBEIDQBPTSAORM-ZDUSSCGKSA-N -1 3 372.226 3.565 20 0 FHADHM COc1ccccc1[C@@H](C)Nc1ccc(-c2nn[n-]n2)cc1Br ZINC000826219080 608047385 /nfs/dbraw/zinc/04/73/85/608047385.db2.gz SITMZFMNWOXIDQ-SNVBAGLBSA-N -1 3 374.242 3.811 20 0 FHADHM OCCCCCCNc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1 ZINC000826509733 608095438 /nfs/dbraw/zinc/09/54/38/608095438.db2.gz HNYAJLPALMYEQW-UHFFFAOYSA-N -1 3 371.416 3.763 20 0 FHADHM OCCCCCCNc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1 ZINC000826509733 608095439 /nfs/dbraw/zinc/09/54/39/608095439.db2.gz HNYAJLPALMYEQW-UHFFFAOYSA-N -1 3 371.416 3.763 20 0 FHADHM Cc1cc([C@H]2CN(c3ccc(Cl)cc3-c3nnn[n-]3)CCO2)ccc1F ZINC000826266210 608151549 /nfs/dbraw/zinc/15/15/49/608151549.db2.gz GUZUTCRPSBIQPF-QGZVFWFLSA-N -1 3 373.819 3.546 20 0 FHADHM Cc1cc([C@H]2CN(c3ccc(Cl)cc3-c3nn[n-]n3)CCO2)ccc1F ZINC000826266210 608151551 /nfs/dbraw/zinc/15/15/51/608151551.db2.gz GUZUTCRPSBIQPF-QGZVFWFLSA-N -1 3 373.819 3.546 20 0 FHADHM c1csc(Oc2ccc(OCc3cccc(-c4nnn[n-]4)c3)cc2)n1 ZINC000826516316 608154726 /nfs/dbraw/zinc/15/47/26/608154726.db2.gz GQDDTKVUWCXXCH-UHFFFAOYSA-N -1 3 351.391 3.695 20 0 FHADHM c1csc(Oc2ccc(OCc3cccc(-c4nn[n-]n4)c3)cc2)n1 ZINC000826516316 608154727 /nfs/dbraw/zinc/15/47/27/608154727.db2.gz GQDDTKVUWCXXCH-UHFFFAOYSA-N -1 3 351.391 3.695 20 0 FHADHM C[C@@H](OC(=O)[C@H](C)c1c(F)cccc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000824707102 608159328 /nfs/dbraw/zinc/15/93/28/608159328.db2.gz NMFYVQRXQZNSIN-GHMZBOCLSA-N -1 3 358.348 3.553 20 0 FHADHM C[C@@H](OC(=O)[C@H](C)c1c(F)cccc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000824707102 608159329 /nfs/dbraw/zinc/15/93/29/608159329.db2.gz NMFYVQRXQZNSIN-GHMZBOCLSA-N -1 3 358.348 3.553 20 0 FHADHM C[C@H](OC(=O)C1(c2ccc(F)cc2)CCC1)c1cccc(-c2nnn[n-]2)c1 ZINC000824712872 608181727 /nfs/dbraw/zinc/18/17/27/608181727.db2.gz DTIKBNRPWKNTHN-ZDUSSCGKSA-N -1 3 366.396 3.732 20 0 FHADHM C[C@H](OC(=O)C1(c2ccc(F)cc2)CCC1)c1cccc(-c2nn[n-]n2)c1 ZINC000824712872 608181728 /nfs/dbraw/zinc/18/17/28/608181728.db2.gz DTIKBNRPWKNTHN-ZDUSSCGKSA-N -1 3 366.396 3.732 20 0 FHADHM C[C@@H](OC(=O)C12CC3CC(CC(C3)C1)C2)c1cccc(-c2nnn[n-]2)c1 ZINC000824713613 608181898 /nfs/dbraw/zinc/18/18/98/608181898.db2.gz JETWDIRTTZCEOX-JSFDKUKPSA-N -1 3 352.438 3.687 20 0 FHADHM C[C@@H](OC(=O)C12CC3CC(CC(C3)C1)C2)c1cccc(-c2nn[n-]n2)c1 ZINC000824713613 608181900 /nfs/dbraw/zinc/18/19/00/608181900.db2.gz JETWDIRTTZCEOX-JSFDKUKPSA-N -1 3 352.438 3.687 20 0 FHADHM Cc1ccccc1C(C)(C)C(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000826306223 608184309 /nfs/dbraw/zinc/18/43/09/608184309.db2.gz SUXVQZLRCKZDAM-CQSZACIVSA-N -1 3 350.422 3.757 20 0 FHADHM Cc1ccccc1C(C)(C)C(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000826306223 608184312 /nfs/dbraw/zinc/18/43/12/608184312.db2.gz SUXVQZLRCKZDAM-CQSZACIVSA-N -1 3 350.422 3.757 20 0 FHADHM COc1ccc([C@@H](C)Nc2ccc3cc(-c4nnn[n-]4)ccc3n2)cc1F ZINC000826189094 608221585 /nfs/dbraw/zinc/22/15/85/608221585.db2.gz NEAMFKJWWBJKQG-LLVKDONJSA-N -1 3 364.384 3.736 20 0 FHADHM COc1ccc([C@@H](C)Nc2ccc3cc(-c4nn[n-]n4)ccc3n2)cc1F ZINC000826189094 608221587 /nfs/dbraw/zinc/22/15/87/608221587.db2.gz NEAMFKJWWBJKQG-LLVKDONJSA-N -1 3 364.384 3.736 20 0 FHADHM CC(=O)CCCCCCC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C(C)C ZINC000823967567 608224825 /nfs/dbraw/zinc/22/48/25/608224825.db2.gz OIAVUQRRCVUGHS-UHFFFAOYSA-N -1 3 371.485 3.533 20 0 FHADHM CC(=O)CCCCCCC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C(C)C ZINC000823967567 608224827 /nfs/dbraw/zinc/22/48/27/608224827.db2.gz OIAVUQRRCVUGHS-UHFFFAOYSA-N -1 3 371.485 3.533 20 0 FHADHM CC(C)(C)Oc1cc(F)ccc1NCc1ccc(-c2nnn[n-]2)cc1F ZINC000824119788 608227314 /nfs/dbraw/zinc/22/73/14/608227314.db2.gz QGYQYCODBIWEBH-UHFFFAOYSA-N -1 3 359.380 3.934 20 0 FHADHM CC(C)(C)Oc1cc(F)ccc1NCc1ccc(-c2nn[n-]n2)cc1F ZINC000824119788 608227316 /nfs/dbraw/zinc/22/73/16/608227316.db2.gz QGYQYCODBIWEBH-UHFFFAOYSA-N -1 3 359.380 3.934 20 0 FHADHM CCc1ccc([C@H]2CCCN2c2ccc3cc(-c4nnn[n-]4)ccc3n2)o1 ZINC000825704954 608228261 /nfs/dbraw/zinc/22/82/61/608228261.db2.gz RLRPKABYZXFMNZ-QGZVFWFLSA-N -1 3 360.421 3.912 20 0 FHADHM CCc1ccc([C@H]2CCCN2c2ccc3cc(-c4nn[n-]n4)ccc3n2)o1 ZINC000825704954 608228262 /nfs/dbraw/zinc/22/82/62/608228262.db2.gz RLRPKABYZXFMNZ-QGZVFWFLSA-N -1 3 360.421 3.912 20 0 FHADHM CCOCCC1(CNc2ccc3cc(-c4nnn[n-]4)ccc3n2)CCCC1 ZINC000825589138 608233120 /nfs/dbraw/zinc/23/31/20/608233120.db2.gz ANWXZPVPILNVTI-UHFFFAOYSA-N -1 3 366.469 3.814 20 0 FHADHM CCOCCC1(CNc2ccc3cc(-c4nn[n-]n4)ccc3n2)CCCC1 ZINC000825589138 608233121 /nfs/dbraw/zinc/23/31/21/608233121.db2.gz ANWXZPVPILNVTI-UHFFFAOYSA-N -1 3 366.469 3.814 20 0 FHADHM Fc1cccc([C@H](Nc2cccc(F)c2-c2nnn[n-]2)c2ccccn2)c1 ZINC000826376898 608234519 /nfs/dbraw/zinc/23/45/19/608234519.db2.gz XKNVVLGOYPIQLL-SFHVURJKSA-N -1 3 364.359 3.741 20 0 FHADHM Fc1cccc([C@H](Nc2cccc(F)c2-c2nn[n-]n2)c2ccccn2)c1 ZINC000826376898 608234521 /nfs/dbraw/zinc/23/45/21/608234521.db2.gz XKNVVLGOYPIQLL-SFHVURJKSA-N -1 3 364.359 3.741 20 0 FHADHM Cc1cccc([C@H](NCc2ccc(-c3nnn[n-]3)s2)c2ccccn2)c1 ZINC000826296986 608241844 /nfs/dbraw/zinc/24/18/44/608241844.db2.gz QJDJCWNFQTUODH-SFHVURJKSA-N -1 3 362.462 3.511 20 0 FHADHM Cc1cccc([C@H](NCc2ccc(-c3nn[n-]n3)s2)c2ccccn2)c1 ZINC000826296986 608241846 /nfs/dbraw/zinc/24/18/46/608241846.db2.gz QJDJCWNFQTUODH-SFHVURJKSA-N -1 3 362.462 3.511 20 0 FHADHM CC(C)[C@H]1C[C@@H](Nc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)CCO1 ZINC000824215011 608242087 /nfs/dbraw/zinc/24/20/87/608242087.db2.gz JITUFMHQFKXHJX-SMDDNHRTSA-N -1 3 355.364 3.501 20 0 FHADHM CC(C)[C@H]1C[C@@H](Nc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)CCO1 ZINC000824215011 608242089 /nfs/dbraw/zinc/24/20/89/608242089.db2.gz JITUFMHQFKXHJX-SMDDNHRTSA-N -1 3 355.364 3.501 20 0 FHADHM Cc1sc(NC(=O)[C@@H](c2ccccc2)C2CC2)c(-c2nnn[n-]2)c1C ZINC000826349434 608264883 /nfs/dbraw/zinc/26/48/83/608264883.db2.gz HSZHJJHBCFIITJ-HNNXBMFYSA-N -1 3 353.451 3.677 20 0 FHADHM Cc1sc(NC(=O)[C@@H](c2ccccc2)C2CC2)c(-c2nn[n-]n2)c1C ZINC000826349434 608264885 /nfs/dbraw/zinc/26/48/85/608264885.db2.gz HSZHJJHBCFIITJ-HNNXBMFYSA-N -1 3 353.451 3.677 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)c(N[C@H]2C[C@H]2c2ccccc2C(F)(F)F)n1 ZINC000826275178 608281820 /nfs/dbraw/zinc/28/18/20/608281820.db2.gz RBUXLDOYQBWXDB-JSGCOSHPSA-N -1 3 360.343 3.557 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)c(N[C@H]2C[C@H]2c2ccccc2C(F)(F)F)n1 ZINC000826275178 608281822 /nfs/dbraw/zinc/28/18/22/608281822.db2.gz RBUXLDOYQBWXDB-JSGCOSHPSA-N -1 3 360.343 3.557 20 0 FHADHM Clc1cncc(NCc2ccc(-c3ccccc3-c3nnn[n-]3)cc2)n1 ZINC000826354244 608296200 /nfs/dbraw/zinc/29/62/00/608296200.db2.gz UYJWRBRJWWVUJO-UHFFFAOYSA-N -1 3 363.812 3.589 20 0 FHADHM Clc1cncc(NCc2ccc(-c3ccccc3-c3nn[n-]n3)cc2)n1 ZINC000826354244 608296201 /nfs/dbraw/zinc/29/62/01/608296201.db2.gz UYJWRBRJWWVUJO-UHFFFAOYSA-N -1 3 363.812 3.589 20 0 FHADHM C[C@H](C(=O)NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1)c1ccco1 ZINC000824038890 608305109 /nfs/dbraw/zinc/30/51/09/608305109.db2.gz ABZCVOIITTYUBH-AWEZNQCLSA-N -1 3 373.416 3.547 20 0 FHADHM C[C@H](C(=O)NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1)c1ccco1 ZINC000824038890 608305111 /nfs/dbraw/zinc/30/51/11/608305111.db2.gz ABZCVOIITTYUBH-AWEZNQCLSA-N -1 3 373.416 3.547 20 0 FHADHM O=C(NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1)c1cccs1 ZINC000826441290 608306057 /nfs/dbraw/zinc/30/60/57/608306057.db2.gz XKFOGLRQNSTKHU-UHFFFAOYSA-N -1 3 361.430 3.525 20 0 FHADHM O=C(NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1)c1cccs1 ZINC000826441290 608306059 /nfs/dbraw/zinc/30/60/59/608306059.db2.gz XKFOGLRQNSTKHU-UHFFFAOYSA-N -1 3 361.430 3.525 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CSCc1ccn(C2CCCC2)n1 ZINC000826173755 608323262 /nfs/dbraw/zinc/32/32/62/608323262.db2.gz SWACHPOMDUIENQ-UHFFFAOYSA-N -1 3 370.482 3.620 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CSCc1ccn(C2CCCC2)n1 ZINC000826173755 608323263 /nfs/dbraw/zinc/32/32/63/608323263.db2.gz SWACHPOMDUIENQ-UHFFFAOYSA-N -1 3 370.482 3.620 20 0 FHADHM CS[C@@H](C)CCC(=O)Nc1sc2c(c1-c1nnn[n-]1)CC[C@@H](C)C2 ZINC000826225622 608338867 /nfs/dbraw/zinc/33/88/67/608338867.db2.gz GPNFCQMCFBCUGF-ZJUUUORDSA-N -1 3 365.528 3.523 20 0 FHADHM CS[C@@H](C)CCC(=O)Nc1sc2c(c1-c1nn[n-]n1)CC[C@@H](C)C2 ZINC000826225622 608338869 /nfs/dbraw/zinc/33/88/69/608338869.db2.gz GPNFCQMCFBCUGF-ZJUUUORDSA-N -1 3 365.528 3.523 20 0 FHADHM CCN(C(=O)C=Cc1cccs1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825366564 608343566 /nfs/dbraw/zinc/34/35/66/608343566.db2.gz BZYUINITBYSICD-VURMDHGXSA-N -1 3 359.842 3.648 20 0 FHADHM CCN(C(=O)C=Cc1cccs1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825366564 608343569 /nfs/dbraw/zinc/34/35/69/608343569.db2.gz BZYUINITBYSICD-VURMDHGXSA-N -1 3 359.842 3.648 20 0 FHADHM CCN(C(=O)[C@@H](C)c1ccccc1F)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825367043 608343812 /nfs/dbraw/zinc/34/38/12/608343812.db2.gz IJKXJNRMOWJNHT-NSHDSACASA-N -1 3 373.819 3.816 20 0 FHADHM CCN(C(=O)[C@@H](C)c1ccccc1F)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825367043 608343814 /nfs/dbraw/zinc/34/38/14/608343814.db2.gz IJKXJNRMOWJNHT-NSHDSACASA-N -1 3 373.819 3.816 20 0 FHADHM CCN(C(=O)[C@@H](C)c1cccs1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825367979 608343830 /nfs/dbraw/zinc/34/38/30/608343830.db2.gz YTTNXOZTTYOAND-JTQLQIEISA-N -1 3 361.858 3.738 20 0 FHADHM CCN(C(=O)[C@@H](C)c1cccs1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825367979 608343832 /nfs/dbraw/zinc/34/38/32/608343832.db2.gz YTTNXOZTTYOAND-JTQLQIEISA-N -1 3 361.858 3.738 20 0 FHADHM CCN(C(=O)[C@H](C)c1cccc(C)c1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825361065 608346640 /nfs/dbraw/zinc/34/66/40/608346640.db2.gz ATCIDKXDQVQXLI-CYBMUJFWSA-N -1 3 369.856 3.985 20 0 FHADHM CCN(C(=O)[C@H](C)c1cccc(C)c1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825361065 608346642 /nfs/dbraw/zinc/34/66/42/608346642.db2.gz ATCIDKXDQVQXLI-CYBMUJFWSA-N -1 3 369.856 3.985 20 0 FHADHM Fc1c(CSC[C@@H]2OCCc3ccccc32)cccc1-c1nnn[n-]1 ZINC000826370715 608404724 /nfs/dbraw/zinc/40/47/24/608404724.db2.gz FIBGAYLUMDMRDD-INIZCTEOSA-N -1 3 356.426 3.553 20 0 FHADHM Fc1c(CSC[C@@H]2OCCc3ccccc32)cccc1-c1nn[n-]n1 ZINC000826370715 608404725 /nfs/dbraw/zinc/40/47/25/608404725.db2.gz FIBGAYLUMDMRDD-INIZCTEOSA-N -1 3 356.426 3.553 20 0 FHADHM CC(C)C[C@H](C)CC(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000824228774 608481426 /nfs/dbraw/zinc/48/14/26/608481426.db2.gz KTKHIMABCXKZGN-HNNXBMFYSA-N -1 3 353.470 3.555 20 0 FHADHM CC(C)C[C@H](C)CC(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000824228774 608481428 /nfs/dbraw/zinc/48/14/28/608481428.db2.gz KTKHIMABCXKZGN-HNNXBMFYSA-N -1 3 353.470 3.555 20 0 FHADHM C[C@H](NCc1coc(-c2ccc(F)cc2)n1)c1cccc(-c2nn[n-]n2)c1 ZINC000824627281 608484664 /nfs/dbraw/zinc/48/46/64/608484664.db2.gz VXOBLAJGYATWFO-LBPRGKRZSA-N -1 3 364.384 3.512 20 0 FHADHM O=C(/C=C/C1CCCCC1)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000826400146 608487254 /nfs/dbraw/zinc/48/72/54/608487254.db2.gz QIRITLZJUJQLKP-IZZDOVSWSA-N -1 3 363.465 3.619 20 0 FHADHM O=C(/C=C/C1CCCCC1)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000826400146 608487255 /nfs/dbraw/zinc/48/72/55/608487255.db2.gz QIRITLZJUJQLKP-IZZDOVSWSA-N -1 3 363.465 3.619 20 0 FHADHM C[C@H]1CCCC[C@H]1CC(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000824936160 608487654 /nfs/dbraw/zinc/48/76/54/608487654.db2.gz FEHLRSGBEIOSQK-KXBFYZLASA-N -1 3 365.481 3.699 20 0 FHADHM C[C@H]1CCCC[C@H]1CC(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000824936160 608487655 /nfs/dbraw/zinc/48/76/55/608487655.db2.gz FEHLRSGBEIOSQK-KXBFYZLASA-N -1 3 365.481 3.699 20 0 FHADHM CSc1cccc(NC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1C ZINC000826231165 608518085 /nfs/dbraw/zinc/51/80/85/608518085.db2.gz ZXIBJAVVUDWIKP-GFCCVEGCSA-N -1 3 368.466 3.780 20 0 FHADHM CSc1cccc(NC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1C ZINC000826231165 608518087 /nfs/dbraw/zinc/51/80/87/608518087.db2.gz ZXIBJAVVUDWIKP-GFCCVEGCSA-N -1 3 368.466 3.780 20 0 FHADHM C[C@H]1C[C@H]1c1ccc(CN(Cc2ccc(-c3nnn[n-]3)s2)C2CC2)o1 ZINC000824899619 608518380 /nfs/dbraw/zinc/51/83/80/608518380.db2.gz LSYWAFYOQMILFR-XHDPSFHLSA-N -1 3 355.467 3.809 20 0 FHADHM C[C@H]1C[C@H]1c1ccc(CN(Cc2ccc(-c3nn[n-]n3)s2)C2CC2)o1 ZINC000824899619 608518382 /nfs/dbraw/zinc/51/83/82/608518382.db2.gz LSYWAFYOQMILFR-XHDPSFHLSA-N -1 3 355.467 3.809 20 0 FHADHM CC(C)(C)Oc1cccc(CNc2ccc(Cl)c(-c3nnn[n-]3)c2)n1 ZINC000824124645 608541785 /nfs/dbraw/zinc/54/17/85/608541785.db2.gz XUMOXLFFIPBIKS-UHFFFAOYSA-N -1 3 358.833 3.705 20 0 FHADHM CC(C)(C)Oc1cccc(CNc2ccc(Cl)c(-c3nn[n-]n3)c2)n1 ZINC000824124645 608541787 /nfs/dbraw/zinc/54/17/87/608541787.db2.gz XUMOXLFFIPBIKS-UHFFFAOYSA-N -1 3 358.833 3.705 20 0 FHADHM Clc1ccccc1C1=CCN(c2ncc(-c3nnn[n-]3)cc2Cl)CC1 ZINC000826353662 608556796 /nfs/dbraw/zinc/55/67/96/608556796.db2.gz YXVZCMWEJUZQNG-UHFFFAOYSA-N -1 3 373.247 3.862 20 0 FHADHM Clc1ccccc1C1=CCN(c2ncc(-c3nn[n-]n3)cc2Cl)CC1 ZINC000826353662 608556798 /nfs/dbraw/zinc/55/67/98/608556798.db2.gz YXVZCMWEJUZQNG-UHFFFAOYSA-N -1 3 373.247 3.862 20 0 FHADHM CC(C)(C)c1csc(NC(=O)c2ccc(Cl)c(-c3nnn[n-]3)c2)n1 ZINC000824135607 608573102 /nfs/dbraw/zinc/57/31/02/608573102.db2.gz HDQQBUIWQCITRH-UHFFFAOYSA-N -1 3 362.846 3.526 20 0 FHADHM CC(C)(C)c1csc(NC(=O)c2ccc(Cl)c(-c3nn[n-]n3)c2)n1 ZINC000824135607 608573103 /nfs/dbraw/zinc/57/31/03/608573103.db2.gz HDQQBUIWQCITRH-UHFFFAOYSA-N -1 3 362.846 3.526 20 0 FHADHM CCc1cccc(CC)c1NC(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000825723332 608573690 /nfs/dbraw/zinc/57/36/90/608573690.db2.gz YLEHFMUBNJVIQH-UHFFFAOYSA-N -1 3 355.829 3.897 20 0 FHADHM CCc1cccc(CC)c1NC(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000825723332 608573692 /nfs/dbraw/zinc/57/36/92/608573692.db2.gz YLEHFMUBNJVIQH-UHFFFAOYSA-N -1 3 355.829 3.897 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nnn[n-]2)c1)c1ccc(F)c(Cl)c1F ZINC000826453377 608574217 /nfs/dbraw/zinc/57/42/17/608574217.db2.gz IWSYQIOVOHNWLU-UHFFFAOYSA-N -1 3 370.146 3.704 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nn[n-]n2)c1)c1ccc(F)c(Cl)c1F ZINC000826453377 608574219 /nfs/dbraw/zinc/57/42/19/608574219.db2.gz IWSYQIOVOHNWLU-UHFFFAOYSA-N -1 3 370.146 3.704 20 0 FHADHM Clc1ccc(CN(Cc2ccc(-c3nnn[n-]3)o2)C2CC2)cc1Cl ZINC000826352267 608612363 /nfs/dbraw/zinc/61/23/63/608612363.db2.gz VESYHOFGZJYXMW-UHFFFAOYSA-N -1 3 364.236 3.931 20 0 FHADHM Clc1ccc(CN(Cc2ccc(-c3nn[n-]n3)o2)C2CC2)cc1Cl ZINC000826352267 608612368 /nfs/dbraw/zinc/61/23/68/608612368.db2.gz VESYHOFGZJYXMW-UHFFFAOYSA-N -1 3 364.236 3.931 20 0 FHADHM C[C@@H](c1cc2ccccc2o1)N(C)Cc1cccc(-c2nnn[n-]2)c1F ZINC000824764761 608640689 /nfs/dbraw/zinc/64/06/89/608640689.db2.gz YEEQRPIEYWPDCE-LBPRGKRZSA-N -1 3 351.385 3.945 20 0 FHADHM CCc1ccc(NC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1C ZINC000825711396 608820341 /nfs/dbraw/zinc/82/03/41/608820341.db2.gz ARODSZRCEFIWLV-CYBMUJFWSA-N -1 3 350.426 3.620 20 0 FHADHM CCc1ccc(NC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1C ZINC000825711396 608820345 /nfs/dbraw/zinc/82/03/45/608820345.db2.gz ARODSZRCEFIWLV-CYBMUJFWSA-N -1 3 350.426 3.620 20 0 FHADHM O=C(O[C@H](C1CCCCC1)C(F)(F)F)c1ccc(-c2nnn[n-]2)cc1 ZINC000826462231 608826932 /nfs/dbraw/zinc/82/69/32/608826932.db2.gz RRZPKGGDTGRBCT-CYBMUJFWSA-N -1 3 354.332 3.535 20 0 FHADHM O=C(O[C@H](C1CCCCC1)C(F)(F)F)c1ccc(-c2nn[n-]n2)cc1 ZINC000826462231 608826933 /nfs/dbraw/zinc/82/69/33/608826933.db2.gz RRZPKGGDTGRBCT-CYBMUJFWSA-N -1 3 354.332 3.535 20 0 FHADHM COc1ccc(F)cc1[C@H](C)N[C@H](C)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000826209050 609134096 /nfs/dbraw/zinc/13/40/96/609134096.db2.gz KOUSQSBUVYIAEY-MNOVXSKESA-N -1 3 359.380 3.565 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)N1CCC[C@@H]1/C=C\c1ccccc1 ZINC000826402067 609138229 /nfs/dbraw/zinc/13/82/29/609138229.db2.gz MKMMEYHKTIXCBR-GTVYGZLISA-N -1 3 371.444 3.584 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)N1CCC[C@@H]1/C=C\c1ccccc1 ZINC000826402067 609138230 /nfs/dbraw/zinc/13/82/30/609138230.db2.gz MKMMEYHKTIXCBR-GTVYGZLISA-N -1 3 371.444 3.584 20 0 FHADHM COc1ccc(Cl)cc1CN[C@@H](C)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000826208708 609139195 /nfs/dbraw/zinc/13/91/95/609139195.db2.gz WXUXYMYRWIRTEE-JTQLQIEISA-N -1 3 361.808 3.519 20 0 FHADHM FC(F)Oc1ccc(N[C@H]2CCCc3cc(-c4nnn[n-]4)ccc32)cc1 ZINC000826369455 609163157 /nfs/dbraw/zinc/16/31/57/609163157.db2.gz DHQSTRHBAMEFTH-INIZCTEOSA-N -1 3 357.364 3.958 20 0 FHADHM FC(F)Oc1ccc(N[C@H]2CCCc3cc(-c4nn[n-]n4)ccc32)cc1 ZINC000826369455 609163158 /nfs/dbraw/zinc/16/31/58/609163158.db2.gz DHQSTRHBAMEFTH-INIZCTEOSA-N -1 3 357.364 3.958 20 0 FHADHM c1cc2c(cc1N[C@@H]1CCCc3cc(-c4nnn[n-]4)ccc31)OCCCO2 ZINC000826518492 609164154 /nfs/dbraw/zinc/16/41/54/609164154.db2.gz PKTBFBYZIFKJFL-QGZVFWFLSA-N -1 3 363.421 3.518 20 0 FHADHM c1cc2c(cc1N[C@@H]1CCCc3cc(-c4nn[n-]n4)ccc31)OCCCO2 ZINC000826518492 609164156 /nfs/dbraw/zinc/16/41/56/609164156.db2.gz PKTBFBYZIFKJFL-QGZVFWFLSA-N -1 3 363.421 3.518 20 0 FHADHM Cc1c(C)n(-c2ccccc2)c(NC(=O)C[C@H]2C=CCC2)c1-c1nnn[n-]1 ZINC000826233859 609168029 /nfs/dbraw/zinc/16/80/29/609168029.db2.gz YDZZVBCOKYXAAM-HNNXBMFYSA-N -1 3 362.437 3.569 20 0 FHADHM Cc1c(C)n(-c2ccccc2)c(NC(=O)C[C@H]2C=CCC2)c1-c1nn[n-]n1 ZINC000826233859 609168031 /nfs/dbraw/zinc/16/80/31/609168031.db2.gz YDZZVBCOKYXAAM-HNNXBMFYSA-N -1 3 362.437 3.569 20 0 FHADHM Cc1c(C)n(-c2ccccc2)c(NC(=O)c2ccsc2)c1-c1nnn[n-]1 ZINC000826234171 609168359 /nfs/dbraw/zinc/16/83/59/609168359.db2.gz KTBSAKIZDGUGKV-UHFFFAOYSA-N -1 3 364.434 3.588 20 0 FHADHM Cc1c(C)n(-c2ccccc2)c(NC(=O)c2ccsc2)c1-c1nn[n-]n1 ZINC000826234171 609168361 /nfs/dbraw/zinc/16/83/61/609168361.db2.gz KTBSAKIZDGUGKV-UHFFFAOYSA-N -1 3 364.434 3.588 20 0 FHADHM CC(C)C[C@@H]1C[C@@H](Nc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)CCO1 ZINC000824243571 609171068 /nfs/dbraw/zinc/17/10/68/609171068.db2.gz JKXVJRHAGBWKMG-QWHCGFSZSA-N -1 3 369.391 3.891 20 0 FHADHM Clc1ccccc1C1=CCN(Cc2ccc(-c3nnn[n-]3)s2)CC1 ZINC000826353120 609175221 /nfs/dbraw/zinc/17/52/21/609175221.db2.gz BUQPSKLORAQACY-UHFFFAOYSA-N -1 3 357.870 3.871 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1SCc1ncc(Cl)cc1Cl ZINC000826371942 609178237 /nfs/dbraw/zinc/17/82/37/609178237.db2.gz ACOFBWWQUMUGAB-UHFFFAOYSA-N -1 3 356.213 4.000 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1SCc1ncc(Cl)cc1Cl ZINC000826371942 609178238 /nfs/dbraw/zinc/17/82/38/609178238.db2.gz ACOFBWWQUMUGAB-UHFFFAOYSA-N -1 3 356.213 4.000 20 0 FHADHM C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC000824763274 609218527 /nfs/dbraw/zinc/21/85/27/609218527.db2.gz MMURLSKTRDZEGL-AWEZNQCLSA-N -1 3 372.432 3.695 20 0 FHADHM C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC000824763274 609218528 /nfs/dbraw/zinc/21/85/28/609218528.db2.gz MMURLSKTRDZEGL-AWEZNQCLSA-N -1 3 372.432 3.695 20 0 FHADHM C[C@@H](Nc1ccc(OC[C@@H]2CCCO2)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000824655558 609236660 /nfs/dbraw/zinc/23/66/60/609236660.db2.gz DQKQDPWKSSCGIR-KUHUBIRLSA-N -1 3 365.437 3.598 20 0 FHADHM C[C@@H](Nc1ccc(OC[C@@H]2CCCO2)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000824655558 609236661 /nfs/dbraw/zinc/23/66/61/609236661.db2.gz DQKQDPWKSSCGIR-KUHUBIRLSA-N -1 3 365.437 3.598 20 0 FHADHM C[C@H](Nc1cccc(OC[C@@H]2CCCO2)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824662835 609236929 /nfs/dbraw/zinc/23/69/29/609236929.db2.gz SBBMLQVGZZTTCM-LIRRHRJNSA-N -1 3 365.437 3.598 20 0 FHADHM C[C@H](Nc1cccc(OC[C@@H]2CCCO2)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824662835 609236930 /nfs/dbraw/zinc/23/69/30/609236930.db2.gz SBBMLQVGZZTTCM-LIRRHRJNSA-N -1 3 365.437 3.598 20 0 FHADHM CC(C)CCn1ccc(N[C@H]2CCCc3cc(-c4nnn[n-]4)ccc32)n1 ZINC000824249348 609248172 /nfs/dbraw/zinc/24/81/72/609248172.db2.gz MFSQTCZETQELCM-KRWDZBQOSA-N -1 3 351.458 3.599 20 0 FHADHM CC(C)CCn1ccc(N[C@H]2CCCc3cc(-c4nn[n-]n4)ccc32)n1 ZINC000824249348 609248173 /nfs/dbraw/zinc/24/81/73/609248173.db2.gz MFSQTCZETQELCM-KRWDZBQOSA-N -1 3 351.458 3.599 20 0 FHADHM Cc1c(N[C@H]2CCCc3cc(-c4nnn[n-]4)ccc32)cnn1CC(C)C ZINC000826242200 609254710 /nfs/dbraw/zinc/25/47/10/609254710.db2.gz FAHFKVLZZFSYIY-KRWDZBQOSA-N -1 3 351.458 3.517 20 0 FHADHM Cc1c(N[C@H]2CCCc3cc(-c4nn[n-]n4)ccc32)cnn1CC(C)C ZINC000826242200 609254712 /nfs/dbraw/zinc/25/47/12/609254712.db2.gz FAHFKVLZZFSYIY-KRWDZBQOSA-N -1 3 351.458 3.517 20 0 FHADHM CCCCn1ncc(N[C@@H]2CCCc3cc(-c4nnn[n-]4)ccc32)c1C ZINC000825301799 609254932 /nfs/dbraw/zinc/25/49/32/609254932.db2.gz OXJVMIXKAIZTHM-QGZVFWFLSA-N -1 3 351.458 3.661 20 0 FHADHM CCCCn1ncc(N[C@@H]2CCCc3cc(-c4nn[n-]n4)ccc32)c1C ZINC000825301799 609254934 /nfs/dbraw/zinc/25/49/34/609254934.db2.gz OXJVMIXKAIZTHM-QGZVFWFLSA-N -1 3 351.458 3.661 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000825553006 609267193 /nfs/dbraw/zinc/26/71/93/609267193.db2.gz HPMVKOPANQAQBN-LBPRGKRZSA-N -1 3 352.398 3.608 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000825553006 609267194 /nfs/dbraw/zinc/26/71/94/609267194.db2.gz HPMVKOPANQAQBN-LBPRGKRZSA-N -1 3 352.398 3.608 20 0 FHADHM C[C@H](Nc1cccc(OCC(F)(F)F)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824663359 609274367 /nfs/dbraw/zinc/27/43/67/609274367.db2.gz YBURGDXAHUSIJZ-NSHDSACASA-N -1 3 363.343 3.981 20 0 FHADHM C[C@H](Nc1cccc(OCC(F)(F)F)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824663359 609274369 /nfs/dbraw/zinc/27/43/69/609274369.db2.gz YBURGDXAHUSIJZ-NSHDSACASA-N -1 3 363.343 3.981 20 0 FHADHM COc1ccc(OC(C)C)c(N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000826210299 609278665 /nfs/dbraw/zinc/27/86/65/609278665.db2.gz LWKPOSVJSNPSGB-ZDUSSCGKSA-N -1 3 353.426 3.836 20 0 FHADHM COc1ccc(OC(C)C)c(N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000826210299 609278667 /nfs/dbraw/zinc/27/86/67/609278667.db2.gz LWKPOSVJSNPSGB-ZDUSSCGKSA-N -1 3 353.426 3.836 20 0 FHADHM COc1ccc(N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c(Br)c1 ZINC000826210320 609281940 /nfs/dbraw/zinc/28/19/40/609281940.db2.gz MTOOSRDWLKOWKJ-JTQLQIEISA-N -1 3 374.242 3.811 20 0 FHADHM COc1ccc(N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c(Br)c1 ZINC000826210320 609281942 /nfs/dbraw/zinc/28/19/42/609281942.db2.gz MTOOSRDWLKOWKJ-JTQLQIEISA-N -1 3 374.242 3.811 20 0 FHADHM CC(C)Oc1ccccc1NC(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000824333830 609296023 /nfs/dbraw/zinc/29/60/23/609296023.db2.gz NOBMNOZVUKSNSA-UHFFFAOYSA-N -1 3 357.801 3.560 20 0 FHADHM CC(C)Oc1ccccc1NC(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000824333830 609296025 /nfs/dbraw/zinc/29/60/25/609296025.db2.gz NOBMNOZVUKSNSA-UHFFFAOYSA-N -1 3 357.801 3.560 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1N[C@H](C)c1nc2ccccc2o1 ZINC000824324389 609301757 /nfs/dbraw/zinc/30/17/57/609301757.db2.gz NNMWINPRPIUEPO-GFCCVEGCSA-N -1 3 364.409 3.968 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1N[C@H](C)c1nc2ccccc2o1 ZINC000824324389 609301759 /nfs/dbraw/zinc/30/17/59/609301759.db2.gz NNMWINPRPIUEPO-GFCCVEGCSA-N -1 3 364.409 3.968 20 0 FHADHM C[C@H]1CCC[C@@H]1NC(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000824937179 609317804 /nfs/dbraw/zinc/31/78/04/609317804.db2.gz ODUCMGWJKLPZGR-BBRMVZONSA-N -1 3 363.421 3.577 20 0 FHADHM C[C@H]1CCC[C@@H]1NC(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000824937179 609317806 /nfs/dbraw/zinc/31/78/06/609317806.db2.gz ODUCMGWJKLPZGR-BBRMVZONSA-N -1 3 363.421 3.577 20 0 FHADHM C[C@@H](N[C@@H](c1ccccc1)c1ccccn1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824539312 609322836 /nfs/dbraw/zinc/32/28/36/609322836.db2.gz MSKQTECMVYCXQE-VLIAUNLRSA-N -1 3 374.423 3.841 20 0 FHADHM C[C@@H](N[C@@H](c1ccccc1)c1ccccn1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824539312 609322838 /nfs/dbraw/zinc/32/28/38/609322838.db2.gz MSKQTECMVYCXQE-VLIAUNLRSA-N -1 3 374.423 3.841 20 0 FHADHM COc1ccc(Cl)cc1CN[C@@H](C)c1ccc(-c2nnn[n-]2)cc1F ZINC000826208442 609331239 /nfs/dbraw/zinc/33/12/39/609331239.db2.gz KOXDLVSFCNLMFT-JTQLQIEISA-N -1 3 361.808 3.519 20 0 FHADHM COc1ccc(Cl)cc1CN[C@@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000826208442 609331241 /nfs/dbraw/zinc/33/12/41/609331241.db2.gz KOXDLVSFCNLMFT-JTQLQIEISA-N -1 3 361.808 3.519 20 0 FHADHM COCCOc1ccc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2F)c(C)c1 ZINC000826162582 609348119 /nfs/dbraw/zinc/34/81/19/609348119.db2.gz JBMMOVQORLTMCF-ZDUSSCGKSA-N -1 3 371.416 3.513 20 0 FHADHM COCCOc1ccc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2F)c(C)c1 ZINC000826162582 609348121 /nfs/dbraw/zinc/34/81/21/609348121.db2.gz JBMMOVQORLTMCF-ZDUSSCGKSA-N -1 3 371.416 3.513 20 0 FHADHM C[C@@H]1CCCN(C(=O)c2ccccc2Oc2ccccc2-c2nnn[n-]2)C1 ZINC000824936510 609361064 /nfs/dbraw/zinc/36/10/64/609361064.db2.gz IJLHWLWAGRVBLT-CQSZACIVSA-N -1 3 363.421 3.531 20 0 FHADHM C[C@@H]1CCCN(C(=O)c2ccccc2Oc2ccccc2-c2nn[n-]n2)C1 ZINC000824936510 609361067 /nfs/dbraw/zinc/36/10/67/609361067.db2.gz IJLHWLWAGRVBLT-CQSZACIVSA-N -1 3 363.421 3.531 20 0 FHADHM C[C@H]1CC[C@]2(CCN(C(=O)Nc3ccc(-c4nnn[n-]4)cc3Cl)C2)C1 ZINC000824919679 609405227 /nfs/dbraw/zinc/40/52/27/609405227.db2.gz WTOIJPDIKLLQPR-GTNSWQLSSA-N -1 3 360.849 3.564 20 0 FHADHM C[C@H]1CC[C@]2(CCN(C(=O)Nc3ccc(-c4nn[n-]n4)cc3Cl)C2)C1 ZINC000824919679 609405228 /nfs/dbraw/zinc/40/52/28/609405228.db2.gz WTOIJPDIKLLQPR-GTNSWQLSSA-N -1 3 360.849 3.564 20 0 FHADHM CCc1csc([C@@H]2CCCN(c3ccc(-c4nnn[n-]4)c(Cl)c3)C2)n1 ZINC000825739221 609425024 /nfs/dbraw/zinc/42/50/24/609425024.db2.gz BTBNIBAGZPCYMG-LLVKDONJSA-N -1 3 374.901 3.923 20 0 FHADHM CCc1csc([C@@H]2CCCN(c3ccc(-c4nn[n-]n4)c(Cl)c3)C2)n1 ZINC000825739221 609425026 /nfs/dbraw/zinc/42/50/26/609425026.db2.gz BTBNIBAGZPCYMG-LLVKDONJSA-N -1 3 374.901 3.923 20 0 FHADHM COc1cc(NCc2ccc(-c3nnn[n-]3)s2)cc(OC)c1C(C)C ZINC000826181457 609446478 /nfs/dbraw/zinc/44/64/78/609446478.db2.gz ZSDHYUQWYNRFNE-UHFFFAOYSA-N -1 3 359.455 3.681 20 0 FHADHM CC[C@@H](C)Sc1ccc(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)c(C)c1 ZINC000825075853 609450104 /nfs/dbraw/zinc/45/01/04/609450104.db2.gz RNNPJIKTSJRSPN-LLVKDONJSA-N -1 3 356.455 3.646 20 0 FHADHM CC[C@@H](C)Sc1ccc(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)c(C)c1 ZINC000825075853 609450106 /nfs/dbraw/zinc/45/01/06/609450106.db2.gz RNNPJIKTSJRSPN-LLVKDONJSA-N -1 3 356.455 3.646 20 0 FHADHM C[C@@H](Sc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)C(=O)OC(C)(C)C ZINC000824757431 609452170 /nfs/dbraw/zinc/45/21/70/609452170.db2.gz WNUYSJPFTKXFHV-MRVPVSSYSA-N -1 3 374.388 3.708 20 0 FHADHM C[C@@H](Sc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)C(=O)OC(C)(C)C ZINC000824757431 609452173 /nfs/dbraw/zinc/45/21/73/609452173.db2.gz WNUYSJPFTKXFHV-MRVPVSSYSA-N -1 3 374.388 3.708 20 0 FHADHM CCc1cnc(CSc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)o1 ZINC000825734234 609452862 /nfs/dbraw/zinc/45/28/62/609452862.db2.gz JVEFIUQSEUUHDB-UHFFFAOYSA-N -1 3 355.345 3.728 20 0 FHADHM CCc1cnc(CSc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)o1 ZINC000825734234 609452864 /nfs/dbraw/zinc/45/28/64/609452864.db2.gz JVEFIUQSEUUHDB-UHFFFAOYSA-N -1 3 355.345 3.728 20 0 FHADHM Cc1cc(SC(C)(C)C)ccc1NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC000826272501 609452972 /nfs/dbraw/zinc/45/29/72/609452972.db2.gz MVVMSPHFPGYAPD-UHFFFAOYSA-N -1 3 356.455 3.646 20 0 FHADHM Cc1cc(SC(C)(C)C)ccc1NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC000826272501 609452974 /nfs/dbraw/zinc/45/29/74/609452974.db2.gz MVVMSPHFPGYAPD-UHFFFAOYSA-N -1 3 356.455 3.646 20 0 FHADHM Clc1cc2ncc(Oc3ccccc3-c3nnn[n-]3)nc2cc1Cl ZINC000826351649 609455018 /nfs/dbraw/zinc/45/50/18/609455018.db2.gz UXUQPDRGIDNBFB-UHFFFAOYSA-N -1 3 359.176 3.909 20 0 FHADHM Clc1cc2ncc(Oc3ccccc3-c3nn[n-]n3)nc2cc1Cl ZINC000826351649 609455020 /nfs/dbraw/zinc/45/50/20/609455020.db2.gz UXUQPDRGIDNBFB-UHFFFAOYSA-N -1 3 359.176 3.909 20 0 FHADHM O=C(Nc1cccc(Sc2ccccc2)c1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC000826457055 609457842 /nfs/dbraw/zinc/45/78/42/609457842.db2.gz KDFKLECWFIUBDK-UHFFFAOYSA-N -1 3 362.418 3.598 20 0 FHADHM O=C(Nc1cccc(Sc2ccccc2)c1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC000826457055 609457845 /nfs/dbraw/zinc/45/78/45/609457845.db2.gz KDFKLECWFIUBDK-UHFFFAOYSA-N -1 3 362.418 3.598 20 0 FHADHM Cc1ccc(NCc2cccc(-c3nnn[n-]3)c2F)cc1Br ZINC000826291784 609476229 /nfs/dbraw/zinc/47/62/29/609476229.db2.gz VWYAKERZDDQVQP-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Cc1ccc(NCc2cccc(-c3nn[n-]n3)c2F)cc1Br ZINC000826291784 609476231 /nfs/dbraw/zinc/47/62/31/609476231.db2.gz VWYAKERZDDQVQP-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Cc1ccc(Br)cc1NCc1cccc(-c2nnn[n-]2)c1F ZINC000826281196 609476415 /nfs/dbraw/zinc/47/64/15/609476415.db2.gz IFTPREKLYPBXCE-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Cc1ccc(Br)cc1NCc1cccc(-c2nn[n-]n2)c1F ZINC000826281196 609476417 /nfs/dbraw/zinc/47/64/17/609476417.db2.gz IFTPREKLYPBXCE-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Fc1c(CNc2cccc(OCC(F)(F)F)c2)cccc1-c1nnn[n-]1 ZINC000826371052 609476494 /nfs/dbraw/zinc/47/64/94/609476494.db2.gz QHDSXYICAJZCLM-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM Fc1c(CNc2cccc(OCC(F)(F)F)c2)cccc1-c1nn[n-]n1 ZINC000826371052 609476497 /nfs/dbraw/zinc/47/64/97/609476497.db2.gz QHDSXYICAJZCLM-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM COc1cc(CNc2cc(-c3nnn[n-]3)ccc2C)ccc1OC(C)C ZINC000826179274 609480285 /nfs/dbraw/zinc/48/02/85/609480285.db2.gz HPHBSQBCKQNFEJ-UHFFFAOYSA-N -1 3 353.426 3.583 20 0 FHADHM COc1cc(CNc2cc(-c3nn[n-]n3)ccc2C)ccc1OC(C)C ZINC000826179274 609480287 /nfs/dbraw/zinc/48/02/87/609480287.db2.gz HPHBSQBCKQNFEJ-UHFFFAOYSA-N -1 3 353.426 3.583 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NCc1cc(Cl)cc2cccnc21 ZINC000826186227 609483700 /nfs/dbraw/zinc/48/37/00/609483700.db2.gz KCUVXRXZFJSMAN-UHFFFAOYSA-N -1 3 366.812 3.689 20 0 FHADHM Cc1ccc(CNc2ccc(OCc3cccc(-c4nnn[n-]4)c3)cc2)o1 ZINC000826288501 609484125 /nfs/dbraw/zinc/48/41/25/609484125.db2.gz JQHZLTSHCCNFQO-UHFFFAOYSA-N -1 3 361.405 3.959 20 0 FHADHM Cc1ccc(CNc2ccc(OCc3cccc(-c4nn[n-]n4)c3)cc2)o1 ZINC000826288501 609484127 /nfs/dbraw/zinc/48/41/27/609484127.db2.gz JQHZLTSHCCNFQO-UHFFFAOYSA-N -1 3 361.405 3.959 20 0 FHADHM Cc1ccc(CNc2ccc(OCc3cccc(-c4nnn[n-]4)c3)cc2)nc1 ZINC000826288613 609486864 /nfs/dbraw/zinc/48/68/64/609486864.db2.gz PJISFKOIJIYEGV-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM Cc1ccc(CNc2ccc(OCc3cccc(-c4nn[n-]n4)c3)cc2)nc1 ZINC000826288613 609486866 /nfs/dbraw/zinc/48/68/66/609486866.db2.gz PJISFKOIJIYEGV-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM CC(C)Oc1ccc(NCc2cnc(C(C)C)s2)cc1-c1nnn[n-]1 ZINC000824329204 609492081 /nfs/dbraw/zinc/49/20/81/609492081.db2.gz LCYMDXPRMJYETF-UHFFFAOYSA-N -1 3 358.471 3.846 20 0 FHADHM CC(C)Oc1ccc(NCc2cnc(C(C)C)s2)cc1-c1nn[n-]n1 ZINC000824329204 609492082 /nfs/dbraw/zinc/49/20/82/609492082.db2.gz LCYMDXPRMJYETF-UHFFFAOYSA-N -1 3 358.471 3.846 20 0 FHADHM CCN(C(=O)c1ccc(-c2ccccc2)o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825379542 609501857 /nfs/dbraw/zinc/50/18/57/609501857.db2.gz HXQQZUBRMVNPAD-UHFFFAOYSA-N -1 3 359.389 3.793 20 0 FHADHM CCN(C(=O)c1ccc(-c2ccccc2)o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825379542 609501859 /nfs/dbraw/zinc/50/18/59/609501859.db2.gz HXQQZUBRMVNPAD-UHFFFAOYSA-N -1 3 359.389 3.793 20 0 FHADHM Cc1cc(F)ccc1N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)C1=CCC1 ZINC000826269076 609526157 /nfs/dbraw/zinc/52/61/57/609526157.db2.gz ZMJSHTSDUUDATQ-UHFFFAOYSA-N -1 3 363.396 3.568 20 0 FHADHM Cc1cc(F)ccc1N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)C1=CCC1 ZINC000826269076 609526158 /nfs/dbraw/zinc/52/61/58/609526158.db2.gz ZMJSHTSDUUDATQ-UHFFFAOYSA-N -1 3 363.396 3.568 20 0 FHADHM CC[C@H](Nc1nccc(C)c1-c1nnn[n-]1)c1ccccc1OC(F)F ZINC000825147555 609532893 /nfs/dbraw/zinc/53/28/93/609532893.db2.gz JEHCGTINRKCAOB-LBPRGKRZSA-N -1 3 360.368 3.735 20 0 FHADHM CC[C@H](Nc1nccc(C)c1-c1nn[n-]n1)c1ccccc1OC(F)F ZINC000825147555 609532895 /nfs/dbraw/zinc/53/28/95/609532895.db2.gz JEHCGTINRKCAOB-LBPRGKRZSA-N -1 3 360.368 3.735 20 0 FHADHM CC[C@H](Nc1ncc(Cl)c(C)c1-c1nnn[n-]1)c1ccccc1OC ZINC000825146278 609532959 /nfs/dbraw/zinc/53/29/59/609532959.db2.gz BKKXBLQJZXETQK-ZDUSSCGKSA-N -1 3 358.833 3.795 20 0 FHADHM CC[C@H](Nc1ncc(Cl)c(C)c1-c1nn[n-]n1)c1ccccc1OC ZINC000825146278 609532960 /nfs/dbraw/zinc/53/29/60/609532960.db2.gz BKKXBLQJZXETQK-ZDUSSCGKSA-N -1 3 358.833 3.795 20 0 FHADHM Cc1cc(C)cc([C@H]2CCN(c3ncc(-c4nnn[n-]4)cc3Cl)C2)c1 ZINC000826264240 609602700 /nfs/dbraw/zinc/60/27/00/609602700.db2.gz GVTXMPZINJGBKL-ZDUSSCGKSA-N -1 3 354.845 3.526 20 0 FHADHM Cc1cc(C)cc([C@H]2CCN(c3ncc(-c4nn[n-]n4)cc3Cl)C2)c1 ZINC000826264240 609602701 /nfs/dbraw/zinc/60/27/01/609602701.db2.gz GVTXMPZINJGBKL-ZDUSSCGKSA-N -1 3 354.845 3.526 20 0 FHADHM O=C(CCCc1cccs1)OCc1ccc(Cl)cc1-c1nnn[n-]1 ZINC000826406999 609617744 /nfs/dbraw/zinc/61/77/44/609617744.db2.gz WQPANPNQLPAUBS-UHFFFAOYSA-N -1 3 362.842 3.648 20 0 FHADHM O=C(CCCc1cccs1)OCc1ccc(Cl)cc1-c1nn[n-]n1 ZINC000826406999 609617745 /nfs/dbraw/zinc/61/77/45/609617745.db2.gz WQPANPNQLPAUBS-UHFFFAOYSA-N -1 3 362.842 3.648 20 0 FHADHM O=S(=O)([N-][C@H]1CCC[C@H]1c1ccccc1)c1cccnc1C(F)(F)F ZINC000583042096 936388222 /nfs/dbraw/zinc/38/82/22/936388222.db2.gz HVITYNRHVGCBEL-KBPBESRZSA-N -1 3 370.396 3.715 20 0 FHADHM C=CCN(Cc1cccc(C#N)c1)Cc1cc(=O)oc2c(C)c([O-])ccc12 ZINC000063300631 927169173 /nfs/dbraw/zinc/16/91/73/927169173.db2.gz FUQVFHLVYGKUIH-UHFFFAOYSA-N -1 3 360.413 3.867 20 0 FHADHM CO[C@](C)(C(=O)Nc1ccc(Br)cc1[O-])c1ccccc1F ZINC000583121759 937143130 /nfs/dbraw/zinc/14/31/30/937143130.db2.gz FZLQBHOFGAYMDP-INIZCTEOSA-N -1 3 368.202 3.794 20 0 FHADHM CCN(C(=O)c1c[n-]c2ccc(Br)cc2c1=O)C1CCCC1 ZINC000579743777 927262531 /nfs/dbraw/zinc/26/25/31/927262531.db2.gz FMADNDBJLORCNF-UHFFFAOYSA-N -1 3 363.255 3.695 20 0 FHADHM CC[C@@H]([N-]S(=O)(=O)c1cc(Cl)ccc1C(F)(F)F)[C@@H]1CCCO1 ZINC000510047539 927404568 /nfs/dbraw/zinc/40/45/68/927404568.db2.gz AGQLRDBVZJBJIU-NEPJUHHUSA-N -1 3 371.808 3.595 20 0 FHADHM CCCC(=CC(=O)N[N-]C(=O)c1ccccc1Br)CCC ZINC000092197898 927522449 /nfs/dbraw/zinc/52/24/49/927522449.db2.gz QDHLHKDIVMIUTN-UHFFFAOYSA-N -1 3 353.260 3.737 20 0 FHADHM O=C([O-])[C@@H](CNCc1ncc(-c2ccccc2)s1)Cc1ccccc1 ZINC000683171738 927737556 /nfs/dbraw/zinc/73/75/56/927737556.db2.gz PMQWCHCGTXQERZ-QGZVFWFLSA-N -1 3 352.459 3.843 20 0 FHADHM COc1ccc([C@H](CC(=O)[O-])NCc2ccc(OC(C)C)c(OC)c2)cc1 ZINC000683171189 927746340 /nfs/dbraw/zinc/74/63/40/927746340.db2.gz GFWZDOVVUQDWGI-SFHVURJKSA-N -1 3 373.449 3.797 20 0 FHADHM CC[C@@H](C)Oc1cc(CN[C@H](C(=O)[O-])c2cccc(F)c2)ccc1OC ZINC000683172832 927757528 /nfs/dbraw/zinc/75/75/28/927757528.db2.gz DVJYJFZNSMZADG-YJYMSZOUSA-N -1 3 361.413 3.927 20 0 FHADHM O=C([O-])c1cccc(CNCc2ccc(OCC(F)(F)F)c(F)c2)c1 ZINC000683176784 927788301 /nfs/dbraw/zinc/78/83/01/927788301.db2.gz RPCYCDXVBVDKQN-UHFFFAOYSA-N -1 3 357.303 3.755 20 0 FHADHM Cn1cc(CN[C@H]2C[C@H](C(=O)[O-])c3ccccc32)c(C2CCCCC2)n1 ZINC000579814686 927848864 /nfs/dbraw/zinc/84/88/64/927848864.db2.gz AKLUBIRNIUFEBP-OALUTQOASA-N -1 3 353.466 3.871 20 0 FHADHM O=C(Nc1ccc(CNc2ccccc2)cc1)c1cc(=O)[n-]c(C2CC2)n1 ZINC000646887022 928031507 /nfs/dbraw/zinc/03/15/07/928031507.db2.gz AJMANHINBMXLSV-UHFFFAOYSA-N -1 3 360.417 3.924 20 0 FHADHM Cc1nsc(C)c1CSc1nc2c(cnn2-c2ccccc2)c(=O)[n-]1 ZINC000583182488 937216075 /nfs/dbraw/zinc/21/60/75/937216075.db2.gz SRCUUCLQZVPPJS-UHFFFAOYSA-N -1 3 369.475 3.887 20 0 FHADHM [O-]c1ccc(F)c(CNCCOc2cccc(Br)c2)c1F ZINC000510094857 928180809 /nfs/dbraw/zinc/18/08/09/928180809.db2.gz ZTMOFQJGMRYPFK-UHFFFAOYSA-N -1 3 358.182 3.602 20 0 FHADHM CC(C)n1ncc2cc(C=CC(=O)Nc3ccc(Cl)cc3[O-])c(=O)[nH]c21 ZINC000254943215 928439784 /nfs/dbraw/zinc/43/97/84/928439784.db2.gz ZFRPDAYWAREOBB-UTCJRWHESA-N -1 3 372.812 3.729 20 0 FHADHM CCC(CC)(COCc1ccccc1)C(=O)Nc1nnc(C(F)(F)F)[n-]1 ZINC000648746280 928564422 /nfs/dbraw/zinc/56/44/22/928564422.db2.gz SKHKOEAQIZHRRG-UHFFFAOYSA-N -1 3 370.375 3.785 20 0 FHADHM CCC(CC)(COCc1ccccc1)C(=O)Nc1nc(C(F)(F)F)n[n-]1 ZINC000648746280 928564429 /nfs/dbraw/zinc/56/44/29/928564429.db2.gz SKHKOEAQIZHRRG-UHFFFAOYSA-N -1 3 370.375 3.785 20 0 FHADHM Cc1sc2[n-]c([C@@H](C)OC(=O)CCc3ccccc3F)nc(=O)c2c1C ZINC000021583378 928643042 /nfs/dbraw/zinc/64/30/42/928643042.db2.gz PEANHLBNPVCWQR-LLVKDONJSA-N -1 3 374.437 3.978 20 0 FHADHM CCCN(C(=O)c1ccccc1NC([O-])=NO[C@@H]1CCCCO1)C(C)C ZINC000274873145 928937539 /nfs/dbraw/zinc/93/75/39/928937539.db2.gz XQYFRMAKTBXUTJ-QGZVFWFLSA-N -1 3 363.458 3.527 20 0 FHADHM CCCN(C(=O)c1ccccc1NC(=O)[N-]O[C@@H]1CCCCO1)C(C)C ZINC000274873145 928937549 /nfs/dbraw/zinc/93/75/49/928937549.db2.gz XQYFRMAKTBXUTJ-QGZVFWFLSA-N -1 3 363.458 3.527 20 0 FHADHM Cc1ccc(NC(=O)c2ccccc2)cc1NC([O-])=NO[C@@H]1CCCCO1 ZINC000274948839 929069648 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O=C(NCc1ccc([O-])c(Br)c1)N1CCC[C@H]1c1ccc[nH]1 ZINC000126246230 937370563 /nfs/dbraw/zinc/37/05/63/937370563.db2.gz OLJZPCJRNVVAHH-AWEZNQCLSA-N -1 3 364.243 3.530 20 0 FHADHM O=C(Nc1nnc(C=Cc2ccco2)s1)c1c[n-]c2ccccc2c1=O ZINC000255115664 930249829 /nfs/dbraw/zinc/24/98/29/930249829.db2.gz KOFCOLWYGCVJQN-FPLPWBNLSA-N -1 3 364.386 3.808 20 0 FHADHM CCOc1cc(/C=C\C(=O)c2cnn(CC)c2)cc(Br)c1[O-] ZINC000216942964 930266632 /nfs/dbraw/zinc/26/66/32/930266632.db2.gz SXGSDZVQGNZCNI-WAYWQWQTSA-N -1 3 365.227 3.666 20 0 FHADHM O=C(Nc1ccc(Br)cc1[O-])c1cccc2ccc(=O)[nH]c21 ZINC000580127552 930287212 /nfs/dbraw/zinc/28/72/12/930287212.db2.gz QRLBZQAEIKRISG-UHFFFAOYSA-N -1 3 359.179 3.661 20 0 FHADHM O=C([N-]c1nnc(/C=C\c2ccco2)s1)c1cc(F)c(F)c(F)c1 ZINC000255322334 930450178 /nfs/dbraw/zinc/45/01/78/930450178.db2.gz YGJIHEKKUTXFKU-ARJAWSKDSA-N -1 3 351.309 3.971 20 0 FHADHM Cc1cc(=O)[n-]c(C(C)(C)NC(=O)[C@@H](C)c2cccc(CC(C)C)c2)n1 ZINC000622739631 930528665 /nfs/dbraw/zinc/52/86/65/930528665.db2.gz 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COc1cc(SC)ccc1[N-]S(=O)(=O)/C=C\c1ccc(F)cc1 ZINC000588599476 938831904 /nfs/dbraw/zinc/83/19/04/938831904.db2.gz ZZCKYPCXPYRGKJ-KTKRTIGZSA-N -1 3 353.440 3.969 20 0 FHADHM CC(C)(C)c1nnc([N-]C(=O)c2cnc(Oc3ccccc3)cn2)s1 ZINC000091027997 938887685 /nfs/dbraw/zinc/88/76/85/938887685.db2.gz UNWZLQSVWDLWAA-UHFFFAOYSA-N -1 3 355.423 3.670 20 0 FHADHM Cc1cc(Br)c(F)cc1NC(=O)c1cc(F)cc2n[n-]nc21 ZINC000506014847 945213764 /nfs/dbraw/zinc/21/37/64/945213764.db2.gz MCVCDDCDGKLASM-UHFFFAOYSA-N -1 3 367.153 3.559 20 0 FHADHM O=C(N[C@@H]1C[C@H]1c1ccc2ccccc2c1)c1cc(=O)c2ccccc2[n-]1 ZINC000437296039 945213817 /nfs/dbraw/zinc/21/38/17/945213817.db2.gz WODSVGCFZSUSIP-AZUAARDMSA-N -1 3 354.409 3.967 20 0 FHADHM Cc1ccc([O-])c(CN2CCO[C@@H](c3cccc(C(F)(F)F)c3)C2)n1 ZINC000093760147 938929466 /nfs/dbraw/zinc/92/94/66/938929466.db2.gz KYUAOSBGPQPZHZ-QGZVFWFLSA-N -1 3 352.356 3.688 20 0 FHADHM O=C(c1ccc(O)cc1[O-])N(CCc1ccccn1)Cc1ccc(F)cc1 ZINC000171226801 938965260 /nfs/dbraw/zinc/96/52/60/938965260.db2.gz RZFXLVADGAQSCJ-UHFFFAOYSA-N -1 3 366.392 3.517 20 0 FHADHM N#C/C(=C\c1ccc([O-])cc1)C(=O)N1CCc2cc(Br)ccc21 ZINC000185876053 939013567 /nfs/dbraw/zinc/01/35/67/939013567.db2.gz OLGGGUSXYQVIFP-NTEUORMPSA-N -1 3 369.218 3.651 20 0 FHADHM COc1ccc(N(C(=O)c2cc(F)cc3n[n-]nc32)[C@@H](C)C2CC2)cc1 ZINC000548865914 939113121 /nfs/dbraw/zinc/11/31/21/939113121.db2.gz MQJLKWOCTZQQPC-NSHDSACASA-N -1 3 354.385 3.551 20 0 FHADHM Cc1nc(COc2ccc(F)cc2)sc1C(=O)Nc1ncccc1[O-] ZINC000023444509 939142445 /nfs/dbraw/zinc/14/24/45/939142445.db2.gz ZPTLNMVSYUCFDZ-UHFFFAOYSA-N -1 3 359.382 3.523 20 0 FHADHM CCCCC[C@H](C)NC(=O)Nc1ccc([N-]S(=O)(=O)CC)c(OC)c1 ZINC000065788171 939149420 /nfs/dbraw/zinc/14/94/20/939149420.db2.gz PGKMMOBNLOBAJZ-ZDUSSCGKSA-N -1 3 371.503 3.547 20 0 FHADHM CCc1ccc(CC(=O)Nc2cccc(-c3nc(CC)cc(=O)[n-]3)c2)cc1 ZINC000151339446 945251175 /nfs/dbraw/zinc/25/11/75/945251175.db2.gz SFTXJKCEWFZMKO-UHFFFAOYSA-N -1 3 361.445 3.743 20 0 FHADHM C[C@H](CC(=O)N=c1cc([C@H]2CCCO2)[n-][nH]1)c1ccc(C(F)(F)F)cc1 ZINC000473856404 945251470 /nfs/dbraw/zinc/25/14/70/945251470.db2.gz PEPPFNHYGPUBGX-IAQYHMDHSA-N -1 3 367.371 3.834 20 0 FHADHM O=C([N-]c1cc(-c2ccccc2)on1)c1csc(-c2ncccc2F)n1 ZINC000507465666 945254274 /nfs/dbraw/zinc/25/42/74/945254274.db2.gz QPHLDCAGKFPHJJ-UHFFFAOYSA-N -1 3 366.377 3.673 20 0 FHADHM O=S(=O)([N-]Cc1cccc(-c2ccccn2)c1)c1ccc(Cl)s1 ZINC000438951377 945258117 /nfs/dbraw/zinc/25/81/17/945258117.db2.gz UZXXLOBVPAXRKP-UHFFFAOYSA-N -1 3 364.879 3.942 20 0 FHADHM Cc1c([N-]S(=O)(=O)c2ccc3c(c2)C[C@H](C)O3)cccc1-c1ncco1 ZINC000427303275 945271096 /nfs/dbraw/zinc/27/10/96/945271096.db2.gz YTZKCMUGOMMWJU-LBPRGKRZSA-N -1 3 370.430 3.774 20 0 FHADHM COc1ccccc1CN(Cc1c(F)ccc([O-])c1F)C[C@H]1CCCO1 ZINC000507484925 945273165 /nfs/dbraw/zinc/27/31/65/945273165.db2.gz KOZIVEDNCGHWSN-OAHLLOKOSA-N -1 3 363.404 3.860 20 0 FHADHM CC[C@H](CC(=O)N[C@]1(C(=O)[O-])CCCN(Cc2ccccc2)C1)C(C)(C)C ZINC001123379447 939824423 /nfs/dbraw/zinc/82/44/23/939824423.db2.gz VYXFQUZCTMZTMT-XMSQKQJNSA-N -1 3 374.525 3.684 20 0 FHADHM O=[N+]([O-])c1ccc([O-])cc1CN1CCCCC[C@@H]1C[C@H](O)c1ccco1 ZINC000091962767 939886361 /nfs/dbraw/zinc/88/63/61/939886361.db2.gz DCWQKAAELQPRFK-QAPCUYQASA-N -1 3 360.410 3.762 20 0 FHADHM CCOC1(C[N-]S(=O)(=O)c2cccc(Cl)c2Cl)CCCC1 ZINC000549522388 945283636 /nfs/dbraw/zinc/28/36/36/945283636.db2.gz DBQPYQWALOHZSH-UHFFFAOYSA-N -1 3 352.283 3.621 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000819772239 945285026 /nfs/dbraw/zinc/28/50/26/945285026.db2.gz BCBOMVXYRPDSHN-XZHRJIJLSA-N -1 3 352.369 3.714 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000819772239 945285034 /nfs/dbraw/zinc/28/50/34/945285034.db2.gz BCBOMVXYRPDSHN-XZHRJIJLSA-N -1 3 352.369 3.714 20 0 FHADHM O=C(NCc1ncccc1[O-])c1sc2ccccc2c1Br ZINC000569774015 939960815 /nfs/dbraw/zinc/96/08/15/939960815.db2.gz WFVOSOVQWXSNJL-UHFFFAOYSA-N -1 3 363.236 3.694 20 0 FHADHM CN(C)[C@@H](CNC(=O)c1cc([O-])ccc1Cl)c1ccccc1Cl ZINC000431655447 940060739 /nfs/dbraw/zinc/06/07/39/940060739.db2.gz YJEPXDNSZUQNPT-INIZCTEOSA-N -1 3 353.249 3.732 20 0 FHADHM CCOC(=O)c1ccc(NC(=O)c2ccn(C3CCCCC3)n2)c([O-])c1 ZINC000472443151 940155507 /nfs/dbraw/zinc/15/55/07/940155507.db2.gz GZZDRYIYZPUAEB-UHFFFAOYSA-N -1 3 357.410 3.523 20 0 FHADHM C[C@@H](C(=O)OCc1cc(-c2nnn[n-]2)ccc1F)c1ccc(Cl)s1 ZINC000819882459 945305067 /nfs/dbraw/zinc/30/50/67/945305067.db2.gz AFEKUWADMLUVRJ-MRVPVSSYSA-N -1 3 366.805 3.568 20 0 FHADHM C[C@@H](C(=O)OCc1cc(-c2nn[n-]n2)ccc1F)c1ccc(Cl)s1 ZINC000819882459 945305077 /nfs/dbraw/zinc/30/50/77/945305077.db2.gz AFEKUWADMLUVRJ-MRVPVSSYSA-N -1 3 366.805 3.568 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2cccc(-c3ncco3)c2C)cc1C ZINC000427350674 945305183 /nfs/dbraw/zinc/30/51/83/945305183.db2.gz UZSWYCGSNCSDNU-UHFFFAOYSA-N -1 3 358.419 3.768 20 0 FHADHM Cc1cc(=O)[n-]c(C(C)(C)NC(=O)[C@@H](C)c2c(Cl)cccc2Cl)n1 ZINC000636115749 940259193 /nfs/dbraw/zinc/25/91/93/940259193.db2.gz TYWOSCHYWFEZHW-JTQLQIEISA-N -1 3 368.264 3.952 20 0 FHADHM CC(C)c1nc2n(n1)CCC[C@H]2NC(=O)c1cc([O-])c2ccccc2c1 ZINC000376095571 940301752 /nfs/dbraw/zinc/30/17/52/940301752.db2.gz NSIZEDXBSOFCTO-MRXNPFEDSA-N -1 3 350.422 3.525 20 0 FHADHM O=C(c1cc(=O)c2ccccc2[n-]1)N1C[C@@H](c2ccccc2)C2(CCC2)C1 ZINC000413971954 940340364 /nfs/dbraw/zinc/34/03/64/940340364.db2.gz BWURASOLFPHHBP-SFHVURJKSA-N -1 3 358.441 3.938 20 0 FHADHM COC(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2N2CCCCC2)[n-]1 ZINC000431757464 940474323 /nfs/dbraw/zinc/47/43/23/940474323.db2.gz WSVYPHPWMKXRLP-UHFFFAOYSA-N -1 3 361.829 3.697 20 0 FHADHM O=C(OCCOCC(F)(F)C(F)F)c1cccc2[n-]c(C(F)F)nc21 ZINC000924080270 940476273 /nfs/dbraw/zinc/47/62/73/940476273.db2.gz OFSQEGMJOYXZIF-UHFFFAOYSA-N -1 3 370.249 3.574 20 0 FHADHM Cc1ccc(CC(=O)[N-]OCc2ccc(F)cc2)cc1Br ZINC000782690290 940481119 /nfs/dbraw/zinc/48/11/19/940481119.db2.gz JQQVLNDJZAZRSD-UHFFFAOYSA-N -1 3 352.203 3.687 20 0 FHADHM Cc1noc(C2CCC(NC(=O)c3cc([O-])c4ccccc4c3)CC2)n1 ZINC000376225284 940488855 /nfs/dbraw/zinc/48/88/55/940488855.db2.gz IYODTXNWDRTIMY-UHFFFAOYSA-N -1 3 351.406 3.693 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H](C)c3c(F)cncc3F)nc2)n1 ZINC000376237470 940505485 /nfs/dbraw/zinc/50/54/85/940505485.db2.gz TWZJZOATMKIBLH-JTQLQIEISA-N -1 3 357.364 3.653 20 0 FHADHM CCSc1cccc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2[O-])c1 ZINC000172200752 940505638 /nfs/dbraw/zinc/50/56/38/940505638.db2.gz CMCCSPGVKVLKLA-QGZVFWFLSA-N -1 3 370.474 3.748 20 0 FHADHM O=C(c1cc([O-])c2ccccc2c1)N1CCC(n2cc(Cl)cn2)CC1 ZINC000376240518 940507761 /nfs/dbraw/zinc/50/77/61/940507761.db2.gz OEQRSLDGIOOQRK-UHFFFAOYSA-N -1 3 355.825 3.873 20 0 FHADHM O=C(c1ccc(F)cc1)[C@H]1CCCN(C(=O)c2cc([O-])ccc2Cl)C1 ZINC000431794507 940509336 /nfs/dbraw/zinc/50/93/36/940509336.db2.gz LZLYIAOMEWZMOK-ZDUSSCGKSA-N -1 3 361.800 3.920 20 0 FHADHM COc1ccc([O-])c(C(=O)Nc2ccc3nc(N4CCCC4)sc3c2)c1 ZINC000613325789 940597851 /nfs/dbraw/zinc/59/78/51/940597851.db2.gz GZPQBFRLKDMZKU-UHFFFAOYSA-N -1 3 369.446 3.863 20 0 FHADHM Cc1ccc(CCN(Cc2ccco2)C(=O)c2ccc(O)cc2[O-])cc1 ZINC000175341893 940848865 /nfs/dbraw/zinc/84/88/65/940848865.db2.gz XZRUVWCATRFPKT-UHFFFAOYSA-N -1 3 351.402 3.884 20 0 FHADHM Cc1cc(S(=O)(=O)[N-][C@H](c2ccccc2)c2ccncc2)c(F)cc1F ZINC000175789536 940929486 /nfs/dbraw/zinc/92/94/86/940929486.db2.gz JWRFZODYOKRZQU-LJQANCHMSA-N -1 3 374.412 3.736 20 0 FHADHM CC[C@@H]1CCC[C@@H]1C[N-]S(=O)(=O)c1csc(-c2ccccc2)n1 ZINC001211889444 945361081 /nfs/dbraw/zinc/36/10/81/945361081.db2.gz BXYPTPOVSHENMW-UKRRQHHQSA-N -1 3 350.509 3.915 20 0 FHADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)C/C=C/c3ccccc3F)cc2)n1 ZINC000175819252 940937238 /nfs/dbraw/zinc/93/72/38/940937238.db2.gz BEASOPQUMQGVPI-GQCTYLIASA-N -1 3 363.392 3.926 20 0 FHADHM CCc1c(C(=O)Nc2cccc([O-])c2F)cnn1-c1ccc(OC)cc1 ZINC000186278837 940973911 /nfs/dbraw/zinc/97/39/11/940973911.db2.gz VVICGYZFDCYTPH-UHFFFAOYSA-N -1 3 355.369 3.540 20 0 FHADHM CC(=O)Nc1nc2ccc(NC(=O)c3cc([O-])ccc3Cl)cc2s1 ZINC000431827527 941017153 /nfs/dbraw/zinc/01/71/53/941017153.db2.gz GOXLHSNYCYSOIZ-UHFFFAOYSA-N -1 3 361.810 3.866 20 0 FHADHM O=C(Cc1cc(Cl)ccc1Br)[N-]OCCC(F)(F)F ZINC000162842707 941060475 /nfs/dbraw/zinc/06/04/75/941060475.db2.gz QQTZECLKEMJUIX-UHFFFAOYSA-N -1 3 360.557 3.645 20 0 FHADHM C=Cc1ccc(S(=O)(=O)[N-]c2ccc(OCC3CCOCC3)cc2)cc1 ZINC000414376208 941066416 /nfs/dbraw/zinc/06/64/16/941066416.db2.gz SXYMGEMJRKLFKP-UHFFFAOYSA-N -1 3 373.474 3.936 20 0 FHADHM Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)c1cccc2n[n-]nc21 ZINC000187192765 941081021 /nfs/dbraw/zinc/08/10/21/941081021.db2.gz YSDDDWGCKDGHDH-UHFFFAOYSA-N -1 3 371.400 3.771 20 0 FHADHM Cc1c(NC(=O)c2ccccc2)cccc1NC(=O)c1cccc2n[n-]nc21 ZINC000187288819 941088202 /nfs/dbraw/zinc/08/82/02/941088202.db2.gz IZRMEYQRYYMYCT-UHFFFAOYSA-N -1 3 371.400 3.771 20 0 FHADHM Cc1cc(S(=O)(=O)[N-]c2ccc(CN(C)C)cc2F)sc1Cl ZINC000414397381 941094211 /nfs/dbraw/zinc/09/42/11/941094211.db2.gz OXQWOYRIFJAOHX-UHFFFAOYSA-N -1 3 362.879 3.711 20 0 FHADHM CC(C)COc1ccc(S(=O)(=O)Nc2cc([O-])c(F)cc2F)cc1 ZINC000414400311 941098460 /nfs/dbraw/zinc/09/84/60/941098460.db2.gz WOEYFAIZTYBVJJ-UHFFFAOYSA-N -1 3 357.378 3.506 20 0 FHADHM O=C(NCc1nccn1C(F)F)c1cc(Oc2ccccc2)ccc1[O-] ZINC000177402502 941121997 /nfs/dbraw/zinc/12/19/97/941121997.db2.gz JKCJIRAYYPGNFD-UHFFFAOYSA-N -1 3 359.332 3.706 20 0 FHADHM CCc1ccc(S(=O)(=O)[N-]c2ccc(OCCOC)c(Cl)c2)cc1 ZINC000511512790 941157762 /nfs/dbraw/zinc/15/77/62/941157762.db2.gz HYTAYLWTXHMNET-UHFFFAOYSA-N -1 3 369.870 3.728 20 0 FHADHM COc1ncc(Cl)cc1-c1noc(C=C([O-])c2ccccc2Cl)n1 ZINC001211647557 941357618 /nfs/dbraw/zinc/35/76/18/941357618.db2.gz VORDYUNBEDIPHR-UHFFFAOYSA-N -1 3 364.188 3.872 20 0 FHADHM Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NC(=O)c1ccc(C)cc1[O-] ZINC000181017190 941360549 /nfs/dbraw/zinc/36/05/49/941360549.db2.gz VASHJWQRHXLWTA-JTQLQIEISA-N -1 3 355.360 3.567 20 0 FHADHM CC(C)[C@@H]1CN([C@H](C(=O)[O-])c2ccccc2Br)CCS1 ZINC000659788454 941395576 /nfs/dbraw/zinc/39/55/76/941395576.db2.gz OKPWSUCRMIDPDA-KBPBESRZSA-N -1 3 358.301 3.648 20 0 FHADHM C[C@]12CCN([C@H](C(=O)[O-])c3ccccc3Br)C[C@H]1C2(F)F ZINC000659795724 941400360 /nfs/dbraw/zinc/40/03/60/941400360.db2.gz GELSCRXEIZTAKO-DYEKYZERSA-N -1 3 360.198 3.552 20 0 FHADHM O=C([O-])[C@@H]1CN(Cc2nnc(-c3ccccc3)s2)C[C@H]1c1ccccc1 ZINC000659797200 941401554 /nfs/dbraw/zinc/40/15/54/941401554.db2.gz RLCWXJHVUBHFQS-DLBZAZTESA-N -1 3 365.458 3.505 20 0 FHADHM O=C([O-])[C@]12CN(Cc3csc(Cc4ccccc4)n3)C[C@H]1CCCC2 ZINC000659798691 941402130 /nfs/dbraw/zinc/40/21/30/941402130.db2.gz NNZRYYCECXFWHT-OXQOHEQNSA-N -1 3 356.491 3.811 20 0 FHADHM CN(Cc1cc(Cl)ccc1OCc1cccnc1)[C@H]1C[C@@H](C(=O)[O-])C1 ZINC000659801809 941404695 /nfs/dbraw/zinc/40/46/95/941404695.db2.gz NLLPMJIFTPERFK-KDYLLFBJSA-N -1 3 360.841 3.609 20 0 FHADHM CCOC(=O)c1ncc(NC(=O)c2cc(C3CC3)nc3ccc(C)cc32)[n-]1 ZINC000617873908 941415297 /nfs/dbraw/zinc/41/52/97/941415297.db2.gz ROECBJUATFXRHH-UHFFFAOYSA-N -1 3 364.405 3.573 20 0 FHADHM CCOC(=O)c1nc(NC(=O)c2cc(C3CC3)nc3ccc(C)cc32)c[n-]1 ZINC000617873908 941415300 /nfs/dbraw/zinc/41/53/00/941415300.db2.gz ROECBJUATFXRHH-UHFFFAOYSA-N -1 3 364.405 3.573 20 0 FHADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)c3cnc(C(C)C)nc3C)c2)n1 ZINC000892736536 941496348 /nfs/dbraw/zinc/49/63/48/941496348.db2.gz KNEXULPVBCJJHN-UHFFFAOYSA-N -1 3 364.405 3.599 20 0 FHADHM Cc1ccc(C(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)c([O-])c1 ZINC000183797629 941550517 /nfs/dbraw/zinc/55/05/17/941550517.db2.gz KFEVFJOONXSQEU-KRWDZBQOSA-N -1 3 365.351 3.933 20 0 FHADHM Cc1ccc(Cl)c(S(=O)(=O)[N-]CC[C@@H]2CCO[C@H](C)C2)c1Cl ZINC000544101291 941584851 /nfs/dbraw/zinc/58/48/51/941584851.db2.gz QJFPWVRHXKGWRA-VXGBXAGGSA-N -1 3 366.310 3.785 20 0 FHADHM Cc1nc(C)c(CCC(=O)N2CC[C@@H](c3ccccc3)C[C@@H]2C)c(=O)[n-]1 ZINC000377278938 941613058 /nfs/dbraw/zinc/61/30/58/941613058.db2.gz RYAULKGBRAGGGO-KBXCAEBGSA-N -1 3 353.466 3.526 20 0 FHADHM CC(=CC(=O)Nc1ccc(-c2nnn[n-]2)cc1)c1ccc(C(F)(F)F)cc1 ZINC000729357006 941728439 /nfs/dbraw/zinc/72/84/39/941728439.db2.gz LXRBMUUFNVKUCT-KHPPLWFESA-N -1 3 373.338 3.928 20 0 FHADHM CC(=CC(=O)Nc1ccc(-c2nn[n-]n2)cc1)c1ccc(C(F)(F)F)cc1 ZINC000729357006 941728441 /nfs/dbraw/zinc/72/84/41/941728441.db2.gz LXRBMUUFNVKUCT-KHPPLWFESA-N -1 3 373.338 3.928 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)c1ccccc1SC(F)(F)F ZINC000729357466 941731956 /nfs/dbraw/zinc/73/19/56/941731956.db2.gz VMTIDKUFVGELQW-UHFFFAOYSA-N -1 3 365.340 3.731 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)c1ccccc1SC(F)(F)F ZINC000729357466 941731961 /nfs/dbraw/zinc/73/19/61/941731961.db2.gz VMTIDKUFVGELQW-UHFFFAOYSA-N -1 3 365.340 3.731 20 0 FHADHM CCN(CC)C(=O)c1cccc(OC(=O)c2cc(-c3ccc(C)o3)[n-]n2)c1 ZINC000174521927 941734505 /nfs/dbraw/zinc/73/45/05/941734505.db2.gz AZGDWWRRNYEIDV-UHFFFAOYSA-N -1 3 367.405 3.679 20 0 FHADHM CCN(CC)C(=O)c1cccc(OC(=O)c2cc(-c3ccc(C)o3)n[n-]2)c1 ZINC000174521927 941734509 /nfs/dbraw/zinc/73/45/09/941734509.db2.gz AZGDWWRRNYEIDV-UHFFFAOYSA-N -1 3 367.405 3.679 20 0 FHADHM CO[C@H]1CCCC[C@@H]1Oc1cc(C)cc([O-])c1I ZINC001225510645 941822166 /nfs/dbraw/zinc/82/21/66/941822166.db2.gz KTJDFQZFUNIDSZ-RYUDHWBXSA-N -1 3 362.207 3.642 20 0 FHADHM Cc1cc([O-])c(I)c(O[C@@H](C)Cc2ccco2)c1 ZINC001225511866 941830598 /nfs/dbraw/zinc/83/05/98/941830598.db2.gz WRVMUBIRNZMDRL-JTQLQIEISA-N -1 3 358.175 3.908 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(Cl)c(Cl)c1)N1C[C@@H]2CCC[C@@]2(C(=O)[O-])C1 ZINC000262215376 941866108 /nfs/dbraw/zinc/86/61/08/941866108.db2.gz URQAWMLWSLAGCP-PSVSLLHZSA-N -1 3 371.264 3.507 20 0 FHADHM CC[C@@H](Cc1ccccc1)NC(=O)c1c[n-]c2c(Cl)cccc2c1=O ZINC001143499117 941954062 /nfs/dbraw/zinc/95/40/62/941954062.db2.gz GVQMIBGZNBGRFS-AWEZNQCLSA-N -1 3 354.837 3.933 20 0 FHADHM C[C@H](NC(=O)c1cc([O-])ccc1Cl)c1nc(-c2ccc(F)cc2)no1 ZINC000377798627 941995765 /nfs/dbraw/zinc/99/57/65/941995765.db2.gz KUMBPMMCSNTJKG-VIFPVBQESA-N -1 3 361.760 3.726 20 0 FHADHM COc1c(NCc2c(F)ccc([O-])c2F)cc(Cl)cc1C(=O)N(C)C ZINC000513641552 942051136 /nfs/dbraw/zinc/05/11/36/942051136.db2.gz 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CC[C@H](C)NC(=O)c1ccc(NCc2cc(=O)[n-]c(C3CC3)n2)c(C)c1 ZINC000417009053 943287702 /nfs/dbraw/zinc/28/77/02/943287702.db2.gz JUDJVXQQNQPBJN-ZDUSSCGKSA-N -1 3 354.454 3.508 20 0 FHADHM CC1CCN(C(=O)c2ccccc2NCc2cc(=O)[n-]c(C3CC3)n2)CC1 ZINC000417014437 943290282 /nfs/dbraw/zinc/29/02/82/943290282.db2.gz LBCBFXVIKRIFOE-UHFFFAOYSA-N -1 3 366.465 3.544 20 0 FHADHM Cc1ccc(CN[C@H](CN2CCCc3ccccc32)C(=O)[O-])c(Cl)c1 ZINC000584617582 943323311 /nfs/dbraw/zinc/32/33/11/943323311.db2.gz YMYWBRLZTRPCRF-GOSISDBHSA-N -1 3 358.869 3.644 20 0 FHADHM Cc1cc(S(=O)(=O)[N-]CCCC2CCC2)sc1Br ZINC000711228027 943333964 /nfs/dbraw/zinc/33/39/64/943333964.db2.gz GQXCXMFHNBVGCL-UHFFFAOYSA-N -1 3 352.319 3.678 20 0 FHADHM CC(C)c1ccc(C[C@H]2CCN(C(=O)c3cc(=O)[n-]c(C4CC4)n3)C2)cc1 ZINC000584663943 943348214 /nfs/dbraw/zinc/34/82/14/943348214.db2.gz QKZOPPBKZPJFSQ-MRXNPFEDSA-N -1 3 365.477 3.888 20 0 FHADHM Cc1ccc(Cl)c(S(=O)(=O)[N-][C@@H](c2ccccc2)[C@@H](C)O)c1Cl ZINC000660162847 943375938 /nfs/dbraw/zinc/37/59/38/943375938.db2.gz QBBLXVJEKURQQR-IAQYHMDHSA-N -1 3 374.289 3.702 20 0 FHADHM Cc1ccc2c(C(=O)Nc3ccccc3[N-]S(C)(=O)=O)csc2c1 ZINC000435407796 943383249 /nfs/dbraw/zinc/38/32/49/943383249.db2.gz NKHFAQGMYLEOJM-UHFFFAOYSA-N -1 3 360.460 3.834 20 0 FHADHM O=C(N[C@@H]1CCCC[C@@H]1Cc1ccccc1)c1cc(=O)[n-]c(C2CC2)n1 ZINC000514947863 943398582 /nfs/dbraw/zinc/39/85/82/943398582.db2.gz MVSLEVZEPUNXOI-IAGOWNOFSA-N -1 3 351.450 3.591 20 0 FHADHM CSCc1cccnc1C(=O)N=c1cc(-c2cc(C)cc(C)c2)[n-][nH]1 ZINC000584690183 943409812 /nfs/dbraw/zinc/40/98/12/943409812.db2.gz YBPWMTRZWDZZPH-UHFFFAOYSA-N -1 3 352.463 3.626 20 0 FHADHM CCO[C@@H]1C[C@H](N(C)C(=O)NCc2ccc([O-])c(F)c2)C1(CC)CC ZINC000435574738 943494384 /nfs/dbraw/zinc/49/43/84/943494384.db2.gz OQRVGVURHCKLOP-DLBZAZTESA-N -1 3 352.450 3.657 20 0 FHADHM Cc1ccc(S(=O)(=O)[N-][C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)o1 ZINC000435593354 943508551 /nfs/dbraw/zinc/50/85/51/943508551.db2.gz MKPWVGOIFYPCKK-MQMHXKEQSA-N -1 3 359.369 3.831 20 0 FHADHM O=C(NC12CCC(C(F)(F)F)(CC1)CC2)c1c[n-]c2ccccc2c1=O ZINC000515184708 943540921 /nfs/dbraw/zinc/54/09/21/943540921.db2.gz NBWINLYYODJPJK-UHFFFAOYSA-N -1 3 364.367 3.913 20 0 FHADHM CC(=O)c1cccc(-c2nc3cc(Br)c(F)cc3c(=O)[n-]2)c1 ZINC000504481073 943641962 /nfs/dbraw/zinc/64/19/62/943641962.db2.gz JZGSCMHSTMVXPG-UHFFFAOYSA-N -1 3 361.170 3.694 20 0 FHADHM CCCN(C)[C@@H](CNC(=O)CC(C)(C)CC(=O)[O-])c1ccc(Cl)cc1 ZINC000504490647 943644363 /nfs/dbraw/zinc/64/43/63/943644363.db2.gz XEYSUGSVYRGKRL-INIZCTEOSA-N -1 3 368.905 3.730 20 0 FHADHM CSCc1cnc(CNC[C@@H](Cc2ccccc2Cl)C(=O)[O-])s1 ZINC000417546329 943687114 /nfs/dbraw/zinc/68/71/14/943687114.db2.gz MEVFXPGVOZSYOH-GFCCVEGCSA-N -1 3 370.927 3.693 20 0 FHADHM COc1ccc([C@@H](CC(=O)[O-])NCc2ccc(C)c(Cl)c2)cc1OC ZINC000417552771 943698917 /nfs/dbraw/zinc/69/89/17/943698917.db2.gz FDFDSKKMXPXCDQ-MRXNPFEDSA-N -1 3 363.841 3.971 20 0 FHADHM CC(C)[C@@H]1CC(NCc2ccc([S@@](C)=O)cc2)(C(=O)[O-])c2ccccc21 ZINC000417575966 943733792 /nfs/dbraw/zinc/73/37/92/943733792.db2.gz GWLCEYMLESRUGF-RKVCDUFXSA-N -1 3 371.502 3.637 20 0 FHADHM C[C@@H](NCc1csc(-c2cccc(Br)c2)n1)[C@@H](C)C(=O)[O-] ZINC000417606647 943747081 /nfs/dbraw/zinc/74/70/81/943747081.db2.gz FSFKSIAUYCKHPL-NXEZZACHSA-N -1 3 369.284 3.771 20 0 FHADHM CCc1cnc(CN[C@H](Cc2ccc(Cl)c(Cl)c2)C(=O)[O-])s1 ZINC000417618936 943754553 /nfs/dbraw/zinc/75/45/53/943754553.db2.gz JYHPPOPVIHZKGJ-CYBMUJFWSA-N -1 3 359.278 3.798 20 0 FHADHM Cc1nn(-c2ccccc2)c(C)c1CN[C@@H]1C[C@H](C(=O)[O-])c2ccccc21 ZINC000417622861 943758141 /nfs/dbraw/zinc/75/81/41/943758141.db2.gz OVHWBYHCCSIGCO-PZJWPPBQSA-N -1 3 361.445 3.892 20 0 FHADHM CC(C)=CCSC[C@@H](NCc1cc(Cl)cc2c1OCC2)C(=O)[O-] ZINC000417631553 943768572 /nfs/dbraw/zinc/76/85/72/943768572.db2.gz VVECNVPOGQNNBE-OAHLLOKOSA-N -1 3 355.887 3.517 20 0 FHADHM COc1cccc(C[C@H](CNCc2c(F)cc(C)cc2Cl)C(=O)[O-])c1 ZINC000417646983 943780667 /nfs/dbraw/zinc/78/06/67/943780667.db2.gz GUNVFVVQVBFRGJ-CQSZACIVSA-N -1 3 365.832 3.829 20 0 FHADHM COc1cccc(C[C@@H](CNCc2c(F)cc(C)cc2Cl)C(=O)[O-])c1 ZINC000417646982 943780821 /nfs/dbraw/zinc/78/08/21/943780821.db2.gz GUNVFVVQVBFRGJ-AWEZNQCLSA-N -1 3 365.832 3.829 20 0 FHADHM Cc1ncsc1CN[C@H](c1ccc(Br)cc1)[C@H](C)C(=O)[O-] ZINC000417641176 943790649 /nfs/dbraw/zinc/79/06/49/943790649.db2.gz OSMORISDVJJECQ-XPTSAGLGSA-N -1 3 369.284 3.766 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)N(CC3CC3)CC3CC3)cc2)cc(=O)[n-]1 ZINC000584859630 943798709 /nfs/dbraw/zinc/79/87/09/943798709.db2.gz GACDVIMJTJBDKV-UHFFFAOYSA-N -1 3 352.438 3.812 20 0 FHADHM CC(=O)c1cccc(NC(=O)[C@H]2CCN(c3ccccc3Cl)C2)c1[O-] ZINC000516929320 943839414 /nfs/dbraw/zinc/83/94/14/943839414.db2.gz VQZFIKGMVGJKOL-ZDUSSCGKSA-N -1 3 358.825 3.713 20 0 FHADHM Cc1nc(C)c(CCC(=O)N2c3ccccc3C(C)(C)C[C@@H]2C)c(=O)[n-]1 ZINC000504857554 943848809 /nfs/dbraw/zinc/84/88/09/943848809.db2.gz KJYCDLYOZDWLKQ-ZDUSSCGKSA-N -1 3 353.466 3.835 20 0 FHADHM Cc1ncc(CNC(=O)N[C@H]2CCC[C@H](c3cccc(Cl)c3)C2)c(=O)[n-]1 ZINC000517015356 943911977 /nfs/dbraw/zinc/91/19/77/943911977.db2.gz PWAUJNHXGWOMKO-YOEHRIQHSA-N -1 3 374.872 3.670 20 0 FHADHM Cc1cn([C@@H](C)c2ccccc2)[nH]c1=NC(=O)c1cc([O-])ccc1Cl ZINC000505739059 943935841 /nfs/dbraw/zinc/93/58/41/943935841.db2.gz CJUQRBNKLUYUAH-ZDUSSCGKSA-N -1 3 355.825 3.834 20 0 FHADHM O=S(=O)([N-]c1ccc(OCc2ccncc2)cc1)c1ccc(F)cc1 ZINC000517159648 944062666 /nfs/dbraw/zinc/06/26/66/944062666.db2.gz ZZQWJECBQFINDH-UHFFFAOYSA-N -1 3 358.394 3.601 20 0 FHADHM COc1cc([N-]S(=O)(=O)c2ccc(OC(C)C)c(C)c2)ccc1F ZINC000436162384 944066016 /nfs/dbraw/zinc/06/60/16/944066016.db2.gz FDSRMYMBXHKSGR-UHFFFAOYSA-N -1 3 353.415 3.731 20 0 FHADHM Cc1noc(C2CC2)c1[N-]C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000190642220 944092451 /nfs/dbraw/zinc/09/24/51/944092451.db2.gz ISVVNIXIWRLRNS-UHFFFAOYSA-N -1 3 366.171 3.783 20 0 FHADHM CCOc1ccc([N-]S(=O)(=O)c2c(C)cc(OC)cc2C)cc1F ZINC000515695584 944136574 /nfs/dbraw/zinc/13/65/74/944136574.db2.gz GTJQHVVIIBQORN-UHFFFAOYSA-N -1 3 353.415 3.651 20 0 FHADHM C[C@H](NC(=O)NCc1ccc([O-])c(F)c1)c1ccc(Br)s1 ZINC000436269453 944167617 /nfs/dbraw/zinc/16/76/17/944167617.db2.gz JRPBCDWVPFQBLB-QMMMGPOBSA-N -1 3 373.247 3.916 20 0 FHADHM CC(C)N1Cc2cccc([N-]S(=O)(=O)C3=Cc4ccccc4OC3)c2C1 ZINC000191552185 944194957 /nfs/dbraw/zinc/19/49/57/944194957.db2.gz XIKDNTUKXLMUEG-UHFFFAOYSA-N -1 3 370.474 3.586 20 0 FHADHM Cn1c(CN2C[C@H](C(=O)[O-])[C@@H](c3ccccc3)C2)nc2cc(Cl)ccc21 ZINC000517371704 944251886 /nfs/dbraw/zinc/25/18/86/944251886.db2.gz XUSUKRDPFPUMGX-CVEARBPZSA-N -1 3 369.852 3.527 20 0 FHADHM Cn1nc(C(F)F)c2cc(C(=O)Nc3cccc(-c4cnn[n-]4)c3)sc21 ZINC000473725909 944297146 /nfs/dbraw/zinc/29/71/46/944297146.db2.gz PNJPSCYYSHKQPD-UHFFFAOYSA-N -1 3 374.376 3.610 20 0 FHADHM CCCCCc1nnc([N-]C(=O)c2cn(-c3cc(C)cc(F)c3)nn2)s1 ZINC000436424857 944297484 /nfs/dbraw/zinc/29/74/84/944297484.db2.gz JIAQZOIBECRCEX-UHFFFAOYSA-N -1 3 374.445 3.551 20 0 FHADHM C=Cc1ccc(S(=O)(=O)[N-]c2ccc(-n3cccn3)c(Cl)c2)cc1 ZINC000436474540 944354312 /nfs/dbraw/zinc/35/43/12/944354312.db2.gz DDXVNEHIYXTPNC-UHFFFAOYSA-N -1 3 359.838 3.970 20 0 FHADHM COCCN(Cc1ccc(F)cc1Cl)C(=O)c1ccc(C)cc1[O-] ZINC000436483681 944367484 /nfs/dbraw/zinc/36/74/84/944367484.db2.gz GDINHOXHWPYWDS-UHFFFAOYSA-N -1 3 351.805 3.782 20 0 FHADHM O=S(=O)([N-]C[C@H]1CCc2ccccc21)c1ccc(F)cc1C(F)(F)F ZINC000518449631 944387965 /nfs/dbraw/zinc/38/79/65/944387965.db2.gz NDLGGHUAHYSGIV-GFCCVEGCSA-N -1 3 373.371 3.853 20 0 FHADHM Cc1ccc(C(=O)Nc2cccc(C)c2C(=O)N2CCCC2)c([O-])c1C ZINC000436525809 944393474 /nfs/dbraw/zinc/39/34/74/944393474.db2.gz OWHWOBDQLRKZQM-UHFFFAOYSA-N -1 3 352.434 3.806 20 0 FHADHM CCN(C(=O)c1cc(F)c([O-])c(F)c1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000436533855 944399602 /nfs/dbraw/zinc/39/96/02/944399602.db2.gz WERMHSVMFCZPGG-WMLDXEAASA-N -1 3 374.431 3.968 20 0 FHADHM Cn1ccnc1[C@@H](NC(=O)c1cc(Oc2ccccc2)ccc1[O-])C1CC1 ZINC000436532222 944399656 /nfs/dbraw/zinc/39/96/56/944399656.db2.gz FQKTYXWZTFLVIB-IBGZPJMESA-N -1 3 363.417 3.799 20 0 FHADHM CC(=O)c1ccc(C(=O)N(C)Cc2ccc(OC(F)(F)F)cc2)cc1[O-] ZINC000436534341 944401690 /nfs/dbraw/zinc/40/16/90/944401690.db2.gz WWYAJDSZPRSVQL-UHFFFAOYSA-N -1 3 367.323 3.766 20 0 FHADHM O=C(Nc1cnn(CC(F)F)c1)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436546223 944406575 /nfs/dbraw/zinc/40/65/75/944406575.db2.gz UIMBPLFSZVYLKH-UHFFFAOYSA-N -1 3 357.360 3.697 20 0 FHADHM CC(=O)Nc1cc(Cl)ccc1NC(=O)c1ccc2c(c1[O-])OC(C)(C)C2 ZINC000436552223 944412166 /nfs/dbraw/zinc/41/21/66/944412166.db2.gz BHXJFSCEBYWYAQ-UHFFFAOYSA-N -1 3 374.824 3.970 20 0 FHADHM C[S@@](=O)c1cccc(NC(=O)c2cc(Cc3ccccc3)ccc2[O-])c1 ZINC000436555062 944413826 /nfs/dbraw/zinc/41/38/26/944413826.db2.gz MGJQCIVJISODBZ-AREMUKBSSA-N -1 3 365.454 3.973 20 0 FHADHM Cc1cc(=O)[n-]c(CNc2nc(C)nc3sc4c(c32)CC[C@H](C)C4)n1 ZINC000894377385 944414611 /nfs/dbraw/zinc/41/46/11/944414611.db2.gz MZADBWNDFJFRFG-VIFPVBQESA-N -1 3 355.467 3.541 20 0 FHADHM Cc1ccc(Cl)c(S(=O)(=O)[N-]C(C)(C)C2CCOCC2)c1Cl ZINC000785397852 944430560 /nfs/dbraw/zinc/43/05/60/944430560.db2.gz KWDFXNSDOGRKQZ-UHFFFAOYSA-N -1 3 366.310 3.785 20 0 FHADHM CCCCOc1ccc(CCNC(=O)c2ccc(C(C)=O)c([O-])c2)cc1 ZINC000436595964 944439977 /nfs/dbraw/zinc/43/99/77/944439977.db2.gz OCFGJZQCUAWGMB-UHFFFAOYSA-N -1 3 355.434 3.746 20 0 FHADHM COc1ccc(NC(=O)c2cc(Oc3ccccc3)ccc2[O-])cc1CO ZINC000436596391 944440802 /nfs/dbraw/zinc/44/08/02/944440802.db2.gz QIUCDNIBLNOSJH-UHFFFAOYSA-N -1 3 365.385 3.938 20 0 FHADHM CC(=O)c1ccc(C(=O)N(C)CCCOc2ccc(Cl)cc2)cc1[O-] ZINC000436596150 944440835 /nfs/dbraw/zinc/44/08/35/944440835.db2.gz OOKSZCIWDBEXTB-UHFFFAOYSA-N -1 3 361.825 3.789 20 0 FHADHM Cc1ccc(C(=O)N(C)Cc2ccc(F)cc2Br)c([O-])c1 ZINC000436597198 944442025 /nfs/dbraw/zinc/44/20/25/944442025.db2.gz UEMJOLFIERJNDQ-UHFFFAOYSA-N -1 3 352.203 3.874 20 0 FHADHM CC[C@@H]1C[C@H](C(=O)N=c2cc(-c3cc(Cl)cc(Cl)c3)[n-][nH]2)CCO1 ZINC000506196080 944446195 /nfs/dbraw/zinc/44/61/95/944446195.db2.gz WDBDPNCIXUKDHO-QMTHXVAHSA-N -1 3 368.264 3.949 20 0 FHADHM CC(C)c1ccc(C(=O)N2CCOC[C@H]2CC(=O)c2ccccc2)c([O-])c1 ZINC000436582203 944446265 /nfs/dbraw/zinc/44/62/65/944446265.db2.gz AOECAWARWUEPOP-GOSISDBHSA-N -1 3 367.445 3.630 20 0 FHADHM COc1ccc(C(=O)N2CCN([C@H](C)c3ccc(Cl)cc3)CC2)c([O-])c1 ZINC000436590405 944451198 /nfs/dbraw/zinc/45/11/98/944451198.db2.gz MSJQCCZXBNIARZ-CQSZACIVSA-N -1 3 374.868 3.573 20 0 FHADHM CCc1ccc(C(=O)N2C[C@H](c3ccccc3)[C@H]3COCC[C@@H]32)c([O-])c1 ZINC000436600694 944453150 /nfs/dbraw/zinc/45/31/50/944453150.db2.gz AUAYCLBEFCBXPE-AQNXPRMDSA-N -1 3 351.446 3.599 20 0 FHADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CC[C@H]([C@H]2CCOC2)C1 ZINC000436605612 944456392 /nfs/dbraw/zinc/45/63/92/944456392.db2.gz PJURFBFEUJQMBV-PMACEKPBSA-N -1 3 365.473 3.676 20 0 FHADHM CN(C[C@H]1CCCCO1)C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436610206 944460092 /nfs/dbraw/zinc/46/00/92/944460092.db2.gz MVWSLUUSRQKCIC-LJQANCHMSA-N -1 3 353.462 3.819 20 0 FHADHM CN(C(=O)c1cc(Cc2ccccc2)ccc1[O-])c1ccc2c(c1)OCO2 ZINC000436610908 944460222 /nfs/dbraw/zinc/46/02/22/944460222.db2.gz VQOMNOXDSCPHLP-UHFFFAOYSA-N -1 3 361.397 3.988 20 0 FHADHM CCc1ccc(C(=O)NC2(Cc3cccc(F)c3)CCOCC2)c([O-])c1 ZINC000436612554 944462001 /nfs/dbraw/zinc/46/20/01/944462001.db2.gz QQQXFIDPIRCRRZ-UHFFFAOYSA-N -1 3 357.425 3.615 20 0 FHADHM Cc1ncc(CNC(=O)c2cc(CCc3ccccc3)ccc2[O-])s1 ZINC000436613306 944462689 /nfs/dbraw/zinc/46/26/89/944462689.db2.gz UQQRHAMFIUFBSW-UHFFFAOYSA-N -1 3 352.459 3.872 20 0 FHADHM O=C(NCc1ccc(Oc2ccc(C(F)(F)F)cc2)cc1)c1cn[n-]n1 ZINC000506196987 944465248 /nfs/dbraw/zinc/46/52/48/944465248.db2.gz RLSQJJAUOAVSIG-UHFFFAOYSA-N -1 3 362.311 3.546 20 0 FHADHM C[C@H](CCC1CCCCC1)NC(=O)[C@@H]1CCCN1C(=O)c1ccccc1[O-] ZINC000436627906 944467628 /nfs/dbraw/zinc/46/76/28/944467628.db2.gz VVUSERMBCUEHQM-APWZRJJASA-N -1 3 372.509 3.862 20 0 FHADHM COc1cc(Cl)c(S(=O)(=O)[N-][C@@H]2CCC[C@H](F)C2)cc1Cl ZINC000518524546 944471156 /nfs/dbraw/zinc/47/11/56/944471156.db2.gz FWFWENZOHOICEV-DTWKUNHWSA-N -1 3 356.246 3.561 20 0 FHADHM COc1ccc(C(=O)N[C@@H](CCO)c2ccc(Cl)c(Cl)c2)c([O-])c1 ZINC000436631285 944472079 /nfs/dbraw/zinc/47/20/79/944472079.db2.gz RIJBMCMWGAGNDV-HNNXBMFYSA-N -1 3 370.232 3.561 20 0 FHADHM CC(C)[C@@H]1CCN1C(=O)C[C@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436635877 944474555 /nfs/dbraw/zinc/47/45/55/944474555.db2.gz OXPMIXZELSEQPE-PMACEKPBSA-N -1 3 366.461 3.510 20 0 FHADHM CC(=O)c1ccc(C(=O)N2CC[C@H](CSc3ccccc3)C2)cc1[O-] ZINC000436653055 944482532 /nfs/dbraw/zinc/48/25/32/944482532.db2.gz CHQJWGHIVCBAQV-HNNXBMFYSA-N -1 3 355.459 3.849 20 0 FHADHM Cc1nc([C@H]2CCCCN2C(=O)c2cc(Cl)c3ccccc3c2[O-])n[nH]1 ZINC000436653371 944485242 /nfs/dbraw/zinc/48/52/42/944485242.db2.gz DJZAJCPMVNPXCM-MRXNPFEDSA-N -1 3 370.840 3.993 20 0 FHADHM Cc1nc2ccc(NC(=O)c3cc(OCc4ccccc4)ccc3[O-])cn2n1 ZINC000436654556 944485919 /nfs/dbraw/zinc/48/59/19/944485919.db2.gz ARKJAPODTFCKNG-UHFFFAOYSA-N -1 3 374.400 3.575 20 0 FHADHM O=C(N[C@H]1CCO[C@H](C2CC2)C1)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436654127 944486654 /nfs/dbraw/zinc/48/66/54/944486654.db2.gz DSYIFOPCBHNZKR-RXVVDRJESA-N -1 3 351.446 3.670 20 0 FHADHM O=C(N[C@@H]1CCO[C@H](C2CC2)C1)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436654126 944486812 /nfs/dbraw/zinc/48/68/12/944486812.db2.gz DSYIFOPCBHNZKR-NQIIRXRSSA-N -1 3 351.446 3.670 20 0 FHADHM Cc1ccc(C(=O)Nc2nc(CN3CCC[C@H](C)C3)cs2)c([O-])c1C ZINC000436657116 944487588 /nfs/dbraw/zinc/48/75/88/944487588.db2.gz PSXHYSHYRIBCSE-LBPRGKRZSA-N -1 3 359.495 3.950 20 0 FHADHM O=C(NCc1ccc(-c2nc3ccccc3s2)o1)c1c([O-])cccc1O ZINC000436646323 944495553 /nfs/dbraw/zinc/49/55/53/944495553.db2.gz HKRBYSFDQCOXHJ-UHFFFAOYSA-N -1 3 366.398 3.898 20 0 FHADHM O=C(NCc1ccc(-c2nc3ccccc3[nH]2)cc1)c1c([O-])cccc1O ZINC000436672080 944505459 /nfs/dbraw/zinc/50/54/59/944505459.db2.gz XYWVJQFJSSTJOA-UHFFFAOYSA-N -1 3 359.385 3.571 20 0 FHADHM CC(C)c1ccc(C(=O)N2CCN[C@H](c3cccc(Cl)c3)C2)c([O-])c1 ZINC000436659006 944508909 /nfs/dbraw/zinc/50/89/09/944508909.db2.gz NHZMVEQMONFWPL-SFHVURJKSA-N -1 3 358.869 3.956 20 0 FHADHM CC1(C)Cc2ccc(C(=O)Nc3nc(-c4cccnc4)cs3)c([O-])c2O1 ZINC000436676993 944514014 /nfs/dbraw/zinc/51/40/14/944514014.db2.gz VFWUFYZUUJLSFB-UHFFFAOYSA-N -1 3 367.430 3.877 20 0 FHADHM Cc1ccc(C(=O)N(C)CCCc2cc(-c3cccc(F)c3)n[nH]2)c([O-])c1 ZINC000436678993 944516006 /nfs/dbraw/zinc/51/60/06/944516006.db2.gz DXNGZLPQTZLFBZ-UHFFFAOYSA-N -1 3 367.424 3.935 20 0 FHADHM COC[C@H](c1ccc(Cl)cc1)N(C)C(=O)c1ccc(C(C)=O)c([O-])c1 ZINC000436682549 944522169 /nfs/dbraw/zinc/52/21/69/944522169.db2.gz QOLVSFXNGCRAFS-QGZVFWFLSA-N -1 3 361.825 3.708 20 0 FHADHM COc1cc(NC(=O)c2ccc(C)cc2[O-])cc(OC)c1Br ZINC000436684655 944524407 /nfs/dbraw/zinc/52/44/07/944524407.db2.gz DIYOHJKTBQCCIW-UHFFFAOYSA-N -1 3 366.211 3.733 20 0 FHADHM O=c1cc(C[S@@](=O)Cc2cccc(Cl)c2Cl)nc(C2CC2)[n-]1 ZINC000517718259 944532703 /nfs/dbraw/zinc/53/27/03/944532703.db2.gz AIADQKBTBLVVBE-QFIPXVFZSA-N -1 3 357.262 3.815 20 0 FHADHM O=C(c1ccccc1[O-])N1CCN(Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000436696023 944534642 /nfs/dbraw/zinc/53/46/42/944534642.db2.gz HJMFVAUPNOBBCG-UHFFFAOYSA-N -1 3 365.260 3.657 20 0 FHADHM CSc1nc(C2CC2)nc(C)c1C(=O)Nc1cccc(C(C)=O)c1[O-] ZINC000517724958 944539781 /nfs/dbraw/zinc/53/97/81/944539781.db2.gz CWAOOTRUDGZYNQ-UHFFFAOYSA-N -1 3 357.435 3.545 20 0 FHADHM COC(=O)c1cccc2[n-]c(NC(=O)Cc3cccc4ccccc43)nc21 ZINC000438355122 944543789 /nfs/dbraw/zinc/54/37/89/944543789.db2.gz RIFMVKWIQDXGNI-UHFFFAOYSA-N -1 3 359.385 3.684 20 0 FHADHM COc1ccc(NC(=O)c2cc(C)ccc2[O-])cc1OCc1ccncc1 ZINC000436725697 944548606 /nfs/dbraw/zinc/54/86/06/944548606.db2.gz ZDHZUVBOSUUVJU-UHFFFAOYSA-N -1 3 364.401 3.936 20 0 FHADHM Cc1ccc(C(=O)Nc2cc(F)ccc2NC(=O)c2ccccn2)c([O-])c1 ZINC000436714613 944553690 /nfs/dbraw/zinc/55/36/90/944553690.db2.gz ISNGXFJNVZWIOF-UHFFFAOYSA-N -1 3 365.364 3.739 20 0 FHADHM CN1CC[C@H](CNC(=O)c2ccccc2[O-])[C@H]1c1ccc(Cl)c(F)c1 ZINC000436718646 944557427 /nfs/dbraw/zinc/55/74/27/944557427.db2.gz XMDJHLGECDYHDF-FZKQIMNGSA-N -1 3 362.832 3.608 20 0 FHADHM CN1CC[C@@H](CNC(=O)c2ccccc2[O-])[C@H]1c1ccc(Cl)c(F)c1 ZINC000436718650 944557665 /nfs/dbraw/zinc/55/76/65/944557665.db2.gz XMDJHLGECDYHDF-SCLBCKFNSA-N -1 3 362.832 3.608 20 0 FHADHM CC[C@@H](C)c1nc([C@@H](C)NC(=O)c2ccc(C(F)(F)F)cc2[O-])n[nH]1 ZINC000436737477 944567291 /nfs/dbraw/zinc/56/72/91/944567291.db2.gz KZWSBFGZTIFODB-RKDXNWHRSA-N -1 3 356.348 3.534 20 0 FHADHM CC[C@H](C)c1nc([C@@H](C)NC(=O)c2ccc(C(F)(F)F)cc2[O-])n[nH]1 ZINC000436737475 944567321 /nfs/dbraw/zinc/56/73/21/944567321.db2.gz KZWSBFGZTIFODB-DTWKUNHWSA-N -1 3 356.348 3.534 20 0 FHADHM COc1cc(OC)c(NC(=O)c2ccc(C)cc2[O-])cc1Br ZINC000436740522 944569912 /nfs/dbraw/zinc/56/99/12/944569912.db2.gz RFBWZRAUFDBFDU-UHFFFAOYSA-N -1 3 366.211 3.733 20 0 FHADHM CCOC(=O)C(C)(C)c1csc(NC(=O)c2ccc(C)c(C)c2[O-])n1 ZINC000436743515 944572445 /nfs/dbraw/zinc/57/24/45/944572445.db2.gz YMUMNGMFJFHSQE-UHFFFAOYSA-N -1 3 362.451 3.559 20 0 FHADHM CC(C)[C@@]1(CO)CCCN(C(=O)c2cc(Cc3ccccc3)ccc2[O-])C1 ZINC000436730235 944577111 /nfs/dbraw/zinc/57/71/11/944577111.db2.gz KHTAKFOVBQHEIE-QHCPKHFHSA-N -1 3 367.489 3.854 20 0 FHADHM CC(C)c1ccc(C(=O)N(C)[C@H](C)c2ccc(-n3cncn3)cc2)c([O-])c1 ZINC000436758040 944580151 /nfs/dbraw/zinc/58/01/51/944580151.db2.gz XHDHPDUDLLUESA-OAHLLOKOSA-N -1 3 364.449 3.930 20 0 FHADHM CN(C)C(=O)c1ccc(NC(=O)c2cc(Cc3ccccc3)ccc2[O-])cc1 ZINC000436757302 944580735 /nfs/dbraw/zinc/58/07/35/944580735.db2.gz USIYAUCPAVCSTC-UHFFFAOYSA-N -1 3 374.440 3.937 20 0 FHADHM C[C@H]1[C@H](NC(=O)c2cc(F)c([O-])c(Cl)c2)CCN1Cc1ccccc1 ZINC000436752044 944590936 /nfs/dbraw/zinc/59/09/36/944590936.db2.gz WOKGVNMMNUXZLG-YVEFUNNKSA-N -1 3 362.832 3.578 20 0 FHADHM C[C@H](OC(=O)CNC(=O)c1ccc([O-])cc1)c1cc(Cl)ccc1Cl ZINC000783419640 944598400 /nfs/dbraw/zinc/59/84/00/944598400.db2.gz CAWXDXDBHHURNF-JTQLQIEISA-N -1 3 368.216 3.733 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)NC[C@@H](C)Oc2ccc(C(C)C)cc2)c1 ZINC000436774050 944602705 /nfs/dbraw/zinc/60/27/05/944602705.db2.gz VCYMTGZQHSIXRF-CQSZACIVSA-N -1 3 370.449 3.671 20 0 FHADHM O=C(NCc1cccc(COCc2ccccc2)c1)c1ccc(O)cc1[O-] ZINC000436775598 944606463 /nfs/dbraw/zinc/60/64/63/944606463.db2.gz QRZRVGALMAZWRR-UHFFFAOYSA-N -1 3 363.413 3.745 20 0 FHADHM CCn1nncc1C(=O)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000436778322 944609622 /nfs/dbraw/zinc/60/96/22/944609622.db2.gz QQIZEOLNXWIUQK-UHFFFAOYSA-N -1 3 365.418 3.533 20 0 FHADHM C[C@H](C[N-]S(=O)(=O)c1csc(-c2ccccc2)n1)Oc1ccccc1 ZINC000506238385 944624666 /nfs/dbraw/zinc/62/46/66/944624666.db2.gz AMNPWOYXZJQTKW-CQSZACIVSA-N -1 3 374.487 3.556 20 0 FHADHM Cc1ccc(C(=O)N2CCC[C@@H]2c2ccc(Br)cn2)c([O-])c1 ZINC000436783109 944625913 /nfs/dbraw/zinc/62/59/13/944625913.db2.gz QLMCUGAVCQZGOH-OAHLLOKOSA-N -1 3 361.239 3.835 20 0 FHADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CCOC[C@@H](C2CCC2)C1 ZINC000436784940 944630145 /nfs/dbraw/zinc/63/01/45/944630145.db2.gz MUTUTAQPTRRPAC-FQEVSTJZSA-N -1 3 365.473 3.872 20 0 FHADHM O=C(NCC1(c2cc(F)cc(C(F)(F)F)c2)CC1)c1ccc(O)cc1[O-] ZINC000436792994 944643283 /nfs/dbraw/zinc/64/32/83/944643283.db2.gz YHKDOUSTVNZSHH-UHFFFAOYSA-N -1 3 369.314 3.717 20 0 FHADHM C[C@H]1C[C@H](CC(=O)N2CCN(C(=O)c3ccccc3[O-])CC2)CC(C)(C)C1 ZINC000436795633 944648637 /nfs/dbraw/zinc/64/86/37/944648637.db2.gz ZRDUJFHSDDQERU-DLBZAZTESA-N -1 3 372.509 3.529 20 0 FHADHM Cn1cc(NC(=O)c2ccc3c(c2[O-])OC(C)(C)C3)c(-c2ccccc2)n1 ZINC000436817182 944652377 /nfs/dbraw/zinc/65/23/77/944652377.db2.gz WLEJTIYLCUEGBE-UHFFFAOYSA-N -1 3 363.417 3.759 20 0 FHADHM O=C(NC[C@@H](c1cccs1)N1CCCC1)c1ccc(Cl)cc1[O-] ZINC000436818206 944654291 /nfs/dbraw/zinc/65/42/91/944654291.db2.gz JNOWAKDRDFKQRE-AWEZNQCLSA-N -1 3 350.871 3.674 20 0 FHADHM O=C(NC[C@H](OCC1CC1)c1ccc(Cl)cc1)c1ccc(O)cc1[O-] ZINC000436818620 944655853 /nfs/dbraw/zinc/65/58/53/944655853.db2.gz KTVLSADFORXBPL-SFHVURJKSA-N -1 3 361.825 3.649 20 0 FHADHM C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)N=c1cc([C@H]2CCCO2)[n-][nH]1 ZINC000473846781 944658479 /nfs/dbraw/zinc/65/84/79/944658479.db2.gz AKXLZACLBKNTGN-IAQYHMDHSA-N -1 3 367.371 3.519 20 0 FHADHM Cc1ccc([O-])c(C(=O)Nc2ccc(C(=O)N3CCCC[C@@H]3C)cc2)c1 ZINC000436809061 944665084 /nfs/dbraw/zinc/66/50/84/944665084.db2.gz RLGKTOBOCPLQFD-HNNXBMFYSA-N -1 3 352.434 3.968 20 0 FHADHM Cc1cccc(C(=O)Nc2ccc(C(=O)N3CCCC[C@@H]3C)cc2)c1[O-] ZINC000436810810 944667677 /nfs/dbraw/zinc/66/76/77/944667677.db2.gz YRSKZCDDBNYNEN-HNNXBMFYSA-N -1 3 352.434 3.968 20 0 FHADHM CCN(C)C(=O)c1cccc(NC(=O)c2cc3c(cc2[O-])CCCC3)c1 ZINC000436811904 944668596 /nfs/dbraw/zinc/66/85/96/944668596.db2.gz WEZYTRWHSJGJRM-UHFFFAOYSA-N -1 3 352.434 3.615 20 0 FHADHM CCc1ccc(C(=O)N[C@H]2c3ccccc3CC23CCOCC3)c([O-])c1 ZINC000436812383 944669917 /nfs/dbraw/zinc/66/99/17/944669917.db2.gz WXXFHVDJADFDBM-FQEVSTJZSA-N -1 3 351.446 3.779 20 0 FHADHM C[C@@H](C(=O)Nc1ccccc1-c1nnn[n-]1)c1c(Cl)cccc1Cl ZINC000735561837 944671117 /nfs/dbraw/zinc/67/11/17/944671117.db2.gz MQLKIDHMQKAJMI-SECBINFHSA-N -1 3 362.220 3.916 20 0 FHADHM C[C@@H](C(=O)Nc1ccccc1-c1nn[n-]n1)c1c(Cl)cccc1Cl ZINC000735561837 944671121 /nfs/dbraw/zinc/67/11/21/944671121.db2.gz MQLKIDHMQKAJMI-SECBINFHSA-N -1 3 362.220 3.916 20 0 FHADHM O=C(N=c1cc([C@H]2CCCO2)[n-][nH]1)c1csc(-c2cccc(Cl)c2)n1 ZINC000473848179 944673239 /nfs/dbraw/zinc/67/32/39/944673239.db2.gz HGVGNVUPPVMFKD-CQSZACIVSA-N -1 3 374.853 3.712 20 0 FHADHM O=C([O-])C[C@H](NCc1ccc(Oc2cnccn2)cc1)c1ccsc1 ZINC000426684096 944680789 /nfs/dbraw/zinc/68/07/89/944680789.db2.gz XFPYYNJOCWHBAT-INIZCTEOSA-N -1 3 355.419 3.636 20 0 FHADHM O=C(N=c1cc([C@@H]2CCCO2)[n-][nH]1)c1occc1CSc1ccccc1 ZINC000473848841 944682524 /nfs/dbraw/zinc/68/25/24/944682524.db2.gz JHLGRLUTFVRYQF-INIZCTEOSA-N -1 3 369.446 3.821 20 0 FHADHM Cc1ccc([C@H]2CSCCN2CCOc2cccc(C(=O)[O-])c2)cc1 ZINC000516300924 944685422 /nfs/dbraw/zinc/68/54/22/944685422.db2.gz LAUXCKFKASMTMX-LJQANCHMSA-N -1 3 357.475 3.862 20 0 FHADHM O=C([O-])COc1ccc(CCNCc2csc(-c3cccs3)n2)cc1 ZINC000426687882 944686964 /nfs/dbraw/zinc/68/69/64/944686964.db2.gz NDDXHJODZLEGKK-UHFFFAOYSA-N -1 3 374.487 3.667 20 0 FHADHM CC(C)Cc1ccc(CCCC(=O)N=c2cc([C@@H]3CCCO3)[n-][nH]2)cc1 ZINC000473847279 944691229 /nfs/dbraw/zinc/69/12/29/944691229.db2.gz DEJVNVPRUOMGHC-IBGZPJMESA-N -1 3 355.482 3.843 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N[C@@H]2CCc3ccc(C(C)C)cc32)c1 ZINC000436839717 944706474 /nfs/dbraw/zinc/70/64/74/944706474.db2.gz VBUOPABRYGDOKP-LJQANCHMSA-N -1 3 352.434 3.891 20 0 FHADHM CCCC[C@H](CC)CC(=O)NC1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436840795 944706527 /nfs/dbraw/zinc/70/65/27/944706527.db2.gz ROEMLMGHGYGYJG-INIZCTEOSA-N -1 3 360.498 3.720 20 0 FHADHM CC(C)(CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1[O-])C1CCCCC1 ZINC000436841607 944707156 /nfs/dbraw/zinc/70/71/56/944707156.db2.gz VSKYBXRMBHUAOF-GOSISDBHSA-N -1 3 372.509 3.720 20 0 FHADHM CCCc1c(NC(=O)c2cccc(OC)c2[O-])cnn1-c1ccc(F)cc1 ZINC000436856390 944718322 /nfs/dbraw/zinc/71/83/22/944718322.db2.gz ZUXOSLNRZHCIKJ-UHFFFAOYSA-N -1 3 369.396 3.930 20 0 FHADHM Cc1cccc([C@@H](NCc2ccc(OC(F)F)c(F)c2)C(=O)[O-])c1C ZINC000426724895 944726555 /nfs/dbraw/zinc/72/65/55/944726555.db2.gz WSIMLHSNEWWMJT-MRXNPFEDSA-N -1 3 353.340 3.959 20 0 FHADHM C[C@@H](CN1CCN(C(=O)c2ccccc2[O-])CC1)c1cccc(Cl)c1 ZINC000436895136 944747391 /nfs/dbraw/zinc/74/73/91/944747391.db2.gz TYGIUFNTRHTPSV-HNNXBMFYSA-N -1 3 358.869 3.607 20 0 FHADHM Cc1cccc([C@H](NCc2cnn(Cc3ccc(F)cc3)c2)C(=O)[O-])c1C ZINC000426737679 944749547 /nfs/dbraw/zinc/74/95/47/944749547.db2.gz PCTZTSWFCRRDOI-FQEVSTJZSA-N -1 3 367.424 3.603 20 0 FHADHM O=C([O-])[C@H](Cc1cccc(Cl)c1)NCc1coc(-c2ccccc2)n1 ZINC000426745111 944758642 /nfs/dbraw/zinc/75/86/42/944758642.db2.gz YYUZGTORHBAZHL-KRWDZBQOSA-N -1 3 356.809 3.781 20 0 FHADHM CC[C@H](CC1CCCCC1)C(=O)N1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436884765 944759327 /nfs/dbraw/zinc/75/93/27/944759327.db2.gz HIVLMKABPGGMSW-GOSISDBHSA-N -1 3 372.509 3.673 20 0 FHADHM COc1cccc(-c2nc([C@H](NC(=O)c3ccccc3)C(C)C)no2)c1[O-] ZINC000436886712 944761572 /nfs/dbraw/zinc/76/15/72/944761572.db2.gz NTNLBTSUFVZVQW-MRXNPFEDSA-N -1 3 367.405 3.578 20 0 FHADHM CC(C)c1ccc(-c2nc(-c3ccc(S(C)(=O)=O)cc3)no2)c([O-])c1 ZINC000436889252 944763749 /nfs/dbraw/zinc/76/37/49/944763749.db2.gz VOGLWIGETBBWFM-UHFFFAOYSA-N -1 3 358.419 3.636 20 0 FHADHM CN(C[C@H]1CCCC[C@H]1O)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436904138 944771108 /nfs/dbraw/zinc/77/11/08/944771108.db2.gz KIMKSCKHSXYACG-DNVCBOLYSA-N -1 3 355.434 3.808 20 0 FHADHM COc1cc(CN[C@H](C(=O)[O-])c2cc(C)cc(C)c2)ccc1OC(F)F ZINC000426758019 944777894 /nfs/dbraw/zinc/77/78/94/944777894.db2.gz GLHGDZRTEAPOKN-KRWDZBQOSA-N -1 3 365.376 3.829 20 0 FHADHM C[C@@H]1CCc2c(sc(NC(=O)[C@H]3CCC[C@@H](C)C3)c2-c2nnn[n-]2)C1 ZINC000736279772 944784477 /nfs/dbraw/zinc/78/44/77/944784477.db2.gz MJJFEPKRYWQNPI-UTUOFQBUSA-N -1 3 359.499 3.818 20 0 FHADHM C[C@@H]1CCc2c(sc(NC(=O)[C@H]3CCC[C@@H](C)C3)c2-c2nn[n-]n2)C1 ZINC000736279772 944784489 /nfs/dbraw/zinc/78/44/89/944784489.db2.gz MJJFEPKRYWQNPI-UTUOFQBUSA-N -1 3 359.499 3.818 20 0 FHADHM O=C([O-])[C@@H](NCc1ccc(OCC(F)(F)F)c(F)c1)c1ccccc1 ZINC000426773803 944790707 /nfs/dbraw/zinc/79/07/07/944790707.db2.gz REEGRHJHARYOKK-HNNXBMFYSA-N -1 3 357.303 3.682 20 0 FHADHM COc1ccc(CN(CCc2ccccn2)C(=O)c2ccccc2[O-])cc1 ZINC000436915299 944796491 /nfs/dbraw/zinc/79/64/91/944796491.db2.gz PYQBHUAZBCBFRO-UHFFFAOYSA-N -1 3 362.429 3.681 20 0 FHADHM Cc1cc([C@@H](NCc2cc(-c3ccccc3)n[nH]2)C(=O)[O-])ccc1Cl ZINC000426785582 944802349 /nfs/dbraw/zinc/80/23/49/944802349.db2.gz QJDFCIOHYRLRPJ-GOSISDBHSA-N -1 3 355.825 3.954 20 0 FHADHM CCCCOc1cc(CN[C@H](C(=O)[O-])c2cccc(F)c2)ccc1OC ZINC000426767171 944803973 /nfs/dbraw/zinc/80/39/73/944803973.db2.gz KZKRNHQHRGZHHT-IBGZPJMESA-N -1 3 361.413 3.929 20 0 FHADHM O=C([O-])C[C@@H](NCc1cccc(F)c1)c1cccc(Br)c1 ZINC000426805830 944806614 /nfs/dbraw/zinc/80/66/14/944806614.db2.gz GDPHQLJFDZVTNX-OAHLLOKOSA-N -1 3 352.203 3.894 20 0 FHADHM O=C([O-])C[C@H](NCc1cc2ccccc2[nH]c1=O)c1cccc(Cl)c1 ZINC000426790191 944811893 /nfs/dbraw/zinc/81/18/93/944811893.db2.gz BKBMDXOJDHBAEJ-KRWDZBQOSA-N -1 3 356.809 3.899 20 0 FHADHM CCC[C@@]1(CO)CCN(C(=O)c2cc(CCc3ccccc3)ccc2[O-])C1 ZINC000436927890 944814590 /nfs/dbraw/zinc/81/45/90/944814590.db2.gz UHEWHAZNQXLDGV-HSZRJFAPSA-N -1 3 367.489 3.802 20 0 FHADHM COc1ccc([C@H](NCc2ccc(C(F)(F)F)cc2)C(=O)[O-])cc1F ZINC000426796334 944818700 /nfs/dbraw/zinc/81/87/00/944818700.db2.gz ADZDPRFERFMKEE-HNNXBMFYSA-N -1 3 357.303 3.769 20 0 FHADHM CCCOc1ccc(CN[C@@H](C(=O)[O-])c2cccc(F)c2)cc1OCC ZINC000426798168 944819887 /nfs/dbraw/zinc/81/98/87/944819887.db2.gz IGWATRQJIWKWFO-LJQANCHMSA-N -1 3 361.413 3.929 20 0 FHADHM COc1ccccc1-c1ccc(CN[C@@H](C(=O)[O-])c2ccc(O)cc2)cc1 ZINC000426797402 944819993 /nfs/dbraw/zinc/81/99/93/944819993.db2.gz FFGWJKQSDCBEOX-OAQYLSRUSA-N -1 3 363.413 3.983 20 0 FHADHM CCc1ccc([O-])c(C(=O)N2CCN(Cc3ccc(Cl)cc3)CC2)c1 ZINC000500415972 944822814 /nfs/dbraw/zinc/82/28/14/944822814.db2.gz SQGPKHQYOWZNLL-UHFFFAOYSA-N -1 3 358.869 3.566 20 0 FHADHM O=S(=O)([N-][C@@H]1CCc2c1cccc2F)c1csc(-c2ccccc2)n1 ZINC000500412593 944824000 /nfs/dbraw/zinc/82/40/00/944824000.db2.gz BMRQJYHWOOCEPL-MRXNPFEDSA-N -1 3 374.462 3.915 20 0 FHADHM O=C(Nc1cccc(NC(=O)C2CC2)c1)c1ccc2c(c1[O-])CCCC2 ZINC000436937952 944824468 /nfs/dbraw/zinc/82/44/68/944824468.db2.gz HVEWMMXNDMSGBK-UHFFFAOYSA-N -1 3 350.418 3.872 20 0 FHADHM COc1ccc([C@@H](NCc2cccc(C(F)(F)F)c2)C(=O)[O-])cc1F ZINC000426805047 944825759 /nfs/dbraw/zinc/82/57/59/944825759.db2.gz YHPFMLYDUZCXEG-OAHLLOKOSA-N -1 3 357.303 3.769 20 0 FHADHM CC[C@@H]1CCCC[C@@H]1NC(=O)c1cc(NC(=O)c2cnoc2C)ccc1[O-] ZINC000436947365 944834262 /nfs/dbraw/zinc/83/42/62/944834262.db2.gz DLSDEHZEKOTSBQ-DYVFJYSZSA-N -1 3 371.437 3.640 20 0 FHADHM O=C(Nc1cccc(CN2CCSCC2)c1)c1ccc(Cl)cc1[O-] ZINC000436949044 944837108 /nfs/dbraw/zinc/83/71/08/944837108.db2.gz QTDFBDGWCUEHKI-UHFFFAOYSA-N -1 3 362.882 3.847 20 0 FHADHM CCCOc1ccc(CN[C@H](C(=O)[O-])c2ccc(CC)cc2)cc1OC ZINC000426816166 944837219 /nfs/dbraw/zinc/83/72/19/944837219.db2.gz JAKIEYNPEKNSOH-FQEVSTJZSA-N -1 3 357.450 3.962 20 0 FHADHM COC(=O)c1ccc(-c2nc(-c3cc(F)ccc3C(F)(F)F)no2)[n-]1 ZINC000426455527 944839876 /nfs/dbraw/zinc/83/98/76/944839876.db2.gz TWXLRSYVNQENLS-UHFFFAOYSA-N -1 3 355.247 3.676 20 0 FHADHM COc1ccc(CN[C@@H](CC(=O)[O-])c2cccc(Br)c2)cc1 ZINC000426818364 944841807 /nfs/dbraw/zinc/84/18/07/944841807.db2.gz FCZLRLIYUKKAFW-INIZCTEOSA-N -1 3 364.239 3.763 20 0 FHADHM O=C([O-])[C@@H](NCc1cccc(OCC(F)(F)F)c1)c1cccc(F)c1 ZINC000426820382 944842826 /nfs/dbraw/zinc/84/28/26/944842826.db2.gz LAUQJZYXNQVKEQ-HNNXBMFYSA-N -1 3 357.303 3.682 20 0 FHADHM O=C(Nc1cccc(C(=O)N2CCCC2)c1)c1ccc2c(c1[O-])CCCC2 ZINC000436952411 944847214 /nfs/dbraw/zinc/84/72/14/944847214.db2.gz WBGMSXUYJWUSEW-UHFFFAOYSA-N -1 3 364.445 3.759 20 0 FHADHM O=C(NCc1cn2ccsc2n1)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436953457 944849709 /nfs/dbraw/zinc/84/97/09/944849709.db2.gz PPJNIBJPHSJNPU-UHFFFAOYSA-N -1 3 365.414 3.824 20 0 FHADHM COc1ccc([C@H](NCc2cccc(OCC(C)C)c2)C(=O)[O-])cc1F ZINC000426828223 944851300 /nfs/dbraw/zinc/85/13/00/944851300.db2.gz YNGJSAFMTBSXAT-IBGZPJMESA-N -1 3 361.413 3.785 20 0 FHADHM COc1ccc([C@H](NCc2cccc(-c3cccnc3)c2)C(=O)[O-])cc1F ZINC000426826600 944851674 /nfs/dbraw/zinc/85/16/74/944851674.db2.gz TWMCKJZHTICGDH-FQEVSTJZSA-N -1 3 366.392 3.812 20 0 FHADHM Cc1cccnc1C(F)(F)C(=O)[N-]Cc1ccc(OCC(F)(F)F)cc1 ZINC000195323984 944852834 /nfs/dbraw/zinc/85/28/34/944852834.db2.gz PWZHOHKKVVEVGG-UHFFFAOYSA-N -1 3 374.309 3.739 20 0 FHADHM COc1ccc2cc(CN[C@@H](C(=O)[O-])c3ccc(OC)c(F)c3)ccc2c1 ZINC000426829010 944853981 /nfs/dbraw/zinc/85/39/81/944853981.db2.gz NKCWCVJENXGUCL-HXUWFJFHSA-N -1 3 369.392 3.912 20 0 FHADHM COc1cc(-c2nc(C3(c4cccc(C)c4)CC3)no2)cc(OC)c1[O-] ZINC000436957432 944854092 /nfs/dbraw/zinc/85/40/92/944854092.db2.gz XXXALPOQTZBBRB-UHFFFAOYSA-N -1 3 352.390 3.848 20 0 FHADHM CCCCOc1ccc(C(=O)N2CCO[C@@H](c3cccc(F)c3)C2)c([O-])c1 ZINC000436972626 944860656 /nfs/dbraw/zinc/86/06/56/944860656.db2.gz PPAPBQURRDMLBF-HXUWFJFHSA-N -1 3 373.424 3.924 20 0 FHADHM CCN(C(=O)c1ccc(Cl)cc1[O-])[C@@H]1CCN(Cc2ccccc2)C1 ZINC000436974098 944862135 /nfs/dbraw/zinc/86/21/35/944862135.db2.gz WFTGYQQPEBCJTP-QGZVFWFLSA-N -1 3 358.869 3.782 20 0 FHADHM Cc1ccc(C(=O)N(C)[C@@H]2c3cc(Cl)cc(Cl)c3C[C@@H]2O)c([O-])c1 ZINC000436984130 944863869 /nfs/dbraw/zinc/86/38/69/944863869.db2.gz YQTDOHCHWWOVEN-DLBZAZTESA-N -1 3 366.244 3.738 20 0 FHADHM O=S(=O)([N-]Cc1ccc(F)cc1F)c1csc(-c2ccccc2)n1 ZINC000500424585 944871708 /nfs/dbraw/zinc/87/17/08/944871708.db2.gz LLGINBIDDOEGMD-UHFFFAOYSA-N -1 3 366.414 3.567 20 0 FHADHM Cc1ccc(-c2ncc(C(=O)Nc3nnc(C(F)(F)F)[n-]3)s2)c(C)c1 ZINC000149702834 944890206 /nfs/dbraw/zinc/89/02/06/944890206.db2.gz AQLBMIIDXWLKEM-UHFFFAOYSA-N -1 3 367.356 3.816 20 0 FHADHM Cc1ccc(-c2ncc(C(=O)Nc3nc(C(F)(F)F)n[n-]3)s2)c(C)c1 ZINC000149702834 944890210 /nfs/dbraw/zinc/89/02/10/944890210.db2.gz AQLBMIIDXWLKEM-UHFFFAOYSA-N -1 3 367.356 3.816 20 0 FHADHM Cc1n[nH]cc1CCCNC(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436996501 944893251 /nfs/dbraw/zinc/89/32/51/944893251.db2.gz CILLWPBMYXTPGA-UHFFFAOYSA-N -1 3 351.406 3.579 20 0 FHADHM CC[C@@H](C)Oc1ccc([N-]S(=O)(=O)c2ccc(CCOC)cc2)cc1 ZINC000511684656 944915995 /nfs/dbraw/zinc/91/59/95/944915995.db2.gz WURPXGKLDAEAAZ-OAHLLOKOSA-N -1 3 363.479 3.854 20 0 FHADHM CC1(C)C[C@@H](O)CCN(C(=O)c2cc(Cc3ccccc3)ccc2[O-])C1 ZINC000518917600 944937414 /nfs/dbraw/zinc/93/74/14/944937414.db2.gz VYPBUMPLDFRNRV-SFHVURJKSA-N -1 3 353.462 3.606 20 0 FHADHM COc1cc(C(=O)N2[C@H](C)C[C@H](c3ccccc3)[C@@H]2C)cc(OC)c1[O-] ZINC000426974583 944975337 /nfs/dbraw/zinc/97/53/37/944975337.db2.gz XKSWODKJBJCLFO-KEYYUXOJSA-N -1 3 355.434 3.816 20 0 FHADHM CC[C@H](C)[C@@H](NC(=O)c1cc(=O)c2ccccc2[n-]1)c1nc2ccccc2[nH]1 ZINC000507131623 944975397 /nfs/dbraw/zinc/97/53/97/944975397.db2.gz CVSFIHCKSQSARV-RNODOKPDSA-N -1 3 374.444 3.922 20 0 FHADHM O=C(N=c1cc([C@@H]2CCCO2)[n-][nH]1)c1csc(-c2ccccc2Cl)n1 ZINC000473852999 944990598 /nfs/dbraw/zinc/99/05/98/944990598.db2.gz CKPAFWDVKNNAKW-AWEZNQCLSA-N -1 3 374.853 3.712 20 0 FHADHM CCc1nc(C(=O)Nc2cccc(-c3nc(CC)cc(=O)[n-]3)c2)c(C)o1 ZINC000506690722 945022005 /nfs/dbraw/zinc/02/20/05/945022005.db2.gz STGAVPIPAOGEOI-UHFFFAOYSA-N -1 3 352.394 3.523 20 0 FHADHM Cc1ccc(C)c(NC(=O)[C@@H](C)Sc2ccc(-c3nnn[n-]3)cc2F)c1 ZINC000737322784 945040001 /nfs/dbraw/zinc/04/00/01/945040001.db2.gz NQSNAGONFKLJKP-GFCCVEGCSA-N -1 3 371.441 3.742 20 0 FHADHM Cc1ccc(C)c(NC(=O)[C@@H](C)Sc2ccc(-c3nn[n-]n3)cc2F)c1 ZINC000737322784 945040010 /nfs/dbraw/zinc/04/00/10/945040010.db2.gz NQSNAGONFKLJKP-GFCCVEGCSA-N -1 3 371.441 3.742 20 0 FHADHM O=C(NCc1ccc([O-])c(F)c1)c1c(F)ccc(Br)c1F ZINC000427059801 945047222 /nfs/dbraw/zinc/04/72/22/945047222.db2.gz CHRNTMZGISVAIZ-UHFFFAOYSA-N -1 3 360.129 3.502 20 0 FHADHM Cc1nsc(NC([O-])=Cc2c(C)nc3ccccc3c2-c2ccccc2)n1 ZINC000440298026 945385653 /nfs/dbraw/zinc/38/56/53/945385653.db2.gz XJCPVQQKFHUCIE-UHFFFAOYSA-N -1 3 374.469 3.973 20 0 FHADHM C[C@@H](NC(=O)N(CC1CC1)C1CCCCC1)c1cccc(-c2nnn[n-]2)c1 ZINC000820340450 945418474 /nfs/dbraw/zinc/41/84/74/945418474.db2.gz KUHKEKWZWXZVBV-CQSZACIVSA-N -1 3 368.485 3.682 20 0 FHADHM C[C@@H](NC(=O)N(CC1CC1)C1CCCCC1)c1cccc(-c2nn[n-]n2)c1 ZINC000820340450 945418480 /nfs/dbraw/zinc/41/84/80/945418480.db2.gz KUHKEKWZWXZVBV-CQSZACIVSA-N -1 3 368.485 3.682 20 0 FHADHM O=C([O-])[C@H](CNCc1cc(Cl)ccc1Cl)Oc1ccc(F)cc1 ZINC000426644547 945441279 /nfs/dbraw/zinc/44/12/79/945441279.db2.gz DNFSOHLYACTASN-HNNXBMFYSA-N -1 3 358.196 3.754 20 0 FHADHM COc1cccc(-c2nc(CNC(C)(C)c3nc(C)cc(=O)[n-]3)cs2)c1 ZINC000660745896 945451222 /nfs/dbraw/zinc/45/12/22/945451222.db2.gz USZFHWZWYKHCEW-UHFFFAOYSA-N -1 3 370.478 3.648 20 0 FHADHM Cc1cc(=O)[n-]c(C(C)(C)NCc2cc(-c3ccc(Cl)cc3)no2)n1 ZINC000660746070 945451513 /nfs/dbraw/zinc/45/15/13/945451513.db2.gz JATLNRNPFGPARU-UHFFFAOYSA-N -1 3 358.829 3.824 20 0 FHADHM C[C@@H]1CCN(C(=O)Nc2cccc(-c3nnn[n-]3)c2)[C@H]1c1cccc(F)c1 ZINC000820717208 945535429 /nfs/dbraw/zinc/53/54/29/945535429.db2.gz OWZKQVILSGUFIL-SJKOYZFVSA-N -1 3 366.400 3.621 20 0 FHADHM C[C@@H]1CCN(C(=O)Nc2cccc(-c3nn[n-]n3)c2)[C@H]1c1cccc(F)c1 ZINC000820717208 945535441 /nfs/dbraw/zinc/53/54/41/945535441.db2.gz OWZKQVILSGUFIL-SJKOYZFVSA-N -1 3 366.400 3.621 20 0 FHADHM C[C@H]1CCN(c2ncc(-c3nnn[n-]3)cc2Cl)[C@@H]1c1cccc(F)c1 ZINC000820726717 945537199 /nfs/dbraw/zinc/53/71/99/945537199.db2.gz BCKYPQRSCZRYAH-BONVTDFDSA-N -1 3 358.808 3.642 20 0 FHADHM C[C@H]1CCN(c2ncc(-c3nn[n-]n3)cc2Cl)[C@@H]1c1cccc(F)c1 ZINC000820726717 945537202 /nfs/dbraw/zinc/53/72/02/945537202.db2.gz BCKYPQRSCZRYAH-BONVTDFDSA-N -1 3 358.808 3.642 20 0 FHADHM CCCCCc1ccc(NC(=O)c2ncc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000821060713 945627857 /nfs/dbraw/zinc/62/78/57/945627857.db2.gz IUDAGWKMJKXQST-UHFFFAOYSA-N -1 3 370.844 3.900 20 0 FHADHM CCCCCc1ccc(NC(=O)c2ncc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000821060713 945627863 /nfs/dbraw/zinc/62/78/63/945627863.db2.gz IUDAGWKMJKXQST-UHFFFAOYSA-N -1 3 370.844 3.900 20 0 FHADHM CCCCCc1ccc(C(=O)CCC(=O)NCc2ncccc2[O-])cc1 ZINC000473633496 945634472 /nfs/dbraw/zinc/63/44/72/945634472.db2.gz JIVKVBFHJZKXGU-UHFFFAOYSA-N -1 3 354.450 3.799 20 0 FHADHM O=C([N-]c1n[nH]c(Cc2cccc(F)c2)n1)c1coc(C2CCCCC2)n1 ZINC000519703803 945653269 /nfs/dbraw/zinc/65/32/69/945653269.db2.gz DNKUAJJOXMNIGI-UHFFFAOYSA-N -1 3 369.400 3.823 20 0 FHADHM Cc1cc(Br)sc1S(=O)(=O)[N-]C[C@@H]1CCC(F)(F)C1 ZINC000651685453 945653407 /nfs/dbraw/zinc/65/34/07/945653407.db2.gz UFDMTLVIOFBSQH-MRVPVSSYSA-N -1 3 374.272 3.533 20 0 FHADHM Cc1ccc(C(=O)c2ccccc2C(=O)NCc2ncccc2[O-])cc1C ZINC000473640195 945663349 /nfs/dbraw/zinc/66/33/49/945663349.db2.gz RYJFXALRBSUVIZ-UHFFFAOYSA-N -1 3 360.413 3.565 20 0 FHADHM O=C(NCc1ncccc1[O-])c1cccc(OCc2cccc(Cl)c2)c1 ZINC000473639803 945667194 /nfs/dbraw/zinc/66/71/94/945667194.db2.gz PTWIFDIFMSBEIN-UHFFFAOYSA-N -1 3 368.820 3.950 20 0 FHADHM O=C(NCc1ncccc1[O-])C1(c2cc(C(F)(F)F)ccc2Cl)CC1 ZINC000473639710 945668601 /nfs/dbraw/zinc/66/86/01/945668601.db2.gz QSUREAPJRMXHCL-UHFFFAOYSA-N -1 3 370.758 3.807 20 0 FHADHM CC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(C)cc2Cl)c(F)c1 ZINC000032081383 945677117 /nfs/dbraw/zinc/67/71/17/945677117.db2.gz SGGNUSBPLNAXGE-UHFFFAOYSA-N -1 3 356.806 3.547 20 0 FHADHM CC[C@@H]1CCCC[C@@H]1OCC(=O)NCc1ccc([O-])c(Br)c1 ZINC000467925683 945701182 /nfs/dbraw/zinc/70/11/82/945701182.db2.gz BDTMFLVHJXBOPA-CJNGLKHVSA-N -1 3 370.287 3.756 20 0 FHADHM CCOC(=O)c1c([N-]C(=O)c2cc(C3CC3)no2)sc2c1CCCC2 ZINC000440447279 945701304 /nfs/dbraw/zinc/70/13/04/945701304.db2.gz CIIGIVRASPMABG-UHFFFAOYSA-N -1 3 360.435 3.921 20 0 FHADHM O=C(Nc1cc(F)cc(Cl)c1[O-])C(C[C@H]1CCCO1)C(F)(F)F ZINC000651756567 945840771 /nfs/dbraw/zinc/84/07/71/945840771.db2.gz ZTSQOCURAPGECA-RKDXNWHRSA-N -1 3 355.715 3.871 20 0 FHADHM Cc1c(NC(=O)c2cc3cc(Cl)ccc3[nH]2)cccc1-c1nnn[n-]1 ZINC000822110160 945964812 /nfs/dbraw/zinc/96/48/12/945964812.db2.gz XYEJMGYSYPXUNQ-UHFFFAOYSA-N -1 3 352.785 3.562 20 0 FHADHM Cc1c(NC(=O)c2cc3cc(Cl)ccc3[nH]2)cccc1-c1nn[n-]n1 ZINC000822110160 945964822 /nfs/dbraw/zinc/96/48/22/945964822.db2.gz XYEJMGYSYPXUNQ-UHFFFAOYSA-N -1 3 352.785 3.562 20 0 FHADHM CC(C)CN(C(=O)c1c[n-]c2ccc(Br)cc2c1=O)C(C)C ZINC000444142626 945983069 /nfs/dbraw/zinc/98/30/69/945983069.db2.gz PLRLRBUXPFNXPE-UHFFFAOYSA-N -1 3 365.271 3.797 20 0 FHADHM Cc1c2cc(F)ccc2oc1S(=O)(=O)[N-][C@H]1CCCc2cc(N)ccc21 ZINC000440854043 945984391 /nfs/dbraw/zinc/98/43/91/945984391.db2.gz ZVKJGPUPXGVGCY-KRWDZBQOSA-N -1 3 374.437 3.818 20 0 FHADHM O=C(N=c1cc(-c2ccccc2)[n-][nH]1)c1cc(Cl)c2c(c1)OCCCO2 ZINC000519998476 946019309 /nfs/dbraw/zinc/01/93/09/946019309.db2.gz ICYULQRKYNCPEF-UHFFFAOYSA-N -1 3 369.808 3.566 20 0 FHADHM Cc1ccc(CNCc2ccc(-c3nnn[n-]3)o2)c(O[C@@H](C)CC(C)C)c1 ZINC000822238341 946022767 /nfs/dbraw/zinc/02/27/67/946022767.db2.gz CYKBXMKXNLSCJH-HNNXBMFYSA-N -1 3 369.469 3.871 20 0 FHADHM Cc1ccc(CNCc2ccc(-c3nn[n-]n3)o2)c(O[C@@H](C)CC(C)C)c1 ZINC000822238341 946022779 /nfs/dbraw/zinc/02/27/79/946022779.db2.gz CYKBXMKXNLSCJH-HNNXBMFYSA-N -1 3 369.469 3.871 20 0 FHADHM C[C@H](OC(=O)c1cc(Cl)c(Cl)[n-]1)C(=O)Nc1cc(F)ccc1F ZINC000011810575 946036773 /nfs/dbraw/zinc/03/67/73/946036773.db2.gz QPMAFNFLBPLBRG-LURJTMIESA-N -1 3 363.147 3.784 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CC[C@H](C(=O)Nc1sc(C)c(C)c1-c1nn[n-]n1)c1ccc(OC)cc1 ZINC000825038400 947055190 /nfs/dbraw/zinc/05/51/90/947055190.db2.gz AVXZKNJOZHAFFH-AWEZNQCLSA-N -1 3 371.466 3.686 20 0 FHADHM C[C@@H]1CCN(C(=O)C2(C(=O)[O-])CCCCCC2)CCN1Cc1ccccc1 ZINC000663107424 947059978 /nfs/dbraw/zinc/05/99/78/947059978.db2.gz JCFHWLOIIXDQHR-GOSISDBHSA-N -1 3 372.509 3.535 20 0 FHADHM O=S(=O)([N-][C@H](c1ccccc1)[C@@H]1CCCO1)c1ccc(Cl)cc1F ZINC000523295133 947071807 /nfs/dbraw/zinc/07/18/07/947071807.db2.gz XLZGGFHVONZYSX-DOTOQJQBSA-N -1 3 369.845 3.678 20 0 FHADHM CCC(CC)n1nc(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1C ZINC000825114030 947084301 /nfs/dbraw/zinc/08/43/01/947084301.db2.gz IHYIULAHVZTPGB-UHFFFAOYSA-N -1 3 373.848 3.638 20 0 FHADHM CCC(CC)n1nc(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1C ZINC000825114030 947084311 /nfs/dbraw/zinc/08/43/11/947084311.db2.gz IHYIULAHVZTPGB-UHFFFAOYSA-N -1 3 373.848 3.638 20 0 FHADHM CCn1c2ccc(C(=O)[O-])cc2nc1CN1CC[C@@](C)(c2ccccc2)C1 ZINC000652428425 947090503 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O=C(NCc1ccc([O-])c(F)c1)c1cc(C2CC2)nn1-c1ccccc1 ZINC000523424576 947237061 /nfs/dbraw/zinc/23/70/61/947237061.db2.gz BHBKOTFTYBLXIT-UHFFFAOYSA-N -1 3 351.381 3.524 20 0 FHADHM Cc1oc(-c2cccs2)nc1CN1CC[C@@](C(=O)[O-])(c2ccccc2)C1 ZINC000652501709 947240281 /nfs/dbraw/zinc/24/02/81/947240281.db2.gz JKQZCYNMXUJAJN-FQEVSTJZSA-N -1 3 368.458 3.940 20 0 FHADHM CC(C)(C)c1ccccc1OCCNC(=O)NCc1ccc([O-])c(F)c1 ZINC000523430717 947243004 /nfs/dbraw/zinc/24/30/04/947243004.db2.gz INUYKRRRRNDJGG-UHFFFAOYSA-N -1 3 360.429 3.707 20 0 FHADHM CC(=O)c1c(C)cc(C)c(CN2CCC([C@@H]3OCC[C@H]3C(=O)[O-])CC2)c1C ZINC000652505523 947244016 /nfs/dbraw/zinc/24/40/16/947244016.db2.gz AJEJYIKMLQJFPZ-NQIIRXRSSA-N -1 3 373.493 3.516 20 0 FHADHM C[C@H]1CN(Cc2cc(Cl)ccc2OCc2cccnc2)CC[C@@H]1C(=O)[O-] ZINC000652497135 947246309 /nfs/dbraw/zinc/24/63/09/947246309.db2.gz MHYMTZIXXSBATF-KSSFIOAISA-N -1 3 374.868 3.857 20 0 FHADHM CC(C)(C(=O)[O-])[C@@H]1CCCN(Cc2ccn(-c3ccc(Cl)cc3)n2)C1 ZINC000652498832 947249214 /nfs/dbraw/zinc/24/92/14/947249214.db2.gz VPOILJNIWZFYQM-CQSZACIVSA-N -1 3 361.873 3.849 20 0 FHADHM O=C(NCCc1c(Cl)cccc1Cl)NCc1ccc([O-])c(F)c1 ZINC000523467788 947287758 /nfs/dbraw/zinc/28/77/58/947287758.db2.gz LDNIOUGEWCAJRM-UHFFFAOYSA-N -1 3 357.212 3.880 20 0 FHADHM CC(=C([O-])Nc1nc(-c2ccccc2)ns1)c1cn(C)c2ccccc12 ZINC000475614360 947297100 /nfs/dbraw/zinc/29/71/00/947297100.db2.gz FUZWAZKUCSSIET-CYBMUJFWSA-N -1 3 362.458 3.861 20 0 FHADHM O=C(NCc1ccc(OC2CCCCC2)nc1)NCc1ccc([O-])c(F)c1 ZINC000523480857 947299836 /nfs/dbraw/zinc/29/98/36/947299836.db2.gz FSWXHBPYMWQCKN-UHFFFAOYSA-N -1 3 373.428 3.637 20 0 FHADHM COc1ccc(OC)c([C@@H]2CCCN2C(=O)NCc2ccc([O-])c(F)c2)c1 ZINC000523510807 947324128 /nfs/dbraw/zinc/32/41/28/947324128.db2.gz BRRXCVLCXHVQPG-KRWDZBQOSA-N -1 3 374.412 3.595 20 0 FHADHM CCO[C@H]1C[C@@H](Nc2ccc(-c3nc(CC)cc(=O)[n-]3)cn2)C12CCCC2 ZINC000301424166 947337177 /nfs/dbraw/zinc/33/71/77/947337177.db2.gz FZYBGEZEEZHDEP-SJORKVTESA-N -1 3 368.481 3.956 20 0 FHADHM CCO[C@H](C[N-]S(=O)(=O)c1cc(F)ccc1Cl)c1ccccc1 ZINC000445002333 947424015 /nfs/dbraw/zinc/42/40/15/947424015.db2.gz VVNWFWAIVKVHIQ-OAHLLOKOSA-N -1 3 357.834 3.535 20 0 FHADHM C[C@H](Oc1ccc(C(F)(F)F)cc1)C(=O)NCc1ccc([O-])c(F)c1 ZINC000188554561 947439847 /nfs/dbraw/zinc/43/98/47/947439847.db2.gz NRJYVSSKSNUKQW-JTQLQIEISA-N -1 3 357.303 3.634 20 0 FHADHM CC(C)(c1nnc([N-]C(=O)c2cn3ccnc3s2)s1)c1ccccc1 ZINC000188297040 947521532 /nfs/dbraw/zinc/52/15/32/947521532.db2.gz GKSDLJHWBIUOKT-UHFFFAOYSA-N -1 3 369.475 3.826 20 0 FHADHM CCOc1ccc(NC(=S)N[N-]C(=O)c2ccc(F)cc2Cl)cc1 ZINC000015875481 947543140 /nfs/dbraw/zinc/54/31/40/947543140.db2.gz YIUNCKSLHZWSSG-UHFFFAOYSA-N -1 3 367.833 3.509 20 0 FHADHM C[C@@H]1CC[C@H](C(=O)[O-])CN1Cc1oc2ccccc2c1Br ZINC000662210900 947543829 /nfs/dbraw/zinc/54/38/29/947543829.db2.gz AYWUXQVIOSVULM-MNOVXSKESA-N -1 3 352.228 3.880 20 0 FHADHM O=C([O-])CC[C@H](CNCc1ccc(F)c(Br)c1)C(F)(F)F ZINC000663261591 947585461 /nfs/dbraw/zinc/58/54/61/947585461.db2.gz LYFXAUAPHQYXSD-SECBINFHSA-N -1 3 372.156 3.721 20 0 FHADHM O=C([O-])[C@@H](CC(F)F)NCc1ccccc1OCc1ccc(F)cc1F ZINC000663261349 947586070 /nfs/dbraw/zinc/58/60/70/947586070.db2.gz AYCRDFNRZXIYSX-OAHLLOKOSA-N -1 3 371.330 3.742 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CCO[C@H](C(C)(C)C)C3)nc2)n1 ZINC000367194247 947595260 /nfs/dbraw/zinc/59/52/60/947595260.db2.gz BAXQNSFPNRLTBH-CVEARBPZSA-N -1 3 356.470 3.812 20 0 FHADHM Cc1cc(C)cc(-c2cc(=NC(=O)c3ccc4nc(C)c(C)nc4c3)[nH][n-]2)c1 ZINC000523776381 947598915 /nfs/dbraw/zinc/59/89/15/947598915.db2.gz SWWZBQLTTCEBAG-UHFFFAOYSA-N -1 3 371.444 3.928 20 0 FHADHM CSc1ccc(C)c(NC(=S)Nc2ccccc2-c2nnn[n-]2)c1 ZINC000826230415 947673840 /nfs/dbraw/zinc/67/38/40/947673840.db2.gz SBESAVCDXSKGRV-UHFFFAOYSA-N -1 3 356.480 3.706 20 0 FHADHM CSc1ccc(C)c(NC(=S)Nc2ccccc2-c2nn[n-]n2)c1 ZINC000826230415 947673860 /nfs/dbraw/zinc/67/38/60/947673860.db2.gz SBESAVCDXSKGRV-UHFFFAOYSA-N -1 3 356.480 3.706 20 0 FHADHM CC(=CC(=O)N(c1ccccc1-c1nnn[n-]1)C1CCC1)c1cccs1 ZINC001573361511 947690279 /nfs/dbraw/zinc/69/02/79/947690279.db2.gz AKPQELITHJMJSW-SEYXRHQNSA-N -1 3 365.462 3.917 20 0 FHADHM CC(=CC(=O)N(c1ccccc1-c1nn[n-]n1)C1CCC1)c1cccs1 ZINC001573361511 947690288 /nfs/dbraw/zinc/69/02/88/947690288.db2.gz AKPQELITHJMJSW-SEYXRHQNSA-N -1 3 365.462 3.917 20 0 FHADHM C[C@@H](C(=O)N1CCC(c2ccc(-c3nnn[n-]3)cc2)CC1)[C@H](C)C(C)(C)C ZINC001573627170 947720047 /nfs/dbraw/zinc/72/00/47/947720047.db2.gz ZVVQRHISXIRBNN-CABCVRRESA-N -1 3 369.513 3.891 20 0 FHADHM C[C@@H](C(=O)N1CCC(c2ccc(-c3nn[n-]n3)cc2)CC1)[C@H](C)C(C)(C)C ZINC001573627170 947720054 /nfs/dbraw/zinc/72/00/54/947720054.db2.gz ZVVQRHISXIRBNN-CABCVRRESA-N -1 3 369.513 3.891 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)Nc1cc(C)cc(-c2nnn[n-]2)c1 ZINC001573364864 947724898 /nfs/dbraw/zinc/72/48/98/947724898.db2.gz KBDPBWKIYZILIX-FMIVXFBMSA-N -1 3 353.813 3.871 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)Nc1cc(C)cc(-c2nn[n-]n2)c1 ZINC001573364864 947724907 /nfs/dbraw/zinc/72/49/07/947724907.db2.gz KBDPBWKIYZILIX-FMIVXFBMSA-N -1 3 353.813 3.871 20 0 FHADHM CCCCc1ccc(NC(=O)Cc2noc(-c3ccccc3[O-])n2)cc1 ZINC000445321572 947726017 /nfs/dbraw/zinc/72/60/17/947726017.db2.gz LWJNTDPLXSJYQW-UHFFFAOYSA-N -1 3 351.406 3.966 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)N1CCc2c1cccc2-c1nnn[n-]1 ZINC001573367107 947753024 /nfs/dbraw/zinc/75/30/24/947753024.db2.gz XKBDCEQKPOJQGE-QXMHVHEDSA-N -1 3 365.824 3.513 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)N1CCc2c1cccc2-c1nn[n-]n1 ZINC001573367107 947753030 /nfs/dbraw/zinc/75/30/30/947753030.db2.gz XKBDCEQKPOJQGE-QXMHVHEDSA-N -1 3 365.824 3.513 20 0 FHADHM Cc1cc(N[C@H](C)c2ccc(-c3cccc(-c4nnn[n-]4)c3)cc2)ncn1 ZINC000826270801 947785442 /nfs/dbraw/zinc/78/54/42/947785442.db2.gz PJLMWCAEBNAMLB-CQSZACIVSA-N -1 3 357.421 3.805 20 0 FHADHM Cc1cc(N[C@H](C)c2ccc(-c3cccc(-c4nn[n-]n4)c3)cc2)ncn1 ZINC000826270801 947785447 /nfs/dbraw/zinc/78/54/47/947785447.db2.gz PJLMWCAEBNAMLB-CQSZACIVSA-N -1 3 357.421 3.805 20 0 FHADHM Cc1ccc(CN[C@H](c2cccc(-c3nnn[n-]3)c2)C(F)(F)F)cc1F ZINC000826288832 947840291 /nfs/dbraw/zinc/84/02/91/947840291.db2.gz YMJUWMRYADMQRD-OAHLLOKOSA-N -1 3 365.334 3.707 20 0 FHADHM Cc1ccc(CN[C@H](c2cccc(-c3nn[n-]n3)c2)C(F)(F)F)cc1F ZINC000826288832 947840299 /nfs/dbraw/zinc/84/02/99/947840299.db2.gz YMJUWMRYADMQRD-OAHLLOKOSA-N -1 3 365.334 3.707 20 0 FHADHM Cc1cccc(NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c1F ZINC000826299761 947870126 /nfs/dbraw/zinc/87/01/26/947870126.db2.gz UHWMBTQFIDAWKF-UHFFFAOYSA-N -1 3 362.821 3.777 20 0 FHADHM Cc1cccc(NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c1F ZINC000826299761 947870135 /nfs/dbraw/zinc/87/01/35/947870135.db2.gz UHWMBTQFIDAWKF-UHFFFAOYSA-N -1 3 362.821 3.777 20 0 FHADHM Cc1ccnc(N2CCCC[C@@H]2c2ccc(F)cc2F)c1-c1nnn[n-]1 ZINC000826311102 947900353 /nfs/dbraw/zinc/90/03/53/947900353.db2.gz SYYQCUBNFYIBRP-OAHLLOKOSA-N -1 3 356.380 3.580 20 0 FHADHM Cc1ccnc(N2CCCC[C@@H]2c2ccc(F)cc2F)c1-c1nn[n-]n1 ZINC000826311102 947900360 /nfs/dbraw/zinc/90/03/60/947900360.db2.gz SYYQCUBNFYIBRP-OAHLLOKOSA-N -1 3 356.380 3.580 20 0 FHADHM CCOC(=O)C(=Cc1cccs1)c1nc(=O)c2c(C)c(C)sc2[n-]1 ZINC000007502843 948063476 /nfs/dbraw/zinc/06/34/76/948063476.db2.gz REZYVOZYMUWACD-WQLSENKSSA-N -1 3 360.460 3.767 20 0 FHADHM Cn1cc(CNc2cc(Cl)ccc2-c2nnn[n-]2)c(-c2ccccc2)n1 ZINC000826361846 948133224 /nfs/dbraw/zinc/13/32/24/948133224.db2.gz RQZOJKVOPPNZGJ-UHFFFAOYSA-N -1 3 365.828 3.533 20 0 FHADHM Cn1cc(CNc2cc(Cl)ccc2-c2nn[n-]n2)c(-c2ccccc2)n1 ZINC000826361846 948133232 /nfs/dbraw/zinc/13/32/32/948133232.db2.gz RQZOJKVOPPNZGJ-UHFFFAOYSA-N -1 3 365.828 3.533 20 0 FHADHM Fc1ccc(F)c(CNc2ccc(Br)cc2-c2nnn[n-]2)c1 ZINC000826374877 948162492 /nfs/dbraw/zinc/16/24/92/948162492.db2.gz PUHXHXOGZAACPI-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1ccc(F)c(CNc2ccc(Br)cc2-c2nn[n-]n2)c1 ZINC000826374877 948162501 /nfs/dbraw/zinc/16/25/01/948162501.db2.gz PUHXHXOGZAACPI-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1cccc(Cc2cnc(NCc3ccc(-c4nnn[n-]4)cc3)s2)c1 ZINC000826377089 948167948 /nfs/dbraw/zinc/16/79/48/948167948.db2.gz DMZJPEOGLUOHHH-UHFFFAOYSA-N -1 3 366.425 3.665 20 0 FHADHM Fc1cccc(Cc2cnc(NCc3ccc(-c4nn[n-]n4)cc3)s2)c1 ZINC000826377089 948167954 /nfs/dbraw/zinc/16/79/54/948167954.db2.gz DMZJPEOGLUOHHH-UHFFFAOYSA-N -1 3 366.425 3.665 20 0 FHADHM O=C([O-])[C@H](CNCc1cnc(C2CCCC2)s1)Oc1ccc(F)cc1 ZINC000417560887 948224399 /nfs/dbraw/zinc/22/43/99/948224399.db2.gz HWAAYSMIOJXTOU-INIZCTEOSA-N -1 3 364.442 3.562 20 0 FHADHM O=C(CC1CCC(C(F)(F)F)CC1)Oc1ccc(-c2nnn[n-]2)cc1 ZINC000826403808 948228789 /nfs/dbraw/zinc/22/87/89/948228789.db2.gz DMEDLDIEWNKSGC-UHFFFAOYSA-N -1 3 354.332 3.531 20 0 FHADHM O=C(CC1CCC(C(F)(F)F)CC1)Oc1ccc(-c2nn[n-]n2)cc1 ZINC000826403808 948228797 /nfs/dbraw/zinc/22/87/97/948228797.db2.gz DMEDLDIEWNKSGC-UHFFFAOYSA-N -1 3 354.332 3.531 20 0 FHADHM O=C(CC1CCC(C(F)(F)F)CC1)Nc1ccc(F)cc1-c1nnn[n-]1 ZINC000826404018 948229058 /nfs/dbraw/zinc/22/90/58/948229058.db2.gz LMTWEZRQZILNIL-UHFFFAOYSA-N -1 3 371.338 3.703 20 0 FHADHM O=C(CC1CCC(C(F)(F)F)CC1)Nc1ccc(F)cc1-c1nn[n-]n1 ZINC000826404018 948229067 /nfs/dbraw/zinc/22/90/67/948229067.db2.gz LMTWEZRQZILNIL-UHFFFAOYSA-N -1 3 371.338 3.703 20 0 FHADHM O=C(CSc1cccc(Cl)c1-c1nnn[n-]1)c1ccc2c(c1)COC2 ZINC000826421052 948266169 /nfs/dbraw/zinc/26/61/69/948266169.db2.gz PKFCMOLGWRBYIQ-UHFFFAOYSA-N -1 3 372.837 3.525 20 0 FHADHM O=C(CSc1cccc(Cl)c1-c1nn[n-]n1)c1ccc2c(c1)COC2 ZINC000826421052 948266176 /nfs/dbraw/zinc/26/61/76/948266176.db2.gz PKFCMOLGWRBYIQ-UHFFFAOYSA-N -1 3 372.837 3.525 20 0 FHADHM O=C(Cc1cccc(-c2nnn[n-]2)c1)Nc1ncc(C2CCCCC2)s1 ZINC000826423474 948273025 /nfs/dbraw/zinc/27/30/25/948273025.db2.gz QLFKYIAULRDXOR-UHFFFAOYSA-N -1 3 368.466 3.552 20 0 FHADHM O=C(Cc1cccc(-c2nn[n-]n2)c1)Nc1ncc(C2CCCCC2)s1 ZINC000826423474 948273037 /nfs/dbraw/zinc/27/30/37/948273037.db2.gz QLFKYIAULRDXOR-UHFFFAOYSA-N -1 3 368.466 3.552 20 0 FHADHM CCCCn1ccnc1-c1cccc(NC([O-])=NO[C@@H]2CCCCO2)c1 ZINC000163057046 948282427 /nfs/dbraw/zinc/28/24/27/948282427.db2.gz XWCSLDNVANJKMO-QGZVFWFLSA-N -1 3 358.442 3.930 20 0 FHADHM CCCCn1ccnc1-c1cccc(NC(=O)[N-]O[C@@H]2CCCCO2)c1 ZINC000163057046 948282433 /nfs/dbraw/zinc/28/24/33/948282433.db2.gz XWCSLDNVANJKMO-QGZVFWFLSA-N -1 3 358.442 3.930 20 0 FHADHM Cc1cccc([C@@H]2CCCCCN2C(=O)c2cnc3c(cnn3C)c2[O-])c1 ZINC000512107279 948434947 /nfs/dbraw/zinc/43/49/47/948434947.db2.gz CGYORGYQQZANQB-SFHVURJKSA-N -1 3 364.449 3.740 20 0 FHADHM O=C(N=c1cc(-c2ccccc2)[n-][nH]1)c1ccc(F)cc1Br ZINC000520632873 948454309 /nfs/dbraw/zinc/45/43/09/948454309.db2.gz DCAYLBIDAFYIBB-UHFFFAOYSA-N -1 3 360.186 3.653 20 0 FHADHM O=C(N=c1cc2ccccn2[n-]1)NC1(c2cccc(C(F)(F)F)c2)CC1 ZINC000520633798 948456609 /nfs/dbraw/zinc/45/66/09/948456609.db2.gz MWFQIGGJDSBDHB-UHFFFAOYSA-N -1 3 360.339 3.586 20 0 FHADHM [O-]c1ccc(F)c(CNCCc2nc3ccccc3n2C(F)F)c1F ZINC000512117214 948464078 /nfs/dbraw/zinc/46/40/78/948464078.db2.gz ZVYRJMMHLYRQQO-UHFFFAOYSA-N -1 3 353.319 3.748 20 0 FHADHM Cc1nc2c(Cl)cccc2cc1C(=O)Nc1ccccc1-c1nnn[n-]1 ZINC001169581349 948489962 /nfs/dbraw/zinc/48/99/62/948489962.db2.gz LLMSIQMSSYMXNE-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1nc2c(Cl)cccc2cc1C(=O)Nc1ccccc1-c1nn[n-]n1 ZINC001169581349 948489965 /nfs/dbraw/zinc/48/99/65/948489965.db2.gz LLMSIQMSSYMXNE-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)C=Cc3ccsc3)c2)n1 ZINC000049302138 948536222 /nfs/dbraw/zinc/53/62/22/948536222.db2.gz OSHPHBQSRCMICZ-VOTSOKGWSA-N -1 3 351.431 3.713 20 0 FHADHM O=C(Nc1cc(-c2nnn[n-]2)ccc1F)c1cc2cccc(Cl)c2o1 ZINC001528506626 948543030 /nfs/dbraw/zinc/54/30/30/948543030.db2.gz OVVGSFIJTHSPPU-UHFFFAOYSA-N -1 3 357.732 3.658 20 0 FHADHM O=C(Nc1cc(-c2nn[n-]n2)ccc1F)c1cc2cccc(Cl)c2o1 ZINC001528506626 948543035 /nfs/dbraw/zinc/54/30/35/948543035.db2.gz OVVGSFIJTHSPPU-UHFFFAOYSA-N -1 3 357.732 3.658 20 0 FHADHM Cc1nscc1C(=O)N=c1cc(-c2cc(Cl)cc(Cl)c2)[n-][nH]1 ZINC000512149270 948561770 /nfs/dbraw/zinc/56/17/70/948561770.db2.gz SWVPWOVGGXCSQO-UHFFFAOYSA-N -1 3 353.234 3.823 20 0 FHADHM Cc1cc(C)c(S(=O)(=O)[N-]c2cccc3c2OCC[C@H]3N(C)C)c(C)c1 ZINC000432490372 948572480 /nfs/dbraw/zinc/57/24/80/948572480.db2.gz SNRPKPDTXBMWQJ-GOSISDBHSA-N -1 3 374.506 3.798 20 0 FHADHM CCOC(=O)c1nc([C@@H](CC(C)C)NCc2ccsc2Cl)n[n-]1 ZINC000895103968 948575238 /nfs/dbraw/zinc/57/52/38/948575238.db2.gz BHYAPKDJKGELGX-LLVKDONJSA-N -1 3 356.879 3.573 20 0 FHADHM CCOC(=O)c1nnc([C@@H](CC(C)C)NCc2ccsc2Cl)[n-]1 ZINC000895103968 948575243 /nfs/dbraw/zinc/57/52/43/948575243.db2.gz BHYAPKDJKGELGX-LLVKDONJSA-N -1 3 356.879 3.573 20 0 FHADHM CCOC(=O)c1n[n-]c([C@@H](CC(C)C)NCc2ccsc2Cl)n1 ZINC000895103968 948575244 /nfs/dbraw/zinc/57/52/44/948575244.db2.gz BHYAPKDJKGELGX-LLVKDONJSA-N -1 3 356.879 3.573 20 0 FHADHM COc1ccc(NC(=O)Cc2noc(-c3ccc(C)cc3[O-])n2)cc1Cl ZINC000445380571 948745917 /nfs/dbraw/zinc/74/59/17/948745917.db2.gz LMUMRJNQAVSKFP-UHFFFAOYSA-N -1 3 373.796 3.594 20 0 FHADHM CC(C)c1ccc2c(c1)[C@H](NC(=O)c1ccc(-c3nnn[n-]3)cc1)CCC2 ZINC001574417078 948767444 /nfs/dbraw/zinc/76/74/44/948767444.db2.gz KUODHSGCAGRQAM-LJQANCHMSA-N -1 3 361.449 3.798 20 0 FHADHM CC(C)c1ccc2c(c1)[C@H](NC(=O)c1ccc(-c3nn[n-]n3)cc1)CCC2 ZINC001574417078 948767455 /nfs/dbraw/zinc/76/74/55/948767455.db2.gz KUODHSGCAGRQAM-LJQANCHMSA-N -1 3 361.449 3.798 20 0 FHADHM C[C@@H]1CN(C(=O)c2ccc3c(c2[O-])OC(C)(C)C3)C[C@H](c2ccccc2)O1 ZINC000078441302 205040274 /nfs/dbraw/zinc/04/02/74/205040274.db2.gz IKKCGXPZFWKBTN-RDTXWAMCSA-N -1 3 367.445 3.708 20 0 FHADHM Cc1cc(C)c(NC(=O)CN(C)C(=O)c2ccc(C)c(C)c2[O-])c(C)c1 ZINC000048379618 205162909 /nfs/dbraw/zinc/16/29/09/205162909.db2.gz NDGKPCWYLMGOGC-UHFFFAOYSA-N -1 3 354.450 3.645 20 0 FHADHM CCc1ccc([O-])c(C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)cc2)c1 ZINC000109821105 206063495 /nfs/dbraw/zinc/06/34/95/206063495.db2.gz RTXAFHNBXPSRTG-HUUCEWRRSA-N -1 3 354.450 3.821 20 0 FHADHM Cc1cc(C(=O)Nc2ccc(Br)cc2[O-])nn1C(C)(C)C ZINC000124314143 206114538 /nfs/dbraw/zinc/11/45/38/206114538.db2.gz GSZRRARRWCFVAQ-UHFFFAOYSA-N -1 3 352.232 3.667 20 0 FHADHM C[C@@H]1CN(c2ccccc2NC(=O)c2cc(-c3ccco3)[n-]n2)C[C@@H](C)O1 ZINC000130184242 132251031 /nfs/dbraw/zinc/25/10/31/132251031.db2.gz GZMUBDUKYRSXJI-ZIAGYGMSSA-N -1 3 366.421 3.536 20 0 FHADHM C[C@@H]1CN(c2ccccc2NC(=O)c2cc(-c3ccco3)n[n-]2)C[C@@H](C)O1 ZINC000130184242 132251032 /nfs/dbraw/zinc/25/10/32/132251032.db2.gz GZMUBDUKYRSXJI-ZIAGYGMSSA-N -1 3 366.421 3.536 20 0 FHADHM CCCc1n[n-]c(=NC(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)s1 ZINC000489536777 514884604 /nfs/dbraw/zinc/88/46/04/514884604.db2.gz SNRSJVVUYXBGJM-GOEBONIOSA-N -1 3 373.526 3.523 20 0 FHADHM C[C@H](CNC(=O)N=c1[n-]nc(-c2ccsc2)s1)N1CCC[C@H](C)C1 ZINC000503033059 514889010 /nfs/dbraw/zinc/88/90/10/514889010.db2.gz HQZBPVDHMBYYNA-NWDGAFQWSA-N -1 3 365.528 3.509 20 0 FHADHM Cc1cc(C)cc(-c2cc(=NC(=O)[C@H]3CC(=O)N[C@H](CC(C)C)C3)[nH][n-]2)c1 ZINC000508852034 514919775 /nfs/dbraw/zinc/91/97/75/514919775.db2.gz ZJTMXIQZDPVBDD-IAGOWNOFSA-N -1 3 368.481 3.573 20 0 FHADHM CC[C@H](C)c1ccccc1OCC(=O)N=c1cc(OC(F)F)n(C)[n-]1 ZINC000490978125 515347334 /nfs/dbraw/zinc/34/73/34/515347334.db2.gz YJQGUZRONNGTAA-NSHDSACASA-N -1 3 353.369 3.553 20 0 FHADHM Cc1ccccc1-c1cc(=NC(=O)c2csc(-c3cnccn3)n2)[nH][n-]1 ZINC000478040411 515678022 /nfs/dbraw/zinc/67/80/22/515678022.db2.gz LUFLQYXYNGOHGJ-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM O=C(N=c1cc([C@H]2CCCO2)[n-][nH]1)c1c[nH]nc1-c1ccc(Cl)cc1 ZINC000473841377 515769865 /nfs/dbraw/zinc/76/98/65/515769865.db2.gz GVXXFBWAQGEZIF-CQSZACIVSA-N -1 3 357.801 3.557 20 0 FHADHM COc1ccc(C(=O)N=c2cc([C@@H]3CCCO3)[n-][nH]2)c(OCC(C)C)c1 ZINC000473854627 515777864 /nfs/dbraw/zinc/77/78/64/515777864.db2.gz ZVKLXFTUBNNTAC-INIZCTEOSA-N -1 3 359.426 3.557 20 0 FHADHM CCc1[n-][nH]c(=NC(=O)C2(CC)CCN(C(=O)c3ccccc3)CC2)c1C ZINC000512529537 516300788 /nfs/dbraw/zinc/30/07/88/516300788.db2.gz UJVOYAMRKJUKTR-UHFFFAOYSA-N -1 3 368.481 3.552 20 0 FHADHM Cc1c(C(=O)N=c2cc(-c3ccccc3)[n-][nH]2)nnn1-c1cccc(C)c1 ZINC000497583495 516327210 /nfs/dbraw/zinc/32/72/10/516327210.db2.gz YRFBNCSYSUPMFG-UHFFFAOYSA-N -1 3 358.405 3.527 20 0 FHADHM CCOc1c(Cl)cc(C(=O)N=c2cc([C@H]3CCCO3)[n-][nH]2)cc1OC ZINC000526959907 517410639 /nfs/dbraw/zinc/41/06/39/517410639.db2.gz VOQWXRUZWKXZCM-CYBMUJFWSA-N -1 3 365.817 3.574 20 0 FHADHM Cn1[n-]c(=NC(=O)N[C@H]2CC[C@H](Cc3ccccc3)C2)cc1OC(F)F ZINC000527088781 517498436 /nfs/dbraw/zinc/49/84/36/517498436.db2.gz QTKNVKZQFZEODX-KGLIPLIRSA-N -1 3 364.396 3.554 20 0 FHADHM Cc1[n-][nH]c(=NC(=O)[C@H]2C[C@@H](C)Cc3c[nH]nc32)c1-c1ccc(F)cc1 ZINC000530276033 517673291 /nfs/dbraw/zinc/67/32/91/517673291.db2.gz DYJWXHABCXRRHN-BONVTDFDSA-N -1 3 353.401 3.552 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NCc3ccnc(SC)c3)nc2)n1 ZINC000538939269 517854677 /nfs/dbraw/zinc/85/46/77/517854677.db2.gz UAPRRLXFBZMLDV-UHFFFAOYSA-N -1 3 353.451 3.536 20 0 FHADHM O=C(COC1CCOCC1)N=c1cc(-c2cc(Cl)cc(Cl)c2)[n-][nH]1 ZINC000605021877 520757315 /nfs/dbraw/zinc/75/73/15/520757315.db2.gz ABOBDZXGNPSHEW-UHFFFAOYSA-N -1 3 370.236 3.518 20 0 FHADHM O=C(c1ccc2c(c1[O-])CCCC2)N1CCO[C@@H](c2ccc(F)c(F)c2)C1 ZINC000185780992 567863532 /nfs/dbraw/zinc/86/35/32/567863532.db2.gz XAULLYBJBPKIRU-LJQANCHMSA-N -1 3 373.399 3.763 20 0 FHADHM COC(=O)c1c(Cl)ccc([N-]C(=O)c2ocnc2C2CC2)c1Cl ZINC000602385880 567974099 /nfs/dbraw/zinc/97/40/99/567974099.db2.gz SPHVNQHYODARTM-UHFFFAOYSA-N -1 3 355.177 3.898 20 0 FHADHM Cc1ncsc1CN(C)C(=O)c1ccc(C(=O)c2cccc([O-])c2)cc1 ZINC000186791221 567983735 /nfs/dbraw/zinc/98/37/35/567983735.db2.gz AZVBNTZYQRCPFB-UHFFFAOYSA-N -1 3 366.442 3.660 20 0 FHADHM COC(=O)c1scc(C)c1[N-]C(=O)c1nc(C(C)C)ncc1Cl ZINC000186877036 567998857 /nfs/dbraw/zinc/99/88/57/567998857.db2.gz SMTBABWPBBBKEN-UHFFFAOYSA-N -1 3 353.831 3.662 20 0 FHADHM COC(=O)c1scc(C)c1[N-]C(=O)c1cnc(-c2ccncc2)s1 ZINC000186914129 568008224 /nfs/dbraw/zinc/00/82/24/568008224.db2.gz RILRLKRCQHVFMQ-UHFFFAOYSA-N -1 3 359.432 3.614 20 0 FHADHM CC[C@H]1CCCN(C(=O)c2cc(=O)c3cc(Br)ccc3[n-]2)C1 ZINC000602744521 568021674 /nfs/dbraw/zinc/02/16/74/568021674.db2.gz UKBAZQGMDOTDKY-NSHDSACASA-N -1 3 363.255 3.553 20 0 FHADHM COc1cc(C(=O)NCCCCCc2ccc(F)cc2)cc(OC)c1[O-] ZINC000186965367 568028509 /nfs/dbraw/zinc/02/85/09/568028509.db2.gz QTXRTCHHKOCLDC-UHFFFAOYSA-N -1 3 361.413 3.691 20 0 FHADHM CCOC[C@@H]1CCCN(C(=O)c2ccc(C(=O)c3cccc([O-])c3)cc2)C1 ZINC000186976729 568033224 /nfs/dbraw/zinc/03/32/24/568033224.db2.gz QZTCQOKNZSYQBI-MRXNPFEDSA-N -1 3 367.445 3.512 20 0 FHADHM O=S(=O)([N-]C[C@@H]1OCCc2ccccc21)c1cc(Cl)ccc1Cl ZINC000603506584 568109775 /nfs/dbraw/zinc/10/97/75/568109775.db2.gz UXVFMKYVQLKGHH-HNNXBMFYSA-N -1 3 372.273 3.586 20 0 FHADHM Cc1cc(C(=O)[N-]c2sc3c(c2C(=O)OC(C)C)CC[C@@H](C)C3)on1 ZINC000603673336 568133425 /nfs/dbraw/zinc/13/34/25/568133425.db2.gz HAKIBDCFUZPFIA-SNVBAGLBSA-N -1 3 362.451 3.987 20 0 FHADHM C[C@H](NC(=O)NCc1ccc([O-])c(F)c1)c1nc(C(C)(C)C)cs1 ZINC000159315778 568134055 /nfs/dbraw/zinc/13/40/55/568134055.db2.gz MTRYXCNFRIOEEW-JTQLQIEISA-N -1 3 351.447 3.846 20 0 FHADHM CCOC(=O)c1ncc(NC(=O)C(C)(C)c2cccc(C(F)(F)F)c2)[n-]1 ZINC000617877169 568192464 /nfs/dbraw/zinc/19/24/64/568192464.db2.gz FKVSECWGPOTDGJ-UHFFFAOYSA-N -1 3 369.343 3.522 20 0 FHADHM CCOC(=O)c1nc(NC(=O)C(C)(C)c2cccc(C(F)(F)F)c2)c[n-]1 ZINC000617877169 568192465 /nfs/dbraw/zinc/19/24/65/568192465.db2.gz FKVSECWGPOTDGJ-UHFFFAOYSA-N -1 3 369.343 3.522 20 0 FHADHM CC(C)c1ccc([C@H](NC(=O)CN2C[C@@H](C(=O)[O-])CC[C@@H]2C)C(C)C)cc1 ZINC000563126134 568259844 /nfs/dbraw/zinc/25/98/44/568259844.db2.gz RUAIFXDHLNMXBP-NBHGPNQESA-N -1 3 374.525 3.808 20 0 FHADHM C[C@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000365210001 568322246 /nfs/dbraw/zinc/32/22/46/568322246.db2.gz YLAAOGRUPJMIQC-DZGCQCFKSA-N -1 3 350.393 3.685 20 0 FHADHM O=C(N[C@H](c1ccc(F)cc1)c1cccnc1)c1c[n-]c2ccccc2c1=O ZINC000365214856 568325602 /nfs/dbraw/zinc/32/56/02/568325602.db2.gz VKIDQPAWMYUSCK-HXUWFJFHSA-N -1 3 373.387 3.582 20 0 FHADHM CC(=O)c1cc(F)c([N-]C(=O)c2sc([C@@H]3CCOC3)nc2C)c(F)c1 ZINC000637052823 568330871 /nfs/dbraw/zinc/33/08/71/568330871.db2.gz CSNXOCYGCYBTKH-SNVBAGLBSA-N -1 3 366.389 3.689 20 0 FHADHM CCCn1c(C)cc(C(=O)CSc2n[n-]c(-c3ccccn3)n2)c1C ZINC000604933251 568395451 /nfs/dbraw/zinc/39/54/51/568395451.db2.gz QIHRMLLVTNJMOQ-UHFFFAOYSA-N -1 3 355.467 3.670 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2cccc(-c3cc[nH]n3)c2)c(C)c1C ZINC000604971558 568462815 /nfs/dbraw/zinc/46/28/15/568462815.db2.gz ZUXMUNQFLJLAAX-UHFFFAOYSA-N -1 3 357.435 3.503 20 0 FHADHM CCOc1ccc([N-]S(=O)(=O)c2ccc(OC)c(C)c2C)cc1F ZINC000604971635 568463546 /nfs/dbraw/zinc/46/35/46/568463546.db2.gz FKYKCNZMLHKLIG-UHFFFAOYSA-N -1 3 353.415 3.651 20 0 FHADHM C[C@H]1CC(NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)C[C@H](C)C1 ZINC000736223229 598827620 /nfs/dbraw/zinc/82/76/20/598827620.db2.gz ILXXTOYAYDFKGS-NXEZZACHSA-N -1 3 364.906 3.631 20 0 FHADHM C[C@H]1CC(NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)C[C@H](C)C1 ZINC000736223229 598827622 /nfs/dbraw/zinc/82/76/22/598827622.db2.gz ILXXTOYAYDFKGS-NXEZZACHSA-N -1 3 364.906 3.631 20 0 FHADHM CC[C@@H]1CCCCCN1C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736401131 598827525 /nfs/dbraw/zinc/82/75/25/598827525.db2.gz VVODTQIQOHSTFR-GFCCVEGCSA-N -1 3 364.906 3.872 20 0 FHADHM CC[C@@H]1CCCCCN1C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736401131 598827527 /nfs/dbraw/zinc/82/75/27/598827527.db2.gz VVODTQIQOHSTFR-GFCCVEGCSA-N -1 3 364.906 3.872 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@@H](C)c1cccc(C)c1 ZINC000736478880 598830658 /nfs/dbraw/zinc/83/06/58/598830658.db2.gz FMRPXKOFSTYWMI-INIZCTEOSA-N -1 3 363.465 3.717 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@@H](C)c1cccc(C)c1 ZINC000736478880 598830660 /nfs/dbraw/zinc/83/06/60/598830660.db2.gz FMRPXKOFSTYWMI-INIZCTEOSA-N -1 3 363.465 3.717 20 0 FHADHM CC(C)CN(Cc1ncc(C(C)C)o1)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000735831076 598831614 /nfs/dbraw/zinc/83/16/14/598831614.db2.gz NHPNWXAXTPPQBX-UHFFFAOYSA-N -1 3 354.458 3.636 20 0 FHADHM CCCCCC(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000736440175 598833469 /nfs/dbraw/zinc/83/34/69/598833469.db2.gz AQTATDTXGAMITI-UHFFFAOYSA-N -1 3 355.467 3.792 20 0 FHADHM CC(C)CCC(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000735796291 598833803 /nfs/dbraw/zinc/83/38/03/598833803.db2.gz YWLXXYVVCBTCCM-UHFFFAOYSA-N -1 3 355.467 3.648 20 0 FHADHM Cc1ccc2oc(SCCCOc3ccc(-c4nn[n-]n4)cc3)nc2c1 ZINC000737380219 598861565 /nfs/dbraw/zinc/86/15/65/598861565.db2.gz MTOXLRGBMGIQQN-UHFFFAOYSA-N -1 3 367.434 3.878 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@H](C)C1CCCC1 ZINC000735831774 598876331 /nfs/dbraw/zinc/87/63/31/598876331.db2.gz VIQNIPLAEHBJMK-OAHLLOKOSA-N -1 3 370.501 3.613 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@H](C)C1CCCC1 ZINC000735831774 598876332 /nfs/dbraw/zinc/87/63/32/598876332.db2.gz VIQNIPLAEHBJMK-OAHLLOKOSA-N -1 3 370.501 3.613 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1Nc1cccc(N2CCCCC2)c1 ZINC000737558595 598939123 /nfs/dbraw/zinc/93/91/23/598939123.db2.gz OGVFNVDDBYVCDE-UHFFFAOYSA-N -1 3 355.833 3.649 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1Nc1cccc(N2CCCCC2)c1 ZINC000737558595 598939125 /nfs/dbraw/zinc/93/91/25/598939125.db2.gz OGVFNVDDBYVCDE-UHFFFAOYSA-N -1 3 355.833 3.649 20 0 FHADHM Clc1ccccc1[C@H]1CCCN1c1ncc(-c2nnn[n-]2)cc1Cl ZINC000737584582 598939343 /nfs/dbraw/zinc/93/93/43/598939343.db2.gz TWKPUSVBYJWNFN-CQSZACIVSA-N -1 3 361.236 3.910 20 0 FHADHM Clc1ccccc1[C@H]1CCCN1c1ncc(-c2nn[n-]n2)cc1Cl ZINC000737584582 598939345 /nfs/dbraw/zinc/93/93/45/598939345.db2.gz TWKPUSVBYJWNFN-CQSZACIVSA-N -1 3 361.236 3.910 20 0 FHADHM CC(C)C[C@H](C(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000735756811 598939539 /nfs/dbraw/zinc/93/95/39/598939539.db2.gz QWTHTQYWBHTQEF-IBGZPJMESA-N -1 3 363.465 3.655 20 0 FHADHM CC(C)C[C@H](C(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000735756811 598939541 /nfs/dbraw/zinc/93/95/41/598939541.db2.gz QWTHTQYWBHTQEF-IBGZPJMESA-N -1 3 363.465 3.655 20 0 FHADHM CC(C)C[C@H](C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccccc1 ZINC000735756776 598940822 /nfs/dbraw/zinc/94/08/22/598940822.db2.gz QRIOUBHRVCUZLD-HNNXBMFYSA-N -1 3 353.401 3.774 20 0 FHADHM CC(C)C[C@H](C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccccc1 ZINC000735756776 598940824 /nfs/dbraw/zinc/94/08/24/598940824.db2.gz QRIOUBHRVCUZLD-HNNXBMFYSA-N -1 3 353.401 3.774 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1N[C@H](c1ccccc1)c1cccnc1 ZINC000737557686 598941604 /nfs/dbraw/zinc/94/16/04/598941604.db2.gz HLLFZUIVEMOERZ-MRXNPFEDSA-N -1 3 363.812 3.512 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1N[C@H](c1ccccc1)c1cccnc1 ZINC000737557686 598941606 /nfs/dbraw/zinc/94/16/06/598941606.db2.gz HLLFZUIVEMOERZ-MRXNPFEDSA-N -1 3 363.812 3.512 20 0 FHADHM CC(C)[C@H]1CCCN(C(=O)Nc2cc(-c3nnn[n-]3)cn2C(C)(C)C)CC1 ZINC000735748071 598961977 /nfs/dbraw/zinc/96/19/77/598961977.db2.gz HDFHSBUMVNUJQO-AWEZNQCLSA-N -1 3 373.505 3.713 20 0 FHADHM CC(C)[C@H]1CCCN(C(=O)Nc2cc(-c3nn[n-]n3)cn2C(C)(C)C)CC1 ZINC000735748071 598961979 /nfs/dbraw/zinc/96/19/79/598961979.db2.gz HDFHSBUMVNUJQO-AWEZNQCLSA-N -1 3 373.505 3.713 20 0 FHADHM Fc1cc(NC[C@H]2CCCOC2)ccc1Oc1ccccc1-c1nnn[n-]1 ZINC000822753295 607256043 /nfs/dbraw/zinc/25/60/43/607256043.db2.gz LYDRSLPEZGSFOP-CYBMUJFWSA-N -1 3 369.400 3.637 20 0 FHADHM Fc1cc(NC[C@H]2CCCOC2)ccc1Oc1ccccc1-c1nn[n-]n1 ZINC000822753295 607256044 /nfs/dbraw/zinc/25/60/44/607256044.db2.gz LYDRSLPEZGSFOP-CYBMUJFWSA-N -1 3 369.400 3.637 20 0 FHADHM CC[C@H](Nc1c(F)cc(-c2nnn[n-]2)cc1F)c1cc(F)ccc1F ZINC000736369438 598975148 /nfs/dbraw/zinc/97/51/48/598975148.db2.gz MQEHTKHPXBVXFV-AWEZNQCLSA-N -1 3 351.307 3.986 20 0 FHADHM CC[C@H](Nc1c(F)cc(-c2nn[n-]n2)cc1F)c1cc(F)ccc1F ZINC000736369438 598975150 /nfs/dbraw/zinc/97/51/50/598975150.db2.gz MQEHTKHPXBVXFV-AWEZNQCLSA-N -1 3 351.307 3.986 20 0 FHADHM FC(F)(F)CCNc1cccc(OCc2cccc(-c3nnn[n-]3)c2)c1 ZINC000737626720 598979974 /nfs/dbraw/zinc/97/99/74/598979974.db2.gz JRAFGHHZASPXMR-UHFFFAOYSA-N -1 3 363.343 3.810 20 0 FHADHM FC(F)(F)CCNc1cccc(OCc2cccc(-c3nn[n-]n3)c2)c1 ZINC000737626720 598979975 /nfs/dbraw/zinc/97/99/75/598979975.db2.gz JRAFGHHZASPXMR-UHFFFAOYSA-N -1 3 363.343 3.810 20 0 FHADHM C[C@H](Nc1ccc(F)cc1OCC1CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736139749 599009125 /nfs/dbraw/zinc/00/91/25/599009125.db2.gz QVLKJYPBVIPEFT-LBPRGKRZSA-N -1 3 353.401 3.968 20 0 FHADHM C[C@H](Nc1ccc(F)cc1OCC1CC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736139749 599009127 /nfs/dbraw/zinc/00/91/27/599009127.db2.gz QVLKJYPBVIPEFT-LBPRGKRZSA-N -1 3 353.401 3.968 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H]1CCC[C@@H](CC)C1 ZINC000736482146 599013903 /nfs/dbraw/zinc/01/39/03/599013903.db2.gz VHXVEKHCNLTTGS-CRAIPNDOSA-N -1 3 370.501 3.757 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H]1CCC[C@@H](CC)C1 ZINC000736482146 599013905 /nfs/dbraw/zinc/01/39/05/599013905.db2.gz VHXVEKHCNLTTGS-CRAIPNDOSA-N -1 3 370.501 3.757 20 0 FHADHM CC[C@H]1CCC[C@@H](NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)C1 ZINC000736398239 599023619 /nfs/dbraw/zinc/02/36/19/599023619.db2.gz ZUCVPAJQXFDHMA-WMLDXEAASA-N -1 3 368.485 3.510 20 0 FHADHM CC[C@H]1CCC[C@@H](NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)C1 ZINC000736398239 599023621 /nfs/dbraw/zinc/02/36/21/599023621.db2.gz ZUCVPAJQXFDHMA-WMLDXEAASA-N -1 3 368.485 3.510 20 0 FHADHM Cc1c(NCc2ncc(-c3ccccc3F)o2)cccc1-c1nnn[n-]1 ZINC000822122718 607257675 /nfs/dbraw/zinc/25/76/75/607257675.db2.gz PMUSABJVSQCULD-UHFFFAOYSA-N -1 3 350.357 3.581 20 0 FHADHM Cc1c(NCc2ncc(-c3ccccc3F)o2)cccc1-c1nn[n-]n1 ZINC000822122718 607257676 /nfs/dbraw/zinc/25/76/76/607257676.db2.gz PMUSABJVSQCULD-UHFFFAOYSA-N -1 3 350.357 3.581 20 0 FHADHM C[C@H]1CN(c2cc(Cl)ccc2-c2nnn[n-]2)C[C@@H](c2ccc(F)cc2)O1 ZINC000820769685 599035336 /nfs/dbraw/zinc/03/53/36/599035336.db2.gz VPRNXLOABAUZSY-GTNSWQLSSA-N -1 3 373.819 3.626 20 0 FHADHM C[C@H]1CN(c2cc(Cl)ccc2-c2nn[n-]n2)C[C@@H](c2ccc(F)cc2)O1 ZINC000820769685 599035339 /nfs/dbraw/zinc/03/53/39/599035339.db2.gz VPRNXLOABAUZSY-GTNSWQLSSA-N -1 3 373.819 3.626 20 0 FHADHM C[C@H]1CN(c2ccc(-c3nnn[n-]3)c(Cl)c2)C[C@H](c2ccc(F)cc2)O1 ZINC000820767341 599038827 /nfs/dbraw/zinc/03/88/27/599038827.db2.gz IGZRNFZCPIRMJZ-APPDUMDISA-N -1 3 373.819 3.626 20 0 FHADHM C[C@H]1CN(c2ccc(-c3nn[n-]n3)c(Cl)c2)C[C@H](c2ccc(F)cc2)O1 ZINC000820767341 599038829 /nfs/dbraw/zinc/03/88/29/599038829.db2.gz IGZRNFZCPIRMJZ-APPDUMDISA-N -1 3 373.819 3.626 20 0 FHADHM Fc1cc(Cl)ccc1Oc1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000737643912 599039870 /nfs/dbraw/zinc/03/98/70/599039870.db2.gz HTQMVFQGVVECKD-UHFFFAOYSA-N -1 3 359.670 3.865 20 0 FHADHM Fc1ccc(F)c(Sc2nc(C(F)(F)F)ccc2-c2nnn[n-]2)c1 ZINC000737658125 599040576 /nfs/dbraw/zinc/04/05/76/599040576.db2.gz CXFGOURBDBYBKK-UHFFFAOYSA-N -1 3 359.283 3.710 20 0 FHADHM Fc1ccc(F)c(Sc2nc(C(F)(F)F)ccc2-c2nn[n-]n2)c1 ZINC000737658125 599040579 /nfs/dbraw/zinc/04/05/79/599040579.db2.gz CXFGOURBDBYBKK-UHFFFAOYSA-N -1 3 359.283 3.710 20 0 FHADHM C[C@@H](Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1)c1cc(F)ccc1F ZINC000736138757 599043641 /nfs/dbraw/zinc/04/36/41/599043641.db2.gz RFQUETSBIRTQHQ-SSDOTTSWSA-N -1 3 370.285 3.732 20 0 FHADHM C[C@@H](Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1)c1cc(F)ccc1F ZINC000736138757 599043643 /nfs/dbraw/zinc/04/36/43/599043643.db2.gz RFQUETSBIRTQHQ-SSDOTTSWSA-N -1 3 370.285 3.732 20 0 FHADHM C[C@@H]1C[C@@H]1c1ccc(CNc2nc(C(F)(F)F)ccc2-c2nnn[n-]2)o1 ZINC000736239914 599045589 /nfs/dbraw/zinc/04/55/89/599045589.db2.gz UTLJHRIDKYCIIC-KCJUWKMLSA-N -1 3 364.331 3.609 20 0 FHADHM C[C@@H]1C[C@@H]1c1ccc(CNc2nc(C(F)(F)F)ccc2-c2nn[n-]n2)o1 ZINC000736239914 599045591 /nfs/dbraw/zinc/04/55/91/599045591.db2.gz UTLJHRIDKYCIIC-KCJUWKMLSA-N -1 3 364.331 3.609 20 0 FHADHM Cc1ccccc1C1(CNc2nc(C(F)(F)F)ccc2-c2nnn[n-]2)CC1 ZINC000737422876 599051226 /nfs/dbraw/zinc/05/12/26/599051226.db2.gz SLOPOWJPLDZJJS-UHFFFAOYSA-N -1 3 374.370 3.733 20 0 FHADHM Cc1ccccc1C1(CNc2nc(C(F)(F)F)ccc2-c2nn[n-]n2)CC1 ZINC000737422876 599051228 /nfs/dbraw/zinc/05/12/28/599051228.db2.gz SLOPOWJPLDZJJS-UHFFFAOYSA-N -1 3 374.370 3.733 20 0 FHADHM Fc1ccc2c(c1)[C@H](Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1)CC2 ZINC000737667924 599055247 /nfs/dbraw/zinc/05/52/47/599055247.db2.gz RXAQMRNUFWLTJG-GFCCVEGCSA-N -1 3 364.306 3.519 20 0 FHADHM Fc1ccc2c(c1)[C@H](Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1)CC2 ZINC000737667924 599055250 /nfs/dbraw/zinc/05/52/50/599055250.db2.gz RXAQMRNUFWLTJG-GFCCVEGCSA-N -1 3 364.306 3.519 20 0 FHADHM Cc1cccc(O[C@@H](C)CNc2cc(-c3nnn[n-]3)c3ccccc3n2)c1 ZINC000822328429 599057506 /nfs/dbraw/zinc/05/75/06/599057506.db2.gz PUMFQMDGTGYKOA-AWEZNQCLSA-N -1 3 360.421 3.603 20 0 FHADHM Cc1cccc(O[C@@H](C)CNc2cc(-c3nn[n-]n3)c3ccccc3n2)c1 ZINC000822328429 599057509 /nfs/dbraw/zinc/05/75/09/599057509.db2.gz PUMFQMDGTGYKOA-AWEZNQCLSA-N -1 3 360.421 3.603 20 0 FHADHM CC(C)[C@@H]1CCCN(c2nc(C(F)(F)F)ccc2-c2nnn[n-]2)CC1 ZINC000735748059 599058500 /nfs/dbraw/zinc/05/85/00/599058500.db2.gz HAQMWOQTJNYJNE-LLVKDONJSA-N -1 3 354.380 3.543 20 0 FHADHM CC(C)[C@@H]1CCCN(c2nc(C(F)(F)F)ccc2-c2nn[n-]n2)CC1 ZINC000735748059 599058503 /nfs/dbraw/zinc/05/85/03/599058503.db2.gz HAQMWOQTJNYJNE-LLVKDONJSA-N -1 3 354.380 3.543 20 0 FHADHM C[C@H]1C[C@@H](c2cccc(F)c2)N(c2ncc(-c3nnn[n-]3)cc2Cl)C1 ZINC000820667621 599060347 /nfs/dbraw/zinc/06/03/47/599060347.db2.gz NCPCMANPEFDECM-BONVTDFDSA-N -1 3 358.808 3.642 20 0 FHADHM C[C@H]1C[C@@H](c2cccc(F)c2)N(c2ncc(-c3nn[n-]n3)cc2Cl)C1 ZINC000820667621 599060350 /nfs/dbraw/zinc/06/03/50/599060350.db2.gz NCPCMANPEFDECM-BONVTDFDSA-N -1 3 358.808 3.642 20 0 FHADHM C[C@H](Sc1ccc(-c2nnn[n-]2)cc1F)c1nc(-c2cccs2)no1 ZINC000736193695 599065267 /nfs/dbraw/zinc/06/52/67/599065267.db2.gz RTBYYTBNMVJWCU-QMMMGPOBSA-N -1 3 374.426 3.971 20 0 FHADHM C[C@H](Sc1ccc(-c2nn[n-]n2)cc1F)c1nc(-c2cccs2)no1 ZINC000736193695 599065270 /nfs/dbraw/zinc/06/52/70/599065270.db2.gz RTBYYTBNMVJWCU-QMMMGPOBSA-N -1 3 374.426 3.971 20 0 FHADHM CCn1c(CSc2ccc(-c3nnn[n-]3)cc2F)nc2c1cccc2F ZINC000736714146 599066287 /nfs/dbraw/zinc/06/62/87/599066287.db2.gz ODQUSTNSMIFZMD-UHFFFAOYSA-N -1 3 372.404 3.807 20 0 FHADHM CCn1c(CSc2ccc(-c3nn[n-]n3)cc2F)nc2c1cccc2F ZINC000736714146 599066290 /nfs/dbraw/zinc/06/62/90/599066290.db2.gz ODQUSTNSMIFZMD-UHFFFAOYSA-N -1 3 372.404 3.807 20 0 FHADHM Fc1cccc(-n2ccc(CSc3ccc(-c4nnn[n-]4)cc3F)n2)c1 ZINC000737667845 599066596 /nfs/dbraw/zinc/06/65/96/599066596.db2.gz RGGHAVNGAKXQEJ-UHFFFAOYSA-N -1 3 370.388 3.623 20 0 FHADHM Fc1cccc(-n2ccc(CSc3ccc(-c4nn[n-]n4)cc3F)n2)c1 ZINC000737667845 599066598 /nfs/dbraw/zinc/06/65/98/599066598.db2.gz RGGHAVNGAKXQEJ-UHFFFAOYSA-N -1 3 370.388 3.623 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)cc1CNc1ncc(C(F)(F)F)cc1Cl ZINC000822761392 599070297 /nfs/dbraw/zinc/07/02/97/599070297.db2.gz LFKIPTOIIAUVAI-UHFFFAOYSA-N -1 3 372.713 3.685 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CNc1ncc(C(F)(F)F)cc1Cl ZINC000822761392 599070300 /nfs/dbraw/zinc/07/03/00/599070300.db2.gz LFKIPTOIIAUVAI-UHFFFAOYSA-N -1 3 372.713 3.685 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)C1CCCCCCC1 ZINC000735873458 599070461 /nfs/dbraw/zinc/07/04/61/599070461.db2.gz ACRPDEQDBMMDKV-UHFFFAOYSA-N -1 3 355.486 3.964 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)C1CCCCCCC1 ZINC000735873458 599070464 /nfs/dbraw/zinc/07/04/64/599070464.db2.gz ACRPDEQDBMMDKV-UHFFFAOYSA-N -1 3 355.486 3.964 20 0 FHADHM CCN(C(=O)[C@@H]1C[C@@H]1C1CCCCC1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736503457 599070482 /nfs/dbraw/zinc/07/04/82/599070482.db2.gz XCASBCPPFYAFEG-NIKGAXFTSA-N -1 3 367.497 3.993 20 0 FHADHM CCN(C(=O)[C@@H]1C[C@@H]1C1CCCCC1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736503457 599070485 /nfs/dbraw/zinc/07/04/85/599070485.db2.gz XCASBCPPFYAFEG-NIKGAXFTSA-N -1 3 367.497 3.993 20 0 FHADHM C[C@H](NC(=O)CCCCOc1cccc(-c2nnn[n-]2)c1)C1CCCCC1 ZINC000736104085 599079039 /nfs/dbraw/zinc/07/90/39/599079039.db2.gz ZEAXNFBXXZZJRL-HNNXBMFYSA-N -1 3 371.485 3.501 20 0 FHADHM C[C@H](NC(=O)CCCCOc1cccc(-c2nn[n-]n2)c1)C1CCCCC1 ZINC000736104085 599079042 /nfs/dbraw/zinc/07/90/42/599079042.db2.gz ZEAXNFBXXZZJRL-HNNXBMFYSA-N -1 3 371.485 3.501 20 0 FHADHM FC(F)(F)Cc1cccc(Nc2ncc(-c3nnn[n-]3)cc2Cl)c1 ZINC000822718733 599085793 /nfs/dbraw/zinc/08/57/93/599085793.db2.gz QIFFVEPRAVOGSU-UHFFFAOYSA-N -1 3 354.723 3.764 20 0 FHADHM FC(F)(F)Cc1cccc(Nc2ncc(-c3nn[n-]n3)cc2Cl)c1 ZINC000822718733 599085796 /nfs/dbraw/zinc/08/57/96/599085796.db2.gz QIFFVEPRAVOGSU-UHFFFAOYSA-N -1 3 354.723 3.764 20 0 FHADHM Cc1cccc([C@@H]2CCCN2C(=O)C=Cc2ccccc2-c2nnn[n-]2)c1C ZINC000737389616 599103326 /nfs/dbraw/zinc/10/33/26/599103326.db2.gz LKBMHDWFCJHKAT-CBUFDYBVSA-N -1 3 373.460 3.860 20 0 FHADHM Cc1cccc([C@@H]2CCCN2C(=O)C=Cc2ccccc2-c2nn[n-]n2)c1C ZINC000737389616 599103328 /nfs/dbraw/zinc/10/33/28/599103328.db2.gz LKBMHDWFCJHKAT-CBUFDYBVSA-N -1 3 373.460 3.860 20 0 FHADHM Cc1cccc([C@@H]2CCCN2C(=O)C=Cc2ccccc2-c2nnn[n-]2)c1C ZINC000737389619 599103456 /nfs/dbraw/zinc/10/34/56/599103456.db2.gz LKBMHDWFCJHKAT-SJFMBGHLSA-N -1 3 373.460 3.860 20 0 FHADHM Cc1cccc([C@@H]2CCCN2C(=O)C=Cc2ccccc2-c2nn[n-]n2)c1C ZINC000737389619 599103459 /nfs/dbraw/zinc/10/34/59/599103459.db2.gz LKBMHDWFCJHKAT-SJFMBGHLSA-N -1 3 373.460 3.860 20 0 FHADHM Cc1cccc([C@@H](C)NC(=O)N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1C ZINC000737390262 599105097 /nfs/dbraw/zinc/10/50/97/599105097.db2.gz RXWCQOOVFPGGIO-LSDHHAIUSA-N -1 3 364.453 3.605 20 0 FHADHM Cc1cccc([C@@H](C)NC(=O)N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1C ZINC000737390262 599105099 /nfs/dbraw/zinc/10/50/99/599105099.db2.gz RXWCQOOVFPGGIO-LSDHHAIUSA-N -1 3 364.453 3.605 20 0 FHADHM Cc1ccnc(Nc2ccc(Oc3ccccc3-c3nnn[n-]3)c(F)c2)n1 ZINC000822378797 599111581 /nfs/dbraw/zinc/11/15/81/599111581.db2.gz DWVDJWRJRKZYQI-UHFFFAOYSA-N -1 3 363.356 3.640 20 0 FHADHM Cc1ccnc(Nc2ccc(Oc3ccccc3-c3nn[n-]n3)c(F)c2)n1 ZINC000822378797 599111584 /nfs/dbraw/zinc/11/15/84/599111584.db2.gz DWVDJWRJRKZYQI-UHFFFAOYSA-N -1 3 363.356 3.640 20 0 FHADHM COC(=O)[C@H](Sc1ccc(C(C)C)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736900934 599112618 /nfs/dbraw/zinc/11/26/18/599112618.db2.gz GYXZAOZAZDQKMR-QGZVFWFLSA-N -1 3 368.462 3.997 20 0 FHADHM COC(=O)[C@H](Sc1ccc(C(C)C)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736900934 599112620 /nfs/dbraw/zinc/11/26/20/599112620.db2.gz GYXZAOZAZDQKMR-QGZVFWFLSA-N -1 3 368.462 3.997 20 0 FHADHM CCO[C@@H]1C[C@H](Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)C12CCC2 ZINC000736611642 599120093 /nfs/dbraw/zinc/12/00/93/599120093.db2.gz JYIDDQCTGFPLHD-UONOGXRCSA-N -1 3 367.375 3.645 20 0 FHADHM CCO[C@@H]1C[C@H](Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)C12CCC2 ZINC000736611642 599120095 /nfs/dbraw/zinc/12/00/95/599120095.db2.gz JYIDDQCTGFPLHD-UONOGXRCSA-N -1 3 367.375 3.645 20 0 FHADHM Cc1cc(F)ccc1N(Cc1ccc(-c2nnn[n-]2)cc1)Cc1ccccn1 ZINC000737270718 599133299 /nfs/dbraw/zinc/13/32/99/599133299.db2.gz PDTNNXPPAFYRLS-UHFFFAOYSA-N -1 3 374.423 3.916 20 0 FHADHM Cc1cc(F)ccc1N(Cc1ccc(-c2nn[n-]n2)cc1)Cc1ccccn1 ZINC000737270718 599133300 /nfs/dbraw/zinc/13/33/00/599133300.db2.gz PDTNNXPPAFYRLS-UHFFFAOYSA-N -1 3 374.423 3.916 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1CNc1cccc(Oc2ccccn2)c1 ZINC000822743711 599133748 /nfs/dbraw/zinc/13/37/48/599133748.db2.gz FDLFBBXUXPPLGE-UHFFFAOYSA-N -1 3 362.368 3.805 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CNc1cccc(Oc2ccccn2)c1 ZINC000822743711 599133749 /nfs/dbraw/zinc/13/37/49/599133749.db2.gz FDLFBBXUXPPLGE-UHFFFAOYSA-N -1 3 362.368 3.805 20 0 FHADHM Cc1cc2cc(C(=O)N(C)Cc3cccc(-c4nnn[n-]4)c3)oc2cc1C ZINC000822212827 599140495 /nfs/dbraw/zinc/14/04/95/599140495.db2.gz IRCBNVHYUDEIOY-UHFFFAOYSA-N -1 3 361.405 3.502 20 0 FHADHM Cc1cc2cc(C(=O)N(C)Cc3cccc(-c4nn[n-]n4)c3)oc2cc1C ZINC000822212827 599140497 /nfs/dbraw/zinc/14/04/97/599140497.db2.gz IRCBNVHYUDEIOY-UHFFFAOYSA-N -1 3 361.405 3.502 20 0 FHADHM O=C(CC1CCC1)Nc1cccc(OCc2cccc(-c3nnn[n-]3)c2)c1 ZINC000822940986 599142740 /nfs/dbraw/zinc/14/27/40/599142740.db2.gz LZOUZYHQTGTICC-UHFFFAOYSA-N -1 3 363.421 3.574 20 0 FHADHM O=C(CC1CCC1)Nc1cccc(OCc2cccc(-c3nn[n-]n3)c2)c1 ZINC000822940986 599142741 /nfs/dbraw/zinc/14/27/41/599142741.db2.gz LZOUZYHQTGTICC-UHFFFAOYSA-N -1 3 363.421 3.574 20 0 FHADHM Cc1cccc([C@@H](C)NC(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)c1C ZINC000737386298 599147664 /nfs/dbraw/zinc/14/76/64/599147664.db2.gz BOHLHVCNQKOUSL-GFCCVEGCSA-N -1 3 354.389 3.505 20 0 FHADHM Cc1cccc([C@@H](C)NC(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)c1C ZINC000737386298 599147666 /nfs/dbraw/zinc/14/76/66/599147666.db2.gz BOHLHVCNQKOUSL-GFCCVEGCSA-N -1 3 354.389 3.505 20 0 FHADHM CCCCC[C@H](C)CC(=O)Nc1ccnn1-c1ccc(-c2nn[n-]n2)cc1 ZINC000821049705 599153581 /nfs/dbraw/zinc/15/35/81/599153581.db2.gz NABDFAVROCUDRG-AWEZNQCLSA-N -1 3 367.457 3.597 20 0 FHADHM Cc1ccccc1[C@@H](C)CC(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2 ZINC000737424676 599158851 /nfs/dbraw/zinc/15/88/51/599158851.db2.gz WQNYSRCPEQCFCQ-LBPRGKRZSA-N -1 3 367.478 3.858 20 0 FHADHM Cc1ccccc1[C@@H](C)CC(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2 ZINC000737424676 599158853 /nfs/dbraw/zinc/15/88/53/599158853.db2.gz WQNYSRCPEQCFCQ-LBPRGKRZSA-N -1 3 367.478 3.858 20 0 FHADHM CC(C)n1ncc2cc(CSc3ccc(-c4nnn[n-]4)cc3F)cnc21 ZINC000735963373 599168678 /nfs/dbraw/zinc/16/86/78/599168678.db2.gz FOCWJRDMIVNTSM-UHFFFAOYSA-N -1 3 369.429 3.624 20 0 FHADHM CC(C)n1ncc2cc(CSc3ccc(-c4nn[n-]n4)cc3F)cnc21 ZINC000735963373 599168679 /nfs/dbraw/zinc/16/86/79/599168679.db2.gz FOCWJRDMIVNTSM-UHFFFAOYSA-N -1 3 369.429 3.624 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)c2cc3cccc(F)c3o2)s1 ZINC000736679392 599184764 /nfs/dbraw/zinc/18/47/64/599184764.db2.gz SNRVMNNXXQEJPL-UHFFFAOYSA-N -1 3 357.370 3.628 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)c2cc3cccc(F)c3o2)s1 ZINC000736679392 599184766 /nfs/dbraw/zinc/18/47/66/599184766.db2.gz SNRVMNNXXQEJPL-UHFFFAOYSA-N -1 3 357.370 3.628 20 0 FHADHM CCN(C(=O)[C@H](C)c1cccc(F)c1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736503356 599182657 /nfs/dbraw/zinc/18/26/57/599182657.db2.gz VPOSXCUOUZCBGA-ZIAGYGMSSA-N -1 3 367.428 3.719 20 0 FHADHM CCN(C(=O)[C@H](C)c1cccc(F)c1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736503356 599182660 /nfs/dbraw/zinc/18/26/60/599182660.db2.gz VPOSXCUOUZCBGA-ZIAGYGMSSA-N -1 3 367.428 3.719 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CCC[C@@H](C(C)(C)C)CC1 ZINC000737290111 599188027 /nfs/dbraw/zinc/18/80/27/599188027.db2.gz BNVYAKVZPDLNRB-OAHLLOKOSA-N -1 3 356.474 3.855 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CCC[C@@H](C(C)(C)C)CC1 ZINC000737290111 599188029 /nfs/dbraw/zinc/18/80/29/599188029.db2.gz BNVYAKVZPDLNRB-OAHLLOKOSA-N -1 3 356.474 3.855 20 0 FHADHM Cc1ccccc1[C@H](C)CC(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000737420346 599190779 /nfs/dbraw/zinc/19/07/79/599190779.db2.gz IGZIQDFAQAKIKG-CABCVRRESA-N -1 3 350.422 3.973 20 0 FHADHM Cc1ccccc1[C@H](C)CC(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000737420346 599190783 /nfs/dbraw/zinc/19/07/83/599190783.db2.gz IGZIQDFAQAKIKG-CABCVRRESA-N -1 3 350.422 3.973 20 0 FHADHM CCC[C@@H]1[C@H](C)CCCN1C(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000821034310 599192675 /nfs/dbraw/zinc/19/26/75/599192675.db2.gz KKVYNOGGCCDBBL-RHSMWYFYSA-N -1 3 373.526 3.527 20 0 FHADHM CCC[C@@H]1[C@H](C)CCCN1C(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000821034310 599192676 /nfs/dbraw/zinc/19/26/76/599192676.db2.gz KKVYNOGGCCDBBL-RHSMWYFYSA-N -1 3 373.526 3.527 20 0 FHADHM C[C@@H]1C[C@@H]1C(=O)N(Cc1ccc(Cl)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000736235294 599208826 /nfs/dbraw/zinc/20/88/26/599208826.db2.gz MYONNGJIGPHPLV-PXAZEXFGSA-N -1 3 367.840 3.709 20 0 FHADHM C[C@@H]1C[C@@H]1C(=O)N(Cc1ccc(Cl)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000736235294 599208827 /nfs/dbraw/zinc/20/88/27/599208827.db2.gz MYONNGJIGPHPLV-PXAZEXFGSA-N -1 3 367.840 3.709 20 0 FHADHM O=C(C1CCC1)N(Cc1ccc(Cl)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000737785500 599210999 /nfs/dbraw/zinc/21/09/99/599210999.db2.gz PYBIIDZRRKFHCT-UHFFFAOYSA-N -1 3 367.840 3.853 20 0 FHADHM O=C(C1CCC1)N(Cc1ccc(Cl)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000737785500 599211002 /nfs/dbraw/zinc/21/10/02/599211002.db2.gz PYBIIDZRRKFHCT-UHFFFAOYSA-N -1 3 367.840 3.853 20 0 FHADHM CC(C)=CC(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1 ZINC000820005351 599217830 /nfs/dbraw/zinc/21/78/30/599217830.db2.gz OFHJQRSBOKGTKR-UHFFFAOYSA-N -1 3 353.357 3.703 20 0 FHADHM CC(C)=CC(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1 ZINC000820005351 599217832 /nfs/dbraw/zinc/21/78/32/599217832.db2.gz OFHJQRSBOKGTKR-UHFFFAOYSA-N -1 3 353.357 3.703 20 0 FHADHM COc1cccc(CCCSCCOc2cccc(-c3nnn[n-]3)c2)c1 ZINC000821867275 599223111 /nfs/dbraw/zinc/22/31/11/599223111.db2.gz AKOSWEUCKKHNCG-UHFFFAOYSA-N -1 3 370.478 3.620 20 0 FHADHM COc1cccc(CCCSCCOc2cccc(-c3nn[n-]n3)c2)c1 ZINC000821867275 599223114 /nfs/dbraw/zinc/22/31/14/599223114.db2.gz AKOSWEUCKKHNCG-UHFFFAOYSA-N -1 3 370.478 3.620 20 0 FHADHM O=C(c1ccccc1-c1ccccc1-c1nnn[n-]1)N1CCC[C@H]2CCC[C@@H]21 ZINC000738277897 599226202 /nfs/dbraw/zinc/22/62/02/599226202.db2.gz HAUOPFHGVMWRST-QRWLVFNGSA-N -1 3 373.460 3.938 20 0 FHADHM O=C(c1ccccc1-c1ccccc1-c1nn[n-]n1)N1CCC[C@H]2CCC[C@@H]21 ZINC000738277897 599226204 /nfs/dbraw/zinc/22/62/04/599226204.db2.gz HAUOPFHGVMWRST-QRWLVFNGSA-N -1 3 373.460 3.938 20 0 FHADHM CC(C)c1cccc(NC(=S)NCc2cc(-c3nnn[n-]3)ccc2F)c1 ZINC000820198276 599227248 /nfs/dbraw/zinc/22/72/48/599227248.db2.gz UJOQWOCIYKFQJJ-UHFFFAOYSA-N -1 3 370.457 3.616 20 0 FHADHM CC(C)c1cccc(NC(=S)NCc2cc(-c3nn[n-]n3)ccc2F)c1 ZINC000820198276 599227250 /nfs/dbraw/zinc/22/72/50/599227250.db2.gz UJOQWOCIYKFQJJ-UHFFFAOYSA-N -1 3 370.457 3.616 20 0 FHADHM CC[C@@H](C)C[C@H](C)NC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820870540 599227918 /nfs/dbraw/zinc/22/79/18/599227918.db2.gz URDNYLQVDCJOLL-ZJUUUORDSA-N -1 3 352.895 3.631 20 0 FHADHM CC[C@@H](C)C[C@H](C)NC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820870540 599227921 /nfs/dbraw/zinc/22/79/21/599227921.db2.gz URDNYLQVDCJOLL-ZJUUUORDSA-N -1 3 352.895 3.631 20 0 FHADHM C[C@@H]1CCN(C(=S)Nc2ccccc2-c2nnn[n-]2)[C@@H](c2ccco2)C1 ZINC000820715956 599238445 /nfs/dbraw/zinc/23/84/45/599238445.db2.gz GFDPUPJFNJFOID-IUODEOHRSA-N -1 3 368.466 3.630 20 0 FHADHM C[C@@H]1CCN(C(=S)Nc2ccccc2-c2nn[n-]n2)[C@@H](c2ccco2)C1 ZINC000820715956 599238447 /nfs/dbraw/zinc/23/84/47/599238447.db2.gz GFDPUPJFNJFOID-IUODEOHRSA-N -1 3 368.466 3.630 20 0 FHADHM Cc1c2cccc(F)c2oc1C(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000822115536 607267566 /nfs/dbraw/zinc/26/75/66/607267566.db2.gz FNAGSTFCTCTESM-UHFFFAOYSA-N -1 3 351.341 3.621 20 0 FHADHM Cc1c2cccc(F)c2oc1C(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000822115536 607267567 /nfs/dbraw/zinc/26/75/67/607267567.db2.gz FNAGSTFCTCTESM-UHFFFAOYSA-N -1 3 351.341 3.621 20 0 FHADHM Cc1cccc(-c2cncc(C(=O)Nc3cccc(-c4nnn[n-]4)c3C)c2)c1 ZINC000822284206 607267729 /nfs/dbraw/zinc/26/77/29/607267729.db2.gz MAWJPWWPGKJQKE-UHFFFAOYSA-N -1 3 370.416 3.798 20 0 FHADHM Cc1cccc(-c2cncc(C(=O)Nc3cccc(-c4nn[n-]n4)c3C)c2)c1 ZINC000822284206 607267730 /nfs/dbraw/zinc/26/77/30/607267730.db2.gz MAWJPWWPGKJQKE-UHFFFAOYSA-N -1 3 370.416 3.798 20 0 FHADHM Cc1sc(NC(=O)C(C)(C)Cc2ccccc2)c(-c2nnn[n-]2)c1C ZINC000737560360 599246350 /nfs/dbraw/zinc/24/63/50/599246350.db2.gz GEUCKEAPTDSSKP-UHFFFAOYSA-N -1 3 355.467 3.752 20 0 FHADHM Cc1sc(NC(=O)C(C)(C)Cc2ccccc2)c(-c2nn[n-]n2)c1C ZINC000737560360 599246352 /nfs/dbraw/zinc/24/63/52/599246352.db2.gz GEUCKEAPTDSSKP-UHFFFAOYSA-N -1 3 355.467 3.752 20 0 FHADHM Cc1c(NC(=O)N(Cc2cccc(F)c2)C2CC2)cccc1-c1nnn[n-]1 ZINC000822084512 607282955 /nfs/dbraw/zinc/28/29/55/607282955.db2.gz LNCHUSZRZKEKHP-UHFFFAOYSA-N -1 3 366.400 3.511 20 0 FHADHM Cc1c(NC(=O)N(Cc2cccc(F)c2)C2CC2)cccc1-c1nn[n-]n1 ZINC000822084512 607282956 /nfs/dbraw/zinc/28/29/56/607282956.db2.gz LNCHUSZRZKEKHP-UHFFFAOYSA-N -1 3 366.400 3.511 20 0 FHADHM Cc1c(NC(=O)N[C@@H](c2ccco2)c2ccccc2)cccc1-c1nnn[n-]1 ZINC000822091034 607280690 /nfs/dbraw/zinc/28/06/90/607280690.db2.gz NAWIFKJGNKOEFJ-GOSISDBHSA-N -1 3 374.404 3.679 20 0 FHADHM Cc1c(NC(=O)N[C@@H](c2ccco2)c2ccccc2)cccc1-c1nn[n-]n1 ZINC000822091034 607280691 /nfs/dbraw/zinc/28/06/91/607280691.db2.gz NAWIFKJGNKOEFJ-GOSISDBHSA-N -1 3 374.404 3.679 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@H]2c2cccc(F)c2)cccc1-c1nnn[n-]1 ZINC000822084942 607281386 /nfs/dbraw/zinc/28/13/86/607281386.db2.gz SZKTURIJQILMHT-KRWDZBQOSA-N -1 3 366.400 3.683 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@H]2c2cccc(F)c2)cccc1-c1nn[n-]n1 ZINC000822084942 607281387 /nfs/dbraw/zinc/28/13/87/607281387.db2.gz SZKTURIJQILMHT-KRWDZBQOSA-N -1 3 366.400 3.683 20 0 FHADHM CCCOc1cccc(NC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000821138549 599252259 /nfs/dbraw/zinc/25/22/59/599252259.db2.gz BAJLDGWXAKNOJZ-CYBMUJFWSA-N -1 3 366.425 3.538 20 0 FHADHM CCCOc1cccc(NC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000821138549 599252263 /nfs/dbraw/zinc/25/22/63/599252263.db2.gz BAJLDGWXAKNOJZ-CYBMUJFWSA-N -1 3 366.425 3.538 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@@H]2c2cccc(F)c2)cccc1-c1nnn[n-]1 ZINC000822084943 607281644 /nfs/dbraw/zinc/28/16/44/607281644.db2.gz SZKTURIJQILMHT-QGZVFWFLSA-N -1 3 366.400 3.683 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@@H]2c2cccc(F)c2)cccc1-c1nn[n-]n1 ZINC000822084943 607281645 /nfs/dbraw/zinc/28/16/45/607281645.db2.gz SZKTURIJQILMHT-QGZVFWFLSA-N -1 3 366.400 3.683 20 0 FHADHM Cc1c(NC(=O)N2CC[C@H](c3ccccc3)[C@H]2C)cccc1-c1nnn[n-]1 ZINC000822084905 607288104 /nfs/dbraw/zinc/28/81/04/607288104.db2.gz RVCUWGJOAMZYOA-PBHICJAKSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1c(NC(=O)N2CC[C@H](c3ccccc3)[C@H]2C)cccc1-c1nn[n-]n1 ZINC000822084905 607288105 /nfs/dbraw/zinc/28/81/05/607288105.db2.gz RVCUWGJOAMZYOA-PBHICJAKSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1c(NC(=O)N[C@@H](C)c2c(F)cccc2Cl)cccc1-c1nnn[n-]1 ZINC000822092714 607288404 /nfs/dbraw/zinc/28/84/04/607288404.db2.gz YRGIKTGGXZXXCM-JTQLQIEISA-N -1 3 374.807 3.850 20 0 FHADHM Cc1c(NC(=O)N[C@@H](C)c2c(F)cccc2Cl)cccc1-c1nn[n-]n1 ZINC000822092714 607288405 /nfs/dbraw/zinc/28/84/05/607288405.db2.gz YRGIKTGGXZXXCM-JTQLQIEISA-N -1 3 374.807 3.850 20 0 FHADHM Cc1nc2ccccc2n1CCCNc1cccc(Cl)c1-c1nnn[n-]1 ZINC000822463446 599255695 /nfs/dbraw/zinc/25/56/95/599255695.db2.gz SBSBCOKTILCCLX-UHFFFAOYSA-N -1 3 367.844 3.680 20 0 FHADHM Cc1nc2ccccc2n1CCCNc1cccc(Cl)c1-c1nn[n-]n1 ZINC000822463446 599255696 /nfs/dbraw/zinc/25/56/96/599255696.db2.gz SBSBCOKTILCCLX-UHFFFAOYSA-N -1 3 367.844 3.680 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)Nc2cccc(-c3nnn[n-]3)c2C)cc1C ZINC000822229354 607286877 /nfs/dbraw/zinc/28/68/77/607286877.db2.gz SCUNKMZCANAFQM-AWEZNQCLSA-N -1 3 350.426 3.675 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)Nc2cccc(-c3nn[n-]n3)c2C)cc1C ZINC000822229354 607286878 /nfs/dbraw/zinc/28/68/78/607286878.db2.gz SCUNKMZCANAFQM-AWEZNQCLSA-N -1 3 350.426 3.675 20 0 FHADHM Cc1c(NC(=O)N[C@H]2CCc3c2cccc3Cl)cccc1-c1nnn[n-]1 ZINC000822092657 607289330 /nfs/dbraw/zinc/28/93/30/607289330.db2.gz YGDHSLAIQNEMFZ-INIZCTEOSA-N -1 3 368.828 3.638 20 0 FHADHM Cc1c(NC(=O)N[C@H]2CCc3c2cccc3Cl)cccc1-c1nn[n-]n1 ZINC000822092657 607289331 /nfs/dbraw/zinc/28/93/31/607289331.db2.gz YGDHSLAIQNEMFZ-INIZCTEOSA-N -1 3 368.828 3.638 20 0 FHADHM Cc1cccc([C@@H]2CCCCCN2C(=O)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000737391093 599262607 /nfs/dbraw/zinc/26/26/07/599262607.db2.gz XVDPTAIPCMDNLP-IBGZPJMESA-N -1 3 361.449 3.933 20 0 FHADHM Cc1cccc([C@@H]2CCCCCN2C(=O)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000737391093 599262608 /nfs/dbraw/zinc/26/26/08/599262608.db2.gz XVDPTAIPCMDNLP-IBGZPJMESA-N -1 3 361.449 3.933 20 0 FHADHM CCN(C(=O)CCCC[C@@H](C)C(C)=O)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821154788 607299554 /nfs/dbraw/zinc/29/95/54/607299554.db2.gz RNRHRFSUUPGLAY-HUUCEWRRSA-N -1 3 371.485 3.562 20 0 FHADHM CCN(C(=O)CCCC[C@@H](C)C(C)=O)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821154788 607299555 /nfs/dbraw/zinc/29/95/55/607299555.db2.gz RNRHRFSUUPGLAY-HUUCEWRRSA-N -1 3 371.485 3.562 20 0 FHADHM COc1ccc(CNc2cc(Br)ccc2C)cc1-c1nnn[n-]1 ZINC000821821138 607308099 /nfs/dbraw/zinc/30/80/99/607308099.db2.gz ACXYUAULUCINIT-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM COc1ccc(CNc2cc(Br)ccc2C)cc1-c1nn[n-]n1 ZINC000821821138 607308100 /nfs/dbraw/zinc/30/81/00/607308100.db2.gz ACXYUAULUCINIT-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM COc1ccc(CNc2cc(Cl)cc3cccnc32)cc1-c1nnn[n-]1 ZINC000821821256 607311504 /nfs/dbraw/zinc/31/15/04/607311504.db2.gz CNFKYUONFKVWJA-UHFFFAOYSA-N -1 3 366.812 3.689 20 0 FHADHM COc1ccc(CNc2cc(Cl)cc3cccnc32)cc1-c1nn[n-]n1 ZINC000821821256 607311505 /nfs/dbraw/zinc/31/15/05/607311505.db2.gz CNFKYUONFKVWJA-UHFFFAOYSA-N -1 3 366.812 3.689 20 0 FHADHM FC(F)(F)c1nc2cc(NCc3ccc(-c4nnn[n-]4)cc3)ccc2o1 ZINC000822728333 607314584 /nfs/dbraw/zinc/31/45/84/607314584.db2.gz HNIBPGIMUAHIAZ-UHFFFAOYSA-N -1 3 360.299 3.639 20 0 FHADHM FC(F)(F)c1nc2cc(NCc3ccc(-c4nn[n-]n4)cc3)ccc2o1 ZINC000822728333 607314585 /nfs/dbraw/zinc/31/45/85/607314585.db2.gz HNIBPGIMUAHIAZ-UHFFFAOYSA-N -1 3 360.299 3.639 20 0 FHADHM c1c(-c2ccc(NCc3ccc(-c4nnn[n-]4)cc3)cc2)nc2n1CCCC2 ZINC000823742321 607314597 /nfs/dbraw/zinc/31/45/97/607314597.db2.gz DHTYDIRQFILCNB-UHFFFAOYSA-N -1 3 371.448 3.679 20 0 FHADHM c1c(-c2ccc(NCc3ccc(-c4nn[n-]n4)cc3)cc2)nc2n1CCCC2 ZINC000823742321 607314598 /nfs/dbraw/zinc/31/45/98/607314598.db2.gz DHTYDIRQFILCNB-UHFFFAOYSA-N -1 3 371.448 3.679 20 0 FHADHM O=C(NCCC1CC1)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)cc1 ZINC000823183447 599266077 /nfs/dbraw/zinc/26/60/77/599266077.db2.gz XJLMJTYRCCLFTG-UHFFFAOYSA-N -1 3 364.409 3.581 20 0 FHADHM O=C(NCCC1CC1)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)cc1 ZINC000823183447 599266080 /nfs/dbraw/zinc/26/60/80/599266080.db2.gz XJLMJTYRCCLFTG-UHFFFAOYSA-N -1 3 364.409 3.581 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N[C@H](CC1CC1)c1ccccc1 ZINC000822217762 599272621 /nfs/dbraw/zinc/27/26/21/599272621.db2.gz MVUIPDPIRWZMPL-GOSISDBHSA-N -1 3 362.437 3.838 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N[C@H](CC1CC1)c1ccccc1 ZINC000822217762 599272623 /nfs/dbraw/zinc/27/26/23/599272623.db2.gz MVUIPDPIRWZMPL-GOSISDBHSA-N -1 3 362.437 3.838 20 0 FHADHM C[C@H](NC(=O)Nc1ncc(C(C)(C)C)s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820379537 599296712 /nfs/dbraw/zinc/29/67/12/599296712.db2.gz CPZHUYRWBHAOCG-JTQLQIEISA-N -1 3 371.470 3.503 20 0 FHADHM C[C@H](NC(=O)Nc1ncc(C(C)(C)C)s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820379537 599296713 /nfs/dbraw/zinc/29/67/13/599296713.db2.gz CPZHUYRWBHAOCG-JTQLQIEISA-N -1 3 371.470 3.503 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1ccc(C)cc1C ZINC000736487466 599276848 /nfs/dbraw/zinc/27/68/48/599276848.db2.gz FYMXHSGVFSKJNI-UHFFFAOYSA-N -1 3 350.426 3.558 20 0 FHADHM CC1(NC(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)CCCCC1 ZINC000820623112 599286828 /nfs/dbraw/zinc/28/68/28/599286828.db2.gz FLKROCUAXJMZOW-UHFFFAOYSA-N -1 3 368.363 3.730 20 0 FHADHM CC1(NC(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)CCCCC1 ZINC000820623112 599286829 /nfs/dbraw/zinc/28/68/29/599286829.db2.gz FLKROCUAXJMZOW-UHFFFAOYSA-N -1 3 368.363 3.730 20 0 FHADHM CCC(CC)n1ccc(CSc2nc(C)cc(C)c2-c2nnn[n-]2)n1 ZINC000820901341 607325613 /nfs/dbraw/zinc/32/56/13/607325613.db2.gz BJPQMHAPMZWKQD-UHFFFAOYSA-N -1 3 357.487 3.728 20 0 FHADHM CCC(CC)n1ccc(CSc2nc(C)cc(C)c2-c2nn[n-]n2)n1 ZINC000820901341 607325614 /nfs/dbraw/zinc/32/56/14/607325614.db2.gz BJPQMHAPMZWKQD-UHFFFAOYSA-N -1 3 357.487 3.728 20 0 FHADHM Fc1ccc(CNc2ccc(-c3nn[n-]n3)cc2F)c(C(F)(F)F)c1 ZINC000737650442 598238482 /nfs/dbraw/zinc/23/84/82/598238482.db2.gz RIHDYPCWJWQVID-UHFFFAOYSA-N -1 3 355.270 3.776 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1NCCOc1cccc(C(F)(F)F)c1 ZINC000737641313 598239616 /nfs/dbraw/zinc/23/96/16/598239616.db2.gz WJTKZNKJRPRSDN-UHFFFAOYSA-N -1 3 367.306 3.516 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1NCc1ccccc1OCC(F)(F)F ZINC000737645012 598241380 /nfs/dbraw/zinc/24/13/80/598241380.db2.gz NPEWNNMKXUELOT-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM Fc1cc(CNc2ccc(-c3nn[n-]n3)cc2F)ccc1Br ZINC000737645242 598243264 /nfs/dbraw/zinc/24/32/64/598243264.db2.gz UDXUPOCILDYDGF-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1cccc(OCCSCCCOc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737663063 598274342 /nfs/dbraw/zinc/27/43/42/598274342.db2.gz DXARKLAGQJGDSM-UHFFFAOYSA-N -1 3 374.441 3.587 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)N1CCC[C@@H]1C1CCCC1 ZINC000735659531 598278765 /nfs/dbraw/zinc/27/87/65/598278765.db2.gz BYNXLVJFLMHNTH-OAHLLOKOSA-N -1 3 371.489 3.610 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)N1CCC[C@@H]1C1CCCC1 ZINC000735659531 598278767 /nfs/dbraw/zinc/27/87/67/598278767.db2.gz BYNXLVJFLMHNTH-OAHLLOKOSA-N -1 3 371.489 3.610 20 0 FHADHM CCCc1cc(C(=O)N(C)c2ccc(-c3nnn[n-]3)cc2F)sc1C ZINC000736498689 598281240 /nfs/dbraw/zinc/28/12/40/598281240.db2.gz XMGPCRFKQQOGLU-UHFFFAOYSA-N -1 3 359.430 3.605 20 0 FHADHM CCCc1cc(C(=O)N(C)c2ccc(-c3nn[n-]n3)cc2F)sc1C ZINC000736498689 598281242 /nfs/dbraw/zinc/28/12/42/598281242.db2.gz XMGPCRFKQQOGLU-UHFFFAOYSA-N -1 3 359.430 3.605 20 0 FHADHM CC(C)(C)OC(=O)Nc1ccc(NCc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000735639838 598284240 /nfs/dbraw/zinc/28/42/40/598284240.db2.gz QDEKVKKNTFPJEN-UHFFFAOYSA-N -1 3 366.425 3.826 20 0 FHADHM CC(C)(C)OC(=O)Nc1ccc(NCc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000735639838 598284242 /nfs/dbraw/zinc/28/42/42/598284242.db2.gz QDEKVKKNTFPJEN-UHFFFAOYSA-N -1 3 366.425 3.826 20 0 FHADHM Cc1ccc(-c2ccncc2)cc1NC(=O)c1sccc1-c1nnn[n-]1 ZINC000737288082 598297000 /nfs/dbraw/zinc/29/70/00/598297000.db2.gz MBUQGHWXJTYQTB-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1ccc(-c2ccncc2)cc1NC(=O)c1sccc1-c1nn[n-]n1 ZINC000737288082 598297001 /nfs/dbraw/zinc/29/70/01/598297001.db2.gz MBUQGHWXJTYQTB-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM CC(C)N(Cc1ccccc1)C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736110238 598303674 /nfs/dbraw/zinc/30/36/74/598303674.db2.gz GQHKUNCPDSXIAZ-OAHLLOKOSA-N -1 3 364.453 3.548 20 0 FHADHM CC(C)N(Cc1ccccc1)C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736110238 598303676 /nfs/dbraw/zinc/30/36/76/598303676.db2.gz GQHKUNCPDSXIAZ-OAHLLOKOSA-N -1 3 364.453 3.548 20 0 FHADHM CC(C)c1ccc(CCC(=O)N(C)c2ccc(-c3nnn[n-]3)cc2F)cc1 ZINC000735925223 598307962 /nfs/dbraw/zinc/30/79/62/598307962.db2.gz ZOOIEZSMZBTZCS-UHFFFAOYSA-N -1 3 367.428 3.725 20 0 FHADHM CC(C)c1ccc(CCC(=O)N(C)c2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000735925223 598307963 /nfs/dbraw/zinc/30/79/63/598307963.db2.gz ZOOIEZSMZBTZCS-UHFFFAOYSA-N -1 3 367.428 3.725 20 0 FHADHM O=C(O[C@@H](c1ccccc1)c1cccc(F)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000738211883 598307976 /nfs/dbraw/zinc/30/79/76/598307976.db2.gz AENZODUAJUTJRU-IBGZPJMESA-N -1 3 374.375 3.952 20 0 FHADHM O=C(O[C@@H](c1ccccc1)c1cccc(F)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000738211883 598307978 /nfs/dbraw/zinc/30/79/78/598307978.db2.gz AENZODUAJUTJRU-IBGZPJMESA-N -1 3 374.375 3.952 20 0 FHADHM CN(C(=O)c1ccc(Cl)c(Cl)c1)c1ccc(-c2nnn[n-]2)cc1F ZINC000736741203 598311164 /nfs/dbraw/zinc/31/11/64/598311164.db2.gz CHAHBHOAWZMUMB-UHFFFAOYSA-N -1 3 366.183 3.589 20 0 FHADHM CN(C(=O)c1ccc(Cl)c(Cl)c1)c1ccc(-c2nn[n-]n2)cc1F ZINC000736741203 598311166 /nfs/dbraw/zinc/31/11/66/598311166.db2.gz CHAHBHOAWZMUMB-UHFFFAOYSA-N -1 3 366.183 3.589 20 0 FHADHM Fc1ccc(CSCc2ccn(-c3ccccc3)n2)c(-c2nnn[n-]2)c1 ZINC000737647263 598315445 /nfs/dbraw/zinc/31/54/45/598315445.db2.gz ASIWDZZDEMIFCP-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM Fc1ccc(CSCc2ccn(-c3ccccc3)n2)c(-c2nn[n-]n2)c1 ZINC000737647263 598315447 /nfs/dbraw/zinc/31/54/47/598315447.db2.gz ASIWDZZDEMIFCP-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM CCOc1ccccc1NC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736655184 598316963 /nfs/dbraw/zinc/31/69/63/598316963.db2.gz ONFQSELZYFGYJX-UHFFFAOYSA-N -1 3 374.857 3.728 20 0 FHADHM CCOc1ccccc1NC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736655184 598316965 /nfs/dbraw/zinc/31/69/65/598316965.db2.gz ONFQSELZYFGYJX-UHFFFAOYSA-N -1 3 374.857 3.728 20 0 FHADHM Cc1ccc(CN(C)C(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1 ZINC000737342685 598317932 /nfs/dbraw/zinc/31/79/32/598317932.db2.gz SVGMEQDZNQXWMA-UHFFFAOYSA-N -1 3 372.885 3.657 20 0 FHADHM Cc1ccc(CN(C)C(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1 ZINC000737342685 598317933 /nfs/dbraw/zinc/31/79/33/598317933.db2.gz SVGMEQDZNQXWMA-UHFFFAOYSA-N -1 3 372.885 3.657 20 0 FHADHM C[C@H]1CCCC[C@@H]1N(C)C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736270059 598318642 /nfs/dbraw/zinc/31/86/42/598318642.db2.gz IUAGKSCDPVHOGB-HZMBPMFUSA-N -1 3 364.906 3.727 20 0 FHADHM C[C@H]1CCCC[C@@H]1N(C)C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736270059 598318645 /nfs/dbraw/zinc/31/86/45/598318645.db2.gz IUAGKSCDPVHOGB-HZMBPMFUSA-N -1 3 364.906 3.727 20 0 FHADHM C[C@H]1CCCC[C@H]1CNC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736269945 598321984 /nfs/dbraw/zinc/32/19/84/598321984.db2.gz HQGQMUICTWDBMH-QWRGUYRKSA-N -1 3 364.906 3.633 20 0 FHADHM C[C@H]1CCCC[C@H]1CNC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736269945 598321985 /nfs/dbraw/zinc/32/19/85/598321985.db2.gz HQGQMUICTWDBMH-QWRGUYRKSA-N -1 3 364.906 3.633 20 0 FHADHM CCC[C@H](NC(=O)NCc1ccc(-c2nnn[n-]2)cc1F)C1CCCCC1 ZINC000736431381 598326204 /nfs/dbraw/zinc/32/62/04/598326204.db2.gz BQRWEZQMWXONIY-KRWDZBQOSA-N -1 3 374.464 3.554 20 0 FHADHM CCC[C@H](NC(=O)NCc1ccc(-c2nn[n-]n2)cc1F)C1CCCCC1 ZINC000736431381 598326206 /nfs/dbraw/zinc/32/62/06/598326206.db2.gz BQRWEZQMWXONIY-KRWDZBQOSA-N -1 3 374.464 3.554 20 0 FHADHM CCCN(CC1CCCCC1)C(=O)NCc1ccc(-c2nnn[n-]2)cc1F ZINC000736470536 598326223 /nfs/dbraw/zinc/32/62/23/598326223.db2.gz KKQWQNCVBJNZHL-UHFFFAOYSA-N -1 3 374.464 3.508 20 0 FHADHM CCCN(CC1CCCCC1)C(=O)NCc1ccc(-c2nn[n-]n2)cc1F ZINC000736470536 598326224 /nfs/dbraw/zinc/32/62/24/598326224.db2.gz KKQWQNCVBJNZHL-UHFFFAOYSA-N -1 3 374.464 3.508 20 0 FHADHM CC(C)CN(C(=O)c1csc(C(C)C)n1)c1ccc(-c2nnn[n-]2)cc1 ZINC000735827873 598326847 /nfs/dbraw/zinc/32/68/47/598326847.db2.gz SWBILPJZQHWOEH-UHFFFAOYSA-N -1 3 370.482 3.749 20 0 FHADHM CC(C)CN(C(=O)c1csc(C(C)C)n1)c1ccc(-c2nn[n-]n2)cc1 ZINC000735827873 598326849 /nfs/dbraw/zinc/32/68/49/598326849.db2.gz SWBILPJZQHWOEH-UHFFFAOYSA-N -1 3 370.482 3.749 20 0 FHADHM Fc1ccc(Cl)c2c1ncc(-c1nnn[n-]1)c2N1Cc2ccccc2C1 ZINC000737658759 598364045 /nfs/dbraw/zinc/36/40/45/598364045.db2.gz HZVRHZAOJQJGCY-UHFFFAOYSA-N -1 3 366.787 3.728 20 0 FHADHM Fc1ccc(Cl)c2c1ncc(-c1nn[n-]n1)c2N1Cc2ccccc2C1 ZINC000737658759 598364046 /nfs/dbraw/zinc/36/40/46/598364046.db2.gz HZVRHZAOJQJGCY-UHFFFAOYSA-N -1 3 366.787 3.728 20 0 FHADHM Clc1ccccc1C1(CNc2ccc(-c3nn[n-]n3)cc2)CCOCC1 ZINC000737582578 598365149 /nfs/dbraw/zinc/36/51/49/598365149.db2.gz DPXBLYUFHLMNKU-UHFFFAOYSA-N -1 3 369.856 3.680 20 0 FHADHM CCN(Cc1ccc(-c2ccccc2-c2nnn[n-]2)cc1)CC(F)(F)F ZINC000736555285 598383242 /nfs/dbraw/zinc/38/32/42/598383242.db2.gz LYVBHLRFGVRDOW-UHFFFAOYSA-N -1 3 361.371 3.918 20 0 FHADHM CCN(Cc1ccc(-c2ccccc2-c2nn[n-]n2)cc1)CC(F)(F)F ZINC000736555285 598383243 /nfs/dbraw/zinc/38/32/43/598383243.db2.gz LYVBHLRFGVRDOW-UHFFFAOYSA-N -1 3 361.371 3.918 20 0 FHADHM CCCOc1ccc([C@@H](C)Nc2ncc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000736489902 598392205 /nfs/dbraw/zinc/39/22/05/598392205.db2.gz DPZPBCMRDMUMPU-LLVKDONJSA-N -1 3 358.833 3.877 20 0 FHADHM CCCOc1ccc([C@@H](C)Nc2ncc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000736489902 598392208 /nfs/dbraw/zinc/39/22/08/598392208.db2.gz DPZPBCMRDMUMPU-LLVKDONJSA-N -1 3 358.833 3.877 20 0 FHADHM Fc1ccc(C2(CNc3ncc(-c4nnn[n-]4)cc3Cl)CCC2)cc1 ZINC000737649035 598394131 /nfs/dbraw/zinc/39/41/31/598394131.db2.gz KDHSVBVGPVZKBY-UHFFFAOYSA-N -1 3 358.808 3.588 20 0 FHADHM Fc1ccc(C2(CNc3ncc(-c4nn[n-]n4)cc3Cl)CCC2)cc1 ZINC000737649035 598394133 /nfs/dbraw/zinc/39/41/33/598394133.db2.gz KDHSVBVGPVZKBY-UHFFFAOYSA-N -1 3 358.808 3.588 20 0 FHADHM C[C@H]1c2ccccc2CCN1C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736302117 598413236 /nfs/dbraw/zinc/41/32/36/598413236.db2.gz FBMITEQJUBXMJY-NSHDSACASA-N -1 3 368.828 3.671 20 0 FHADHM C[C@H]1c2ccccc2CCN1C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736302117 598413237 /nfs/dbraw/zinc/41/32/37/598413237.db2.gz FBMITEQJUBXMJY-NSHDSACASA-N -1 3 368.828 3.671 20 0 FHADHM Cc1ccc(NC(=O)[C@@H](C)Sc2ccc(-c3nnn[n-]3)cc2)cc1C ZINC000737357521 598414517 /nfs/dbraw/zinc/41/45/17/598414517.db2.gz ZPEBQRKVAZVYTR-CYBMUJFWSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1ccc(NC(=O)[C@@H](C)Sc2ccc(-c3nn[n-]n3)cc2)cc1C ZINC000737357521 598414519 /nfs/dbraw/zinc/41/45/19/598414519.db2.gz ZPEBQRKVAZVYTR-CYBMUJFWSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1cc(C)c(C)c(OCCC(=O)Nc2cc(-c3nnn[n-]3)ccc2C)c1 ZINC000737246551 598421683 /nfs/dbraw/zinc/42/16/83/598421683.db2.gz LKWZZAZBAYJTHN-UHFFFAOYSA-N -1 3 365.437 3.508 20 0 FHADHM Cc1cc(C)c(C)c(OCCC(=O)Nc2cc(-c3nn[n-]n3)ccc2C)c1 ZINC000737246551 598421684 /nfs/dbraw/zinc/42/16/84/598421684.db2.gz LKWZZAZBAYJTHN-UHFFFAOYSA-N -1 3 365.437 3.508 20 0 FHADHM C[C@H](NC(=O)c1sccc1-c1nnn[n-]1)c1cc2ccccc2s1 ZINC000736127734 598422789 /nfs/dbraw/zinc/42/27/89/598422789.db2.gz UDBLEQLEJABCHJ-VIFPVBQESA-N -1 3 355.448 3.634 20 0 FHADHM C[C@H](NC(=O)c1sccc1-c1nn[n-]n1)c1cc2ccccc2s1 ZINC000736127734 598422791 /nfs/dbraw/zinc/42/27/91/598422791.db2.gz UDBLEQLEJABCHJ-VIFPVBQESA-N -1 3 355.448 3.634 20 0 FHADHM Cc1cc(C)cc([C@H](C)NC(=O)Nc2cc(-c3nnn[n-]3)ccc2C)c1 ZINC000737254081 598431694 /nfs/dbraw/zinc/43/16/94/598431694.db2.gz WHHATGILXLONEG-AWEZNQCLSA-N -1 3 350.426 3.675 20 0 FHADHM Cc1cc(C)cc([C@H](C)NC(=O)Nc2cc(-c3nn[n-]n3)ccc2C)c1 ZINC000737254081 598431696 /nfs/dbraw/zinc/43/16/96/598431696.db2.gz WHHATGILXLONEG-AWEZNQCLSA-N -1 3 350.426 3.675 20 0 FHADHM O=C(Oc1ccc(-c2nnn[n-]2)cc1)[C@H]1C[C@@H]1c1cccc2ccccc21 ZINC000738251888 598436187 /nfs/dbraw/zinc/43/61/87/598436187.db2.gz STUHRMLDURRKSZ-MOPGFXCFSA-N -1 3 356.385 3.729 20 0 FHADHM O=C(Oc1ccc(-c2nn[n-]n2)cc1)[C@H]1C[C@@H]1c1cccc2ccccc21 ZINC000738251888 598436189 /nfs/dbraw/zinc/43/61/89/598436189.db2.gz STUHRMLDURRKSZ-MOPGFXCFSA-N -1 3 356.385 3.729 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1OC(=O)C=C(C)c1ccccc1Cl ZINC000737023114 598441373 /nfs/dbraw/zinc/44/13/73/598441373.db2.gz BEGHBPQFAHKQDV-PKNBQFBNSA-N -1 3 370.796 3.538 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1OC(=O)C=C(C)c1ccccc1Cl ZINC000737023114 598441375 /nfs/dbraw/zinc/44/13/75/598441375.db2.gz BEGHBPQFAHKQDV-PKNBQFBNSA-N -1 3 370.796 3.538 20 0 FHADHM CC(C)(NC(=O)Nc1cccc(-c2nnn[n-]2)c1)c1ccc(Cl)cc1 ZINC000735671771 598467705 /nfs/dbraw/zinc/46/77/05/598467705.db2.gz HIUVIHSTFNMHHI-UHFFFAOYSA-N -1 3 356.817 3.577 20 0 FHADHM CC(C)(NC(=O)Nc1cccc(-c2nn[n-]n2)c1)c1ccc(Cl)cc1 ZINC000735671771 598467706 /nfs/dbraw/zinc/46/77/06/598467706.db2.gz HIUVIHSTFNMHHI-UHFFFAOYSA-N -1 3 356.817 3.577 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)N1CCC[C@@H](c2ccccc2)CC1 ZINC000738151979 598468834 /nfs/dbraw/zinc/46/88/34/598468834.db2.gz MPUMGAZTMVSUBU-MRXNPFEDSA-N -1 3 362.437 3.668 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)N1CCC[C@@H](c2ccccc2)CC1 ZINC000738151979 598468835 /nfs/dbraw/zinc/46/88/35/598468835.db2.gz MPUMGAZTMVSUBU-MRXNPFEDSA-N -1 3 362.437 3.668 20 0 FHADHM CC(=CC(=O)OCc1ccc(-c2nnn[n-]2)cc1F)c1ccccc1Cl ZINC000735446595 598473805 /nfs/dbraw/zinc/47/38/05/598473805.db2.gz BJXZURWVEKARLO-DHZHZOJOSA-N -1 3 372.787 3.806 20 0 FHADHM CC(=CC(=O)OCc1ccc(-c2nn[n-]n2)cc1F)c1ccccc1Cl ZINC000735446595 598473807 /nfs/dbraw/zinc/47/38/07/598473807.db2.gz BJXZURWVEKARLO-DHZHZOJOSA-N -1 3 372.787 3.806 20 0 FHADHM Cc1ccc(F)cc1NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000737348322 598475418 /nfs/dbraw/zinc/47/54/18/598475418.db2.gz WRSNPEXARJVKPS-UHFFFAOYSA-N -1 3 366.400 3.511 20 0 FHADHM Cc1ccc(F)cc1NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000737348322 598475419 /nfs/dbraw/zinc/47/54/19/598475419.db2.gz WRSNPEXARJVKPS-UHFFFAOYSA-N -1 3 366.400 3.511 20 0 FHADHM CCC1CCC(NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)CC1 ZINC000736398154 598478190 /nfs/dbraw/zinc/47/81/90/598478190.db2.gz YYJCBXXSDCWMTO-UHFFFAOYSA-N -1 3 368.485 3.510 20 0 FHADHM CCC1CCC(NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)CC1 ZINC000736398154 598478192 /nfs/dbraw/zinc/47/81/92/598478192.db2.gz YYJCBXXSDCWMTO-UHFFFAOYSA-N -1 3 368.485 3.510 20 0 FHADHM CC[C@H]1CCCC[C@@H]1NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000736401421 598478464 /nfs/dbraw/zinc/47/84/64/598478464.db2.gz WLKGYDQKDVEZRL-YJBOKZPZSA-N -1 3 368.485 3.510 20 0 FHADHM CC[C@H]1CCCC[C@@H]1NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000736401421 598478466 /nfs/dbraw/zinc/47/84/66/598478466.db2.gz WLKGYDQKDVEZRL-YJBOKZPZSA-N -1 3 368.485 3.510 20 0 FHADHM Cc1nc(C(C)(C)C)sc1C(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000737467974 598483378 /nfs/dbraw/zinc/48/33/78/598483378.db2.gz MGHCUVJFGNIJFU-NSHDSACASA-N -1 3 371.466 3.847 20 0 FHADHM Cc1nc(C(C)(C)C)sc1C(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000737467974 598483379 /nfs/dbraw/zinc/48/33/79/598483379.db2.gz MGHCUVJFGNIJFU-NSHDSACASA-N -1 3 371.466 3.847 20 0 FHADHM C[C@H](SCc1ccccc1)C(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000736190046 598486360 /nfs/dbraw/zinc/48/63/60/598486360.db2.gz FHDXNVFZPPDLBQ-KBPBESRZSA-N -1 3 368.462 3.793 20 0 FHADHM C[C@H](SCc1ccccc1)C(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000736190046 598486362 /nfs/dbraw/zinc/48/63/62/598486362.db2.gz FHDXNVFZPPDLBQ-KBPBESRZSA-N -1 3 368.462 3.793 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)c1ccc(C(F)F)cc1 ZINC000735662315 598488263 /nfs/dbraw/zinc/48/82/63/598488263.db2.gz UWSSBPMAALPCCS-UHFFFAOYSA-N -1 3 360.368 3.613 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)c1ccc(C(F)F)cc1 ZINC000735662315 598488265 /nfs/dbraw/zinc/48/82/65/598488265.db2.gz UWSSBPMAALPCCS-UHFFFAOYSA-N -1 3 360.368 3.613 20 0 FHADHM CC(C)c1ccccc1OCC(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000735931675 598488519 /nfs/dbraw/zinc/48/85/19/598488519.db2.gz BOQNABSNHFAINT-AWEZNQCLSA-N -1 3 366.421 3.673 20 0 FHADHM CC(C)c1ccccc1OCC(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000735931675 598488520 /nfs/dbraw/zinc/48/85/20/598488520.db2.gz BOQNABSNHFAINT-AWEZNQCLSA-N -1 3 366.421 3.673 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccc(Cl)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000736147977 598490118 /nfs/dbraw/zinc/49/01/18/598490118.db2.gz BKXJFWVWASSLHA-MQGYJPLLSA-N -1 3 354.797 3.838 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccc(Cl)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000736147977 598490119 /nfs/dbraw/zinc/49/01/19/598490119.db2.gz BKXJFWVWASSLHA-MQGYJPLLSA-N -1 3 354.797 3.838 20 0 FHADHM C[C@H](OC(=O)CCc1c[nH]c2ccccc12)c1cccc(-c2nnn[n-]2)c1 ZINC000736150976 598491224 /nfs/dbraw/zinc/49/12/24/598491224.db2.gz PEZDADIMCXTNRK-ZDUSSCGKSA-N -1 3 361.405 3.585 20 0 FHADHM C[C@H](OC(=O)CCc1c[nH]c2ccccc12)c1cccc(-c2nn[n-]n2)c1 ZINC000736150976 598491226 /nfs/dbraw/zinc/49/12/26/598491226.db2.gz PEZDADIMCXTNRK-ZDUSSCGKSA-N -1 3 361.405 3.585 20 0 FHADHM Cc1ncccc1C(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737501054 598494855 /nfs/dbraw/zinc/49/48/55/598494855.db2.gz HPOXONCCHUQUCB-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ncccc1C(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737501054 598494857 /nfs/dbraw/zinc/49/48/57/598494857.db2.gz HPOXONCCHUQUCB-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccc(N(C(=O)c2ccc(-c3nnn[n-]3)cc2)C2CCCCC2)nc1 ZINC000737346554 598495084 /nfs/dbraw/zinc/49/50/84/598495084.db2.gz HPDAHNQXUBSUQL-UHFFFAOYSA-N -1 3 362.437 3.550 20 0 FHADHM Cc1ccc(N(C(=O)c2ccc(-c3nn[n-]n3)cc2)C2CCCCC2)nc1 ZINC000737346554 598495086 /nfs/dbraw/zinc/49/50/86/598495086.db2.gz HPDAHNQXUBSUQL-UHFFFAOYSA-N -1 3 362.437 3.550 20 0 FHADHM CCc1ccc([C@H](C)C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCC3)cc1 ZINC000736684545 598497101 /nfs/dbraw/zinc/49/71/01/598497101.db2.gz APYGUFRXRHZAQQ-NSHDSACASA-N -1 3 367.478 3.722 20 0 FHADHM CCc1ccc([C@H](C)C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCC3)cc1 ZINC000736684545 598497103 /nfs/dbraw/zinc/49/71/03/598497103.db2.gz APYGUFRXRHZAQQ-NSHDSACASA-N -1 3 367.478 3.722 20 0 FHADHM Cc1cc(N[C@@H](C)c2cccnc2)n2c3ccccc3nc2c1-c1nnn[n-]1 ZINC000737280708 598503749 /nfs/dbraw/zinc/50/37/49/598503749.db2.gz OTTCCHIXBSQBKI-ZDUSSCGKSA-N -1 3 370.420 3.544 20 0 FHADHM Cc1cc(N[C@@H](C)c2cccnc2)n2c3ccccc3nc2c1-c1nn[n-]n1 ZINC000737280708 598503750 /nfs/dbraw/zinc/50/37/50/598503750.db2.gz OTTCCHIXBSQBKI-ZDUSSCGKSA-N -1 3 370.420 3.544 20 0 FHADHM Cc1noc(CSCc2ccc(-c3ccccc3-c3nnn[n-]3)cc2)n1 ZINC000737546838 598512016 /nfs/dbraw/zinc/51/20/16/598512016.db2.gz RUQWUNSOHSMXAV-UHFFFAOYSA-N -1 3 364.434 3.659 20 0 FHADHM Cc1noc(CSCc2ccc(-c3ccccc3-c3nn[n-]n3)cc2)n1 ZINC000737546838 598512018 /nfs/dbraw/zinc/51/20/18/598512018.db2.gz RUQWUNSOHSMXAV-UHFFFAOYSA-N -1 3 364.434 3.659 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cccc3c2CCC3)c1-c1nn[n-]n1 ZINC000736674390 598513942 /nfs/dbraw/zinc/51/39/42/598513942.db2.gz CFQMOQMPSUWEEZ-UHFFFAOYSA-N -1 3 353.451 3.540 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cccc3c2CCC3)c1-c1nnn[n-]1 ZINC000736674390 598513940 /nfs/dbraw/zinc/51/39/40/598513940.db2.gz CFQMOQMPSUWEEZ-UHFFFAOYSA-N -1 3 353.451 3.540 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)c1-c1nnn[n-]1 ZINC000736670806 598516894 /nfs/dbraw/zinc/51/68/94/598516894.db2.gz SHEHMMSNJBCALZ-UONOGXRCSA-N -1 3 371.441 3.680 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)c1-c1nn[n-]n1 ZINC000736670806 598516896 /nfs/dbraw/zinc/51/68/96/598516896.db2.gz SHEHMMSNJBCALZ-UONOGXRCSA-N -1 3 371.441 3.680 20 0 FHADHM CCc1c(C)sc(NC(=O)C[C@H](C)c2ccccc2)c1-c1nnn[n-]1 ZINC000736669233 598517906 /nfs/dbraw/zinc/51/79/06/598517906.db2.gz AELFAHCACYJLGS-NSHDSACASA-N -1 3 355.467 3.931 20 0 FHADHM CCc1c(C)sc(NC(=O)C[C@H](C)c2ccccc2)c1-c1nn[n-]n1 ZINC000736669233 598517907 /nfs/dbraw/zinc/51/79/07/598517907.db2.gz AELFAHCACYJLGS-NSHDSACASA-N -1 3 355.467 3.931 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)[C@@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000738161616 598533636 /nfs/dbraw/zinc/53/36/36/598533636.db2.gz HAHMFIROLGFFPE-DLBZAZTESA-N -1 3 373.391 3.901 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)[C@@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000738161616 598533638 /nfs/dbraw/zinc/53/36/38/598533638.db2.gz HAHMFIROLGFFPE-DLBZAZTESA-N -1 3 373.391 3.901 20 0 FHADHM CC/C=C(\C)C(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736408749 598543405 /nfs/dbraw/zinc/54/34/05/598543405.db2.gz GREKTPQVFHSXAY-LHHJGKSTSA-N -1 3 363.421 3.741 20 0 FHADHM CC/C=C(\C)C(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736408749 598543407 /nfs/dbraw/zinc/54/34/07/598543407.db2.gz GREKTPQVFHSXAY-LHHJGKSTSA-N -1 3 363.421 3.741 20 0 FHADHM CC/C=C(/C)C(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736408752 598543641 /nfs/dbraw/zinc/54/36/41/598543641.db2.gz GREKTPQVFHSXAY-RZNTYIFUSA-N -1 3 363.421 3.741 20 0 FHADHM CC/C=C(/C)C(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736408752 598543642 /nfs/dbraw/zinc/54/36/42/598543642.db2.gz GREKTPQVFHSXAY-RZNTYIFUSA-N -1 3 363.421 3.741 20 0 FHADHM C[C@H](CC(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(F)F)CC(C)(C)C ZINC000735975779 598544638 /nfs/dbraw/zinc/54/46/38/598544638.db2.gz OHQPCMBKBZIRRQ-SNVBAGLBSA-N -1 3 367.400 3.869 20 0 FHADHM C[C@H](CC(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(F)F)CC(C)(C)C ZINC000735975779 598544640 /nfs/dbraw/zinc/54/46/40/598544640.db2.gz OHQPCMBKBZIRRQ-SNVBAGLBSA-N -1 3 367.400 3.869 20 0 FHADHM Cc1ccc(-c2nc(COc3ccc(-c4nnn[n-]4)c(F)c3)cs2)o1 ZINC000737289284 598547920 /nfs/dbraw/zinc/54/79/20/598547920.db2.gz UPLPHXLSNOFHIG-UHFFFAOYSA-N -1 3 357.370 3.610 20 0 FHADHM Cc1ccc(-c2nc(COc3ccc(-c4nn[n-]n4)c(F)c3)cs2)o1 ZINC000737289284 598547922 /nfs/dbraw/zinc/54/79/22/598547922.db2.gz UPLPHXLSNOFHIG-UHFFFAOYSA-N -1 3 357.370 3.610 20 0 FHADHM Fc1cc(OCc2coc(-c3cccc(Cl)c3)n2)ccc1-c1nnn[n-]1 ZINC000737651678 598549380 /nfs/dbraw/zinc/54/93/80/598549380.db2.gz MWPWAJYVOSJSBJ-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM Fc1cc(OCc2coc(-c3cccc(Cl)c3)n2)ccc1-c1nn[n-]n1 ZINC000737651678 598549381 /nfs/dbraw/zinc/54/93/81/598549381.db2.gz MWPWAJYVOSJSBJ-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H](C)c2ccccc2F)c1-c1nnn[n-]1 ZINC000736669445 598553316 /nfs/dbraw/zinc/55/33/16/598553316.db2.gz HXLDZPDUTRIHAA-SECBINFHSA-N -1 3 359.430 3.680 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H](C)c2ccccc2F)c1-c1nn[n-]n1 ZINC000736669445 598553319 /nfs/dbraw/zinc/55/33/19/598553319.db2.gz HXLDZPDUTRIHAA-SECBINFHSA-N -1 3 359.430 3.680 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1)Nc1ccccn1 ZINC000738174362 598562418 /nfs/dbraw/zinc/56/24/18/598562418.db2.gz YFOYPIARZPIGQB-UHFFFAOYSA-N -1 3 373.376 3.698 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1)Nc1ccccn1 ZINC000738174362 598562419 /nfs/dbraw/zinc/56/24/19/598562419.db2.gz YFOYPIARZPIGQB-UHFFFAOYSA-N -1 3 373.376 3.698 20 0 FHADHM CCOc1ccc(CNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)cc1 ZINC000736644372 598577163 /nfs/dbraw/zinc/57/71/63/598577163.db2.gz JSPCULOGBZMFES-UHFFFAOYSA-N -1 3 363.343 3.896 20 0 FHADHM CCOc1ccc(CNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)cc1 ZINC000736644372 598577165 /nfs/dbraw/zinc/57/71/65/598577165.db2.gz JSPCULOGBZMFES-UHFFFAOYSA-N -1 3 363.343 3.896 20 0 FHADHM Fc1ccccc1-c1nc(CSc2ccc(-c3nnn[n-]3)cn2)cs1 ZINC000737663575 598581063 /nfs/dbraw/zinc/58/10/63/598581063.db2.gz JDIPCNGQBDVLPJ-UHFFFAOYSA-N -1 3 370.438 3.817 20 0 FHADHM Fc1ccccc1-c1nc(CSc2ccc(-c3nn[n-]n3)cn2)cs1 ZINC000737663575 598581064 /nfs/dbraw/zinc/58/10/64/598581064.db2.gz JDIPCNGQBDVLPJ-UHFFFAOYSA-N -1 3 370.438 3.817 20 0 FHADHM C[C@H](OC(=O)[C@H]1C[C@H]1c1ccc(F)c(F)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000736149480 598582936 /nfs/dbraw/zinc/58/29/36/598582936.db2.gz GNOLEDMSDQVLIZ-LKTVYLICSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@H]1C[C@H]1c1ccc(F)c(F)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000736149480 598582937 /nfs/dbraw/zinc/58/29/37/598582937.db2.gz GNOLEDMSDQVLIZ-LKTVYLICSA-N -1 3 370.359 3.553 20 0 FHADHM COc1cc(COc2ccc(-c3nnn[n-]3)cc2Cl)ccc1SC ZINC000737046761 598584840 /nfs/dbraw/zinc/58/48/40/598584840.db2.gz FTIFCROCRFIARK-UHFFFAOYSA-N -1 3 362.842 3.830 20 0 FHADHM COc1cc(COc2ccc(-c3nn[n-]n3)cc2Cl)ccc1SC ZINC000737046761 598584841 /nfs/dbraw/zinc/58/48/41/598584841.db2.gz FTIFCROCRFIARK-UHFFFAOYSA-N -1 3 362.842 3.830 20 0 FHADHM O=C(CCc1ccc2ccccc2c1)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000737857150 598585086 /nfs/dbraw/zinc/58/50/86/598585086.db2.gz NJGRLHADRRKTAT-UHFFFAOYSA-N -1 3 361.380 3.730 20 0 FHADHM O=C(CCc1ccc2ccccc2c1)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000737857150 598585087 /nfs/dbraw/zinc/58/50/87/598585087.db2.gz NJGRLHADRRKTAT-UHFFFAOYSA-N -1 3 361.380 3.730 20 0 FHADHM O=C(Cc1ccc(-c2nnn[n-]2)cc1)O[C@H](c1ccccc1)C1CCCC1 ZINC000737955980 598585910 /nfs/dbraw/zinc/58/59/10/598585910.db2.gz QRVOIXCXBQZGQA-HXUWFJFHSA-N -1 3 362.433 3.884 20 0 FHADHM O=C(Cc1ccc(-c2nn[n-]n2)cc1)O[C@H](c1ccccc1)C1CCCC1 ZINC000737955980 598585912 /nfs/dbraw/zinc/58/59/12/598585912.db2.gz QRVOIXCXBQZGQA-HXUWFJFHSA-N -1 3 362.433 3.884 20 0 FHADHM Cc1ccc(NC(=O)c2cccc(Nc3ccc(-c4nn[n-]n4)cc3)c2)cn1 ZINC000822254829 607361946 /nfs/dbraw/zinc/36/19/46/607361946.db2.gz SGZMCGLGDMSRMB-UHFFFAOYSA-N -1 3 371.404 3.566 20 0 FHADHM CC[C@H](C)[C@H](C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccccc1 ZINC000736335676 598590157 /nfs/dbraw/zinc/59/01/57/598590157.db2.gz ZKPPYQNMVPFDOU-SJCJKPOMSA-N -1 3 353.401 3.774 20 0 FHADHM CC[C@H](C)[C@H](C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccccc1 ZINC000736335676 598590158 /nfs/dbraw/zinc/59/01/58/598590158.db2.gz ZKPPYQNMVPFDOU-SJCJKPOMSA-N -1 3 353.401 3.774 20 0 FHADHM Cc1ccc2c(CC(=O)Nc3ccc(F)c(-c4nnn[n-]4)c3)coc2c1C ZINC000737371792 598590726 /nfs/dbraw/zinc/59/07/26/598590726.db2.gz LQCCYABERKSDQC-UHFFFAOYSA-N -1 3 365.368 3.550 20 0 FHADHM Cc1ccc2c(CC(=O)Nc3ccc(F)c(-c4nn[n-]n4)c3)coc2c1C ZINC000737371792 598590728 /nfs/dbraw/zinc/59/07/28/598590728.db2.gz LQCCYABERKSDQC-UHFFFAOYSA-N -1 3 365.368 3.550 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)c1cc2c(s1)CCCCC2 ZINC000738168244 598591651 /nfs/dbraw/zinc/59/16/51/598591651.db2.gz XBVRFQROULYAGQ-UHFFFAOYSA-N -1 3 357.414 3.589 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)c1cc2c(s1)CCCCC2 ZINC000738168244 598591652 /nfs/dbraw/zinc/59/16/52/598591652.db2.gz XBVRFQROULYAGQ-UHFFFAOYSA-N -1 3 357.414 3.589 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)c1sccc1-c1ccccc1 ZINC000738167014 598598650 /nfs/dbraw/zinc/59/86/50/598598650.db2.gz ZVFIAYCPOLMINW-UHFFFAOYSA-N -1 3 365.393 3.987 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)c1sccc1-c1ccccc1 ZINC000738167014 598598651 /nfs/dbraw/zinc/59/86/51/598598651.db2.gz ZVFIAYCPOLMINW-UHFFFAOYSA-N -1 3 365.393 3.987 20 0 FHADHM Clc1cccc(-c2noc(C=Cc3ccccc3-c3nnn[n-]3)n2)c1 ZINC000737576081 598608882 /nfs/dbraw/zinc/60/88/82/598608882.db2.gz TZALOPANWCLOSD-HJWRWDBZSA-N -1 3 350.769 3.741 20 0 FHADHM Clc1cccc(-c2noc(C=Cc3ccccc3-c3nn[n-]n3)n2)c1 ZINC000737576081 598608883 /nfs/dbraw/zinc/60/88/83/598608883.db2.gz TZALOPANWCLOSD-HJWRWDBZSA-N -1 3 350.769 3.741 20 0 FHADHM CCC[C@H]1CCCC[C@@H]1NC(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000736436579 598609237 /nfs/dbraw/zinc/60/92/37/598609237.db2.gz RWKMHTIXUJKLIL-RDJZCZTQSA-N -1 3 373.526 3.575 20 0 FHADHM CCC[C@H]1CCCC[C@@H]1NC(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000736436579 598609240 /nfs/dbraw/zinc/60/92/40/598609240.db2.gz RWKMHTIXUJKLIL-RDJZCZTQSA-N -1 3 373.526 3.575 20 0 FHADHM CC(C)Cc1noc(-c2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)n1 ZINC000735851006 598610459 /nfs/dbraw/zinc/61/04/59/598610459.db2.gz JNLZQVFOBWXVQE-UHFFFAOYSA-N -1 3 362.393 3.908 20 0 FHADHM c1ccc2c(c1)cccc2-c1noc(COc2ccccc2-c2nnn[n-]2)n1 ZINC000738427340 598613298 /nfs/dbraw/zinc/61/32/98/598613298.db2.gz UOVHQKFSLZEMNT-UHFFFAOYSA-N -1 3 370.372 3.649 20 0 FHADHM c1ccc2c(c1)cccc2-c1noc(COc2ccccc2-c2nn[n-]n2)n1 ZINC000738427340 598613299 /nfs/dbraw/zinc/61/32/99/598613299.db2.gz UOVHQKFSLZEMNT-UHFFFAOYSA-N -1 3 370.372 3.649 20 0 FHADHM C[C@H](NC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1cccc(Cl)c1 ZINC000736114337 598623972 /nfs/dbraw/zinc/62/39/72/598623972.db2.gz BBDKKTARLCEHCL-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM C[C@H](NC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1cccc(Cl)c1 ZINC000736114337 598623974 /nfs/dbraw/zinc/62/39/74/598623974.db2.gz BBDKKTARLCEHCL-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM Cc1cc([C@H](C)NC(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)c(C)s1 ZINC000737244719 598624991 /nfs/dbraw/zinc/62/49/91/598624991.db2.gz KIBNELVDSNIJBQ-VIFPVBQESA-N -1 3 360.418 3.567 20 0 FHADHM Cc1cc([C@H](C)NC(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)c(C)s1 ZINC000737244719 598624992 /nfs/dbraw/zinc/62/49/92/598624992.db2.gz KIBNELVDSNIJBQ-VIFPVBQESA-N -1 3 360.418 3.567 20 0 FHADHM C[C@@H](c1ccccc1Cl)N(C)C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000736205299 598628998 /nfs/dbraw/zinc/62/89/98/598628998.db2.gz VFMFTLIACLYLAZ-JTQLQIEISA-N -1 3 374.807 3.884 20 0 FHADHM C[C@@H](c1ccccc1Cl)N(C)C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000736205299 598628999 /nfs/dbraw/zinc/62/89/99/598628999.db2.gz VFMFTLIACLYLAZ-JTQLQIEISA-N -1 3 374.807 3.884 20 0 FHADHM C[C@@H](Nc1ccc(F)cc1-c1nnn[n-]1)c1ccccc1Br ZINC000736138380 598630930 /nfs/dbraw/zinc/63/09/30/598630930.db2.gz MZRHNUMQAGJQCA-SECBINFHSA-N -1 3 362.206 3.941 20 0 FHADHM C[C@@H](Nc1ccc(F)cc1-c1nn[n-]n1)c1ccccc1Br ZINC000736138380 598630931 /nfs/dbraw/zinc/63/09/31/598630931.db2.gz MZRHNUMQAGJQCA-SECBINFHSA-N -1 3 362.206 3.941 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)N1CCC[C@@H]1c1ccc(F)cc1 ZINC000738160781 598631457 /nfs/dbraw/zinc/63/14/57/598631457.db2.gz BABPHXSMEULXEO-MRXNPFEDSA-N -1 3 370.363 3.514 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)N1CCC[C@@H]1c1ccc(F)cc1 ZINC000738160781 598631459 /nfs/dbraw/zinc/63/14/59/598631459.db2.gz BABPHXSMEULXEO-MRXNPFEDSA-N -1 3 370.363 3.514 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(N2CCC(OCc3ccccc3)CC2)c1 ZINC000737571060 598633607 /nfs/dbraw/zinc/63/36/07/598633607.db2.gz QDMGNFBWUQCNCT-UHFFFAOYSA-N -1 3 369.856 3.706 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(N2CCC(OCc3ccccc3)CC2)c1 ZINC000737571060 598633609 /nfs/dbraw/zinc/63/36/09/598633609.db2.gz QDMGNFBWUQCNCT-UHFFFAOYSA-N -1 3 369.856 3.706 20 0 FHADHM Cc1ccc(NC(=O)c2ccc(Oc3ccc(-c4nnn[n-]4)cn3)cc2)cc1 ZINC000737359003 598643542 /nfs/dbraw/zinc/64/35/42/598643542.db2.gz CXNWLNKXNYZBHA-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccc(NC(=O)c2ccc(Oc3ccc(-c4nn[n-]n4)cn3)cc2)cc1 ZINC000737359003 598643544 /nfs/dbraw/zinc/64/35/44/598643544.db2.gz CXNWLNKXNYZBHA-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM CCCCc1ccc(NC(=O)CSc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000736465498 598647410 /nfs/dbraw/zinc/64/74/10/598647410.db2.gz FMLKTEFFLPUSEV-UHFFFAOYSA-N -1 3 367.478 3.940 20 0 FHADHM CCCCc1ccc(NC(=O)CSc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000736465498 598647412 /nfs/dbraw/zinc/64/74/12/598647412.db2.gz FMLKTEFFLPUSEV-UHFFFAOYSA-N -1 3 367.478 3.940 20 0 FHADHM CCC(CC)NC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736344741 598647479 /nfs/dbraw/zinc/64/74/79/598647479.db2.gz CNLGDULUVRSLFD-UHFFFAOYSA-N -1 3 351.410 3.577 20 0 FHADHM CCC(CC)NC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736344741 598647480 /nfs/dbraw/zinc/64/74/80/598647480.db2.gz CNLGDULUVRSLFD-UHFFFAOYSA-N -1 3 351.410 3.577 20 0 FHADHM O=C(C[C@H](c1ccccc1)C(F)(F)F)Nc1sccc1-c1nnn[n-]1 ZINC000737809825 598647730 /nfs/dbraw/zinc/64/77/30/598647730.db2.gz UMPHCDDWWOVDDR-LLVKDONJSA-N -1 3 367.356 3.603 20 0 FHADHM O=C(C[C@H](c1ccccc1)C(F)(F)F)Nc1sccc1-c1nn[n-]n1 ZINC000737809825 598647732 /nfs/dbraw/zinc/64/77/32/598647732.db2.gz UMPHCDDWWOVDDR-LLVKDONJSA-N -1 3 367.356 3.603 20 0 FHADHM O=C(C[C@H](c1ccccc1)C(F)(F)F)Nc1ccccc1-c1nnn[n-]1 ZINC000737807090 598647791 /nfs/dbraw/zinc/64/77/91/598647791.db2.gz JYWQGRWWQACRFQ-CYBMUJFWSA-N -1 3 361.327 3.541 20 0 FHADHM O=C(C[C@H](c1ccccc1)C(F)(F)F)Nc1ccccc1-c1nn[n-]n1 ZINC000737807090 598647792 /nfs/dbraw/zinc/64/77/92/598647792.db2.gz JYWQGRWWQACRFQ-CYBMUJFWSA-N -1 3 361.327 3.541 20 0 FHADHM CN(C(=O)CCCCOc1cccc(-c2nnn[n-]2)c1)C1CCCCCC1 ZINC000736731795 598647912 /nfs/dbraw/zinc/64/79/12/598647912.db2.gz HTMNQCONURBUSU-UHFFFAOYSA-N -1 3 371.485 3.597 20 0 FHADHM CN(C(=O)CCCCOc1cccc(-c2nn[n-]n2)c1)C1CCCCCC1 ZINC000736731795 598647914 /nfs/dbraw/zinc/64/79/14/598647914.db2.gz HTMNQCONURBUSU-UHFFFAOYSA-N -1 3 371.485 3.597 20 0 FHADHM CC(C)[C@@H](C)N(C)C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000735699571 598651229 /nfs/dbraw/zinc/65/12/29/598651229.db2.gz ACMQSMCOMVZXFE-CQSZACIVSA-N -1 3 365.437 3.776 20 0 FHADHM CC(C)[C@@H](C)N(C)C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735699571 598651230 /nfs/dbraw/zinc/65/12/30/598651230.db2.gz ACMQSMCOMVZXFE-CQSZACIVSA-N -1 3 365.437 3.776 20 0 FHADHM Clc1cc(NCc2csc(Br)c2)ccc1-c1nnn[n-]1 ZINC000737563026 598652249 /nfs/dbraw/zinc/65/22/49/598652249.db2.gz CLVFXFFEYZHKOF-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM Clc1cc(NCc2csc(Br)c2)ccc1-c1nn[n-]n1 ZINC000737563026 598652251 /nfs/dbraw/zinc/65/22/51/598652251.db2.gz CLVFXFFEYZHKOF-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM CCN(C(=O)CSc1ccc(-c2nnn[n-]2)cc1)c1ccc(C)cc1C ZINC000736505328 598652316 /nfs/dbraw/zinc/65/23/16/598652316.db2.gz LVSQZJKZNFCQTB-UHFFFAOYSA-N -1 3 367.478 3.629 20 0 FHADHM CCN(C(=O)CSc1ccc(-c2nn[n-]n2)cc1)c1ccc(C)cc1C ZINC000736505328 598652318 /nfs/dbraw/zinc/65/23/18/598652318.db2.gz LVSQZJKZNFCQTB-UHFFFAOYSA-N -1 3 367.478 3.629 20 0 FHADHM Cc1ccc(C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)cc1Cl ZINC000737309759 598652571 /nfs/dbraw/zinc/65/25/71/598652571.db2.gz ULPCDDAUHDBGGC-UHFFFAOYSA-N -1 3 367.840 3.633 20 0 FHADHM Cc1ccc(C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)cc1Cl ZINC000737309759 598652573 /nfs/dbraw/zinc/65/25/73/598652573.db2.gz ULPCDDAUHDBGGC-UHFFFAOYSA-N -1 3 367.840 3.633 20 0 FHADHM CC(C)(C)CCNC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000735603141 598653078 /nfs/dbraw/zinc/65/30/78/598653078.db2.gz XWQNDUKCFQMRTA-UHFFFAOYSA-N -1 3 365.437 3.825 20 0 FHADHM CC(C)(C)CCNC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735603141 598653080 /nfs/dbraw/zinc/65/30/80/598653080.db2.gz XWQNDUKCFQMRTA-UHFFFAOYSA-N -1 3 365.437 3.825 20 0 FHADHM COc1ccc([C@H](C)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1OC ZINC000737075098 598653582 /nfs/dbraw/zinc/65/35/82/598653582.db2.gz KNTJWEDIWIIPAQ-JTQLQIEISA-N -1 3 359.817 3.710 20 0 FHADHM COc1ccc([C@H](C)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1OC ZINC000737075098 598653583 /nfs/dbraw/zinc/65/35/83/598653583.db2.gz KNTJWEDIWIIPAQ-JTQLQIEISA-N -1 3 359.817 3.710 20 0 FHADHM CCC[C@@H](CC)NC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736422548 598656844 /nfs/dbraw/zinc/65/68/44/598656844.db2.gz IVIKLKGVBYESBG-MRXNPFEDSA-N -1 3 365.437 3.968 20 0 FHADHM CCC[C@@H](CC)NC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736422548 598656846 /nfs/dbraw/zinc/65/68/46/598656846.db2.gz IVIKLKGVBYESBG-MRXNPFEDSA-N -1 3 365.437 3.968 20 0 FHADHM Cc1c2ccc3ccccc3c2oc1C(=O)Nc1ccc(-c2nnn[n-]2)cn1 ZINC000737214795 598661531 /nfs/dbraw/zinc/66/15/31/598661531.db2.gz SDFJWHUPLLCUNJ-UHFFFAOYSA-N -1 3 370.372 3.722 20 0 FHADHM Cc1c2ccc3ccccc3c2oc1C(=O)Nc1ccc(-c2nn[n-]n2)cn1 ZINC000737214795 598661533 /nfs/dbraw/zinc/66/15/33/598661533.db2.gz SDFJWHUPLLCUNJ-UHFFFAOYSA-N -1 3 370.372 3.722 20 0 FHADHM CCCN(C(=O)Cc1ccc(-c2nnn[n-]2)cc1)c1ccc(Cl)cc1 ZINC000736467619 598668025 /nfs/dbraw/zinc/66/80/25/598668025.db2.gz HVGDKCVYEXJNLK-UHFFFAOYSA-N -1 3 355.829 3.506 20 0 FHADHM CCCN(C(=O)Cc1ccc(-c2nn[n-]n2)cc1)c1ccc(Cl)cc1 ZINC000736467619 598668027 /nfs/dbraw/zinc/66/80/27/598668027.db2.gz HVGDKCVYEXJNLK-UHFFFAOYSA-N -1 3 355.829 3.506 20 0 FHADHM O[C@H](CNc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccc2ccccc2c1 ZINC000738381607 598674571 /nfs/dbraw/zinc/67/45/71/598674571.db2.gz ILDKSXLNLIJESS-GOSISDBHSA-N -1 3 365.824 3.819 20 0 FHADHM O[C@H](CNc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccc2ccccc2c1 ZINC000738381607 598674572 /nfs/dbraw/zinc/67/45/72/598674572.db2.gz ILDKSXLNLIJESS-GOSISDBHSA-N -1 3 365.824 3.819 20 0 FHADHM O=C(Cc1csc2ccccc12)OCc1ccc(F)cc1-c1nnn[n-]1 ZINC000737978405 598708322 /nfs/dbraw/zinc/70/83/22/598708322.db2.gz UKFMSWCTEFJLIJ-UHFFFAOYSA-N -1 3 368.393 3.506 20 0 FHADHM O=C(Cc1csc2ccccc12)OCc1ccc(F)cc1-c1nn[n-]n1 ZINC000737978405 598708323 /nfs/dbraw/zinc/70/83/23/598708323.db2.gz UKFMSWCTEFJLIJ-UHFFFAOYSA-N -1 3 368.393 3.506 20 0 FHADHM CC(C)(NC(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccc(F)cc1 ZINC000735671920 598715898 /nfs/dbraw/zinc/71/58/98/598715898.db2.gz UCPLRBCPGBSSGC-UHFFFAOYSA-N -1 3 374.807 3.716 20 0 FHADHM CC(C)(NC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccc(F)cc1 ZINC000735671920 598715899 /nfs/dbraw/zinc/71/58/99/598715899.db2.gz UCPLRBCPGBSSGC-UHFFFAOYSA-N -1 3 374.807 3.716 20 0 FHADHM CC(C)C[C@@H](C)OC(=O)c1ccc(Oc2ccc(-c3nnn[n-]3)cn2)cc1 ZINC000735761062 598734557 /nfs/dbraw/zinc/73/45/57/598734557.db2.gz KQNQAHQJUNXXMK-CYBMUJFWSA-N -1 3 367.409 3.645 20 0 FHADHM CC(C)C[C@@H](C)OC(=O)c1ccc(Oc2ccc(-c3nn[n-]n3)cn2)cc1 ZINC000735761062 598734559 /nfs/dbraw/zinc/73/45/59/598734559.db2.gz KQNQAHQJUNXXMK-CYBMUJFWSA-N -1 3 367.409 3.645 20 0 FHADHM CC(C)C[C@H](C)OC(=O)c1ccc(Oc2ccc(-c3nnn[n-]3)cn2)cc1 ZINC000735761064 598734577 /nfs/dbraw/zinc/73/45/77/598734577.db2.gz KQNQAHQJUNXXMK-ZDUSSCGKSA-N -1 3 367.409 3.645 20 0 FHADHM CC(C)C[C@H](C)OC(=O)c1ccc(Oc2ccc(-c3nn[n-]n3)cn2)cc1 ZINC000735761064 598734579 /nfs/dbraw/zinc/73/45/79/598734579.db2.gz KQNQAHQJUNXXMK-ZDUSSCGKSA-N -1 3 367.409 3.645 20 0 FHADHM Cc1ccccc1CCC(=O)N(CC(C)C)c1ccc(-c2nnn[n-]2)cc1 ZINC000737428484 598736621 /nfs/dbraw/zinc/73/66/21/598736621.db2.gz YCPUWCKLQXDVLG-UHFFFAOYSA-N -1 3 363.465 3.797 20 0 FHADHM Cc1ccccc1CCC(=O)N(CC(C)C)c1ccc(-c2nn[n-]n2)cc1 ZINC000737428484 598736623 /nfs/dbraw/zinc/73/66/23/598736623.db2.gz YCPUWCKLQXDVLG-UHFFFAOYSA-N -1 3 363.465 3.797 20 0 FHADHM CC(C)(C)CCCC(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(F)F ZINC000735602201 598736798 /nfs/dbraw/zinc/73/67/98/598736798.db2.gz BBIHCTVJFVCVFT-UHFFFAOYSA-N -1 3 353.373 3.623 20 0 FHADHM CC(C)(C)CCCC(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(F)F ZINC000735602201 598736799 /nfs/dbraw/zinc/73/67/99/598736799.db2.gz BBIHCTVJFVCVFT-UHFFFAOYSA-N -1 3 353.373 3.623 20 0 FHADHM CC(C)CN(C(=O)[C@@H](C)Cc1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000735819605 598741241 /nfs/dbraw/zinc/74/12/41/598741241.db2.gz ZIWRJHSFIPAEMU-INIZCTEOSA-N -1 3 363.465 3.735 20 0 FHADHM CC(C)CN(C(=O)[C@@H](C)Cc1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000735819605 598741242 /nfs/dbraw/zinc/74/12/42/598741242.db2.gz ZIWRJHSFIPAEMU-INIZCTEOSA-N -1 3 363.465 3.735 20 0 FHADHM CC(C)Sc1ccc([C@@H](C)NC(=O)c2sccc2-c2nnn[n-]2)cc1 ZINC000735921319 598743677 /nfs/dbraw/zinc/74/36/77/598743677.db2.gz OYJMBMQBFNYRSB-LLVKDONJSA-N -1 3 373.507 3.920 20 0 FHADHM CC(C)Sc1ccc([C@@H](C)NC(=O)c2sccc2-c2nn[n-]n2)cc1 ZINC000735921319 598743679 /nfs/dbraw/zinc/74/36/79/598743679.db2.gz OYJMBMQBFNYRSB-LLVKDONJSA-N -1 3 373.507 3.920 20 0 FHADHM CC(C)Sc1ccc([C@H](C)NC(=O)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000735920989 598743802 /nfs/dbraw/zinc/74/38/02/598743802.db2.gz DLIWWFDLCLGPFV-ZDUSSCGKSA-N -1 3 367.478 3.858 20 0 FHADHM CC(C)Sc1ccc([C@H](C)NC(=O)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000735920989 598743804 /nfs/dbraw/zinc/74/38/04/598743804.db2.gz DLIWWFDLCLGPFV-ZDUSSCGKSA-N -1 3 367.478 3.858 20 0 FHADHM Cc1ccccc1[C@H](NC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)C(C)C ZINC000737423330 598761018 /nfs/dbraw/zinc/76/10/18/598761018.db2.gz QLMLYBAAXODEEX-QGZVFWFLSA-N -1 3 368.416 3.833 20 0 FHADHM Cc1ccccc1[C@H](NC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)C(C)C ZINC000737423330 598761020 /nfs/dbraw/zinc/76/10/20/598761020.db2.gz QLMLYBAAXODEEX-QGZVFWFLSA-N -1 3 368.416 3.833 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@@H](CC)Cc2ccccc2)s1 ZINC000736679325 598763044 /nfs/dbraw/zinc/76/30/44/598763044.db2.gz RJZGUHPBTSUVON-ZDUSSCGKSA-N -1 3 355.467 3.698 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@@H](CC)Cc2ccccc2)s1 ZINC000736679325 598763046 /nfs/dbraw/zinc/76/30/46/598763046.db2.gz RJZGUHPBTSUVON-ZDUSSCGKSA-N -1 3 355.467 3.698 20 0 FHADHM CCc1ccc(CNc2c(-c3nnn[n-]3)cnc3c(F)cc(F)cc32)s1 ZINC000736692657 598769891 /nfs/dbraw/zinc/76/98/91/598769891.db2.gz TYISZDFPPJQHIT-UHFFFAOYSA-N -1 3 372.404 3.929 20 0 FHADHM CCc1ccc(CNc2c(-c3nn[n-]n3)cnc3c(F)cc(F)cc32)s1 ZINC000736692657 598769893 /nfs/dbraw/zinc/76/98/93/598769893.db2.gz TYISZDFPPJQHIT-UHFFFAOYSA-N -1 3 372.404 3.929 20 0 FHADHM C[C@H](CCc1ccco1)Nc1c(-c2nnn[n-]2)cnc2c(F)cc(F)cc21 ZINC000735993455 598770129 /nfs/dbraw/zinc/77/01/29/598770129.db2.gz SGZNHLVGCNHZIS-SNVBAGLBSA-N -1 3 370.363 3.719 20 0 FHADHM C[C@H](CCc1ccco1)Nc1c(-c2nn[n-]n2)cnc2c(F)cc(F)cc21 ZINC000735993455 598770132 /nfs/dbraw/zinc/77/01/32/598770132.db2.gz SGZNHLVGCNHZIS-SNVBAGLBSA-N -1 3 370.363 3.719 20 0 FHADHM CC(C)Oc1ccc(NC(=S)Nc2ccccc2F)cc1-c1nnn[n-]1 ZINC000820173978 607366968 /nfs/dbraw/zinc/36/69/68/607366968.db2.gz OFTVHHKDEYOMGF-UHFFFAOYSA-N -1 3 372.429 3.602 20 0 FHADHM CC(C)Oc1ccc(NC(=S)Nc2ccccc2F)cc1-c1nn[n-]n1 ZINC000820173978 607366970 /nfs/dbraw/zinc/36/69/70/607366970.db2.gz OFTVHHKDEYOMGF-UHFFFAOYSA-N -1 3 372.429 3.602 20 0 FHADHM CCOc1ccc(CNc2ccc(Cl)cc2-c2nnn[n-]2)cc1OC ZINC000736644669 598793195 /nfs/dbraw/zinc/79/31/95/598793195.db2.gz OGLLHWPETAVXHI-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM CCOc1ccc(CNc2ccc(Cl)cc2-c2nn[n-]n2)cc1OC ZINC000736644669 598793197 /nfs/dbraw/zinc/79/31/97/598793197.db2.gz OGLLHWPETAVXHI-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM Clc1ccc(NCc2ccc(N3CCCCC3)nc2)c(-c2nnn[n-]2)c1 ZINC000737574723 598793568 /nfs/dbraw/zinc/79/35/68/598793568.db2.gz OQDAOMVYGIOLJA-UHFFFAOYSA-N -1 3 369.860 3.518 20 0 FHADHM Clc1ccc(NCc2ccc(N3CCCCC3)nc2)c(-c2nn[n-]n2)c1 ZINC000737574723 598793569 /nfs/dbraw/zinc/79/35/69/598793569.db2.gz OQDAOMVYGIOLJA-UHFFFAOYSA-N -1 3 369.860 3.518 20 0 FHADHM Clc1ccc(NCc2csc(Br)c2)c(-c2nnn[n-]2)c1 ZINC000737573469 598793582 /nfs/dbraw/zinc/79/35/82/598793582.db2.gz IGTLLJADNVPSGP-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM Clc1ccc(NCc2csc(Br)c2)c(-c2nn[n-]n2)c1 ZINC000737573469 598793583 /nfs/dbraw/zinc/79/35/83/598793583.db2.gz IGTLLJADNVPSGP-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM Clc1ccc(NCCCCOCCc2ccccc2)c(-c2nnn[n-]2)c1 ZINC000737573009 598794714 /nfs/dbraw/zinc/79/47/14/598794714.db2.gz CZHAXNCEYKHAKP-UHFFFAOYSA-N -1 3 371.872 3.972 20 0 FHADHM Clc1ccc(NCCCCOCCc2ccccc2)c(-c2nn[n-]n2)c1 ZINC000737573009 598794715 /nfs/dbraw/zinc/79/47/15/598794715.db2.gz CZHAXNCEYKHAKP-UHFFFAOYSA-N -1 3 371.872 3.972 20 0 FHADHM Cc1cc(Oc2ncccc2-c2nnn[n-]2)ccc1NC(=O)[C@H](C)C(C)C ZINC000737281453 598804308 /nfs/dbraw/zinc/80/43/08/598804308.db2.gz ZJSWACDLYFWGMC-CYBMUJFWSA-N -1 3 366.425 3.593 20 0 FHADHM CCC[C@@H](CC1CCCC1)C(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1 ZINC000736421529 598821497 /nfs/dbraw/zinc/82/14/97/598821497.db2.gz BPLYELFDCPMXOT-SFHVURJKSA-N -1 3 355.486 3.822 20 0 FHADHM CCC[C@@H](CC1CCCC1)C(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1 ZINC000736421529 598821498 /nfs/dbraw/zinc/82/14/98/598821498.db2.gz BPLYELFDCPMXOT-SFHVURJKSA-N -1 3 355.486 3.822 20 0 FHADHM CCC[C@H](CC1CCCCC1)C(=O)NCc1cccc(-c2nnn[n-]2)c1 ZINC000736423627 598821633 /nfs/dbraw/zinc/82/16/33/598821633.db2.gz WEZTZMGTWLAODU-GOSISDBHSA-N -1 3 355.486 3.870 20 0 FHADHM CCC[C@H](CC1CCCCC1)C(=O)NCc1cccc(-c2nn[n-]n2)c1 ZINC000736423627 598821635 /nfs/dbraw/zinc/82/16/35/598821635.db2.gz WEZTZMGTWLAODU-GOSISDBHSA-N -1 3 355.486 3.870 20 0 FHADHM C[C@@H](SCc1cc(F)cc2c1OCOC2)c1ccc(-c2nnn[n-]2)cc1 ZINC000736189666 599326063 /nfs/dbraw/zinc/32/60/63/599326063.db2.gz QHFNVWXPHJFWNX-LLVKDONJSA-N -1 3 372.425 3.867 20 0 FHADHM C[C@@H](SCc1cc(F)cc2c1OCOC2)c1ccc(-c2nn[n-]n2)cc1 ZINC000736189666 599326066 /nfs/dbraw/zinc/32/60/66/599326066.db2.gz QHFNVWXPHJFWNX-LLVKDONJSA-N -1 3 372.425 3.867 20 0 FHADHM C[C@@H](S[C@@H](C)C(=O)N[C@@H]1CCCC[C@@H]1C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736189200 599327777 /nfs/dbraw/zinc/32/77/77/599327777.db2.gz OLMCSQQETPZMJG-QDEZUTFSSA-N -1 3 373.526 3.744 20 0 FHADHM C[C@@H](S[C@@H](C)C(=O)N[C@@H]1CCCC[C@@H]1C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736189200 599327780 /nfs/dbraw/zinc/32/77/80/599327780.db2.gz OLMCSQQETPZMJG-QDEZUTFSSA-N -1 3 373.526 3.744 20 0 FHADHM C[C@H](S[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)C(=O)NC1CCC(C)CC1 ZINC000736243689 599328848 /nfs/dbraw/zinc/32/88/48/599328848.db2.gz YHMVRTKBMOZGST-CWVKQELPSA-N -1 3 373.526 3.744 20 0 FHADHM C[C@H](S[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)C(=O)NC1CCC(C)CC1 ZINC000736243689 599328850 /nfs/dbraw/zinc/32/88/50/599328850.db2.gz YHMVRTKBMOZGST-CWVKQELPSA-N -1 3 373.526 3.744 20 0 FHADHM CCN(C(=O)CS[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000736505027 599331201 /nfs/dbraw/zinc/33/12/01/599331201.db2.gz KPSAUEYDGZJUII-AWEZNQCLSA-N -1 3 367.478 3.714 20 0 FHADHM CCN(C(=O)CS[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000736505027 599331204 /nfs/dbraw/zinc/33/12/04/599331204.db2.gz KPSAUEYDGZJUII-AWEZNQCLSA-N -1 3 367.478 3.714 20 0 FHADHM Cc1ccc(NC(=O)CS[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c(F)c1 ZINC000737356589 599332495 /nfs/dbraw/zinc/33/24/95/599332495.db2.gz HWAYFAIIZUIFHP-GFCCVEGCSA-N -1 3 371.441 3.747 20 0 FHADHM Cc1ccc(NC(=O)CS[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c(F)c1 ZINC000737356589 599332498 /nfs/dbraw/zinc/33/24/98/599332498.db2.gz HWAYFAIIZUIFHP-GFCCVEGCSA-N -1 3 371.441 3.747 20 0 FHADHM CC(C)[C@H](Sc1ccccc1-c1nnn[n-]1)C(=O)Nc1ccccc1F ZINC000820031323 599348719 /nfs/dbraw/zinc/34/87/19/599348719.db2.gz CEGKWAZIGKZJJT-INIZCTEOSA-N -1 3 371.441 3.761 20 0 FHADHM CC(C)[C@H](Sc1ccccc1-c1nn[n-]n1)C(=O)Nc1ccccc1F ZINC000820031323 599348721 /nfs/dbraw/zinc/34/87/21/599348721.db2.gz CEGKWAZIGKZJJT-INIZCTEOSA-N -1 3 371.441 3.761 20 0 FHADHM Cc1cc(C)cc(NC(=O)[C@H](C)Sc2ccccc2-c2nnn[n-]2)c1 ZINC000822196688 599350795 /nfs/dbraw/zinc/35/07/95/599350795.db2.gz SQKNDJIUIVQVKX-ZDUSSCGKSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1cc(C)cc(NC(=O)[C@H](C)Sc2ccccc2-c2nn[n-]n2)c1 ZINC000822196688 599350798 /nfs/dbraw/zinc/35/07/98/599350798.db2.gz SQKNDJIUIVQVKX-ZDUSSCGKSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1sc(NC(=O)CSc2ccccc2-c2nnn[n-]2)c(C)c1C ZINC000822563189 599352742 /nfs/dbraw/zinc/35/27/42/599352742.db2.gz GMJSBGGGVVKHJS-UHFFFAOYSA-N -1 3 359.480 3.584 20 0 FHADHM Cc1sc(NC(=O)CSc2ccccc2-c2nn[n-]n2)c(C)c1C ZINC000822563189 599352744 /nfs/dbraw/zinc/35/27/44/599352744.db2.gz GMJSBGGGVVKHJS-UHFFFAOYSA-N -1 3 359.480 3.584 20 0 FHADHM C[C@H](Nc1ncnc2cc(Cl)ccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000820461246 599354802 /nfs/dbraw/zinc/35/48/02/599354802.db2.gz GHWURQQFJURWNB-JTQLQIEISA-N -1 3 351.801 3.636 20 0 FHADHM C[C@H](Nc1ncnc2cc(Cl)ccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000820461246 599354804 /nfs/dbraw/zinc/35/48/04/599354804.db2.gz GHWURQQFJURWNB-JTQLQIEISA-N -1 3 351.801 3.636 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000821333824 599367228 /nfs/dbraw/zinc/36/72/28/599367228.db2.gz AMAQHBBHXDRCHU-GFCCVEGCSA-N -1 3 352.398 3.608 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000821333824 599367231 /nfs/dbraw/zinc/36/72/31/599367231.db2.gz AMAQHBBHXDRCHU-GFCCVEGCSA-N -1 3 352.398 3.608 20 0 FHADHM COc1ccc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1Br ZINC000821835435 599376592 /nfs/dbraw/zinc/37/65/92/599376592.db2.gz KWKQPRZPWIPLET-JTQLQIEISA-N -1 3 374.242 3.811 20 0 FHADHM COc1ccc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1Br ZINC000821835435 599376595 /nfs/dbraw/zinc/37/65/95/599376595.db2.gz KWKQPRZPWIPLET-JTQLQIEISA-N -1 3 374.242 3.811 20 0 FHADHM C[C@H](NC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1ccc(F)cc1Cl ZINC000736099087 599378215 /nfs/dbraw/zinc/37/82/15/599378215.db2.gz GKXJVADMCXYNAQ-WDDYJBPVSA-N -1 3 371.803 3.550 20 0 FHADHM C[C@H](NC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1ccc(F)cc1Cl ZINC000736099087 599378218 /nfs/dbraw/zinc/37/82/18/599378218.db2.gz GKXJVADMCXYNAQ-WDDYJBPVSA-N -1 3 371.803 3.550 20 0 FHADHM Cc1ccc(Oc2ccc(N[C@@H](C)c3ccc(-c4nnn[n-]4)cc3)cc2)nn1 ZINC000822267313 599381065 /nfs/dbraw/zinc/38/10/65/599381065.db2.gz SBNZLOPZICNOMT-AWEZNQCLSA-N -1 3 373.420 3.931 20 0 FHADHM Cc1ccc(Oc2ccc(N[C@@H](C)c3ccc(-c4nn[n-]n4)cc3)cc2)nn1 ZINC000822267313 599381068 /nfs/dbraw/zinc/38/10/68/599381068.db2.gz SBNZLOPZICNOMT-AWEZNQCLSA-N -1 3 373.420 3.931 20 0 FHADHM Cc1cc(Cn2ccc(-c3ccc(-c4nnn[n-]4)cc3)n2)c2ccccc2n1 ZINC000822202209 599384649 /nfs/dbraw/zinc/38/46/49/599384649.db2.gz PMYABTUTPSGFKR-UHFFFAOYSA-N -1 3 367.416 3.635 20 0 FHADHM Cc1cc(Cn2ccc(-c3ccc(-c4nn[n-]n4)cc3)n2)c2ccccc2n1 ZINC000822202209 599384652 /nfs/dbraw/zinc/38/46/52/599384652.db2.gz PMYABTUTPSGFKR-UHFFFAOYSA-N -1 3 367.416 3.635 20 0 FHADHM C[C@@H](NCc1csc(-c2ccsc2)n1)c1cccc(-c2nn[n-]n2)c1 ZINC000820437682 599392809 /nfs/dbraw/zinc/39/28/09/599392809.db2.gz BFSUCOBMVCKOPT-LLVKDONJSA-N -1 3 368.491 3.903 20 0 FHADHM c1ccc(CC2CCN(c3cc(-c4nnn[n-]4)c4ccccc4n3)CC2)cc1 ZINC000738428657 599394526 /nfs/dbraw/zinc/39/45/26/599394526.db2.gz QCZADRLFXLURFW-UHFFFAOYSA-N -1 3 370.460 3.874 20 0 FHADHM c1ccc(CC2CCN(c3cc(-c4nn[n-]n4)c4ccccc4n3)CC2)cc1 ZINC000738428657 599394532 /nfs/dbraw/zinc/39/45/32/599394532.db2.gz QCZADRLFXLURFW-UHFFFAOYSA-N -1 3 370.460 3.874 20 0 FHADHM CN(Cc1ccc(Cl)s1)c1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000736816490 599397885 /nfs/dbraw/zinc/39/78/85/599397885.db2.gz JRAQAZUTMUBYBE-UHFFFAOYSA-N -1 3 356.842 3.766 20 0 FHADHM CN(Cc1ccc(Cl)s1)c1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000736816490 599397886 /nfs/dbraw/zinc/39/78/86/599397886.db2.gz JRAQAZUTMUBYBE-UHFFFAOYSA-N -1 3 356.842 3.766 20 0 FHADHM c1ccc2c(c1)nc(NCCCOC1CCCCC1)cc2-c1nnn[n-]1 ZINC000738432562 599400806 /nfs/dbraw/zinc/40/08/06/599400806.db2.gz HHENXQLHPLVKHE-UHFFFAOYSA-N -1 3 352.442 3.566 20 0 FHADHM c1ccc2c(c1)nc(NCCCOC1CCCCC1)cc2-c1nn[n-]n1 ZINC000738432562 599400809 /nfs/dbraw/zinc/40/08/09/599400809.db2.gz HHENXQLHPLVKHE-UHFFFAOYSA-N -1 3 352.442 3.566 20 0 FHADHM CC(C)[C@@H](NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000820356941 599400894 /nfs/dbraw/zinc/40/08/94/599400894.db2.gz CYCTVFUJMRPXDZ-KBXCAEBGSA-N -1 3 364.453 3.624 20 0 FHADHM CC(C)[C@@H](NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000820356941 599400897 /nfs/dbraw/zinc/40/08/97/599400897.db2.gz CYCTVFUJMRPXDZ-KBXCAEBGSA-N -1 3 364.453 3.624 20 0 FHADHM c1ccc([C@@H](Nc2cc(-c3nnn[n-]3)c3ccccc3n2)[C@H]2CCCO2)cc1 ZINC000738426576 599425943 /nfs/dbraw/zinc/42/59/43/599425943.db2.gz FLNTUFWLTJBVJV-UYAOXDASSA-N -1 3 372.432 3.747 20 0 FHADHM c1ccc([C@@H](Nc2cc(-c3nn[n-]n3)c3ccccc3n2)[C@H]2CCCO2)cc1 ZINC000738426576 599425945 /nfs/dbraw/zinc/42/59/45/599425945.db2.gz FLNTUFWLTJBVJV-UYAOXDASSA-N -1 3 372.432 3.747 20 0 FHADHM CC(C)(C)c1csc(CCNc2cc(Cl)ccc2-c2nnn[n-]2)n1 ZINC000735652159 599428695 /nfs/dbraw/zinc/42/86/95/599428695.db2.gz CFLKCLOMXWEGTK-UHFFFAOYSA-N -1 3 362.890 3.929 20 0 FHADHM CC(C)(C)c1csc(CCNc2cc(Cl)ccc2-c2nn[n-]n2)n1 ZINC000735652159 599428698 /nfs/dbraw/zinc/42/86/98/599428698.db2.gz CFLKCLOMXWEGTK-UHFFFAOYSA-N -1 3 362.890 3.929 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@@H]1NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820073853 599432179 /nfs/dbraw/zinc/43/21/79/599432179.db2.gz WJAGNYQMLZCYQB-VKJFTORMSA-N -1 3 370.501 3.832 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@@H]1NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820073853 599432181 /nfs/dbraw/zinc/43/21/81/599432181.db2.gz WJAGNYQMLZCYQB-VKJFTORMSA-N -1 3 370.501 3.832 20 0 FHADHM CC(C)(C)[C@@H]1OCCC[C@@H]1CNc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000735595225 599440316 /nfs/dbraw/zinc/44/03/16/599440316.db2.gz FFBCGKKONZIELH-FZKQIMNGSA-N -1 3 366.469 3.668 20 0 FHADHM CC(C)(C)[C@@H]1OCCC[C@@H]1CNc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000735595225 599440319 /nfs/dbraw/zinc/44/03/19/599440319.db2.gz FFBCGKKONZIELH-FZKQIMNGSA-N -1 3 366.469 3.668 20 0 FHADHM CC(C)(C)[C@@H]1OCCC[C@H]1CNc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000735595230 599440838 /nfs/dbraw/zinc/44/08/38/599440838.db2.gz FFBCGKKONZIELH-SCLBCKFNSA-N -1 3 366.469 3.668 20 0 FHADHM CC(C)(C)[C@@H]1OCCC[C@H]1CNc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000735595230 599440840 /nfs/dbraw/zinc/44/08/40/599440840.db2.gz FFBCGKKONZIELH-SCLBCKFNSA-N -1 3 366.469 3.668 20 0 FHADHM C[C@H](CCC1CCCCC1)NC(=O)NCc1cc(-c2nnn[n-]2)ccc1F ZINC000820242230 599440956 /nfs/dbraw/zinc/44/09/56/599440956.db2.gz LYDOVNYZMYFCCC-CYBMUJFWSA-N -1 3 374.464 3.554 20 0 FHADHM C[C@H](CCC1CCCCC1)NC(=O)NCc1cc(-c2nn[n-]n2)ccc1F ZINC000820242230 599440957 /nfs/dbraw/zinc/44/09/57/599440957.db2.gz LYDOVNYZMYFCCC-CYBMUJFWSA-N -1 3 374.464 3.554 20 0 FHADHM COc1cc([C@H](C)Nc2ccc(F)cc2-c2nnn[n-]2)ccc1OC(C)C ZINC000821708498 599471883 /nfs/dbraw/zinc/47/18/83/599471883.db2.gz RBLLZOINVPFGBD-LBPRGKRZSA-N -1 3 371.416 3.975 20 0 FHADHM COc1cc([C@H](C)Nc2ccc(F)cc2-c2nn[n-]n2)ccc1OC(C)C ZINC000821708498 599471884 /nfs/dbraw/zinc/47/18/84/599471884.db2.gz RBLLZOINVPFGBD-LBPRGKRZSA-N -1 3 371.416 3.975 20 0 FHADHM COc1cc(C)c([C@@H](C)Nc2ccc(F)cc2-c2nnn[n-]2)cc1OC ZINC000821708662 599478007 /nfs/dbraw/zinc/47/80/07/599478007.db2.gz VLCOJFZYMRLSRO-LLVKDONJSA-N -1 3 357.389 3.505 20 0 FHADHM COc1cc(C)c([C@@H](C)Nc2ccc(F)cc2-c2nn[n-]n2)cc1OC ZINC000821708662 599478008 /nfs/dbraw/zinc/47/80/08/599478008.db2.gz VLCOJFZYMRLSRO-LLVKDONJSA-N -1 3 357.389 3.505 20 0 FHADHM CCO[C@H](C)c1nc(CSCc2ccc(-c3nnn[n-]3)cc2)cs1 ZINC000736616664 599480700 /nfs/dbraw/zinc/48/07/00/599480700.db2.gz OTMIJNOQYIPPCA-LLVKDONJSA-N -1 3 361.496 3.854 20 0 FHADHM CCO[C@H](C)c1nc(CSCc2ccc(-c3nn[n-]n3)cc2)cs1 ZINC000736616664 599480702 /nfs/dbraw/zinc/48/07/02/599480702.db2.gz OTMIJNOQYIPPCA-LLVKDONJSA-N -1 3 361.496 3.854 20 0 FHADHM Cc1cccc([C@H](C)NC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1C ZINC000822288544 599482238 /nfs/dbraw/zinc/48/22/38/599482238.db2.gz BBTPYLVFQAFKHI-CABCVRRESA-N -1 3 364.453 3.605 20 0 FHADHM Cc1cccc([C@H](C)NC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1C ZINC000822288544 599482240 /nfs/dbraw/zinc/48/22/40/599482240.db2.gz BBTPYLVFQAFKHI-CABCVRRESA-N -1 3 364.453 3.605 20 0 FHADHM Fc1ccc(NCCOc2ccc(C(F)(F)F)cc2)c(-c2nnn[n-]2)c1 ZINC000822778122 599483272 /nfs/dbraw/zinc/48/32/72/599483272.db2.gz DHEFLPSPYQNWHJ-UHFFFAOYSA-N -1 3 367.306 3.516 20 0 FHADHM Fc1ccc(NCCOc2ccc(C(F)(F)F)cc2)c(-c2nn[n-]n2)c1 ZINC000822778122 599483275 /nfs/dbraw/zinc/48/32/75/599483275.db2.gz DHEFLPSPYQNWHJ-UHFFFAOYSA-N -1 3 367.306 3.516 20 0 FHADHM Fc1ccc(CNc2ccc(F)cc2-c2nnn[n-]2)c(Br)c1 ZINC000822772393 599491569 /nfs/dbraw/zinc/49/15/69/599491569.db2.gz XEXJBCSVHGCOEC-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1ccc(CNc2ccc(F)cc2-c2nn[n-]n2)c(Br)c1 ZINC000822772393 599491571 /nfs/dbraw/zinc/49/15/71/599491571.db2.gz XEXJBCSVHGCOEC-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)N1CCCCC[C@@H]1c1ccco1 ZINC000738178137 599493428 /nfs/dbraw/zinc/49/34/28/599493428.db2.gz FKKQQWSKFQYAIY-OAHLLOKOSA-N -1 3 352.398 3.609 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)N1CCCCC[C@@H]1c1ccco1 ZINC000738178137 599493430 /nfs/dbraw/zinc/49/34/30/599493430.db2.gz FKKQQWSKFQYAIY-OAHLLOKOSA-N -1 3 352.398 3.609 20 0 FHADHM CC(C)[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820313170 599497900 /nfs/dbraw/zinc/49/79/00/599497900.db2.gz BLFPLOCZVUSPDZ-KXBFYZLASA-N -1 3 363.465 3.559 20 0 FHADHM CC(C)[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820313170 599497903 /nfs/dbraw/zinc/49/79/03/599497903.db2.gz BLFPLOCZVUSPDZ-KXBFYZLASA-N -1 3 363.465 3.559 20 0 FHADHM CC(C)(C(=O)OCc1ccc(-c2nnn[n-]2)cc1)c1cccc(Cl)c1 ZINC000735582728 599498811 /nfs/dbraw/zinc/49/88/11/599498811.db2.gz OFSVTRZXFNBIJE-UHFFFAOYSA-N -1 3 356.813 3.541 20 0 FHADHM CC(C)(C(=O)OCc1ccc(-c2nn[n-]n2)cc1)c1cccc(Cl)c1 ZINC000735582728 599498813 /nfs/dbraw/zinc/49/88/13/599498813.db2.gz OFSVTRZXFNBIJE-UHFFFAOYSA-N -1 3 356.813 3.541 20 0 FHADHM Fc1ccc(NC[C@H]2CCN(c3ccc(Cl)cc3)C2)c(-c2nnn[n-]2)c1 ZINC000822778805 599499068 /nfs/dbraw/zinc/49/90/68/599499068.db2.gz OACODDCQTFQHIT-GFCCVEGCSA-N -1 3 372.835 3.598 20 0 FHADHM Fc1ccc(NC[C@H]2CCN(c3ccc(Cl)cc3)C2)c(-c2nn[n-]n2)c1 ZINC000822778805 599499069 /nfs/dbraw/zinc/49/90/69/599499069.db2.gz OACODDCQTFQHIT-GFCCVEGCSA-N -1 3 372.835 3.598 20 0 FHADHM C[C@H](NC(=O)C1(c2ccccc2)CCCC1)c1cccc(-c2nnn[n-]2)c1 ZINC000820322058 599515808 /nfs/dbraw/zinc/51/58/08/599515808.db2.gz QGPZQONDYNRPOV-HNNXBMFYSA-N -1 3 361.449 3.556 20 0 FHADHM C[C@H](NC(=O)C1(c2ccccc2)CCCC1)c1cccc(-c2nn[n-]n2)c1 ZINC000820322058 599515810 /nfs/dbraw/zinc/51/58/10/599515810.db2.gz QGPZQONDYNRPOV-HNNXBMFYSA-N -1 3 361.449 3.556 20 0 FHADHM Cc1cc(CNc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)ccc1F ZINC000737263659 599518806 /nfs/dbraw/zinc/51/88/06/599518806.db2.gz GQOWTRFPRSTEAA-UHFFFAOYSA-N -1 3 351.307 3.945 20 0 FHADHM C[C@@H](S[C@@H](C)C(=O)Nc1cccc(-c2nnn[n-]2)c1)c1cccs1 ZINC000736188475 599521502 /nfs/dbraw/zinc/52/15/02/599521502.db2.gz KENWTXNKDSUCST-MNOVXSKESA-N -1 3 359.480 3.750 20 0 FHADHM C[C@@H](S[C@@H](C)C(=O)Nc1cccc(-c2nn[n-]n2)c1)c1cccs1 ZINC000736188475 599521504 /nfs/dbraw/zinc/52/15/04/599521504.db2.gz KENWTXNKDSUCST-MNOVXSKESA-N -1 3 359.480 3.750 20 0 FHADHM CCc1nc(CN(C)c2ccc(-c3nn[n-]n3)cc2C(F)(F)F)cs1 ZINC000736703904 599522673 /nfs/dbraw/zinc/52/26/73/599522673.db2.gz HTPVSGIOMZMBNL-UHFFFAOYSA-N -1 3 368.388 3.541 20 0 FHADHM CCc1ccc([C@@H](C)CC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000821475848 599522894 /nfs/dbraw/zinc/52/28/94/599522894.db2.gz BAFJPDGCNBOZHH-GJZGRUSLSA-N -1 3 363.465 3.800 20 0 FHADHM CCc1ccc([C@@H](C)CC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000821475848 599522895 /nfs/dbraw/zinc/52/28/95/599522895.db2.gz BAFJPDGCNBOZHH-GJZGRUSLSA-N -1 3 363.465 3.800 20 0 FHADHM CCc1ccc([C@@H](C)CC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000821475850 599523036 /nfs/dbraw/zinc/52/30/36/599523036.db2.gz BAFJPDGCNBOZHH-LSDHHAIUSA-N -1 3 363.465 3.800 20 0 FHADHM CCc1ccc([C@@H](C)CC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000821475850 599523037 /nfs/dbraw/zinc/52/30/37/599523037.db2.gz BAFJPDGCNBOZHH-LSDHHAIUSA-N -1 3 363.465 3.800 20 0 FHADHM FC(F)(F)c1cc(-c2nn[n-]n2)ccc1NC[C@H]1CCc2ccccc2N1 ZINC000822718200 599524220 /nfs/dbraw/zinc/52/42/20/599524220.db2.gz CBZQTZHGPHMNOT-CYBMUJFWSA-N -1 3 374.370 3.724 20 0 FHADHM C[C@H](SCCC(=O)Nc1ccccc1-c1nnn[n-]1)c1cccs1 ZINC000736188023 599524389 /nfs/dbraw/zinc/52/43/89/599524389.db2.gz GVKPHRONPSMLJF-NSHDSACASA-N -1 3 359.480 3.751 20 0 FHADHM C[C@H](SCCC(=O)Nc1ccccc1-c1nn[n-]n1)c1cccs1 ZINC000736188023 599524392 /nfs/dbraw/zinc/52/43/92/599524392.db2.gz GVKPHRONPSMLJF-NSHDSACASA-N -1 3 359.480 3.751 20 0 FHADHM Fc1ccc(F)c(CNc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)c1 ZINC000737661602 599525810 /nfs/dbraw/zinc/52/58/10/599525810.db2.gz ZIZGUOUMNGGNIV-UHFFFAOYSA-N -1 3 355.270 3.776 20 0 FHADHM Cc1ccc([C@@H](C)CNc2nc(C(F)(F)F)ccc2-c2nnn[n-]2)cc1 ZINC000737319892 599531355 /nfs/dbraw/zinc/53/13/55/599531355.db2.gz HCYQCDAFCISQLO-NSHDSACASA-N -1 3 362.359 3.805 20 0 FHADHM Cc1ccc([C@@H](C)CNc2nc(C(F)(F)F)ccc2-c2nn[n-]n2)cc1 ZINC000737319892 599531357 /nfs/dbraw/zinc/53/13/57/599531357.db2.gz HCYQCDAFCISQLO-NSHDSACASA-N -1 3 362.359 3.805 20 0 FHADHM CC[C@H](CC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(C)cc1 ZINC000820882577 599537386 /nfs/dbraw/zinc/53/73/86/599537386.db2.gz UKRQNUPKYDSDGS-JKSUJKDBSA-N -1 3 363.465 3.936 20 0 FHADHM CC[C@H](CC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(C)cc1 ZINC000820882577 599537389 /nfs/dbraw/zinc/53/73/89/599537389.db2.gz UKRQNUPKYDSDGS-JKSUJKDBSA-N -1 3 363.465 3.936 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)C1(c2cccs2)CCCCC1 ZINC000606347974 599538161 /nfs/dbraw/zinc/53/81/61/599538161.db2.gz XZOVDHSNXJWGSZ-UHFFFAOYSA-N -1 3 353.451 3.769 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)C1(c2cccs2)CCCCC1 ZINC000606347974 599538164 /nfs/dbraw/zinc/53/81/64/599538164.db2.gz XZOVDHSNXJWGSZ-UHFFFAOYSA-N -1 3 353.451 3.769 20 0 FHADHM CCc1ccc([C@@H](C)CC(=O)N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000736684627 599542022 /nfs/dbraw/zinc/54/20/22/599542022.db2.gz BHLHVZOZODHXJE-LSDHHAIUSA-N -1 3 363.465 3.800 20 0 FHADHM CCc1ccc([C@@H](C)CC(=O)N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000736684627 599542024 /nfs/dbraw/zinc/54/20/24/599542024.db2.gz BHLHVZOZODHXJE-LSDHHAIUSA-N -1 3 363.465 3.800 20 0 FHADHM CC[C@@H](C)[C@H]1CCCCN1C(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000736326622 599547558 /nfs/dbraw/zinc/54/75/58/599547558.db2.gz BVECNAYVZKCXOA-RHSMWYFYSA-N -1 3 373.526 3.527 20 0 FHADHM CC[C@@H](C)[C@H]1CCCCN1C(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000736326622 599547560 /nfs/dbraw/zinc/54/75/60/599547560.db2.gz BVECNAYVZKCXOA-RHSMWYFYSA-N -1 3 373.526 3.527 20 0 FHADHM O=C(NC(c1cccs1)c1cccs1)c1ccc(-c2nnn[n-]2)cc1 ZINC000738000459 599550258 /nfs/dbraw/zinc/55/02/58/599550258.db2.gz FPFXESRRPFRHIC-UHFFFAOYSA-N -1 3 367.459 3.509 20 0 FHADHM O=C(NC(c1cccs1)c1cccs1)c1ccc(-c2nn[n-]n2)cc1 ZINC000738000459 599550260 /nfs/dbraw/zinc/55/02/60/599550260.db2.gz FPFXESRRPFRHIC-UHFFFAOYSA-N -1 3 367.459 3.509 20 0 FHADHM CCCCCNC(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736450681 599561803 /nfs/dbraw/zinc/56/18/03/599561803.db2.gz FICSWXBNLCWWMT-UHFFFAOYSA-N -1 3 350.426 3.530 20 0 FHADHM CN(C(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1)C1CCCC1 ZINC000736741086 599561805 /nfs/dbraw/zinc/56/18/05/599561805.db2.gz MXUSNMGQHHCUEM-UHFFFAOYSA-N -1 3 362.437 3.625 20 0 FHADHM Fc1ccccc1C1CCN(c2c(-c3nnn[n-]3)cnc3ccccc32)CC1 ZINC000822792512 599564775 /nfs/dbraw/zinc/56/47/75/599564775.db2.gz ZGMGGHQDLIQGGD-UHFFFAOYSA-N -1 3 374.423 3.938 20 0 FHADHM Fc1ccccc1C1CCN(c2c(-c3nn[n-]n3)cnc3ccccc32)CC1 ZINC000822792512 599564777 /nfs/dbraw/zinc/56/47/77/599564777.db2.gz ZGMGGHQDLIQGGD-UHFFFAOYSA-N -1 3 374.423 3.938 20 0 FHADHM Cc1cccnc1NC(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737437850 599565537 /nfs/dbraw/zinc/56/55/37/599565537.db2.gz ZFHOOYHNZOSOLO-UHFFFAOYSA-N -1 3 371.404 3.566 20 0 FHADHM CC[C@@H](CC(=O)OCc1cccc(-c2nnn[n-]2)c1)c1ccc(C)cc1 ZINC000736335846 599605198 /nfs/dbraw/zinc/60/51/98/599605198.db2.gz WCZBQJGQTRPTBZ-INIZCTEOSA-N -1 3 350.422 3.802 20 0 FHADHM CC[C@@H](CC(=O)OCc1cccc(-c2nn[n-]n2)c1)c1ccc(C)cc1 ZINC000736335846 599605201 /nfs/dbraw/zinc/60/52/01/599605201.db2.gz WCZBQJGQTRPTBZ-INIZCTEOSA-N -1 3 350.422 3.802 20 0 FHADHM Cc1sc(NC(=O)[C@H](C)CCc2cccc(F)c2)c(-c2nnn[n-]2)c1C ZINC000822557980 599628895 /nfs/dbraw/zinc/62/88/95/599628895.db2.gz LFYLDQBDSCTVPD-SNVBAGLBSA-N -1 3 373.457 3.892 20 0 FHADHM Cc1sc(NC(=O)[C@H](C)CCc2cccc(F)c2)c(-c2nn[n-]n2)c1C ZINC000822557980 599628896 /nfs/dbraw/zinc/62/88/96/599628896.db2.gz LFYLDQBDSCTVPD-SNVBAGLBSA-N -1 3 373.457 3.892 20 0 FHADHM Cc1ccc(F)c(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)c1 ZINC000822239991 599632763 /nfs/dbraw/zinc/63/27/63/599632763.db2.gz NPUHUJGRGZKCRS-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM Cc1ccc(F)c(C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)c1 ZINC000822239991 599632764 /nfs/dbraw/zinc/63/27/64/599632764.db2.gz NPUHUJGRGZKCRS-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM O=C(C=Cc1ccccc1)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000822928300 599633154 /nfs/dbraw/zinc/63/31/54/599633154.db2.gz GOCOXEFVEMFWKT-RMKNXTFCSA-N -1 3 359.311 3.537 20 0 FHADHM O=C(C=Cc1ccccc1)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000822928300 599633155 /nfs/dbraw/zinc/63/31/55/599633155.db2.gz GOCOXEFVEMFWKT-RMKNXTFCSA-N -1 3 359.311 3.537 20 0 FHADHM CC(C)CCOc1ccc(NC(=O)c2sccc2-c2nnn[n-]2)cc1 ZINC000820076364 599656611 /nfs/dbraw/zinc/65/66/11/599656611.db2.gz IQHGHHBPBWBEPG-UHFFFAOYSA-N -1 3 357.439 3.605 20 0 FHADHM CC(C)CCOc1ccc(NC(=O)c2sccc2-c2nn[n-]n2)cc1 ZINC000820076364 599656612 /nfs/dbraw/zinc/65/66/12/599656612.db2.gz IQHGHHBPBWBEPG-UHFFFAOYSA-N -1 3 357.439 3.605 20 0 FHADHM C[C@H](C(=O)OCc1ccc(F)cc1-c1nnn[n-]1)c1cccc(Cl)c1 ZINC000819883957 599665679 /nfs/dbraw/zinc/66/56/79/599665679.db2.gz PFLQKRMOJUMGMM-JTQLQIEISA-N -1 3 360.776 3.506 20 0 FHADHM C[C@H](C(=O)OCc1ccc(F)cc1-c1nn[n-]n1)c1cccc(Cl)c1 ZINC000819883957 599665680 /nfs/dbraw/zinc/66/56/80/599665680.db2.gz PFLQKRMOJUMGMM-JTQLQIEISA-N -1 3 360.776 3.506 20 0 FHADHM CC[C@H](C)C[C@H](C)NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C(C)C ZINC000820869574 599678454 /nfs/dbraw/zinc/67/84/54/599678454.db2.gz HYTYOIIFOFKWCR-GJZGRUSLSA-N -1 3 358.490 3.611 20 0 FHADHM CC[C@H](C)C[C@H](C)NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C(C)C ZINC000820869574 599678455 /nfs/dbraw/zinc/67/84/55/599678455.db2.gz HYTYOIIFOFKWCR-GJZGRUSLSA-N -1 3 358.490 3.611 20 0 FHADHM COc1ccc2cc([C@@H](C)OC(=O)c3ccc(-c4nnn[n-]4)cc3)ccc2c1 ZINC000821854813 599684872 /nfs/dbraw/zinc/68/48/72/599684872.db2.gz WMJJWUBJMAYIEH-CYBMUJFWSA-N -1 3 374.400 3.947 20 0 FHADHM COc1ccc2cc([C@@H](C)OC(=O)c3ccc(-c4nn[n-]n4)cc3)ccc2c1 ZINC000821854813 599684873 /nfs/dbraw/zinc/68/48/73/599684873.db2.gz WMJJWUBJMAYIEH-CYBMUJFWSA-N -1 3 374.400 3.947 20 0 FHADHM COc1ccc(C2CCN(c3c(F)cc(-c4nnn[n-]4)cc3F)CC2)cc1 ZINC000821786502 599685759 /nfs/dbraw/zinc/68/57/59/599685759.db2.gz FBDPTUSANCMHOF-UHFFFAOYSA-N -1 3 371.391 3.538 20 0 FHADHM COc1ccc(C2CCN(c3c(F)cc(-c4nn[n-]n4)cc3F)CC2)cc1 ZINC000821786502 599685760 /nfs/dbraw/zinc/68/57/60/599685760.db2.gz FBDPTUSANCMHOF-UHFFFAOYSA-N -1 3 371.391 3.538 20 0 FHADHM C[C@@H](CCOc1ccccc1)C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000820249324 599689384 /nfs/dbraw/zinc/68/93/84/599689384.db2.gz USJRXKUJYMHCHA-LBPRGKRZSA-N -1 3 371.828 3.564 20 0 FHADHM C[C@@H](CCOc1ccccc1)C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000820249324 599689385 /nfs/dbraw/zinc/68/93/85/599689385.db2.gz USJRXKUJYMHCHA-LBPRGKRZSA-N -1 3 371.828 3.564 20 0 FHADHM CC[C@@H]1C[C@H](C)CN1C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000820966919 599693380 /nfs/dbraw/zinc/69/33/80/599693380.db2.gz IUVPKFPXSHSEKL-GXSJLCMTSA-N -1 3 368.363 3.538 20 0 FHADHM CC[C@@H]1C[C@H](C)CN1C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000820966919 599693381 /nfs/dbraw/zinc/69/33/81/599693381.db2.gz IUVPKFPXSHSEKL-GXSJLCMTSA-N -1 3 368.363 3.538 20 0 FHADHM CCN(CC)[C@H](CNC(=O)c1ccccc1NC(=O)[O-])c1ccsc1 ZINC000737086547 599708872 /nfs/dbraw/zinc/70/88/72/599708872.db2.gz ZUNZCTBHAUHWDN-MRXNPFEDSA-N -1 3 361.467 3.651 20 0 FHADHM COc1cc(CN(C)[C@@H](C(=O)[O-])c2ccc(F)cc2)ccc1OC(F)F ZINC000572533150 599709229 /nfs/dbraw/zinc/70/92/29/599709229.db2.gz UPACOGQUEKHBBN-MRXNPFEDSA-N -1 3 369.339 3.693 20 0 FHADHM Cc1ccc(C(=O)[O-])cc1NC(=O)[C@H](C)N1CC[C@@H](c2ccccc2C)C1 ZINC000738518626 599716855 /nfs/dbraw/zinc/71/68/55/599716855.db2.gz MCDLMAWICUHUGV-FUHWJXTLSA-N -1 3 366.461 3.818 20 0 FHADHM CC(C)c1ccccc1NC(=O)NC1(c2cccc(-c3nnn[n-]3)c2)CC1 ZINC000824353056 607391004 /nfs/dbraw/zinc/39/10/04/607391004.db2.gz WFYFWUCFRJRZFD-UHFFFAOYSA-N -1 3 362.437 3.801 20 0 FHADHM CC(C)c1ccccc1NC(=O)NC1(c2cccc(-c3nn[n-]n3)c2)CC1 ZINC000824353056 607391006 /nfs/dbraw/zinc/39/10/06/607391006.db2.gz WFYFWUCFRJRZFD-UHFFFAOYSA-N -1 3 362.437 3.801 20 0 FHADHM CSc1ccccc1C(=O)Nc1ccc(OC(C)C)c(-c2nnn[n-]2)c1 ZINC000821984373 607397701 /nfs/dbraw/zinc/39/77/01/607397701.db2.gz OZLIIFPLIJTWIJ-UHFFFAOYSA-N -1 3 369.450 3.628 20 0 FHADHM CSc1ccccc1C(=O)Nc1ccc(OC(C)C)c(-c2nn[n-]n2)c1 ZINC000821984373 607397702 /nfs/dbraw/zinc/39/77/02/607397702.db2.gz OZLIIFPLIJTWIJ-UHFFFAOYSA-N -1 3 369.450 3.628 20 0 FHADHM 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FHADHM C[C@H](C(=O)[O-])[C@@H](NCC(=O)Nc1ccc2ccccc2c1)c1ccccc1 ZINC000826052981 601657605 /nfs/dbraw/zinc/65/76/05/601657605.db2.gz HQSNPDHRQPCVBR-YCRPNKLZSA-N -1 3 362.429 3.830 20 0 FHADHM O=C([O-])c1ccc(CN(Cc2ccccc2)C[C@@H](O)c2ccco2)cc1F ZINC000833314474 601659030 /nfs/dbraw/zinc/65/90/30/601659030.db2.gz JTFZUFWQEGDQHU-LJQANCHMSA-N -1 3 369.392 3.853 20 0 FHADHM O=C([O-])c1sccc1CNC1(c2ccc3c(c2)OCCO3)CCCC1 ZINC000833349015 601809888 /nfs/dbraw/zinc/80/98/88/601809888.db2.gz YCOIVTRONQCEAX-UHFFFAOYSA-N -1 3 359.447 3.777 20 0 FHADHM C[C@@H](c1nc(-c2cccc(C(F)(F)F)c2)no1)N1CC[C@@](C)(C(=O)[O-])C1 ZINC000263179130 601942243 /nfs/dbraw/zinc/94/22/43/601942243.db2.gz RAYAQAQOIKLTEN-MGPLVRAMSA-N -1 3 369.343 3.613 20 0 FHADHM COc1ccc(CN[C@@H](C(=O)[O-])c2cc(Cl)cc(Cl)c2)cc1OC ZINC000832340299 601971232 /nfs/dbraw/zinc/97/12/32/601971232.db2.gz CJGVXQWEEQIESB-MRXNPFEDSA-N -1 3 370.232 3.926 20 0 FHADHM Cn1nccc1[C@@H]1CCCN([C@H](C(=O)[O-])c2cc(Cl)cc(Cl)c2)C1 ZINC000833060743 602035193 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COc1ccc(CNC[C@@H](NC(=O)[O-])c2ccc(C(C)C)cc2)cc1O ZINC000739903030 602335782 /nfs/dbraw/zinc/33/57/82/602335782.db2.gz JCPBINDEPNGFTJ-QGZVFWFLSA-N -1 3 358.438 3.623 20 0 FHADHM CN(C[C@H]1CCCN(Cc2ccccc2Oc2cccnc2)C1)C(=O)[O-] ZINC000739638471 602398017 /nfs/dbraw/zinc/39/80/17/602398017.db2.gz VLFAHHFSYGGRQO-MRXNPFEDSA-N -1 3 355.438 3.696 20 0 FHADHM CN(C)Cc1cccc(NC(=O)Nc2ccc3c(c2)CCCN3C(=O)[O-])c1 ZINC000739614342 602554142 /nfs/dbraw/zinc/55/41/42/602554142.db2.gz GDMJMQLCKJJFLK-UHFFFAOYSA-N -1 3 368.437 3.823 20 0 FHADHM O=C([O-])Nc1ccc(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1 ZINC000740710739 602602955 /nfs/dbraw/zinc/60/29/55/602602955.db2.gz YLAXJXRNVWKJBP-GOSISDBHSA-N -1 3 368.437 3.735 20 0 FHADHM CC1(C)Cc2cc(CNCc3ccc(CCNC(=O)[O-])cc3)ccc2O1 ZINC000739074721 602647228 /nfs/dbraw/zinc/64/72/28/602647228.db2.gz LLTCXCBQJRFFNX-UHFFFAOYSA-N -1 3 354.450 3.500 20 0 FHADHM C[C@@H](CCNCc1csc(-c2ccc(C(F)(F)F)cc2)n1)NC(=O)[O-] ZINC000738902217 602875770 /nfs/dbraw/zinc/87/57/70/602875770.db2.gz BAEVYMQAASSCNW-JTQLQIEISA-N -1 3 373.400 3.965 20 0 FHADHM Cc1ccc(-c2nc(CN[C@@H](C)[C@H]3CCCN(C(=O)[O-])C3)cs2)cc1 ZINC000740092646 602876837 /nfs/dbraw/zinc/87/68/37/602876837.db2.gz OOJZGUXHQARROU-HOCLYGCPSA-N -1 3 359.495 3.987 20 0 FHADHM C[C@@H]1CCN(C(=O)c2ccc(NC(=O)[O-])cc2)CCN1Cc1ccccc1 ZINC000825943275 603227714 /nfs/dbraw/zinc/22/77/14/603227714.db2.gz BVKHBUJPLXHUDM-MRXNPFEDSA-N -1 3 367.449 3.513 20 0 FHADHM O=C([O-])N1CC[C@H](CN2CCC[C@@H]2c2ccc(Br)cc2)C1 ZINC000740500812 603327698 /nfs/dbraw/zinc/32/76/98/603327698.db2.gz SDNVODPJRSXGMX-IUODEOHRSA-N -1 3 353.260 3.586 20 0 FHADHM CN(C)Cc1ccc(-c2noc(-c3ccc(F)c(NC(=O)[O-])c3)n2)cc1 ZINC000828042688 603637357 /nfs/dbraw/zinc/63/73/57/603637357.db2.gz MKJAHSXPRPEFHV-UHFFFAOYSA-N -1 3 356.357 3.694 20 0 FHADHM C[C@@H](Cc1nc(-c2cccc(-c3nnn[n-]3)c2)cs1)n1cc(Cl)cn1 ZINC000824466812 607643856 /nfs/dbraw/zinc/64/38/56/607643856.db2.gz ZCXHFFZKJSIRAU-JTQLQIEISA-N -1 3 371.857 3.644 20 0 FHADHM C[C@@H](Cc1nc(-c2cccc(-c3nn[n-]n3)c2)cs1)n1cc(Cl)cn1 ZINC000824466812 607643859 /nfs/dbraw/zinc/64/38/59/607643859.db2.gz ZCXHFFZKJSIRAU-JTQLQIEISA-N -1 3 371.857 3.644 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N(C)Cc1ccc2ccccc2c1 ZINC000826243514 607649442 /nfs/dbraw/zinc/64/94/42/607649442.db2.gz KZFYYROEMZTLCD-UHFFFAOYSA-N -1 3 357.417 3.601 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N(C)Cc1ccc2ccccc2c1 ZINC000826243514 607649443 /nfs/dbraw/zinc/64/94/43/607649443.db2.gz KZFYYROEMZTLCD-UHFFFAOYSA-N -1 3 357.417 3.601 20 0 FHADHM C[C@H](SCCC(=O)N(C)c1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824756871 607652851 /nfs/dbraw/zinc/65/28/51/607652851.db2.gz REWNESMLJJGJRP-AWEZNQCLSA-N -1 3 367.478 3.714 20 0 FHADHM C[C@H](SCCC(=O)N(C)c1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824756871 607652852 /nfs/dbraw/zinc/65/28/52/607652852.db2.gz REWNESMLJJGJRP-AWEZNQCLSA-N -1 3 367.478 3.714 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1ccc(Cl)c2cccnc12 ZINC000826249902 607655415 /nfs/dbraw/zinc/65/54/15/607655415.db2.gz AMNWVRDHFGOBLB-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1ccc(Cl)c2cccnc12 ZINC000826249902 607655416 /nfs/dbraw/zinc/65/54/16/607655416.db2.gz AMNWVRDHFGOBLB-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM CN(C(=O)c1cccc(NC(=O)[O-])c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000827945278 603885033 /nfs/dbraw/zinc/88/50/33/603885033.db2.gz MFKYINCHBGQWSZ-LJQANCHMSA-N -1 3 367.449 3.513 20 0 FHADHM Cc1c2ccccc2oc1[C@H](C)NC(=O)c1ccc(-c2nnn[n-]2)cc1C ZINC000826246644 607666980 /nfs/dbraw/zinc/66/69/80/607666980.db2.gz IILXNXVAQFTYRO-ZDUSSCGKSA-N -1 3 361.405 3.721 20 0 FHADHM Cc1c2ccccc2oc1[C@H](C)NC(=O)c1ccc(-c2nn[n-]n2)cc1C ZINC000826246644 607666982 /nfs/dbraw/zinc/66/69/82/607666982.db2.gz IILXNXVAQFTYRO-ZDUSSCGKSA-N -1 3 361.405 3.721 20 0 FHADHM CCCCOc1ccc(NC(=O)c2ccc(-c3nnn[n-]3)cc2C)c(C)c1 ZINC000825290680 607667960 /nfs/dbraw/zinc/66/79/60/607667960.db2.gz DZCDAZMKDXXPCP-UHFFFAOYSA-N -1 3 365.437 3.915 20 0 FHADHM CCCCOc1ccc(NC(=O)c2ccc(-c3nn[n-]n3)cc2C)c(C)c1 ZINC000825290680 607667961 /nfs/dbraw/zinc/66/79/61/607667961.db2.gz DZCDAZMKDXXPCP-UHFFFAOYSA-N -1 3 365.437 3.915 20 0 FHADHM CCCCN(C)c1ccc(NC(=O)c2ccc(-c3nnn[n-]3)cc2C)cc1 ZINC000825281560 607685294 /nfs/dbraw/zinc/68/52/94/607685294.db2.gz FXNXITZSPRMQBQ-UHFFFAOYSA-N -1 3 364.453 3.664 20 0 FHADHM CCCCN(C)c1ccc(NC(=O)c2ccc(-c3nn[n-]n3)cc2C)cc1 ZINC000825281560 607685295 /nfs/dbraw/zinc/68/52/95/607685295.db2.gz FXNXITZSPRMQBQ-UHFFFAOYSA-N -1 3 364.453 3.664 20 0 FHADHM Cc1cc([C@H](C)N2CCC(C(=O)NC3CCCCC3)CC2)oc1C(=O)[O-] ZINC000832871451 604383995 /nfs/dbraw/zinc/38/39/95/604383995.db2.gz ROTZDVCPTAGTBF-AWEZNQCLSA-N -1 3 362.470 3.508 20 0 FHADHM C[C@H](NC(=O)[O-])c1ccc(CNCc2cnc(-c3ccncc3)s2)cc1 ZINC000825402127 604413427 /nfs/dbraw/zinc/41/34/27/604413427.db2.gz HYTFZZSVNSVQOU-ZDUSSCGKSA-N -1 3 368.462 3.824 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N(C)[C@@H](C)Cc1ccc(Cl)cc1 ZINC000826243690 607693493 /nfs/dbraw/zinc/69/34/93/607693493.db2.gz RIPLWMMCTCONNT-ZDUSSCGKSA-N -1 3 369.856 3.532 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N(C)[C@@H](C)Cc1ccc(Cl)cc1 ZINC000826243690 607693494 /nfs/dbraw/zinc/69/34/94/607693494.db2.gz RIPLWMMCTCONNT-ZDUSSCGKSA-N -1 3 369.856 3.532 20 0 FHADHM Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)c2ccc(-c3nnn[n-]3)cc2C)C1 ZINC000826244231 607693783 /nfs/dbraw/zinc/69/37/83/607693783.db2.gz KZRLKCVBUOHIBC-DOTOQJQBSA-N -1 3 361.449 3.502 20 0 FHADHM Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)c2ccc(-c3nn[n-]n3)cc2C)C1 ZINC000826244231 607693785 /nfs/dbraw/zinc/69/37/85/607693785.db2.gz KZRLKCVBUOHIBC-DOTOQJQBSA-N -1 3 361.449 3.502 20 0 FHADHM Cc1cccc([C@H]2CCCN2C(=O)c2ccc(-c3nnn[n-]3)cc2C)c1C ZINC000826244829 607694908 /nfs/dbraw/zinc/69/49/08/607694908.db2.gz DYPHCNCYSKCNLS-LJQANCHMSA-N -1 3 361.449 3.769 20 0 FHADHM Cc1cccc([C@H]2CCCN2C(=O)c2ccc(-c3nn[n-]n3)cc2C)c1C ZINC000826244829 607694910 /nfs/dbraw/zinc/69/49/10/607694910.db2.gz DYPHCNCYSKCNLS-LJQANCHMSA-N -1 3 361.449 3.769 20 0 FHADHM COc1ccc([C@H]2CCCN2Cc2ccc(O[C@@H](C)C(=O)[O-])cc2)cc1 ZINC000833731679 604516201 /nfs/dbraw/zinc/51/62/01/604516201.db2.gz BVEDUSOZCKJNIZ-MGPUTAFESA-N -1 3 355.434 3.884 20 0 FHADHM C[C@@H](Oc1ccc(CN2CC=C(c3ccc(F)cc3)CC2)cc1)C(=O)[O-] ZINC000833542413 604522792 /nfs/dbraw/zinc/52/27/92/604522792.db2.gz RDNXNGLCWYXVPK-OAHLLOKOSA-N -1 3 355.409 3.967 20 0 FHADHM CN(C(=O)Nc1cc(C(=O)[O-])cs1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000830499704 604526497 /nfs/dbraw/zinc/52/64/97/604526497.db2.gz AYQLTZFPLVRKII-INIZCTEOSA-N -1 3 373.478 3.575 20 0 FHADHM O=C([O-])[C@@H]1CC12CCN(CC1=Cc3cc(Cl)cc(Cl)c3OC1)CC2 ZINC000833771580 604648196 /nfs/dbraw/zinc/64/81/96/604648196.db2.gz JQFGUDSYLPHOBV-AWEZNQCLSA-N -1 3 368.260 3.956 20 0 FHADHM CC(C)Oc1cccc(CN(C)Cc2ccc(O[C@H](C)C(=O)[O-])cc2)c1 ZINC000833507551 604679587 /nfs/dbraw/zinc/67/95/87/604679587.db2.gz UUBNTWZUXJNXOG-MRXNPFEDSA-N -1 3 357.450 3.958 20 0 FHADHM CC(C)c1ccccc1OCCC(=O)OCc1ccccc1-c1nnn[n-]1 ZINC000824352606 607719087 /nfs/dbraw/zinc/71/90/87/607719087.db2.gz KCDDCENRLBAEFB-UHFFFAOYSA-N -1 3 366.421 3.502 20 0 FHADHM CC(C)c1ccccc1OCCC(=O)OCc1ccccc1-c1nn[n-]n1 ZINC000824352606 607719088 /nfs/dbraw/zinc/71/90/88/607719088.db2.gz KCDDCENRLBAEFB-UHFFFAOYSA-N -1 3 366.421 3.502 20 0 FHADHM CC(C)(C)OC(=O)Nc1cccc(CN[C@H](C(=O)[O-])c2ccccc2)c1 ZINC000833445103 604920464 /nfs/dbraw/zinc/92/04/64/604920464.db2.gz PSCVZWTXZRAPAP-KRWDZBQOSA-N -1 3 356.422 3.949 20 0 FHADHM CC(C)(C)OC(=O)Nc1cccc(CN[C@@H](C(=O)[O-])c2ccccc2)c1 ZINC000833445106 604920821 /nfs/dbraw/zinc/92/08/21/604920821.db2.gz PSCVZWTXZRAPAP-QGZVFWFLSA-N -1 3 356.422 3.949 20 0 FHADHM CN(C(=O)CN[C@H](c1ccc(F)cc1)C(C)(C)C)c1ccccc1C(=O)[O-] ZINC000833685159 604922239 /nfs/dbraw/zinc/92/22/39/604922239.db2.gz BSGUTDMNSXETFS-LJQANCHMSA-N -1 3 372.440 3.864 20 0 FHADHM CC[C@@H](CC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccc(OC)cc1 ZINC000825082292 607723772 /nfs/dbraw/zinc/72/37/72/607723772.db2.gz RQMZTUQQSCABOJ-LBPRGKRZSA-N -1 3 369.400 3.537 20 0 FHADHM CC[C@@H](CC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccc(OC)cc1 ZINC000825082292 607723775 /nfs/dbraw/zinc/72/37/75/607723775.db2.gz RQMZTUQQSCABOJ-LBPRGKRZSA-N -1 3 369.400 3.537 20 0 FHADHM CC(C)(C)c1ccccc1NC(=O)CN1CCC[C@@H](C(C)(C)C(=O)[O-])C1 ZINC000833449974 604941779 /nfs/dbraw/zinc/94/17/79/604941779.db2.gz SLSDHACWRXKSLL-OAHLLOKOSA-N -1 3 360.498 3.745 20 0 FHADHM O=C([O-])NCCc1ccc(CN[C@@H]2CCSc3ccc(F)cc32)cc1 ZINC000832673329 604943182 /nfs/dbraw/zinc/94/31/82/604943182.db2.gz ZYANHXYJNGOPHK-QGZVFWFLSA-N -1 3 360.454 3.963 20 0 FHADHM Cc1cccc(-c2nnc([C@@H](C)N3CCC[C@@H](C(C)(C)C(=O)[O-])C3)o2)c1 ZINC000833752258 604946903 /nfs/dbraw/zinc/94/69/03/604946903.db2.gz ORJOYXWUHCAZKR-GDBMZVCRSA-N -1 3 357.454 3.929 20 0 FHADHM CC(C)(C(=O)[O-])[C@H]1CCCN(Cc2ccc(F)c(Br)c2)C1 ZINC000135037395 604948326 /nfs/dbraw/zinc/94/83/26/604948326.db2.gz JNFFVEUOSIQTKO-LBPRGKRZSA-N -1 3 358.251 3.911 20 0 FHADHM CC(C)C[C@@H](NC(=O)CN1CCC[C@H](C(C)(C)C(=O)[O-])C1)c1ccccc1 ZINC000833478872 604953504 /nfs/dbraw/zinc/95/35/04/604953504.db2.gz VUUISUDNWPNZNU-RBUKOAKNSA-N -1 3 374.525 3.713 20 0 FHADHM Cc1nc(-c2ccc([C@@H](C)N[C@@H](C(=O)[O-])c3cccnc3)cc2)cs1 ZINC000832990626 604974203 /nfs/dbraw/zinc/97/42/03/604974203.db2.gz HICWMDOMNAKJBU-KZULUSFZSA-N -1 3 353.447 3.990 20 0 FHADHM CCOCCC1(CNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)CC1 ZINC000825589837 607729583 /nfs/dbraw/zinc/72/95/83/607729583.db2.gz KEVWFGQVXNRRSR-UHFFFAOYSA-N -1 3 355.364 3.504 20 0 FHADHM CCOCCC1(CNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)CC1 ZINC000825589837 607729585 /nfs/dbraw/zinc/72/95/85/607729585.db2.gz KEVWFGQVXNRRSR-UHFFFAOYSA-N -1 3 355.364 3.504 20 0 FHADHM C[C@@H](Oc1ccc(CN[C@H]2CC(C)(C)Oc3ccccc32)cc1)C(=O)[O-] ZINC000833541612 605117363 /nfs/dbraw/zinc/11/73/63/605117363.db2.gz RVHUEFMIXVMQLB-KDOFPFPSSA-N -1 3 355.434 3.931 20 0 FHADHM COCc1cccc(CN[C@@H](C(=O)[O-])c2cccc(Br)c2)c1 ZINC000683175358 605180886 /nfs/dbraw/zinc/18/08/86/605180886.db2.gz VWXBEUXVARVZEH-MRXNPFEDSA-N -1 3 364.239 3.511 20 0 FHADHM COc1ccc([C@H]2CCCN2Cc2ccc(OCC(=O)[O-])cc2)cc1OC ZINC000833732220 605293878 /nfs/dbraw/zinc/29/38/78/605293878.db2.gz JBFMCFRVJBOIIB-GOSISDBHSA-N -1 3 371.433 3.504 20 0 FHADHM CN(C(=O)CN[C@H](CC1CCC1)c1ccccc1)c1ccccc1C(=O)[O-] ZINC000833686545 605391346 /nfs/dbraw/zinc/39/13/46/605391346.db2.gz YYRZYRVASFMUQI-LJQANCHMSA-N -1 3 366.461 3.869 20 0 FHADHM O=C([O-])N1CCc2cccc(CN3CCC([C@@H](O)c4ccccc4)CC3)c21 ZINC000834121708 605469947 /nfs/dbraw/zinc/46/99/47/605469947.db2.gz BXLNVAHJKFOIAC-NRFANRHFSA-N -1 3 366.461 3.673 20 0 FHADHM O=C([O-])N1CC[C@@]2(C1)C[C@@H](N[C@H]1CCCc3[nH]ccc31)c1ccccc1O2 ZINC000834082905 605638916 /nfs/dbraw/zinc/63/89/16/605638916.db2.gz FWJPRGDKQPSIHH-UEXGIBASSA-N -1 3 367.449 3.628 20 0 FHADHM O=C(NCc1cc(-c2nnn[n-]2)ccc1F)Nc1cccc2ccsc21 ZINC000826440306 607768346 /nfs/dbraw/zinc/76/83/46/607768346.db2.gz HYEHKTLGQKVUBE-UHFFFAOYSA-N -1 3 368.397 3.542 20 0 FHADHM O=C(NCc1cc(-c2nn[n-]n2)ccc1F)Nc1cccc2ccsc21 ZINC000826440306 607768347 /nfs/dbraw/zinc/76/83/47/607768347.db2.gz HYEHKTLGQKVUBE-UHFFFAOYSA-N -1 3 368.397 3.542 20 0 FHADHM Cn1cc(CN[C@H]2CCc3cc(NC(=O)[O-])ccc32)c(-c2ccccc2)n1 ZINC000833946723 605984156 /nfs/dbraw/zinc/98/41/56/605984156.db2.gz LOIGABGGUNDQNE-IBGZPJMESA-N -1 3 362.433 3.954 20 0 FHADHM OCCCCCCSc1nc(-c2ccccc2)ccc1-c1nnn[n-]1 ZINC000823718707 606022842 /nfs/dbraw/zinc/02/28/42/606022842.db2.gz YSOGLDJJHUKZPR-UHFFFAOYSA-N -1 3 355.467 3.574 20 0 FHADHM OCCCCCCSc1nc(-c2ccccc2)ccc1-c1nn[n-]n1 ZINC000823718707 606022847 /nfs/dbraw/zinc/02/28/47/606022847.db2.gz YSOGLDJJHUKZPR-UHFFFAOYSA-N -1 3 355.467 3.574 20 0 FHADHM C[C@H](Nc1nc2ccccc2cc1-c1nnn[n-]1)c1ccc(F)c(F)c1 ZINC000820462588 606025957 /nfs/dbraw/zinc/02/59/57/606025957.db2.gz YWVDDBRAWDSGHG-JTQLQIEISA-N -1 3 352.348 3.866 20 0 FHADHM C[C@H](Nc1nc2ccccc2cc1-c1nn[n-]n1)c1ccc(F)c(F)c1 ZINC000820462588 606025963 /nfs/dbraw/zinc/02/59/63/606025963.db2.gz YWVDDBRAWDSGHG-JTQLQIEISA-N -1 3 352.348 3.866 20 0 FHADHM CCOc1ccc([C@@H](C)Nc2nc3ccccc3cc2-c2nnn[n-]2)cc1 ZINC000821416919 606029616 /nfs/dbraw/zinc/02/96/16/606029616.db2.gz FPYASGQCUCBPTO-CYBMUJFWSA-N -1 3 360.421 3.987 20 0 FHADHM CCOc1ccc([C@@H](C)Nc2nc3ccccc3cc2-c2nn[n-]n2)cc1 ZINC000821416919 606029619 /nfs/dbraw/zinc/02/96/19/606029619.db2.gz FPYASGQCUCBPTO-CYBMUJFWSA-N -1 3 360.421 3.987 20 0 FHADHM CCO[C@H](CCNc1ccc(-c2nn[n-]n2)cc1C(F)(F)F)C(C)C ZINC000821350824 606039306 /nfs/dbraw/zinc/03/93/06/606039306.db2.gz DWUNINOCHLQHKJ-CQSZACIVSA-N -1 3 357.380 3.749 20 0 FHADHM O=C([O-])N1CCC[C@H](N[C@H](c2cccc(Cl)c2)c2ccccn2)CC1 ZINC000834100069 606044502 /nfs/dbraw/zinc/04/45/02/606044502.db2.gz RUGHVGGYZZEFSJ-FUHWJXTLSA-N -1 3 359.857 3.947 20 0 FHADHM Cc1nc(-c2ccccc2)sc1[C@H](C)Nc1ccc(-c2nnn[n-]2)nc1 ZINC000822424138 606055146 /nfs/dbraw/zinc/05/51/46/606055146.db2.gz RZGOBWQIEVAZFQ-NSHDSACASA-N -1 3 363.450 3.867 20 0 FHADHM Cc1nc(-c2ccccc2)sc1[C@H](C)Nc1ccc(-c2nn[n-]n2)nc1 ZINC000822424138 606055149 /nfs/dbraw/zinc/05/51/49/606055149.db2.gz RZGOBWQIEVAZFQ-NSHDSACASA-N -1 3 363.450 3.867 20 0 FHADHM Cc1ccc(C)n1C1CCN(c2nc3ccccc3cc2-c2nnn[n-]2)CC1 ZINC000822231719 606064624 /nfs/dbraw/zinc/06/46/24/606064624.db2.gz FDDXMRHKTFLHJM-UHFFFAOYSA-N -1 3 373.464 3.675 20 0 FHADHM Cc1ccc(C)n1C1CCN(c2nc3ccccc3cc2-c2nn[n-]n2)CC1 ZINC000822231719 606064630 /nfs/dbraw/zinc/06/46/30/606064630.db2.gz FDDXMRHKTFLHJM-UHFFFAOYSA-N -1 3 373.464 3.675 20 0 FHADHM COc1cc(Cl)ccc1CNc1nc2ccccc2cc1-c1nnn[n-]1 ZINC000821720488 606079389 /nfs/dbraw/zinc/07/93/89/606079389.db2.gz SWQNUEHJZIOVHV-UHFFFAOYSA-N -1 3 366.812 3.689 20 0 FHADHM COc1cc(Cl)ccc1CNc1nc2ccccc2cc1-c1nn[n-]n1 ZINC000821720488 606079394 /nfs/dbraw/zinc/07/93/94/606079394.db2.gz SWQNUEHJZIOVHV-UHFFFAOYSA-N -1 3 366.812 3.689 20 0 FHADHM C[C@@H](C(=O)Nc1ccccc1-c1nnn[n-]1)c1ccc(Cl)c(Cl)c1 ZINC000819877314 606099236 /nfs/dbraw/zinc/09/92/36/606099236.db2.gz SZAQSYVPBFFUOW-SECBINFHSA-N -1 3 362.220 3.916 20 0 FHADHM C[C@@H](C(=O)Nc1ccccc1-c1nn[n-]n1)c1ccc(Cl)c(Cl)c1 ZINC000819877314 606099241 /nfs/dbraw/zinc/09/92/41/606099241.db2.gz SZAQSYVPBFFUOW-SECBINFHSA-N -1 3 362.220 3.916 20 0 FHADHM Cc1cnc([C@@H](C)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)s1 ZINC000822389048 606103809 /nfs/dbraw/zinc/10/38/09/606103809.db2.gz JQVMWIHEGFOWRK-MRVPVSSYSA-N -1 3 354.361 3.824 20 0 FHADHM Cc1cnc([C@@H](C)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)s1 ZINC000822389048 606103811 /nfs/dbraw/zinc/10/38/11/606103811.db2.gz JQVMWIHEGFOWRK-MRVPVSSYSA-N -1 3 354.361 3.824 20 0 FHADHM CCS[C@H]1CCCC[C@H]1Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000821456843 606105903 /nfs/dbraw/zinc/10/59/03/606105903.db2.gz SBIKSVUKZYCZHO-MNOVXSKESA-N -1 3 372.420 3.757 20 0 FHADHM CCS[C@H]1CCCC[C@H]1Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000821456843 606105904 /nfs/dbraw/zinc/10/59/04/606105904.db2.gz SBIKSVUKZYCZHO-MNOVXSKESA-N -1 3 372.420 3.757 20 0 FHADHM CN(Cc1nccs1)Cc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000821608816 606111606 /nfs/dbraw/zinc/11/16/06/606111606.db2.gz WAIWTZLAXQKYQS-UHFFFAOYSA-N -1 3 362.462 3.622 20 0 FHADHM CN(Cc1nccs1)Cc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000821608816 606111607 /nfs/dbraw/zinc/11/16/07/606111607.db2.gz WAIWTZLAXQKYQS-UHFFFAOYSA-N -1 3 362.462 3.622 20 0 FHADHM CC1(C(=O)Nc2ccc(Oc3ccccc3-c3nnn[n-]3)c(F)c2)CCC1 ZINC000820577078 606116918 /nfs/dbraw/zinc/11/69/18/606116918.db2.gz JDOYOTYWHLEUHE-UHFFFAOYSA-N -1 3 367.384 3.927 20 0 FHADHM CC1(C(=O)Nc2ccc(Oc3ccccc3-c3nn[n-]n3)c(F)c2)CCC1 ZINC000820577078 606116920 /nfs/dbraw/zinc/11/69/20/606116920.db2.gz JDOYOTYWHLEUHE-UHFFFAOYSA-N -1 3 367.384 3.927 20 0 FHADHM COc1ccccc1[C@H]1CCCN1c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000821890887 606125028 /nfs/dbraw/zinc/12/50/28/606125028.db2.gz QNQWKNMYYBHLIP-MRXNPFEDSA-N -1 3 355.829 3.870 20 0 FHADHM COc1ccccc1[C@H]1CCCN1c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000821890887 606125029 /nfs/dbraw/zinc/12/50/29/606125029.db2.gz QNQWKNMYYBHLIP-MRXNPFEDSA-N -1 3 355.829 3.870 20 0 FHADHM C[C@H]1c2ccccc2CN1c1c(-c2nnn[n-]2)cnc2c(F)cc(F)cc21 ZINC000820826976 606137737 /nfs/dbraw/zinc/13/77/37/606137737.db2.gz PLWURNYJMSDHOU-JTQLQIEISA-N -1 3 364.359 3.774 20 0 FHADHM C[C@H]1c2ccccc2CN1c1c(-c2nn[n-]n2)cnc2c(F)cc(F)cc21 ZINC000820826976 606137739 /nfs/dbraw/zinc/13/77/39/606137739.db2.gz PLWURNYJMSDHOU-JTQLQIEISA-N -1 3 364.359 3.774 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NCc1ncc(-c2cccc(F)c2)o1 ZINC000822221435 606156476 /nfs/dbraw/zinc/15/64/76/606156476.db2.gz OTDBGVLZGSFMMM-UHFFFAOYSA-N -1 3 350.357 3.581 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NCc1ncc(-c2cccc(F)c2)o1 ZINC000822221435 606156477 /nfs/dbraw/zinc/15/64/77/606156477.db2.gz OTDBGVLZGSFMMM-UHFFFAOYSA-N -1 3 350.357 3.581 20 0 FHADHM CN(C(=O)c1cccc(-c2nnn[n-]2)c1)C1c2ccccc2-c2ccccc21 ZINC000821574569 606183581 /nfs/dbraw/zinc/18/35/81/606183581.db2.gz MLTNGAMNCMPXPG-UHFFFAOYSA-N -1 3 367.412 3.709 20 0 FHADHM CN(C(=O)c1cccc(-c2nn[n-]n2)c1)C1c2ccccc2-c2ccccc21 ZINC000821574569 606183582 /nfs/dbraw/zinc/18/35/82/606183582.db2.gz MLTNGAMNCMPXPG-UHFFFAOYSA-N -1 3 367.412 3.709 20 0 FHADHM O=C(Nc1ccccc1-c1nnn[n-]1)c1cc(C2CC2)nc2ccc(F)cc21 ZINC000823367998 606183695 /nfs/dbraw/zinc/18/36/95/606183695.db2.gz QQUCSFSZCCICIK-UHFFFAOYSA-N -1 3 374.379 3.684 20 0 FHADHM O=C(Nc1ccccc1-c1nn[n-]n1)c1cc(C2CC2)nc2ccc(F)cc21 ZINC000823367998 606183696 /nfs/dbraw/zinc/18/36/96/606183696.db2.gz QQUCSFSZCCICIK-UHFFFAOYSA-N -1 3 374.379 3.684 20 0 FHADHM C[C@@H](NC(=O)c1ccc(OC(C)(C)C)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820396251 606184263 /nfs/dbraw/zinc/18/42/63/606184263.db2.gz DNEWMKYHOYLDMC-CYBMUJFWSA-N -1 3 365.437 3.535 20 0 FHADHM C[C@@H](NC(=O)c1ccc(OC(C)(C)C)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820396251 606184264 /nfs/dbraw/zinc/18/42/64/606184264.db2.gz DNEWMKYHOYLDMC-CYBMUJFWSA-N -1 3 365.437 3.535 20 0 FHADHM CCCCSCCC(=O)Nc1cc(-c2nn[n-]n2)ccc1NCCC ZINC000821077932 606192428 /nfs/dbraw/zinc/19/24/28/606192428.db2.gz XKZGOOLREVUVMC-UHFFFAOYSA-N -1 3 362.503 3.551 20 0 FHADHM Oc1ccc(C2CCN(c3cc(-c4nnn[n-]4)c4ccccc4n3)CC2)cc1 ZINC000823727071 606213969 /nfs/dbraw/zinc/21/39/69/606213969.db2.gz MQEOXWKDVVFKRG-UHFFFAOYSA-N -1 3 372.432 3.505 20 0 FHADHM Oc1ccc(C2CCN(c3cc(-c4nn[n-]n4)c4ccccc4n3)CC2)cc1 ZINC000823727071 606213970 /nfs/dbraw/zinc/21/39/70/606213970.db2.gz MQEOXWKDVVFKRG-UHFFFAOYSA-N -1 3 372.432 3.505 20 0 FHADHM c1ccc(COC[C@@H](Nc2ccc(-c3nnn[n-]3)nc2)c2ccccc2)cc1 ZINC000823788287 606222224 /nfs/dbraw/zinc/22/22/24/606222224.db2.gz XIHIGDSQOYZTET-HXUWFJFHSA-N -1 3 372.432 3.632 20 0 FHADHM c1ccc(COC[C@@H](Nc2ccc(-c3nn[n-]n3)nc2)c2ccccc2)cc1 ZINC000823788287 606222225 /nfs/dbraw/zinc/22/22/25/606222225.db2.gz XIHIGDSQOYZTET-HXUWFJFHSA-N -1 3 372.432 3.632 20 0 FHADHM COC[C@H](Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)c1ccc(C)o1 ZINC000821684375 606223463 /nfs/dbraw/zinc/22/34/63/606223463.db2.gz ZUDPZZMKZGRELL-ZDUSSCGKSA-N -1 3 367.331 3.587 20 0 FHADHM COC[C@H](Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)c1ccc(C)o1 ZINC000821684375 606223464 /nfs/dbraw/zinc/22/34/64/606223464.db2.gz ZUDPZZMKZGRELL-ZDUSSCGKSA-N -1 3 367.331 3.587 20 0 FHADHM C[C@H](Nc1ccc(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)cc1)c1ccccc1 ZINC000820455358 606260208 /nfs/dbraw/zinc/26/02/08/606260208.db2.gz HQKSCNGHISNFDB-ZDUSSCGKSA-N -1 3 373.420 3.620 20 0 FHADHM C[C@H](Nc1ccc(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)cc1)c1ccccc1 ZINC000820455358 606260210 /nfs/dbraw/zinc/26/02/10/606260210.db2.gz HQKSCNGHISNFDB-ZDUSSCGKSA-N -1 3 373.420 3.620 20 0 FHADHM CCCCc1ccc(N[C@H](C(=O)OC)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000821077685 606299307 /nfs/dbraw/zinc/29/93/07/606299307.db2.gz QAGISKSHEBDQOQ-SFHVURJKSA-N -1 3 365.437 3.536 20 0 FHADHM CCCCc1ccc(N[C@H](C(=O)OC)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000821077685 606299309 /nfs/dbraw/zinc/29/93/09/606299309.db2.gz QAGISKSHEBDQOQ-SFHVURJKSA-N -1 3 365.437 3.536 20 0 FHADHM FC(F)n1c(CSc2cccc(-c3nnn[n-]3)c2)nc2ccccc21 ZINC000822736845 606324410 /nfs/dbraw/zinc/32/44/10/606324410.db2.gz LAYNCUOQWDSECC-UHFFFAOYSA-N -1 3 358.377 3.904 20 0 FHADHM FC(F)n1c(CSc2cccc(-c3nn[n-]n3)c2)nc2ccccc21 ZINC000822736845 606324412 /nfs/dbraw/zinc/32/44/12/606324412.db2.gz LAYNCUOQWDSECC-UHFFFAOYSA-N -1 3 358.377 3.904 20 0 FHADHM Cc1c(Cl)cccc1NC(=O)[C@@H](C)Sc1cccc(-c2nnn[n-]2)c1 ZINC000822035701 606326345 /nfs/dbraw/zinc/32/63/45/606326345.db2.gz YJMJNQWEWMBBKH-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM Cc1c(Cl)cccc1NC(=O)[C@@H](C)Sc1cccc(-c2nn[n-]n2)c1 ZINC000822035701 606326347 /nfs/dbraw/zinc/32/63/47/606326347.db2.gz YJMJNQWEWMBBKH-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM Cn1c(CSc2cccc(-c3nnn[n-]3)c2)nc2cc(Cl)ccc21 ZINC000822595685 606328172 /nfs/dbraw/zinc/32/81/72/606328172.db2.gz BLGZKTJTSBNYQX-UHFFFAOYSA-N -1 3 356.842 3.699 20 0 FHADHM Cn1c(CSc2cccc(-c3nn[n-]n3)c2)nc2cc(Cl)ccc21 ZINC000822595685 606328174 /nfs/dbraw/zinc/32/81/74/606328174.db2.gz BLGZKTJTSBNYQX-UHFFFAOYSA-N -1 3 356.842 3.699 20 0 FHADHM C[C@@H](OC(=O)[C@H](C)Oc1ccccc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000820550200 606339485 /nfs/dbraw/zinc/33/94/85/606339485.db2.gz VTJUXLXKEWOKPB-NEPJUHHUSA-N -1 3 372.812 3.592 20 0 FHADHM C[C@@H](OC(=O)[C@H](C)Oc1ccccc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000820550200 606339487 /nfs/dbraw/zinc/33/94/87/606339487.db2.gz VTJUXLXKEWOKPB-NEPJUHHUSA-N -1 3 372.812 3.592 20 0 FHADHM Cc1cccc(CSCC(=O)O[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000822303711 606341618 /nfs/dbraw/zinc/34/16/18/606341618.db2.gz GNIPSYBKHMNSMN-AWEZNQCLSA-N -1 3 368.462 3.713 20 0 FHADHM Cc1cccc(CSCC(=O)O[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000822303711 606341620 /nfs/dbraw/zinc/34/16/20/606341620.db2.gz GNIPSYBKHMNSMN-AWEZNQCLSA-N -1 3 368.462 3.713 20 0 FHADHM Cc1ccc2cccc(C(=O)O[C@@H](C)c3ccc(-c4nnn[n-]4)cc3)c2n1 ZINC000822280309 606346890 /nfs/dbraw/zinc/34/68/90/606346890.db2.gz KAWBHWRSJNGBOD-ZDUSSCGKSA-N -1 3 359.389 3.641 20 0 FHADHM Cc1ccc2cccc(C(=O)O[C@@H](C)c3ccc(-c4nn[n-]n4)cc3)c2n1 ZINC000822280309 606346892 /nfs/dbraw/zinc/34/68/92/606346892.db2.gz KAWBHWRSJNGBOD-ZDUSSCGKSA-N -1 3 359.389 3.641 20 0 FHADHM C[C@H](OC(=O)CCSc1ccccc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000820498183 606349477 /nfs/dbraw/zinc/34/94/77/606349477.db2.gz ZCIKBPUNFAYNQE-LBPRGKRZSA-N -1 3 372.425 3.792 20 0 FHADHM C[C@H](OC(=O)CCSc1ccccc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000820498183 606349479 /nfs/dbraw/zinc/34/94/79/606349479.db2.gz ZCIKBPUNFAYNQE-LBPRGKRZSA-N -1 3 372.425 3.792 20 0 FHADHM CSCc1ccc(C(=O)O[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000821971055 606349867 /nfs/dbraw/zinc/34/98/67/606349867.db2.gz WPVKETLBHGPHPR-GFCCVEGCSA-N -1 3 354.435 3.648 20 0 FHADHM CSCc1ccc(C(=O)O[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000821971055 606349868 /nfs/dbraw/zinc/34/98/68/606349868.db2.gz WPVKETLBHGPHPR-GFCCVEGCSA-N -1 3 354.435 3.648 20 0 FHADHM CS[C@@H](C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000821943960 606356780 /nfs/dbraw/zinc/35/67/80/606356780.db2.gz YPWLQYMNXYQOED-BLLLJJGKSA-N -1 3 354.435 3.575 20 0 FHADHM CS[C@@H](C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000821943960 606356782 /nfs/dbraw/zinc/35/67/82/606356782.db2.gz YPWLQYMNXYQOED-BLLLJJGKSA-N -1 3 354.435 3.575 20 0 FHADHM Cc1ccccc1SCC(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000822366380 606358979 /nfs/dbraw/zinc/35/89/79/606358979.db2.gz JBLBHWZTWLQGDQ-ZDUSSCGKSA-N -1 3 354.435 3.572 20 0 FHADHM Cc1ccccc1SCC(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000822366380 606358980 /nfs/dbraw/zinc/35/89/80/606358980.db2.gz JBLBHWZTWLQGDQ-ZDUSSCGKSA-N -1 3 354.435 3.572 20 0 FHADHM C[C@@H](OC(=O)c1csc(-c2ccoc2)n1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820518675 606359148 /nfs/dbraw/zinc/35/91/48/606359148.db2.gz ISZGILRINDTKHE-SNVBAGLBSA-N -1 3 367.390 3.501 20 0 FHADHM C[C@@H](OC(=O)c1csc(-c2ccoc2)n1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820518675 606359149 /nfs/dbraw/zinc/35/91/49/606359149.db2.gz ISZGILRINDTKHE-SNVBAGLBSA-N -1 3 367.390 3.501 20 0 FHADHM C[C@H](OC(=O)[C@H]1C[C@H]1c1cc(F)ccc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000820487749 606359630 /nfs/dbraw/zinc/35/96/30/606359630.db2.gz IKXLYOMIUFIWRP-FSBGKCOPSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@H]1C[C@H]1c1cc(F)ccc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000820487749 606359631 /nfs/dbraw/zinc/35/96/31/606359631.db2.gz IKXLYOMIUFIWRP-FSBGKCOPSA-N -1 3 370.359 3.553 20 0 FHADHM CC(C)SCC(=O)Oc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000820183688 606360462 /nfs/dbraw/zinc/36/04/62/606360462.db2.gz IXNQNJKKPASPJI-UHFFFAOYSA-N -1 3 370.434 3.706 20 0 FHADHM CC(C)SCC(=O)Oc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000820183688 606360464 /nfs/dbraw/zinc/36/04/64/606360464.db2.gz IXNQNJKKPASPJI-UHFFFAOYSA-N -1 3 370.434 3.706 20 0 FHADHM CC[C@H](Oc1ccccc1Cl)C(=O)Nc1cc(-c2nnn[n-]2)ccc1C ZINC000820938456 606362269 /nfs/dbraw/zinc/36/22/69/606362269.db2.gz JBWPHVALTXIATI-HNNXBMFYSA-N -1 3 371.828 3.625 20 0 FHADHM CC[C@H](Oc1ccccc1Cl)C(=O)Nc1cc(-c2nn[n-]n2)ccc1C ZINC000820938456 606362271 /nfs/dbraw/zinc/36/22/71/606362271.db2.gz JBWPHVALTXIATI-HNNXBMFYSA-N -1 3 371.828 3.625 20 0 FHADHM CN(C(=O)c1ccc2ccccc2c1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821574722 606412667 /nfs/dbraw/zinc/41/26/67/606412667.db2.gz UIFYFRNUJJUFTN-UHFFFAOYSA-N -1 3 363.808 3.950 20 0 FHADHM CN(C(=O)c1ccc2ccccc2c1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821574722 606412668 /nfs/dbraw/zinc/41/26/68/606412668.db2.gz UIFYFRNUJJUFTN-UHFFFAOYSA-N -1 3 363.808 3.950 20 0 FHADHM Cc1ccc(SCC(=O)N(C)c2cc(Cl)ccc2-c2nnn[n-]2)cc1 ZINC000822267054 606413077 /nfs/dbraw/zinc/41/30/77/606413077.db2.gz MTRXWCYKQPGIKC-UHFFFAOYSA-N -1 3 373.869 3.584 20 0 FHADHM Cc1ccc(SCC(=O)N(C)c2cc(Cl)ccc2-c2nn[n-]n2)cc1 ZINC000822267054 606413078 /nfs/dbraw/zinc/41/30/78/606413078.db2.gz MTRXWCYKQPGIKC-UHFFFAOYSA-N -1 3 373.869 3.584 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)N1CCCC[C@@H]1c1ccc(F)cc1 ZINC000823308835 606439711 /nfs/dbraw/zinc/43/97/11/606439711.db2.gz KSWLQLDYWCOZID-QGZVFWFLSA-N -1 3 366.400 3.765 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)N1CCCC[C@@H]1c1ccc(F)cc1 ZINC000823308835 606439712 /nfs/dbraw/zinc/43/97/12/606439712.db2.gz KSWLQLDYWCOZID-QGZVFWFLSA-N -1 3 366.400 3.765 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1NCc1csc(-c2ccccc2)n1 ZINC000822748089 606445097 /nfs/dbraw/zinc/44/50/97/606445097.db2.gz HCLJHNUFXZREFW-UHFFFAOYSA-N -1 3 352.398 3.741 20 0 FHADHM FC(F)(F)c1cc(-c2nn[n-]n2)ccc1N1CCC[C@H]1c1cccnc1 ZINC000822718288 606445127 /nfs/dbraw/zinc/44/51/27/606445127.db2.gz GTLYOBAHWRJSCJ-AWEZNQCLSA-N -1 3 360.343 3.622 20 0 FHADHM C[C@H](Nc1c(F)cc(-c2nnn[n-]2)cc1F)c1ccc(OC(F)F)cc1 ZINC000820449690 606447597 /nfs/dbraw/zinc/44/75/97/606447597.db2.gz APPPNBKZGPVJOH-QMMMGPOBSA-N -1 3 367.306 3.919 20 0 FHADHM C[C@H](Nc1c(F)cc(-c2nn[n-]n2)cc1F)c1ccc(OC(F)F)cc1 ZINC000820449690 606447599 /nfs/dbraw/zinc/44/75/99/606447599.db2.gz APPPNBKZGPVJOH-QMMMGPOBSA-N -1 3 367.306 3.919 20 0 FHADHM COc1ccc(NCc2cc(-c3nnn[n-]3)ccc2F)c(C(F)(F)F)c1 ZINC000821835410 606449018 /nfs/dbraw/zinc/44/90/18/606449018.db2.gz KDJAILJVNNHIDJ-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM COc1ccc(NCc2cc(-c3nn[n-]n3)ccc2F)c(C(F)(F)F)c1 ZINC000821835410 606449019 /nfs/dbraw/zinc/44/90/19/606449019.db2.gz KDJAILJVNNHIDJ-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM CCOCCOc1ccc(Cl)cc1NCc1cccc(-c2nnn[n-]2)c1 ZINC000821383903 606456943 /nfs/dbraw/zinc/45/69/43/606456943.db2.gz KVGPQLGFEOQKEJ-UHFFFAOYSA-N -1 3 373.844 3.548 20 0 FHADHM CCOCCOc1ccc(Cl)cc1NCc1cccc(-c2nn[n-]n2)c1 ZINC000821383903 606456944 /nfs/dbraw/zinc/45/69/44/606456944.db2.gz KVGPQLGFEOQKEJ-UHFFFAOYSA-N -1 3 373.844 3.548 20 0 FHADHM Fc1ccc([C@@H]2CCCCN2c2ncc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000822766156 606476023 /nfs/dbraw/zinc/47/60/23/606476023.db2.gz FLEVCPSHAAMMOC-HNNXBMFYSA-N -1 3 358.808 3.786 20 0 FHADHM Fc1ccc([C@@H]2CCCCN2c2ncc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000822766156 606476024 /nfs/dbraw/zinc/47/60/24/606476024.db2.gz FLEVCPSHAAMMOC-HNNXBMFYSA-N -1 3 358.808 3.786 20 0 FHADHM CSc1nc2ccc(NC(=O)c3cc(-c4nnn[n-]4)cs3)cc2s1 ZINC000821990857 606478601 /nfs/dbraw/zinc/47/86/01/606478601.db2.gz XCHCJBYPVBVQEM-UHFFFAOYSA-N -1 3 374.476 3.512 20 0 FHADHM CSc1nc2ccc(NC(=O)c3cc(-c4nn[n-]n4)cs3)cc2s1 ZINC000821990857 606478603 /nfs/dbraw/zinc/47/86/03/606478603.db2.gz XCHCJBYPVBVQEM-UHFFFAOYSA-N -1 3 374.476 3.512 20 0 FHADHM Cc1ccc(-c2csc(NC(=O)c3cc(-c4nnn[n-]4)cs3)n2)cc1 ZINC000822213811 606478729 /nfs/dbraw/zinc/47/87/29/606478729.db2.gz BITPKDUOLMYTOO-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM Cc1ccc(-c2csc(NC(=O)c3cc(-c4nn[n-]n4)cs3)n2)cc1 ZINC000822213811 606478731 /nfs/dbraw/zinc/47/87/31/606478731.db2.gz BITPKDUOLMYTOO-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM O=C(Nc1ccccc1N1CCCCCC1)c1cc(-c2nnn[n-]2)cs1 ZINC000823373304 606488382 /nfs/dbraw/zinc/48/83/82/606488382.db2.gz WJUWKMHSWCMDEV-UHFFFAOYSA-N -1 3 368.466 3.561 20 0 FHADHM O=C(Nc1ccccc1N1CCCCCC1)c1cc(-c2nn[n-]n2)cs1 ZINC000823373304 606488383 /nfs/dbraw/zinc/48/83/83/606488383.db2.gz WJUWKMHSWCMDEV-UHFFFAOYSA-N -1 3 368.466 3.561 20 0 FHADHM Cc1cscc1C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCCC2 ZINC000822414691 606489300 /nfs/dbraw/zinc/48/93/00/606489300.db2.gz PYLVGPFAYTUEDS-UHFFFAOYSA-N -1 3 359.480 3.819 20 0 FHADHM Cc1cscc1C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCCC2 ZINC000822414691 606489302 /nfs/dbraw/zinc/48/93/02/606489302.db2.gz PYLVGPFAYTUEDS-UHFFFAOYSA-N -1 3 359.480 3.819 20 0 FHADHM Cc1cccc(CN(CC(C)C)C(=O)c2cc(-c3nnn[n-]3)cs2)c1 ZINC000822304064 606492598 /nfs/dbraw/zinc/49/25/98/606492598.db2.gz PDICDBUCDHEVII-UHFFFAOYSA-N -1 3 355.467 3.535 20 0 FHADHM Cc1cccc(CN(CC(C)C)C(=O)c2cc(-c3nn[n-]n3)cs2)c1 ZINC000822304064 606492599 /nfs/dbraw/zinc/49/25/99/606492599.db2.gz PDICDBUCDHEVII-UHFFFAOYSA-N -1 3 355.467 3.535 20 0 FHADHM CC(C)(C)[C@H](NC(=O)c1cc(-c2nnn[n-]2)cs1)c1ccc(F)cc1 ZINC000819899293 606493513 /nfs/dbraw/zinc/49/35/13/606493513.db2.gz QKOAJOGPMLNTDL-CQSZACIVSA-N -1 3 359.430 3.585 20 0 FHADHM CC(C)(C)[C@H](NC(=O)c1cc(-c2nn[n-]n2)cs1)c1ccc(F)cc1 ZINC000819899293 606493514 /nfs/dbraw/zinc/49/35/14/606493514.db2.gz QKOAJOGPMLNTDL-CQSZACIVSA-N -1 3 359.430 3.585 20 0 FHADHM CCN(Cc1ccc2ccccc2c1)C(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000821220558 606497266 /nfs/dbraw/zinc/49/72/66/606497266.db2.gz BSXSBINNYKCGHS-UHFFFAOYSA-N -1 3 363.446 3.744 20 0 FHADHM CCN(Cc1ccc2ccccc2c1)C(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000821220558 606497268 /nfs/dbraw/zinc/49/72/68/606497268.db2.gz BSXSBINNYKCGHS-UHFFFAOYSA-N -1 3 363.446 3.744 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)c1ccc2ccc(Cl)cc2n1 ZINC000822220553 606500906 /nfs/dbraw/zinc/50/09/06/606500906.db2.gz WNFZHAGSSUKFKN-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)c1ccc2ccc(Cl)cc2n1 ZINC000822220553 606500908 /nfs/dbraw/zinc/50/09/08/606500908.db2.gz WNFZHAGSSUKFKN-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM CCN(C(=O)c1ccc(C)cc1F)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821160438 606505234 /nfs/dbraw/zinc/50/52/34/606505234.db2.gz KUZBKPKBUVBZQT-CYBMUJFWSA-N -1 3 353.401 3.538 20 0 FHADHM CCN(C(=O)c1ccc(C)cc1F)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821160438 606505236 /nfs/dbraw/zinc/50/52/36/606505236.db2.gz KUZBKPKBUVBZQT-CYBMUJFWSA-N -1 3 353.401 3.538 20 0 FHADHM O=C(Nc1ccc(NC2CCCCC2)cc1)c1cc(-c2nnn[n-]2)cs1 ZINC000823350261 606556440 /nfs/dbraw/zinc/55/64/40/606556440.db2.gz GLHZPOJWFUGNGT-UHFFFAOYSA-N -1 3 368.466 3.925 20 0 FHADHM O=C(Nc1ccc(NC2CCCCC2)cc1)c1cc(-c2nn[n-]n2)cs1 ZINC000823350261 606556441 /nfs/dbraw/zinc/55/64/41/606556441.db2.gz GLHZPOJWFUGNGT-UHFFFAOYSA-N -1 3 368.466 3.925 20 0 FHADHM C[C@H]1CCCN1C(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)cc1 ZINC000820708962 606574201 /nfs/dbraw/zinc/57/42/01/606574201.db2.gz AXNURKIBHZXMJR-ZDUSSCGKSA-N -1 3 364.409 3.675 20 0 FHADHM C[C@H]1CCCN1C(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)cc1 ZINC000820708962 606574203 /nfs/dbraw/zinc/57/42/03/606574203.db2.gz AXNURKIBHZXMJR-ZDUSSCGKSA-N -1 3 364.409 3.675 20 0 FHADHM CC1(CNC(=O)Nc2cccc(Oc3ccc(-c4nnn[n-]4)cc3)c2)CC1 ZINC000820618526 606577687 /nfs/dbraw/zinc/57/76/87/606577687.db2.gz HISYQEAHPLBVHW-UHFFFAOYSA-N -1 3 364.409 3.581 20 0 FHADHM CC1(CNC(=O)Nc2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)CC1 ZINC000820618526 606577689 /nfs/dbraw/zinc/57/76/89/606577689.db2.gz HISYQEAHPLBVHW-UHFFFAOYSA-N -1 3 364.409 3.581 20 0 FHADHM Fc1ccc(CSCc2cn3cc(Cl)ccc3n2)c(-c2nnn[n-]2)c1 ZINC000822775605 606599630 /nfs/dbraw/zinc/59/96/30/606599630.db2.gz YJNFFOSRAKYOTR-UHFFFAOYSA-N -1 3 374.832 3.740 20 0 FHADHM Fc1ccc(CSCc2cn3cc(Cl)ccc3n2)c(-c2nn[n-]n2)c1 ZINC000822775605 606599632 /nfs/dbraw/zinc/59/96/32/606599632.db2.gz YJNFFOSRAKYOTR-UHFFFAOYSA-N -1 3 374.832 3.740 20 0 FHADHM c1sc(CCc2ccccc2)nc1COc1cccc(-c2nnn[n-]2)c1 ZINC000823779494 606601692 /nfs/dbraw/zinc/60/16/92/606601692.db2.gz FAXHIGILSXHIJJ-UHFFFAOYSA-N -1 3 363.446 3.687 20 0 FHADHM c1sc(CCc2ccccc2)nc1COc1cccc(-c2nn[n-]n2)c1 ZINC000823779494 606601693 /nfs/dbraw/zinc/60/16/93/606601693.db2.gz FAXHIGILSXHIJJ-UHFFFAOYSA-N -1 3 363.446 3.687 20 0 FHADHM O=C(c1cccc(-c2nnn[n-]2)c1)N1CCCCC[C@@H]1/C=C/c1ccccc1 ZINC000823487737 606626317 /nfs/dbraw/zinc/62/63/17/606626317.db2.gz GYHSNWBFAOBXOB-FBRRREGBSA-N -1 3 373.460 3.965 20 0 FHADHM O=C(c1cccc(-c2nn[n-]n2)c1)N1CCCCC[C@@H]1/C=C/c1ccccc1 ZINC000823487737 606626319 /nfs/dbraw/zinc/62/63/19/606626319.db2.gz GYHSNWBFAOBXOB-FBRRREGBSA-N -1 3 373.460 3.965 20 0 FHADHM CC[C@@H](C)Oc1ccc(C(=O)N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000820875752 606626461 /nfs/dbraw/zinc/62/64/61/606626461.db2.gz DVZXBJXHFCFLPG-ZIAGYGMSSA-N -1 3 365.437 3.535 20 0 FHADHM CC[C@@H](C)Oc1ccc(C(=O)N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000820875752 606626462 /nfs/dbraw/zinc/62/64/62/606626462.db2.gz DVZXBJXHFCFLPG-ZIAGYGMSSA-N -1 3 365.437 3.535 20 0 FHADHM C[C@@H](OC(=O)C/C=C/c1ccc(F)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000820486769 606626737 /nfs/dbraw/zinc/62/67/37/606626737.db2.gz CUIIUJSLAKSWDH-CXLRFSCWSA-N -1 3 352.369 3.714 20 0 FHADHM C[C@@H](OC(=O)C/C=C/c1ccc(F)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000820486769 606626739 /nfs/dbraw/zinc/62/67/39/606626739.db2.gz CUIIUJSLAKSWDH-CXLRFSCWSA-N -1 3 352.369 3.714 20 0 FHADHM O=C(Nc1ccc(Cl)cc1Cl)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000823332812 606664274 /nfs/dbraw/zinc/66/42/74/606664274.db2.gz RQVSTIZJIBYSGE-UHFFFAOYSA-N -1 3 370.146 3.704 20 0 FHADHM O=C(Nc1ccc(Cl)cc1Cl)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000823332812 606664275 /nfs/dbraw/zinc/66/42/75/606664275.db2.gz RQVSTIZJIBYSGE-UHFFFAOYSA-N -1 3 370.146 3.704 20 0 FHADHM Cc1cc(C)c(NC(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)c(Cl)c1 ZINC000822194361 606665397 /nfs/dbraw/zinc/66/53/97/606665397.db2.gz UCPAOSSXQZMRHA-UHFFFAOYSA-N -1 3 363.755 3.667 20 0 FHADHM Cc1cc(C)c(NC(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)c(Cl)c1 ZINC000822194361 606665398 /nfs/dbraw/zinc/66/53/98/606665398.db2.gz UCPAOSSXQZMRHA-UHFFFAOYSA-N -1 3 363.755 3.667 20 0 FHADHM CCCCN(C(=O)c1c(F)cc(-c2nnn[n-]2)cc1F)C1CCCCC1 ZINC000821060357 606670510 /nfs/dbraw/zinc/67/05/10/606670510.db2.gz BPNQXLDHMYVBJX-UHFFFAOYSA-N -1 3 363.412 3.720 20 0 FHADHM CCCCN(C(=O)c1c(F)cc(-c2nn[n-]n2)cc1F)C1CCCCC1 ZINC000821060357 606670511 /nfs/dbraw/zinc/67/05/11/606670511.db2.gz BPNQXLDHMYVBJX-UHFFFAOYSA-N -1 3 363.412 3.720 20 0 FHADHM CCCCOc1cccc(NC(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)c1 ZINC000821077382 606672864 /nfs/dbraw/zinc/67/28/64/606672864.db2.gz CWOGATLECFAJKR-UHFFFAOYSA-N -1 3 373.363 3.576 20 0 FHADHM CCCCOc1cccc(NC(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)c1 ZINC000821077382 606672865 /nfs/dbraw/zinc/67/28/65/606672865.db2.gz CWOGATLECFAJKR-UHFFFAOYSA-N -1 3 373.363 3.576 20 0 FHADHM CC(C)[C@@H](c1ccccc1)N(C)C(=O)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000820032341 606678748 /nfs/dbraw/zinc/67/87/48/606678748.db2.gz MFIVOJWZHXHRRF-KRWDZBQOSA-N -1 3 371.391 3.614 20 0 FHADHM CC(C)[C@@H](c1ccccc1)N(C)C(=O)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000820032341 606678749 /nfs/dbraw/zinc/67/87/49/606678749.db2.gz MFIVOJWZHXHRRF-KRWDZBQOSA-N -1 3 371.391 3.614 20 0 FHADHM CC[C@@H]1CCN(C(=O)c2cccc(Oc3ccc(-c4nnn[n-]4)cc3)c2)C1 ZINC000820989477 606689663 /nfs/dbraw/zinc/68/96/63/606689663.db2.gz UHZXNEDHNVQZGP-CQSZACIVSA-N -1 3 363.421 3.531 20 0 FHADHM CC[C@@H]1CCN(C(=O)c2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)C1 ZINC000820989477 606689664 /nfs/dbraw/zinc/68/96/64/606689664.db2.gz UHZXNEDHNVQZGP-CQSZACIVSA-N -1 3 363.421 3.531 20 0 FHADHM O=C(N[C@@H](c1ccccc1F)C1CCCC1)c1sccc1-c1nnn[n-]1 ZINC000823140376 606693739 /nfs/dbraw/zinc/69/37/39/606693739.db2.gz UMGKQGHIGGURBC-OAHLLOKOSA-N -1 3 371.441 3.729 20 0 FHADHM O=C(N[C@@H](c1ccccc1F)C1CCCC1)c1sccc1-c1nn[n-]n1 ZINC000823140376 606693740 /nfs/dbraw/zinc/69/37/40/606693740.db2.gz UMGKQGHIGGURBC-OAHLLOKOSA-N -1 3 371.441 3.729 20 0 FHADHM C[C@@H](NC(=O)N(C)C1CCC(C)(C)CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820339238 606696136 /nfs/dbraw/zinc/69/61/36/606696136.db2.gz AJIJDKPKTIEVRT-CYBMUJFWSA-N -1 3 356.474 3.538 20 0 FHADHM C[C@@H](NC(=O)N(C)C1CCC(C)(C)CC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820339238 606696137 /nfs/dbraw/zinc/69/61/37/606696137.db2.gz AJIJDKPKTIEVRT-CYBMUJFWSA-N -1 3 356.474 3.538 20 0 FHADHM CC(C)Sc1ccccc1NC(=O)CCc1ccc(-c2nnn[n-]2)cc1 ZINC000820183911 606744937 /nfs/dbraw/zinc/74/49/37/606744937.db2.gz MDYZEAGLWZBDLG-UHFFFAOYSA-N -1 3 367.478 3.939 20 0 FHADHM CC(C)Sc1ccccc1NC(=O)CCc1ccc(-c2nn[n-]n2)cc1 ZINC000820183911 606744939 /nfs/dbraw/zinc/74/49/39/606744939.db2.gz MDYZEAGLWZBDLG-UHFFFAOYSA-N -1 3 367.478 3.939 20 0 FHADHM O=C(OCc1ccc2ccccc2c1)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000823426907 606756340 /nfs/dbraw/zinc/75/63/40/606756340.db2.gz QJFBSLVLDNSPJU-UHFFFAOYSA-N -1 3 366.327 3.655 20 0 FHADHM O=C(OCc1ccc2ccccc2c1)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000823426907 606756341 /nfs/dbraw/zinc/75/63/41/606756341.db2.gz QJFBSLVLDNSPJU-UHFFFAOYSA-N -1 3 366.327 3.655 20 0 FHADHM C[C@@H](OC1CCCCCC1)C(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820519288 606759589 /nfs/dbraw/zinc/75/95/89/606759589.db2.gz QTKAGTPUKNDVOT-UONOGXRCSA-N -1 3 358.442 3.599 20 0 FHADHM C[C@@H](OC1CCCCCC1)C(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820519288 606759590 /nfs/dbraw/zinc/75/95/90/606759590.db2.gz QTKAGTPUKNDVOT-UONOGXRCSA-N -1 3 358.442 3.599 20 0 FHADHM Cc1nnc(-c2cccc(-c3nnn[n-]3)c2)n1CC[C@@H]1CCC[C@H](C)C1 ZINC000822505457 606769881 /nfs/dbraw/zinc/76/98/81/606769881.db2.gz LBDAVPBVMPDZGT-ZFWWWQNUSA-N -1 3 351.458 3.650 20 0 FHADHM Cc1nnc(-c2cccc(-c3nn[n-]n3)c2)n1CC[C@@H]1CCC[C@H](C)C1 ZINC000822505457 606769883 /nfs/dbraw/zinc/76/98/83/606769883.db2.gz LBDAVPBVMPDZGT-ZFWWWQNUSA-N -1 3 351.458 3.650 20 0 FHADHM Cc1nnc(-c2cccc(-c3nnn[n-]3)c2)n1CC[C@H]1CCC[C@@H](C)C1 ZINC000822505456 606769992 /nfs/dbraw/zinc/76/99/92/606769992.db2.gz LBDAVPBVMPDZGT-UKRRQHHQSA-N -1 3 351.458 3.650 20 0 FHADHM Cc1nnc(-c2cccc(-c3nn[n-]n3)c2)n1CC[C@H]1CCC[C@@H](C)C1 ZINC000822505456 606769993 /nfs/dbraw/zinc/76/99/93/606769993.db2.gz LBDAVPBVMPDZGT-UKRRQHHQSA-N -1 3 351.458 3.650 20 0 FHADHM Cc1ccc(C)c([C@@H]2CCCN2C(=O)C=Cc2ccccc2-c2nnn[n-]2)c1 ZINC000822230774 606807842 /nfs/dbraw/zinc/80/78/42/606807842.db2.gz QEMWRZVPSMPGGW-DUQGCJEPSA-N -1 3 373.460 3.860 20 0 FHADHM Cc1ccc(C)c([C@@H]2CCCN2C(=O)C=Cc2ccccc2-c2nn[n-]n2)c1 ZINC000822230774 606807844 /nfs/dbraw/zinc/80/78/44/606807844.db2.gz QEMWRZVPSMPGGW-DUQGCJEPSA-N -1 3 373.460 3.860 20 0 FHADHM Cc1ccc(C)c([C@H]2CCCN2C(=O)c2sccc2-c2nnn[n-]2)c1 ZINC000822230633 606817110 /nfs/dbraw/zinc/81/71/10/606817110.db2.gz MDVNZIOUGVLZKG-OAHLLOKOSA-N -1 3 353.451 3.522 20 0 FHADHM Cc1ccc(C)c([C@H]2CCCN2C(=O)c2sccc2-c2nn[n-]n2)c1 ZINC000822230633 606817111 /nfs/dbraw/zinc/81/71/11/606817111.db2.gz MDVNZIOUGVLZKG-OAHLLOKOSA-N -1 3 353.451 3.522 20 0 FHADHM Cc1ccc(C)c([C@@H]2CCCN2C(=O)c2sccc2-c2nnn[n-]2)c1 ZINC000822230632 606817419 /nfs/dbraw/zinc/81/74/19/606817419.db2.gz MDVNZIOUGVLZKG-HNNXBMFYSA-N -1 3 353.451 3.522 20 0 FHADHM Cc1ccc(C)c([C@@H]2CCCN2C(=O)c2sccc2-c2nn[n-]n2)c1 ZINC000822230632 606817422 /nfs/dbraw/zinc/81/74/22/606817422.db2.gz MDVNZIOUGVLZKG-HNNXBMFYSA-N -1 3 353.451 3.522 20 0 FHADHM C[C@H](SCc1cccc(-c2nnn[n-]2)c1)c1nc(-c2ccccc2)no1 ZINC000820548668 606827691 /nfs/dbraw/zinc/82/76/91/606827691.db2.gz DZVBCTRQWRMBRJ-LBPRGKRZSA-N -1 3 364.434 3.911 20 0 FHADHM C[C@H](SCc1cccc(-c2nn[n-]n2)c1)c1nc(-c2ccccc2)no1 ZINC000820548668 606827692 /nfs/dbraw/zinc/82/76/92/606827692.db2.gz DZVBCTRQWRMBRJ-LBPRGKRZSA-N -1 3 364.434 3.911 20 0 FHADHM Cc1ccccc1NC(=O)[C@H](C)Sc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822361488 606851537 /nfs/dbraw/zinc/85/15/37/606851537.db2.gz CHROUGAXUHTEOK-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM Cc1ccccc1NC(=O)[C@H](C)Sc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822361488 606851539 /nfs/dbraw/zinc/85/15/39/606851539.db2.gz CHROUGAXUHTEOK-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM O[C@H](COc1ccc(-c2ccccc2)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000823690770 606853370 /nfs/dbraw/zinc/85/33/70/606853370.db2.gz UAARVUZDQROQOR-HXUWFJFHSA-N -1 3 358.401 3.646 20 0 FHADHM O[C@H](COc1ccc(-c2ccccc2)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000823690770 606853373 /nfs/dbraw/zinc/85/33/73/606853373.db2.gz UAARVUZDQROQOR-HXUWFJFHSA-N -1 3 358.401 3.646 20 0 FHADHM CCCC(=O)Nc1ccc(Cl)c(NCc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000821009048 606859782 /nfs/dbraw/zinc/85/97/82/606859782.db2.gz NHCVCKXBGNXAIC-UHFFFAOYSA-N -1 3 370.844 3.871 20 0 FHADHM CCCC(=O)Nc1ccc(Cl)c(NCc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000821009048 606859784 /nfs/dbraw/zinc/85/97/84/606859784.db2.gz NHCVCKXBGNXAIC-UHFFFAOYSA-N -1 3 370.844 3.871 20 0 FHADHM Cc1cnc(CNc2ccc(Oc3ccccc3-c3nnn[n-]3)c(F)c2)o1 ZINC000822394971 606865264 /nfs/dbraw/zinc/86/52/64/606865264.db2.gz MVNSCLVLEPKNAN-UHFFFAOYSA-N -1 3 366.356 3.707 20 0 FHADHM Cc1cnc(CNc2ccc(Oc3ccccc3-c3nn[n-]n3)c(F)c2)o1 ZINC000822394971 606865265 /nfs/dbraw/zinc/86/52/65/606865265.db2.gz MVNSCLVLEPKNAN-UHFFFAOYSA-N -1 3 366.356 3.707 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1cccc(Cl)c1F ZINC000821104523 606866787 /nfs/dbraw/zinc/86/67/87/606866787.db2.gz HGFFTCFXXUCGMO-UHFFFAOYSA-N -1 3 373.819 3.712 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1cccc(Cl)c1F ZINC000821104523 606866789 /nfs/dbraw/zinc/86/67/89/606866789.db2.gz HGFFTCFXXUCGMO-UHFFFAOYSA-N -1 3 373.819 3.712 20 0 FHADHM Cc1csc(CSc2nc(-c3ccccc3)ccc2-c2nnn[n-]2)n1 ZINC000822414435 606867347 /nfs/dbraw/zinc/86/73/47/606867347.db2.gz FRJFKDFSBSMSGY-UHFFFAOYSA-N -1 3 366.475 3.986 20 0 FHADHM Cc1csc(CSc2nc(-c3ccccc3)ccc2-c2nn[n-]n2)n1 ZINC000822414435 606867348 /nfs/dbraw/zinc/86/73/48/606867348.db2.gz FRJFKDFSBSMSGY-UHFFFAOYSA-N -1 3 366.475 3.986 20 0 FHADHM CC1(CNC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)CCCCC1 ZINC000820612161 606870740 /nfs/dbraw/zinc/87/07/40/606870740.db2.gz BMXXVRVIPGYFSH-UHFFFAOYSA-N -1 3 371.485 3.502 20 0 FHADHM CC1(CNC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)CCCCC1 ZINC000820612161 606870741 /nfs/dbraw/zinc/87/07/41/606870741.db2.gz BMXXVRVIPGYFSH-UHFFFAOYSA-N -1 3 371.485 3.502 20 0 FHADHM CN(C[C@@H](O)c1ccc(-c2nnn[n-]2)cc1)c1ccc(-c2ccccc2)cc1 ZINC000821594900 606905868 /nfs/dbraw/zinc/90/58/68/606905868.db2.gz GBAFMPYUUDFHIY-OAQYLSRUSA-N -1 3 371.444 3.704 20 0 FHADHM CN(C[C@@H](O)c1ccc(-c2nn[n-]n2)cc1)c1ccc(-c2ccccc2)cc1 ZINC000821594900 606905870 /nfs/dbraw/zinc/90/58/70/606905870.db2.gz GBAFMPYUUDFHIY-OAQYLSRUSA-N -1 3 371.444 3.704 20 0 FHADHM CCc1nnc(SCc2ccc(Cl)cc2)c(-c2nnn[n-]2)c1CC ZINC000821548803 606916621 /nfs/dbraw/zinc/91/66/21/606916621.db2.gz YYPMRWKGRAMKTQ-UHFFFAOYSA-N -1 3 360.874 3.727 20 0 FHADHM CCc1nnc(SCc2ccc(Cl)cc2)c(-c2nn[n-]n2)c1CC ZINC000821548803 606916623 /nfs/dbraw/zinc/91/66/23/606916623.db2.gz YYPMRWKGRAMKTQ-UHFFFAOYSA-N -1 3 360.874 3.727 20 0 FHADHM Fc1ccc(CNc2cccc(OC3CCCC3)c2)cc1-c1nnn[n-]1 ZINC000822771105 606928047 /nfs/dbraw/zinc/92/80/47/606928047.db2.gz BLAYOGNWOUQZGC-UHFFFAOYSA-N -1 3 353.401 3.939 20 0 FHADHM Fc1ccc(CNc2cccc(OC3CCCC3)c2)cc1-c1nn[n-]n1 ZINC000822771105 606928048 /nfs/dbraw/zinc/92/80/48/606928048.db2.gz BLAYOGNWOUQZGC-UHFFFAOYSA-N -1 3 353.401 3.939 20 0 FHADHM CCCC(=O)Nc1cccc(NCc2ccc(F)c(-c3nnn[n-]3)c2)c1C ZINC000821009570 606928600 /nfs/dbraw/zinc/92/86/00/606928600.db2.gz WBBKRCRDMINCTQ-UHFFFAOYSA-N -1 3 368.416 3.665 20 0 FHADHM CCCC(=O)Nc1cccc(NCc2ccc(F)c(-c3nn[n-]n3)c2)c1C ZINC000821009570 606928602 /nfs/dbraw/zinc/92/86/02/606928602.db2.gz WBBKRCRDMINCTQ-UHFFFAOYSA-N -1 3 368.416 3.665 20 0 FHADHM Fc1ccc(CNc2c(F)cccc2Br)cc1-c1nnn[n-]1 ZINC000822772425 606931747 /nfs/dbraw/zinc/93/17/47/606931747.db2.gz YKHDQEGCOUAAFW-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1ccc(CNc2c(F)cccc2Br)cc1-c1nn[n-]n1 ZINC000822772425 606931748 /nfs/dbraw/zinc/93/17/48/606931748.db2.gz YKHDQEGCOUAAFW-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1ccc(CNc2cccc(CC(F)(F)F)c2)cc1-c1nnn[n-]1 ZINC000822771070 606931926 /nfs/dbraw/zinc/93/19/26/606931926.db2.gz ABMDEKWNYRQQBT-UHFFFAOYSA-N -1 3 351.307 3.723 20 0 FHADHM Fc1ccc(CNc2cccc(CC(F)(F)F)c2)cc1-c1nn[n-]n1 ZINC000822771070 606931928 /nfs/dbraw/zinc/93/19/28/606931928.db2.gz ABMDEKWNYRQQBT-UHFFFAOYSA-N -1 3 351.307 3.723 20 0 FHADHM Cc1noc(C)c1CCCNc1ccc(C(F)(F)F)cc1-c1nnn[n-]1 ZINC000822522390 606943972 /nfs/dbraw/zinc/94/39/72/606943972.db2.gz IGRQABDRBJVJIE-UHFFFAOYSA-N -1 3 366.347 3.535 20 0 FHADHM Cc1noc(C)c1CCCNc1ccc(C(F)(F)F)cc1-c1nn[n-]n1 ZINC000822522390 606943974 /nfs/dbraw/zinc/94/39/74/606943974.db2.gz IGRQABDRBJVJIE-UHFFFAOYSA-N -1 3 366.347 3.535 20 0 FHADHM CN(C(=O)C/C=C/c1ccc(F)cc1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821569691 606960727 /nfs/dbraw/zinc/96/07/27/606960727.db2.gz SBHQOGADYBSFCT-NSCUHMNNSA-N -1 3 371.803 3.726 20 0 FHADHM CN(C(=O)C/C=C/c1ccc(F)cc1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821569691 606960728 /nfs/dbraw/zinc/96/07/28/606960728.db2.gz SBHQOGADYBSFCT-NSCUHMNNSA-N -1 3 371.803 3.726 20 0 FHADHM CN(C(=O)c1ccc(Oc2ccccc2)cc1)c1ccccc1-c1nnn[n-]1 ZINC000821574815 606971556 /nfs/dbraw/zinc/97/15/56/606971556.db2.gz YJUCOICQEVQBMH-UHFFFAOYSA-N -1 3 371.400 3.936 20 0 FHADHM CN(C(=O)c1ccc(Oc2ccccc2)cc1)c1ccccc1-c1nn[n-]n1 ZINC000821574815 606971558 /nfs/dbraw/zinc/97/15/58/606971558.db2.gz YJUCOICQEVQBMH-UHFFFAOYSA-N -1 3 371.400 3.936 20 0 FHADHM Fc1ccc([C@H]2CCCN2Cc2ccc(F)c(-c3nnn[n-]3)c2)cc1F ZINC000822767180 606972867 /nfs/dbraw/zinc/97/28/67/606972867.db2.gz ZAFYJNMYSJXUNJ-QGZVFWFLSA-N -1 3 359.355 3.621 20 0 FHADHM Fc1ccc([C@H]2CCCN2Cc2ccc(F)c(-c3nn[n-]n3)c2)cc1F ZINC000822767180 606972868 /nfs/dbraw/zinc/97/28/68/606972868.db2.gz ZAFYJNMYSJXUNJ-QGZVFWFLSA-N -1 3 359.355 3.621 20 0 FHADHM CCCC1(CNC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)CCC1 ZINC000821034566 606988595 /nfs/dbraw/zinc/98/85/95/606988595.db2.gz PDUSHGBWOZYCDN-UHFFFAOYSA-N -1 3 370.501 3.757 20 0 FHADHM CCCC1(CNC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)CCC1 ZINC000821034566 606988597 /nfs/dbraw/zinc/98/85/97/606988597.db2.gz PDUSHGBWOZYCDN-UHFFFAOYSA-N -1 3 370.501 3.757 20 0 FHADHM CCC(=CC(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)nc1)CC ZINC000820833283 607025406 /nfs/dbraw/zinc/02/54/06/607025406.db2.gz VNYMPTSKVKQBLV-UHFFFAOYSA-N -1 3 364.409 3.739 20 0 FHADHM Cc1nc(SCc2cc(F)ccc2-c2nnn[n-]2)n(CC(C)C)c1C ZINC000822454559 607037786 /nfs/dbraw/zinc/03/77/86/607037786.db2.gz YBNZBLHBPNNWGU-UHFFFAOYSA-N -1 3 360.462 3.767 20 0 FHADHM Cc1nc(SCc2cc(F)ccc2-c2nn[n-]n2)n(CC(C)C)c1C ZINC000822454559 607037789 /nfs/dbraw/zinc/03/77/89/607037789.db2.gz YBNZBLHBPNNWGU-UHFFFAOYSA-N -1 3 360.462 3.767 20 0 FHADHM CCCCn1c(C)c(C)nc1SCc1cc(F)ccc1-c1nnn[n-]1 ZINC000821082343 607039339 /nfs/dbraw/zinc/03/93/39/607039339.db2.gz IZLMSEMDDHUNLD-UHFFFAOYSA-N -1 3 360.462 3.912 20 0 FHADHM CCCCn1c(C)c(C)nc1SCc1cc(F)ccc1-c1nn[n-]n1 ZINC000821082343 607039341 /nfs/dbraw/zinc/03/93/41/607039341.db2.gz IZLMSEMDDHUNLD-UHFFFAOYSA-N -1 3 360.462 3.912 20 0 FHADHM CC(C)(C)OC1CCN(c2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)CC1 ZINC000819946922 607043670 /nfs/dbraw/zinc/04/36/70/607043670.db2.gz WJGREJXMWBWRCP-UHFFFAOYSA-N -1 3 369.391 3.669 20 0 FHADHM CC(C)(C)OC1CCN(c2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)CC1 ZINC000819946922 607043672 /nfs/dbraw/zinc/04/36/72/607043672.db2.gz WJGREJXMWBWRCP-UHFFFAOYSA-N -1 3 369.391 3.669 20 0 FHADHM Brc1ccc(Oc2nc3ccccc3o2)c(-c2nnn[n-]2)c1 ZINC000819688392 607045371 /nfs/dbraw/zinc/04/53/71/607045371.db2.gz ICSIPWLANVXENL-UHFFFAOYSA-N -1 3 358.155 3.563 20 0 FHADHM Brc1ccc(Oc2nc3ccccc3o2)c(-c2nn[n-]n2)c1 ZINC000819688392 607045372 /nfs/dbraw/zinc/04/53/72/607045372.db2.gz ICSIPWLANVXENL-UHFFFAOYSA-N -1 3 358.155 3.563 20 0 FHADHM Cc1ccc(Cl)c(NC(=O)C(C)(C)Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000822239808 607063846 /nfs/dbraw/zinc/06/38/46/607063846.db2.gz FKAHRQUCENDVLN-UHFFFAOYSA-N -1 3 371.828 3.625 20 0 FHADHM Cc1ccc(Cl)c(NC(=O)C(C)(C)Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000822239808 607063847 /nfs/dbraw/zinc/06/38/47/607063847.db2.gz FKAHRQUCENDVLN-UHFFFAOYSA-N -1 3 371.828 3.625 20 0 FHADHM O=C(CC/C=C\c1ccccc1)OCc1cc(F)ccc1-c1nnn[n-]1 ZINC000822954932 607084274 /nfs/dbraw/zinc/08/42/74/607084274.db2.gz FVLPAUZKDMPESB-YWEYNIOJSA-N -1 3 352.369 3.543 20 0 FHADHM O=C(CC/C=C\c1ccccc1)OCc1cc(F)ccc1-c1nn[n-]n1 ZINC000822954932 607084276 /nfs/dbraw/zinc/08/42/76/607084276.db2.gz FVLPAUZKDMPESB-YWEYNIOJSA-N -1 3 352.369 3.543 20 0 FHADHM C[C@H](C(=O)OCc1cc(F)ccc1-c1nnn[n-]1)c1ccc(Cl)s1 ZINC000819883262 607084774 /nfs/dbraw/zinc/08/47/74/607084774.db2.gz GISUWCAZQBBESA-QMMMGPOBSA-N -1 3 366.805 3.568 20 0 FHADHM C[C@H](C(=O)OCc1cc(F)ccc1-c1nn[n-]n1)c1ccc(Cl)s1 ZINC000819883262 607084775 /nfs/dbraw/zinc/08/47/75/607084775.db2.gz GISUWCAZQBBESA-QMMMGPOBSA-N -1 3 366.805 3.568 20 0 FHADHM C[C@@H](C(=O)OCc1cc(F)ccc1-c1nnn[n-]1)c1cccc(Cl)c1 ZINC000819884032 607085158 /nfs/dbraw/zinc/08/51/58/607085158.db2.gz RGJFKOPHBXSEGA-SNVBAGLBSA-N -1 3 360.776 3.506 20 0 FHADHM C[C@@H](C(=O)OCc1cc(F)ccc1-c1nn[n-]n1)c1cccc(Cl)c1 ZINC000819884032 607085160 /nfs/dbraw/zinc/08/51/60/607085160.db2.gz RGJFKOPHBXSEGA-SNVBAGLBSA-N -1 3 360.776 3.506 20 0 FHADHM CCCOc1cc(F)ccc1NC(=S)Nc1ccccc1-c1nnn[n-]1 ZINC000821128205 607112523 /nfs/dbraw/zinc/11/25/23/607112523.db2.gz ROCVAAKNXZVTOC-UHFFFAOYSA-N -1 3 372.429 3.604 20 0 FHADHM CCCOc1cc(F)ccc1NC(=S)Nc1ccccc1-c1nn[n-]n1 ZINC000821128205 607112525 /nfs/dbraw/zinc/11/25/25/607112525.db2.gz ROCVAAKNXZVTOC-UHFFFAOYSA-N -1 3 372.429 3.604 20 0 FHADHM FC(F)Oc1ccccc1CNc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822736259 607125235 /nfs/dbraw/zinc/12/52/35/607125235.db2.gz BTXWXVNYBDBBRI-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1OCc1ccc(Cl)c2cccnc12 ZINC000822748302 607136785 /nfs/dbraw/zinc/13/67/85/607136785.db2.gz SIKBAYSNYJGVQN-UHFFFAOYSA-N -1 3 355.760 3.786 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1OCc1ccc(Cl)c2cccnc12 ZINC000822748302 607136787 /nfs/dbraw/zinc/13/67/87/607136787.db2.gz SIKBAYSNYJGVQN-UHFFFAOYSA-N -1 3 355.760 3.786 20 0 FHADHM Fc1ccc(-c2nc(COc3ccc(-c4nnn[n-]4)cc3F)co2)cc1F ZINC000822754033 607140327 /nfs/dbraw/zinc/14/03/27/607140327.db2.gz WOQTYLZDEJYHHQ-UHFFFAOYSA-N -1 3 373.294 3.518 20 0 FHADHM Fc1ccc(-c2nc(COc3ccc(-c4nn[n-]n4)cc3F)co2)cc1F ZINC000822754033 607140328 /nfs/dbraw/zinc/14/03/28/607140328.db2.gz WOQTYLZDEJYHHQ-UHFFFAOYSA-N -1 3 373.294 3.518 20 0 FHADHM Cc1cc(C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c(Cl)cc1F ZINC000822177060 607142174 /nfs/dbraw/zinc/14/21/74/607142174.db2.gz SQZAFQXWWALVJZ-UHFFFAOYSA-N -1 3 366.183 3.873 20 0 FHADHM Cc1cc(C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c(Cl)cc1F ZINC000822177060 607142175 /nfs/dbraw/zinc/14/21/75/607142175.db2.gz SQZAFQXWWALVJZ-UHFFFAOYSA-N -1 3 366.183 3.873 20 0 FHADHM O=C(NCc1cccc(-c2nnn[n-]2)c1)N1CCC[C@H]1CCC1CCCC1 ZINC000823257809 607154064 /nfs/dbraw/zinc/15/40/64/607154064.db2.gz UKDGKQLUCGZPBM-SFHVURJKSA-N -1 3 368.485 3.511 20 0 FHADHM O=C(NCc1cccc(-c2nn[n-]n2)c1)N1CCC[C@H]1CCC1CCCC1 ZINC000823257809 607154065 /nfs/dbraw/zinc/15/40/65/607154065.db2.gz UKDGKQLUCGZPBM-SFHVURJKSA-N -1 3 368.485 3.511 20 0 FHADHM Cc1cc(C(=O)CSc2cccc(-c3nnn[n-]3)c2)c(Cl)cc1F ZINC000822167849 607158598 /nfs/dbraw/zinc/15/85/98/607158598.db2.gz JKIZANSWTAIPGL-UHFFFAOYSA-N -1 3 362.817 3.943 20 0 FHADHM Cc1cc(C(=O)CSc2cccc(-c3nn[n-]n3)c2)c(Cl)cc1F ZINC000822167849 607158600 /nfs/dbraw/zinc/15/86/00/607158600.db2.gz JKIZANSWTAIPGL-UHFFFAOYSA-N -1 3 362.817 3.943 20 0 FHADHM CC(C)[C@H](Sc1ccc(-c2nnn[n-]2)cc1)C(=O)Nc1ccccc1F ZINC000820031204 607161879 /nfs/dbraw/zinc/16/18/79/607161879.db2.gz BNWLUBVTYCIAGP-INIZCTEOSA-N -1 3 371.441 3.761 20 0 FHADHM CC(C)[C@H](Sc1ccc(-c2nn[n-]n2)cc1)C(=O)Nc1ccccc1F ZINC000820031204 607161881 /nfs/dbraw/zinc/16/18/81/607161881.db2.gz BNWLUBVTYCIAGP-INIZCTEOSA-N -1 3 371.441 3.761 20 0 FHADHM O=C(Nc1cccc(O)c1)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000823367191 607185534 /nfs/dbraw/zinc/18/55/34/607185534.db2.gz FMGKDZRMMFRWOB-UHFFFAOYSA-N -1 3 373.372 3.617 20 0 FHADHM O=C(C/C=C\c1ccc(F)cc1)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822945934 607190014 /nfs/dbraw/zinc/19/00/14/607190014.db2.gz UIDFNOWTUWILSQ-UPHRSURJSA-N -1 3 357.776 3.701 20 0 FHADHM O=C(C/C=C\c1ccc(F)cc1)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822945934 607190015 /nfs/dbraw/zinc/19/00/15/607190015.db2.gz UIDFNOWTUWILSQ-UPHRSURJSA-N -1 3 357.776 3.701 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N1CCCc2sccc2C1 ZINC000823315467 607195253 /nfs/dbraw/zinc/19/52/53/607195253.db2.gz YCJPTZLAKUKRLC-UHFFFAOYSA-N -1 3 374.857 3.562 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N1CCCc2sccc2C1 ZINC000823315467 607195254 /nfs/dbraw/zinc/19/52/54/607195254.db2.gz YCJPTZLAKUKRLC-UHFFFAOYSA-N -1 3 374.857 3.562 20 0 FHADHM Cc1ccc(CC[C@H](C)NC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)o1 ZINC000822235241 607196676 /nfs/dbraw/zinc/19/66/76/607196676.db2.gz YRRGIKIFFHPDBJ-JTQLQIEISA-N -1 3 374.832 3.564 20 0 FHADHM Cc1ccc(CC[C@H](C)NC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)o1 ZINC000822235241 607196677 /nfs/dbraw/zinc/19/66/77/607196677.db2.gz YRRGIKIFFHPDBJ-JTQLQIEISA-N -1 3 374.832 3.564 20 0 FHADHM C[C@H](c1cccs1)N(C)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820570929 607197000 /nfs/dbraw/zinc/19/70/00/607197000.db2.gz UCSRBULBVYJNPJ-SECBINFHSA-N -1 3 362.846 3.807 20 0 FHADHM C[C@H](c1cccs1)N(C)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820570929 607197001 /nfs/dbraw/zinc/19/70/01/607197001.db2.gz UCSRBULBVYJNPJ-SECBINFHSA-N -1 3 362.846 3.807 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N1CC2C[C@@H]3CC1C[C@H](C2)C3 ZINC000823313827 607197126 /nfs/dbraw/zinc/19/71/26/607197126.db2.gz JMVVIHMZFXYZFU-KCXRBIIJSA-N -1 3 372.860 3.563 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N1CC2C[C@@H]3CC1C[C@H](C2)C3 ZINC000823313827 607197127 /nfs/dbraw/zinc/19/71/27/607197127.db2.gz JMVVIHMZFXYZFU-KCXRBIIJSA-N -1 3 372.860 3.563 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N1CCCc2ccccc2C1 ZINC000823313539 607198616 /nfs/dbraw/zinc/19/86/16/607198616.db2.gz DXYRKCUWGUDGLS-UHFFFAOYSA-N -1 3 368.828 3.500 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N1CCCc2ccccc2C1 ZINC000823313539 607198617 /nfs/dbraw/zinc/19/86/17/607198617.db2.gz DXYRKCUWGUDGLS-UHFFFAOYSA-N -1 3 368.828 3.500 20 0 FHADHM CN(C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)[C@@H]1CCc2ccccc21 ZINC000821572130 607199003 /nfs/dbraw/zinc/19/90/03/607199003.db2.gz SHAMJXRNZGXWAP-MRXNPFEDSA-N -1 3 368.828 3.671 20 0 FHADHM CN(C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)[C@@H]1CCc2ccccc21 ZINC000821572130 607199004 /nfs/dbraw/zinc/19/90/04/607199004.db2.gz SHAMJXRNZGXWAP-MRXNPFEDSA-N -1 3 368.828 3.671 20 0 FHADHM CCC(CC)(CNC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)SC ZINC000820887675 607200870 /nfs/dbraw/zinc/20/08/70/607200870.db2.gz LOCXYXIINYRPTG-UHFFFAOYSA-N -1 3 368.894 3.563 20 0 FHADHM CCC(CC)(CNC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)SC ZINC000820887675 607200871 /nfs/dbraw/zinc/20/08/71/607200871.db2.gz LOCXYXIINYRPTG-UHFFFAOYSA-N -1 3 368.894 3.563 20 0 FHADHM CC[C@H](C)[C@H]1CCCCN1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820864169 607201388 /nfs/dbraw/zinc/20/13/88/607201388.db2.gz XBLQPLJHHWVPLR-XHDPSFHLSA-N -1 3 362.865 3.953 20 0 FHADHM CC[C@H](C)[C@H]1CCCCN1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820864169 607201389 /nfs/dbraw/zinc/20/13/89/607201389.db2.gz XBLQPLJHHWVPLR-XHDPSFHLSA-N -1 3 362.865 3.953 20 0 FHADHM CC[C@@H](C)[C@@H]1CCCCN1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820864166 607201706 /nfs/dbraw/zinc/20/17/06/607201706.db2.gz XBLQPLJHHWVPLR-ABAIWWIYSA-N -1 3 362.865 3.953 20 0 FHADHM CC[C@@H](C)[C@@H]1CCCCN1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820864166 607201707 /nfs/dbraw/zinc/20/17/07/607201707.db2.gz XBLQPLJHHWVPLR-ABAIWWIYSA-N -1 3 362.865 3.953 20 0 FHADHM CCN(C(=O)C1CCC(C)(C)CC1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821149189 607209392 /nfs/dbraw/zinc/20/93/92/607209392.db2.gz ULRNMQYFWKARRE-CQSZACIVSA-N -1 3 355.486 3.993 20 0 FHADHM CCN(C(=O)C1CCC(C)(C)CC1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821149189 607209393 /nfs/dbraw/zinc/20/93/93/607209393.db2.gz ULRNMQYFWKARRE-CQSZACIVSA-N -1 3 355.486 3.993 20 0 FHADHM C[C@H]1c2cc(Cl)cc(Cl)c2CCN1c1ccc(-c2nn[n-]n2)nc1 ZINC000820819917 607234851 /nfs/dbraw/zinc/23/48/51/607234851.db2.gz LKXOWCVBFILNOU-VIFPVBQESA-N -1 3 361.236 3.692 20 0 FHADHM C[C@H]1c2cc(Cl)cc(Cl)c2CCN1c1ccc(-c2nnn[n-]2)nc1 ZINC000820819917 607234850 /nfs/dbraw/zinc/23/48/50/607234850.db2.gz LKXOWCVBFILNOU-VIFPVBQESA-N -1 3 361.236 3.692 20 0 FHADHM Cc1cc(Cl)ccc1C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2 ZINC000822202003 607235701 /nfs/dbraw/zinc/23/57/01/607235701.db2.gz GJZAITYPSYQBTN-UHFFFAOYSA-N -1 3 359.842 3.631 20 0 FHADHM Cc1cc(Cl)ccc1C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2 ZINC000822202003 607235702 /nfs/dbraw/zinc/23/57/02/607235702.db2.gz GJZAITYPSYQBTN-UHFFFAOYSA-N -1 3 359.842 3.631 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccc(F)c(Cl)c1 ZINC000823308939 607235951 /nfs/dbraw/zinc/23/59/51/607235951.db2.gz MZTSGWQYRFIIAD-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccc(F)c(Cl)c1 ZINC000823308939 607235952 /nfs/dbraw/zinc/23/59/52/607235952.db2.gz MZTSGWQYRFIIAD-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM C[C@]1(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)CCCc2ccccc21 ZINC000820577549 607240391 /nfs/dbraw/zinc/24/03/91/607240391.db2.gz QXPRSHJOCCRWII-IBGZPJMESA-N -1 3 367.840 3.753 20 0 FHADHM C[C@]1(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)CCCc2ccccc21 ZINC000820577549 607240392 /nfs/dbraw/zinc/24/03/92/607240392.db2.gz QXPRSHJOCCRWII-IBGZPJMESA-N -1 3 367.840 3.753 20 0 FHADHM Cc1ccc(/C=C/CC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000822233521 607241556 /nfs/dbraw/zinc/24/15/56/607241556.db2.gz QQOPTKHAGJBGMR-NSCUHMNNSA-N -1 3 353.813 3.871 20 0 FHADHM Cc1ccc(/C=C/CC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000822233521 607241557 /nfs/dbraw/zinc/24/15/57/607241557.db2.gz QQOPTKHAGJBGMR-NSCUHMNNSA-N -1 3 353.813 3.871 20 0 FHADHM COc1cccc2cc(C(=O)Nc3ccc(-c4nnn[n-]4)cc3Cl)oc21 ZINC000821877757 607241584 /nfs/dbraw/zinc/24/15/84/607241584.db2.gz UNEWDBDGZUXFQN-UHFFFAOYSA-N -1 3 369.768 3.527 20 0 FHADHM COc1cccc2cc(C(=O)Nc3ccc(-c4nn[n-]n4)cc3Cl)oc21 ZINC000821877757 607241585 /nfs/dbraw/zinc/24/15/85/607241585.db2.gz UNEWDBDGZUXFQN-UHFFFAOYSA-N -1 3 369.768 3.527 20 0 FHADHM Cc1nc2ccccc2cc1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822464055 607243828 /nfs/dbraw/zinc/24/38/28/607243828.db2.gz ZIGREXWPNMFPOY-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1nc2ccccc2cc1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822464055 607243829 /nfs/dbraw/zinc/24/38/29/607243829.db2.gz ZIGREXWPNMFPOY-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1cccc2cc(C(=O)Nc3ccc(-c4nnn[n-]4)cc3Cl)oc21 ZINC000822341500 607243932 /nfs/dbraw/zinc/24/39/32/607243932.db2.gz YSMLBZXJPLUQIU-UHFFFAOYSA-N -1 3 353.769 3.827 20 0 FHADHM Cc1cccc2cc(C(=O)Nc3ccc(-c4nn[n-]n4)cc3Cl)oc21 ZINC000822341500 607243933 /nfs/dbraw/zinc/24/39/33/607243933.db2.gz YSMLBZXJPLUQIU-UHFFFAOYSA-N -1 3 353.769 3.827 20 0 FHADHM O=C(Oc1ccc(-c2nnn[n-]2)cc1F)c1ccc(SC(F)F)cc1 ZINC000823451013 607245983 /nfs/dbraw/zinc/24/59/83/607245983.db2.gz SHUMXMKOVUAHBH-UHFFFAOYSA-N -1 3 366.324 3.540 20 0 FHADHM O=C(Oc1ccc(-c2nn[n-]n2)cc1F)c1ccc(SC(F)F)cc1 ZINC000823451013 607245984 /nfs/dbraw/zinc/24/59/84/607245984.db2.gz SHUMXMKOVUAHBH-UHFFFAOYSA-N -1 3 366.324 3.540 20 0 FHADHM CN(C(=O)[C@H]1C[C@@H]1c1cccc2ccccc21)c1ccccc1-c1nnn[n-]1 ZINC000825811733 607789663 /nfs/dbraw/zinc/78/96/63/607789663.db2.gz AHEGTEFFBAFXJM-MOPGFXCFSA-N -1 3 369.428 3.786 20 0 FHADHM CN(C(=O)[C@H]1C[C@@H]1c1cccc2ccccc21)c1ccccc1-c1nn[n-]n1 ZINC000825811733 607789664 /nfs/dbraw/zinc/78/96/64/607789664.db2.gz AHEGTEFFBAFXJM-MOPGFXCFSA-N -1 3 369.428 3.786 20 0 FHADHM CCN(C(=O)CCc1c[nH]c2cc(C)ccc12)c1ccc(-c2nnn[n-]2)cc1 ZINC000825372220 607796628 /nfs/dbraw/zinc/79/66/28/607796628.db2.gz SLVAVXCRKOCUDP-UHFFFAOYSA-N -1 3 374.448 3.642 20 0 FHADHM CCN(C(=O)CCc1c[nH]c2cc(C)ccc12)c1ccc(-c2nn[n-]n2)cc1 ZINC000825372220 607796629 /nfs/dbraw/zinc/79/66/29/607796629.db2.gz SLVAVXCRKOCUDP-UHFFFAOYSA-N -1 3 374.448 3.642 20 0 FHADHM CCN(C(=O)C[C@@H]1CCCc2ccccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000825366545 607798135 /nfs/dbraw/zinc/79/81/35/607798135.db2.gz BQTRACSDWCVRQV-KRWDZBQOSA-N -1 3 361.449 3.730 20 0 FHADHM CCN(C(=O)C[C@@H]1CCCc2ccccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000825366545 607798136 /nfs/dbraw/zinc/79/81/36/607798136.db2.gz BQTRACSDWCVRQV-KRWDZBQOSA-N -1 3 361.449 3.730 20 0 FHADHM CCN(C(=O)CCCc1cc(C)sc1C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825371785 607799690 /nfs/dbraw/zinc/79/96/90/607799690.db2.gz LNQGXVIUIQCETB-UHFFFAOYSA-N -1 3 369.494 3.921 20 0 FHADHM CCN(C(=O)CCCc1cc(C)sc1C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825371785 607799691 /nfs/dbraw/zinc/79/96/91/607799691.db2.gz LNQGXVIUIQCETB-UHFFFAOYSA-N -1 3 369.494 3.921 20 0 FHADHM CCN(C(=O)C[C@@H](C)c1ccc(F)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825366662 607799854 /nfs/dbraw/zinc/79/98/54/607799854.db2.gz DELLATIZJYZMGI-CYBMUJFWSA-N -1 3 353.401 3.553 20 0 FHADHM CCN(C(=O)C[C@@H](C)c1ccc(F)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825366662 607799855 /nfs/dbraw/zinc/79/98/55/607799855.db2.gz DELLATIZJYZMGI-CYBMUJFWSA-N -1 3 353.401 3.553 20 0 FHADHM Fc1cccc(N[C@H](C[C@H]2CCOC2)c2ccccc2)c1-c1nnn[n-]1 ZINC000826377273 607811184 /nfs/dbraw/zinc/81/11/84/607811184.db2.gz LGSVYXROKUUYGT-CXAGYDPISA-N -1 3 353.401 3.586 20 0 FHADHM Fc1cccc(N[C@H](C[C@H]2CCOC2)c2ccccc2)c1-c1nn[n-]n1 ZINC000826377273 607811185 /nfs/dbraw/zinc/81/11/85/607811185.db2.gz LGSVYXROKUUYGT-CXAGYDPISA-N -1 3 353.401 3.586 20 0 FHADHM Fc1cccc(N[C@@H](C[C@@H]2CCOC2)c2ccccc2)c1-c1nnn[n-]1 ZINC000826377275 607811301 /nfs/dbraw/zinc/81/13/01/607811301.db2.gz LGSVYXROKUUYGT-GUYCJALGSA-N -1 3 353.401 3.586 20 0 FHADHM Fc1cccc(N[C@@H](C[C@@H]2CCOC2)c2ccccc2)c1-c1nn[n-]n1 ZINC000826377275 607811302 /nfs/dbraw/zinc/81/13/02/607811302.db2.gz LGSVYXROKUUYGT-GUYCJALGSA-N -1 3 353.401 3.586 20 0 FHADHM C[C@H](Cc1ccccc1Cl)C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000824458278 607819225 /nfs/dbraw/zinc/81/92/25/607819225.db2.gz VATOZVMCMVQYOW-CHWSQXEVSA-N -1 3 369.856 3.576 20 0 FHADHM C[C@H](Cc1ccccc1Cl)C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000824458278 607819226 /nfs/dbraw/zinc/81/92/26/607819226.db2.gz VATOZVMCMVQYOW-CHWSQXEVSA-N -1 3 369.856 3.576 20 0 FHADHM Cc1c(NC(=O)[C@@H](C)Cc2ccccc2Cl)cccc1-c1nnn[n-]1 ZINC000826240921 607822979 /nfs/dbraw/zinc/82/29/79/607822979.db2.gz LOLUJQIXOZHIDG-NSHDSACASA-N -1 3 355.829 3.646 20 0 FHADHM Cc1c(NC(=O)[C@@H](C)Cc2ccccc2Cl)cccc1-c1nn[n-]n1 ZINC000826240921 607822980 /nfs/dbraw/zinc/82/29/80/607822980.db2.gz LOLUJQIXOZHIDG-NSHDSACASA-N -1 3 355.829 3.646 20 0 FHADHM CC(C)(C)SCCCC(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000824123885 607827212 /nfs/dbraw/zinc/82/72/12/607827212.db2.gz LEWLBEYPYCLOLK-UHFFFAOYSA-N -1 3 364.519 3.674 20 0 FHADHM CC(C)(C)SCCCC(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000824123885 607827213 /nfs/dbraw/zinc/82/72/13/607827213.db2.gz LEWLBEYPYCLOLK-UHFFFAOYSA-N -1 3 364.519 3.674 20 0 FHADHM c1[nH]c2ccccc2c1CCNc1ccc2cc(-c3nnn[n-]3)ccc2n1 ZINC000826523040 607838396 /nfs/dbraw/zinc/83/83/96/607838396.db2.gz YIOIARPEQCVYPX-UHFFFAOYSA-N -1 3 355.405 3.551 20 0 FHADHM c1[nH]c2ccccc2c1CCNc1ccc2cc(-c3nn[n-]n3)ccc2n1 ZINC000826523040 607838397 /nfs/dbraw/zinc/83/83/97/607838397.db2.gz YIOIARPEQCVYPX-UHFFFAOYSA-N -1 3 355.405 3.551 20 0 FHADHM O=C(CSc1ccc(-c2nnn[n-]2)cc1Cl)c1cc(F)ccc1F ZINC000826420972 607844171 /nfs/dbraw/zinc/84/41/71/607844171.db2.gz LPGVZBHMBXWDEQ-UHFFFAOYSA-N -1 3 366.780 3.773 20 0 FHADHM O=C(CSc1ccc(-c2nn[n-]n2)cc1Cl)c1cc(F)ccc1F ZINC000826420972 607844172 /nfs/dbraw/zinc/84/41/72/607844172.db2.gz LPGVZBHMBXWDEQ-UHFFFAOYSA-N -1 3 366.780 3.773 20 0 FHADHM Clc1cc(-c2nnn[n-]2)ccc1SCc1nc(-c2ccccc2)no1 ZINC000826350574 607845684 /nfs/dbraw/zinc/84/56/84/607845684.db2.gz CCOROLVHHYQTOM-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1cc(-c2nn[n-]n2)ccc1SCc1nc(-c2ccccc2)no1 ZINC000826350574 607845685 /nfs/dbraw/zinc/84/56/85/607845685.db2.gz CCOROLVHHYQTOM-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1cc(-c2nn[n-]n2)ccc1NCc1coc(-c2ccccc2)n1 ZINC000826350756 607880912 /nfs/dbraw/zinc/88/09/12/607880912.db2.gz JXPLUBKGKPNXJT-UHFFFAOYSA-N -1 3 352.785 3.787 20 0 FHADHM C[C@H](NC(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824472991 607880973 /nfs/dbraw/zinc/88/09/73/607880973.db2.gz YAQPSRUFAPJCJY-OXXUSNJHSA-N -1 3 353.470 3.650 20 0 FHADHM C[C@H](NC(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824472991 607880974 /nfs/dbraw/zinc/88/09/74/607880974.db2.gz YAQPSRUFAPJCJY-OXXUSNJHSA-N -1 3 353.470 3.650 20 0 FHADHM CC1(C)CCC[C@H](C(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(F)F)C1 ZINC000824801447 607893941 /nfs/dbraw/zinc/89/39/41/607893941.db2.gz FRTJWPSBQCDZSN-NSHDSACASA-N -1 3 365.384 3.623 20 0 FHADHM CC1(C)CCC[C@H](C(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(F)F)C1 ZINC000824801447 607893942 /nfs/dbraw/zinc/89/39/42/607893942.db2.gz FRTJWPSBQCDZSN-NSHDSACASA-N -1 3 365.384 3.623 20 0 FHADHM C[C@H](Cc1cccc(Cl)c1)C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000824459071 607905807 /nfs/dbraw/zinc/90/58/07/607905807.db2.gz ZJSCPWBJDLNSHA-OLZOCXBDSA-N -1 3 369.856 3.576 20 0 FHADHM C[C@H](Cc1cccc(Cl)c1)C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000824459071 607905808 /nfs/dbraw/zinc/90/58/08/607905808.db2.gz ZJSCPWBJDLNSHA-OLZOCXBDSA-N -1 3 369.856 3.576 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000823942320 607905834 /nfs/dbraw/zinc/90/58/34/607905834.db2.gz BCGKUKJAXDOICD-KXXVWKPMSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000823942320 607905835 /nfs/dbraw/zinc/90/58/35/607905835.db2.gz BCGKUKJAXDOICD-KXXVWKPMSA-N -1 3 367.840 3.801 20 0 FHADHM Cc1c(C(=O)N2CCc3ccc(-c4nnn[n-]4)cc32)oc2c1c(C)ccc2C ZINC000826285158 607954931 /nfs/dbraw/zinc/95/49/31/607954931.db2.gz QXJDTFCUBJWQPU-UHFFFAOYSA-N -1 3 373.416 3.741 20 0 FHADHM Cc1c(C(=O)N2CCc3ccc(-c4nn[n-]n4)cc32)oc2c1c(C)ccc2C ZINC000826285158 607954932 /nfs/dbraw/zinc/95/49/32/607954932.db2.gz QXJDTFCUBJWQPU-UHFFFAOYSA-N -1 3 373.416 3.741 20 0 FHADHM CC(C)C[C@@H]1CCN(C(=O)c2c(Cl)cc(-c3nnn[n-]3)cc2Cl)C1 ZINC000824244859 607964021 /nfs/dbraw/zinc/96/40/21/607964021.db2.gz VIAWLQHJLINVMC-JTQLQIEISA-N -1 3 368.268 3.682 20 0 FHADHM CC(C)C[C@@H]1CCN(C(=O)c2c(Cl)cc(-c3nn[n-]n3)cc2Cl)C1 ZINC000824244859 607964022 /nfs/dbraw/zinc/96/40/22/607964022.db2.gz VIAWLQHJLINVMC-JTQLQIEISA-N -1 3 368.268 3.682 20 0 FHADHM Cc1cc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)ncc1Br ZINC000826270872 607965053 /nfs/dbraw/zinc/96/50/53/607965053.db2.gz RYAXJRNFQOJLCF-JTQLQIEISA-N -1 3 359.231 3.506 20 0 FHADHM Cc1cc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)ncc1Br ZINC000826270872 607965054 /nfs/dbraw/zinc/96/50/54/607965054.db2.gz RYAXJRNFQOJLCF-JTQLQIEISA-N -1 3 359.231 3.506 20 0 FHADHM CCc1nc2sccc2c(Oc2cc(Cl)ccc2-c2nnn[n-]2)n1 ZINC000825750602 607966408 /nfs/dbraw/zinc/96/64/08/607966408.db2.gz UEKUAFSRNZASNU-UHFFFAOYSA-N -1 3 358.814 3.880 20 0 FHADHM CCc1nc2sccc2c(Oc2cc(Cl)ccc2-c2nn[n-]n2)n1 ZINC000825750602 607966409 /nfs/dbraw/zinc/96/64/09/607966409.db2.gz UEKUAFSRNZASNU-UHFFFAOYSA-N -1 3 358.814 3.880 20 0 FHADHM Cc1cc(C)nc(Oc2ccc(Oc3ccc(-c4nnn[n-]4)cc3)cc2)n1 ZINC000826265525 607966674 /nfs/dbraw/zinc/96/66/74/607966674.db2.gz COQQHUVTMUVOOX-UHFFFAOYSA-N -1 3 360.377 3.858 20 0 FHADHM Cc1cc(C)nc(Oc2ccc(Oc3ccc(-c4nn[n-]n4)cc3)cc2)n1 ZINC000826265525 607966675 /nfs/dbraw/zinc/96/66/75/607966675.db2.gz COQQHUVTMUVOOX-UHFFFAOYSA-N -1 3 360.377 3.858 20 0 FHADHM O=Cc1cc(Cl)c(Oc2ncc(-c3nnn[n-]3)cc2Cl)cc1Cl ZINC000826484203 607967424 /nfs/dbraw/zinc/96/74/24/607967424.db2.gz RWYJFLBBNWFLIT-UHFFFAOYSA-N -1 3 370.583 3.827 20 0 FHADHM O=Cc1cc(Cl)c(Oc2ncc(-c3nn[n-]n3)cc2Cl)cc1Cl ZINC000826484203 607967425 /nfs/dbraw/zinc/96/74/25/607967425.db2.gz RWYJFLBBNWFLIT-UHFFFAOYSA-N -1 3 370.583 3.827 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)C(C)=Cc1ccc(Cl)cc1 ZINC000826185729 607981428 /nfs/dbraw/zinc/98/14/28/607981428.db2.gz RSDHRZRLJFVFAM-LUAWRHEFSA-N -1 3 369.812 3.571 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)C(C)=Cc1ccc(Cl)cc1 ZINC000826185729 607981429 /nfs/dbraw/zinc/98/14/29/607981429.db2.gz RSDHRZRLJFVFAM-LUAWRHEFSA-N -1 3 369.812 3.571 20 0 FHADHM Cc1ccc(-c2ncco2)cc1NCc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000826273914 607982782 /nfs/dbraw/zinc/98/27/82/607982782.db2.gz ZTNIYQXAIOWMPF-UHFFFAOYSA-N -1 3 350.357 3.581 20 0 FHADHM Cc1ccc(-c2ncco2)cc1NCc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000826273914 607982783 /nfs/dbraw/zinc/98/27/83/607982783.db2.gz ZTNIYQXAIOWMPF-UHFFFAOYSA-N -1 3 350.357 3.581 20 0 FHADHM c1sc(C2CC2)nc1CSCCOc1ccccc1-c1nnn[n-]1 ZINC000826519728 607983829 /nfs/dbraw/zinc/98/38/29/607983829.db2.gz LLPRUVPKQSUYBH-UHFFFAOYSA-N -1 3 359.480 3.513 20 0 FHADHM c1sc(C2CC2)nc1CSCCOc1ccccc1-c1nn[n-]n1 ZINC000826519728 607983830 /nfs/dbraw/zinc/98/38/30/607983830.db2.gz LLPRUVPKQSUYBH-UHFFFAOYSA-N -1 3 359.480 3.513 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CCCC12CCCCC2 ZINC000825621014 608006098 /nfs/dbraw/zinc/00/60/98/608006098.db2.gz MVOOYIPZITWQML-UHFFFAOYSA-N -1 3 370.457 3.596 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CCCC12CCCCC2 ZINC000825621014 608006099 /nfs/dbraw/zinc/00/60/99/608006099.db2.gz MVOOYIPZITWQML-UHFFFAOYSA-N -1 3 370.457 3.596 20 0 FHADHM CC(C)c1ccc([C@H]2CCCN2C(=O)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824347660 608008179 /nfs/dbraw/zinc/00/81/79/608008179.db2.gz JJRLOTDDDDEXRP-LJQANCHMSA-N -1 3 361.449 3.967 20 0 FHADHM CC(C)c1ccc([C@H]2CCCN2C(=O)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824347660 608008180 /nfs/dbraw/zinc/00/81/80/608008180.db2.gz JJRLOTDDDDEXRP-LJQANCHMSA-N -1 3 361.449 3.967 20 0 FHADHM O=C(c1sccc1-c1nnn[n-]1)N1CCCC[C@H]1CCc1ccccc1 ZINC000826475518 608032188 /nfs/dbraw/zinc/03/21/88/608032188.db2.gz IMUPOGWMFSHYFM-HNNXBMFYSA-N -1 3 367.478 3.556 20 0 FHADHM O=C(c1sccc1-c1nn[n-]n1)N1CCCC[C@H]1CCc1ccccc1 ZINC000826475518 608032189 /nfs/dbraw/zinc/03/21/89/608032189.db2.gz IMUPOGWMFSHYFM-HNNXBMFYSA-N -1 3 367.478 3.556 20 0 FHADHM CCc1c(C)sc(NC(=O)c2c(C)cc(C)cc2C)c1-c1nnn[n-]1 ZINC000825686949 608062587 /nfs/dbraw/zinc/06/25/87/608062587.db2.gz CODDHZZJDFMWEZ-UHFFFAOYSA-N -1 3 355.467 3.977 20 0 FHADHM CCc1c(C)sc(NC(=O)c2c(C)cc(C)cc2C)c1-c1nn[n-]n1 ZINC000825686949 608062588 /nfs/dbraw/zinc/06/25/88/608062588.db2.gz CODDHZZJDFMWEZ-UHFFFAOYSA-N -1 3 355.467 3.977 20 0 FHADHM Cc1c2c(nc(SCc3cccc(F)c3F)c1-c1nnn[n-]1)CCC2 ZINC000826243152 608074310 /nfs/dbraw/zinc/07/43/10/608074310.db2.gz WTAYAOXCJGSRMM-UHFFFAOYSA-N -1 3 359.405 3.629 20 0 FHADHM Cc1c2c(nc(SCc3cccc(F)c3F)c1-c1nn[n-]n1)CCC2 ZINC000826243152 608074311 /nfs/dbraw/zinc/07/43/11/608074311.db2.gz WTAYAOXCJGSRMM-UHFFFAOYSA-N -1 3 359.405 3.629 20 0 FHADHM Cc1sc(NC(=O)[C@@H](C)c2c(F)cccc2F)c(-c2nnn[n-]2)c1C ZINC000826349889 608122987 /nfs/dbraw/zinc/12/29/87/608122987.db2.gz YPBWRFNDDVPGOL-QMMMGPOBSA-N -1 3 363.393 3.565 20 0 FHADHM Cc1sc(NC(=O)[C@@H](C)c2c(F)cccc2F)c(-c2nn[n-]n2)c1C ZINC000826349889 608122988 /nfs/dbraw/zinc/12/29/88/608122988.db2.gz YPBWRFNDDVPGOL-QMMMGPOBSA-N -1 3 363.393 3.565 20 0 FHADHM CCN(C(=O)CCCC(F)(F)F)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825371743 608150103 /nfs/dbraw/zinc/15/01/03/608150103.db2.gz JQPPHJOJQWUZOS-LLVKDONJSA-N -1 3 355.364 3.509 20 0 FHADHM CCN(C(=O)CCCC(F)(F)F)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825371743 608150108 /nfs/dbraw/zinc/15/01/08/608150108.db2.gz JQPPHJOJQWUZOS-LLVKDONJSA-N -1 3 355.364 3.509 20 0 FHADHM CN(C(=O)C1(Cc2ccc(Cl)cc2)CC1)c1cccc(-c2nnn[n-]2)c1 ZINC000825812785 608155807 /nfs/dbraw/zinc/15/58/07/608155807.db2.gz UHTSKEMHQXFGEH-UHFFFAOYSA-N -1 3 367.840 3.506 20 0 FHADHM CN(C(=O)C1(Cc2ccc(Cl)cc2)CC1)c1cccc(-c2nn[n-]n2)c1 ZINC000825812785 608155808 /nfs/dbraw/zinc/15/58/08/608155808.db2.gz UHTSKEMHQXFGEH-UHFFFAOYSA-N -1 3 367.840 3.506 20 0 FHADHM C[C@H](OC(=O)c1cccn1Cc1ccccc1)c1cccc(-c2nnn[n-]2)c1 ZINC000824722904 608185631 /nfs/dbraw/zinc/18/56/31/608185631.db2.gz KEIVQOGBCFYQGT-HNNXBMFYSA-N -1 3 373.416 3.635 20 0 FHADHM C[C@H](OC(=O)c1cccn1Cc1ccccc1)c1cccc(-c2nn[n-]n2)c1 ZINC000824722904 608185634 /nfs/dbraw/zinc/18/56/34/608185634.db2.gz KEIVQOGBCFYQGT-HNNXBMFYSA-N -1 3 373.416 3.635 20 0 FHADHM Cc1nsc(Oc2ccc(Oc3ccc(-c4nnn[n-]4)cc3)cc2)n1 ZINC000826340350 608189354 /nfs/dbraw/zinc/18/93/54/608189354.db2.gz ULSQSTSYKVHAGT-UHFFFAOYSA-N -1 3 352.379 3.611 20 0 FHADHM Cc1nsc(Oc2ccc(Oc3ccc(-c4nn[n-]n4)cc3)cc2)n1 ZINC000826340350 608189356 /nfs/dbraw/zinc/18/93/56/608189356.db2.gz ULSQSTSYKVHAGT-UHFFFAOYSA-N -1 3 352.379 3.611 20 0 FHADHM CCN(C(=O)CSc1cccc(Cl)c1-c1nnn[n-]1)c1ccccc1 ZINC000825376267 608205951 /nfs/dbraw/zinc/20/59/51/608205951.db2.gz FCNITQJJUIFSIM-UHFFFAOYSA-N -1 3 373.869 3.665 20 0 FHADHM CCN(C(=O)CSc1cccc(Cl)c1-c1nn[n-]n1)c1ccccc1 ZINC000825376267 608205952 /nfs/dbraw/zinc/20/59/52/608205952.db2.gz FCNITQJJUIFSIM-UHFFFAOYSA-N -1 3 373.869 3.665 20 0 FHADHM c1cnc2c(c1)cccc2CNc1ccc2cc(-c3nnn[n-]3)ccc2n1 ZINC000826525518 608226123 /nfs/dbraw/zinc/22/61/23/608226123.db2.gz NVNATXXTGAIEME-UHFFFAOYSA-N -1 3 353.389 3.575 20 0 FHADHM c1cnc2c(c1)cccc2CNc1ccc2cc(-c3nn[n-]n3)ccc2n1 ZINC000826525518 608226124 /nfs/dbraw/zinc/22/61/24/608226124.db2.gz NVNATXXTGAIEME-UHFFFAOYSA-N -1 3 353.389 3.575 20 0 FHADHM c1cc2nc(N[C@@H]3CCOC4(CCCCC4)C3)ccc2cc1-c1nnn[n-]1 ZINC000826518337 608233776 /nfs/dbraw/zinc/23/37/76/608233776.db2.gz JVGAWTSHGFLKSW-MRXNPFEDSA-N -1 3 364.453 3.709 20 0 FHADHM c1cc2nc(N[C@@H]3CCOC4(CCCCC4)C3)ccc2cc1-c1nn[n-]n1 ZINC000826518337 608233777 /nfs/dbraw/zinc/23/37/77/608233777.db2.gz JVGAWTSHGFLKSW-MRXNPFEDSA-N -1 3 364.453 3.709 20 0 FHADHM COc1ccc([C@H](OC)[C@@H](C)Nc2cc(Cl)ccc2-c2nnn[n-]2)cc1 ZINC000826190166 608239764 /nfs/dbraw/zinc/23/97/64/608239764.db2.gz RRCQHELBMUDSBF-PIGZYNQJSA-N -1 3 373.844 3.717 20 0 FHADHM COc1ccc([C@H](OC)[C@@H](C)Nc2cc(Cl)ccc2-c2nn[n-]n2)cc1 ZINC000826190166 608239765 /nfs/dbraw/zinc/23/97/65/608239765.db2.gz RRCQHELBMUDSBF-PIGZYNQJSA-N -1 3 373.844 3.717 20 0 FHADHM CCN(C(=O)c1c(F)ccc(C)c1F)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825376664 608269157 /nfs/dbraw/zinc/26/91/57/608269157.db2.gz KROVXDMCWIXNOW-GFCCVEGCSA-N -1 3 371.391 3.677 20 0 FHADHM CCN(C(=O)c1c(F)ccc(C)c1F)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825376664 608269159 /nfs/dbraw/zinc/26/91/59/608269159.db2.gz KROVXDMCWIXNOW-GFCCVEGCSA-N -1 3 371.391 3.677 20 0 FHADHM CCCOc1ccc([C@H](C)Nc2nc(C)ccc2-c2nnn[n-]2)cc1OC ZINC000825339216 608275252 /nfs/dbraw/zinc/27/52/52/608275252.db2.gz RUDUWOHVDIEOQU-ZDUSSCGKSA-N -1 3 368.441 3.541 20 0 FHADHM CCCOc1ccc([C@H](C)Nc2nc(C)ccc2-c2nn[n-]n2)cc1OC ZINC000825339216 608275254 /nfs/dbraw/zinc/27/52/54/608275254.db2.gz RUDUWOHVDIEOQU-ZDUSSCGKSA-N -1 3 368.441 3.541 20 0 FHADHM CCC(CC)c1cc(CNc2nc3c(cc2-c2nnn[n-]2)CCCC3)on1 ZINC000825115218 608291074 /nfs/dbraw/zinc/29/10/74/608291074.db2.gz VSFWTCGODQIRTE-UHFFFAOYSA-N -1 3 367.457 3.644 20 0 FHADHM CCC(CC)c1cc(CNc2nc3c(cc2-c2nn[n-]n2)CCCC3)on1 ZINC000825115218 608291076 /nfs/dbraw/zinc/29/10/76/608291076.db2.gz VSFWTCGODQIRTE-UHFFFAOYSA-N -1 3 367.457 3.644 20 0 FHADHM CCc1nsc(NCc2ccc(-c3ccccc3-c3nnn[n-]3)cc2)n1 ZINC000825777589 608294263 /nfs/dbraw/zinc/29/42/63/608294263.db2.gz ZARNKMJBJUBTEF-UHFFFAOYSA-N -1 3 363.450 3.560 20 0 FHADHM CCc1nsc(NCc2ccc(-c3ccccc3-c3nn[n-]n3)cc2)n1 ZINC000825777589 608294265 /nfs/dbraw/zinc/29/42/65/608294265.db2.gz ZARNKMJBJUBTEF-UHFFFAOYSA-N -1 3 363.450 3.560 20 0 FHADHM Cc1scc(C(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(C)C)c1C ZINC000826350517 608299939 /nfs/dbraw/zinc/29/99/39/608299939.db2.gz ZPMPDUYDUCEDQC-UHFFFAOYSA-N -1 3 357.439 3.585 20 0 FHADHM Cc1scc(C(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(C)C)c1C ZINC000826350517 608299941 /nfs/dbraw/zinc/29/99/41/608299941.db2.gz ZPMPDUYDUCEDQC-UHFFFAOYSA-N -1 3 357.439 3.585 20 0 FHADHM O=C(Nc1ccc(COc2ccccc2)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000826453663 608308859 /nfs/dbraw/zinc/30/88/59/608308859.db2.gz UTVZSXUTMKCRPR-UHFFFAOYSA-N -1 3 371.400 3.698 20 0 FHADHM O=C(Nc1ccc(COc2ccccc2)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000826453663 608308861 /nfs/dbraw/zinc/30/88/61/608308861.db2.gz UTVZSXUTMKCRPR-UHFFFAOYSA-N -1 3 371.400 3.698 20 0 FHADHM COc1ccc([C@@H](OC(=O)c2cc(-c3nnn[n-]3)cs2)C2CC2)c(C)c1 ZINC000826188856 608316809 /nfs/dbraw/zinc/31/68/09/608316809.db2.gz IWZIHZBPIPQYBJ-INIZCTEOSA-N -1 3 370.434 3.553 20 0 FHADHM COc1ccc([C@@H](OC(=O)c2cc(-c3nn[n-]n3)cs2)C2CC2)c(C)c1 ZINC000826188856 608316811 /nfs/dbraw/zinc/31/68/11/608316811.db2.gz IWZIHZBPIPQYBJ-INIZCTEOSA-N -1 3 370.434 3.553 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CSCc1cc(-c2ccco2)on1 ZINC000826173514 608322814 /nfs/dbraw/zinc/32/28/14/608322814.db2.gz HNSXJFMBVRQIHO-UHFFFAOYSA-N -1 3 369.406 3.557 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CSCc1cc(-c2ccco2)on1 ZINC000826173514 608322816 /nfs/dbraw/zinc/32/28/16/608322816.db2.gz HNSXJFMBVRQIHO-UHFFFAOYSA-N -1 3 369.406 3.557 20 0 FHADHM Oc1cccc2c1CC[C@@H]2Nc1ccc(-c2nn[n-]n2)cc1C(F)(F)F ZINC000826511544 608382118 /nfs/dbraw/zinc/38/21/18/608382118.db2.gz UQOWTNDFBPFVLY-ZDUSSCGKSA-N -1 3 361.327 3.691 20 0 FHADHM Cc1nc(CCOc2ccc(-c3ccc(-c4nnn[n-]4)cc3)cc2)cs1 ZINC000826325786 608390820 /nfs/dbraw/zinc/39/08/20/608390820.db2.gz LROOGWVMHZEPQK-UHFFFAOYSA-N -1 3 363.446 3.920 20 0 FHADHM Cc1nc(CCOc2ccc(-c3ccc(-c4nn[n-]n4)cc3)cc2)cs1 ZINC000826325786 608390821 /nfs/dbraw/zinc/39/08/21/608390821.db2.gz LROOGWVMHZEPQK-UHFFFAOYSA-N -1 3 363.446 3.920 20 0 FHADHM CCCCc1noc([C@H](C)SCc2cccc(-c3nnn[n-]3)c2F)n1 ZINC000825296666 608404222 /nfs/dbraw/zinc/40/42/22/608404222.db2.gz RPEXRRHSJVBFEQ-JTQLQIEISA-N -1 3 362.434 3.726 20 0 FHADHM CCCCc1noc([C@H](C)SCc2cccc(-c3nn[n-]n3)c2F)n1 ZINC000825296666 608404223 /nfs/dbraw/zinc/40/42/23/608404223.db2.gz RPEXRRHSJVBFEQ-JTQLQIEISA-N -1 3 362.434 3.726 20 0 FHADHM CCc1nc2c(s1)[C@@H](N(C)Cc1cccc(-c3nnn[n-]3)c1F)CCC2 ZINC000825749377 608407356 /nfs/dbraw/zinc/40/73/56/608407356.db2.gz CMYLFMWFDOJBKP-AWEZNQCLSA-N -1 3 372.473 3.534 20 0 FHADHM O=C(OCc1cccc(-c2nnn[n-]2)c1F)c1c(Cl)cccc1Cl ZINC000826465985 608437329 /nfs/dbraw/zinc/43/73/29/608437329.db2.gz KWMNWSUJTUNHPL-UHFFFAOYSA-N -1 3 367.167 3.670 20 0 FHADHM O=C(OCc1cccc(-c2nn[n-]n2)c1F)c1c(Cl)cccc1Cl ZINC000826465985 608437330 /nfs/dbraw/zinc/43/73/30/608437330.db2.gz KWMNWSUJTUNHPL-UHFFFAOYSA-N -1 3 367.167 3.670 20 0 FHADHM c1cc2c(ccnc2N2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)s1 ZINC000823867462 608441270 /nfs/dbraw/zinc/44/12/70/608441270.db2.gz AFRNDYHFACJZFN-UHFFFAOYSA-N -1 3 360.446 3.770 20 0 FHADHM c1cc2c(ccnc2N2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)s1 ZINC000823867462 608441273 /nfs/dbraw/zinc/44/12/73/608441273.db2.gz AFRNDYHFACJZFN-UHFFFAOYSA-N -1 3 360.446 3.770 20 0 FHADHM Cc1ccc(-c2nc(CN[C@H](C)c3ccc(-c4nn[n-]n4)cc3)cs2)o1 ZINC000826273845 608467060 /nfs/dbraw/zinc/46/70/60/608467060.db2.gz WWPICKVDDTYDEX-GFCCVEGCSA-N -1 3 366.450 3.742 20 0 FHADHM C[C@H]1CCC[C@@H](CC(=O)N2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)C1 ZINC000824925522 608477996 /nfs/dbraw/zinc/47/79/96/608477996.db2.gz DQTKHVJBUVMVHZ-JKSUJKDBSA-N -1 3 365.481 3.699 20 0 FHADHM C[C@H]1CCC[C@@H](CC(=O)N2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)C1 ZINC000824925522 608477998 /nfs/dbraw/zinc/47/79/98/608477998.db2.gz DQTKHVJBUVMVHZ-JKSUJKDBSA-N -1 3 365.481 3.699 20 0 FHADHM CCC(CC)(CC)C(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000825090049 608478053 /nfs/dbraw/zinc/47/80/53/608478053.db2.gz QQGHBHWPWRJSTA-UHFFFAOYSA-N -1 3 353.470 3.699 20 0 FHADHM CCC(CC)(CC)C(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000825090049 608478055 /nfs/dbraw/zinc/47/80/55/608478055.db2.gz QQGHBHWPWRJSTA-UHFFFAOYSA-N -1 3 353.470 3.699 20 0 FHADHM CCc1ccnc(C(=O)Oc2ccc(-c3ccc(-c4nnn[n-]4)cc3)cc2)c1 ZINC000825728756 608540097 /nfs/dbraw/zinc/54/00/97/608540097.db2.gz YMZOPRZRSGLHNA-UHFFFAOYSA-N -1 3 371.400 3.710 20 0 FHADHM CCc1ccnc(C(=O)Oc2ccc(-c3ccc(-c4nn[n-]n4)cc3)cc2)c1 ZINC000825728756 608540098 /nfs/dbraw/zinc/54/00/98/608540098.db2.gz YMZOPRZRSGLHNA-UHFFFAOYSA-N -1 3 371.400 3.710 20 0 FHADHM CCC[C@@H](NCc1cccc(-c2nnn[n-]2)c1F)c1ccc(F)cc1F ZINC000825242756 608553716 /nfs/dbraw/zinc/55/37/16/608553716.db2.gz ZYNOQMMLVDRNDP-MRXNPFEDSA-N -1 3 361.371 3.915 20 0 FHADHM C[C@H](NC(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1)c1ccccc1Cl ZINC000824520951 608573072 /nfs/dbraw/zinc/57/30/72/608573072.db2.gz GOVUPJIOALTZPC-VIFPVBQESA-N -1 3 362.220 3.665 20 0 FHADHM C[C@H](NC(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1)c1ccccc1Cl ZINC000824520951 608573073 /nfs/dbraw/zinc/57/30/73/608573073.db2.gz GOVUPJIOALTZPC-VIFPVBQESA-N -1 3 362.220 3.665 20 0 FHADHM Cc1cccc2sc(NC(=O)c3ccc(Cl)c(-c4nnn[n-]4)c3)nc21 ZINC000826305365 608574050 /nfs/dbraw/zinc/57/40/50/608574050.db2.gz UFLPJFFZAYOVGN-UHFFFAOYSA-N -1 3 370.825 3.691 20 0 FHADHM Cc1cccc2sc(NC(=O)c3ccc(Cl)c(-c4nn[n-]n4)c3)nc21 ZINC000826305365 608574051 /nfs/dbraw/zinc/57/40/51/608574051.db2.gz UFLPJFFZAYOVGN-UHFFFAOYSA-N -1 3 370.825 3.691 20 0 FHADHM CC[C@@H]1c2ccsc2CCN1C(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000825219221 608575204 /nfs/dbraw/zinc/57/52/04/608575204.db2.gz IBWBYAJWBWCJFN-CQSZACIVSA-N -1 3 373.869 3.731 20 0 FHADHM CC[C@@H]1c2ccsc2CCN1C(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000825219221 608575206 /nfs/dbraw/zinc/57/52/06/608575206.db2.gz IBWBYAJWBWCJFN-CQSZACIVSA-N -1 3 373.869 3.731 20 0 FHADHM Cc1ccc(F)c2c1N(C(=O)c1ccc(Cl)c(-c3nnn[n-]3)c1)CCC2 ZINC000826290018 608575634 /nfs/dbraw/zinc/57/56/34/608575634.db2.gz WPFOBHZKOJUYKF-UHFFFAOYSA-N -1 3 371.803 3.561 20 0 FHADHM Cc1ccc(F)c2c1N(C(=O)c1ccc(Cl)c(-c3nn[n-]n3)c1)CCC2 ZINC000826290018 608575636 /nfs/dbraw/zinc/57/56/36/608575636.db2.gz WPFOBHZKOJUYKF-UHFFFAOYSA-N -1 3 371.803 3.561 20 0 FHADHM FC(F)(F)c1cccc([C@@H](Nc2ncccc2-c2nnn[n-]2)C2CC2)c1 ZINC000826369232 608800125 /nfs/dbraw/zinc/80/01/25/608800125.db2.gz STJULNANECAOMA-AWEZNQCLSA-N -1 3 360.343 3.844 20 0 FHADHM FC(F)(F)c1cccc([C@@H](Nc2ncccc2-c2nn[n-]n2)C2CC2)c1 ZINC000826369232 608800127 /nfs/dbraw/zinc/80/01/27/608800127.db2.gz STJULNANECAOMA-AWEZNQCLSA-N -1 3 360.343 3.844 20 0 FHADHM C[C@H](N[C@@H](c1ccccc1)c1ccncc1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824540202 609136388 /nfs/dbraw/zinc/13/63/88/609136388.db2.gz SYGOEOKSEOWLEN-XOBRGWDASA-N -1 3 374.423 3.841 20 0 FHADHM C[C@H](N[C@@H](c1ccccc1)c1ccncc1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824540202 609136390 /nfs/dbraw/zinc/13/63/90/609136390.db2.gz SYGOEOKSEOWLEN-XOBRGWDASA-N -1 3 374.423 3.841 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CCC[C@H]1/C=C\c1ccccc1 ZINC000826278379 609157609 /nfs/dbraw/zinc/15/76/09/609157609.db2.gz ZHJZVQUJLXNHRT-ANGAQGJPSA-N -1 3 374.448 3.885 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CCC[C@H]1/C=C\c1ccccc1 ZINC000826278379 609157611 /nfs/dbraw/zinc/15/76/11/609157611.db2.gz ZHJZVQUJLXNHRT-ANGAQGJPSA-N -1 3 374.448 3.885 20 0 FHADHM CCC(=O)Nc1ccc(C)c(N[C@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)c1 ZINC000825034921 609157704 /nfs/dbraw/zinc/15/77/04/609157704.db2.gz UJMRXNFCQOFSJV-GFCCVEGCSA-N -1 3 368.416 3.836 20 0 FHADHM CCC(=O)Nc1ccc(C)c(N[C@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)c1 ZINC000825034921 609157705 /nfs/dbraw/zinc/15/77/05/609157705.db2.gz UJMRXNFCQOFSJV-GFCCVEGCSA-N -1 3 368.416 3.836 20 0 FHADHM CCC(=O)Nc1ccc(C)c(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000825034158 609157802 /nfs/dbraw/zinc/15/78/02/609157802.db2.gz FMRVTKOLPMQPFJ-CYBMUJFWSA-N -1 3 350.426 3.697 20 0 FHADHM CCC(=O)Nc1ccc(C)c(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000825034158 609157803 /nfs/dbraw/zinc/15/78/03/609157803.db2.gz FMRVTKOLPMQPFJ-CYBMUJFWSA-N -1 3 350.426 3.697 20 0 FHADHM CC(C)C[C@H]1C[C@@H](Nc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)CCO1 ZINC000824243572 609171116 /nfs/dbraw/zinc/17/11/16/609171116.db2.gz JKXVJRHAGBWKMG-STQMWFEESA-N -1 3 369.391 3.891 20 0 FHADHM CC(C)C[C@H]1C[C@@H](Nc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)CCO1 ZINC000824245425 609171755 /nfs/dbraw/zinc/17/17/55/609171755.db2.gz ZMVCKDGTLCYNQX-STQMWFEESA-N -1 3 369.391 3.891 20 0 FHADHM CC(C)C[C@H]1C[C@@H](Nc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)CCO1 ZINC000824245425 609171757 /nfs/dbraw/zinc/17/17/57/609171757.db2.gz ZMVCKDGTLCYNQX-STQMWFEESA-N -1 3 369.391 3.891 20 0 FHADHM CC(C)C[C@H]1C[C@H](Nc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)CCO1 ZINC000824245421 609171900 /nfs/dbraw/zinc/17/19/00/609171900.db2.gz ZMVCKDGTLCYNQX-OLZOCXBDSA-N -1 3 369.391 3.891 20 0 FHADHM CC(C)C[C@H]1C[C@H](Nc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)CCO1 ZINC000824245421 609171903 /nfs/dbraw/zinc/17/19/03/609171903.db2.gz ZMVCKDGTLCYNQX-OLZOCXBDSA-N -1 3 369.391 3.891 20 0 FHADHM C[C@@H](Nc1ccc(OC(F)F)c(F)c1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824658412 609180243 /nfs/dbraw/zinc/18/02/43/609180243.db2.gz XALMXMJVFPXXCW-MRVPVSSYSA-N -1 3 367.306 3.919 20 0 FHADHM C[C@@H](Nc1ccc(OC(F)F)c(F)c1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824658412 609180244 /nfs/dbraw/zinc/18/02/44/609180244.db2.gz XALMXMJVFPXXCW-MRVPVSSYSA-N -1 3 367.306 3.919 20 0 FHADHM C[C@H](Nc1ccc(F)cc1OCC1CC1)c1cccc(-c2nnn[n-]2)c1 ZINC000824656499 609238858 /nfs/dbraw/zinc/23/88/58/609238858.db2.gz KYVBBTFLGZSTQY-LBPRGKRZSA-N -1 3 353.401 3.968 20 0 FHADHM C[C@H](Nc1ccc(F)cc1OCC1CC1)c1cccc(-c2nn[n-]n2)c1 ZINC000824656499 609238860 /nfs/dbraw/zinc/23/88/60/609238860.db2.gz KYVBBTFLGZSTQY-LBPRGKRZSA-N -1 3 353.401 3.968 20 0 FHADHM C[C@@H](Nc1ccccc1OCC(F)F)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824662371 609243649 /nfs/dbraw/zinc/24/36/49/609243649.db2.gz IWOHGGFKWCLLDU-SNVBAGLBSA-N -1 3 363.343 3.823 20 0 FHADHM C[C@@H](Nc1ccccc1OCC(F)F)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824662371 609243651 /nfs/dbraw/zinc/24/36/51/609243651.db2.gz IWOHGGFKWCLLDU-SNVBAGLBSA-N -1 3 363.343 3.823 20 0 FHADHM C[C@@H](Nc1cnn(-c2ccccc2Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824662404 609251450 /nfs/dbraw/zinc/25/14/50/609251450.db2.gz JJXFPLYACURQAY-GFCCVEGCSA-N -1 3 365.828 3.879 20 0 FHADHM C[C@@H](Nc1cnn(-c2ccccc2Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824662404 609251452 /nfs/dbraw/zinc/25/14/52/609251452.db2.gz JJXFPLYACURQAY-GFCCVEGCSA-N -1 3 365.828 3.879 20 0 FHADHM C[C@@H](Nc1ccc(-n2ccnc2)c(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824658564 609277761 /nfs/dbraw/zinc/27/77/61/609277761.db2.gz YLZJKDSHFICJRL-GFCCVEGCSA-N -1 3 365.828 3.879 20 0 FHADHM C[C@@H](Nc1ccc(-n2ccnc2)c(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824658564 609277763 /nfs/dbraw/zinc/27/77/63/609277763.db2.gz YLZJKDSHFICJRL-GFCCVEGCSA-N -1 3 365.828 3.879 20 0 FHADHM C[C@@H](Nc1ccc(-n2cccn2)c(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824657222 609277767 /nfs/dbraw/zinc/27/77/67/609277767.db2.gz PVMLXAVCMKXVNP-GFCCVEGCSA-N -1 3 365.828 3.879 20 0 FHADHM C[C@@H](Nc1ccc(-n2cccn2)c(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824657222 609277769 /nfs/dbraw/zinc/27/77/69/609277769.db2.gz PVMLXAVCMKXVNP-GFCCVEGCSA-N -1 3 365.828 3.879 20 0 FHADHM C[C@H](Nc1ccc(F)cc1OC(F)F)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824655087 609279018 /nfs/dbraw/zinc/27/90/18/609279018.db2.gz BFCHOURPTBFZJT-QMMMGPOBSA-N -1 3 367.306 3.919 20 0 FHADHM C[C@H](Nc1ccc(F)cc1OC(F)F)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824655087 609279020 /nfs/dbraw/zinc/27/90/20/609279020.db2.gz BFCHOURPTBFZJT-QMMMGPOBSA-N -1 3 367.306 3.919 20 0 FHADHM C[C@H](Nc1ccc2c(cnn2C(F)F)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824657904 609279226 /nfs/dbraw/zinc/27/92/26/609279226.db2.gz SJKXXRXOULLJDS-JTQLQIEISA-N -1 3 355.352 3.785 20 0 FHADHM C[C@H](Nc1ccc2c(cnn2C(F)F)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824657904 609279228 /nfs/dbraw/zinc/27/92/28/609279228.db2.gz SJKXXRXOULLJDS-JTQLQIEISA-N -1 3 355.352 3.785 20 0 FHADHM CC1(C(=O)N2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)CCCCCC1 ZINC000824779147 609283955 /nfs/dbraw/zinc/28/39/55/609283955.db2.gz TVTQXSOTIQVPDX-UHFFFAOYSA-N -1 3 365.481 3.843 20 0 FHADHM CC1(C(=O)N2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)CCCCCC1 ZINC000824779147 609283957 /nfs/dbraw/zinc/28/39/57/609283957.db2.gz TVTQXSOTIQVPDX-UHFFFAOYSA-N -1 3 365.481 3.843 20 0 FHADHM Fc1ccc(NCc2ccccc2N2CCCCC2)c(-c2nnn[n-]2)c1 ZINC000826375301 609321256 /nfs/dbraw/zinc/32/12/56/609321256.db2.gz HWCNKKZLRHZTMI-UHFFFAOYSA-N -1 3 352.417 3.608 20 0 FHADHM Fc1ccc(NCc2ccccc2N2CCCCC2)c(-c2nn[n-]n2)c1 ZINC000826375301 609321258 /nfs/dbraw/zinc/32/12/58/609321258.db2.gz HWCNKKZLRHZTMI-UHFFFAOYSA-N -1 3 352.417 3.608 20 0 FHADHM FC(F)(F)CCSCc1ccc(-c2nnn[n-]2)cc1Br ZINC000826367629 609329647 /nfs/dbraw/zinc/32/96/47/609329647.db2.gz HNNXOOLXTSUZIT-UHFFFAOYSA-N -1 3 367.194 3.815 20 0 FHADHM FC(F)(F)CCSCc1ccc(-c2nn[n-]n2)cc1Br ZINC000826367629 609329650 /nfs/dbraw/zinc/32/96/50/609329650.db2.gz HNNXOOLXTSUZIT-UHFFFAOYSA-N -1 3 367.194 3.815 20 0 FHADHM CCc1cc(NC(=O)CSCc2ccc(-c3nnn[n-]3)cc2)ccc1C ZINC000825700924 609331005 /nfs/dbraw/zinc/33/10/05/609331005.db2.gz ZLIAVGQFEBOAAM-UHFFFAOYSA-N -1 3 367.478 3.609 20 0 FHADHM CCc1cc(NC(=O)CSCc2ccc(-c3nn[n-]n3)cc2)ccc1C ZINC000825700924 609331006 /nfs/dbraw/zinc/33/10/06/609331006.db2.gz ZLIAVGQFEBOAAM-UHFFFAOYSA-N -1 3 367.478 3.609 20 0 FHADHM C[C@H](NC(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1)C1CCC1 ZINC000824521253 609331689 /nfs/dbraw/zinc/33/16/89/609331689.db2.gz IVMUSEWHJISIAI-ZDUSSCGKSA-N -1 3 363.421 3.577 20 0 FHADHM C[C@H](NC(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1)C1CCC1 ZINC000824521253 609331691 /nfs/dbraw/zinc/33/16/91/609331691.db2.gz IVMUSEWHJISIAI-ZDUSSCGKSA-N -1 3 363.421 3.577 20 0 FHADHM CCOc1ccccc1[C@H](C)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000825654114 609332500 /nfs/dbraw/zinc/33/25/00/609332500.db2.gz OPHNOGDXVAUSGB-OLZOCXBDSA-N -1 3 355.417 3.816 20 0 FHADHM C[C@H](NCc1ccccc1OC1CCC1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824626407 609342763 /nfs/dbraw/zinc/34/27/63/609342763.db2.gz OAFNLPIADNKXMF-ZDUSSCGKSA-N -1 3 367.428 3.788 20 0 FHADHM Cc1c(NCc2ccc(-c3nnn[n-]3)cc2)cnn1-c1cc(C)ccc1C ZINC000826284075 609344827 /nfs/dbraw/zinc/34/48/27/609344827.db2.gz JDYOAAYPHORSLE-UHFFFAOYSA-N -1 3 359.437 3.590 20 0 FHADHM Cc1c(NCc2ccc(-c3nn[n-]n3)cc2)cnn1-c1cc(C)ccc1C ZINC000826284075 609344829 /nfs/dbraw/zinc/34/48/29/609344829.db2.gz JDYOAAYPHORSLE-UHFFFAOYSA-N -1 3 359.437 3.590 20 0 FHADHM CCc1cc(NCc2cn(C)nc2-c2ccc(-c3nnn[n-]3)cc2)ccc1C ZINC000825700532 609346146 /nfs/dbraw/zinc/34/61/46/609346146.db2.gz JKFFJZGDYDMECO-UHFFFAOYSA-N -1 3 373.464 3.750 20 0 FHADHM CCc1cc(NCc2cn(C)nc2-c2ccc(-c3nn[n-]n3)cc2)ccc1C ZINC000825700532 609346147 /nfs/dbraw/zinc/34/61/47/609346147.db2.gz JKFFJZGDYDMECO-UHFFFAOYSA-N -1 3 373.464 3.750 20 0 FHADHM CCOc1ccc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2F)cc1OC ZINC000825643492 609349558 /nfs/dbraw/zinc/34/95/58/609349558.db2.gz ORFMVQAQARVNSF-NSHDSACASA-N -1 3 357.389 3.586 20 0 FHADHM CCOc1ccc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2F)cc1OC ZINC000825643492 609349560 /nfs/dbraw/zinc/34/95/60/609349560.db2.gz ORFMVQAQARVNSF-NSHDSACASA-N -1 3 357.389 3.586 20 0 FHADHM C[C@@H](Nc1ccn(-c2cccc(F)c2-c2nnn[n-]2)n1)c1ccccc1F ZINC000824662568 609350925 /nfs/dbraw/zinc/35/09/25/609350925.db2.gz NGDKKSRCNPVPMF-LLVKDONJSA-N -1 3 367.363 3.504 20 0 FHADHM OCc1ccc(COc2ccc(-c3ccc(-c4nnn[n-]4)cc3)cc2)cc1 ZINC000826510184 609416019 /nfs/dbraw/zinc/41/60/19/609416019.db2.gz BUNOIOOMYNAPMP-UHFFFAOYSA-N -1 3 358.401 3.605 20 0 FHADHM OCc1ccc(COc2ccc(-c3ccc(-c4nn[n-]n4)cc3)cc2)cc1 ZINC000826510184 609416021 /nfs/dbraw/zinc/41/60/21/609416021.db2.gz BUNOIOOMYNAPMP-UHFFFAOYSA-N -1 3 358.401 3.605 20 0 FHADHM CCC(CC)c1cc(CNc2cc(-c3nnn[n-]3)ccc2C(C)=O)on1 ZINC000825114202 609423191 /nfs/dbraw/zinc/42/31/91/609423191.db2.gz LFTLKXGLLMPXEI-UHFFFAOYSA-N -1 3 354.414 3.573 20 0 FHADHM CCC(CC)c1cc(CNc2cc(-c3nn[n-]n3)ccc2C(C)=O)on1 ZINC000825114202 609423194 /nfs/dbraw/zinc/42/31/94/609423194.db2.gz LFTLKXGLLMPXEI-UHFFFAOYSA-N -1 3 354.414 3.573 20 0 FHADHM CC(C)N(CCCSc1cccc(-c2nnn[n-]2)c1)CC(F)(F)F ZINC000824288922 609434700 /nfs/dbraw/zinc/43/47/00/609434700.db2.gz QDUSZSJNFNNTQN-UHFFFAOYSA-N -1 3 359.421 3.622 20 0 FHADHM CC(C)N(CCCSc1cccc(-c2nn[n-]n2)c1)CC(F)(F)F ZINC000824288922 609434701 /nfs/dbraw/zinc/43/47/01/609434701.db2.gz QDUSZSJNFNNTQN-UHFFFAOYSA-N -1 3 359.421 3.622 20 0 FHADHM CC[C@H](C)NC(=O)N[C@@H](C)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000825068444 609441466 /nfs/dbraw/zinc/44/14/66/609441466.db2.gz RUDJLNHTPWKRIS-KBPBESRZSA-N -1 3 364.453 3.692 20 0 FHADHM CC[C@H](C)NC(=O)N[C@@H](C)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000825068444 609441467 /nfs/dbraw/zinc/44/14/67/609441467.db2.gz RUDJLNHTPWKRIS-KBPBESRZSA-N -1 3 364.453 3.692 20 0 FHADHM CC(C)CNC(=O)N[C@H](C)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824266583 609442912 /nfs/dbraw/zinc/44/29/12/609442912.db2.gz NMGALHCCDQJWQK-CQSZACIVSA-N -1 3 364.453 3.550 20 0 FHADHM CC(C)CNC(=O)N[C@H](C)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824266583 609442915 /nfs/dbraw/zinc/44/29/15/609442915.db2.gz NMGALHCCDQJWQK-CQSZACIVSA-N -1 3 364.453 3.550 20 0 FHADHM CCc1nnc([C@H](C)Sc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)o1 ZINC000825762670 609453023 /nfs/dbraw/zinc/45/30/23/609453023.db2.gz GMZYDBQKPSYNHJ-ZETCQYMHSA-N -1 3 370.360 3.684 20 0 FHADHM CCc1nnc([C@H](C)Sc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)o1 ZINC000825762670 609453026 /nfs/dbraw/zinc/45/30/26/609453026.db2.gz GMZYDBQKPSYNHJ-ZETCQYMHSA-N -1 3 370.360 3.684 20 0 FHADHM OCCCCCCCSc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000826508825 609453574 /nfs/dbraw/zinc/45/35/74/609453574.db2.gz CRKZJGRCICUXLA-UHFFFAOYSA-N -1 3 360.405 3.920 20 0 FHADHM OCCCCCCCSc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000826508825 609453576 /nfs/dbraw/zinc/45/35/76/609453576.db2.gz CRKZJGRCICUXLA-UHFFFAOYSA-N -1 3 360.405 3.920 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NCc1cc2cccc(OC)c2o1 ZINC000825632419 609477386 /nfs/dbraw/zinc/47/73/86/609477386.db2.gz QYJLACWRWXJZPB-UHFFFAOYSA-N -1 3 365.393 3.632 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NCc1cc2cccc(OC)c2o1 ZINC000825632419 609477388 /nfs/dbraw/zinc/47/73/88/609477388.db2.gz QYJLACWRWXJZPB-UHFFFAOYSA-N -1 3 365.393 3.632 20 0 FHADHM Fc1ccc(NCc2cccc(-c3nnn[n-]3)c2F)c(OCC2CC2)c1 ZINC000826375662 609479029 /nfs/dbraw/zinc/47/90/29/609479029.db2.gz XKTADMWJXFDQPE-UHFFFAOYSA-N -1 3 357.364 3.546 20 0 FHADHM Fc1ccc(NCc2cccc(-c3nn[n-]n3)c2F)c(OCC2CC2)c1 ZINC000826375662 609479031 /nfs/dbraw/zinc/47/90/31/609479031.db2.gz XKTADMWJXFDQPE-UHFFFAOYSA-N -1 3 357.364 3.546 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NCc1cc(Cl)cc2cccnc21 ZINC000826278603 609479362 /nfs/dbraw/zinc/47/93/62/609479362.db2.gz LDFLSBRMLCBFGU-UHFFFAOYSA-N -1 3 350.813 3.989 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NCc1cc(Cl)cc2cccnc21 ZINC000826278603 609479364 /nfs/dbraw/zinc/47/93/64/609479364.db2.gz LDFLSBRMLCBFGU-UHFFFAOYSA-N -1 3 350.813 3.989 20 0 FHADHM Cc1nnc(SCCCc2ccccc2Cl)c(-c2nnn[n-]2)c1C ZINC000826336841 609488273 /nfs/dbraw/zinc/48/82/73/609488273.db2.gz QAQTVLUCKUVDPO-UHFFFAOYSA-N -1 3 360.874 3.652 20 0 FHADHM Cc1nnc(SCCCc2ccccc2Cl)c(-c2nn[n-]n2)c1C ZINC000826336841 609488275 /nfs/dbraw/zinc/48/82/75/609488275.db2.gz QAQTVLUCKUVDPO-UHFFFAOYSA-N -1 3 360.874 3.652 20 0 FHADHM Cc1c(Cl)cnc(N[C@@H]2CCC[C@H](C(F)(F)F)C2)c1-c1nnn[n-]1 ZINC000826239189 609526560 /nfs/dbraw/zinc/52/65/60/609526560.db2.gz ZQRXTUUPBHKDJK-DTWKUNHWSA-N -1 3 360.771 3.757 20 0 FHADHM Cc1c(Cl)cnc(N[C@@H]2CCC[C@H](C(F)(F)F)C2)c1-c1nn[n-]n1 ZINC000826239189 609526561 /nfs/dbraw/zinc/52/65/61/609526561.db2.gz ZQRXTUUPBHKDJK-DTWKUNHWSA-N -1 3 360.771 3.757 20 0 FHADHM Cc1ccccc1[C@H]1CCCN1c1ncc(Cl)c(C)c1-c1nnn[n-]1 ZINC000826306496 609537661 /nfs/dbraw/zinc/53/76/61/609537661.db2.gz BELMTZYEJNMJMK-OAHLLOKOSA-N -1 3 354.845 3.873 20 0 FHADHM Cc1ccccc1[C@H]1CCCN1c1ncc(Cl)c(C)c1-c1nn[n-]n1 ZINC000826306496 609537663 /nfs/dbraw/zinc/53/76/63/609537663.db2.gz BELMTZYEJNMJMK-OAHLLOKOSA-N -1 3 354.845 3.873 20 0 FHADHM Cc1ccnc(N2CCC[C@@H]2c2ccccc2C(F)(F)F)c1-c1nnn[n-]1 ZINC000826310781 609547944 /nfs/dbraw/zinc/54/79/44/609547944.db2.gz ICJJWOQNAYQFMR-CQSZACIVSA-N -1 3 374.370 3.930 20 0 FHADHM Cc1ccnc(N2CCC[C@@H]2c2ccccc2C(F)(F)F)c1-c1nn[n-]n1 ZINC000826310781 609547947 /nfs/dbraw/zinc/54/79/47/609547947.db2.gz ICJJWOQNAYQFMR-CQSZACIVSA-N -1 3 374.370 3.930 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1N1CCC[C@H]1/C=C/c1ccccc1 ZINC000826350952 609580375 /nfs/dbraw/zinc/58/03/75/609580375.db2.gz RGEIDWWYJJXXRZ-HVHJFMEUSA-N -1 3 352.829 3.597 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1N1CCC[C@H]1/C=C/c1ccccc1 ZINC000826350952 609580377 /nfs/dbraw/zinc/58/03/77/609580377.db2.gz RGEIDWWYJJXXRZ-HVHJFMEUSA-N -1 3 352.829 3.597 20 0 FHADHM CC/C(C)=C(\C)C(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000825049548 609586968 /nfs/dbraw/zinc/58/69/68/609586968.db2.gz CLZZKIJIMHTJTE-OUKQBFOZSA-N -1 3 367.478 3.958 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)N1CCC[C@@H]1/C=C\c1ccccc1 ZINC000826452439 609606811 /nfs/dbraw/zinc/60/68/11/609606811.db2.gz TZCJVFPTEWGWJD-RUEYPURISA-N -1 3 360.421 3.576 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)N1CCC[C@@H]1/C=C\c1ccccc1 ZINC000826452439 609606814 /nfs/dbraw/zinc/60/68/14/609606814.db2.gz TZCJVFPTEWGWJD-RUEYPURISA-N -1 3 360.421 3.576 20 0 FHADHM CC/C(C)=C(/C)C(=O)NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000825050362 609609579 /nfs/dbraw/zinc/60/95/79/609609579.db2.gz IIZPOYGBACYTFJ-PFONDFGASA-N -1 3 361.449 3.896 20 0 FHADHM CC/C(C)=C(/C)C(=O)NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000825050362 609609581 /nfs/dbraw/zinc/60/95/81/609609581.db2.gz IIZPOYGBACYTFJ-PFONDFGASA-N -1 3 361.449 3.896 20 0 FHADHM O=C(OCc1ccc(Cl)cc1-c1nnn[n-]1)c1c(F)cccc1Cl ZINC000826465661 609616678 /nfs/dbraw/zinc/61/66/78/609616678.db2.gz WOLIDTPEGAVNAW-UHFFFAOYSA-N -1 3 367.167 3.670 20 0 FHADHM O=C(OCc1ccc(Cl)cc1-c1nn[n-]n1)c1c(F)cccc1Cl ZINC000826465661 609616679 /nfs/dbraw/zinc/61/66/79/609616679.db2.gz WOLIDTPEGAVNAW-UHFFFAOYSA-N -1 3 367.167 3.670 20 0 FHADHM Cc1nc(-c2ccc(F)cc2)sc1C(=O)N=c1cc2ccccn2[n-]1 ZINC000582981868 936342108 /nfs/dbraw/zinc/34/21/08/936342108.db2.gz NLBWQJQAZODALJ-UHFFFAOYSA-N -1 3 352.394 3.580 20 0 FHADHM C[C@H](c1nc(-c2cccc(C(F)(F)F)c2)no1)N1CC[C@@H](C(=O)[O-])[C@H]1C ZINC000583030094 936379677 /nfs/dbraw/zinc/37/96/77/936379677.db2.gz DTQDIPLEHODQFQ-GIPNMCIBSA-N -1 3 369.343 3.611 20 0 FHADHM [O-]c1cc(F)cc(CNc2ccn(-c3ccc(Br)cc3)n2)c1 ZINC000583037772 936387623 /nfs/dbraw/zinc/38/76/23/936387623.db2.gz PCMZZRPDMGAPKQ-UHFFFAOYSA-N -1 3 362.202 3.514 20 0 FHADHM CO[C@@H](CS(=O)(=O)[N-]c1cccc(Br)c1Cl)C(C)C ZINC000647275583 937119515 /nfs/dbraw/zinc/11/95/15/937119515.db2.gz NQOSLGYBEKWVFB-NSHDSACASA-N -1 3 370.696 3.515 20 0 FHADHM 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932174392 /nfs/dbraw/zinc/17/43/92/932174392.db2.gz IRDKBARVXYKQMY-XOIDGJRKSA-N -1 3 356.179 3.808 20 0 FHADHM CO[C@@H](CS(=O)(=O)[N-]c1ccc2cnn(C(C)C)c2c1)C1CCCC1 ZINC000656621277 932201740 /nfs/dbraw/zinc/20/17/40/932201740.db2.gz OCMRSRAZXKEAOM-SFHVURJKSA-N -1 3 365.499 3.564 20 0 FHADHM CO[C@@H](CS(=O)(=O)[N-]c1cc(C(C)=O)ccc1Cl)C1CCCCC1 ZINC000656625974 932210214 /nfs/dbraw/zinc/21/02/14/932210214.db2.gz JVANRMABAJMFNY-KRWDZBQOSA-N -1 3 373.902 3.880 20 0 FHADHM CCCCn1ncc([N-]S(=O)(=O)CCc2ccc(F)cc2)c1C(C)C ZINC000656628359 932214080 /nfs/dbraw/zinc/21/40/80/932214080.db2.gz MNDGHNOSDQSWNA-UHFFFAOYSA-N -1 3 367.490 3.930 20 0 FHADHM CC[C@@H](C)Oc1cccc(S(=O)(=O)Nc2cc([O-])c(F)cc2F)c1 ZINC000656631395 932218759 /nfs/dbraw/zinc/21/87/59/932218759.db2.gz KTUHCWOGAKBGEW-SNVBAGLBSA-N -1 3 357.378 3.649 20 0 FHADHM CO[C@@H](CS(=O)(=O)[N-]c1ccc2ccn(C(F)F)c2c1)C1CCCC1 ZINC000656633990 932221870 /nfs/dbraw/zinc/22/18/70/932221870.db2.gz LSJASRFLHJYUIS-INIZCTEOSA-N -1 3 372.437 3.983 20 0 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Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)NCc1ncccc1[O-] ZINC000471741386 932761909 /nfs/dbraw/zinc/76/19/09/932761909.db2.gz QMRWGOSMPDAMCI-ZDUSSCGKSA-N -1 3 368.462 3.780 20 0 FHADHM CCC[C@@]1([N-]S(=O)(=O)c2ccc(Cl)cc2C(F)(F)F)CCOC1 ZINC000510472175 932836091 /nfs/dbraw/zinc/83/60/91/932836091.db2.gz MJZCQCURHQJIKN-CYBMUJFWSA-N -1 3 371.808 3.596 20 0 FHADHM CC(C)c1ccc([C@H](NC(=O)CN2CCCC[C@@H]2CC(=O)[O-])C(C)C)cc1 ZINC000650504398 932837280 /nfs/dbraw/zinc/83/72/80/932837280.db2.gz LPDBHKDOKCAKPO-DENIHFKCSA-N -1 3 374.525 3.953 20 0 FHADHM Cc1cc(F)cc2c(=O)c(C(=O)N3CCc4ccc(Cl)cc43)c[n-]c12 ZINC000178204351 932885738 /nfs/dbraw/zinc/88/57/38/932885738.db2.gz UBMMYMLNSGSLJF-UHFFFAOYSA-N -1 3 356.784 3.832 20 0 FHADHM O=C1[N-]C(=O)C(=CNc2ccc(COC3CCCC3)cc2)c2ccccc21 ZINC000157980438 932987922 /nfs/dbraw/zinc/98/79/22/932987922.db2.gz CJKFPVFFJNHTAD-DEDYPNTBSA-N -1 3 362.429 3.869 20 0 FHADHM O=C(CNC(=O)c1cc([O-])ccc1Cl)Nc1cc(Cl)ccc1Cl ZINC000581950737 933099330 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CCC[C@H](NC(=O)c1cc(NC(=O)c2cnoc2C)ccc1[O-])C1CCC1 ZINC000458324949 934698502 /nfs/dbraw/zinc/69/85/02/934698502.db2.gz IASVAEJMHSKJMS-KRWDZBQOSA-N -1 3 371.437 3.640 20 0 FHADHM CCC[C@@H](NC(=O)c1cc(NC(=O)c2cnoc2C)ccc1[O-])C1CCC1 ZINC000458324951 934699249 /nfs/dbraw/zinc/69/92/49/934699249.db2.gz IASVAEJMHSKJMS-QGZVFWFLSA-N -1 3 371.437 3.640 20 0 FHADHM O=S(=O)([N-]C1CCC2(CC2(F)F)CC1)c1cc(F)ccc1Cl ZINC000657198019 934743478 /nfs/dbraw/zinc/74/34/78/934743478.db2.gz VQYOWBNYLUAWJJ-UHFFFAOYSA-N -1 3 353.793 3.725 20 0 FHADHM Cc1cc(S(=O)(=O)[N-]C2CCC3(CC3(F)F)CC2)c(F)cc1F ZINC000657198254 934748871 /nfs/dbraw/zinc/74/88/71/934748871.db2.gz ZDLNKVPVHDYPKF-UHFFFAOYSA-N -1 3 351.365 3.520 20 0 FHADHM O=C(NCc1ncccc1[O-])N[C@H](Cc1ccccc1)c1ccccc1F ZINC000472005332 934810665 /nfs/dbraw/zinc/81/06/65/934810665.db2.gz JZFTYBCPQUHQBG-GOSISDBHSA-N -1 3 365.408 3.710 20 0 FHADHM COc1ccc(C(=O)N(Cc2ccco2)Cc2ccc(O)cc2)c([O-])c1 ZINC000092763860 934892627 /nfs/dbraw/zinc/89/26/27/934892627.db2.gz 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CC[C@H](C)NC(=O)c1cccc(CNC(=O)c2cc([O-])ccc2Cl)c1 ZINC000277431491 935166163 /nfs/dbraw/zinc/16/61/63/935166163.db2.gz MYQUNOCWRFSSPD-LBPRGKRZSA-N -1 3 360.841 3.504 20 0 FHADHM COc1cnc([C@@H]2CCCN2CCOc2cccc3ccccc32)[n-]c1=O ZINC000934278637 935241317 /nfs/dbraw/zinc/24/13/17/935241317.db2.gz VAORLTYYEIETPM-KRWDZBQOSA-N -1 3 365.433 3.560 20 0 FHADHM O=C(N=c1cc(-c2ccccc2)[n-][nH]1)c1cc(F)ccc1Br ZINC000519067331 945090837 /nfs/dbraw/zinc/09/08/37/945090837.db2.gz WPYDVVRXQRDPJR-UHFFFAOYSA-N -1 3 360.186 3.653 20 0 FHADHM Fc1cc2cccnc2c(CSc2ccc(-c3nnn[n-]3)cc2F)c1 ZINC000737643129 945107171 /nfs/dbraw/zinc/10/71/71/945107171.db2.gz BDRNJDKVQXKVLR-UHFFFAOYSA-N -1 3 355.373 3.985 20 0 FHADHM Fc1cc2cccnc2c(CSc2ccc(-c3nn[n-]n3)cc2F)c1 ZINC000737643129 945107176 /nfs/dbraw/zinc/10/71/76/945107176.db2.gz BDRNJDKVQXKVLR-UHFFFAOYSA-N -1 3 355.373 3.985 20 0 FHADHM Cc1cn2ccc(NC(=O)c3c[n-]c(=NC(=O)OC(C)(C)C)s3)cc2n1 ZINC001167767450 945111500 /nfs/dbraw/zinc/11/15/00/945111500.db2.gz 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366.461 3.653 20 0 FHADHM O=C(C[C@H](NC(=O)c1ccc([O-])cc1)c1ccccc1)Nc1ccccc1 ZINC000182874439 941465779 /nfs/dbraw/zinc/46/57/79/941465779.db2.gz QZGHXYNUJQNSQG-FQEVSTJZSA-N -1 3 360.413 3.892 20 0 FHADHM CCCCCNC(=O)C[C@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000182870127 941466036 /nfs/dbraw/zinc/46/60/36/941466036.db2.gz OUIGCLCRNJAWQW-IBGZPJMESA-N -1 3 354.450 3.560 20 0 FHADHM C[C@H]1CCCCN1C(=O)C[C@@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000182886850 941469106 /nfs/dbraw/zinc/46/91/06/941469106.db2.gz JKJZKYJEVBXFSP-OXJNMPFZSA-N -1 3 366.461 3.654 20 0 FHADHM Cn1nc(C(F)(F)F)cc1COC(=O)c1cccc2[n-]c(C(F)F)nc21 ZINC000924085411 941504003 /nfs/dbraw/zinc/50/40/03/941504003.db2.gz DWPAZXOCOWHOGT-UHFFFAOYSA-N -1 3 374.269 3.610 20 0 FHADHM CCOC(=O)c1cc(NC(=O)c2c(C)c(C)oc2-c2ccccc2)[n-]n1 ZINC000189019910 941535738 /nfs/dbraw/zinc/53/57/38/941535738.db2.gz IGPTZESVOXCUJW-UHFFFAOYSA-N -1 3 353.378 3.716 20 0 FHADHM CCOC(=O)c1cc(NC(=O)c2c(C)c(C)oc2-c2ccccc2)n[n-]1 ZINC000189019910 941535741 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CC(=CC(=O)Nc1ccc(-c2nn[n-]n2)cc1)c1ccc(C(F)(F)F)cc1 ZINC000729357009 941728734 /nfs/dbraw/zinc/72/87/34/941728734.db2.gz LXRBMUUFNVKUCT-ZHACJKMWSA-N -1 3 373.338 3.928 20 0 FHADHM O=S(=O)([N-]CCc1ccsc1)c1ccc(Cl)cc1C(F)(F)F ZINC000513170767 941759003 /nfs/dbraw/zinc/75/90/03/941759003.db2.gz MRBJHAKUWOXKGM-UHFFFAOYSA-N -1 3 369.817 3.941 20 0 FHADHM COc1cc(C(=O)N2CC[C@H](c3ccc(C)cc3C)C2)cc(OC)c1[O-] ZINC000473525347 941765336 /nfs/dbraw/zinc/76/53/36/941765336.db2.gz PQXFFAJDPFSSTG-HNNXBMFYSA-N -1 3 355.434 3.656 20 0 FHADHM C[C@H]1SCCN(CCOc2cccc(C(=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000584535046 941881127 /nfs/dbraw/zinc/88/11/27/941881127.db2.gz ORLDGNSOPRAVMV-BEFAXECRSA-N -1 3 357.475 3.942 20 0 FHADHM O=S(=O)([N-]c1ccc2nc(C3CCC3)[nH]c2c1)c1ccc(F)c(F)c1 ZINC000433814468 941914960 /nfs/dbraw/zinc/91/49/60/941914960.db2.gz WCZOLDXOXNXEDM-UHFFFAOYSA-N -1 3 363.389 3.909 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)c3ccc(NC)s3)c2)n1 ZINC000377806066 942003517 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COC(=O)c1cccc2[n-]c(NC(=O)C3CC(c4ccc(F)cc4)C3)nc21 ZINC000590309802 942111654 /nfs/dbraw/zinc/11/16/54/942111654.db2.gz BGCAXKFAYFFLCY-UHFFFAOYSA-N -1 3 367.380 3.621 20 0 FHADHM Cc1noc(OCc2nc(=O)c3c([n-]2)sc(C)c3-c2ccc(C)cc2)n1 ZINC000501954213 942146648 /nfs/dbraw/zinc/14/66/48/942146648.db2.gz RSWGWWHTTKCRAJ-UHFFFAOYSA-N -1 3 368.418 3.951 20 0 FHADHM CCc1cnc(C[N-]S(=O)(=O)c2c(C)sc3c2cccc3C)o1 ZINC000420692933 942159197 /nfs/dbraw/zinc/15/91/97/942159197.db2.gz SPHDVDJDDFDKFF-UHFFFAOYSA-N -1 3 350.465 3.547 20 0 FHADHM C[C@@H](CC(F)(F)F)[N-]S(=O)(=O)c1cc(Cl)ccc1OC(F)F ZINC000420693625 942160116 /nfs/dbraw/zinc/16/01/16/942160116.db2.gz URMZVNGTMDBVOO-LURJTMIESA-N -1 3 367.723 3.561 20 0 FHADHM Cc1c(C(=O)[N-]c2nnc(-c3ccsc3)s2)nnn1CC1CCCC1 ZINC000280401250 942171680 /nfs/dbraw/zinc/17/16/80/942171680.db2.gz GNGMHRPIELCUAU-UHFFFAOYSA-N -1 3 374.495 3.609 20 0 FHADHM C[C@@H](c1ccc(Cl)cc1)[C@H](C)N(C)C(=O)c1cnc2c(cnn2C)c1[O-] ZINC000182110025 942215267 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CCC[C@@H](NC(=O)CSCc1cc(=O)[n-]c(C2CC2)n1)c1ccccc1 ZINC000419586467 942322938 /nfs/dbraw/zinc/32/29/38/942322938.db2.gz MDIBNFKLGZRLGK-QGZVFWFLSA-N -1 3 371.506 3.950 20 0 FHADHM Cc1ccc(-c2nc(NC(=O)C3(Oc4ccc(Cl)cc4)CC3)n[n-]2)o1 ZINC000501232599 942362232 /nfs/dbraw/zinc/36/22/32/942362232.db2.gz KLNWXTFZDNLRHG-UHFFFAOYSA-N -1 3 358.785 3.577 20 0 FHADHM COc1cc(S(=O)(=O)[N-]c2ccc(N(C)C)cc2C)ccc1Cl ZINC000414432790 942439386 /nfs/dbraw/zinc/43/93/86/942439386.db2.gz AJNXWDKMJWSCOW-UHFFFAOYSA-N -1 3 354.859 3.524 20 0 FHADHM O=C(NC1(Cc2cccc(F)c2)CCC1)c1c[n-]c2ccccc2c1=O ZINC001269734653 942443616 /nfs/dbraw/zinc/44/36/16/942443616.db2.gz JGPWWVIHOJKIBY-UHFFFAOYSA-N -1 3 350.393 3.562 20 0 FHADHM CCCc1nnc([N-]C(=O)c2csc(Cc3cccc(F)c3)n2)s1 ZINC000502537800 942515904 /nfs/dbraw/zinc/51/59/04/942515904.db2.gz NDJRGQOCWVWZAN-UHFFFAOYSA-N -1 3 362.455 3.929 20 0 FHADHM O=C(N[C@@H]1CCSc2ccc(Cl)cc21)c1cc(F)cc2n[n-]nc21 ZINC000501556072 942546575 /nfs/dbraw/zinc/54/65/75/942546575.db2.gz 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ZINC000514053709 942708192 /nfs/dbraw/zinc/70/81/92/942708192.db2.gz ZHWMNCKTZLMURH-UHFFFAOYSA-N -1 3 356.226 3.874 20 0 FHADHM O=C(CCCn1cnc2ccccc21)Nc1ccc(Br)cc1[O-] ZINC000613705432 942749539 /nfs/dbraw/zinc/74/95/39/942749539.db2.gz CCAZREQJBKKSPB-UHFFFAOYSA-N -1 3 374.238 3.923 20 0 FHADHM CCC1(C(=O)N=c2[n-]n(CC(F)(F)F)cc2Br)CCCC1 ZINC000421681964 942756531 /nfs/dbraw/zinc/75/65/31/942756531.db2.gz JLMKKTXGCDWNAR-UHFFFAOYSA-N -1 3 368.197 3.539 20 0 FHADHM C[C@H]1CCCc2nc(S(=O)(=O)[N-]c3c(F)cc(Cl)cc3F)cn21 ZINC000416419182 942802684 /nfs/dbraw/zinc/80/26/84/942802684.db2.gz UDIQAUNXGDGAQZ-QMMMGPOBSA-N -1 3 361.801 3.513 20 0 FHADHM Cc1ccc(Cc2cnc(NC(=O)[N-]OCc3cccnc3)s2)cc1F ZINC000182898454 942802779 /nfs/dbraw/zinc/80/27/79/942802779.db2.gz HBGHHEALBDXEFE-UHFFFAOYSA-N -1 3 372.425 3.830 20 0 FHADHM Cc1nc(-c2ccccc2)sc1C(=O)N=c1cc(-c2ccncc2)[n-][nH]1 ZINC000502969017 942882192 /nfs/dbraw/zinc/88/21/92/942882192.db2.gz NWRCMHKTFQIUGV-UHFFFAOYSA-N -1 3 361.430 3.578 20 0 FHADHM [O-]c1cc(F)cc(CNc2ccc(Cl)c(CN3CCOCC3)c2)c1 ZINC000430091370 942885285 /nfs/dbraw/zinc/88/52/85/942885285.db2.gz WXKMBCPMMWDZIB-UHFFFAOYSA-N -1 3 350.821 3.629 20 0 FHADHM O=C(Nc1ccc(OC2CCCC2)c(F)c1)c1cc(F)cc2n[n-]nc21 ZINC000502994829 942897353 /nfs/dbraw/zinc/89/73/53/942897353.db2.gz XGJXFXKWWHQKPJ-UHFFFAOYSA-N -1 3 358.348 3.810 20 0 FHADHM O=S(=O)([N-]c1ccc(OC2CCCC2)cc1)c1ccc2c(c1)CCO2 ZINC000514386254 942976355 /nfs/dbraw/zinc/97/63/55/942976355.db2.gz ZWZFBQNJMKZQHY-UHFFFAOYSA-N -1 3 359.447 3.744 20 0 FHADHM C[C@H]1C[C@H]([N-]S(=O)(=O)c2cc(Cl)ccc2C(F)(F)F)CS1 ZINC000416581857 942984234 /nfs/dbraw/zinc/98/42/34/942984234.db2.gz FWCBIKNJXAVQQI-CBAPKCEASA-N -1 3 359.822 3.531 20 0 FHADHM CC[C@@H](C[N-]S(=O)(=O)c1cc(Cl)ccc1OC)CC(F)(F)F ZINC000416586860 942991440 /nfs/dbraw/zinc/99/14/40/942991440.db2.gz DAKNIEQEFHYKDV-SECBINFHSA-N -1 3 359.797 3.606 20 0 FHADHM CC(C)(C[N-]S(=O)(=O)c1cccc(Cl)c1Cl)c1cccnc1 ZINC000416636341 943017236 /nfs/dbraw/zinc/01/72/36/943017236.db2.gz 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/nfs/dbraw/zinc/18/00/22/943180022.db2.gz WOWPHSUTYSADNQ-UHFFFAOYSA-N -1 3 360.251 3.916 20 0 FHADHM COc1ccc([N-]S(=O)(=O)c2ccc3c(c2)CCC3)cc1OC(C)C ZINC000545473370 943212931 /nfs/dbraw/zinc/21/29/31/943212931.db2.gz MVTWBWPFVJOAIJ-UHFFFAOYSA-N -1 3 361.463 3.772 20 0 FHADHM C[C@@H]1CC[C@@H](C(=O)[O-])CN1Cc1cnc(-c2c(F)cccc2F)s1 ZINC000422637240 943216654 /nfs/dbraw/zinc/21/66/54/943216654.db2.gz QPZMSIGKNLOASJ-GHMZBOCLSA-N -1 3 352.406 3.773 20 0 FHADHM CC(C)[C@H]1C[C@@H](CC(=O)NCc2ccc([O-])c(Br)c2)CCO1 ZINC000272848809 943232501 /nfs/dbraw/zinc/23/25/01/943232501.db2.gz QOAWXSQZPZVZKI-BLLLJJGKSA-N -1 3 370.287 3.612 20 0 FHADHM COC(=O)c1cccc2[n-]c(NC(=O)CCSc3ccc(C)cc3)nc21 ZINC000503591617 943279386 /nfs/dbraw/zinc/27/93/86/943279386.db2.gz SHUDRTVEFXEDDM-UHFFFAOYSA-N -1 3 369.446 3.779 20 0 FHADHM Cc1ccc(NCc2cc(=O)[n-]c(C3CC3)n2)c(OCC(F)(F)F)c1 ZINC000417026235 943301610 /nfs/dbraw/zinc/30/16/10/943301610.db2.gz YTTJSVVYFRVVTP-UHFFFAOYSA-N -1 3 353.344 3.921 20 0 FHADHM COC(=O)c1cc2cccc(NCc3cc(=O)[n-]c(C4CC4)n3)c2s1 ZINC000417040916 943307531 /nfs/dbraw/zinc/30/75/31/943307531.db2.gz PKPGLYPXZRPJHP-UHFFFAOYSA-N -1 3 355.419 3.673 20 0 FHADHM CCCc1cc(=O)[n-]c(C(=Cc2ccc(OCC(=O)OCC)cc2)CC)n1 ZINC000435334808 943337744 /nfs/dbraw/zinc/33/77/44/943337744.db2.gz COGOCLWVJDVTQC-VBKFSLOCSA-N -1 3 370.449 3.615 20 0 FHADHM COC(=O)c1cccc2[n-]c(NC(=O)c3ccc4nc(C)sc4c3)nc21 ZINC000431919509 943338360 /nfs/dbraw/zinc/33/83/60/943338360.db2.gz AKBQIAHTLWTJNG-UHFFFAOYSA-N -1 3 366.402 3.520 20 0 FHADHM CC(=O)c1c(C)cc(C)c(C[S@@](=O)Cc2cc(=O)[n-]c(C3CC3)n2)c1C ZINC000417134688 943372964 /nfs/dbraw/zinc/37/29/64/943372964.db2.gz AQKDAGSXPUDECB-SANMLTNESA-N -1 3 372.490 3.636 20 0 FHADHM O=C(CCn1c(=O)oc2cc(Cl)ccc21)Nc1cc(Cl)ccc1[O-] ZINC000518784913 943390058 /nfs/dbraw/zinc/39/00/58/943390058.db2.gz XWCHBTKMFDCAAF-UHFFFAOYSA-N -1 3 367.188 3.636 20 0 FHADHM CCCc1csc(CNC[C@H](Cc2cccc(Cl)c2)C(=O)[O-])n1 ZINC000417548459 943689755 /nfs/dbraw/zinc/68/97/55/943689755.db2.gz QTJZEOCFIYBENA-ZDUSSCGKSA-N -1 3 352.887 3.782 20 0 FHADHM Cc1nc(CCNCc2cc(Cl)sc2Cl)sc1C(=O)[O-] ZINC000417550962 943696613 /nfs/dbraw/zinc/69/66/13/943696613.db2.gz XYDIGFZDFSVUKK-UHFFFAOYSA-N -1 3 351.280 3.850 20 0 FHADHM CC(C)c1nc2ccc([N-]S(=O)(=O)CCOCC3CC3)cc2s1 ZINC000424066021 943706322 /nfs/dbraw/zinc/70/63/22/943706322.db2.gz MUEWQBQYAOHVOH-UHFFFAOYSA-N -1 3 354.497 3.588 20 0 FHADHM COc1ccc(CN[C@@H](C(=O)[O-])c2ccc(Cl)c(F)c2)c(C)c1OC ZINC000417558274 943706469 /nfs/dbraw/zinc/70/64/69/943706469.db2.gz FCFJZQMUYMDTDZ-MRXNPFEDSA-N -1 3 367.804 3.720 20 0 FHADHM Cc1nn(C)cc1CN[C@@H](CCC(=O)[O-])c1ccc(Cl)c(Cl)c1 ZINC000417571627 943711320 /nfs/dbraw/zinc/71/13/20/943711320.db2.gz OJSRXZYPYOBTSR-HNNXBMFYSA-N -1 3 356.253 3.731 20 0 FHADHM CCC(C)(C)OCc1ccccc1[N-]S(=O)(=O)CCOCC1CC1 ZINC000424059606 943716467 /nfs/dbraw/zinc/71/64/67/943716467.db2.gz BHBRPOKXWVYAGE-UHFFFAOYSA-N -1 3 355.500 3.560 20 0 FHADHM COc1cccc(COc2cccc(Cl)c2CNC[C@@H](C)C(=O)[O-])c1 ZINC000417593532 943740173 /nfs/dbraw/zinc/74/01/73/943740173.db2.gz ZKKMIHQWADZZIW-CYBMUJFWSA-N -1 3 363.841 3.738 20 0 FHADHM Cc1nn(C(C)C)cc1CN[C@]1(C(=O)[O-])C[C@@H](C(C)C)c2ccccc21 ZINC000417594647 943740972 /nfs/dbraw/zinc/74/09/72/943740972.db2.gz WOWJKOIDXISSJG-GHTZIAJQSA-N -1 3 355.482 3.985 20 0 FHADHM CC(C)c1nn(-c2ccccc2)cc1CNC[C@@H](CC(=O)[O-])C(F)(F)F ZINC000417624122 943775659 /nfs/dbraw/zinc/77/56/59/943775659.db2.gz KQBIJPDUMPKQFG-CQSZACIVSA-N -1 3 369.387 3.739 20 0 FHADHM Cc1cc(S(=O)(=O)[N-]c2c(F)cccc2N2CCCC2)cc(C)c1F ZINC000437403874 943779313 /nfs/dbraw/zinc/77/93/13/943779313.db2.gz MBGXHSKFYOVRFM-UHFFFAOYSA-N -1 3 366.433 3.983 20 0 FHADHM Cc1ccc(OCc2nc(CNC[C@H]3CCC[C@H]3C(=O)[O-])cs2)cc1 ZINC000417650321 943780782 /nfs/dbraw/zinc/78/07/82/943780782.db2.gz UVWZRQGOKNVJOF-RHSMWYFYSA-N -1 3 360.479 3.621 20 0 FHADHM O=C(N[C@H]1CC[C@H](c2ccccc2F)C1)c1cc(=O)c2ccccc2[n-]1 ZINC000366666413 943800477 /nfs/dbraw/zinc/80/04/77/943800477.db2.gz PTRZLWPIWXEUQK-KBPBESRZSA-N -1 3 350.393 3.733 20 0 FHADHM O=C([O-])CC[C@H]1CCCCN1Cc1csc(-c2ccc3c(c2)OCO3)n1 ZINC000424255851 943809556 /nfs/dbraw/zinc/80/95/56/943809556.db2.gz IFUJAEIOLHZYPI-OAHLLOKOSA-N -1 3 374.462 3.758 20 0 FHADHM O=C([O-])CC[C@@H]1CCCCN1CC(=O)N[C@H](c1ccccc1)C1CCCC1 ZINC000424266579 943813442 /nfs/dbraw/zinc/81/34/42/943813442.db2.gz XCXHXGWSRQLGJB-SIKLNZKXSA-N -1 3 372.509 3.753 20 0 FHADHM Cc1cc(CNCc2cc(Cl)c3c(c2)OCCCO3)ccc1C(=O)[O-] ZINC000417672484 943814767 /nfs/dbraw/zinc/81/47/67/943814767.db2.gz TYPQQKWVEQBMRB-UHFFFAOYSA-N -1 3 361.825 3.798 20 0 FHADHM COc1cc(-c2nc(C3(c4ccc(F)cc4)CC3)no2)cc(OC)c1[O-] ZINC000424364817 943868867 /nfs/dbraw/zinc/86/88/67/943868867.db2.gz RSWVJOWGHSLYPZ-UHFFFAOYSA-N -1 3 356.353 3.678 20 0 FHADHM CCCOc1c(Cl)cc(CN2CCC[C@@H](C)[C@@H]2C(=O)[O-])cc1OC ZINC000424414277 943911282 /nfs/dbraw/zinc/91/12/82/943911282.db2.gz HBQCWTIMYRDOKZ-MLGOLLRUSA-N -1 3 355.862 3.823 20 0 FHADHM CC(=O)c1cc(F)c([N-]C(=O)c2ccc(OC(C)C)cn2)c(F)c1F ZINC000436052098 943974291 /nfs/dbraw/zinc/97/42/91/943974291.db2.gz RGOPXMVOCYZYEY-UHFFFAOYSA-N -1 3 352.312 3.741 20 0 FHADHM Cc1ccc(CNCc2c(F)ccc([O-])c2F)c(OC[C@@H]2CCCO2)c1 ZINC000511643675 943981050 /nfs/dbraw/zinc/98/10/50/943981050.db2.gz AZOCABDFQTWTIV-HNNXBMFYSA-N -1 3 363.404 3.826 20 0 FHADHM Cc1cc(F)c(CNC2CCN(c3ccc(C(=O)[O-])cc3)CC2)c(F)c1 ZINC000424626725 944018193 /nfs/dbraw/zinc/01/81/93/944018193.db2.gz VCVAVZQVZFKUOK-UHFFFAOYSA-N -1 3 360.404 3.730 20 0 FHADHM Cc1ccc(OCc2nc(CN[C@@H](C)[C@@H](C(=O)[O-])C(C)C)cs2)cc1 ZINC000424630722 944021664 /nfs/dbraw/zinc/02/16/64/944021664.db2.gz ZKOIVZWLYMSHRP-KSSFIOAISA-N -1 3 362.495 3.865 20 0 FHADHM CC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccsc2Cl)cc1Cl ZINC000437679002 944029394 /nfs/dbraw/zinc/02/93/94/944029394.db2.gz XIKKRMNWOVWHII-UHFFFAOYSA-N -1 3 365.263 3.814 20 0 FHADHM CC(C)Oc1ccc([N-]S(=O)(=O)c2c[nH]c3ncccc23)c(Cl)c1 ZINC000436159038 944064189 /nfs/dbraw/zinc/06/41/89/944064189.db2.gz XXTUVLLTGMWVLD-UHFFFAOYSA-N -1 3 365.842 3.804 20 0 FHADHM O=C(Nc1cc(Br)ccc1[O-])c1cc(-n2cccc2)ccn1 ZINC000500109237 944114067 /nfs/dbraw/zinc/11/40/67/944114067.db2.gz MFAJRWYXNGVSPW-UHFFFAOYSA-N -1 3 358.195 3.593 20 0 FHADHM CCOc1ccc([N-]S(=O)(=O)c2cc(C)c(OC)c(C)c2)cc1F ZINC000515696014 944138123 /nfs/dbraw/zinc/13/81/23/944138123.db2.gz WARBFQLOFFFHLF-UHFFFAOYSA-N -1 3 353.415 3.651 20 0 FHADHM N#Cc1ccc(Br)c(CO[N-]C(=O)CCCc2ccccc2)c1 ZINC000191683946 944216281 /nfs/dbraw/zinc/21/62/81/944216281.db2.gz BNHDEWHPIPJGHY-UHFFFAOYSA-N -1 3 373.250 3.891 20 0 FHADHM Cc1ccc(NC(=O)N(C)C)cc1NC(=O)CCCc1ccc([O-])c(F)c1 ZINC000437913107 944226217 /nfs/dbraw/zinc/22/62/17/944226217.db2.gz UJRGVHAWMKXKGS-UHFFFAOYSA-N -1 3 373.428 3.895 20 0 FHADHM Cc1cc(NC([O-])=NOCC(F)F)nn1-c1ccc(Cl)cc1Cl ZINC000760023923 944239343 /nfs/dbraw/zinc/23/93/43/944239343.db2.gz AHOVLGRWLMGJKB-UHFFFAOYSA-N -1 3 365.167 3.806 20 0 FHADHM Cc1cc(NC(=O)[N-]OCC(F)F)nn1-c1ccc(Cl)cc1Cl ZINC000760023923 944239354 /nfs/dbraw/zinc/23/93/54/944239354.db2.gz AHOVLGRWLMGJKB-UHFFFAOYSA-N 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O=C(c1ccccc1[O-])N1CCN(C2c3ccccc3-c3ccccc32)CC1 ZINC000436514938 944383633 /nfs/dbraw/zinc/38/36/33/944383633.db2.gz PRYAIFBBSBOAED-UHFFFAOYSA-N -1 3 370.452 3.920 20 0 FHADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CC[C@H](C2CCOCC2)C1 ZINC000436513768 944383738 /nfs/dbraw/zinc/38/37/38/944383738.db2.gz MQSDNIBRWVOCKQ-FQEVSTJZSA-N -1 3 365.473 3.872 20 0 FHADHM CN(C)[C@H](CNC(=O)c1ccc2ccccc2c1[O-])c1cccc(F)c1 ZINC000436523014 944391716 /nfs/dbraw/zinc/39/17/16/944391716.db2.gz POWQWNIRISKPDM-LJQANCHMSA-N -1 3 352.409 3.717 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N[C@H](C)c2oc3ccccc3c2C)c1 ZINC000436527059 944395824 /nfs/dbraw/zinc/39/58/24/944395824.db2.gz BPGJSMVUTLLWLM-GFCCVEGCSA-N -1 3 352.390 3.896 20 0 FHADHM O=C(Cc1noc(-c2ccccc2[O-])n1)Nc1cccc(C(F)(F)F)c1 ZINC000436529754 944396579 /nfs/dbraw/zinc/39/65/79/944396579.db2.gz CFRMJHVTBAZOJS-UHFFFAOYSA-N -1 3 363.295 3.642 20 0 FHADHM CCN(C(=O)c1cc(F)c([O-])c(F)c1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000436533854 944400072 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CN1CCN(C(=O)c2cc(Oc3ccccc3)ccc2[O-])c2cccnc21 ZINC000436576328 944425439 /nfs/dbraw/zinc/42/54/39/944425439.db2.gz QKWIGTFNGQVFDQ-UHFFFAOYSA-N -1 3 361.401 3.676 20 0 FHADHM Cc1cc(C[C@H](C)NC(=O)c2cc(Oc3ccccc3)ccc2[O-])[nH]n1 ZINC000436596523 944441087 /nfs/dbraw/zinc/44/10/87/944441087.db2.gz QTXOPFPPQWVMDM-ZDUSSCGKSA-N -1 3 351.406 3.577 20 0 FHADHM CC(C)c1ccc(C(=O)NCc2nnc(-c3ccccc3)s2)c([O-])c1 ZINC000436580166 944445362 /nfs/dbraw/zinc/44/53/62/944445362.db2.gz FOFGFZWCGRCTHU-UHFFFAOYSA-N -1 3 353.447 3.964 20 0 FHADHM COc1cc2[nH]c(CCCNC(=O)c3ccc(C)cc3[O-])cc2c(OC)c1 ZINC000436585368 944447903 /nfs/dbraw/zinc/44/79/03/944447903.db2.gz LVMOZVSUSTULGH-UHFFFAOYSA-N -1 3 368.433 3.562 20 0 FHADHM COc1cccc([C@@H]2CN(C(=O)c3ccc(C(C)C)cc3[O-])CCO2)c1 ZINC000436600092 944453138 /nfs/dbraw/zinc/45/31/38/944453138.db2.gz ZTNRLCUEJBFTRL-FQEVSTJZSA-N -1 3 355.434 3.738 20 0 FHADHM Cc1cccc(C[C@@H](CNCc2nc3c(s2)C[C@@H](C)CC3)C(=O)[O-])c1 ZINC000426668445 944456005 /nfs/dbraw/zinc/45/60/05/944456005.db2.gz FDOCPLSZNVJSQH-HOCLYGCPSA-N -1 3 358.507 3.609 20 0 FHADHM CC(=O)c1ccc(C(=O)N2CCC(Oc3cc(C)ccc3C)CC2)cc1[O-] ZINC000436607728 944457578 /nfs/dbraw/zinc/45/75/78/944457578.db2.gz PGEAROQUGMZQPN-UHFFFAOYSA-N -1 3 367.445 3.895 20 0 FHADHM Cc1cc(N(C)C)cc(C)c1[N-]S(=O)(=O)c1ccc2c(c1)C(=O)CCC2 ZINC000517636862 944458499 /nfs/dbraw/zinc/45/84/99/944458499.db2.gz RTACRBYZQHIUIO-UHFFFAOYSA-N -1 3 372.490 3.689 20 0 FHADHM C[C@@H](CCC1CCCCC1)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1[O-] ZINC000436627910 944468140 /nfs/dbraw/zinc/46/81/40/944468140.db2.gz VVUSERMBCUEHQM-QFBILLFUSA-N -1 3 372.509 3.862 20 0 FHADHM COc1ccccc1[C@H](CNC(=O)c1ccc(C(C)C)cc1[O-])N(C)C ZINC000436621749 944478972 /nfs/dbraw/zinc/47/89/72/944478972.db2.gz DNGIMEDKXOEPQL-SFHVURJKSA-N -1 3 356.466 3.557 20 0 FHADHM CC(C)[C@H](NC(=O)c1cc(CCc2ccccc2)ccc1[O-])c1ncon1 ZINC000436650506 944480820 /nfs/dbraw/zinc/48/08/20/944480820.db2.gz RRRDFVPYPIYANJ-IBGZPJMESA-N -1 3 365.433 3.688 20 0 FHADHM CC(=O)c1ccc(C(=O)Nc2ccc(NC[C@@H]3CCCO3)c(F)c2)cc1[O-] ZINC000436650517 944480951 /nfs/dbraw/zinc/48/09/51/944480951.db2.gz WMECHLLVAIQKKR-HNNXBMFYSA-N -1 3 372.396 3.577 20 0 FHADHM CC(=O)NCCN(Cc1ccc(C)s1)C(=O)c1ccc(C(C)C)cc1[O-] ZINC000436654537 944485804 /nfs/dbraw/zinc/48/58/04/944485804.db2.gz ANOWIKKDAGHIAH-UHFFFAOYSA-N -1 3 374.506 3.664 20 0 FHADHM CC(C)c1ccc(C(=O)NCc2cccc(N3CCCC3=O)c2)c([O-])c1 ZINC000436640658 944489558 /nfs/dbraw/zinc/48/95/58/944489558.db2.gz QDYHVVJBINZXNX-UHFFFAOYSA-N -1 3 352.434 3.572 20 0 FHADHM COc1ccc(Oc2ccc(NC(=O)c3c([O-])cccc3O)cn2)cc1 ZINC000436645303 944493946 /nfs/dbraw/zinc/49/39/46/944493946.db2.gz BTOOKMLADJKQGS-UHFFFAOYSA-N -1 3 352.346 3.546 20 0 FHADHM CCn1c2ccc(Cl)cc2nc1NC(=O)c1ccc(C(C)=O)c([O-])c1 ZINC000436666410 944501600 /nfs/dbraw/zinc/50/16/00/944501600.db2.gz TVQNRQVCOASTBB-UHFFFAOYSA-N -1 3 357.797 3.870 20 0 FHADHM CCC[C@@H](CC1CCCCC1)C(=O)NCCNC(=O)c1ccc([O-])cc1 ZINC000436678629 944516836 /nfs/dbraw/zinc/51/68/36/944516836.db2.gz HNQZQEYHEXEUMB-SFHVURJKSA-N -1 3 360.498 3.625 20 0 FHADHM CCOc1cc(CN[C@@H](C(=O)[O-])c2ccc(C)cc2)cc(Cl)c1OC ZINC000426670657 944522329 /nfs/dbraw/zinc/52/23/29/944522329.db2.gz HHOQMWPEDMLULE-QGZVFWFLSA-N -1 3 363.841 3.971 20 0 FHADHM O=C(Nc1ccc(Nc2ccccc2)nc1)c1c[n-]c2ccccc2c1=O ZINC000101951560 944526340 /nfs/dbraw/zinc/52/63/40/944526340.db2.gz WUANIXAMPCGMCI-UHFFFAOYSA-N -1 3 356.385 3.919 20 0 FHADHM COC(=O)c1cccc2[n-]c(NC(=O)CCc3ccc(Cl)s3)nc21 ZINC000438345675 944526325 /nfs/dbraw/zinc/52/63/25/944526325.db2.gz AFDABUZLNMIGKJ-UHFFFAOYSA-N -1 3 363.826 3.636 20 0 FHADHM COc1cc(-c2nc(CCCOc3ccc(F)cc3)no2)cc(OC)c1[O-] ZINC000436690856 944529384 /nfs/dbraw/zinc/52/93/84/944529384.db2.gz RRFWKPANYASZIZ-UHFFFAOYSA-N -1 3 374.368 3.610 20 0 FHADHM COc1cc(-c2nc([C@H](C)c3c(F)cccc3F)no2)cc(OC)c1[O-] ZINC000436692012 944530134 /nfs/dbraw/zinc/53/01/34/944530134.db2.gz VRYZEKFOGJWHJY-SECBINFHSA-N -1 3 362.332 3.889 20 0 FHADHM COc1cc(-c2nc(CSCc3ccccc3)no2)cc(OC)c1[O-] ZINC000436691940 944530153 /nfs/dbraw/zinc/53/01/53/944530153.db2.gz VWABXEHWDYJZLF-UHFFFAOYSA-N -1 3 358.419 3.893 20 0 FHADHM COc1cc(-c2nc([C@H]3CCCc4ccccc43)no2)cc(OC)c1[O-] ZINC000436691622 944530258 /nfs/dbraw/zinc/53/02/58/944530258.db2.gz UCJCRXRFPSHWNF-HNNXBMFYSA-N -1 3 352.390 3.928 20 0 FHADHM COC(=O)c1cccc2[n-]c(NC(=O)CCc3ccc(Cl)cc3)nc21 ZINC000438358587 944531032 /nfs/dbraw/zinc/53/10/32/944531032.db2.gz VHSOKLKYADALQA-UHFFFAOYSA-N -1 3 357.797 3.574 20 0 FHADHM COc1cc(OC)cc(C2(F)CCN(C(=O)c3ccc(C)cc3[O-])CC2)c1 ZINC000436699989 944539688 /nfs/dbraw/zinc/53/96/88/944539688.db2.gz SNNHHLYOUCNXJX-UHFFFAOYSA-N -1 3 373.424 3.819 20 0 FHADHM Cc1nc2ccccc2nc1SCc1noc(-c2ccccc2[O-])n1 ZINC000436707937 944546856 /nfs/dbraw/zinc/54/68/56/944546856.db2.gz SWHJRJSWLWMLOY-UHFFFAOYSA-N -1 3 350.403 3.986 20 0 FHADHM CC(C)c1ccc(C(=O)N[C@@H](C)c2ncc(Br)cn2)c([O-])c1 ZINC000436707385 944547740 /nfs/dbraw/zinc/54/77/40/944547740.db2.gz GTNMYNYMBOZPEI-JTQLQIEISA-N -1 3 364.243 3.559 20 0 FHADHM COc1ccc(C(=O)N2CCC(Cc3ccccc3OC)CC2)c([O-])c1 ZINC000436726422 944549361 /nfs/dbraw/zinc/54/93/61/944549361.db2.gz VBUCOQCFJATLGP-UHFFFAOYSA-N -1 3 355.434 3.504 20 0 FHADHM CC[C@H](C)N[C@@H](CNC(=O)c1cc(F)c([O-])c(Cl)c1)c1ccco1 ZINC000436713932 944552693 /nfs/dbraw/zinc/55/26/93/944552693.db2.gz DMPXAZGXADNSBU-HZMBPMFUSA-N -1 3 354.809 3.637 20 0 FHADHM COc1ccc(C(=O)NC[C@H]2CCN(c3cc(Cl)ccc3C)C2)c([O-])c1 ZINC000436725086 944563861 /nfs/dbraw/zinc/56/38/61/944563861.db2.gz PYSCHZNMEUJBSA-CQSZACIVSA-N -1 3 374.868 3.619 20 0 FHADHM O=C(NCc1nccc(C(F)F)n1)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436738657 944568415 /nfs/dbraw/zinc/56/84/15/944568415.db2.gz MADUHQWSVMYXMR-UHFFFAOYSA-N -1 3 371.343 3.842 20 0 FHADHM O=C(c1c([O-])cccc1O)N1CC[C@](F)(c2cccc(C(F)(F)F)c2)C1 ZINC000436741532 944571398 /nfs/dbraw/zinc/57/13/98/944571398.db2.gz CJYCHIFBJRWZFG-QGZVFWFLSA-N -1 3 369.314 3.828 20 0 FHADHM C/C=C/c1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2ccccc2[O-])cc1 ZINC000436741527 944571597 /nfs/dbraw/zinc/57/15/97/944571597.db2.gz CJWMVHDOCIWWPQ-VBAWXRRRSA-N -1 3 350.418 3.669 20 0 FHADHM CCCC[C@@H](CC)CNC(=O)c1cc(NC(=O)c2cnoc2C)ccc1[O-] ZINC000436728388 944575431 /nfs/dbraw/zinc/57/54/31/944575431.db2.gz KWTCYKPXWORJBW-CQSZACIVSA-N -1 3 373.453 3.887 20 0 FHADHM Cn1ncc2c1CCC[C@H]2NC(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436757781 944580980 /nfs/dbraw/zinc/58/09/80/944580980.db2.gz UKRRGUUWJNFBMI-GOSISDBHSA-N -1 3 363.417 3.725 20 0 FHADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CCC(CCCO)CC1 ZINC000436749524 944589053 /nfs/dbraw/zinc/58/90/53/944589053.db2.gz JZVJIQUDERWSSD-UHFFFAOYSA-N -1 3 367.489 3.802 20 0 FHADHM C[C@@H]1[C@H](NC(=O)c2cc(F)c([O-])c(Cl)c2)CCN1Cc1ccccc1 ZINC000436752043 944590835 /nfs/dbraw/zinc/59/08/35/944590835.db2.gz WOKGVNMMNUXZLG-SJKOYZFVSA-N -1 3 362.832 3.578 20 0 FHADHM O=C(Nc1cc2c(cc1Cl)NC(=O)CO2)c1cc2c(cc1[O-])CCCC2 ZINC000436754845 944596222 /nfs/dbraw/zinc/59/62/22/944596222.db2.gz KGCOQHBDQXESQW-UHFFFAOYSA-N -1 3 372.808 3.508 20 0 FHADHM COc1cc(NC(=O)c2cc3c(cc2[O-])CCCC3)cc(OC)c1OC ZINC000436755515 944598439 /nfs/dbraw/zinc/59/84/39/944598439.db2.gz NWUAADNDHFJYLI-UHFFFAOYSA-N -1 3 357.406 3.549 20 0 FHADHM COc1ccc2c(c1)CCC[C@H]2N(C)C(=O)c1cc(OC)c([O-])c(OC)c1 ZINC000436783274 944629483 /nfs/dbraw/zinc/62/94/83/944629483.db2.gz QRCSZSFTJHIPPR-QGZVFWFLSA-N -1 3 371.433 3.568 20 0 FHADHM O=C(CCCCCc1ccc(F)cc1)Nc1cccc(-c2nnn[n-]2)c1 ZINC000494889514 944633022 /nfs/dbraw/zinc/63/30/22/944633022.db2.gz BPAOZHRAOXWODH-UHFFFAOYSA-N -1 3 353.401 3.747 20 0 FHADHM O=C(CCCCCc1ccc(F)cc1)Nc1cccc(-c2nn[n-]n2)c1 ZINC000494889514 944633028 /nfs/dbraw/zinc/63/30/28/944633028.db2.gz BPAOZHRAOXWODH-UHFFFAOYSA-N -1 3 353.401 3.747 20 0 FHADHM CCC[C@@H](CCc1ccccc1)NC(=O)c1cc(NC(C)=O)ccc1[O-] ZINC000436787925 944634940 /nfs/dbraw/zinc/63/49/40/944634940.db2.gz RNRFBBGXWFCXMN-KRWDZBQOSA-N -1 3 354.450 3.882 20 0 FHADHM C[C@@H]1C[C@@H](CC(=O)N2CCN(C(=O)c3ccc([O-])cc3)CC2)CC(C)(C)C1 ZINC000436790640 944640996 /nfs/dbraw/zinc/64/09/96/944640996.db2.gz HDIOLRUGDIVSRS-SJORKVTESA-N -1 3 372.509 3.529 20 0 FHADHM CC1(C)Cc2ccc(C(=O)Nc3nc(CC(F)(F)F)cs3)c([O-])c2O1 ZINC000436794454 944647295 /nfs/dbraw/zinc/64/72/95/944647295.db2.gz OANJBKKRUQIXMA-UHFFFAOYSA-N -1 3 372.368 3.919 20 0 FHADHM CC(C)(C)c1csc2ncnc(NCCNC(=O)c3ccc([O-])cc3)c12 ZINC000436797997 944650022 /nfs/dbraw/zinc/65/00/22/944650022.db2.gz JHSTXMXBVDNHKJ-UHFFFAOYSA-N -1 3 370.478 3.536 20 0 FHADHM C[C@@H](c1cnn(C)c1)N(C)C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436815888 944651237 /nfs/dbraw/zinc/65/12/37/944651237.db2.gz MVBUGXMHDGALMC-INIZCTEOSA-N -1 3 363.461 3.744 20 0 FHADHM CCc1ccc(C(=O)N2CCO[C@@H](c3ccc(F)c(Cl)c3)C2)c([O-])c1 ZINC000436818165 944652892 /nfs/dbraw/zinc/65/28/92/944652892.db2.gz DMHCCSYKXAGVDW-GOSISDBHSA-N -1 3 363.816 3.961 20 0 FHADHM COc1ccccc1[C@@H](CNC(=O)c1ccc(Cl)cc1[O-])N1CCCC1 ZINC000436817844 944653967 /nfs/dbraw/zinc/65/39/67/944653967.db2.gz ISKNCKFUCZONBQ-QGZVFWFLSA-N -1 3 374.868 3.621 20 0 FHADHM C[C@H](O)C[C@@H]1CCCCN1C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436804671 944659168 /nfs/dbraw/zinc/65/91/68/944659168.db2.gz PTOXVGCZZMXELC-PXNSSMCTSA-N -1 3 367.489 3.943 20 0 FHADHM C[C@H](C(=O)Nc1sccc1-c1nnn[n-]1)c1c(Cl)cccc1Cl ZINC000735570946 944671498 /nfs/dbraw/zinc/67/14/98/944671498.db2.gz QFJGSROCYRREMW-ZETCQYMHSA-N -1 3 368.249 3.977 20 0 FHADHM C[C@H](C(=O)Nc1sccc1-c1nn[n-]n1)c1c(Cl)cccc1Cl ZINC000735570946 944671505 /nfs/dbraw/zinc/67/15/05/944671505.db2.gz QFJGSROCYRREMW-ZETCQYMHSA-N -1 3 368.249 3.977 20 0 FHADHM COc1cccc([C@@H]2C[C@H](C)CN2C(=O)c2cc(NC(C)=O)ccc2[O-])c1 ZINC000436829483 944677072 /nfs/dbraw/zinc/67/70/72/944677072.db2.gz BFQUEBVXXHBISS-DJJJIMSYSA-N -1 3 368.433 3.583 20 0 FHADHM CCc1ccc(C(=O)N[C@@H](C)c2nc(-c3ccccc3OC)no2)c([O-])c1 ZINC000436831783 944678309 /nfs/dbraw/zinc/67/83/09/944678309.db2.gz GWKHFPKOQNQIGL-LBPRGKRZSA-N -1 3 367.405 3.504 20 0 FHADHM CC[C@H](C(=O)N=c1cc([C@@H]2CCCO2)[n-][nH]1)c1cccc(C(F)(F)F)c1 ZINC000473848729 944680623 /nfs/dbraw/zinc/68/06/23/944680623.db2.gz SXBPAOQDPCBRNE-ZFWWWQNUSA-N -1 3 367.371 3.834 20 0 FHADHM CC(C)(Cc1ccccc1)C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000735670608 944688528 /nfs/dbraw/zinc/68/85/28/944688528.db2.gz FHRWPTHMPZFARB-UHFFFAOYSA-N -1 3 355.829 3.728 20 0 FHADHM CC(C)(Cc1ccccc1)C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000735670608 944688531 /nfs/dbraw/zinc/68/85/31/944688531.db2.gz FHRWPTHMPZFARB-UHFFFAOYSA-N -1 3 355.829 3.728 20 0 FHADHM COc1cc(CN[C@H](CC(=O)[O-])c2ccsc2)cc(Cl)c1OC ZINC000426697466 944698005 /nfs/dbraw/zinc/69/80/05/944698005.db2.gz XGLACCYHASGMRN-CYBMUJFWSA-N -1 3 355.843 3.724 20 0 FHADHM COc1cccc(C(=O)Nc2cccc(Cl)c2OCC(F)F)c1[O-] ZINC000436843629 944710248 /nfs/dbraw/zinc/71/02/48/944710248.db2.gz JHUWMKMSQBGOJU-UHFFFAOYSA-N -1 3 357.740 3.950 20 0 FHADHM CCc1ccc(C(=O)NCCCc2nc(-c3ccc(F)cc3)no2)c([O-])c1 ZINC000436844603 944710742 /nfs/dbraw/zinc/71/07/42/944710742.db2.gz OGWYWRWDMAMSST-UHFFFAOYSA-N -1 3 369.396 3.506 20 0 FHADHM O=C(c1c([O-])cccc1O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000436846055 944712126 /nfs/dbraw/zinc/71/21/26/944712126.db2.gz WAYFIGCFCPFXEV-LBPRGKRZSA-N -1 3 351.324 3.746 20 0 FHADHM CC(C)c1ccc(NC(=O)c2ccc(-c3nnn[n-]3)cn2)c(C(C)C)c1 ZINC000735928938 944714683 /nfs/dbraw/zinc/71/46/83/944714683.db2.gz SEKSDGCZLKQDQX-UHFFFAOYSA-N -1 3 350.426 3.761 20 0 FHADHM CC(C)c1ccc(NC(=O)c2ccc(-c3nn[n-]n3)cn2)c(C(C)C)c1 ZINC000735928938 944714694 /nfs/dbraw/zinc/71/46/94/944714694.db2.gz SEKSDGCZLKQDQX-UHFFFAOYSA-N -1 3 350.426 3.761 20 0 FHADHM Cn1cc(C(=O)Nc2ccc(Br)cc2[O-])c(-c2ccccc2)n1 ZINC000516325434 944725119 /nfs/dbraw/zinc/72/51/19/944725119.db2.gz YFTVUEZWTMLYML-UHFFFAOYSA-N -1 3 372.222 3.808 20 0 FHADHM COc1cccc(C(=O)Nc2cnn(-c3ccc(Cl)cc3)c2C)c1[O-] ZINC000436866066 944731068 /nfs/dbraw/zinc/73/10/68/944731068.db2.gz WJOULIBLVPOFCP-UHFFFAOYSA-N -1 3 357.797 3.801 20 0 FHADHM C[C@@H]([C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1[O-])C1CCCCC1 ZINC000436868664 944734435 /nfs/dbraw/zinc/73/44/35/944734435.db2.gz HUONPICKSULINZ-TXPKVOOTSA-N -1 3 372.509 3.718 20 0 FHADHM O=C([O-])[C@@H](NCc1cccc(OC(F)F)c1)c1ccc(Cl)c(F)c1 ZINC000426729447 944738017 /nfs/dbraw/zinc/73/80/17/944738017.db2.gz CWVZWKCBRVTKOD-AWEZNQCLSA-N -1 3 359.731 3.996 20 0 FHADHM COc1ccc(CN[C@@H](C(=O)[O-])c2cccc(C)c2C)cc1OC(F)F ZINC000426732462 944742613 /nfs/dbraw/zinc/74/26/13/944742613.db2.gz INXMYPNGBUCAGC-QGZVFWFLSA-N -1 3 365.376 3.829 20 0 FHADHM O=C(NCCCOc1ccc(C(F)(F)F)cn1)c1cc([O-])ccc1Cl ZINC000506611975 944746949 /nfs/dbraw/zinc/74/69/49/944746949.db2.gz MTBRTPXZDCXPEZ-UHFFFAOYSA-N -1 3 374.746 3.658 20 0 FHADHM O=C([O-])[C@@H](Cc1cccc(Cl)c1)NCc1csc(-c2ccccn2)n1 ZINC000426736707 944748699 /nfs/dbraw/zinc/74/86/99/944748699.db2.gz YMFUYQYYSSMUPK-MRXNPFEDSA-N -1 3 373.865 3.644 20 0 FHADHM Cc1cc(C)cc([C@@H](NCc2ccc(OC(F)F)c(F)c2)C(=O)[O-])c1 ZINC000426745852 944760098 /nfs/dbraw/zinc/76/00/98/944760098.db2.gz ICCMKJUGXQJVDJ-MRXNPFEDSA-N -1 3 353.340 3.959 20 0 FHADHM COc1ccc(Br)c(CNC(=O)c2cc([O-])ccc2Cl)c1 ZINC000516353280 944760834 /nfs/dbraw/zinc/76/08/34/944760834.db2.gz QCDGFHFMCBOJJY-UHFFFAOYSA-N -1 3 370.630 3.747 20 0 FHADHM CC1(C)CCC(NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)CC1 ZINC000736210732 944764044 /nfs/dbraw/zinc/76/40/44/944764044.db2.gz HLQRBNHXSQLRKJ-UHFFFAOYSA-N -1 3 364.906 3.775 20 0 FHADHM CC1(C)CCC(NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)CC1 ZINC000736210732 944764050 /nfs/dbraw/zinc/76/40/50/944764050.db2.gz HLQRBNHXSQLRKJ-UHFFFAOYSA-N -1 3 364.906 3.775 20 0 FHADHM Cc1cc(C)n(C[C@@H](NCc2ccc(-c3ccccc3)cc2F)C(=O)[O-])n1 ZINC000426748915 944767603 /nfs/dbraw/zinc/76/76/03/944767603.db2.gz BBFFVOMHHUEZHB-HXUWFJFHSA-N -1 3 367.424 3.549 20 0 FHADHM CN(C[C@@H]1CCCC[C@@H]1O)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436904141 944771140 /nfs/dbraw/zinc/77/11/40/944771140.db2.gz KIMKSCKHSXYACG-KXBFYZLASA-N -1 3 355.434 3.808 20 0 FHADHM C[C@@H]1CCc2onc(C(=O)Nc3cc(Br)ccc3[O-])c2C1 ZINC000436902514 944771491 /nfs/dbraw/zinc/77/14/91/944771491.db2.gz QFMVEPSCKHTEKL-MRVPVSSYSA-N -1 3 351.200 3.520 20 0 FHADHM O=C(NCc1ccco1)c1cccc(-c2noc(-c3ccccc3[O-])n2)c1 ZINC000436906659 944775121 /nfs/dbraw/zinc/77/51/21/944775121.db2.gz WJIQYJYKPMMFEX-UHFFFAOYSA-N -1 3 361.357 3.632 20 0 FHADHM CC(C)[C@H](C)N(C)C(=O)C[C@@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436908780 944777530 /nfs/dbraw/zinc/77/75/30/944777530.db2.gz JZFXJPVJGTYIRE-OXJNMPFZSA-N -1 3 368.477 3.756 20 0 FHADHM CCOc1c(OC)cc(CN[C@H](C(=O)[O-])c2cc(C)cc(C)c2)cc1OC ZINC000426758156 944777986 /nfs/dbraw/zinc/77/79/86/944777986.db2.gz RHRFOQPYVHSWEW-IBGZPJMESA-N -1 3 373.449 3.635 20 0 FHADHM NC(=O)c1ccc(-c2noc(-c3cc(Cc4ccccc4)ccc3[O-])n2)cc1 ZINC000436896254 944783293 /nfs/dbraw/zinc/78/32/93/944783293.db2.gz XWIIMNDBLLTVBZ-UHFFFAOYSA-N -1 3 371.396 3.799 20 0 FHADHM CCC(=O)[C@@H]1CCCCN1C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436896493 944785521 /nfs/dbraw/zinc/78/55/21/944785521.db2.gz NARZJMSHRNLSBB-IBGZPJMESA-N -1 3 351.446 3.957 20 0 FHADHM Cc1cc(C)cc([C@H](NCc2cnn(-c3ccc(F)cc3)c2)C(=O)[O-])c1 ZINC000426762377 944786517 /nfs/dbraw/zinc/78/65/17/944786517.db2.gz JTAGUYIYNMBMEW-IBGZPJMESA-N -1 3 353.397 3.544 20 0 FHADHM CC[C@@H]1CCCN1C(=O)C[C@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436932327 944794706 /nfs/dbraw/zinc/79/47/06/944794706.db2.gz NGKIDYAZBBBKNI-QUCCMNQESA-N -1 3 366.461 3.654 20 0 FHADHM CC(C)N(Cc1ccc(Br)cc1)C(=O)c1ccc(O)cc1[O-] ZINC000436930703 944794802 /nfs/dbraw/zinc/79/48/02/944794802.db2.gz XXIKKFTYYCBNSW-UHFFFAOYSA-N -1 3 364.239 3.911 20 0 FHADHM COc1cc(C=Cc2cc(=O)[n-]c(C3CC3)n2)cc(Br)c1O ZINC000436931751 944795902 /nfs/dbraw/zinc/79/59/02/944795902.db2.gz KJUFKKWZQAKLGH-DJWKRKHSSA-N -1 3 363.211 3.707 20 0 FHADHM CC(C)CC1(C)CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2[O-])CC1 ZINC000436922023 944806547 /nfs/dbraw/zinc/80/65/47/944806547.db2.gz LVWDMGDUCDEUEZ-GOSISDBHSA-N -1 3 372.509 3.672 20 0 FHADHM Cc1nc(C)c(CN[C@H](CC(=O)[O-])c2cccc(Br)c2)s1 ZINC000426807449 944809887 /nfs/dbraw/zinc/80/98/87/944809887.db2.gz HVLUMXPLMAMKOF-CYBMUJFWSA-N -1 3 369.284 3.828 20 0 FHADHM CCC[C@H](CC)S(=O)(=O)[N-]c1ccc(NC(C)=O)cc1C(F)(F)F ZINC000517912806 944813120 /nfs/dbraw/zinc/81/31/20/944813120.db2.gz RRRYMWXOBDEVRM-LBPRGKRZSA-N -1 3 366.405 3.984 20 0 FHADHM O=C(c1cc(F)cc(Cl)c1[O-])N1CCN(CC2CCCCC2)CC1 ZINC000436927669 944814867 /nfs/dbraw/zinc/81/48/67/944814867.db2.gz QGXVEARDLBFERO-UHFFFAOYSA-N -1 3 354.853 3.523 20 0 FHADHM CCC[C@H](CC)NC(=O)C[C@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436930096 944815942 /nfs/dbraw/zinc/81/59/42/944815942.db2.gz FHRCWMIUSBGJSA-ICSRJNTNSA-N -1 3 368.477 3.948 20 0 FHADHM Cc1cc(CN[C@@H](C(=O)[O-])c2cccc(F)c2)sc1Br ZINC000426802074 944822502 /nfs/dbraw/zinc/82/25/02/944822502.db2.gz UMAIEDNQMGLLEA-GFCCVEGCSA-N -1 3 358.232 3.874 20 0 FHADHM Cc1ccc(C(=O)Nc2cccc(CN3C[C@@H](C)O[C@@H](C)C3)c2)c([O-])c1 ZINC000436940442 944828067 /nfs/dbraw/zinc/82/80/67/944828067.db2.gz ADTOUMRDGJQDAW-IYBDPMFKSA-N -1 3 354.450 3.562 20 0 FHADHM COc1ccc(CN[C@@H](C(=O)[O-])c2ccc(O)cc2)cc1OCCC(C)C ZINC000426811926 944833376 /nfs/dbraw/zinc/83/33/76/944833376.db2.gz OSVUGWUSRPIRIK-HXUWFJFHSA-N -1 3 373.449 3.741 20 0 FHADHM CCc1noc(C)c1CNC(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436948927 944836954 /nfs/dbraw/zinc/83/69/54/944836954.db2.gz QHMKJRGWLYUZEQ-UHFFFAOYSA-N -1 3 350.418 3.772 20 0 FHADHM COc1ccc(NC(=O)c2cc(OCc3ccccc3)ccc2[O-])cc1O ZINC000436964013 944840194 /nfs/dbraw/zinc/84/01/94/944840194.db2.gz LEWOQAXTVFJYNR-UHFFFAOYSA-N -1 3 365.385 3.938 20 0 FHADHM [O-]c1ccccc1-c1nc(-c2cn3ccc(Br)cc3n2)no1 ZINC000436954028 944849581 /nfs/dbraw/zinc/84/95/81/944849581.db2.gz DBPZRCLIDXZUQZ-UHFFFAOYSA-N -1 3 357.167 3.519 20 0 FHADHM CC[C@@H](c1ccc(Cl)cc1)N1CCN(C(=O)c2ccc([O-])cc2)CC1 ZINC000436952639 944849658 /nfs/dbraw/zinc/84/96/58/944849658.db2.gz XMLCQTKCIAQJRY-IBGZPJMESA-N -1 3 358.869 3.955 20 0 FHADHM COc1ccc(CCCC(=O)Nc2cccc(C(C)=O)c2[O-])c(OC)c1 ZINC000517938746 944851364 /nfs/dbraw/zinc/85/13/64/944851364.db2.gz DGSRFPGDDXNYDJ-UHFFFAOYSA-N -1 3 357.406 3.573 20 0 FHADHM CCNC(=O)Nc1cccc(NC(=O)c2ccc3c(c2[O-])CCCC3)c1 ZINC000436955468 944851837 /nfs/dbraw/zinc/85/18/37/944851837.db2.gz GGAARXUTZZZNPX-UHFFFAOYSA-N -1 3 353.422 3.665 20 0 FHADHM COc1ccc(COCCCc2noc(-c3ccc(C)cc3[O-])n2)cc1 ZINC000436955453 944851972 /nfs/dbraw/zinc/85/19/72/944851972.db2.gz FZOPPEODXGGZCQ-UHFFFAOYSA-N -1 3 354.406 3.909 20 0 FHADHM Cc1cccnc1C(F)(F)C(=O)[N-]Cc1ccccc1OC(F)(F)F ZINC000195318960 944852933 /nfs/dbraw/zinc/85/29/33/944852933.db2.gz IBXDDCIHLZUOED-UHFFFAOYSA-N -1 3 360.282 3.697 20 0 FHADHM O=S(=O)([N-]CC1(Sc2ccccc2)CC1)c1ccc(F)cc1F ZINC000518843536 944854349 /nfs/dbraw/zinc/85/43/49/944854349.db2.gz IGMDQEMYVZZKKF-UHFFFAOYSA-N -1 3 355.431 3.568 20 0 FHADHM CCCCOc1ccc(C(=O)NCCc2ccc(NC(C)=O)cc2)c([O-])c1 ZINC000436970544 944858347 /nfs/dbraw/zinc/85/83/47/944858347.db2.gz FSEPDDPJVSOABJ-UHFFFAOYSA-N -1 3 370.449 3.502 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)[C@@H]1CCC[C@@H](C)C1 ZINC000736625482 944859063 /nfs/dbraw/zinc/85/90/63/944859063.db2.gz AFBXNABDSRQHJS-GHMZBOCLSA-N -1 3 364.833 3.651 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)[C@@H]1CCC[C@@H](C)C1 ZINC000736625482 944859074 /nfs/dbraw/zinc/85/90/74/944859074.db2.gz AFBXNABDSRQHJS-GHMZBOCLSA-N -1 3 364.833 3.651 20 0 FHADHM [O-]c1ccc(F)c(CN2CCN(Cc3ccc(Cl)s3)CC2)c1F ZINC000507002430 944870014 /nfs/dbraw/zinc/87/00/14/944870014.db2.gz PLKQSHDCXFXZQT-UHFFFAOYSA-N -1 3 358.841 3.703 20 0 FHADHM COCC1=CCN(C(=O)c2cc(CCc3ccccc3)ccc2[O-])CC1 ZINC000436969423 944876168 /nfs/dbraw/zinc/87/61/68/944876168.db2.gz IOQQZVXKBJKUMO-UHFFFAOYSA-N -1 3 351.446 3.596 20 0 FHADHM CCc1c([N-]C(=O)c2cc(-c3ccncc3)on2)onc1C(F)(F)F ZINC000505918843 944890462 /nfs/dbraw/zinc/89/04/62/944890462.db2.gz KXLYUZLEKDEYAI-UHFFFAOYSA-N -1 3 352.272 3.558 20 0 FHADHM COCCCC[C@@H](NC(=O)c1cc(OC)c([O-])c(OC)c1)c1ccccc1 ZINC000436995699 944892654 /nfs/dbraw/zinc/89/26/54/944892654.db2.gz BQWIJPQOMTTXKH-QGZVFWFLSA-N -1 3 373.449 3.697 20 0 FHADHM COc1ccc([O-])c(-c2nc(-c3ccc(Oc4ncccn4)cc3)no2)c1 ZINC000436999264 944914720 /nfs/dbraw/zinc/91/47/20/944914720.db2.gz QPXKGQDMCJGKFV-UHFFFAOYSA-N -1 3 362.345 3.700 20 0 FHADHM COc1cccc(-c2nc(-c3cc(Cl)c4c(c3)OCCCO4)no2)c1[O-] ZINC000437001952 944920777 /nfs/dbraw/zinc/92/07/77/944920777.db2.gz RJARHHCSMRFKBO-UHFFFAOYSA-N -1 3 374.780 3.933 20 0 FHADHM COc1ccc(Cl)cc1C(C)(C)NC(=O)NCc1ccc([O-])c(F)c1 ZINC000425687866 944924061 /nfs/dbraw/zinc/92/40/61/944924061.db2.gz VMMPZQSWDLAVMZ-UHFFFAOYSA-N -1 3 366.820 3.928 20 0 FHADHM CC[C@H](C)Oc1ccc([N-]S(=O)(=O)c2ccc(OC)c(F)c2)cc1 ZINC000511710129 944937316 /nfs/dbraw/zinc/93/73/16/944937316.db2.gz JVFZDRUNYWDJFA-LBPRGKRZSA-N -1 3 353.415 3.812 20 0 FHADHM C[C@H]1Cc2cc(S(=O)(=O)[N-]c3cccc(CC(F)(F)F)c3)ccc2O1 ZINC000438759198 944995608 /nfs/dbraw/zinc/99/56/08/944995608.db2.gz REMRBNOVSBYSOD-NSHDSACASA-N -1 3 371.380 3.916 20 0 FHADHM O=C(N=c1cc(-c2ccncc2)[n-][nH]1)[C@H]1C[C@H]1c1cccc2ccccc21 ZINC000518085785 945005233 /nfs/dbraw/zinc/00/52/33/945005233.db2.gz RRWXYTJGGYUXAY-OALUTQOASA-N -1 3 354.413 3.789 20 0 FHADHM CC(C)COc1cccc([N-]S(=O)(=O)Cc2cc(C(C)(C)C)on2)c1 ZINC000506691034 945021177 /nfs/dbraw/zinc/02/11/77/945021177.db2.gz WBRGRXRCICPJQR-UHFFFAOYSA-N -1 3 366.483 3.949 20 0 FHADHM CC1(C)Cc2cc(S(=O)(=O)[N-]c3ccc(-c4ncc[nH]4)cc3)ccc2O1 ZINC000439884227 945062281 /nfs/dbraw/zinc/06/22/81/945062281.db2.gz SQXVQDOBLCNKKD-UHFFFAOYSA-N -1 3 369.446 3.591 20 0 FHADHM CCc1ccccc1S(=O)(=O)[N-]c1ccc2c(c1)C(=O)CC(C)(C)O2 ZINC000507645263 945413105 /nfs/dbraw/zinc/41/31/05/945413105.db2.gz QMGPKUNYLCFBAG-UHFFFAOYSA-N -1 3 359.447 3.794 20 0 FHADHM C[C@H](NC(=O)N(CC1CCCCC1)C1CC1)c1cccc(-c2nnn[n-]2)c1 ZINC000820340225 945416786 /nfs/dbraw/zinc/41/67/86/945416786.db2.gz IRHUDLQKQPGNJC-AWEZNQCLSA-N -1 3 368.485 3.682 20 0 FHADHM C[C@H](NC(=O)N(CC1CCCCC1)C1CC1)c1cccc(-c2nn[n-]n2)c1 ZINC000820340225 945416790 /nfs/dbraw/zinc/41/67/90/945416790.db2.gz IRHUDLQKQPGNJC-AWEZNQCLSA-N -1 3 368.485 3.682 20 0 FHADHM Cc1cccc(C[C@H](CNCc2coc(-c3ccccc3)n2)C(=O)[O-])c1 ZINC000426637949 945433261 /nfs/dbraw/zinc/43/32/61/945433261.db2.gz NVZXBURHISCBOH-GOSISDBHSA-N -1 3 350.418 3.683 20 0 FHADHM Cc1cc(=O)[n-]c(C(C)(C)NCc2csc(-c3ccc(F)cc3)n2)n1 ZINC000660745123 945442544 /nfs/dbraw/zinc/44/25/44/945442544.db2.gz KDDMDRARGHXRAZ-UHFFFAOYSA-N -1 3 358.442 3.778 20 0 FHADHM O=C([O-])[C@@H](CNCc1cc(Cl)ccc1Cl)Oc1ccc(F)cc1 ZINC000426644549 945443017 /nfs/dbraw/zinc/44/30/17/945443017.db2.gz DNFSOHLYACTASN-OAHLLOKOSA-N -1 3 358.196 3.754 20 0 FHADHM Cc1ccc(CNC(C)(C)c2nc(C)cc(=O)[n-]2)c(Br)c1 ZINC000660749992 945447485 /nfs/dbraw/zinc/44/74/85/945447485.db2.gz VRVBDHSGOUHLKX-UHFFFAOYSA-N -1 3 350.260 3.586 20 0 FHADHM Cc1ccccc1C[C@H](CNCc1nc2c(s1)C[C@H](C)CC2)C(=O)[O-] ZINC000426643735 945456209 /nfs/dbraw/zinc/45/62/09/945456209.db2.gz RVABZCLMEFUWLP-CZUORRHYSA-N -1 3 358.507 3.609 20 0 FHADHM C[C@@]1(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)CCc2ccccc2C1 ZINC000820577172 945488292 /nfs/dbraw/zinc/48/82/92/945488292.db2.gz MFJQFRLFRCWFII-LJQANCHMSA-N -1 3 367.840 3.654 20 0 FHADHM C[C@@]1(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)CCc2ccccc2C1 ZINC000820577172 945488300 /nfs/dbraw/zinc/48/83/00/945488300.db2.gz MFJQFRLFRCWFII-LJQANCHMSA-N -1 3 367.840 3.654 20 0 FHADHM O=S(=O)([N-]Cc1nccn1C(F)F)c1c(Cl)ccc2ccccc21 ZINC000440404610 945510144 /nfs/dbraw/zinc/51/01/44/945510144.db2.gz UYUOUXQMOOXXET-UHFFFAOYSA-N -1 3 371.796 3.563 20 0 FHADHM C/C=C(\C)C(=O)Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2OC)cc1 ZINC000820827728 945562390 /nfs/dbraw/zinc/56/23/90/945562390.db2.gz WJJPUWHCQZKVPK-UUILKARUSA-N -1 3 365.393 3.572 20 0 FHADHM C/C=C(\C)C(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2OC)cc1 ZINC000820827728 945562394 /nfs/dbraw/zinc/56/23/94/945562394.db2.gz WJJPUWHCQZKVPK-UUILKARUSA-N -1 3 365.393 3.572 20 0 FHADHM CCC(C)(C)NC(=O)Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000820847350 945570341 /nfs/dbraw/zinc/57/03/41/945570341.db2.gz BIULULBGCSGHKV-UHFFFAOYSA-N -1 3 366.425 3.969 20 0 FHADHM CCC(C)(C)NC(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000820847350 945570346 /nfs/dbraw/zinc/57/03/46/945570346.db2.gz BIULULBGCSGHKV-UHFFFAOYSA-N -1 3 366.425 3.969 20 0 FHADHM Cc1csc(C2([N-]S(=O)(=O)Cc3c(F)cccc3Cl)CCC2)n1 ZINC000519522192 945577530 /nfs/dbraw/zinc/57/75/30/945577530.db2.gz HXMUKKZOVGHDPE-UHFFFAOYSA-N -1 3 374.890 3.743 20 0 FHADHM CC(C)c1c(C(=O)NCc2ncccc2[O-])cnn1-c1cccc(Cl)c1 ZINC000473635126 945652723 /nfs/dbraw/zinc/65/27/23/945652723.db2.gz FQYRJVYKTKPUKM-UHFFFAOYSA-N -1 3 370.840 3.680 20 0 FHADHM Cc1cc2cc(C(=O)NCc3ncccc3[O-])oc2c(Br)c1 ZINC000473638651 945665085 /nfs/dbraw/zinc/66/50/85/945665085.db2.gz YUAQYPNJJWOORY-UHFFFAOYSA-N -1 3 361.195 3.534 20 0 FHADHM Cc1ccc(Sc2ncccc2C(=O)NCc2ncccc2[O-])cc1C ZINC000473643238 945688376 /nfs/dbraw/zinc/68/83/76/945688376.db2.gz RHXNDZPRKAXDPY-UHFFFAOYSA-N -1 3 365.458 3.880 20 0 FHADHM CS[C@H]1CCC[C@@H]([N-]S(=O)(=O)c2csc(-c3ccccc3)n2)C1 ZINC000522716651 945710859 /nfs/dbraw/zinc/71/08/59/945710859.db2.gz NHXJHRNSJJJJAG-KGLIPLIRSA-N -1 3 368.549 3.763 20 0 FHADHM CCc1nsc(NCc2cccc(-c3ccc(-c4nnn[n-]4)s3)c2)n1 ZINC000821559158 945714979 /nfs/dbraw/zinc/71/49/79/945714979.db2.gz WVFKBMHVQQFQNM-UHFFFAOYSA-N -1 3 369.479 3.621 20 0 FHADHM Cc1ccnc([C@H]2CCN(Cc3nc4c5ccccc5oc4c(=O)[n-]3)C2)c1 ZINC000519766070 945723190 /nfs/dbraw/zinc/72/31/90/945723190.db2.gz WRSXWYAEBQMLQJ-AWEZNQCLSA-N -1 3 360.417 3.775 20 0 FHADHM COc1cc(C(=O)N[C@@H]2CC[C@@H](c3ccc(F)cc3)C2)cc(OC)c1[O-] ZINC000473654344 945751613 /nfs/dbraw/zinc/75/16/13/945751613.db2.gz NSWCUQIOGXZTKD-CZUORRHYSA-N -1 3 359.397 3.615 20 0 FHADHM Cc1cc(Br)sc1S(=O)(=O)[N-]CCCC(C)(F)F ZINC000651721743 945769708 /nfs/dbraw/zinc/76/97/08/945769708.db2.gz PECCFNJRKFCDEY-UHFFFAOYSA-N -1 3 362.261 3.533 20 0 FHADHM O=S(=O)([N-][C@H]1CCCC(F)(F)C1)c1ccc(C(F)(F)F)cc1F ZINC000444070768 945787978 /nfs/dbraw/zinc/78/79/78/945787978.db2.gz HJRYYUCAHVOVHZ-VIFPVBQESA-N -1 3 361.307 3.701 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CCO[C@@H]3c3ccccc3)nc2)n1 ZINC000301477699 945805722 /nfs/dbraw/zinc/80/57/22/945805722.db2.gz PREWPHXWCCJAOT-YLJYHZDGSA-N -1 3 362.433 3.749 20 0 FHADHM O=c1nc(-c2cccc(-n3cccn3)n2)[n-]c2sc(-c3ccccc3)cc21 ZINC000129384980 945808184 /nfs/dbraw/zinc/80/81/84/945808184.db2.gz GLJPCDODQVWGHE-UHFFFAOYSA-N -1 3 371.425 3.899 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)c3cccc4cccnc43)c2)n1 ZINC000049301692 945825937 /nfs/dbraw/zinc/82/59/37/945825937.db2.gz VGFNOHYWCOTTFQ-UHFFFAOYSA-N -1 3 370.412 3.800 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)Cc3c[nH]c4ccccc34)c2)n1 ZINC000049303828 945831045 /nfs/dbraw/zinc/83/10/45/945831045.db2.gz AUJODKHBTXIZGC-UHFFFAOYSA-N -1 3 372.428 3.662 20 0 FHADHM COc1ccc(-c2ccc(CNc3ncccc3-c3nnn[n-]3)s2)cc1 ZINC000821727116 945851326 /nfs/dbraw/zinc/85/13/26/945851326.db2.gz CCGPHYNAVZRKMI-UHFFFAOYSA-N -1 3 364.434 3.611 20 0 FHADHM COc1ccc(-c2ccc(CNc3ncccc3-c3nn[n-]n3)s2)cc1 ZINC000821727116 945851339 /nfs/dbraw/zinc/85/13/39/945851339.db2.gz CCGPHYNAVZRKMI-UHFFFAOYSA-N -1 3 364.434 3.611 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CCc4c3cccc4OC)nc2)n1 ZINC000301635408 945887726 /nfs/dbraw/zinc/88/77/26/945887726.db2.gz KPJBMQKFKFUXMX-QGZVFWFLSA-N -1 3 362.433 3.915 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)N3CCn4cccc4[C@@H]3C)cc2)cc(=O)[n-]1 ZINC000519945956 945917039 /nfs/dbraw/zinc/91/70/39/945917039.db2.gz GQHSSMOLKDBDSG-ZDUSSCGKSA-N -1 3 363.421 3.568 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)c3ccc4c(c3)CCC4)c2)n1 ZINC000049301930 945939529 /nfs/dbraw/zinc/93/95/29/945939529.db2.gz ARKCYTRHZAKOST-UHFFFAOYSA-N -1 3 359.429 3.740 20 0 FHADHM C[C@@H]1CCC[C@@H](C)N1C(=O)c1c[n-]c2ccc(Br)cc2c1=O ZINC000444181074 946038071 /nfs/dbraw/zinc/03/80/71/946038071.db2.gz IXZPROCVCODCCP-GHMZBOCLSA-N -1 3 363.255 3.694 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NCCc3cc(F)c(F)c(F)c3)nc2)n1 ZINC000302023075 946082142 /nfs/dbraw/zinc/08/21/42/946082142.db2.gz JBPWBIDGMQLDIG-UHFFFAOYSA-N -1 3 374.366 3.879 20 0 FHADHM CCc1cc(N2CCC(C(=O)Nc3cc(Cl)ccc3[O-])CC2)nc(C)n1 ZINC000302037632 946089921 /nfs/dbraw/zinc/08/99/21/946089921.db2.gz GJMSLZQFJXQMNR-UHFFFAOYSA-N -1 3 374.872 3.562 20 0 FHADHM Cc1nccn1-c1ccc([C@@H](C)Nc2cccc(F)c2-c2nnn[n-]2)cc1 ZINC000822477035 946100030 /nfs/dbraw/zinc/10/00/30/946100030.db2.gz DKXJLPAZSIVMPZ-GFCCVEGCSA-N -1 3 363.400 3.673 20 0 FHADHM Cc1nccn1-c1ccc([C@@H](C)Nc2cccc(F)c2-c2nn[n-]n2)cc1 ZINC000822477035 946100038 /nfs/dbraw/zinc/10/00/38/946100038.db2.gz DKXJLPAZSIVMPZ-GFCCVEGCSA-N -1 3 363.400 3.673 20 0 FHADHM C[C@H](CO)[C@@H]1CCCCN1Cc1nc(=O)c2c(-c3ccco3)csc2[n-]1 ZINC000661447858 946113152 /nfs/dbraw/zinc/11/31/52/946113152.db2.gz ZONCPOMQAYSCIZ-OCCSQVGLSA-N -1 3 373.478 3.640 20 0 FHADHM Cc1noc(C)c1COc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000822522758 946114399 /nfs/dbraw/zinc/11/43/99/946114399.db2.gz MLGWPNMKLPVPQZ-UHFFFAOYSA-N -1 3 363.377 3.843 20 0 FHADHM Cc1noc(C)c1COc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000822522758 946114406 /nfs/dbraw/zinc/11/44/06/946114406.db2.gz MLGWPNMKLPVPQZ-UHFFFAOYSA-N -1 3 363.377 3.843 20 0 FHADHM C[C@H]1CCCN(C(=O)c2c[n-]c3ccc(Br)cc3c2=O)[C@H]1C ZINC000444257415 946139610 /nfs/dbraw/zinc/13/96/10/946139610.db2.gz PKQQNFYFPULUHB-QWRGUYRKSA-N -1 3 363.255 3.551 20 0 FHADHM Cc1nc(C)c(CC(=O)Nc2ccc(F)cc2-c2ccc(F)cc2)c(=O)[n-]1 ZINC000103106111 946210999 /nfs/dbraw/zinc/21/09/99/946210999.db2.gz QORORMIXHPSNEX-UHFFFAOYSA-N -1 3 369.371 3.513 20 0 FHADHM CC(C)c1ccc(S(=O)(=O)[N-]c2ccc(NC(=O)NC3CC3)cc2)cc1 ZINC000045866266 946214845 /nfs/dbraw/zinc/21/48/45/946214845.db2.gz OYICWRVHYJFBEG-UHFFFAOYSA-N -1 3 373.478 3.895 20 0 FHADHM CC[C@@H](C)N(C)C(=O)C[C@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000184145450 946231593 /nfs/dbraw/zinc/23/15/93/946231593.db2.gz RLZLLKFRLDTQLE-BEFAXECRSA-N -1 3 354.450 3.510 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CCCO[C@@H]3CC(C)C)nc2)n1 ZINC000302521105 946240982 /nfs/dbraw/zinc/24/09/82/946240982.db2.gz YXVOEPZXEGIFAU-IAGOWNOFSA-N -1 3 356.470 3.812 20 0 FHADHM CN(CCCc1cc(-c2ccc(F)cc2)n[nH]1)C(=O)c1ccccc1[O-] ZINC000042760038 946322782 /nfs/dbraw/zinc/32/27/82/946322782.db2.gz IXPUWWQLCXXVAU-UHFFFAOYSA-N -1 3 353.397 3.626 20 0 FHADHM CCC(C)(CC)[N-]S(=O)(=O)c1c(Cl)cccc1Br ZINC000310735247 946373926 /nfs/dbraw/zinc/37/39/26/946373926.db2.gz YLTOZIUKDVVEBS-UHFFFAOYSA-N -1 3 354.697 3.960 20 0 FHADHM O=C(NCCCOc1ccc2ccccc2c1)NCc1ccc([O-])c(F)c1 ZINC000475102185 946393121 /nfs/dbraw/zinc/39/31/21/946393121.db2.gz RUSLSJUMAULGRW-UHFFFAOYSA-N -1 3 368.408 3.953 20 0 FHADHM O=C(NC[C@H](c1cccs1)N1CCCC1)c1cc(F)c([O-])c(Cl)c1 ZINC000184198233 946405469 /nfs/dbraw/zinc/40/54/69/946405469.db2.gz QWKNTMGMVGLCEH-CQSZACIVSA-N -1 3 368.861 3.813 20 0 FHADHM [O-]c1ccc(CN[C@H](CCO)c2ccccc2Br)cc1F ZINC000893490995 946448440 /nfs/dbraw/zinc/44/84/40/946448440.db2.gz QMKLHUKOLUKAFO-OAHLLOKOSA-N -1 3 354.219 3.507 20 0 FHADHM Cc1nc(C)c(CC(=O)N(Cc2ccccc2Cl)C2CCCC2)c(=O)[n-]1 ZINC000104415753 946501015 /nfs/dbraw/zinc/50/10/15/946501015.db2.gz CSFGCILDLQBKKL-UHFFFAOYSA-N -1 3 373.884 3.554 20 0 FHADHM COc1cccc(CCCN(CCC(=O)[O-])Cc2cccc(F)c2F)c1 ZINC000520416572 946561599 /nfs/dbraw/zinc/56/15/99/946561599.db2.gz JWDVGGBAFDACMC-UHFFFAOYSA-N -1 3 363.404 3.883 20 0 FHADHM O=C([N-]c1cc(-c2nc[nH]n2)ccc1F)c1c(F)ccc(F)c1Cl ZINC001270853381 946577865 /nfs/dbraw/zinc/57/78/65/946577865.db2.gz KQTSUGXBAOBUHR-UHFFFAOYSA-N -1 3 352.703 3.795 20 0 FHADHM Cn1cc(CC(=O)Nc2cc(Br)ccc2[O-])c2ccccc21 ZINC000531394648 946592430 /nfs/dbraw/zinc/59/24/30/946592430.db2.gz LMYMCTJNASUORZ-UHFFFAOYSA-N -1 3 359.223 3.828 20 0 FHADHM CCc1nc2ccccc2n1C1CCN([C@@H](C)c2nc(C)cc(=O)[n-]2)CC1 ZINC000192720194 946618814 /nfs/dbraw/zinc/61/88/14/946618814.db2.gz DBKHHVCXSBHALF-HNNXBMFYSA-N -1 3 365.481 3.801 20 0 FHADHM CC(C)Cn1ncc(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1C(F)F ZINC000824285143 946644684 /nfs/dbraw/zinc/64/46/84/946644684.db2.gz YVCOVZZNCKHFOW-LLVKDONJSA-N -1 3 361.400 3.830 20 0 FHADHM CC(C)Cn1ncc(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1C(F)F ZINC000824285143 946644690 /nfs/dbraw/zinc/64/46/90/946644690.db2.gz YVCOVZZNCKHFOW-LLVKDONJSA-N -1 3 361.400 3.830 20 0 FHADHM C[C@H](CCCc1ccccc1)C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000824402142 946683318 /nfs/dbraw/zinc/68/33/18/946683318.db2.gz UWTNJESPAPYYRO-CVEARBPZSA-N -1 3 363.465 3.703 20 0 FHADHM C[C@H](CCCc1ccccc1)C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000824402142 946683326 /nfs/dbraw/zinc/68/33/26/946683326.db2.gz UWTNJESPAPYYRO-CVEARBPZSA-N -1 3 363.465 3.703 20 0 FHADHM C[C@@H](NC(=O)C1CC=CC1)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824471150 946722653 /nfs/dbraw/zinc/72/26/53/946722653.db2.gz OGQGMWWVNDBLGH-CQSZACIVSA-N -1 3 359.433 3.677 20 0 FHADHM C[C@@H](NC(=O)C1CC=CC1)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824471150 946722662 /nfs/dbraw/zinc/72/26/62/946722662.db2.gz OGQGMWWVNDBLGH-CQSZACIVSA-N -1 3 359.433 3.677 20 0 FHADHM C[C@H](NC(=O)[C@H]1[C@@H]2CCC[C@@H]21)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824473278 946728374 /nfs/dbraw/zinc/72/83/74/946728374.db2.gz ZKQJKSMGRHEYEO-YGHPHNMRSA-N -1 3 373.460 3.757 20 0 FHADHM C[C@H](NC(=O)[C@H]1[C@@H]2CCC[C@@H]21)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824473278 946728380 /nfs/dbraw/zinc/72/83/80/946728380.db2.gz ZKQJKSMGRHEYEO-YGHPHNMRSA-N -1 3 373.460 3.757 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2cccc(-n3nc(C)cc3C)c2)cc1C ZINC000614793257 946739807 /nfs/dbraw/zinc/73/98/07/946739807.db2.gz UZSHIOIYFGAJQO-UHFFFAOYSA-N -1 3 371.462 3.607 20 0 FHADHM CN(CCC1CC1)C(=O)C[C@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000184250438 946758928 /nfs/dbraw/zinc/75/89/28/946758928.db2.gz HZBMCTRWCZWLPB-FQEVSTJZSA-N -1 3 366.461 3.512 20 0 FHADHM C[C@H](N[C@@H](CCc1ccccc1)C(F)F)c1cccc(-c2nnn[n-]2)c1 ZINC000824529998 946765174 /nfs/dbraw/zinc/76/51/74/946765174.db2.gz ISIJYPOLTSJSGU-GUYCJALGSA-N -1 3 357.408 3.784 20 0 FHADHM C[C@H](N[C@@H](CCc1ccccc1)C(F)F)c1cccc(-c2nn[n-]n2)c1 ZINC000824529998 946765178 /nfs/dbraw/zinc/76/51/78/946765178.db2.gz ISIJYPOLTSJSGU-GUYCJALGSA-N -1 3 357.408 3.784 20 0 FHADHM O=C(Nc1ccc(Cc2nnn[n-]2)cc1)C1CCC(c2ccccc2)CC1 ZINC000473936766 946824516 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Cc1ccnc(N2CCCC[C@H]2c2ccc(F)cc2F)c1-c1nn[n-]n1 ZINC000826311101 947900743 /nfs/dbraw/zinc/90/07/43/947900743.db2.gz SYYQCUBNFYIBRP-HNNXBMFYSA-N -1 3 356.380 3.580 20 0 FHADHM Cc1nc(CSc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)oc1C ZINC000826326682 947952427 /nfs/dbraw/zinc/95/24/27/947952427.db2.gz ZPMLUMUQIFNSEF-UHFFFAOYSA-N -1 3 355.345 3.783 20 0 FHADHM Cc1nc(CSc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)oc1C ZINC000826326682 947952437 /nfs/dbraw/zinc/95/24/37/947952437.db2.gz ZPMLUMUQIFNSEF-UHFFFAOYSA-N -1 3 355.345 3.783 20 0 FHADHM O=C(OCc1cncc(Br)c1)c1cc(F)cc(Cl)c1[O-] ZINC000785359127 948063179 /nfs/dbraw/zinc/06/31/79/948063179.db2.gz RTIMWQQWJOOMOV-UHFFFAOYSA-N -1 3 360.566 3.699 20 0 FHADHM Cc1n[nH]c(C)c1[C@H]1CCCN1Cc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000091081854 948103680 /nfs/dbraw/zinc/10/36/80/948103680.db2.gz MTMUCOYLWZJXDN-CQSZACIVSA-N -1 3 363.421 3.759 20 0 FHADHM Clc1cccc(SCc2cnn(-c3ccccc3)c2)c1-c1nnn[n-]1 ZINC000826353581 948103940 /nfs/dbraw/zinc/10/39/40/948103940.db2.gz 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CCOc1ccc([N-]S(=O)(=O)c2cc(-c3nc(C)no3)ccc2C)cc1 ZINC000603641226 568129427 /nfs/dbraw/zinc/12/94/27/568129427.db2.gz QDQGDRXDYZZMQH-UHFFFAOYSA-N -1 3 373.434 3.553 20 0 FHADHM CCOC(=O)c1ncc(NC(=O)c2ccccc2Nc2ccccc2)[n-]1 ZINC000617876602 568166437 /nfs/dbraw/zinc/16/64/37/568166437.db2.gz WPRUZWNREPCHEF-UHFFFAOYSA-N -1 3 350.378 3.582 20 0 FHADHM CCOC(=O)c1nc(NC(=O)c2ccccc2Nc2ccccc2)c[n-]1 ZINC000617876602 568166439 /nfs/dbraw/zinc/16/64/39/568166439.db2.gz WPRUZWNREPCHEF-UHFFFAOYSA-N -1 3 350.378 3.582 20 0 FHADHM O=C(c1cc(F)cc(Br)c1)N1CCCc2cccc([O-])c21 ZINC000063063925 568181343 /nfs/dbraw/zinc/18/13/43/568181343.db2.gz CVFCKJLWRVRIPG-UHFFFAOYSA-N -1 3 350.187 3.887 20 0 FHADHM CC(C)c1cc(C(=O)N2CCO[C@]3(CCO[C@H]3C)C2)c([O-])c(C(C)C)c1 ZINC000408276749 568287921 /nfs/dbraw/zinc/28/79/21/568287921.db2.gz LEOCZMXKFHDUNG-YCRPNKLZSA-N -1 3 361.482 3.659 20 0 FHADHM CSc1ccc([O-])c(C(=O)N2C[C@@H](C)O[C@H](c3ccc(F)cc3)C2)c1 ZINC000669182683 568311967 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CC[C@H](OC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1ccc(F)cc1F ZINC000736380383 598823305 /nfs/dbraw/zinc/82/33/05/598823305.db2.gz FSGOFWMESZQYEN-JEJOPICUSA-N -1 3 370.359 3.853 20 0 FHADHM Cc1csc(-c2cccc(C(=O)Nc3cccc(-c4nnn[n-]4)c3)c2)n1 ZINC000159066702 598828791 /nfs/dbraw/zinc/82/87/91/598828791.db2.gz NLULDNKUFDKVGQ-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1csc(-c2cccc(C(=O)Nc3cccc(-c4nn[n-]n4)c3)c2)n1 ZINC000159066702 598828793 /nfs/dbraw/zinc/82/87/93/598828793.db2.gz NLULDNKUFDKVGQ-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1cccc([C@H](C)C(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(C)C)c1 ZINC000737384960 598831605 /nfs/dbraw/zinc/83/16/05/598831605.db2.gz OHEYUIUFXSEASC-AWEZNQCLSA-N -1 3 365.437 3.705 20 0 FHADHM Cc1cccc([C@H](C)C(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(C)C)c1 ZINC000737384960 598831607 /nfs/dbraw/zinc/83/16/07/598831607.db2.gz OHEYUIUFXSEASC-AWEZNQCLSA-N -1 3 365.437 3.705 20 0 FHADHM O=C(NCC1(c2cccs2)CCCCC1)c1cccc(-c2nnn[n-]2)c1 ZINC000738043264 598836704 /nfs/dbraw/zinc/83/67/04/598836704.db2.gz BOUKSKCXQKRTBD-UHFFFAOYSA-N -1 3 367.478 3.560 20 0 FHADHM O=C(NCC1(c2cccs2)CCCCC1)c1cccc(-c2nn[n-]n2)c1 ZINC000738043264 598836706 /nfs/dbraw/zinc/83/67/06/598836706.db2.gz BOUKSKCXQKRTBD-UHFFFAOYSA-N -1 3 367.478 3.560 20 0 FHADHM O=C(NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1)c1cccs1 ZINC000738112802 598836788 /nfs/dbraw/zinc/83/67/88/598836788.db2.gz SQMHEOWSENIOBK-UHFFFAOYSA-N -1 3 367.459 3.587 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)Nc1cccc(COC(C)C)c1 ZINC000737295779 598851236 /nfs/dbraw/zinc/85/12/36/598851236.db2.gz ZZIOZBYPWKUKPU-UHFFFAOYSA-N -1 3 366.425 3.744 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)Nc1cccc(COC(C)C)c1 ZINC000737295779 598851237 /nfs/dbraw/zinc/85/12/37/598851237.db2.gz ZZIOZBYPWKUKPU-UHFFFAOYSA-N -1 3 366.425 3.744 20 0 FHADHM Clc1cncc(NCc2cccc(-c3ccc(-c4nnn[n-]4)s3)c2)n1 ZINC000737584501 598854922 /nfs/dbraw/zinc/85/49/22/598854922.db2.gz RAGVCYINJPOJRF-UHFFFAOYSA-N -1 3 369.841 3.651 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1CNc1ccc(Oc2ccccn2)cc1 ZINC000737641139 598871718 /nfs/dbraw/zinc/87/17/18/598871718.db2.gz SKUBTCXVMLAGBZ-UHFFFAOYSA-N -1 3 362.368 3.805 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CNc1ccc(Oc2ccccn2)cc1 ZINC000737641139 598871719 /nfs/dbraw/zinc/87/17/19/598871719.db2.gz SKUBTCXVMLAGBZ-UHFFFAOYSA-N -1 3 362.368 3.805 20 0 FHADHM Cc1ccc2oc(NCCSCc3ccccc3-c3nnn[n-]3)nc2c1 ZINC000737381510 598936343 /nfs/dbraw/zinc/93/63/43/598936343.db2.gz XYZMSFNLTCZFIF-UHFFFAOYSA-N -1 3 366.450 3.662 20 0 FHADHM Cc1ccc2oc(NCCSCc3ccccc3-c3nn[n-]n3)nc2c1 ZINC000737381510 598936344 /nfs/dbraw/zinc/93/63/44/598936344.db2.gz XYZMSFNLTCZFIF-UHFFFAOYSA-N -1 3 366.450 3.662 20 0 FHADHM C[C@@H](c1cc2ccccc2o1)N(C)c1ncc(-c2nnn[n-]2)cc1Cl ZINC000736198347 598936629 /nfs/dbraw/zinc/93/66/29/598936629.db2.gz SKOZDDKURDKIHT-JTQLQIEISA-N -1 3 354.801 3.859 20 0 FHADHM C[C@@H](c1cc2ccccc2o1)N(C)c1ncc(-c2nn[n-]n2)cc1Cl ZINC000736198347 598936630 /nfs/dbraw/zinc/93/66/30/598936630.db2.gz SKOZDDKURDKIHT-JTQLQIEISA-N -1 3 354.801 3.859 20 0 FHADHM CC(C)(C)[C@H]1CCc2c(sc(NC(=O)C3CC=CC3)c2-c2nnn[n-]2)C1 ZINC000735598213 598939027 /nfs/dbraw/zinc/93/90/27/598939027.db2.gz XTYKRYLIVFSWHG-LBPRGKRZSA-N -1 3 371.510 3.984 20 0 FHADHM CC(C)(C)[C@H]1CCc2c(sc(NC(=O)C3CC=CC3)c2-c2nn[n-]n2)C1 ZINC000735598213 598939028 /nfs/dbraw/zinc/93/90/28/598939028.db2.gz XTYKRYLIVFSWHG-LBPRGKRZSA-N -1 3 371.510 3.984 20 0 FHADHM C[C@H](c1ccccc1)N(CC1CCC1)C(=O)c1sccc1-c1nnn[n-]1 ZINC000736205918 598944743 /nfs/dbraw/zinc/94/47/43/598944743.db2.gz ZRUGCYXOBZPSKK-CYBMUJFWSA-N -1 3 367.478 3.932 20 0 FHADHM C[C@H](c1ccccc1)N(CC1CCC1)C(=O)c1sccc1-c1nn[n-]n1 ZINC000736205918 598944745 /nfs/dbraw/zinc/94/47/45/598944745.db2.gz ZRUGCYXOBZPSKK-CYBMUJFWSA-N -1 3 367.478 3.932 20 0 FHADHM Fc1ccc(NCc2ccc(-c3nnn[n-]3)cc2)c(OC2CCCC2)c1 ZINC000822783012 607256067 /nfs/dbraw/zinc/25/60/67/607256067.db2.gz PWURTPZDGSZGAV-UHFFFAOYSA-N -1 3 353.401 3.939 20 0 FHADHM Fc1ccc(NCc2ccc(-c3nn[n-]n3)cc2)c(OC2CCCC2)c1 ZINC000822783012 607256068 /nfs/dbraw/zinc/25/60/68/607256068.db2.gz PWURTPZDGSZGAV-UHFFFAOYSA-N -1 3 353.401 3.939 20 0 FHADHM Cc1cccc(NC2CCN(c3c(F)cc(-c4nnn[n-]4)cc3F)CC2)c1 ZINC000737398610 598975701 /nfs/dbraw/zinc/97/57/01/598975701.db2.gz CIHONROAGZZSKH-UHFFFAOYSA-N -1 3 370.407 3.534 20 0 FHADHM Cc1cccc(NC2CCN(c3c(F)cc(-c4nn[n-]n4)cc3F)CC2)c1 ZINC000737398610 598975703 /nfs/dbraw/zinc/97/57/03/598975703.db2.gz CIHONROAGZZSKH-UHFFFAOYSA-N -1 3 370.407 3.534 20 0 FHADHM O=C(CCC1CC1)Nc1sc2c(c1-c1nnn[n-]1)-c1ccccc1CC2 ZINC000737824910 598994782 /nfs/dbraw/zinc/99/47/82/598994782.db2.gz VAVLCBRAGAXFOZ-UHFFFAOYSA-N -1 3 365.462 3.823 20 0 FHADHM O=C(CCC1CC1)Nc1sc2c(c1-c1nn[n-]n1)-c1ccccc1CC2 ZINC000737824910 598994784 /nfs/dbraw/zinc/99/47/84/598994784.db2.gz VAVLCBRAGAXFOZ-UHFFFAOYSA-N -1 3 365.462 3.823 20 0 FHADHM CC(C)[C@H](NC(=O)Cc1ccc(-c2nnn[n-]2)cc1)c1ccccc1Cl ZINC000735722407 599006936 /nfs/dbraw/zinc/00/69/36/599006936.db2.gz RATMJLSSPLHGEB-SFHVURJKSA-N -1 3 369.856 3.576 20 0 FHADHM CC(C)[C@H](NC(=O)Cc1ccc(-c2nn[n-]n2)cc1)c1ccccc1Cl ZINC000735722407 599006938 /nfs/dbraw/zinc/00/69/38/599006938.db2.gz RATMJLSSPLHGEB-SFHVURJKSA-N -1 3 369.856 3.576 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1OCCS[C@@H](C)c1ccccc1 ZINC000737032833 599009795 /nfs/dbraw/zinc/00/97/95/599009795.db2.gz PGZDNQNTTRNWNP-ZDUSSCGKSA-N -1 3 356.451 3.749 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1OCCS[C@@H](C)c1ccccc1 ZINC000737032833 599009796 /nfs/dbraw/zinc/00/97/96/599009796.db2.gz PGZDNQNTTRNWNP-ZDUSSCGKSA-N -1 3 356.451 3.749 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@@H]2C(=O)OCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000735922224 599016601 /nfs/dbraw/zinc/01/66/01/599016601.db2.gz CVOVCMRKFBNBCD-OALUTQOASA-N -1 3 362.433 3.837 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@@H]2C(=O)OCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000735922224 599016603 /nfs/dbraw/zinc/01/66/03/599016603.db2.gz CVOVCMRKFBNBCD-OALUTQOASA-N -1 3 362.433 3.837 20 0 FHADHM Cc1oc(-c2cccs2)nc1CNc1cccc(-c2nnn[n-]2)c1C ZINC000822535279 607256968 /nfs/dbraw/zinc/25/69/68/607256968.db2.gz LZUCYYNEJJJWTJ-UHFFFAOYSA-N -1 3 352.423 3.812 20 0 FHADHM Cc1oc(-c2cccs2)nc1CNc1cccc(-c2nn[n-]n2)c1C ZINC000822535279 607256969 /nfs/dbraw/zinc/25/69/69/607256969.db2.gz LZUCYYNEJJJWTJ-UHFFFAOYSA-N -1 3 352.423 3.812 20 0 FHADHM CC(C)CC[C@@H](C)NC(=O)c1c(Cl)cc(-c2nnn[n-]2)cc1Cl ZINC000824242780 607833110 /nfs/dbraw/zinc/83/31/10/607833110.db2.gz BKFUKZNQTJBXQJ-SECBINFHSA-N -1 3 356.257 3.728 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N[C@@H]2CCCc3ccccc32)n1 ZINC000737633389 599037394 /nfs/dbraw/zinc/03/73/94/599037394.db2.gz QVAPJJFWEOBYAW-CYBMUJFWSA-N -1 3 360.343 3.770 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N[C@@H]2CCCc3ccccc32)n1 ZINC000737633389 599037397 /nfs/dbraw/zinc/03/73/97/599037397.db2.gz QVAPJJFWEOBYAW-CYBMUJFWSA-N -1 3 360.343 3.770 20 0 FHADHM CN(Cc1ccc(Cl)s1)c1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000736816928 599039076 /nfs/dbraw/zinc/03/90/76/599039076.db2.gz PLKSOOBXGRSZPQ-UHFFFAOYSA-N -1 3 374.779 3.632 20 0 FHADHM CN(Cc1ccc(Cl)s1)c1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000736816928 599039078 /nfs/dbraw/zinc/03/90/78/599039078.db2.gz PLKSOOBXGRSZPQ-UHFFFAOYSA-N -1 3 374.779 3.632 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N2CCC[C@@H]2c2ccccc2)n1 ZINC000737633224 599041891 /nfs/dbraw/zinc/04/18/91/599041891.db2.gz PGKKDXZARCTFSB-CYBMUJFWSA-N -1 3 360.343 3.622 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N2CCC[C@@H]2c2ccccc2)n1 ZINC000737633224 599041894 /nfs/dbraw/zinc/04/18/94/599041894.db2.gz PGKKDXZARCTFSB-CYBMUJFWSA-N -1 3 360.343 3.622 20 0 FHADHM CO[C@@H](CNc1c(F)cc(-c2nnn[n-]2)cc1F)c1ccc(Cl)cc1 ZINC000821677539 599043943 /nfs/dbraw/zinc/04/39/43/599043943.db2.gz ZLWGNJPEFZAESD-AWEZNQCLSA-N -1 3 365.771 3.598 20 0 FHADHM CO[C@@H](CNc1c(F)cc(-c2nn[n-]n2)cc1F)c1ccc(Cl)cc1 ZINC000821677539 599043946 /nfs/dbraw/zinc/04/39/46/599043946.db2.gz ZLWGNJPEFZAESD-AWEZNQCLSA-N -1 3 365.771 3.598 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(NCCc2ccc(Cl)s2)n1 ZINC000737634903 599044487 /nfs/dbraw/zinc/04/44/87/599044487.db2.gz BCXDBHZUQKPAOT-UHFFFAOYSA-N -1 3 374.779 3.650 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(NCCc2ccc(Cl)s2)n1 ZINC000737634903 599044489 /nfs/dbraw/zinc/04/44/89/599044489.db2.gz BCXDBHZUQKPAOT-UHFFFAOYSA-N -1 3 374.779 3.650 20 0 FHADHM CC(C)CC[C@@H](C)NC(=O)c1c(Cl)cc(-c2nn[n-]n2)cc1Cl ZINC000824242780 607833111 /nfs/dbraw/zinc/83/31/11/607833111.db2.gz BKFUKZNQTJBXQJ-SECBINFHSA-N -1 3 356.257 3.728 20 0 FHADHM CC1(C)CN(c2nc(C(F)(F)F)ccc2-c2nnn[n-]2)[C@H]1c1ccccc1 ZINC000736215039 599045687 /nfs/dbraw/zinc/04/56/87/599045687.db2.gz ZUKIYSRKEFROSF-AWEZNQCLSA-N -1 3 374.370 3.868 20 0 FHADHM CC1(C)CN(c2nc(C(F)(F)F)ccc2-c2nn[n-]n2)[C@H]1c1ccccc1 ZINC000736215039 599045690 /nfs/dbraw/zinc/04/56/90/599045690.db2.gz ZUKIYSRKEFROSF-AWEZNQCLSA-N -1 3 374.370 3.868 20 0 FHADHM C[C@@H](Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1)c1c(F)cccc1F ZINC000736135957 599045843 /nfs/dbraw/zinc/04/58/43/599045843.db2.gz CMXHVUADSDHELS-SSDOTTSWSA-N -1 3 370.285 3.732 20 0 FHADHM C[C@@H](Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1)c1c(F)cccc1F ZINC000736135957 599045846 /nfs/dbraw/zinc/04/58/46/599045846.db2.gz CMXHVUADSDHELS-SSDOTTSWSA-N -1 3 370.285 3.732 20 0 FHADHM COc1cccc(Oc2ncccc2CNc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737140118 599049622 /nfs/dbraw/zinc/04/96/22/599049622.db2.gz CVVNDSGXBJAIFP-UHFFFAOYSA-N -1 3 374.404 3.675 20 0 FHADHM Fc1ccc(CNc2nc(C(F)(F)F)ccc2-c2nnn[n-]2)cc1Cl ZINC000737649344 599052244 /nfs/dbraw/zinc/05/22/44/599052244.db2.gz NMFOANRAEXCWQQ-UHFFFAOYSA-N -1 3 372.713 3.685 20 0 FHADHM Fc1ccc(CNc2nc(C(F)(F)F)ccc2-c2nn[n-]n2)cc1Cl ZINC000737649344 599052246 /nfs/dbraw/zinc/05/22/46/599052246.db2.gz NMFOANRAEXCWQQ-UHFFFAOYSA-N -1 3 372.713 3.685 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N2CCC3(CCCCC3)CC2)n1 ZINC000737633716 599052986 /nfs/dbraw/zinc/05/29/86/599052986.db2.gz VIGRQYWERSAKCK-UHFFFAOYSA-N -1 3 366.391 3.831 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N2CCC3(CCCCC3)CC2)n1 ZINC000737633716 599052989 /nfs/dbraw/zinc/05/29/89/599052989.db2.gz VIGRQYWERSAKCK-UHFFFAOYSA-N -1 3 366.391 3.831 20 0 FHADHM C[C@H](CCc1cccn1C)Nc1ccc(-c2nn[n-]n2)cc1C(F)(F)F ZINC000820253314 599054457 /nfs/dbraw/zinc/05/44/57/599054457.db2.gz HWGXHDKDFFNRGW-LLVKDONJSA-N -1 3 364.375 3.657 20 0 FHADHM Clc1ccc(N[C@@H]2CCCN(c3ccccc3)C2)c(-c2nnn[n-]2)c1 ZINC000737576178 599059847 /nfs/dbraw/zinc/05/98/47/599059847.db2.gz XJZLBVDYRZIWLW-CQSZACIVSA-N -1 3 354.845 3.601 20 0 FHADHM Clc1ccc(N[C@@H]2CCCN(c3ccccc3)C2)c(-c2nn[n-]n2)c1 ZINC000737576178 599059850 /nfs/dbraw/zinc/05/98/50/599059850.db2.gz XJZLBVDYRZIWLW-CQSZACIVSA-N -1 3 354.845 3.601 20 0 FHADHM Cc1ccc(NC(=O)[C@H](C)Sc2ccc(-c3nnn[n-]3)cc2F)c(C)c1 ZINC000737355401 599064505 /nfs/dbraw/zinc/06/45/05/599064505.db2.gz GDWIRVRFXUVURG-LBPRGKRZSA-N -1 3 371.441 3.742 20 0 FHADHM Cc1ccc(NC(=O)[C@H](C)Sc2ccc(-c3nn[n-]n3)cc2F)c(C)c1 ZINC000737355401 599064507 /nfs/dbraw/zinc/06/45/07/599064507.db2.gz GDWIRVRFXUVURG-LBPRGKRZSA-N -1 3 371.441 3.742 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1SCc1coc(-c2ccccc2)n1 ZINC000737643173 599064561 /nfs/dbraw/zinc/06/45/61/599064561.db2.gz CGDILIOCGSOFCG-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1SCc1coc(-c2ccccc2)n1 ZINC000737643173 599064564 /nfs/dbraw/zinc/06/45/64/599064564.db2.gz CGDILIOCGSOFCG-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM C[C@@H](C(=O)N(Cc1ccccc1)c1ccccc1-c1nnn[n-]1)c1ccco1 ZINC000735515049 599069532 /nfs/dbraw/zinc/06/95/32/599069532.db2.gz YJDOOIXSLTWNOT-OAHLLOKOSA-N -1 3 373.416 3.797 20 0 FHADHM C[C@@H](C(=O)N(Cc1ccccc1)c1ccccc1-c1nn[n-]n1)c1ccco1 ZINC000735515049 599069534 /nfs/dbraw/zinc/06/95/34/599069534.db2.gz YJDOOIXSLTWNOT-OAHLLOKOSA-N -1 3 373.416 3.797 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@@H]1C[C@H]1C1CCCCC1 ZINC000736481157 599070555 /nfs/dbraw/zinc/07/05/55/599070555.db2.gz UYCSZANLFZUQQQ-RBUKOAKNSA-N -1 3 367.497 3.822 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@@H]1C[C@H]1C1CCCCC1 ZINC000736481157 599070559 /nfs/dbraw/zinc/07/05/59/599070559.db2.gz UYCSZANLFZUQQQ-RBUKOAKNSA-N -1 3 367.497 3.822 20 0 FHADHM CCc1ccc(CC(=O)N(CC)[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000736682186 599071484 /nfs/dbraw/zinc/07/14/84/599071484.db2.gz ICWKADXRNAAPJP-OAHLLOKOSA-N -1 3 363.465 3.581 20 0 FHADHM CCc1ccc(CC(=O)N(CC)[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000736682186 599071486 /nfs/dbraw/zinc/07/14/86/599071486.db2.gz ICWKADXRNAAPJP-OAHLLOKOSA-N -1 3 363.465 3.581 20 0 FHADHM CCSCc1cccc(NC(=O)CCc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736666897 599084393 /nfs/dbraw/zinc/08/43/93/599084393.db2.gz PFJJTCXJKSGMNP-UHFFFAOYSA-N -1 3 367.478 3.691 20 0 FHADHM CCSCc1cccc(NC(=O)CCc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736666897 599084394 /nfs/dbraw/zinc/08/43/94/599084394.db2.gz PFJJTCXJKSGMNP-UHFFFAOYSA-N -1 3 367.478 3.691 20 0 FHADHM Cc1cc(NC(=O)C=Cc2ccccc2-c2nnn[n-]2)ccc1OC(C)C ZINC000737270334 599091123 /nfs/dbraw/zinc/09/11/23/599091123.db2.gz GBQWEUOCMROQRT-FLIBITNWSA-N -1 3 363.421 3.614 20 0 FHADHM Cc1cc(NC(=O)C=Cc2ccccc2-c2nn[n-]n2)ccc1OC(C)C ZINC000737270334 599091125 /nfs/dbraw/zinc/09/11/25/599091125.db2.gz GBQWEUOCMROQRT-FLIBITNWSA-N -1 3 363.421 3.614 20 0 FHADHM FC(F)(F)c1cc(N2CCC(C(F)(F)F)CC2)ccc1-c1nnn[n-]1 ZINC000822724034 599091608 /nfs/dbraw/zinc/09/16/08/599091608.db2.gz WWJGHJUXWCROJO-UHFFFAOYSA-N -1 3 365.281 3.664 20 0 FHADHM FC(F)(F)c1cc(N2CCC(C(F)(F)F)CC2)ccc1-c1nn[n-]n1 ZINC000822724034 599091611 /nfs/dbraw/zinc/09/16/11/599091611.db2.gz WWJGHJUXWCROJO-UHFFFAOYSA-N -1 3 365.281 3.664 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1Nc1cccc(Oc2ccccn2)c1 ZINC000822568203 599111888 /nfs/dbraw/zinc/11/18/88/599111888.db2.gz NIHDPVOIEWKGMT-UHFFFAOYSA-N -1 3 365.784 3.846 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1Nc1cccc(Oc2ccccn2)c1 ZINC000822568203 599111891 /nfs/dbraw/zinc/11/18/91/599111891.db2.gz NIHDPVOIEWKGMT-UHFFFAOYSA-N -1 3 365.784 3.846 20 0 FHADHM COC(=O)[C@@H](Sc1cccc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736900780 599112602 /nfs/dbraw/zinc/11/26/02/599112602.db2.gz GHCPRFSPQHRZCV-AWEZNQCLSA-N -1 3 360.826 3.527 20 0 FHADHM COC(=O)[C@@H](Sc1cccc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736900780 599112605 /nfs/dbraw/zinc/11/26/05/599112605.db2.gz GHCPRFSPQHRZCV-AWEZNQCLSA-N -1 3 360.826 3.527 20 0 FHADHM CCN(C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)[C@@H](C)c1cccnc1 ZINC000736506334 599145220 /nfs/dbraw/zinc/14/52/20/599145220.db2.gz UTPYTXZOFNHTAZ-NSHDSACASA-N -1 3 371.832 3.530 20 0 FHADHM CCN(C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)[C@@H](C)c1cccnc1 ZINC000736506334 599145223 /nfs/dbraw/zinc/14/52/23/599145223.db2.gz UTPYTXZOFNHTAZ-NSHDSACASA-N -1 3 371.832 3.530 20 0 FHADHM Cc1ccc(SCc2nnc(-c3ccc(-c4nnn[n-]4)cc3)o2)c(C)c1 ZINC000737369903 599159673 /nfs/dbraw/zinc/15/96/73/599159673.db2.gz YQFPSMFIRRBWQS-UHFFFAOYSA-N -1 3 364.434 3.826 20 0 FHADHM Cc1ccc(SCc2nnc(-c3ccc(-c4nn[n-]n4)cc3)o2)c(C)c1 ZINC000737369903 599159676 /nfs/dbraw/zinc/15/96/76/599159676.db2.gz YQFPSMFIRRBWQS-UHFFFAOYSA-N -1 3 364.434 3.826 20 0 FHADHM CC(C)(C)[C@@H]1CCCN(C(=O)C=Cc2ccccc2-c2nnn[n-]2)CC1 ZINC000735597959 599162414 /nfs/dbraw/zinc/16/24/14/599162414.db2.gz UYDCHZZWALTZLQ-BLIJAFNYSA-N -1 3 353.470 3.555 20 0 FHADHM CC(C)(C)[C@@H]1CCCN(C(=O)C=Cc2ccccc2-c2nn[n-]n2)CC1 ZINC000735597959 599162417 /nfs/dbraw/zinc/16/24/17/599162417.db2.gz UYDCHZZWALTZLQ-BLIJAFNYSA-N -1 3 353.470 3.555 20 0 FHADHM CC(C)c1ccc(C(=O)[C@H](C)Sc2cc(-c3nnn[n-]3)ccn2)cc1 ZINC000736192699 599164203 /nfs/dbraw/zinc/16/42/03/599164203.db2.gz LWNNPQCAGKQMQW-LBPRGKRZSA-N -1 3 353.451 3.749 20 0 FHADHM CC(C)c1ccc(C(=O)[C@H](C)Sc2cc(-c3nn[n-]n3)ccn2)cc1 ZINC000736192699 599164204 /nfs/dbraw/zinc/16/42/04/599164204.db2.gz LWNNPQCAGKQMQW-LBPRGKRZSA-N -1 3 353.451 3.749 20 0 FHADHM CCc1ccccc1NC(=O)[C@H](C)Sc1ccc(-c2nnn[n-]2)cc1F ZINC000736702924 599169020 /nfs/dbraw/zinc/16/90/20/599169020.db2.gz ZJJUYHNOBSVFGL-NSHDSACASA-N -1 3 371.441 3.688 20 0 FHADHM CCc1ccccc1NC(=O)[C@H](C)Sc1ccc(-c2nn[n-]n2)cc1F ZINC000736702924 599169022 /nfs/dbraw/zinc/16/90/22/599169022.db2.gz ZJJUYHNOBSVFGL-NSHDSACASA-N -1 3 371.441 3.688 20 0 FHADHM Cc1ccc(NC(=O)[C@@H](C)Sc2ccc(-c3nnn[n-]3)cc2F)cc1C ZINC000737356618 599171379 /nfs/dbraw/zinc/17/13/79/599171379.db2.gz QSGZNGLYOPMMMS-GFCCVEGCSA-N -1 3 371.441 3.742 20 0 FHADHM Cc1ccc(NC(=O)[C@@H](C)Sc2ccc(-c3nn[n-]n3)cc2F)cc1C ZINC000737356618 599171380 /nfs/dbraw/zinc/17/13/80/599171380.db2.gz QSGZNGLYOPMMMS-GFCCVEGCSA-N -1 3 371.441 3.742 20 0 FHADHM O=C(Oc1ccc(-c2ccc(-c3nnn[n-]3)cc2)cc1)[C@H]1Cc2ccccc21 ZINC000738250611 599179542 /nfs/dbraw/zinc/17/95/42/599179542.db2.gz JBCREXGIBAHIHA-FQEVSTJZSA-N -1 3 368.396 3.779 20 0 FHADHM O=C(Oc1ccc(-c2ccc(-c3nn[n-]n3)cc2)cc1)[C@H]1Cc2ccccc21 ZINC000738250611 599179545 /nfs/dbraw/zinc/17/95/45/599179545.db2.gz JBCREXGIBAHIHA-FQEVSTJZSA-N -1 3 368.396 3.779 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@@H](C)c1cccc(F)c1 ZINC000735511140 599182351 /nfs/dbraw/zinc/18/23/51/599182351.db2.gz DTMJDFYDXHYYHO-AWEZNQCLSA-N -1 3 367.428 3.547 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@@H](C)c1cccc(F)c1 ZINC000735511140 599182353 /nfs/dbraw/zinc/18/23/53/599182353.db2.gz DTMJDFYDXHYYHO-AWEZNQCLSA-N -1 3 367.428 3.547 20 0 FHADHM C[C@@H](OC(=O)C[C@H](C)c1cccc(F)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000735974878 599189806 /nfs/dbraw/zinc/18/98/06/599189806.db2.gz CUXYZALYFRLHHZ-QWHCGFSZSA-N -1 3 354.385 3.804 20 0 FHADHM C[C@@H](OC(=O)C[C@H](C)c1cccc(F)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000735974878 599189808 /nfs/dbraw/zinc/18/98/08/599189808.db2.gz CUXYZALYFRLHHZ-QWHCGFSZSA-N -1 3 354.385 3.804 20 0 FHADHM O=C(CC1CC1)N(Cc1ccccc1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000737813943 599190157 /nfs/dbraw/zinc/19/01/57/599190157.db2.gz MEYMFYODWWRKCD-UHFFFAOYSA-N -1 3 367.840 3.853 20 0 FHADHM O=C(CC1CC1)N(Cc1ccccc1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000737813943 599190158 /nfs/dbraw/zinc/19/01/58/599190158.db2.gz MEYMFYODWWRKCD-UHFFFAOYSA-N -1 3 367.840 3.853 20 0 FHADHM CCC[C@H]1[C@H](C)CCCN1C(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000821034308 599192471 /nfs/dbraw/zinc/19/24/71/599192471.db2.gz KKVYNOGGCCDBBL-PBHICJAKSA-N -1 3 373.526 3.527 20 0 FHADHM CCC[C@H]1[C@H](C)CCCN1C(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000821034308 599192474 /nfs/dbraw/zinc/19/24/74/599192474.db2.gz KKVYNOGGCCDBBL-PBHICJAKSA-N -1 3 373.526 3.527 20 0 FHADHM CCCCNC(=O)c1cccc(Oc2ccc(Cl)cc2-c2nnn[n-]2)c1 ZINC000736459975 599192631 /nfs/dbraw/zinc/19/26/31/599192631.db2.gz CUDCQXQNHZTLPC-UHFFFAOYSA-N -1 3 371.828 3.842 20 0 FHADHM CCCCNC(=O)c1cccc(Oc2ccc(Cl)cc2-c2nn[n-]n2)c1 ZINC000736459975 599192634 /nfs/dbraw/zinc/19/26/34/599192634.db2.gz CUDCQXQNHZTLPC-UHFFFAOYSA-N -1 3 371.828 3.842 20 0 FHADHM CCc1noc(-c2cccc(Oc3cccc(Cl)c3-c3nnn[n-]3)c2)n1 ZINC000736710980 599192652 /nfs/dbraw/zinc/19/26/52/599192652.db2.gz MYQVNEVWXRDPTE-UHFFFAOYSA-N -1 3 368.784 3.925 20 0 FHADHM C[C@H](CC(=O)Oc1ccc(-c2ccc(-c3nnn[n-]3)cc2)cc1)n1cccc1 ZINC000735975478 599199027 /nfs/dbraw/zinc/19/90/27/599199027.db2.gz HFYXZKCRSSYWDY-OAHLLOKOSA-N -1 3 373.416 3.892 20 0 FHADHM C[C@H](CC(=O)Oc1ccc(-c2ccc(-c3nn[n-]n3)cc2)cc1)n1cccc1 ZINC000735975478 599199028 /nfs/dbraw/zinc/19/90/28/599199028.db2.gz HFYXZKCRSSYWDY-OAHLLOKOSA-N -1 3 373.416 3.892 20 0 FHADHM Cc1cccc([C@H]2CCCCN2C(=O)c2sccc2-c2nnn[n-]2)c1C ZINC000822299933 599202795 /nfs/dbraw/zinc/20/27/95/599202795.db2.gz ZNXMSQDBADQREF-MRXNPFEDSA-N -1 3 367.478 3.912 20 0 FHADHM Cc1cccc([C@H]2CCCCN2C(=O)c2sccc2-c2nn[n-]n2)c1C ZINC000822299933 599202797 /nfs/dbraw/zinc/20/27/97/599202797.db2.gz ZNXMSQDBADQREF-MRXNPFEDSA-N -1 3 367.478 3.912 20 0 FHADHM O=C(CC1CC1)N(Cc1ccc(Cl)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000737813888 599211529 /nfs/dbraw/zinc/21/15/29/599211529.db2.gz LMMYJHHYHPNSTE-UHFFFAOYSA-N -1 3 367.840 3.853 20 0 FHADHM O=C(CC1CC1)N(Cc1ccc(Cl)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000737813888 599211531 /nfs/dbraw/zinc/21/15/31/599211531.db2.gz LMMYJHHYHPNSTE-UHFFFAOYSA-N -1 3 367.840 3.853 20 0 FHADHM CCc1ccc([C@@H]2C[C@H](C)CCN2C(=O)c2ccc(-c3nnn[n-]3)cc2)o1 ZINC000821481998 599221005 /nfs/dbraw/zinc/22/10/05/599221005.db2.gz PDINWDCGTPJKHA-DYVFJYSZSA-N -1 3 365.437 3.636 20 0 FHADHM CCc1ccc([C@@H]2C[C@H](C)CCN2C(=O)c2ccc(-c3nn[n-]n3)cc2)o1 ZINC000821481998 599221007 /nfs/dbraw/zinc/22/10/07/599221007.db2.gz PDINWDCGTPJKHA-DYVFJYSZSA-N -1 3 365.437 3.636 20 0 FHADHM C[C@@H]1C[C@@H]1[C@@H](NC(=O)c1cccc(-c2nnn[n-]2)c1)c1ccc(Cl)cc1 ZINC000736231691 599226081 /nfs/dbraw/zinc/22/60/81/599226081.db2.gz CCTHAMJFLBLPSV-NVGVWMPQSA-N -1 3 367.840 3.647 20 0 FHADHM C[C@@H]1C[C@@H]1[C@@H](NC(=O)c1cccc(-c2nn[n-]n2)c1)c1ccc(Cl)cc1 ZINC000736231691 599226083 /nfs/dbraw/zinc/22/60/83/599226083.db2.gz CCTHAMJFLBLPSV-NVGVWMPQSA-N -1 3 367.840 3.647 20 0 FHADHM CC[C@@H](C)C[C@@H](C)NC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820870537 599227797 /nfs/dbraw/zinc/22/77/97/599227797.db2.gz URDNYLQVDCJOLL-NXEZZACHSA-N -1 3 352.895 3.631 20 0 FHADHM CC[C@@H](C)C[C@@H](C)NC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820870537 599227800 /nfs/dbraw/zinc/22/78/00/599227800.db2.gz URDNYLQVDCJOLL-NXEZZACHSA-N -1 3 352.895 3.631 20 0 FHADHM Cc1c(Cl)cccc1NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000822034754 599235834 /nfs/dbraw/zinc/23/58/34/599235834.db2.gz KQULXRFNUMJBTF-LLVKDONJSA-N -1 3 356.817 3.711 20 0 FHADHM Cc1c(Cl)cccc1NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000822034754 599235836 /nfs/dbraw/zinc/23/58/36/599235836.db2.gz KQULXRFNUMJBTF-LLVKDONJSA-N -1 3 356.817 3.711 20 0 FHADHM Cc1c(NC(=O)CCCc2c[nH]c3ccccc23)cccc1-c1nnn[n-]1 ZINC000822066593 607267091 /nfs/dbraw/zinc/26/70/91/607267091.db2.gz GKOWXQZHWKIMOV-UHFFFAOYSA-N -1 3 360.421 3.618 20 0 FHADHM Cc1c(NC(=O)CCCc2c[nH]c3ccccc23)cccc1-c1nn[n-]n1 ZINC000822066593 607267092 /nfs/dbraw/zinc/26/70/92/607267092.db2.gz GKOWXQZHWKIMOV-UHFFFAOYSA-N -1 3 360.421 3.618 20 0 FHADHM C[C@H]1CCN(C(=S)Nc2ccccc2-c2nnn[n-]2)[C@H](c2ccco2)C1 ZINC000820715958 599238599 /nfs/dbraw/zinc/23/85/99/599238599.db2.gz GFDPUPJFNJFOID-WFASDCNBSA-N -1 3 368.466 3.630 20 0 FHADHM C[C@H]1CCN(C(=S)Nc2ccccc2-c2nn[n-]n2)[C@H](c2ccco2)C1 ZINC000820715958 599238601 /nfs/dbraw/zinc/23/86/01/599238601.db2.gz GFDPUPJFNJFOID-WFASDCNBSA-N -1 3 368.466 3.630 20 0 FHADHM Cc1ccc(C)c(NC(=S)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000822232270 599239095 /nfs/dbraw/zinc/23/90/95/599239095.db2.gz ZGSVJBUGVFDJKO-ZDUSSCGKSA-N -1 3 352.467 3.531 20 0 FHADHM Cc1ccc(C)c(NC(=S)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000822232270 599239098 /nfs/dbraw/zinc/23/90/98/599239098.db2.gz ZGSVJBUGVFDJKO-ZDUSSCGKSA-N -1 3 352.467 3.531 20 0 FHADHM C[C@H](NC(=O)Nc1ccc(F)cc1Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000820380523 599243327 /nfs/dbraw/zinc/24/33/27/599243327.db2.gz VSVLRNPELRTKHS-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM C[C@H](NC(=O)Nc1ccc(F)cc1Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000820380523 599243329 /nfs/dbraw/zinc/24/33/29/599243329.db2.gz VSVLRNPELRTKHS-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM C[C@@H](NC(=O)Nc1cc(Cl)ccc1F)c1cccc(-c2nnn[n-]2)c1 ZINC000820374918 599248939 /nfs/dbraw/zinc/24/89/39/599248939.db2.gz TXRFBLHIBUMYDC-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM C[C@@H](NC(=O)Nc1cc(Cl)ccc1F)c1cccc(-c2nn[n-]n2)c1 ZINC000820374918 599248940 /nfs/dbraw/zinc/24/89/40/599248940.db2.gz TXRFBLHIBUMYDC-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM C[C@@H](NC(=O)Nc1cccc(Cl)c1F)c1cccc(-c2nnn[n-]2)c1 ZINC000820380582 599248989 /nfs/dbraw/zinc/24/89/89/599248989.db2.gz WPKVTCPNODEUQB-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM C[C@@H](NC(=O)Nc1cccc(Cl)c1F)c1cccc(-c2nn[n-]n2)c1 ZINC000820380582 599248992 /nfs/dbraw/zinc/24/89/92/599248992.db2.gz WPKVTCPNODEUQB-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM CC(C)Oc1ccc(NC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000820164357 599254201 /nfs/dbraw/zinc/25/42/01/599254201.db2.gz IXAVXCBJMZIGKS-CYBMUJFWSA-N -1 3 366.425 3.537 20 0 FHADHM CC(C)Oc1ccc(NC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000820164357 599254204 /nfs/dbraw/zinc/25/42/04/599254204.db2.gz IXAVXCBJMZIGKS-CYBMUJFWSA-N -1 3 366.425 3.537 20 0 FHADHM Cc1c(NC(=O)N[C@@H](c2cccs2)C2CC2)cccc1-c1nnn[n-]1 ZINC000822089965 607285807 /nfs/dbraw/zinc/28/58/07/607285807.db2.gz HZGJVWMSCZCFIC-OAHLLOKOSA-N -1 3 354.439 3.509 20 0 FHADHM Cc1c(NC(=O)N[C@@H](c2cccs2)C2CC2)cccc1-c1nn[n-]n1 ZINC000822089965 607285808 /nfs/dbraw/zinc/28/58/08/607285808.db2.gz HZGJVWMSCZCFIC-OAHLLOKOSA-N -1 3 354.439 3.509 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)Nc2cccc(-c3nnn[n-]3)c2C)c(C)c1 ZINC000822228857 607286988 /nfs/dbraw/zinc/28/69/88/607286988.db2.gz HDKJZWHMIKGJGH-AWEZNQCLSA-N -1 3 350.426 3.675 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)Nc2cccc(-c3nn[n-]n3)c2C)c(C)c1 ZINC000822228857 607286989 /nfs/dbraw/zinc/28/69/89/607286989.db2.gz HDKJZWHMIKGJGH-AWEZNQCLSA-N -1 3 350.426 3.675 20 0 FHADHM Cc1c(NC(=O)N(C)Cc2ccc(Cl)s2)cccc1-c1nnn[n-]1 ZINC000822075297 607287317 /nfs/dbraw/zinc/28/73/17/607287317.db2.gz BBSJMEGJCRZWNT-UHFFFAOYSA-N -1 3 362.846 3.554 20 0 FHADHM Cc1c(NC(=O)N(C)Cc2ccc(Cl)s2)cccc1-c1nn[n-]n1 ZINC000822075297 607287318 /nfs/dbraw/zinc/28/73/18/607287318.db2.gz BBSJMEGJCRZWNT-UHFFFAOYSA-N -1 3 362.846 3.554 20 0 FHADHM Cc1c(NC(=O)N[C@@H](CC2CC2)c2ccccc2)cccc1-c1nnn[n-]1 ZINC000822092158 607289910 /nfs/dbraw/zinc/28/99/10/607289910.db2.gz VKILCEQTBHQZCR-SFHVURJKSA-N -1 3 362.437 3.838 20 0 FHADHM Cc1c(NC(=O)N[C@@H](CC2CC2)c2ccccc2)cccc1-c1nn[n-]n1 ZINC000822092158 607289911 /nfs/dbraw/zinc/28/99/11/607289911.db2.gz VKILCEQTBHQZCR-SFHVURJKSA-N -1 3 362.437 3.838 20 0 FHADHM Cc1ccc([C@H]2CCCN2C(=O)Nc2cccc(-c3nnn[n-]3)c2C)cc1 ZINC000822233887 607291332 /nfs/dbraw/zinc/29/13/32/607291332.db2.gz XKNKXYLQDJFDBA-GOSISDBHSA-N -1 3 362.437 3.853 20 0 FHADHM Cc1ccc([C@H]2CCCN2C(=O)Nc2cccc(-c3nn[n-]n3)c2C)cc1 ZINC000822233887 607291333 /nfs/dbraw/zinc/29/13/33/607291333.db2.gz XKNKXYLQDJFDBA-GOSISDBHSA-N -1 3 362.437 3.853 20 0 FHADHM CCC[C@@H]1[C@H](C)CCCN1C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821033775 599263245 /nfs/dbraw/zinc/26/32/45/599263245.db2.gz FDYJKXWUTMTKMS-JKIFEVAISA-N -1 3 356.474 3.538 20 0 FHADHM CCC[C@@H]1[C@H](C)CCCN1C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821033775 599263248 /nfs/dbraw/zinc/26/32/48/599263248.db2.gz FDYJKXWUTMTKMS-JKIFEVAISA-N -1 3 356.474 3.538 20 0 FHADHM c1cc(-c2nnn[n-]2)sc1CNc1ccc(-c2cn3ccccc3n2)cc1 ZINC000823802720 607309553 /nfs/dbraw/zinc/30/95/53/607309553.db2.gz ZONIOPYVVGQXIA-UHFFFAOYSA-N -1 3 373.445 3.855 20 0 FHADHM O[C@@H]1CCCC[C@H]1CCCNc1ccc(C(F)(F)F)cc1-c1nnn[n-]1 ZINC000823704563 607306211 /nfs/dbraw/zinc/30/62/11/607306211.db2.gz CBUZXMVSDNPKEE-XHDPSFHLSA-N -1 3 369.391 3.629 20 0 FHADHM O[C@@H]1CCCC[C@H]1CCCNc1ccc(C(F)(F)F)cc1-c1nn[n-]n1 ZINC000823704563 607306212 /nfs/dbraw/zinc/30/62/12/607306212.db2.gz CBUZXMVSDNPKEE-XHDPSFHLSA-N -1 3 369.391 3.629 20 0 FHADHM c1nc(COc2ccccc2NCc2ccc(-c3nnn[n-]3)cc2)cs1 ZINC000823792522 607316619 /nfs/dbraw/zinc/31/66/19/607316619.db2.gz WIELZRSRMGHGOU-UHFFFAOYSA-N -1 3 364.434 3.514 20 0 FHADHM c1nc(COc2ccccc2NCc2ccc(-c3nn[n-]n3)cc2)cs1 ZINC000823792522 607316620 /nfs/dbraw/zinc/31/66/20/607316620.db2.gz WIELZRSRMGHGOU-UHFFFAOYSA-N -1 3 364.434 3.514 20 0 FHADHM CCC[C@H]1[C@H](C)CCCN1C(=O)Nc1cc(-c2nnn[n-]2)ccc1OCC ZINC000821034404 599266643 /nfs/dbraw/zinc/26/66/43/599266643.db2.gz LVNCDYYIWJAQMP-CJNGLKHVSA-N -1 3 372.473 3.698 20 0 FHADHM CCC[C@H]1[C@H](C)CCCN1C(=O)Nc1cc(-c2nn[n-]n2)ccc1OCC ZINC000821034404 599266646 /nfs/dbraw/zinc/26/66/46/599266646.db2.gz LVNCDYYIWJAQMP-CJNGLKHVSA-N -1 3 372.473 3.698 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N[C@@H](CC1CC1)c1ccccc1 ZINC000822217763 599272765 /nfs/dbraw/zinc/27/27/65/599272765.db2.gz MVUIPDPIRWZMPL-SFHVURJKSA-N -1 3 362.437 3.838 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N[C@@H](CC1CC1)c1ccccc1 ZINC000822217763 599272767 /nfs/dbraw/zinc/27/27/67/599272767.db2.gz MVUIPDPIRWZMPL-SFHVURJKSA-N -1 3 362.437 3.838 20 0 FHADHM Cc1cc(N2CCCC[C@@H]2C)ccc1NCc1ccc(-c2nnn[n-]2)o1 ZINC000822207339 607318563 /nfs/dbraw/zinc/31/85/63/607318563.db2.gz SFSGMIVEXBMBKR-AWEZNQCLSA-N -1 3 352.442 3.759 20 0 FHADHM Cc1cc(N2CCCC[C@@H]2C)ccc1NCc1ccc(-c2nn[n-]n2)o1 ZINC000822207339 607318564 /nfs/dbraw/zinc/31/85/64/607318564.db2.gz SFSGMIVEXBMBKR-AWEZNQCLSA-N -1 3 352.442 3.759 20 0 FHADHM Cc1cc(F)cc(NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)c1 ZINC000822203508 607319733 /nfs/dbraw/zinc/31/97/33/607319733.db2.gz XICMUBKBMGKRNV-UHFFFAOYSA-N -1 3 366.400 3.511 20 0 FHADHM Cc1cc(F)cc(NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)c1 ZINC000822203508 607319734 /nfs/dbraw/zinc/31/97/34/607319734.db2.gz XICMUBKBMGKRNV-UHFFFAOYSA-N -1 3 366.400 3.511 20 0 FHADHM C[C@H](Sc1nnc(-c2ccc(F)cc2)o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736191112 599284909 /nfs/dbraw/zinc/28/49/09/599284909.db2.gz IBFFLUXXVIGEOB-JTQLQIEISA-N -1 3 368.397 3.909 20 0 FHADHM C[C@H](Sc1nnc(-c2ccc(F)cc2)o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736191112 599284911 /nfs/dbraw/zinc/28/49/11/599284911.db2.gz IBFFLUXXVIGEOB-JTQLQIEISA-N -1 3 368.397 3.909 20 0 FHADHM C[C@H]1CCCC[C@@H]1NC(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000820704677 599286606 /nfs/dbraw/zinc/28/66/06/599286606.db2.gz PHJZKGPYXVTDBS-ZANVPECISA-N -1 3 368.363 3.586 20 0 FHADHM C[C@H]1CCCC[C@@H]1NC(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000820704677 599286608 /nfs/dbraw/zinc/28/66/08/599286608.db2.gz PHJZKGPYXVTDBS-ZANVPECISA-N -1 3 368.363 3.586 20 0 FHADHM Cc1nnc(S[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)n1-c1ccccc1 ZINC000737532692 599288251 /nfs/dbraw/zinc/28/82/51/599288251.db2.gz KGGPPFLGZXWLJX-LBPRGKRZSA-N -1 3 363.450 3.609 20 0 FHADHM Cc1nnc(S[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)n1-c1ccccc1 ZINC000737532692 599288254 /nfs/dbraw/zinc/28/82/54/599288254.db2.gz KGGPPFLGZXWLJX-LBPRGKRZSA-N -1 3 363.450 3.609 20 0 FHADHM O=C(c1cccc(-c2nnn[n-]2)c1)N1CCCC[C@H]1c1ccc(F)cc1F ZINC000823487540 607321435 /nfs/dbraw/zinc/32/14/35/607321435.db2.gz DXEMMAAMGYVIJB-KRWDZBQOSA-N -1 3 369.375 3.512 20 0 FHADHM O=C(c1cccc(-c2nn[n-]n2)c1)N1CCCC[C@H]1c1ccc(F)cc1F ZINC000823487540 607321436 /nfs/dbraw/zinc/32/14/36/607321436.db2.gz DXEMMAAMGYVIJB-KRWDZBQOSA-N -1 3 369.375 3.512 20 0 FHADHM O=C(c1ccc(-c2nnn[n-]2)cc1)N1CCCC[C@@H]1c1ccc(F)cc1F ZINC000823478720 607321533 /nfs/dbraw/zinc/32/15/33/607321533.db2.gz QDFAOCSPPDDGDN-QGZVFWFLSA-N -1 3 369.375 3.512 20 0 FHADHM O=C(c1ccc(-c2nn[n-]n2)cc1)N1CCCC[C@@H]1c1ccc(F)cc1F ZINC000823478720 607321534 /nfs/dbraw/zinc/32/15/34/607321534.db2.gz QDFAOCSPPDDGDN-QGZVFWFLSA-N -1 3 369.375 3.512 20 0 FHADHM CCC(CC)n1ccc(CSCCOc2ccc(-c3nn[n-]n3)cc2)n1 ZINC000820898319 607325739 /nfs/dbraw/zinc/32/57/39/607325739.db2.gz ZBLJFLZRCIGMPC-UHFFFAOYSA-N -1 3 372.498 3.737 20 0 FHADHM CCOc1ccc([C@H](C)Nc2ccc(-c3nn[n-]n3)cc2F)cc1OCC ZINC000736635988 598234708 /nfs/dbraw/zinc/23/47/08/598234708.db2.gz GFJVQJCLUOOSAB-LBPRGKRZSA-N -1 3 371.416 3.976 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1NC[C@H]1CCCO[C@H]1c1ccccc1 ZINC000737641780 598242245 /nfs/dbraw/zinc/24/22/45/598242245.db2.gz YLEOOBXCIGGOHO-QAPCUYQASA-N -1 3 353.401 3.586 20 0 FHADHM CC(C)CCOc1ccc([C@H](C)Nc2ccc(-c3nnn[n-]3)cn2)cc1 ZINC000735819783 598243659 /nfs/dbraw/zinc/24/36/59/598243659.db2.gz LHECTXGVMGQCBG-AWEZNQCLSA-N -1 3 352.442 3.860 20 0 FHADHM CC(C)CCOc1ccc([C@H](C)Nc2ccc(-c3nn[n-]n3)cn2)cc1 ZINC000735819783 598243661 /nfs/dbraw/zinc/24/36/61/598243661.db2.gz LHECTXGVMGQCBG-AWEZNQCLSA-N -1 3 352.442 3.860 20 0 FHADHM O=C(c1ccccc1)c1cccc(NCc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000738279464 598250475 /nfs/dbraw/zinc/25/04/75/598250475.db2.gz STOHRGIOHMHLJR-UHFFFAOYSA-N -1 3 355.401 3.710 20 0 FHADHM O=C(c1ccccc1)c1cccc(NCc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000738279464 598250476 /nfs/dbraw/zinc/25/04/76/598250476.db2.gz STOHRGIOHMHLJR-UHFFFAOYSA-N -1 3 355.401 3.710 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)N[C@@H](c1ccc(F)cc1)C1CCC1 ZINC000738151424 598254879 /nfs/dbraw/zinc/25/48/79/598254879.db2.gz IECFHGHLLHBCMF-QGZVFWFLSA-N -1 3 366.400 3.669 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)N[C@@H](c1ccc(F)cc1)C1CCC1 ZINC000738151424 598254880 /nfs/dbraw/zinc/25/48/80/598254880.db2.gz IECFHGHLLHBCMF-QGZVFWFLSA-N -1 3 366.400 3.669 20 0 FHADHM CC[C@H](C)NC(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736324818 598267413 /nfs/dbraw/zinc/26/74/13/598267413.db2.gz ILNUUFNMHPVOMV-LBPRGKRZSA-N -1 3 352.398 3.579 20 0 FHADHM CC[C@H](C)NC(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736324818 598267414 /nfs/dbraw/zinc/26/74/14/598267414.db2.gz ILNUUFNMHPVOMV-LBPRGKRZSA-N -1 3 352.398 3.579 20 0 FHADHM Cc1ccccc1[C@H](C)NC(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000737420154 598275187 /nfs/dbraw/zinc/27/51/87/598275187.db2.gz HAIDIDLANDYNLL-ZDUSSCGKSA-N -1 3 367.457 3.614 20 0 FHADHM Cc1ccccc1[C@H](C)NC(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000737420154 598275189 /nfs/dbraw/zinc/27/51/89/598275189.db2.gz HAIDIDLANDYNLL-ZDUSSCGKSA-N -1 3 367.457 3.614 20 0 FHADHM CC(=CC(=O)N(C)c1ccc(-c2nnn[n-]2)cc1F)c1ccccc1Cl ZINC000735450528 598278034 /nfs/dbraw/zinc/27/80/34/598278034.db2.gz ZWHQGVXKHPMHDZ-PKNBQFBNSA-N -1 3 371.803 3.726 20 0 FHADHM CC(=CC(=O)N(C)c1ccc(-c2nn[n-]n2)cc1F)c1ccccc1Cl ZINC000735450528 598278036 /nfs/dbraw/zinc/27/80/36/598278036.db2.gz ZWHQGVXKHPMHDZ-PKNBQFBNSA-N -1 3 371.803 3.726 20 0 FHADHM CN(C(=O)c1cc2sccc2s1)c1ccc(-c2nnn[n-]2)cc1F ZINC000736749216 598280055 /nfs/dbraw/zinc/28/00/55/598280055.db2.gz OAQKQDFXXQQOEA-UHFFFAOYSA-N -1 3 359.411 3.559 20 0 FHADHM CN(C(=O)c1cc2sccc2s1)c1ccc(-c2nn[n-]n2)cc1F ZINC000736749216 598280057 /nfs/dbraw/zinc/28/00/57/598280057.db2.gz OAQKQDFXXQQOEA-UHFFFAOYSA-N -1 3 359.411 3.559 20 0 FHADHM CC(C)(C)C[C@H]1CCCN1C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000735604857 598280440 /nfs/dbraw/zinc/28/04/40/598280440.db2.gz ZVWNNGQEEKWXJS-CQSZACIVSA-N -1 3 373.505 3.856 20 0 FHADHM CC(C)(C)C[C@H]1CCCN1C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000735604857 598280441 /nfs/dbraw/zinc/28/04/41/598280441.db2.gz ZVWNNGQEEKWXJS-CQSZACIVSA-N -1 3 373.505 3.856 20 0 FHADHM CN(C(=O)CC12CC3CC(CC(C3)C1)C2)c1ccc(-c2nnn[n-]2)cc1F ZINC000736731444 598281473 /nfs/dbraw/zinc/28/14/73/598281473.db2.gz CYAGVXGNHSGVFC-UHFFFAOYSA-N -1 3 369.444 3.575 20 0 FHADHM CN(C(=O)CC12CC3CC(CC(C3)C1)C2)c1ccc(-c2nn[n-]n2)cc1F ZINC000736731444 598281475 /nfs/dbraw/zinc/28/14/75/598281475.db2.gz CYAGVXGNHSGVFC-UHFFFAOYSA-N -1 3 369.444 3.575 20 0 FHADHM Cc1nc(-c2ccsc2)ccc1C(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000104367765 598294679 /nfs/dbraw/zinc/29/46/79/598294679.db2.gz OBUCWQWOKJOMEQ-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1nc(-c2ccsc2)ccc1C(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000104367765 598294680 /nfs/dbraw/zinc/29/46/80/598294680.db2.gz OBUCWQWOKJOMEQ-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM C[C@@H](NC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1cccs1 ZINC000736127065 598316241 /nfs/dbraw/zinc/31/62/41/598316241.db2.gz QLYKAOAIMQSRMH-MRVPVSSYSA-N -1 3 364.887 3.629 20 0 FHADHM C[C@@H](NC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1cccs1 ZINC000736127065 598316243 /nfs/dbraw/zinc/31/62/43/598316243.db2.gz QLYKAOAIMQSRMH-MRVPVSSYSA-N -1 3 364.887 3.629 20 0 FHADHM C[C@H](NC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1cccs1 ZINC000736127068 598316496 /nfs/dbraw/zinc/31/64/96/598316496.db2.gz QLYKAOAIMQSRMH-QMMMGPOBSA-N -1 3 364.887 3.629 20 0 FHADHM C[C@H](NC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1cccs1 ZINC000736127068 598316497 /nfs/dbraw/zinc/31/64/97/598316497.db2.gz QLYKAOAIMQSRMH-QMMMGPOBSA-N -1 3 364.887 3.629 20 0 FHADHM C[C@@H](CNC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccccc1 ZINC000736026752 598316641 /nfs/dbraw/zinc/31/66/41/598316641.db2.gz XINQJWVLPKTTHX-NSHDSACASA-N -1 3 372.885 3.610 20 0 FHADHM C[C@@H](CNC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccccc1 ZINC000736026752 598316643 /nfs/dbraw/zinc/31/66/43/598316643.db2.gz XINQJWVLPKTTHX-NSHDSACASA-N -1 3 372.885 3.610 20 0 FHADHM C[C@@H](N(C)C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)C(C)(C)C ZINC000736095608 598318601 /nfs/dbraw/zinc/31/86/01/598318601.db2.gz HRNRYRBWFYOPMB-SECBINFHSA-N -1 3 352.895 3.583 20 0 FHADHM C[C@@H](N(C)C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)C(C)(C)C ZINC000736095608 598318603 /nfs/dbraw/zinc/31/86/03/598318603.db2.gz HRNRYRBWFYOPMB-SECBINFHSA-N -1 3 352.895 3.583 20 0 FHADHM CC(C)c1nc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCC3)cs1 ZINC000735940579 598324882 /nfs/dbraw/zinc/32/48/82/598324882.db2.gz RDHJEGJTHZKBJI-UHFFFAOYSA-N -1 3 374.495 3.639 20 0 FHADHM CC(C)c1nc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCC3)cs1 ZINC000735940579 598324883 /nfs/dbraw/zinc/32/48/83/598324883.db2.gz RDHJEGJTHZKBJI-UHFFFAOYSA-N -1 3 374.495 3.639 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)[C@@H]1CCCc2sccc21 ZINC000823303854 607350238 /nfs/dbraw/zinc/35/02/38/607350238.db2.gz XCTHUOCUXZDYEE-LLVKDONJSA-N -1 3 359.842 3.640 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)[C@@H]1CCCc2sccc21 ZINC000823303854 607350240 /nfs/dbraw/zinc/35/02/40/607350240.db2.gz XCTHUOCUXZDYEE-LLVKDONJSA-N -1 3 359.842 3.640 20 0 FHADHM CC[C@@H](Oc1ccccc1C(C)C)C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000517310709 598358065 /nfs/dbraw/zinc/35/80/65/598358065.db2.gz VOKVSFOLAXBHMR-QGZVFWFLSA-N -1 3 365.437 3.786 20 0 FHADHM CC[C@@H](Oc1ccccc1C(C)C)C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000517310709 598358067 /nfs/dbraw/zinc/35/80/67/598358067.db2.gz VOKVSFOLAXBHMR-QGZVFWFLSA-N -1 3 365.437 3.786 20 0 FHADHM CC[C@@H](Oc1ccccc1C(C)C)C(=O)Nc1sccc1-c1nnn[n-]1 ZINC000736392779 598359011 /nfs/dbraw/zinc/35/90/11/598359011.db2.gz SAJLBTPBUDURTM-CQSZACIVSA-N -1 3 371.466 3.848 20 0 FHADHM CC[C@@H](Oc1ccccc1C(C)C)C(=O)Nc1sccc1-c1nn[n-]n1 ZINC000736392779 598359014 /nfs/dbraw/zinc/35/90/14/598359014.db2.gz SAJLBTPBUDURTM-CQSZACIVSA-N -1 3 371.466 3.848 20 0 FHADHM CC(C)Oc1ccccc1C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000735913268 598359054 /nfs/dbraw/zinc/35/90/54/598359054.db2.gz LZKFVMXTXAVQDX-UHFFFAOYSA-N -1 3 357.801 3.560 20 0 FHADHM CC(C)Oc1ccccc1C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000735913268 598359056 /nfs/dbraw/zinc/35/90/56/598359056.db2.gz LZKFVMXTXAVQDX-UHFFFAOYSA-N -1 3 357.801 3.560 20 0 FHADHM C[C@H](CC(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2)c1ccccc1F ZINC000735976318 598364459 /nfs/dbraw/zinc/36/44/59/598364459.db2.gz LCSKXJWMQNDNJN-SNVBAGLBSA-N -1 3 371.441 3.688 20 0 FHADHM C[C@H](CC(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2)c1ccccc1F ZINC000735976318 598364461 /nfs/dbraw/zinc/36/44/61/598364461.db2.gz LCSKXJWMQNDNJN-SNVBAGLBSA-N -1 3 371.441 3.688 20 0 FHADHM CCN(C(=O)c1cccc2c1ccn2C)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736509366 598382933 /nfs/dbraw/zinc/38/29/33/598382933.db2.gz WAJILQRVHULZCI-AWEZNQCLSA-N -1 3 374.448 3.582 20 0 FHADHM CCN(C(=O)c1cccc2c1ccn2C)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736509366 598382935 /nfs/dbraw/zinc/38/29/35/598382935.db2.gz WAJILQRVHULZCI-AWEZNQCLSA-N -1 3 374.448 3.582 20 0 FHADHM c1coc(CN(Cc2cccs2)Cc2cccc(-c3nn[n-]n3)c2)c1 ZINC000738411353 598383771 /nfs/dbraw/zinc/38/37/71/598383771.db2.gz BFOPFFWEJZGGAS-UHFFFAOYSA-N -1 3 351.435 3.724 20 0 FHADHM CN(Cc1cccc(C(F)(F)F)c1)c1ncc(-c2nnn[n-]2)cc1Cl ZINC000736821338 598390593 /nfs/dbraw/zinc/39/05/93/598390593.db2.gz DEKIYUNNYCZZAU-UHFFFAOYSA-N -1 3 368.750 3.570 20 0 FHADHM CN(Cc1cccc(C(F)(F)F)c1)c1ncc(-c2nn[n-]n2)cc1Cl ZINC000736821338 598390595 /nfs/dbraw/zinc/39/05/95/598390595.db2.gz DEKIYUNNYCZZAU-UHFFFAOYSA-N -1 3 368.750 3.570 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1NCc1ccccc1OC1CCCC1 ZINC000737558568 598391609 /nfs/dbraw/zinc/39/16/09/598391609.db2.gz NOJGLRBJZJQHFZ-UHFFFAOYSA-N -1 3 370.844 3.849 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1NCc1ccccc1OC1CCCC1 ZINC000737558568 598391611 /nfs/dbraw/zinc/39/16/11/598391611.db2.gz NOJGLRBJZJQHFZ-UHFFFAOYSA-N -1 3 370.844 3.849 20 0 FHADHM CC(C)COc1cccc(CNc2ncc(-c3nnn[n-]3)cc2Cl)c1 ZINC000735845643 598392251 /nfs/dbraw/zinc/39/22/51/598392251.db2.gz ZRNXHSDBIFIOOE-UHFFFAOYSA-N -1 3 358.833 3.562 20 0 FHADHM CC(C)COc1cccc(CNc2ncc(-c3nn[n-]n3)cc2Cl)c1 ZINC000735845643 598392252 /nfs/dbraw/zinc/39/22/52/598392252.db2.gz ZRNXHSDBIFIOOE-UHFFFAOYSA-N -1 3 358.833 3.562 20 0 FHADHM FC(F)(F)c1ccccc1CNc1ncc(-c2nnn[n-]2)cc1Cl ZINC000737634682 598392355 /nfs/dbraw/zinc/39/23/55/598392355.db2.gz ACULYJCLEYSGMT-UHFFFAOYSA-N -1 3 354.723 3.546 20 0 FHADHM FC(F)(F)c1ccccc1CNc1ncc(-c2nn[n-]n2)cc1Cl ZINC000737634682 598392357 /nfs/dbraw/zinc/39/23/57/598392357.db2.gz ACULYJCLEYSGMT-UHFFFAOYSA-N -1 3 354.723 3.546 20 0 FHADHM Cc1[nH]c2ccccc2c1CCNc1c(F)cc(-c2nnn[n-]2)cc1F ZINC000737199484 598394851 /nfs/dbraw/zinc/39/48/51/598394851.db2.gz NGLMSXDICUDQDM-UHFFFAOYSA-N -1 3 354.364 3.589 20 0 FHADHM Cc1[nH]c2ccccc2c1CCNc1c(F)cc(-c2nn[n-]n2)cc1F ZINC000737199484 598394852 /nfs/dbraw/zinc/39/48/52/598394852.db2.gz NGLMSXDICUDQDM-UHFFFAOYSA-N -1 3 354.364 3.589 20 0 FHADHM CSc1ccccc1NC(=O)[C@H](C)Sc1ccc(-c2nnn[n-]2)cc1 ZINC000737189853 598414548 /nfs/dbraw/zinc/41/45/48/598414548.db2.gz CTAFCPRMKMKEMM-NSHDSACASA-N -1 3 371.491 3.708 20 0 FHADHM CSc1ccccc1NC(=O)[C@H](C)Sc1ccc(-c2nn[n-]n2)cc1 ZINC000737189853 598414550 /nfs/dbraw/zinc/41/45/50/598414550.db2.gz CTAFCPRMKMKEMM-NSHDSACASA-N -1 3 371.491 3.708 20 0 FHADHM CCc1ccccc1NC(=O)[C@@H](C)Sc1ccc(-c2nnn[n-]2)cc1 ZINC000736701544 598415571 /nfs/dbraw/zinc/41/55/71/598415571.db2.gz DDDBLYNDSAVAHK-GFCCVEGCSA-N -1 3 353.451 3.548 20 0 FHADHM CCc1ccccc1NC(=O)[C@@H](C)Sc1ccc(-c2nn[n-]n2)cc1 ZINC000736701544 598415572 /nfs/dbraw/zinc/41/55/72/598415572.db2.gz DDDBLYNDSAVAHK-GFCCVEGCSA-N -1 3 353.451 3.548 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@H](Sc1ccccc1)C(C)C ZINC000737291760 598418330 /nfs/dbraw/zinc/41/83/30/598418330.db2.gz OSGPHHQOOFOYSD-QGZVFWFLSA-N -1 3 367.478 3.931 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@H](Sc1ccccc1)C(C)C ZINC000737291760 598418333 /nfs/dbraw/zinc/41/83/33/598418333.db2.gz OSGPHHQOOFOYSD-QGZVFWFLSA-N -1 3 367.478 3.931 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl ZINC000499756025 598418783 /nfs/dbraw/zinc/41/87/83/598418783.db2.gz JZBVGEKJHYPFRW-KGLIPLIRSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl ZINC000499756025 598418784 /nfs/dbraw/zinc/41/87/84/598418784.db2.gz JZBVGEKJHYPFRW-KGLIPLIRSA-N -1 3 374.231 3.916 20 0 FHADHM Clc1ccc(-c2cnc(CNc3cccc(-c4nnn[n-]4)c3)o2)cc1 ZINC000737566561 598420222 /nfs/dbraw/zinc/42/02/22/598420222.db2.gz VBDBNXAGBXLHEH-UHFFFAOYSA-N -1 3 352.785 3.787 20 0 FHADHM Clc1ccc(-c2cnc(CNc3cccc(-c4nn[n-]n4)c3)o2)cc1 ZINC000737566561 598420224 /nfs/dbraw/zinc/42/02/24/598420224.db2.gz VBDBNXAGBXLHEH-UHFFFAOYSA-N -1 3 352.785 3.787 20 0 FHADHM O=C(Nc1ccccc1-c1nnn[n-]1)[C@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000738190936 598420427 /nfs/dbraw/zinc/42/04/27/598420427.db2.gz FRRCTSXNCDBTLU-STQMWFEESA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1ccccc1-c1nn[n-]n1)[C@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000738190936 598420428 /nfs/dbraw/zinc/42/04/28/598420428.db2.gz FRRCTSXNCDBTLU-STQMWFEESA-N -1 3 374.231 3.916 20 0 FHADHM C[C@H](NC(=O)Cc1ccc(-c2nnn[n-]2)cc1)c1cc2ccccc2s1 ZINC000736110696 598421795 /nfs/dbraw/zinc/42/17/95/598421795.db2.gz JVHZYMMZJYTYCH-LBPRGKRZSA-N -1 3 363.446 3.501 20 0 FHADHM C[C@H](NC(=O)Cc1ccc(-c2nn[n-]n2)cc1)c1cc2ccccc2s1 ZINC000736110696 598421797 /nfs/dbraw/zinc/42/17/97/598421797.db2.gz JVHZYMMZJYTYCH-LBPRGKRZSA-N -1 3 363.446 3.501 20 0 FHADHM CC(C)[C@@H](Sc1ccccc1)C(=O)OCc1ccc(-c2nnn[n-]2)cc1 ZINC000735736753 598425374 /nfs/dbraw/zinc/42/53/74/598425374.db2.gz WBKBESPMCLWKAI-QGZVFWFLSA-N -1 3 368.462 3.727 20 0 FHADHM CC(C)[C@@H](Sc1ccccc1)C(=O)OCc1ccc(-c2nn[n-]n2)cc1 ZINC000735736753 598425375 /nfs/dbraw/zinc/42/53/75/598425375.db2.gz WBKBESPMCLWKAI-QGZVFWFLSA-N -1 3 368.462 3.727 20 0 FHADHM CCCCC[C@@H](C)NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C(C)C ZINC000736440710 598428580 /nfs/dbraw/zinc/42/85/80/598428580.db2.gz FSQPUCMQWSGSBV-OAHLLOKOSA-N -1 3 358.490 3.756 20 0 FHADHM CCCCC[C@@H](C)NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C(C)C ZINC000736440710 598428582 /nfs/dbraw/zinc/42/85/82/598428582.db2.gz FSQPUCMQWSGSBV-OAHLLOKOSA-N -1 3 358.490 3.756 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)NC[C@@H]1CCCC[C@H]1C ZINC000736271839 598429938 /nfs/dbraw/zinc/42/99/38/598429938.db2.gz OTWWQICOEISXDM-QAPCUYQASA-N -1 3 370.501 3.613 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)NC[C@@H]1CCCC[C@H]1C ZINC000736271839 598429940 /nfs/dbraw/zinc/42/99/40/598429940.db2.gz OTWWQICOEISXDM-QAPCUYQASA-N -1 3 370.501 3.613 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H](C)c1ccccc1 ZINC000736481780 598429956 /nfs/dbraw/zinc/42/99/56/598429956.db2.gz UXFWSFZISWJSQR-HNNXBMFYSA-N -1 3 364.453 3.550 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H](C)c1ccccc1 ZINC000736481780 598429958 /nfs/dbraw/zinc/42/99/58/598429958.db2.gz UXFWSFZISWJSQR-HNNXBMFYSA-N -1 3 364.453 3.550 20 0 FHADHM CC(=CC(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1)c1ccccc1Cl ZINC000735449385 598442291 /nfs/dbraw/zinc/44/22/91/598442291.db2.gz PQSRKEFSLSZHIW-ACCUITESSA-N -1 3 367.840 3.582 20 0 FHADHM CC(=CC(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1)c1ccccc1Cl ZINC000735449385 598442292 /nfs/dbraw/zinc/44/22/92/598442292.db2.gz PQSRKEFSLSZHIW-ACCUITESSA-N -1 3 367.840 3.582 20 0 FHADHM C[C@H](NC(=O)C[C@H]1C[C@@H](C)CC(C)(C)C1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736229482 598442448 /nfs/dbraw/zinc/44/24/48/598442448.db2.gz QZDUASJHZMOFHW-QLFBSQMISA-N -1 3 355.486 3.896 20 0 FHADHM C[C@H](NC(=O)C[C@H]1C[C@@H](C)CC(C)(C)C1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736229482 598442450 /nfs/dbraw/zinc/44/24/50/598442450.db2.gz QZDUASJHZMOFHW-QLFBSQMISA-N -1 3 355.486 3.896 20 0 FHADHM CC(=CC(=O)OCc1cc(-c2nnn[n-]2)ccc1F)c1ccccc1Cl ZINC000735448121 598474128 /nfs/dbraw/zinc/47/41/28/598474128.db2.gz PIZPCLBOQNZTMI-FLIBITNWSA-N -1 3 372.787 3.806 20 0 FHADHM CC(=CC(=O)OCc1cc(-c2nn[n-]n2)ccc1F)c1ccccc1Cl ZINC000735448121 598474130 /nfs/dbraw/zinc/47/41/30/598474130.db2.gz PIZPCLBOQNZTMI-FLIBITNWSA-N -1 3 372.787 3.806 20 0 FHADHM CCCc1nc(C)c(C(=O)O[C@H](C)c2cccc(-c3nnn[n-]3)c2)s1 ZINC000736495186 598484956 /nfs/dbraw/zinc/48/49/56/598484956.db2.gz JLAGUUJCAVXZRD-LLVKDONJSA-N -1 3 357.439 3.502 20 0 FHADHM CCCc1nc(C)c(C(=O)O[C@H](C)c2cccc(-c3nn[n-]n3)c2)s1 ZINC000736495186 598484958 /nfs/dbraw/zinc/48/49/58/598484958.db2.gz JLAGUUJCAVXZRD-LLVKDONJSA-N -1 3 357.439 3.502 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)Cc1nc(C)c2ccccc2n1 ZINC000736480098 598486752 /nfs/dbraw/zinc/48/67/52/598486752.db2.gz KFQVJWQKUKNKEW-UHFFFAOYSA-N -1 3 373.464 3.531 20 0 FHADHM Cc1cccc(OCCCC(=O)O[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000737402267 598487175 /nfs/dbraw/zinc/48/71/75/598487175.db2.gz UMHWHQAOFNJULV-OAHLLOKOSA-N -1 3 366.421 3.639 20 0 FHADHM Cc1cccc(OCCCC(=O)O[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000737402267 598487177 /nfs/dbraw/zinc/48/71/77/598487177.db2.gz UMHWHQAOFNJULV-OAHLLOKOSA-N -1 3 366.421 3.639 20 0 FHADHM Cc1[nH]c2ccccc2c1CC(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000737200473 598488178 /nfs/dbraw/zinc/48/81/78/598488178.db2.gz UPBFSNDZYZMPFJ-CYBMUJFWSA-N -1 3 361.405 3.503 20 0 FHADHM Cc1[nH]c2ccccc2c1CC(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000737200473 598488180 /nfs/dbraw/zinc/48/81/80/598488180.db2.gz UPBFSNDZYZMPFJ-CYBMUJFWSA-N -1 3 361.405 3.503 20 0 FHADHM C[C@H](NC(=O)C[C@@H]1CCCc2ccccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000736102029 598493249 /nfs/dbraw/zinc/49/32/49/598493249.db2.gz QBXRTIKZZNJDJP-KSSFIOAISA-N -1 3 361.449 3.554 20 0 FHADHM C[C@H](NC(=O)C[C@@H]1CCCc2ccccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000736102029 598493250 /nfs/dbraw/zinc/49/32/50/598493250.db2.gz QBXRTIKZZNJDJP-KSSFIOAISA-N -1 3 361.449 3.554 20 0 FHADHM O=C(NCC1CCC(c2ccccc2)CC1)c1cccc(-c2nnn[n-]2)c1 ZINC000738044289 598495335 /nfs/dbraw/zinc/49/53/35/598495335.db2.gz JFXSTKBUBBJUJF-UHFFFAOYSA-N -1 3 361.449 3.571 20 0 FHADHM O=C(NCC1CCC(c2ccccc2)CC1)c1cccc(-c2nn[n-]n2)c1 ZINC000738044289 598495336 /nfs/dbraw/zinc/49/53/36/598495336.db2.gz JFXSTKBUBBJUJF-UHFFFAOYSA-N -1 3 361.449 3.571 20 0 FHADHM COc1ccc(CCCNc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1OC ZINC000737088631 598507925 /nfs/dbraw/zinc/50/79/25/598507925.db2.gz NLUOHOYKBOJEFX-UHFFFAOYSA-N -1 3 373.844 3.582 20 0 FHADHM COc1ccc(CCCNc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1OC ZINC000737088631 598507926 /nfs/dbraw/zinc/50/79/26/598507926.db2.gz NLUOHOYKBOJEFX-UHFFFAOYSA-N -1 3 373.844 3.582 20 0 FHADHM COc1ccccc1[C@@H](NCc1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000737149694 598512203 /nfs/dbraw/zinc/51/22/03/598512203.db2.gz YQSXEPDCIKPZRF-NRFANRHFSA-N -1 3 371.444 3.755 20 0 FHADHM CCCCS[C@H](C)C(=O)Nc1sc(C)c(CC)c1-c1nnn[n-]1 ZINC000736462388 598513447 /nfs/dbraw/zinc/51/34/47/598513447.db2.gz FBEDUEOPCPROQX-SNVBAGLBSA-N -1 3 353.517 3.659 20 0 FHADHM CCCCS[C@H](C)C(=O)Nc1sc(C)c(CC)c1-c1nn[n-]n1 ZINC000736462388 598513449 /nfs/dbraw/zinc/51/34/49/598513449.db2.gz FBEDUEOPCPROQX-SNVBAGLBSA-N -1 3 353.517 3.659 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@@H]1NC(=S)Nc1ccccc1-c1nnn[n-]1 ZINC000735796796 598513557 /nfs/dbraw/zinc/51/35/57/598513557.db2.gz IISRYOZEXBAYAA-ZFWWWQNUSA-N -1 3 358.515 3.758 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@@H]1NC(=S)Nc1ccccc1-c1nn[n-]n1 ZINC000735796796 598513558 /nfs/dbraw/zinc/51/35/58/598513558.db2.gz IISRYOZEXBAYAA-ZFWWWQNUSA-N -1 3 358.515 3.758 20 0 FHADHM CCc1c(C)sc(NC(=O)CCc2ccccc2F)c1-c1nnn[n-]1 ZINC000736672094 598516736 /nfs/dbraw/zinc/51/67/36/598516736.db2.gz YCCLBMNKKBQSSY-UHFFFAOYSA-N -1 3 359.430 3.509 20 0 FHADHM CCc1c(C)sc(NC(=O)CCc2ccccc2F)c1-c1nn[n-]n1 ZINC000736672094 598516737 /nfs/dbraw/zinc/51/67/37/598516737.db2.gz YCCLBMNKKBQSSY-UHFFFAOYSA-N -1 3 359.430 3.509 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccc3c(c2)CCCC3)c1-c1nnn[n-]1 ZINC000736676431 598517395 /nfs/dbraw/zinc/51/73/95/598517395.db2.gz UZBQTCMCYIMHGI-UHFFFAOYSA-N -1 3 367.478 3.930 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccc3c(c2)CCCC3)c1-c1nn[n-]n1 ZINC000736676431 598517396 /nfs/dbraw/zinc/51/73/96/598517396.db2.gz UZBQTCMCYIMHGI-UHFFFAOYSA-N -1 3 367.478 3.930 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@@H]1NC(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1 ZINC000735798556 598528318 /nfs/dbraw/zinc/52/83/18/598528318.db2.gz XPYPFMIKZIXGQF-WMZOPIPTSA-N -1 3 370.501 3.613 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@@H]1NC(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1 ZINC000735798556 598528319 /nfs/dbraw/zinc/52/83/19/598528319.db2.gz XPYPFMIKZIXGQF-WMZOPIPTSA-N -1 3 370.501 3.613 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)O[C@H]1CCc2ccc(Cl)cc21 ZINC000737799044 598538147 /nfs/dbraw/zinc/53/81/47/598538147.db2.gz ITKMTIMNVRRBRK-JEZWAEDTSA-N -1 3 366.808 3.764 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)O[C@H]1CCc2ccc(Cl)cc21 ZINC000737799044 598538149 /nfs/dbraw/zinc/53/81/49/598538149.db2.gz ITKMTIMNVRRBRK-JEZWAEDTSA-N -1 3 366.808 3.764 20 0 FHADHM Fc1cc(OCc2cc3ccccc3nc2Cl)ccc1-c1nnn[n-]1 ZINC000737648805 598550487 /nfs/dbraw/zinc/55/04/87/598550487.db2.gz BYSWPQINEIQODC-UHFFFAOYSA-N -1 3 355.760 3.786 20 0 FHADHM Fc1cc(OCc2cc3ccccc3nc2Cl)ccc1-c1nn[n-]n1 ZINC000737648805 598550488 /nfs/dbraw/zinc/55/04/88/598550488.db2.gz BYSWPQINEIQODC-UHFFFAOYSA-N -1 3 355.760 3.786 20 0 FHADHM Fc1cc(OCc2c(Cl)ccc3cccnc32)ccc1-c1nnn[n-]1 ZINC000737648670 598550498 /nfs/dbraw/zinc/55/04/98/598550498.db2.gz BFXWNQSMJGJTMO-UHFFFAOYSA-N -1 3 355.760 3.786 20 0 FHADHM Fc1cc(OCc2c(Cl)ccc3cccnc32)ccc1-c1nn[n-]n1 ZINC000737648670 598550500 /nfs/dbraw/zinc/55/05/00/598550500.db2.gz BFXWNQSMJGJTMO-UHFFFAOYSA-N -1 3 355.760 3.786 20 0 FHADHM CCCCNC(=S)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736461854 598551537 /nfs/dbraw/zinc/55/15/37/598551537.db2.gz UZCKVNSDLVMNSI-UHFFFAOYSA-N -1 3 368.466 3.746 20 0 FHADHM CCCCNC(=S)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736461854 598551538 /nfs/dbraw/zinc/55/15/38/598551538.db2.gz UZCKVNSDLVMNSI-UHFFFAOYSA-N -1 3 368.466 3.746 20 0 FHADHM O=C(C=Cc1ccco1)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000737806045 598555503 /nfs/dbraw/zinc/55/55/03/598555503.db2.gz KVODFNIPAJLGLZ-KHPPLWFESA-N -1 3 373.372 3.904 20 0 FHADHM O=C(C=Cc1ccco1)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000737806045 598555505 /nfs/dbraw/zinc/55/55/05/598555505.db2.gz KVODFNIPAJLGLZ-KHPPLWFESA-N -1 3 373.372 3.904 20 0 FHADHM O=C(NCC1CCC1)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000738044303 598565709 /nfs/dbraw/zinc/56/57/09/598565709.db2.gz JICAUJXULSOCIT-UHFFFAOYSA-N -1 3 364.409 3.581 20 0 FHADHM O=C(NCC1CCC1)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000738044303 598565711 /nfs/dbraw/zinc/56/57/11/598565711.db2.gz JICAUJXULSOCIT-UHFFFAOYSA-N -1 3 364.409 3.581 20 0 FHADHM CCOc1ccccc1CNc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000736653099 598576359 /nfs/dbraw/zinc/57/63/59/598576359.db2.gz GFCLJRYMFILVDQ-UHFFFAOYSA-N -1 3 363.343 3.896 20 0 FHADHM CCOc1ccccc1CNc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000736653099 598576361 /nfs/dbraw/zinc/57/63/61/598576361.db2.gz GFCLJRYMFILVDQ-UHFFFAOYSA-N -1 3 363.343 3.896 20 0 FHADHM FC(F)(F)c1cc(N[C@@H]2CCN(c3ccccc3)C2)ccc1-c1nnn[n-]1 ZINC000737633844 598580812 /nfs/dbraw/zinc/58/08/12/598580812.db2.gz WWYARVBVXXFYQQ-CYBMUJFWSA-N -1 3 374.370 3.576 20 0 FHADHM FC(F)(F)c1cc(N[C@@H]2CCN(c3ccccc3)C2)ccc1-c1nn[n-]n1 ZINC000737633844 598580814 /nfs/dbraw/zinc/58/08/14/598580814.db2.gz WWYARVBVXXFYQQ-CYBMUJFWSA-N -1 3 374.370 3.576 20 0 FHADHM O=C(CCCCCc1cccs1)OCc1ccc(F)cc1-c1nnn[n-]1 ZINC000737823857 598583749 /nfs/dbraw/zinc/58/37/49/598583749.db2.gz BYDYXRMKTPMZOZ-UHFFFAOYSA-N -1 3 374.441 3.914 20 0 FHADHM O=C(CCCCCc1cccs1)OCc1ccc(F)cc1-c1nn[n-]n1 ZINC000737823857 598583751 /nfs/dbraw/zinc/58/37/51/598583751.db2.gz BYDYXRMKTPMZOZ-UHFFFAOYSA-N -1 3 374.441 3.914 20 0 FHADHM Cc1c2cc(Cl)ccc2oc1C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000737209277 598589195 /nfs/dbraw/zinc/58/91/95/598589195.db2.gz LXNIUOPLJSNQQK-UHFFFAOYSA-N -1 3 371.759 3.966 20 0 FHADHM Cc1c2cc(Cl)ccc2oc1C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000737209277 598589196 /nfs/dbraw/zinc/58/91/96/598589196.db2.gz LXNIUOPLJSNQQK-UHFFFAOYSA-N -1 3 371.759 3.966 20 0 FHADHM CC[C@H](C)c1ccc(NC(=O)CNc2ccc(F)c(-c3nnn[n-]3)c2)cc1 ZINC000736329649 598603369 /nfs/dbraw/zinc/60/33/69/598603369.db2.gz UKVMXYKAEAELIY-LBPRGKRZSA-N -1 3 368.416 3.570 20 0 FHADHM CC[C@H](C)c1ccc(NC(=O)CNc2ccc(F)c(-c3nn[n-]n3)c2)cc1 ZINC000736329649 598603371 /nfs/dbraw/zinc/60/33/71/598603371.db2.gz UKVMXYKAEAELIY-LBPRGKRZSA-N -1 3 368.416 3.570 20 0 FHADHM Cc1ccc([C@H]2CCCN2C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)cc1 ZINC000737333067 598631521 /nfs/dbraw/zinc/63/15/21/598631521.db2.gz RHDUASOJGGNNJE-QGZVFWFLSA-N -1 3 366.400 3.683 20 0 FHADHM Cc1ccc([C@H]2CCCN2C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)cc1 ZINC000737333067 598631522 /nfs/dbraw/zinc/63/15/22/598631522.db2.gz RHDUASOJGGNNJE-QGZVFWFLSA-N -1 3 366.400 3.683 20 0 FHADHM Cc1ccc([C@@H](NC(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)C2CC2)cc1 ZINC000737320102 598632337 /nfs/dbraw/zinc/63/23/37/598632337.db2.gz NLVCDWRFAIENBO-QGZVFWFLSA-N -1 3 366.400 3.587 20 0 FHADHM Cc1ccc([C@@H](NC(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)C2CC2)cc1 ZINC000737320102 598632339 /nfs/dbraw/zinc/63/23/39/598632339.db2.gz NLVCDWRFAIENBO-QGZVFWFLSA-N -1 3 366.400 3.587 20 0 FHADHM CCC[C@H](NC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccccc1 ZINC000736431463 598633946 /nfs/dbraw/zinc/63/39/46/598633946.db2.gz HIHKPCQWSQNTOC-INIZCTEOSA-N -1 3 354.389 3.669 20 0 FHADHM CCC[C@H](NC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccccc1 ZINC000736431463 598633947 /nfs/dbraw/zinc/63/39/47/598633947.db2.gz HIHKPCQWSQNTOC-INIZCTEOSA-N -1 3 354.389 3.669 20 0 FHADHM Cc1cc(NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)ccc1F ZINC000737273430 598646096 /nfs/dbraw/zinc/64/60/96/598646096.db2.gz CTXXYKLJQCVSCA-UHFFFAOYSA-N -1 3 362.821 3.777 20 0 FHADHM Cc1cc(NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)ccc1F ZINC000737273430 598646098 /nfs/dbraw/zinc/64/60/98/598646098.db2.gz CTXXYKLJQCVSCA-UHFFFAOYSA-N -1 3 362.821 3.777 20 0 FHADHM CC(C)(C)c1ccccc1NC(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000735652827 598646579 /nfs/dbraw/zinc/64/65/79/598646579.db2.gz SSBDRZUOIGDVHL-UHFFFAOYSA-N -1 3 367.478 3.895 20 0 FHADHM CC(C)(C)c1ccccc1NC(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000735652827 598646581 /nfs/dbraw/zinc/64/65/81/598646581.db2.gz SSBDRZUOIGDVHL-UHFFFAOYSA-N -1 3 367.478 3.895 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1ccc(C)c(Cl)c1 ZINC000736481792 598652310 /nfs/dbraw/zinc/65/23/10/598652310.db2.gz VARUBFMEQJRBQM-UHFFFAOYSA-N -1 3 369.856 3.881 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1ccc(C)c(Cl)c1 ZINC000736481792 598652313 /nfs/dbraw/zinc/65/23/13/598652313.db2.gz VARUBFMEQJRBQM-UHFFFAOYSA-N -1 3 369.856 3.881 20 0 FHADHM C[C@H](Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccc2c(c1)CCC(=O)N2 ZINC000736137947 598652931 /nfs/dbraw/zinc/65/29/31/598652931.db2.gz MPYRYMJDHYHVFH-JTQLQIEISA-N -1 3 368.828 3.578 20 0 FHADHM C[C@H](Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccc2c(c1)CCC(=O)N2 ZINC000736137947 598652933 /nfs/dbraw/zinc/65/29/33/598652933.db2.gz MPYRYMJDHYHVFH-JTQLQIEISA-N -1 3 368.828 3.578 20 0 FHADHM Clc1cc(NCc2cc(Br)cs2)ccc1-c1nnn[n-]1 ZINC000737565774 598653388 /nfs/dbraw/zinc/65/33/88/598653388.db2.gz QRHRMMCGRHTYGQ-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM Clc1cc(NCc2cc(Br)cs2)ccc1-c1nn[n-]n1 ZINC000737565774 598653390 /nfs/dbraw/zinc/65/33/90/598653390.db2.gz QRHRMMCGRHTYGQ-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM Cc1cc([C@H](C)NC(=O)CSc2ccc(-c3nnn[n-]3)cc2)c(C)s1 ZINC000737244699 598653656 /nfs/dbraw/zinc/65/36/56/598653656.db2.gz KEVRQPCRHPECGF-NSHDSACASA-N -1 3 373.507 3.515 20 0 FHADHM Cc1cc([C@H](C)NC(=O)CSc2ccc(-c3nn[n-]n3)cc2)c(C)s1 ZINC000737244699 598653658 /nfs/dbraw/zinc/65/36/58/598653658.db2.gz KEVRQPCRHPECGF-NSHDSACASA-N -1 3 373.507 3.515 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)C[C@@H](C)c2ccccc2OC)s1 ZINC000736679070 598654991 /nfs/dbraw/zinc/65/49/91/598654991.db2.gz JVFMPEIDTIFSSS-LLVKDONJSA-N -1 3 371.466 3.632 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)C[C@@H](C)c2ccccc2OC)s1 ZINC000736679070 598654993 /nfs/dbraw/zinc/65/49/93/598654993.db2.gz JVFMPEIDTIFSSS-LLVKDONJSA-N -1 3 371.466 3.632 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)C[C@@H](c1ccccc1)C(C)C ZINC000737060029 598657432 /nfs/dbraw/zinc/65/74/32/598657432.db2.gz ZEQNHAVABFRFPJ-MRXNPFEDSA-N -1 3 365.437 3.644 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)C[C@@H](c1ccccc1)C(C)C ZINC000737060029 598657434 /nfs/dbraw/zinc/65/74/34/598657434.db2.gz ZEQNHAVABFRFPJ-MRXNPFEDSA-N -1 3 365.437 3.644 20 0 FHADHM Fc1ccc(N2CC[C@@H](CNc3ccc(-c4nnn[n-]4)c(Cl)c3)C2)cc1 ZINC000737660195 598658244 /nfs/dbraw/zinc/65/82/44/598658244.db2.gz ORUQMJAUUJCXJX-LBPRGKRZSA-N -1 3 372.835 3.598 20 0 FHADHM Fc1ccc(N2CC[C@@H](CNc3ccc(-c4nn[n-]n4)c(Cl)c3)C2)cc1 ZINC000737660195 598658246 /nfs/dbraw/zinc/65/82/46/598658246.db2.gz ORUQMJAUUJCXJX-LBPRGKRZSA-N -1 3 372.835 3.598 20 0 FHADHM Cc1ccc(OCc2ccc(F)cc2-c2nnn[n-]2)c(Br)c1 ZINC000737364729 598674767 /nfs/dbraw/zinc/67/47/67/598674767.db2.gz DMODPTYHHGZYND-UHFFFAOYSA-N -1 3 363.190 3.656 20 0 FHADHM Cc1ccc(OCc2ccc(F)cc2-c2nn[n-]n2)c(Br)c1 ZINC000737364729 598674768 /nfs/dbraw/zinc/67/47/68/598674768.db2.gz DMODPTYHHGZYND-UHFFFAOYSA-N -1 3 363.190 3.656 20 0 FHADHM CC(C)c1ccccc1OCCNc1ncc(-c2nnn[n-]2)cc1Cl ZINC000735932657 598681135 /nfs/dbraw/zinc/68/11/35/598681135.db2.gz OWQDRDUXEITPSE-UHFFFAOYSA-N -1 3 358.833 3.529 20 0 FHADHM CC(C)c1ccccc1OCCNc1ncc(-c2nn[n-]n2)cc1Cl ZINC000735932657 598681136 /nfs/dbraw/zinc/68/11/36/598681136.db2.gz OWQDRDUXEITPSE-UHFFFAOYSA-N -1 3 358.833 3.529 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)Nc1ccnc(-c2ccccc2)c1 ZINC000737802106 598697697 /nfs/dbraw/zinc/69/76/97/598697697.db2.gz OPFKZMHZBNRYPT-KHPPLWFESA-N -1 3 368.400 3.581 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)Nc1ccnc(-c2ccccc2)c1 ZINC000737802106 598697699 /nfs/dbraw/zinc/69/76/99/598697699.db2.gz OPFKZMHZBNRYPT-KHPPLWFESA-N -1 3 368.400 3.581 20 0 FHADHM Cc1cc(F)ccc1N(Cc1ccno1)Cc1cccc(-c2nnn[n-]2)c1 ZINC000737270601 598704082 /nfs/dbraw/zinc/70/40/82/598704082.db2.gz MZYWPFIZHYSOJN-UHFFFAOYSA-N -1 3 364.384 3.509 20 0 FHADHM Cc1cc(F)ccc1N(Cc1ccno1)Cc1cccc(-c2nn[n-]n2)c1 ZINC000737270601 598704084 /nfs/dbraw/zinc/70/40/84/598704084.db2.gz MZYWPFIZHYSOJN-UHFFFAOYSA-N -1 3 364.384 3.509 20 0 FHADHM CCC[C@@H](C(=O)OCc1ccc(F)cc1-c1nnn[n-]1)c1ccccc1 ZINC000736416925 598704448 /nfs/dbraw/zinc/70/44/48/598704448.db2.gz PCPSVEQSXNQPQW-MRXNPFEDSA-N -1 3 354.385 3.633 20 0 FHADHM CCC[C@@H](C(=O)OCc1ccc(F)cc1-c1nn[n-]n1)c1ccccc1 ZINC000736416925 598704450 /nfs/dbraw/zinc/70/44/50/598704450.db2.gz PCPSVEQSXNQPQW-MRXNPFEDSA-N -1 3 354.385 3.633 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nnn[n-]1)c1csc2ccccc12 ZINC000738234899 598707250 /nfs/dbraw/zinc/70/72/50/598707250.db2.gz GYSWGQSYCOBDEE-UHFFFAOYSA-N -1 3 354.366 3.578 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nn[n-]n1)c1csc2ccccc12 ZINC000738234899 598707252 /nfs/dbraw/zinc/70/72/52/598707252.db2.gz GYSWGQSYCOBDEE-UHFFFAOYSA-N -1 3 354.366 3.578 20 0 FHADHM CC(C)(C(=O)OCc1ccc(F)cc1-c1nnn[n-]1)c1ccc(Cl)cc1 ZINC000735583438 598709239 /nfs/dbraw/zinc/70/92/39/598709239.db2.gz YVMTWFIYJJQALI-UHFFFAOYSA-N -1 3 374.803 3.680 20 0 FHADHM CC(C)(C(=O)OCc1ccc(F)cc1-c1nn[n-]n1)c1ccc(Cl)cc1 ZINC000735583438 598709241 /nfs/dbraw/zinc/70/92/41/598709241.db2.gz YVMTWFIYJJQALI-UHFFFAOYSA-N -1 3 374.803 3.680 20 0 FHADHM CC(C)[C@H](CC(=O)OCc1ccccc1-c1nnn[n-]1)c1ccccc1 ZINC000735708142 598712039 /nfs/dbraw/zinc/71/20/39/598712039.db2.gz KGLKLCIQPGGGJN-SFHVURJKSA-N -1 3 350.422 3.740 20 0 FHADHM CC(C)[C@H](CC(=O)OCc1ccccc1-c1nn[n-]n1)c1ccccc1 ZINC000735708142 598712040 /nfs/dbraw/zinc/71/20/40/598712040.db2.gz KGLKLCIQPGGGJN-SFHVURJKSA-N -1 3 350.422 3.740 20 0 FHADHM CC(C)[C@@H](CC(=O)OCc1ccccc1-c1nnn[n-]1)c1ccccc1 ZINC000735708140 598712472 /nfs/dbraw/zinc/71/24/72/598712472.db2.gz KGLKLCIQPGGGJN-GOSISDBHSA-N -1 3 350.422 3.740 20 0 FHADHM CC(C)[C@@H](CC(=O)OCc1ccccc1-c1nn[n-]n1)c1ccccc1 ZINC000735708140 598712474 /nfs/dbraw/zinc/71/24/74/598712474.db2.gz KGLKLCIQPGGGJN-GOSISDBHSA-N -1 3 350.422 3.740 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)N1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000738152423 598716367 /nfs/dbraw/zinc/71/63/67/598716367.db2.gz SNSKIVVTJDQNHV-CQSZACIVSA-N -1 3 368.828 3.542 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)N1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000738152423 598716369 /nfs/dbraw/zinc/71/63/69/598716369.db2.gz SNSKIVVTJDQNHV-CQSZACIVSA-N -1 3 368.828 3.542 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)Nc1ccc(F)c(C)c1 ZINC000736481565 598717790 /nfs/dbraw/zinc/71/77/90/598717790.db2.gz QYZBWAVWIIYINW-UHFFFAOYSA-N -1 3 368.416 3.758 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)Nc1ccc(F)c(C)c1 ZINC000736481565 598717791 /nfs/dbraw/zinc/71/77/91/598717791.db2.gz QYZBWAVWIIYINW-UHFFFAOYSA-N -1 3 368.416 3.758 20 0 FHADHM Cc1cc(NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)ccc1F ZINC000737273885 598718281 /nfs/dbraw/zinc/71/82/81/598718281.db2.gz IOFAGQHYMPVLIK-UHFFFAOYSA-N -1 3 366.400 3.511 20 0 FHADHM Cc1cc(NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)ccc1F ZINC000737273885 598718283 /nfs/dbraw/zinc/71/82/83/598718283.db2.gz IOFAGQHYMPVLIK-UHFFFAOYSA-N -1 3 366.400 3.511 20 0 FHADHM Clc1ccccc1-c1nnc(SCc2ccccc2-c2nnn[n-]2)o1 ZINC000737576635 598718801 /nfs/dbraw/zinc/71/88/01/598718801.db2.gz ZVKHAXCRQQVNAC-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1ccccc1-c1nnc(SCc2ccccc2-c2nn[n-]n2)o1 ZINC000737576635 598718802 /nfs/dbraw/zinc/71/88/02/598718802.db2.gz ZVKHAXCRQQVNAC-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM CCc1cccc(OC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)c1 ZINC000736700450 598734060 /nfs/dbraw/zinc/73/40/60/598734060.db2.gz SCHHTQQVAUJSDH-UHFFFAOYSA-N -1 3 366.421 3.584 20 0 FHADHM CCc1cccc(OC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)c1 ZINC000736700450 598734062 /nfs/dbraw/zinc/73/40/62/598734062.db2.gz SCHHTQQVAUJSDH-UHFFFAOYSA-N -1 3 366.421 3.584 20 0 FHADHM Cc1ccccc1CCC(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCC2 ZINC000737425836 598735251 /nfs/dbraw/zinc/73/52/51/598735251.db2.gz DYBQMZHDBHTUFP-UHFFFAOYSA-N -1 3 367.478 3.687 20 0 FHADHM Cc1ccccc1CCC(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCC2 ZINC000737425836 598735252 /nfs/dbraw/zinc/73/52/52/598735252.db2.gz DYBQMZHDBHTUFP-UHFFFAOYSA-N -1 3 367.478 3.687 20 0 FHADHM CCc1c(C)sc(NC(=O)CCc2ccccc2C)c1-c1nnn[n-]1 ZINC000736669326 598737488 /nfs/dbraw/zinc/73/74/88/598737488.db2.gz DSFJUFZCEIKTEA-UHFFFAOYSA-N -1 3 355.467 3.679 20 0 FHADHM CCc1c(C)sc(NC(=O)CCc2ccccc2C)c1-c1nn[n-]n1 ZINC000736669326 598737489 /nfs/dbraw/zinc/73/74/89/598737489.db2.gz DSFJUFZCEIKTEA-UHFFFAOYSA-N -1 3 355.467 3.679 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)C[C@H]2CCc3ccccc3C2)s1 ZINC000736678679 598741721 /nfs/dbraw/zinc/74/17/21/598741721.db2.gz DRPIALNLXCGYLE-LBPRGKRZSA-N -1 3 367.478 3.624 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)C[C@H]2CCc3ccccc3C2)s1 ZINC000736678679 598741723 /nfs/dbraw/zinc/74/17/23/598741723.db2.gz DRPIALNLXCGYLE-LBPRGKRZSA-N -1 3 367.478 3.624 20 0 FHADHM CC(C)Sc1ccc([C@@H](C)NC(=O)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000735920988 598743456 /nfs/dbraw/zinc/74/34/56/598743456.db2.gz DLIWWFDLCLGPFV-CYBMUJFWSA-N -1 3 367.478 3.858 20 0 FHADHM CC(C)Sc1ccc([C@@H](C)NC(=O)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000735920988 598743458 /nfs/dbraw/zinc/74/34/58/598743458.db2.gz DLIWWFDLCLGPFV-CYBMUJFWSA-N -1 3 367.478 3.858 20 0 FHADHM COCCSc1ccc([C@H](C)Nc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000737014813 598755737 /nfs/dbraw/zinc/75/57/37/598755737.db2.gz RWOVHZIGFXWKQI-ZDUSSCGKSA-N -1 3 355.467 3.778 20 0 FHADHM Cc1ccccc1[C@H](NC(=O)Nc1cccc(-c2nnn[n-]2)c1)C(C)C ZINC000737418484 598757564 /nfs/dbraw/zinc/75/75/64/598757564.db2.gz BGBUCOKRUWMKRW-QGZVFWFLSA-N -1 3 350.426 3.694 20 0 FHADHM Cc1ccccc1[C@H](NC(=O)Nc1cccc(-c2nn[n-]n2)c1)C(C)C ZINC000737418484 598757565 /nfs/dbraw/zinc/75/75/65/598757565.db2.gz BGBUCOKRUWMKRW-QGZVFWFLSA-N -1 3 350.426 3.694 20 0 FHADHM Cc1ccccc1CN(C)c1c(-c2nnn[n-]2)cnc2c(F)cc(F)cc21 ZINC000737427817 598770557 /nfs/dbraw/zinc/77/05/57/598770557.db2.gz FUMQERJGMLCWQM-UHFFFAOYSA-N -1 3 366.375 3.638 20 0 FHADHM Cc1ccccc1CN(C)c1c(-c2nn[n-]n2)cnc2c(F)cc(F)cc21 ZINC000737427817 598770559 /nfs/dbraw/zinc/77/05/59/598770559.db2.gz FUMQERJGMLCWQM-UHFFFAOYSA-N -1 3 366.375 3.638 20 0 FHADHM Cc1ccc(CNc2c(-c3nnn[n-]3)cnc3c(F)cc(F)cc32)cc1 ZINC000737342252 598770716 /nfs/dbraw/zinc/77/07/16/598770716.db2.gz NQGIOVVXOILWMC-UHFFFAOYSA-N -1 3 352.348 3.614 20 0 FHADHM Cc1ccc(CNc2c(-c3nn[n-]n3)cnc3c(F)cc(F)cc32)cc1 ZINC000737342252 598770719 /nfs/dbraw/zinc/77/07/19/598770719.db2.gz NQGIOVVXOILWMC-UHFFFAOYSA-N -1 3 352.348 3.614 20 0 FHADHM Cc1ccc(CNc2c(-c3nnn[n-]3)cnc3c(F)cc(F)cc32)cc1F ZINC000737341324 598770745 /nfs/dbraw/zinc/77/07/45/598770745.db2.gz FZKPBUMDBZZEKX-UHFFFAOYSA-N -1 3 370.338 3.753 20 0 FHADHM Cc1ccc(CNc2c(-c3nn[n-]n3)cnc3c(F)cc(F)cc32)cc1F ZINC000737341324 598770746 /nfs/dbraw/zinc/77/07/46/598770746.db2.gz FZKPBUMDBZZEKX-UHFFFAOYSA-N -1 3 370.338 3.753 20 0 FHADHM Fc1ccc(F)c(CNc2c(-c3nnn[n-]3)cnc3c(F)cc(F)cc32)c1 ZINC000737658623 598772388 /nfs/dbraw/zinc/77/23/88/598772388.db2.gz FCHMCXRECVWAHQ-UHFFFAOYSA-N -1 3 374.301 3.583 20 0 FHADHM Fc1ccc(F)c(CNc2c(-c3nn[n-]n3)cnc3c(F)cc(F)cc32)c1 ZINC000737658623 598772390 /nfs/dbraw/zinc/77/23/90/598772390.db2.gz FCHMCXRECVWAHQ-UHFFFAOYSA-N -1 3 374.301 3.583 20 0 FHADHM CC(C)(C(=O)OCc1ccccc1-c1nnn[n-]1)c1ccccc1Cl ZINC000735583376 598778477 /nfs/dbraw/zinc/77/84/77/598778477.db2.gz XTDIAOHXFMDTDT-UHFFFAOYSA-N -1 3 356.813 3.541 20 0 FHADHM CC(C)(C(=O)OCc1ccccc1-c1nn[n-]n1)c1ccccc1Cl ZINC000735583376 598778478 /nfs/dbraw/zinc/77/84/78/598778478.db2.gz XTDIAOHXFMDTDT-UHFFFAOYSA-N -1 3 356.813 3.541 20 0 FHADHM CC(C)(C(=O)OCc1cc(-c2nnn[n-]2)ccc1F)c1ccccc1Cl ZINC000735583005 598778601 /nfs/dbraw/zinc/77/86/01/598778601.db2.gz RWVCFVDYFIEJSA-UHFFFAOYSA-N -1 3 374.803 3.680 20 0 FHADHM CC(C)(C(=O)OCc1cc(-c2nn[n-]n2)ccc1F)c1ccccc1Cl ZINC000735583005 598778603 /nfs/dbraw/zinc/77/86/03/598778603.db2.gz RWVCFVDYFIEJSA-UHFFFAOYSA-N -1 3 374.803 3.680 20 0 FHADHM Cc1ccccc1[C@H](NC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)C1CC1 ZINC000737418514 598782750 /nfs/dbraw/zinc/78/27/50/598782750.db2.gz BRSOABBXSZKJQB-QGZVFWFLSA-N -1 3 366.400 3.587 20 0 FHADHM Cc1ccccc1[C@H](NC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)C1CC1 ZINC000737418514 598782751 /nfs/dbraw/zinc/78/27/51/598782751.db2.gz BRSOABBXSZKJQB-QGZVFWFLSA-N -1 3 366.400 3.587 20 0 FHADHM CC(C)(C)NC(=S)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000735622954 598788345 /nfs/dbraw/zinc/78/83/45/598788345.db2.gz JGWXGHGZVXIHTJ-UHFFFAOYSA-N -1 3 368.466 3.744 20 0 FHADHM CC(C)(C)NC(=S)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735622954 598788347 /nfs/dbraw/zinc/78/83/47/598788347.db2.gz JGWXGHGZVXIHTJ-UHFFFAOYSA-N -1 3 368.466 3.744 20 0 FHADHM Clc1ccc(NCc2ccccc2Br)c(-c2nnn[n-]2)c1 ZINC000737576247 598794951 /nfs/dbraw/zinc/79/49/51/598794951.db2.gz ZUTMGNCBVXGLTQ-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM Clc1ccc(NCc2ccccc2Br)c(-c2nn[n-]n2)c1 ZINC000737576247 598794952 /nfs/dbraw/zinc/79/49/52/598794952.db2.gz ZUTMGNCBVXGLTQ-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM CC(C)n1cc([C@H](C)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)cn1 ZINC000736140396 598815970 /nfs/dbraw/zinc/81/59/70/598815970.db2.gz VMFROYAOVQXJJN-JTQLQIEISA-N -1 3 365.363 3.836 20 0 FHADHM CC(C)n1cc([C@H](C)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)cn1 ZINC000736140396 598815972 /nfs/dbraw/zinc/81/59/72/598815972.db2.gz VMFROYAOVQXJJN-JTQLQIEISA-N -1 3 365.363 3.836 20 0 FHADHM CCN(c1ncccc1-c1nnn[n-]1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000736564937 598816725 /nfs/dbraw/zinc/81/67/25/598816725.db2.gz PHOFYOXDLSHMTK-NSHDSACASA-N -1 3 362.359 3.868 20 0 FHADHM CCN(c1ncccc1-c1nn[n-]n1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000736564937 598816726 /nfs/dbraw/zinc/81/67/26/598816726.db2.gz PHOFYOXDLSHMTK-NSHDSACASA-N -1 3 362.359 3.868 20 0 FHADHM CCC/C=C/C(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736440016 598821226 /nfs/dbraw/zinc/82/12/26/598821226.db2.gz WZMYRRPPLGLVJJ-XBXARRHUSA-N -1 3 363.421 3.741 20 0 FHADHM CCC/C=C/C(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736440016 598821227 /nfs/dbraw/zinc/82/12/27/598821227.db2.gz WZMYRRPPLGLVJJ-XBXARRHUSA-N -1 3 363.421 3.741 20 0 FHADHM Cc1occc1C(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737556042 598821599 /nfs/dbraw/zinc/82/15/99/598821599.db2.gz CUHGODMUEZBFNI-UHFFFAOYSA-N -1 3 361.361 3.813 20 0 FHADHM Cc1occc1C(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737556042 598821601 /nfs/dbraw/zinc/82/16/01/598821601.db2.gz CUHGODMUEZBFNI-UHFFFAOYSA-N -1 3 361.361 3.813 20 0 FHADHM Cc1ccoc1C(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737441509 598821836 /nfs/dbraw/zinc/82/18/36/598821836.db2.gz GMOKXOBDRPLKKT-UHFFFAOYSA-N -1 3 361.361 3.813 20 0 FHADHM Cc1ccoc1C(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737441509 598821837 /nfs/dbraw/zinc/82/18/37/598821837.db2.gz GMOKXOBDRPLKKT-UHFFFAOYSA-N -1 3 361.361 3.813 20 0 FHADHM CC(C)[C@H](c1ccccc1Cl)N(C)C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000735733959 598823044 /nfs/dbraw/zinc/82/30/44/598823044.db2.gz DHMLZDPIBGFPTE-QGZVFWFLSA-N -1 3 369.856 3.989 20 0 FHADHM CC(C)[C@H](c1ccccc1Cl)N(C)C(=O)c1cccc(-c2nn[n-]n2)c1 ZINC000735733959 598823045 /nfs/dbraw/zinc/82/30/45/598823045.db2.gz DHMLZDPIBGFPTE-QGZVFWFLSA-N -1 3 369.856 3.989 20 0 FHADHM CCC[C@@H](CC)NC(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000821015556 599293759 /nfs/dbraw/zinc/29/37/59/599293759.db2.gz QMOMIIMWUIXBIN-SECBINFHSA-N -1 3 356.352 3.586 20 0 FHADHM CCC[C@@H](CC)NC(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000821015556 599293761 /nfs/dbraw/zinc/29/37/61/599293761.db2.gz QMOMIIMWUIXBIN-SECBINFHSA-N -1 3 356.352 3.586 20 0 FHADHM CCCCNC(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1 ZINC000821072616 599300006 /nfs/dbraw/zinc/30/00/06/599300006.db2.gz UXJCEWQZCKYHBA-UHFFFAOYSA-N -1 3 370.388 3.720 20 0 FHADHM CCCCNC(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1 ZINC000821072616 599300008 /nfs/dbraw/zinc/30/00/08/599300008.db2.gz UXJCEWQZCKYHBA-UHFFFAOYSA-N -1 3 370.388 3.720 20 0 FHADHM Cc1nc(-c2ccccc2)ccc1C(=O)N(C)c1ccc(-c2nnn[n-]2)cc1 ZINC000737462953 599306070 /nfs/dbraw/zinc/30/60/70/599306070.db2.gz BHOLHVUGQRQDLG-UHFFFAOYSA-N -1 3 370.416 3.514 20 0 FHADHM Cc1nc(-c2ccccc2)ccc1C(=O)N(C)c1ccc(-c2nn[n-]n2)cc1 ZINC000737462953 599306073 /nfs/dbraw/zinc/30/60/73/599306073.db2.gz BHOLHVUGQRQDLG-UHFFFAOYSA-N -1 3 370.416 3.514 20 0 FHADHM c1cc(Oc2ccc(-c3nn[n-]n3)cc2)cc(-c2nc(CC3CC3)no2)c1 ZINC000823762201 599310753 /nfs/dbraw/zinc/31/07/53/599310753.db2.gz MINWMYBHSTVONI-UHFFFAOYSA-N -1 3 360.377 3.662 20 0 FHADHM CCN(C(=O)c1cc2c(s1)CC[C@@H](C)C2)c1ccc(-c2nnn[n-]2)cc1 ZINC000736505481 599313928 /nfs/dbraw/zinc/31/39/28/599313928.db2.gz JYLNUUNFJZGMKK-GFCCVEGCSA-N -1 3 367.478 3.720 20 0 FHADHM CCN(C(=O)c1cc2c(s1)CC[C@@H](C)C2)c1ccc(-c2nn[n-]n2)cc1 ZINC000736505481 599313930 /nfs/dbraw/zinc/31/39/30/599313930.db2.gz JYLNUUNFJZGMKK-GFCCVEGCSA-N -1 3 367.478 3.720 20 0 FHADHM COc1cc(OC)c(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1Cl ZINC000737052019 599324463 /nfs/dbraw/zinc/32/44/63/599324463.db2.gz PCPJPGBAVIHZNF-SNVBAGLBSA-N -1 3 359.817 3.710 20 0 FHADHM COc1cc(OC)c(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1Cl ZINC000737052019 599324466 /nfs/dbraw/zinc/32/44/66/599324466.db2.gz PCPJPGBAVIHZNF-SNVBAGLBSA-N -1 3 359.817 3.710 20 0 FHADHM CC(=O)Nc1cccc(CS[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000735489126 599324916 /nfs/dbraw/zinc/32/49/16/599324916.db2.gz WYOJINXMJPUVQB-LBPRGKRZSA-N -1 3 353.451 3.820 20 0 FHADHM CC(=O)Nc1cccc(CS[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735489126 599324919 /nfs/dbraw/zinc/32/49/19/599324919.db2.gz WYOJINXMJPUVQB-LBPRGKRZSA-N -1 3 353.451 3.820 20 0 FHADHM C[C@H](SCc1noc(-c2ccsc2)n1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736192815 599325539 /nfs/dbraw/zinc/32/55/39/599325539.db2.gz MNIICCFPRKOODL-JTQLQIEISA-N -1 3 370.463 3.973 20 0 FHADHM C[C@H](SCc1noc(-c2ccsc2)n1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736192815 599325543 /nfs/dbraw/zinc/32/55/43/599325543.db2.gz MNIICCFPRKOODL-JTQLQIEISA-N -1 3 370.463 3.973 20 0 FHADHM CCCCC[C@@H](C)NC(=O)CS[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736440520 599328603 /nfs/dbraw/zinc/32/86/03/599328603.db2.gz CQBZUUXHOVJTBO-ZIAGYGMSSA-N -1 3 361.515 3.746 20 0 FHADHM CCCCC[C@@H](C)NC(=O)CS[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736440520 599328606 /nfs/dbraw/zinc/32/86/06/599328606.db2.gz CQBZUUXHOVJTBO-ZIAGYGMSSA-N -1 3 361.515 3.746 20 0 FHADHM CCN(C(=O)CS[C@H](C)c1ccc(-c2nnn[n-]2)cc1)C1CCCCC1 ZINC000736504458 599331539 /nfs/dbraw/zinc/33/15/39/599331539.db2.gz DSXAULSSOVCXAG-CQSZACIVSA-N -1 3 373.526 3.842 20 0 FHADHM CCN(C(=O)CS[C@H](C)c1ccc(-c2nn[n-]n2)cc1)C1CCCCC1 ZINC000736504458 599331542 /nfs/dbraw/zinc/33/15/42/599331542.db2.gz DSXAULSSOVCXAG-CQSZACIVSA-N -1 3 373.526 3.842 20 0 FHADHM C[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000736240623 599348616 /nfs/dbraw/zinc/34/86/16/599348616.db2.gz VPVQLIGKUDHPDT-IPYPFGDCSA-N -1 3 371.489 3.608 20 0 FHADHM C[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000736240623 599348619 /nfs/dbraw/zinc/34/86/19/599348619.db2.gz VPVQLIGKUDHPDT-IPYPFGDCSA-N -1 3 371.489 3.608 20 0 FHADHM COC(=O)[C@H](Sc1ccccc1-c1nnn[n-]1)c1cccc(Cl)c1 ZINC000821650039 599349899 /nfs/dbraw/zinc/34/98/99/599349899.db2.gz ITYWXEFJQJBQIP-CQSZACIVSA-N -1 3 360.826 3.527 20 0 FHADHM COC(=O)[C@H](Sc1ccccc1-c1nn[n-]n1)c1cccc(Cl)c1 ZINC000821650039 599349902 /nfs/dbraw/zinc/34/99/02/599349902.db2.gz ITYWXEFJQJBQIP-CQSZACIVSA-N -1 3 360.826 3.527 20 0 FHADHM Fc1c(F)c(F)c(CSc2ccccc2-c2nnn[n-]2)c(F)c1F ZINC000822737502 599350824 /nfs/dbraw/zinc/35/08/24/599350824.db2.gz XUJSZOMBSVFMPC-UHFFFAOYSA-N -1 3 358.295 3.855 20 0 FHADHM Fc1c(F)c(F)c(CSc2ccccc2-c2nn[n-]n2)c(F)c1F ZINC000822737502 599350826 /nfs/dbraw/zinc/35/08/26/599350826.db2.gz XUJSZOMBSVFMPC-UHFFFAOYSA-N -1 3 358.295 3.855 20 0 FHADHM C[C@@H](N[C@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ncc(-c2ccccc2)o1 ZINC000820414563 599366816 /nfs/dbraw/zinc/36/68/16/599366816.db2.gz ZFDIDDSRTZNANI-ZIAGYGMSSA-N -1 3 360.421 3.934 20 0 FHADHM C[C@H](Nc1ccc(OC[C@H]2CCCO2)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820455162 599369177 /nfs/dbraw/zinc/36/91/77/599369177.db2.gz FRLHXUSEWMJICC-IFXJQAMLSA-N -1 3 365.437 3.598 20 0 FHADHM C[C@H](Nc1ccc(OC[C@H]2CCCO2)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820455162 599369179 /nfs/dbraw/zinc/36/91/79/599369179.db2.gz FRLHXUSEWMJICC-IFXJQAMLSA-N -1 3 365.437 3.598 20 0 FHADHM Cc1cccc(Cl)c1OC(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000737397037 599376935 /nfs/dbraw/zinc/37/69/35/599376935.db2.gz RURBIPVNYWMZIB-UHFFFAOYSA-N -1 3 374.853 3.667 20 0 FHADHM Cc1cccc(Cl)c1OC(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000737397037 599376938 /nfs/dbraw/zinc/37/69/38/599376938.db2.gz RURBIPVNYWMZIB-UHFFFAOYSA-N -1 3 374.853 3.667 20 0 FHADHM Cc1ccnc(-c2ccc(N[C@H](C)c3ccc(-c4nnn[n-]4)cc3)cc2)n1 ZINC000822373961 599378973 /nfs/dbraw/zinc/37/89/73/599378973.db2.gz GUXPEHMQQCANCB-CQSZACIVSA-N -1 3 357.421 3.805 20 0 FHADHM Cc1ccnc(-c2ccc(N[C@H](C)c3ccc(-c4nn[n-]n4)cc3)cc2)n1 ZINC000822373961 599378975 /nfs/dbraw/zinc/37/89/75/599378975.db2.gz GUXPEHMQQCANCB-CQSZACIVSA-N -1 3 357.421 3.805 20 0 FHADHM CCCC(=O)Nc1ccc(CNc2cc(Cl)ccc2-c2nnn[n-]2)cc1 ZINC000736416918 599409983 /nfs/dbraw/zinc/40/99/83/599409983.db2.gz PATGGICYUNKRNI-UHFFFAOYSA-N -1 3 370.844 3.871 20 0 FHADHM CCCC(=O)Nc1ccc(CNc2cc(Cl)ccc2-c2nn[n-]n2)cc1 ZINC000736416918 599409984 /nfs/dbraw/zinc/40/99/84/599409984.db2.gz PATGGICYUNKRNI-UHFFFAOYSA-N -1 3 370.844 3.871 20 0 FHADHM CCOc1ccccc1[C@@H](C)Nc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000736654277 599419788 /nfs/dbraw/zinc/41/97/88/599419788.db2.gz ISXVULQZLOJJRV-CYBMUJFWSA-N -1 3 360.421 3.987 20 0 FHADHM CCOc1ccccc1[C@@H](C)Nc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000736654277 599419791 /nfs/dbraw/zinc/41/97/91/599419791.db2.gz ISXVULQZLOJJRV-CYBMUJFWSA-N -1 3 360.421 3.987 20 0 FHADHM C[C@@H]1C[C@H](c2ccccc2)CN1c1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000736235034 599438733 /nfs/dbraw/zinc/43/87/33/599438733.db2.gz LNONLOIXTUQAKS-ZBFHGGJFSA-N -1 3 356.433 3.797 20 0 FHADHM C[C@@H]1C[C@H](c2ccccc2)CN1c1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000736235034 599438735 /nfs/dbraw/zinc/43/87/35/599438735.db2.gz LNONLOIXTUQAKS-ZBFHGGJFSA-N -1 3 356.433 3.797 20 0 FHADHM c1ccc2c(c1)nc(NCCOC1CCCCCC1)cc2-c1nnn[n-]1 ZINC000738433970 599442148 /nfs/dbraw/zinc/44/21/48/599442148.db2.gz XRFNBYYQABZVCP-UHFFFAOYSA-N -1 3 352.442 3.566 20 0 FHADHM c1ccc2c(c1)nc(NCCOC1CCCCCC1)cc2-c1nn[n-]n1 ZINC000738433970 599442151 /nfs/dbraw/zinc/44/21/51/599442151.db2.gz XRFNBYYQABZVCP-UHFFFAOYSA-N -1 3 352.442 3.566 20 0 FHADHM COc1ccc(CNc2cccc(Cl)c2OC(C)C)cc1-c1nnn[n-]1 ZINC000821821592 599442895 /nfs/dbraw/zinc/44/28/95/599442895.db2.gz MLOIVLFZSJCSHM-UHFFFAOYSA-N -1 3 373.844 3.928 20 0 FHADHM COc1ccc(CNc2cccc(Cl)c2OC(C)C)cc1-c1nn[n-]n1 ZINC000821821592 599442897 /nfs/dbraw/zinc/44/28/97/599442897.db2.gz MLOIVLFZSJCSHM-UHFFFAOYSA-N -1 3 373.844 3.928 20 0 FHADHM CCCCc1noc([C@@H](C)SCc2ccc(-c3nnn[n-]3)cc2F)n1 ZINC000736466481 599451637 /nfs/dbraw/zinc/45/16/37/599451637.db2.gz KKDHBZSRMZKMKN-SNVBAGLBSA-N -1 3 362.434 3.726 20 0 FHADHM CCCCc1noc([C@@H](C)SCc2ccc(-c3nn[n-]n3)cc2F)n1 ZINC000736466481 599451640 /nfs/dbraw/zinc/45/16/40/599451640.db2.gz KKDHBZSRMZKMKN-SNVBAGLBSA-N -1 3 362.434 3.726 20 0 FHADHM C[C@H](Nc1ccc(F)cc1-c1nnn[n-]1)c1ccc(NC(=O)C2CC2)cc1 ZINC000820455501 599469107 /nfs/dbraw/zinc/46/91/07/599469107.db2.gz IZLNCSWTXOZRDA-NSHDSACASA-N -1 3 366.400 3.527 20 0 FHADHM C[C@H](Nc1ccc(F)cc1-c1nn[n-]n1)c1ccc(NC(=O)C2CC2)cc1 ZINC000820455501 599469110 /nfs/dbraw/zinc/46/91/10/599469110.db2.gz IZLNCSWTXOZRDA-NSHDSACASA-N -1 3 366.400 3.527 20 0 FHADHM CCCN(Cc1ccccc1)C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821109222 599471386 /nfs/dbraw/zinc/47/13/86/599471386.db2.gz DAUYYVQWAXSWSR-OAHLLOKOSA-N -1 3 364.453 3.550 20 0 FHADHM CCCN(Cc1ccccc1)C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821109222 599471389 /nfs/dbraw/zinc/47/13/89/599471389.db2.gz DAUYYVQWAXSWSR-OAHLLOKOSA-N -1 3 364.453 3.550 20 0 FHADHM C[C@@H]1C[C@H](c2ccc(F)cc2)CN1c1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000736238728 599474132 /nfs/dbraw/zinc/47/41/32/599474132.db2.gz ZSPHGNHRUOGTES-HIFRSBDPSA-N -1 3 374.423 3.936 20 0 FHADHM C[C@@H]1C[C@H](c2ccc(F)cc2)CN1c1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000736238728 599474135 /nfs/dbraw/zinc/47/41/35/599474135.db2.gz ZSPHGNHRUOGTES-HIFRSBDPSA-N -1 3 374.423 3.936 20 0 FHADHM C[C@H]1C[C@H](c2ccc(F)cc2)CN1c1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000736238730 599474400 /nfs/dbraw/zinc/47/44/00/599474400.db2.gz ZSPHGNHRUOGTES-ZFWWWQNUSA-N -1 3 374.423 3.936 20 0 FHADHM C[C@H]1C[C@H](c2ccc(F)cc2)CN1c1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000736238730 599474403 /nfs/dbraw/zinc/47/44/03/599474403.db2.gz ZSPHGNHRUOGTES-ZFWWWQNUSA-N -1 3 374.423 3.936 20 0 FHADHM C[C@H](NC(=O)N1CCC[C@H]1c1ccsc1)c1cccc(-c2nnn[n-]2)c1 ZINC000820348178 599478030 /nfs/dbraw/zinc/47/80/30/599478030.db2.gz ASFSNKQBYXXOLP-LRDDRELGSA-N -1 3 368.466 3.536 20 0 FHADHM C[C@H](NC(=O)N1CCC[C@H]1c1ccsc1)c1cccc(-c2nn[n-]n2)c1 ZINC000820348178 599478032 /nfs/dbraw/zinc/47/80/32/599478032.db2.gz ASFSNKQBYXXOLP-LRDDRELGSA-N -1 3 368.466 3.536 20 0 FHADHM CCC[C@@H](NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)C1CCCCC1 ZINC000821020952 599484169 /nfs/dbraw/zinc/48/41/69/599484169.db2.gz KENNKKZRDWLKDF-KBXCAEBGSA-N -1 3 370.501 3.976 20 0 FHADHM CCC[C@@H](NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)C1CCCCC1 ZINC000821020952 599484171 /nfs/dbraw/zinc/48/41/71/599484171.db2.gz KENNKKZRDWLKDF-KBXCAEBGSA-N -1 3 370.501 3.976 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1NCCCOCCc1ccccc1 ZINC000822582886 599486245 /nfs/dbraw/zinc/48/62/45/599486245.db2.gz ZTRJDUIMZGFDAH-UHFFFAOYSA-N -1 3 357.845 3.581 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1NCCCOCCc1ccccc1 ZINC000822582886 599486246 /nfs/dbraw/zinc/48/62/46/599486246.db2.gz ZTRJDUIMZGFDAH-UHFFFAOYSA-N -1 3 357.845 3.581 20 0 FHADHM C[C@@H](C[C@H](O)c1ccc(F)cc1)Nc1ccc(Cl)cc1-c1nnn[n-]1 ZINC000820232149 607381457 /nfs/dbraw/zinc/38/14/57/607381457.db2.gz FCOBGOFULKQQFF-QFYYESIMSA-N -1 3 361.808 3.583 20 0 FHADHM C[C@@H](C[C@H](O)c1ccc(F)cc1)Nc1ccc(Cl)cc1-c1nn[n-]n1 ZINC000820232149 607381460 /nfs/dbraw/zinc/38/14/60/607381460.db2.gz FCOBGOFULKQQFF-QFYYESIMSA-N -1 3 361.808 3.583 20 0 FHADHM Cc1cccc(COC(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)n1 ZINC000737397569 599497103 /nfs/dbraw/zinc/49/71/03/599497103.db2.gz YCLABKMMBKZRAB-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM Cc1cccc(COC(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)n1 ZINC000737397569 599497107 /nfs/dbraw/zinc/49/71/07/599497107.db2.gz YCLABKMMBKZRAB-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM CC(C)(C(=O)OCc1cccc(-c2nnn[n-]2)c1)c1cccc(Cl)c1 ZINC000735582129 599497918 /nfs/dbraw/zinc/49/79/18/599497918.db2.gz GKXRBOBGTOZXBO-UHFFFAOYSA-N -1 3 356.813 3.541 20 0 FHADHM CC(C)(C(=O)OCc1cccc(-c2nn[n-]n2)c1)c1cccc(Cl)c1 ZINC000735582129 599497921 /nfs/dbraw/zinc/49/79/21/599497921.db2.gz GKXRBOBGTOZXBO-UHFFFAOYSA-N -1 3 356.813 3.541 20 0 FHADHM Fc1ccc(NC[C@@H]2CCN(c3ccc(Cl)cc3)C2)c(-c2nnn[n-]2)c1 ZINC000822778809 599499049 /nfs/dbraw/zinc/49/90/49/599499049.db2.gz OACODDCQTFQHIT-LBPRGKRZSA-N -1 3 372.835 3.598 20 0 FHADHM Fc1ccc(NC[C@@H]2CCN(c3ccc(Cl)cc3)C2)c(-c2nn[n-]n2)c1 ZINC000822778809 599499052 /nfs/dbraw/zinc/49/90/52/599499052.db2.gz OACODDCQTFQHIT-LBPRGKRZSA-N -1 3 372.835 3.598 20 0 FHADHM CCC(=CC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(C)cc1 ZINC000820832775 599500319 /nfs/dbraw/zinc/50/03/19/599500319.db2.gz NPKMHRLSPFOWIY-XERWBJCMSA-N -1 3 361.449 3.846 20 0 FHADHM CCC(=CC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(C)cc1 ZINC000820832775 599500321 /nfs/dbraw/zinc/50/03/21/599500321.db2.gz NPKMHRLSPFOWIY-XERWBJCMSA-N -1 3 361.449 3.846 20 0 FHADHM C[C@H](NC(=O)c1cc2sccc2s1)c1cccc(-c2nnn[n-]2)c1 ZINC000820391769 599501626 /nfs/dbraw/zinc/50/16/26/599501626.db2.gz QJKVKZCEPKQFHM-VIFPVBQESA-N -1 3 355.448 3.634 20 0 FHADHM C[C@H](NC(=O)c1cc2sccc2s1)c1cccc(-c2nn[n-]n2)c1 ZINC000820391769 599501628 /nfs/dbraw/zinc/50/16/28/599501628.db2.gz QJKVKZCEPKQFHM-VIFPVBQESA-N -1 3 355.448 3.634 20 0 FHADHM Cc1cc(Oc2ccc(-c3nnn[n-]3)cc2)ccc1NC(=O)N(C)C1CC1 ZINC000737279653 599502882 /nfs/dbraw/zinc/50/28/82/599502882.db2.gz LCUVPKGARWVMOC-UHFFFAOYSA-N -1 3 364.409 3.594 20 0 FHADHM Cc1cc(Oc2ccc(-c3nn[n-]n3)cc2)ccc1NC(=O)N(C)C1CC1 ZINC000737279653 599502885 /nfs/dbraw/zinc/50/28/85/599502885.db2.gz LCUVPKGARWVMOC-UHFFFAOYSA-N -1 3 364.409 3.594 20 0 FHADHM Cc1ccc(C)c(N[C@@H](C)C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c1 ZINC000737326892 599503090 /nfs/dbraw/zinc/50/30/90/599503090.db2.gz SYDAFAFBJHKEJK-LBPRGKRZSA-N -1 3 370.844 3.576 20 0 FHADHM Cc1ccc(C)c(N[C@@H](C)C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c1 ZINC000737326892 599503091 /nfs/dbraw/zinc/50/30/91/599503091.db2.gz SYDAFAFBJHKEJK-LBPRGKRZSA-N -1 3 370.844 3.576 20 0 FHADHM Cc1csc([C@H]2CCCN(c3cc(Cl)ccc3-c3nnn[n-]3)C2)n1 ZINC000822409323 599509344 /nfs/dbraw/zinc/50/93/44/599509344.db2.gz PWFAXWUBXSIIMF-NSHDSACASA-N -1 3 360.874 3.669 20 0 FHADHM Cc1csc([C@H]2CCCN(c3cc(Cl)ccc3-c3nn[n-]n3)C2)n1 ZINC000822409323 599509346 /nfs/dbraw/zinc/50/93/46/599509346.db2.gz PWFAXWUBXSIIMF-NSHDSACASA-N -1 3 360.874 3.669 20 0 FHADHM Cc1nc([C@H]2CCCN(c3cc(Cl)ccc3-c3nnn[n-]3)C2)sc1C ZINC000822435791 599509584 /nfs/dbraw/zinc/50/95/84/599509584.db2.gz BCMXMISQGYSPCN-LBPRGKRZSA-N -1 3 374.901 3.977 20 0 FHADHM Cc1nc([C@H]2CCCN(c3cc(Cl)ccc3-c3nn[n-]n3)C2)sc1C ZINC000822435791 599509586 /nfs/dbraw/zinc/50/95/86/599509586.db2.gz BCMXMISQGYSPCN-LBPRGKRZSA-N -1 3 374.901 3.977 20 0 FHADHM C[C@H](NC(=O)C[C@@H]1C[C@@H](C)CC(C)(C)C1)c1cccc(-c2nnn[n-]2)c1 ZINC000820655256 599514722 /nfs/dbraw/zinc/51/47/22/599514722.db2.gz ALHHGIMDOQEYAO-ILXRZTDVSA-N -1 3 355.486 3.896 20 0 FHADHM C[C@H](NC(=O)C[C@@H]1C[C@@H](C)CC(C)(C)C1)c1cccc(-c2nn[n-]n2)c1 ZINC000820655256 599514724 /nfs/dbraw/zinc/51/47/24/599514724.db2.gz ALHHGIMDOQEYAO-ILXRZTDVSA-N -1 3 355.486 3.896 20 0 FHADHM C[C@H](NC(=O)C[C@H]1C[C@@H](C)CC(C)(C)C1)c1cccc(-c2nnn[n-]2)c1 ZINC000820655259 599515286 /nfs/dbraw/zinc/51/52/86/599515286.db2.gz ALHHGIMDOQEYAO-QLFBSQMISA-N -1 3 355.486 3.896 20 0 FHADHM C[C@H](NC(=O)C[C@H]1C[C@@H](C)CC(C)(C)C1)c1cccc(-c2nn[n-]n2)c1 ZINC000820655259 599515288 /nfs/dbraw/zinc/51/52/88/599515288.db2.gz ALHHGIMDOQEYAO-QLFBSQMISA-N -1 3 355.486 3.896 20 0 FHADHM CC(=CC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1Cl ZINC000819764146 599520414 /nfs/dbraw/zinc/52/04/14/599520414.db2.gz FWKCPFCTARKSIX-RSKUSDAESA-N -1 3 367.840 3.801 20 0 FHADHM CC(=CC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1Cl ZINC000819764146 599520415 /nfs/dbraw/zinc/52/04/15/599520415.db2.gz FWKCPFCTARKSIX-RSKUSDAESA-N -1 3 367.840 3.801 20 0 FHADHM FC(F)(F)c1cc(-c2nn[n-]n2)ccc1N1CC[C@@H](c2ccccc2)C1 ZINC000737628568 599523187 /nfs/dbraw/zinc/52/31/87/599523187.db2.gz XNBUHNUPYUYWJN-CQSZACIVSA-N -1 3 359.355 3.879 20 0 FHADHM Fc1ccc(CNc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)cc1F ZINC000737651194 599523722 /nfs/dbraw/zinc/52/37/22/599523722.db2.gz USUOTTJQAYPMIM-UHFFFAOYSA-N -1 3 355.270 3.776 20 0 FHADHM COCCSc1ccc([C@@H](C)Nc2ccc(F)cc2-c2nnn[n-]2)cc1 ZINC000821694418 599526270 /nfs/dbraw/zinc/52/62/70/599526270.db2.gz MKIDUOUPVIMDCO-GFCCVEGCSA-N -1 3 373.457 3.917 20 0 FHADHM COCCSc1ccc([C@@H](C)Nc2ccc(F)cc2-c2nn[n-]n2)cc1 ZINC000821694418 599526273 /nfs/dbraw/zinc/52/62/73/599526273.db2.gz MKIDUOUPVIMDCO-GFCCVEGCSA-N -1 3 373.457 3.917 20 0 FHADHM Fc1ccc(N[C@H](c2nccs2)c2ccccc2)c(-c2nnn[n-]2)c1 ZINC000822778176 599527380 /nfs/dbraw/zinc/52/73/80/599527380.db2.gz FFVSSHTZJKEDDM-HNNXBMFYSA-N -1 3 352.398 3.664 20 0 FHADHM Fc1ccc(N[C@H](c2nccs2)c2ccccc2)c(-c2nn[n-]n2)c1 ZINC000822778176 599527382 /nfs/dbraw/zinc/52/73/82/599527382.db2.gz FFVSSHTZJKEDDM-HNNXBMFYSA-N -1 3 352.398 3.664 20 0 FHADHM COc1ccc(C(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c2ccccc12 ZINC000821770032 599535555 /nfs/dbraw/zinc/53/55/55/599535555.db2.gz NQIPYXPMGLXSIV-ZDUSSCGKSA-N -1 3 373.416 3.520 20 0 FHADHM COc1ccc(C(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c2ccccc12 ZINC000821770032 599535557 /nfs/dbraw/zinc/53/55/57/599535557.db2.gz NQIPYXPMGLXSIV-ZDUSSCGKSA-N -1 3 373.416 3.520 20 0 FHADHM CC(C)(NC(=S)Nc1ccccc1-c1nnn[n-]1)c1cccc(Cl)c1 ZINC000735677592 599535779 /nfs/dbraw/zinc/53/57/79/599535779.db2.gz FJYJWGQEIQRDER-UHFFFAOYSA-N -1 3 372.885 3.742 20 0 FHADHM CC(C)(NC(=S)Nc1ccccc1-c1nn[n-]n1)c1cccc(Cl)c1 ZINC000735677592 599535782 /nfs/dbraw/zinc/53/57/82/599535782.db2.gz FJYJWGQEIQRDER-UHFFFAOYSA-N -1 3 372.885 3.742 20 0 FHADHM COc1ccccc1[C@H]1CCN(c2cc(Cl)ccc2-c2nnn[n-]2)C1 ZINC000737146168 599536783 /nfs/dbraw/zinc/53/67/83/599536783.db2.gz HBCFMJUTJOKIBL-LBPRGKRZSA-N -1 3 355.829 3.523 20 0 FHADHM COc1ccccc1[C@H]1CCN(c2cc(Cl)ccc2-c2nn[n-]n2)C1 ZINC000737146168 599536785 /nfs/dbraw/zinc/53/67/85/599536785.db2.gz HBCFMJUTJOKIBL-LBPRGKRZSA-N -1 3 355.829 3.523 20 0 FHADHM CC(C)(C)CCC(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)nc1 ZINC000735604816 599541300 /nfs/dbraw/zinc/54/13/00/599541300.db2.gz ZDPDGNWKNQSMCK-UHFFFAOYSA-N -1 3 366.425 3.819 20 0 FHADHM CC(C)(C)CCC(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)nc1 ZINC000735604816 599541301 /nfs/dbraw/zinc/54/13/01/599541301.db2.gz ZDPDGNWKNQSMCK-UHFFFAOYSA-N -1 3 366.425 3.819 20 0 FHADHM c1ccc(C[C@@H]2CCCN(c3c(-c4nnn[n-]4)cnc4ccccc43)C2)cc1 ZINC000823779522 599543894 /nfs/dbraw/zinc/54/38/94/599543894.db2.gz FPDRESKQGNQDHD-KRWDZBQOSA-N -1 3 370.460 3.874 20 0 FHADHM c1ccc(C[C@@H]2CCCN(c3c(-c4nn[n-]n4)cnc4ccccc43)C2)cc1 ZINC000823779522 599543896 /nfs/dbraw/zinc/54/38/96/599543896.db2.gz FPDRESKQGNQDHD-KRWDZBQOSA-N -1 3 370.460 3.874 20 0 FHADHM CCS[C@@H]1CCCCN(c2c(-c3nnn[n-]3)cnc3ccccc32)C1 ZINC000821455211 599553056 /nfs/dbraw/zinc/55/30/56/599553056.db2.gz IWJNFPIIXHZHSZ-CYBMUJFWSA-N -1 3 354.483 3.527 20 0 FHADHM CCS[C@@H]1CCCCN(c2c(-c3nn[n-]n3)cnc3ccccc32)C1 ZINC000821455211 599553058 /nfs/dbraw/zinc/55/30/58/599553058.db2.gz IWJNFPIIXHZHSZ-CYBMUJFWSA-N -1 3 354.483 3.527 20 0 FHADHM Cc1cccc(NC(=O)c2cccc(Nc3ccc(-c4nn[n-]n4)cc3)c2)n1 ZINC000737400254 599565322 /nfs/dbraw/zinc/56/53/22/599565322.db2.gz RCOQUFDFXUDBLR-UHFFFAOYSA-N -1 3 371.404 3.566 20 0 FHADHM O=C(NCC1CCCC1)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000738044943 599565669 /nfs/dbraw/zinc/56/56/69/599565669.db2.gz NINJQVUEFBSMAY-UHFFFAOYSA-N -1 3 362.437 3.530 20 0 FHADHM Fc1ccc(F)c2c1ncc(-c1nnn[n-]1)c2N1CCC2(CCCC2)CC1 ZINC000822774873 599567800 /nfs/dbraw/zinc/56/78/00/599567800.db2.gz QGXXBCGYEOAJBU-UHFFFAOYSA-N -1 3 370.407 3.854 20 0 FHADHM Fc1ccc(F)c2c1ncc(-c1nn[n-]n1)c2N1CCC2(CCCC2)CC1 ZINC000822774873 599567801 /nfs/dbraw/zinc/56/78/01/599567801.db2.gz QGXXBCGYEOAJBU-UHFFFAOYSA-N -1 3 370.407 3.854 20 0 FHADHM CC(C)(C)[C@H]1CCc2c(sc(NC(=O)C=CC3CC3)c2-c2nn[n-]n2)C1 ZINC000819908203 599629244 /nfs/dbraw/zinc/62/92/44/599629244.db2.gz XUOXVASGUNLFEU-PWWFUAJNSA-N -1 3 371.510 3.984 20 0 FHADHM CC(C)(C)[C@H]1CCc2c(sc(NC(=O)/C=C\C3CC3)c2-c2nn[n-]n2)C1 ZINC000819908203 599629245 /nfs/dbraw/zinc/62/92/45/599629245.db2.gz XUOXVASGUNLFEU-PWWFUAJNSA-N -1 3 371.510 3.984 20 0 FHADHM Cc1cncc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCCCC3)c1 ZINC000822399920 599630932 /nfs/dbraw/zinc/63/09/32/599630932.db2.gz PJLLMLUWPKIWEQ-UHFFFAOYSA-N -1 3 368.466 3.543 20 0 FHADHM Cc1cncc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCCCC3)c1 ZINC000822399920 599630933 /nfs/dbraw/zinc/63/09/33/599630933.db2.gz PJLLMLUWPKIWEQ-UHFFFAOYSA-N -1 3 368.466 3.543 20 0 FHADHM CCCCS[C@@H](C)C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000821077676 599632727 /nfs/dbraw/zinc/63/27/27/599632727.db2.gz PUCDSRYFHVVBJI-VIFPVBQESA-N -1 3 373.404 3.746 20 0 FHADHM CCCCS[C@@H](C)C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000821077676 599632728 /nfs/dbraw/zinc/63/27/28/599632728.db2.gz PUCDSRYFHVVBJI-VIFPVBQESA-N -1 3 373.404 3.746 20 0 FHADHM CCc1ccc(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)cc1 ZINC000821476264 599632745 /nfs/dbraw/zinc/63/27/45/599632745.db2.gz KOPYANUWKLGCMC-UHFFFAOYSA-N -1 3 361.327 3.700 20 0 FHADHM CCc1ccc(C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)cc1 ZINC000821476264 599632746 /nfs/dbraw/zinc/63/27/46/599632746.db2.gz KOPYANUWKLGCMC-UHFFFAOYSA-N -1 3 361.327 3.700 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)c1ccc2c(c1)CCC2 ZINC000823303738 599633430 /nfs/dbraw/zinc/63/34/30/599633430.db2.gz TZXZRQUDQHGRCO-UHFFFAOYSA-N -1 3 373.338 3.627 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)c1ccc2c(c1)CCC2 ZINC000823303738 599633431 /nfs/dbraw/zinc/63/34/31/599633431.db2.gz TZXZRQUDQHGRCO-UHFFFAOYSA-N -1 3 373.338 3.627 20 0 FHADHM Cc1cc(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)ccc1F ZINC000822176478 599633685 /nfs/dbraw/zinc/63/36/85/599633685.db2.gz KJYAFZGPAQBDDD-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM Cc1cc(C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)ccc1F ZINC000822176478 599633686 /nfs/dbraw/zinc/63/36/86/599633686.db2.gz KJYAFZGPAQBDDD-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)c1cc2ccccc2o1 ZINC000823303529 599634063 /nfs/dbraw/zinc/63/40/63/599634063.db2.gz LRYUMBKJMSXAGN-UHFFFAOYSA-N -1 3 373.294 3.884 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)c1cc2ccccc2o1 ZINC000823303529 599634064 /nfs/dbraw/zinc/63/40/64/599634064.db2.gz LRYUMBKJMSXAGN-UHFFFAOYSA-N -1 3 373.294 3.884 20 0 FHADHM CCC(C)(C)CC(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)nc1 ZINC000820847777 599648058 /nfs/dbraw/zinc/64/80/58/599648058.db2.gz LEVKKBFIRULEJA-UHFFFAOYSA-N -1 3 366.425 3.819 20 0 FHADHM CCC(C)(C)CC(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)nc1 ZINC000820847777 599648059 /nfs/dbraw/zinc/64/80/59/599648059.db2.gz LEVKKBFIRULEJA-UHFFFAOYSA-N -1 3 366.425 3.819 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H](C)C1CCCCC1 ZINC000820339426 599675661 /nfs/dbraw/zinc/67/56/61/599675661.db2.gz BYQSKDWGSWQBDZ-HNNXBMFYSA-N -1 3 370.501 3.756 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H](C)C1CCCCC1 ZINC000820339426 599675662 /nfs/dbraw/zinc/67/56/62/599675662.db2.gz BYQSKDWGSWQBDZ-HNNXBMFYSA-N -1 3 370.501 3.756 20 0 FHADHM CC(C)C[C@@H]1CCN(c2c(-c3nnn[n-]3)cnc3c(F)cc(F)cc32)C1 ZINC000820067500 599686235 /nfs/dbraw/zinc/68/62/35/599686235.db2.gz JMVRPPOENJFRQX-NSHDSACASA-N -1 3 358.396 3.566 20 0 FHADHM CC(C)C[C@@H]1CCN(c2c(-c3nn[n-]n3)cnc3c(F)cc(F)cc32)C1 ZINC000820067500 599686236 /nfs/dbraw/zinc/68/62/36/599686236.db2.gz JMVRPPOENJFRQX-NSHDSACASA-N -1 3 358.396 3.566 20 0 FHADHM CC(C)C[C@H]1CCN(c2c(-c3nnn[n-]3)cnc3c(F)ccc(F)c32)C1 ZINC000820068163 599686514 /nfs/dbraw/zinc/68/65/14/599686514.db2.gz OLEXQJWTSJOHCS-LLVKDONJSA-N -1 3 358.396 3.566 20 0 FHADHM CC(C)C[C@H]1CCN(c2c(-c3nn[n-]n3)cnc3c(F)ccc(F)c32)C1 ZINC000820068163 599686515 /nfs/dbraw/zinc/68/65/15/599686515.db2.gz OLEXQJWTSJOHCS-LLVKDONJSA-N -1 3 358.396 3.566 20 0 FHADHM C[C@H](Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1cccc(-n2cccn2)c1 ZINC000820457205 599687041 /nfs/dbraw/zinc/68/70/41/599687041.db2.gz YXALAKZYBCQZRH-LBPRGKRZSA-N -1 3 365.828 3.879 20 0 FHADHM C[C@H](Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1cccc(-n2cccn2)c1 ZINC000820457205 599687042 /nfs/dbraw/zinc/68/70/42/599687042.db2.gz YXALAKZYBCQZRH-LBPRGKRZSA-N -1 3 365.828 3.879 20 0 FHADHM CC[C@H]1C[C@H](C)CN1C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000820966925 599693463 /nfs/dbraw/zinc/69/34/63/599693463.db2.gz IUVPKFPXSHSEKL-ONGXEEELSA-N -1 3 368.363 3.538 20 0 FHADHM CC[C@H]1C[C@H](C)CN1C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000820966925 599693464 /nfs/dbraw/zinc/69/34/64/599693464.db2.gz IUVPKFPXSHSEKL-ONGXEEELSA-N -1 3 368.363 3.538 20 0 FHADHM O=C(Cc1csc2ccc(Cl)cc12)Nc1ccccc1-c1nnn[n-]1 ZINC000826423846 607782663 /nfs/dbraw/zinc/78/26/63/607782663.db2.gz JNWYCUBFGFAVHV-UHFFFAOYSA-N -1 3 369.837 3.916 20 0 FHADHM CN(CCCc1cc(-c2ccc(F)cc2)no1)Cc1ccc(C(=O)[O-])o1 ZINC000737440341 599720495 /nfs/dbraw/zinc/72/04/95/599720495.db2.gz GDWUZGGSIHFYDM-UHFFFAOYSA-N -1 3 358.369 3.837 20 0 FHADHM O=C(Cc1csc2ccc(Cl)cc12)Nc1ccccc1-c1nn[n-]n1 ZINC000826423846 607782664 /nfs/dbraw/zinc/78/26/64/607782664.db2.gz JNWYCUBFGFAVHV-UHFFFAOYSA-N -1 3 369.837 3.916 20 0 FHADHM C[C@@H](c1ccc(C(=O)[O-])o1)N1CCC(C(=O)Nc2ccc(F)cc2)CC1 ZINC000736713427 599786062 /nfs/dbraw/zinc/78/60/62/599786062.db2.gz BLPZYENRMJHEGL-LBPRGKRZSA-N -1 3 360.385 3.529 20 0 FHADHM O=C([O-])[C@H](NCc1cccc(C(=O)Nc2ccccc2)c1)c1ccccc1 ZINC000738511672 599787576 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KPODTIALGMEBHF-HNNXBMFYSA-N -1 3 370.449 3.506 20 0 FHADHM CC(C)C[C@H](NC(=O)[O-])c1noc(C2CCN(Cc3ccccc3)CC2)n1 ZINC000738815028 602410560 /nfs/dbraw/zinc/41/05/60/602410560.db2.gz FKEBUXJQVRAPHU-KRWDZBQOSA-N -1 3 372.469 3.804 20 0 FHADHM O=C(Nc1sccc1-c1nnn[n-]1)c1ccc(Cl)c(C(F)(F)F)c1 ZINC000826461188 607577380 /nfs/dbraw/zinc/57/73/80/607577380.db2.gz JTBMIEULVQNATN-UHFFFAOYSA-N -1 3 373.747 3.853 20 0 FHADHM O=C(Nc1sccc1-c1nn[n-]n1)c1ccc(Cl)c(C(F)(F)F)c1 ZINC000826461188 607577382 /nfs/dbraw/zinc/57/73/82/607577382.db2.gz JTBMIEULVQNATN-UHFFFAOYSA-N -1 3 373.747 3.853 20 0 FHADHM C[C@H](NCC[C@@H]1CCCN(C(=O)[O-])C1)c1nc2ccccc2n1C(F)F ZINC000739037696 602649894 /nfs/dbraw/zinc/64/98/94/602649894.db2.gz YBIVOYOBSZUKIF-STQMWFEESA-N -1 3 366.412 3.862 20 0 FHADHM O=C([O-])Nc1cccc(C(=O)N(CCN2CCCC2)c2ccccc2)c1 ZINC000740026729 603009946 /nfs/dbraw/zinc/00/99/46/603009946.db2.gz AKQIJGHNEQSROV-UHFFFAOYSA-N -1 3 353.422 3.519 20 0 FHADHM CCN(Cc1ccccc1NC(=O)c1cccc(CN(C)C)c1)C(=O)[O-] ZINC000739441671 603088736 /nfs/dbraw/zinc/08/87/36/603088736.db2.gz DOIZYQCTAQOBFI-UHFFFAOYSA-N -1 3 355.438 3.500 20 0 FHADHM C[C@H](NC(=O)[O-])c1ccc(NC(=O)c2cccc(CN3CCCC3)c2)cc1 ZINC000825443186 603187220 /nfs/dbraw/zinc/18/72/20/603187220.db2.gz ZPLXPLWYYMBRKK-HNNXBMFYSA-N -1 3 367.449 3.863 20 0 FHADHM C[C@@H]1CCN(C(=O)c2cccc(NC(=O)[O-])c2)CCN1Cc1ccccc1 ZINC000825945186 603227934 /nfs/dbraw/zinc/22/79/34/603227934.db2.gz URHPZKKWRVNCLE-MRXNPFEDSA-N -1 3 367.449 3.513 20 0 FHADHM CC[C@H](SC)C(=O)OCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000825159103 607635200 /nfs/dbraw/zinc/63/52/00/607635200.db2.gz IWLSVAVGGXFJSD-KRWDZBQOSA-N -1 3 368.462 3.719 20 0 FHADHM CC[C@H](SC)C(=O)OCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000825159103 607635202 /nfs/dbraw/zinc/63/52/02/607635202.db2.gz IWLSVAVGGXFJSD-KRWDZBQOSA-N -1 3 368.462 3.719 20 0 FHADHM C[C@H](NCc1ccc(NC(=O)[O-])nc1)[C@H](O)c1c(Cl)cccc1Cl ZINC000825503839 603559249 /nfs/dbraw/zinc/55/92/49/603559249.db2.gz XYFWUKDNHHDDIK-VFZGTOFNSA-N -1 3 370.236 3.690 20 0 FHADHM C[C@@H](NCc1ccc(NC(=O)[O-])nc1)[C@H](O)c1c(Cl)cccc1Cl ZINC000825503837 603559807 /nfs/dbraw/zinc/55/98/07/603559807.db2.gz XYFWUKDNHHDDIK-PSLIRLAXSA-N -1 3 370.236 3.690 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1ccc(-c2nccs2)cc1 ZINC000826250108 607654037 /nfs/dbraw/zinc/65/40/37/607654037.db2.gz LDCCYUUYJIMYGM-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1ccc(-c2nccs2)cc1 ZINC000826250108 607654038 /nfs/dbraw/zinc/65/40/38/607654038.db2.gz LDCCYUUYJIMYGM-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N(Cc1ccc(Cl)cc1)C1CC1 ZINC000826244009 607660173 /nfs/dbraw/zinc/66/01/73/607660173.db2.gz DQNUJMJXRYTZIG-UHFFFAOYSA-N -1 3 367.840 3.633 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N(Cc1ccc(Cl)cc1)C1CC1 ZINC000826244009 607660175 /nfs/dbraw/zinc/66/01/75/607660175.db2.gz DQNUJMJXRYTZIG-UHFFFAOYSA-N -1 3 367.840 3.633 20 0 FHADHM CC[C@@H](C)Oc1ccc(NC(=O)c2ccc(-c3nnn[n-]3)cc2C)cc1 ZINC000825074339 607669660 /nfs/dbraw/zinc/66/96/60/607669660.db2.gz GPZBOJFJBSNAHV-CYBMUJFWSA-N -1 3 351.410 3.605 20 0 FHADHM CC[C@@H](C)Oc1ccc(NC(=O)c2ccc(-c3nn[n-]n3)cc2C)cc1 ZINC000825074339 607669662 /nfs/dbraw/zinc/66/96/62/607669662.db2.gz GPZBOJFJBSNAHV-CYBMUJFWSA-N -1 3 351.410 3.605 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1CCC[C@H](c2ccccc2)CC1 ZINC000826244942 607683219 /nfs/dbraw/zinc/68/32/19/607683219.db2.gz IRJPDPHJTRBZFG-KRWDZBQOSA-N -1 3 361.449 3.585 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1CCC[C@H](c2ccccc2)CC1 ZINC000826244942 607683221 /nfs/dbraw/zinc/68/32/21/607683221.db2.gz IRJPDPHJTRBZFG-KRWDZBQOSA-N -1 3 361.449 3.585 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N[C@@H](C)c1csc2ccccc21 ZINC000826246808 607686324 /nfs/dbraw/zinc/68/63/24/607686324.db2.gz LYBTXWRPWWBMOC-LBPRGKRZSA-N -1 3 363.446 3.881 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N[C@@H](C)c1csc2ccccc21 ZINC000826246808 607686325 /nfs/dbraw/zinc/68/63/25/607686325.db2.gz LYBTXWRPWWBMOC-LBPRGKRZSA-N -1 3 363.446 3.881 20 0 FHADHM Cc1cc([C@@H](C)N2CCC(C(=O)Nc3ccccc3)CC2)oc1C(=O)[O-] ZINC000832871189 604382701 /nfs/dbraw/zinc/38/27/01/604382701.db2.gz QNOFAODSWSZCNF-CQSZACIVSA-N -1 3 356.422 3.698 20 0 FHADHM Cc1cc([C@@H](C)N2CCC(C(=O)Nc3cccc(F)c3)CC2)oc1C(=O)[O-] ZINC000832872166 604385729 /nfs/dbraw/zinc/38/57/29/604385729.db2.gz ZGEYHWBSKOBSDX-CYBMUJFWSA-N -1 3 374.412 3.837 20 0 FHADHM O=C(Nc1ccccc1Sc1ccccc1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC000826457879 607690849 /nfs/dbraw/zinc/69/08/49/607690849.db2.gz UNNFOKOOMYIMKE-UHFFFAOYSA-N -1 3 362.418 3.598 20 0 FHADHM O=C(Nc1ccccc1Sc1ccccc1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC000826457879 607690851 /nfs/dbraw/zinc/69/08/51/607690851.db2.gz UNNFOKOOMYIMKE-UHFFFAOYSA-N -1 3 362.418 3.598 20 0 FHADHM C[C@H](c1ccc(Cl)cc1)N(C)C(=O)CNC1(C(=O)[O-])CCCCCC1 ZINC000833547001 604480804 /nfs/dbraw/zinc/48/08/04/604480804.db2.gz OQFHAPAUDMCREG-CQSZACIVSA-N -1 3 366.889 3.627 20 0 FHADHM CC(=O)N1CC[C@H](N[C@@H](C(=O)[O-])c2cccc(Cl)c2)c2ccccc21 ZINC000833392847 604631731 /nfs/dbraw/zinc/63/17/31/604631731.db2.gz GLONHXKHHJRXFN-FUHWJXTLSA-N -1 3 358.825 3.553 20 0 FHADHM C[C@@H]1Cc2cc(-c3ccc(CN[C@@H](C(=O)[O-])c4cccnc4)cc3)ccc2O1 ZINC000833633038 604631836 /nfs/dbraw/zinc/63/18/36/604631836.db2.gz RQOYEXYJBHWPHH-IVZQSRNASA-N -1 3 374.440 3.988 20 0 FHADHM Cc1cccc(C)c1Oc1ccccc1NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC000826296616 607705799 /nfs/dbraw/zinc/70/57/99/607705799.db2.gz CSXPYVQIRDQEDE-UHFFFAOYSA-N -1 3 374.404 3.856 20 0 FHADHM Cc1cccc(C)c1Oc1ccccc1NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC000826296616 607705800 /nfs/dbraw/zinc/70/58/00/607705800.db2.gz CSXPYVQIRDQEDE-UHFFFAOYSA-N -1 3 374.404 3.856 20 0 FHADHM Cc1coc(-c2ccc(C)c(NC(=O)c3ccc(-c4nnn[n-]4)cc3C)c2)n1 ZINC000826320142 607706778 /nfs/dbraw/zinc/70/67/78/607706778.db2.gz IBVGPJHRRYOPQK-UHFFFAOYSA-N -1 3 374.404 3.699 20 0 FHADHM Cc1coc(-c2ccc(C)c(NC(=O)c3ccc(-c4nn[n-]n4)cc3C)c2)n1 ZINC000826320142 607706779 /nfs/dbraw/zinc/70/67/79/607706779.db2.gz IBVGPJHRRYOPQK-UHFFFAOYSA-N -1 3 374.404 3.699 20 0 FHADHM C[C@H](C(=O)[O-])[C@@H](NC[C@H]1CC(c2ccc(Cl)cc2)=NO1)c1ccccc1 ZINC000833406106 604717008 /nfs/dbraw/zinc/71/70/08/604717008.db2.gz ATGJZWWPDSNRJL-BOFPYLFWSA-N -1 3 372.852 3.885 20 0 FHADHM CC[C@@H](CC(=O)OCc1ccc(-c2nnn[n-]2)cc1)c1ccc(OC)cc1 ZINC000825081847 607715646 /nfs/dbraw/zinc/71/56/46/607715646.db2.gz NMBSVBQCSQDOIA-HNNXBMFYSA-N -1 3 366.421 3.502 20 0 FHADHM CC[C@@H](CC(=O)OCc1ccc(-c2nn[n-]n2)cc1)c1ccc(OC)cc1 ZINC000825081847 607715649 /nfs/dbraw/zinc/71/56/49/607715649.db2.gz NMBSVBQCSQDOIA-HNNXBMFYSA-N -1 3 366.421 3.502 20 0 FHADHM CC(C)(C(=O)[O-])[C@@H]1CCCN(CC(=O)Nc2cccc3ccccc32)C1 ZINC000833420941 604943767 /nfs/dbraw/zinc/94/37/67/604943767.db2.gz CXLZQUZPNUZXBC-MRXNPFEDSA-N -1 3 354.450 3.601 20 0 FHADHM COc1cc([C@@H](C)N[C@H](C(=O)[O-])c2cccnc2)ccc1OCC(C)C ZINC000831956188 604990872 /nfs/dbraw/zinc/99/08/72/604990872.db2.gz RZCOHTNOPLIHNG-KUHUBIRLSA-N -1 3 358.438 3.602 20 0 FHADHM CCOCCC1(CNc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)CC1 ZINC000825589660 607729222 /nfs/dbraw/zinc/72/92/22/607729222.db2.gz IHDQWMPJHSAVLN-UHFFFAOYSA-N -1 3 355.364 3.504 20 0 FHADHM CCOCCC1(CNc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)CC1 ZINC000825589660 607729224 /nfs/dbraw/zinc/72/92/24/607729224.db2.gz IHDQWMPJHSAVLN-UHFFFAOYSA-N -1 3 355.364 3.504 20 0 FHADHM C[C@H](NCc1ccc([C@H](C)NC(=O)[O-])cc1)c1ccc2c(c1)CCC(=O)N2 ZINC000825503880 605118539 /nfs/dbraw/zinc/11/85/39/605118539.db2.gz YZOADYTUJNMOMP-KBPBESRZSA-N -1 3 367.449 3.751 20 0 FHADHM CC(C)(C(=O)[O-])[C@H](NCc1cncc(Br)c1)c1ccccc1 ZINC000833412853 605180095 /nfs/dbraw/zinc/18/00/95/605180095.db2.gz DBPAMIYLHSYYLW-OAHLLOKOSA-N -1 3 363.255 3.786 20 0 FHADHM C[C@@H](c1ccccc1)N(C)C(=O)CN[C@H](c1ccccc1)C(C)(C)C(=O)[O-] ZINC000833548226 605183886 /nfs/dbraw/zinc/18/38/86/605183886.db2.gz JHILTYLHQOYDSZ-OXJNMPFZSA-N -1 3 368.477 3.648 20 0 FHADHM Cc1c(NC(=O)CCOc2ccccc2C(C)C)cccc1-c1nnn[n-]1 ZINC000826241511 607755542 /nfs/dbraw/zinc/75/55/42/607755542.db2.gz GDJDELWVPDWGRB-UHFFFAOYSA-N -1 3 365.437 3.706 20 0 FHADHM Cc1c(NC(=O)CCOc2ccccc2C(C)C)cccc1-c1nn[n-]n1 ZINC000826241511 607755543 /nfs/dbraw/zinc/75/55/43/607755543.db2.gz GDJDELWVPDWGRB-UHFFFAOYSA-N -1 3 365.437 3.706 20 0 FHADHM O=C([O-])N1CCc2cccc(CN3CCC([C@H](O)c4ccccc4)CC3)c21 ZINC000834121712 605469924 /nfs/dbraw/zinc/46/99/24/605469924.db2.gz BXLNVAHJKFOIAC-OAQYLSRUSA-N -1 3 366.461 3.673 20 0 FHADHM O=C(NCC1(C2CC2)CCC1)c1ccccc1-c1ccccc1-c1nnn[n-]1 ZINC000826433469 607762999 /nfs/dbraw/zinc/76/29/99/607762999.db2.gz HHMNAJYISSQRCP-UHFFFAOYSA-N -1 3 373.460 3.844 20 0 FHADHM O=C(NCC1(C2CC2)CCC1)c1ccccc1-c1ccccc1-c1nn[n-]n1 ZINC000826433469 607763000 /nfs/dbraw/zinc/76/30/00/607763000.db2.gz HHMNAJYISSQRCP-UHFFFAOYSA-N -1 3 373.460 3.844 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)N1CC[C@@H]1c1ccc(Cl)cc1 ZINC000826454365 607764666 /nfs/dbraw/zinc/76/46/66/607764666.db2.gz TWOMAKJDLKDXSV-OAHLLOKOSA-N -1 3 372.791 3.638 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)N1CC[C@@H]1c1ccc(Cl)cc1 ZINC000826454365 607764667 /nfs/dbraw/zinc/76/46/67/607764667.db2.gz TWOMAKJDLKDXSV-OAHLLOKOSA-N -1 3 372.791 3.638 20 0 FHADHM COc1ccc2c(c1)CCC[C@H]2N[C@H](C)c1ccc(CNC(=O)[O-])nc1C ZINC000833890366 605597056 /nfs/dbraw/zinc/59/70/56/605597056.db2.gz LBCKCICGJVBCPW-JLTOFOAXSA-N -1 3 369.465 3.894 20 0 FHADHM O=C([O-])N[C@@H]1C[C@H](N[C@@H](c2ccccc2)[C@@H]2CCCO2)c2ccccc21 ZINC000834158246 605797338 /nfs/dbraw/zinc/79/73/38/605797338.db2.gz KRKDGLKBXHHBTI-YRPNKDGESA-N -1 3 352.434 3.950 20 0 FHADHM O=C([O-])N[C@@H]1C[C@H](N[C@H](c2ccccc2)[C@@H]2CCCO2)c2ccccc21 ZINC000834158248 605797573 /nfs/dbraw/zinc/79/75/73/605797573.db2.gz KRKDGLKBXHHBTI-ZGXWSNOMSA-N -1 3 352.434 3.950 20 0 FHADHM COc1cccc2c1CC[C@@H]2N[C@H](C)c1ccc(CNC(=O)[O-])nc1C ZINC000833891948 605989681 /nfs/dbraw/zinc/98/96/81/605989681.db2.gz WWIJLBRXCGNERK-ACJLOTCBSA-N -1 3 355.438 3.504 20 0 FHADHM COc1cccc2c1CC[C@H]2N[C@H](C)c1ccc(CNC(=O)[O-])nc1C ZINC000833891949 605989717 /nfs/dbraw/zinc/98/97/17/605989717.db2.gz WWIJLBRXCGNERK-FZKQIMNGSA-N -1 3 355.438 3.504 20 0 FHADHM O=C([O-])N1CCC[C@@H]1[C@H]1CCC[C@@H]1NCc1coc(-c2ccccc2)n1 ZINC000834108864 605990173 /nfs/dbraw/zinc/99/01/73/605990173.db2.gz RUKLJRVUTQOTAJ-OKZBNKHCSA-N -1 3 355.438 3.742 20 0 FHADHM Cc1ccc(C)c(Oc2ccc(CNc3ccc(-c4nnn[n-]4)nc3)cn2)c1 ZINC000822232184 606045722 /nfs/dbraw/zinc/04/57/22/606045722.db2.gz WCEMULBMKUFHCX-UHFFFAOYSA-N -1 3 373.420 3.678 20 0 FHADHM Cc1ccc(C)c(Oc2ccc(CNc3ccc(-c4nn[n-]n4)nc3)cn2)c1 ZINC000822232184 606045726 /nfs/dbraw/zinc/04/57/26/606045726.db2.gz WCEMULBMKUFHCX-UHFFFAOYSA-N -1 3 373.420 3.678 20 0 FHADHM C[C@@H](Nc1ccc(-c2nnn[n-]2)nc1)c1c(Cl)ccc(F)c1Cl ZINC000820455456 606049885 /nfs/dbraw/zinc/04/98/85/606049885.db2.gz IQKURNDCTCLDRO-SSDOTTSWSA-N -1 3 353.188 3.881 20 0 FHADHM C[C@@H](Nc1ccc(-c2nn[n-]n2)nc1)c1c(Cl)ccc(F)c1Cl ZINC000820455456 606049890 /nfs/dbraw/zinc/04/98/90/606049890.db2.gz IQKURNDCTCLDRO-SSDOTTSWSA-N -1 3 353.188 3.881 20 0 FHADHM c1ccc(COCCCCNc2nc3ccccc3cc2-c2nnn[n-]2)cc1 ZINC000823787757 606066138 /nfs/dbraw/zinc/06/61/38/606066138.db2.gz QBUWRADLPJCAFB-UHFFFAOYSA-N -1 3 374.448 3.824 20 0 FHADHM c1ccc(COCCCCNc2nc3ccccc3cc2-c2nn[n-]n2)cc1 ZINC000823787757 606066141 /nfs/dbraw/zinc/06/61/41/606066141.db2.gz QBUWRADLPJCAFB-UHFFFAOYSA-N -1 3 374.448 3.824 20 0 FHADHM C[C@@H]1CCc2c(sc(NC(=O)[C@@H]3CC34CCCC4)c2-c2nnn[n-]2)C1 ZINC000820727461 606145848 /nfs/dbraw/zinc/14/58/48/606145848.db2.gz MBVZUXKBDDKYFS-PWSUYJOCSA-N -1 3 357.483 3.572 20 0 FHADHM C[C@@H]1CCc2c(sc(NC(=O)[C@@H]3CC34CCCC4)c2-c2nn[n-]n2)C1 ZINC000820727461 606145850 /nfs/dbraw/zinc/14/58/50/606145850.db2.gz MBVZUXKBDDKYFS-PWSUYJOCSA-N -1 3 357.483 3.572 20 0 FHADHM CCc1cnc(CN(C)c2ccc(-c3nn[n-]n3)cc2C(F)(F)F)s1 ZINC000821497708 606164150 /nfs/dbraw/zinc/16/41/50/606164150.db2.gz XNTHTHLWIPVWRW-UHFFFAOYSA-N -1 3 368.388 3.541 20 0 FHADHM C[C@H](NC(=O)c1ccc(OC(C)(C)C)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000820395992 606186099 /nfs/dbraw/zinc/18/60/99/606186099.db2.gz BBASMPLFOGXTLW-ZDUSSCGKSA-N -1 3 365.437 3.535 20 0 FHADHM C[C@H](NC(=O)c1ccc(OC(C)(C)C)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000820395992 606186100 /nfs/dbraw/zinc/18/61/00/606186100.db2.gz BBASMPLFOGXTLW-ZDUSSCGKSA-N -1 3 365.437 3.535 20 0 FHADHM Cc1ccccc1[C@@H](NC(=O)Cc1cccc(-c2nnn[n-]2)c1)C(C)(C)C ZINC000822350649 606190599 /nfs/dbraw/zinc/19/05/99/606190599.db2.gz FUXCWKLUQQUUDC-LJQANCHMSA-N -1 3 363.465 3.621 20 0 FHADHM Cc1ccccc1[C@@H](NC(=O)Cc1cccc(-c2nn[n-]n2)c1)C(C)(C)C ZINC000822350649 606190600 /nfs/dbraw/zinc/19/06/00/606190600.db2.gz FUXCWKLUQQUUDC-LJQANCHMSA-N -1 3 363.465 3.621 20 0 FHADHM c1coc(COCc2cccc(NCc3cc(-c4nnn[n-]4)cs3)c2)c1 ZINC000823751292 606213503 /nfs/dbraw/zinc/21/35/03/606213503.db2.gz DTLYLOYTPCPCOR-UHFFFAOYSA-N -1 3 367.434 3.850 20 0 FHADHM c1coc(COCc2cccc(NCc3cc(-c4nn[n-]n4)cs3)c2)c1 ZINC000823751292 606213505 /nfs/dbraw/zinc/21/35/05/606213505.db2.gz DTLYLOYTPCPCOR-UHFFFAOYSA-N -1 3 367.434 3.850 20 0 FHADHM c1sc(CNc2ccc(COC3CCCC3)cc2)cc1-c1nnn[n-]1 ZINC000823757847 606222159 /nfs/dbraw/zinc/22/21/59/606222159.db2.gz XDFQVRMXNXSNKT-UHFFFAOYSA-N -1 3 355.467 4.000 20 0 FHADHM c1sc(CNc2ccc(COC3CCCC3)cc2)cc1-c1nn[n-]n1 ZINC000823757847 606222161 /nfs/dbraw/zinc/22/21/61/606222161.db2.gz XDFQVRMXNXSNKT-UHFFFAOYSA-N -1 3 355.467 4.000 20 0 FHADHM CC(C)(C)n1ncc2c1CCC[C@H]2Nc1c(F)cc(-c2nnn[n-]2)cc1F ZINC000819975804 606224219 /nfs/dbraw/zinc/22/42/19/606224219.db2.gz DFPGPYAKSXVIBH-CQSZACIVSA-N -1 3 373.411 3.586 20 0 FHADHM CC(C)(C)n1ncc2c1CCC[C@H]2Nc1c(F)cc(-c2nn[n-]n2)cc1F ZINC000819975804 606224221 /nfs/dbraw/zinc/22/42/21/606224221.db2.gz DFPGPYAKSXVIBH-CQSZACIVSA-N -1 3 373.411 3.586 20 0 FHADHM CC(C)[C@H](CNc1cc(-c2nnn[n-]2)nc2ccccc21)c1cccnc1 ZINC000820021506 606228947 /nfs/dbraw/zinc/22/89/47/606228947.db2.gz VRCCOGGBSXYVLA-INIZCTEOSA-N -1 3 359.437 3.662 20 0 FHADHM CC[C@@H](C)Sc1ccc(NC(=O)c2cc(-c3nnn[n-]3)cn2C)c(C)c1 ZINC000820882115 606238503 /nfs/dbraw/zinc/23/85/03/606238503.db2.gz KABMPGPAJKZDSN-GFCCVEGCSA-N -1 3 370.482 3.657 20 0 FHADHM CC[C@@H](C)Sc1ccc(NC(=O)c2cc(-c3nn[n-]n3)cn2C)c(C)c1 ZINC000820882115 606238504 /nfs/dbraw/zinc/23/85/04/606238504.db2.gz KABMPGPAJKZDSN-GFCCVEGCSA-N -1 3 370.482 3.657 20 0 FHADHM O=C(Nc1ccccn1)c1ccc(Sc2ccccc2-c2nnn[n-]2)cc1 ZINC000823372420 606247529 /nfs/dbraw/zinc/24/75/29/606247529.db2.gz CFUSMYFTSXGNCJ-UHFFFAOYSA-N -1 3 374.429 3.665 20 0 FHADHM O=C(Nc1ccccn1)c1ccc(Sc2ccccc2-c2nn[n-]n2)cc1 ZINC000823372420 606247530 /nfs/dbraw/zinc/24/75/30/606247530.db2.gz CFUSMYFTSXGNCJ-UHFFFAOYSA-N -1 3 374.429 3.665 20 0 FHADHM COc1cccc(C(C)=CC(=O)O[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000821859993 606260219 /nfs/dbraw/zinc/26/02/19/606260219.db2.gz VOWUCKNRJJZFEY-FZDNWWAKSA-N -1 3 364.405 3.583 20 0 FHADHM COc1cccc(C(C)=CC(=O)O[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000821859993 606260221 /nfs/dbraw/zinc/26/02/21/606260221.db2.gz VOWUCKNRJJZFEY-FZDNWWAKSA-N -1 3 364.405 3.583 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000823344354 606270796 /nfs/dbraw/zinc/27/07/96/606270796.db2.gz WGQFTNBILDXUCO-IAGOWNOFSA-N -1 3 373.391 3.901 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000823344354 606270799 /nfs/dbraw/zinc/27/07/99/606270799.db2.gz WGQFTNBILDXUCO-IAGOWNOFSA-N -1 3 373.391 3.901 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)[C@H]1C[C@@H]1c1cccc2ccccc21 ZINC000823343721 606272143 /nfs/dbraw/zinc/27/21/43/606272143.db2.gz FHLWDRFBQUGKMU-SJORKVTESA-N -1 3 373.391 3.901 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)[C@H]1C[C@@H]1c1cccc2ccccc21 ZINC000823343721 606272145 /nfs/dbraw/zinc/27/21/45/606272145.db2.gz FHLWDRFBQUGKMU-SJORKVTESA-N -1 3 373.391 3.901 20 0 FHADHM CC(C)(C)NC(=O)c1ccc(Sc2ccccc2-c2nnn[n-]2)cc1 ZINC000819922230 606313218 /nfs/dbraw/zinc/31/32/18/606313218.db2.gz HVJUDWWRQQKWJI-UHFFFAOYSA-N -1 3 353.451 3.546 20 0 FHADHM CC(C)(C)NC(=O)c1ccc(Sc2ccccc2-c2nn[n-]n2)cc1 ZINC000819922230 606313220 /nfs/dbraw/zinc/31/32/20/606313220.db2.gz HVJUDWWRQQKWJI-UHFFFAOYSA-N -1 3 353.451 3.546 20 0 FHADHM CC[C@@H](C)CN(CC)C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820870207 606327630 /nfs/dbraw/zinc/32/76/30/606327630.db2.gz OZQSVHQQBPPWBB-SNVBAGLBSA-N -1 3 352.895 3.585 20 0 FHADHM CC[C@@H](C)CN(CC)C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820870207 606327633 /nfs/dbraw/zinc/32/76/33/606327633.db2.gz OZQSVHQQBPPWBB-SNVBAGLBSA-N -1 3 352.895 3.585 20 0 FHADHM C[C@@H](OC(=O)C(C)(C)c1ccccc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000820480995 606340537 /nfs/dbraw/zinc/34/05/37/606340537.db2.gz RGTAGORFVWKOSD-GFCCVEGCSA-N -1 3 354.385 3.588 20 0 FHADHM C[C@@H](OC(=O)C(C)(C)c1ccccc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000820480995 606340540 /nfs/dbraw/zinc/34/05/40/606340540.db2.gz RGTAGORFVWKOSD-GFCCVEGCSA-N -1 3 354.385 3.588 20 0 FHADHM COc1ccccc1C(C)=CC(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821882706 606341467 /nfs/dbraw/zinc/34/14/67/606341467.db2.gz INYHEXWFKJJMMR-WUFNSSIPSA-N -1 3 364.405 3.583 20 0 FHADHM COc1ccccc1C(C)=CC(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821882706 606341468 /nfs/dbraw/zinc/34/14/68/606341468.db2.gz INYHEXWFKJJMMR-WUFNSSIPSA-N -1 3 364.405 3.583 20 0 FHADHM C[C@@H](OC(=O)c1cc(F)c(F)cc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000820507590 606346053 /nfs/dbraw/zinc/34/60/53/606346053.db2.gz IKRNDBKPADBZSG-MRVPVSSYSA-N -1 3 364.739 3.716 20 0 FHADHM C[C@@H](OC(=O)c1cc(F)c(F)cc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000820507590 606346054 /nfs/dbraw/zinc/34/60/54/606346054.db2.gz IKRNDBKPADBZSG-MRVPVSSYSA-N -1 3 364.739 3.716 20 0 FHADHM Cc1ccccc1[C@@H]1CCCN1C(=O)Nc1ccc(F)cc1-c1nnn[n-]1 ZINC000822352424 606347532 /nfs/dbraw/zinc/34/75/32/606347532.db2.gz ZGCPLXUFEUZZIV-KRWDZBQOSA-N -1 3 366.400 3.683 20 0 FHADHM Cc1ccccc1[C@@H]1CCCN1C(=O)Nc1ccc(F)cc1-c1nn[n-]n1 ZINC000822352424 606347534 /nfs/dbraw/zinc/34/75/34/606347534.db2.gz ZGCPLXUFEUZZIV-KRWDZBQOSA-N -1 3 366.400 3.683 20 0 FHADHM Cc1ccc([C@@H](C)N(C)C(=O)Nc2ccc(F)cc2-c2nnn[n-]2)c(C)c1 ZINC000822228926 606347562 /nfs/dbraw/zinc/34/75/62/606347562.db2.gz IWNZZMMLBJSVFM-CYBMUJFWSA-N -1 3 368.416 3.848 20 0 FHADHM Cc1ccc([C@@H](C)N(C)C(=O)Nc2ccc(F)cc2-c2nn[n-]n2)c(C)c1 ZINC000822228926 606347563 /nfs/dbraw/zinc/34/75/63/606347563.db2.gz IWNZZMMLBJSVFM-CYBMUJFWSA-N -1 3 368.416 3.848 20 0 FHADHM C[C@@H](OC(=O)CCSc1ccccc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000820498182 606349298 /nfs/dbraw/zinc/34/92/98/606349298.db2.gz ZCIKBPUNFAYNQE-GFCCVEGCSA-N -1 3 372.425 3.792 20 0 FHADHM C[C@@H](OC(=O)CCSc1ccccc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000820498182 606349299 /nfs/dbraw/zinc/34/92/99/606349299.db2.gz ZCIKBPUNFAYNQE-GFCCVEGCSA-N -1 3 372.425 3.792 20 0 FHADHM C[C@H](OC(=O)[C@@H]1SCCc2ccccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488144 606350476 /nfs/dbraw/zinc/35/04/76/606350476.db2.gz LOPQJKCFJRCUEZ-YVEFUNNKSA-N -1 3 366.446 3.502 20 0 FHADHM C[C@H](OC(=O)[C@@H]1SCCc2ccccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488144 606350477 /nfs/dbraw/zinc/35/04/77/606350477.db2.gz LOPQJKCFJRCUEZ-YVEFUNNKSA-N -1 3 366.446 3.502 20 0 FHADHM CC(C)[C@H](c1ccccc1)N(C)C(=O)Nc1ccc(F)cc1-c1nnn[n-]1 ZINC000820033926 606353692 /nfs/dbraw/zinc/35/36/92/606353692.db2.gz ZRAAAJAAKBNZGL-QGZVFWFLSA-N -1 3 368.416 3.867 20 0 FHADHM CC(C)[C@H](c1ccccc1)N(C)C(=O)Nc1ccc(F)cc1-c1nn[n-]n1 ZINC000820033926 606353694 /nfs/dbraw/zinc/35/36/94/606353694.db2.gz ZRAAAJAAKBNZGL-QGZVFWFLSA-N -1 3 368.416 3.867 20 0 FHADHM C[C@@H](OC(=O)C[C@H](C)c1cccc(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820225284 606354151 /nfs/dbraw/zinc/35/41/51/606354151.db2.gz FPYLKQPUKOLJRI-QWHCGFSZSA-N -1 3 354.385 3.804 20 0 FHADHM C[C@@H](OC(=O)C[C@H](C)c1cccc(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820225284 606354152 /nfs/dbraw/zinc/35/41/52/606354152.db2.gz FPYLKQPUKOLJRI-QWHCGFSZSA-N -1 3 354.385 3.804 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccnc2ccccc12)c1ccc(-c2nnn[n-]2)cc1 ZINC000820487425 606354212 /nfs/dbraw/zinc/35/42/12/606354212.db2.gz GQRCMAVXAFJICQ-BMSUMIBZSA-N -1 3 371.400 3.733 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccnc2ccccc12)c1ccc(-c2nn[n-]n2)cc1 ZINC000820487425 606354213 /nfs/dbraw/zinc/35/42/13/606354213.db2.gz GQRCMAVXAFJICQ-BMSUMIBZSA-N -1 3 371.400 3.733 20 0 FHADHM CS[C@@H](C(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000821943962 606356798 /nfs/dbraw/zinc/35/67/98/606356798.db2.gz YPWLQYMNXYQOED-MLGOLLRUSA-N -1 3 354.435 3.575 20 0 FHADHM CS[C@@H](C(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000821943962 606356800 /nfs/dbraw/zinc/35/68/00/606356800.db2.gz YPWLQYMNXYQOED-MLGOLLRUSA-N -1 3 354.435 3.575 20 0 FHADHM C[C@H](OC(=O)c1csc(C(C)(C)C)n1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820519366 606360058 /nfs/dbraw/zinc/36/00/58/606360058.db2.gz SRNVMGLAAVYIIE-JTQLQIEISA-N -1 3 357.439 3.539 20 0 FHADHM C[C@H](OC(=O)c1csc(C(C)(C)C)n1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820519366 606360060 /nfs/dbraw/zinc/36/00/60/606360060.db2.gz SRNVMGLAAVYIIE-JTQLQIEISA-N -1 3 357.439 3.539 20 0 FHADHM CCCCOc1ccc(OC)cc1NCc1cccc(-c2nnn[n-]2)c1 ZINC000821077969 606446956 /nfs/dbraw/zinc/44/69/56/606446956.db2.gz YZEYANSDKCGCOF-UHFFFAOYSA-N -1 3 353.426 3.666 20 0 FHADHM CCCCOc1ccc(OC)cc1NCc1cccc(-c2nn[n-]n2)c1 ZINC000821077969 606446957 /nfs/dbraw/zinc/44/69/57/606446957.db2.gz YZEYANSDKCGCOF-UHFFFAOYSA-N -1 3 353.426 3.666 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)cc1CNc1ccc(Oc2ccccn2)cc1 ZINC000822761859 606459792 /nfs/dbraw/zinc/45/97/92/606459792.db2.gz UTHIDFAOJRJTFO-UHFFFAOYSA-N -1 3 362.368 3.805 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CNc1ccc(Oc2ccccn2)cc1 ZINC000822761859 606459794 /nfs/dbraw/zinc/45/97/94/606459794.db2.gz UTHIDFAOJRJTFO-UHFFFAOYSA-N -1 3 362.368 3.805 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)cc1CNc1cccc(Oc2ccccn2)c1 ZINC000822762006 606463053 /nfs/dbraw/zinc/46/30/53/606463053.db2.gz XIOLBFRWUQWRNP-UHFFFAOYSA-N -1 3 362.368 3.805 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CNc1cccc(Oc2ccccn2)c1 ZINC000822762006 606463054 /nfs/dbraw/zinc/46/30/54/606463054.db2.gz XIOLBFRWUQWRNP-UHFFFAOYSA-N -1 3 362.368 3.805 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)cc1CNc1ccc(CC(F)(F)F)cc1 ZINC000822761243 606463083 /nfs/dbraw/zinc/46/30/83/606463083.db2.gz DQQNFVCTVJHXRS-UHFFFAOYSA-N -1 3 351.307 3.723 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CNc1ccc(CC(F)(F)F)cc1 ZINC000822761243 606463084 /nfs/dbraw/zinc/46/30/84/606463084.db2.gz DQQNFVCTVJHXRS-UHFFFAOYSA-N -1 3 351.307 3.723 20 0 FHADHM CC(C)(C)C(=O)c1ccc(NCc2cc(-c3nnn[n-]3)ccc2F)cc1 ZINC000819899319 606464281 /nfs/dbraw/zinc/46/42/81/606464281.db2.gz RHXOSZSIWMAKHK-UHFFFAOYSA-N -1 3 353.401 3.847 20 0 FHADHM CC(C)(C)C(=O)c1ccc(NCc2cc(-c3nn[n-]n3)ccc2F)cc1 ZINC000819899319 606464282 /nfs/dbraw/zinc/46/42/82/606464282.db2.gz RHXOSZSIWMAKHK-UHFFFAOYSA-N -1 3 353.401 3.847 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)O[C@@H](C1CCCC1)C(F)(F)F ZINC000822936495 606470877 /nfs/dbraw/zinc/47/08/77/606470877.db2.gz VGBBCIKZKAFASL-FEAKQIBJSA-N -1 3 366.343 3.544 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)O[C@@H](C1CCCC1)C(F)(F)F ZINC000822936495 606470879 /nfs/dbraw/zinc/47/08/79/606470879.db2.gz VGBBCIKZKAFASL-FEAKQIBJSA-N -1 3 366.343 3.544 20 0 FHADHM CC(C)(C)OCc1ccc(NC(=O)Nc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000819951779 606479500 /nfs/dbraw/zinc/47/95/00/606479500.db2.gz WMQISVWEONGHPO-UHFFFAOYSA-N -1 3 366.425 3.826 20 0 FHADHM CC(C)(C)OCc1ccc(NC(=O)Nc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000819951779 606479502 /nfs/dbraw/zinc/47/95/02/606479502.db2.gz WMQISVWEONGHPO-UHFFFAOYSA-N -1 3 366.425 3.826 20 0 FHADHM Cc1cc2cc(CNCc3ccc(-c4nn[n-]n4)cc3F)oc2cc1C ZINC000822213162 606480207 /nfs/dbraw/zinc/48/02/07/606480207.db2.gz XBIHIBITRFAGIS-UHFFFAOYSA-N -1 3 351.385 3.659 20 0 FHADHM CN(Cc1cccc(Cl)c1Cl)C(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000821613522 606480247 /nfs/dbraw/zinc/48/02/47/606480247.db2.gz QSRZPIAROZYYPD-UHFFFAOYSA-N -1 3 368.249 3.507 20 0 FHADHM CN(Cc1cccc(Cl)c1Cl)C(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000821613522 606480249 /nfs/dbraw/zinc/48/02/49/606480249.db2.gz QSRZPIAROZYYPD-UHFFFAOYSA-N -1 3 368.249 3.507 20 0 FHADHM C[C@H](NC(=O)c1cc(-c2nnn[n-]2)cs1)c1ccc(Cl)c(Cl)c1 ZINC000820390315 606481191 /nfs/dbraw/zinc/48/11/91/606481191.db2.gz HBFXJBGZQFFDNP-ZETCQYMHSA-N -1 3 368.249 3.726 20 0 FHADHM C[C@H](NC(=O)c1cc(-c2nn[n-]n2)cs1)c1ccc(Cl)c(Cl)c1 ZINC000820390315 606481193 /nfs/dbraw/zinc/48/11/93/606481193.db2.gz HBFXJBGZQFFDNP-ZETCQYMHSA-N -1 3 368.249 3.726 20 0 FHADHM CCCN(C(=O)c1cc(-c2nnn[n-]2)cs1)[C@@H](C)c1ccccc1OC ZINC000821083343 606492032 /nfs/dbraw/zinc/49/20/32/606492032.db2.gz YGKWKZONOMZTME-LBPRGKRZSA-N -1 3 371.466 3.550 20 0 FHADHM CCCN(C(=O)c1cc(-c2nn[n-]n2)cs1)[C@@H](C)c1ccccc1OC ZINC000821083343 606492033 /nfs/dbraw/zinc/49/20/33/606492033.db2.gz YGKWKZONOMZTME-LBPRGKRZSA-N -1 3 371.466 3.550 20 0 FHADHM CCN(C(=O)c1ccc(C)cc1F)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821160439 606505055 /nfs/dbraw/zinc/50/50/55/606505055.db2.gz KUZBKPKBUVBZQT-ZDUSSCGKSA-N -1 3 353.401 3.538 20 0 FHADHM CCN(C(=O)c1ccc(C)cc1F)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821160439 606505058 /nfs/dbraw/zinc/50/50/58/606505058.db2.gz KUZBKPKBUVBZQT-ZDUSSCGKSA-N -1 3 353.401 3.538 20 0 FHADHM CC(C)CCOc1ccc(NC(=O)c2cc(-c3nnn[n-]3)cs2)cc1 ZINC000820076143 606523331 /nfs/dbraw/zinc/52/33/31/606523331.db2.gz COMISAGNWFFWBK-UHFFFAOYSA-N -1 3 357.439 3.605 20 0 FHADHM CC(C)CCOc1ccc(NC(=O)c2cc(-c3nn[n-]n3)cs2)cc1 ZINC000820076143 606523333 /nfs/dbraw/zinc/52/33/33/606523333.db2.gz COMISAGNWFFWBK-UHFFFAOYSA-N -1 3 357.439 3.605 20 0 FHADHM Cc1c(COC(C)(C)C)cccc1NC(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000822029062 606529750 /nfs/dbraw/zinc/52/97/50/606529750.db2.gz UXOAOPZGYFUCKG-UHFFFAOYSA-N -1 3 371.466 3.804 20 0 FHADHM Cc1c(COC(C)(C)C)cccc1NC(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000822029062 606529751 /nfs/dbraw/zinc/52/97/51/606529751.db2.gz UXOAOPZGYFUCKG-UHFFFAOYSA-N -1 3 371.466 3.804 20 0 FHADHM CSc1ccc(NC(=O)c2cc(-c3nnn[n-]3)cs2)cc1Cl ZINC000821985066 606529824 /nfs/dbraw/zinc/52/98/24/606529824.db2.gz YEWLCKBYWYHGTD-UHFFFAOYSA-N -1 3 351.844 3.556 20 0 FHADHM CSc1ccc(NC(=O)c2cc(-c3nn[n-]n3)cs2)cc1Cl ZINC000821985066 606529825 /nfs/dbraw/zinc/52/98/25/606529825.db2.gz YEWLCKBYWYHGTD-UHFFFAOYSA-N -1 3 351.844 3.556 20 0 FHADHM CC(C)[C@@H](NC(=O)Cc1cccc(-c2nnn[n-]2)c1)c1ccccc1Cl ZINC000820025688 606562353 /nfs/dbraw/zinc/56/23/53/606562353.db2.gz BYUCWPIHTBMURD-GOSISDBHSA-N -1 3 369.856 3.576 20 0 FHADHM CC(C)[C@@H](NC(=O)Cc1cccc(-c2nn[n-]n2)c1)c1ccccc1Cl ZINC000820025688 606562355 /nfs/dbraw/zinc/56/23/55/606562355.db2.gz BYUCWPIHTBMURD-GOSISDBHSA-N -1 3 369.856 3.576 20 0 FHADHM FC(F)Oc1cc(-c2nnn[n-]2)ccc1CSc1ncccc1Cl ZINC000822731947 606589717 /nfs/dbraw/zinc/58/97/17/606589717.db2.gz GHRWCBOMKBSMNR-UHFFFAOYSA-N -1 3 369.784 3.809 20 0 FHADHM FC(F)Oc1cc(-c2nn[n-]n2)ccc1CSc1ncccc1Cl ZINC000822731947 606589719 /nfs/dbraw/zinc/58/97/19/606589719.db2.gz GHRWCBOMKBSMNR-UHFFFAOYSA-N -1 3 369.784 3.809 20 0 FHADHM CN(C)C(=O)Sc1cccc(CSc2ccccc2-c2nnn[n-]2)c1 ZINC000821577914 606591049 /nfs/dbraw/zinc/59/10/49/606591049.db2.gz DHZUKAPOYCANEZ-UHFFFAOYSA-N -1 3 371.491 3.933 20 0 FHADHM CN(C)C(=O)Sc1cccc(CSc2ccccc2-c2nn[n-]n2)c1 ZINC000821577914 606591051 /nfs/dbraw/zinc/59/10/51/606591051.db2.gz DHZUKAPOYCANEZ-UHFFFAOYSA-N -1 3 371.491 3.933 20 0 FHADHM C[C@@H](Nc1cc(-c2nnn[n-]2)c2ccccc2n1)c1ccc(F)cc1F ZINC000736140307 606592912 /nfs/dbraw/zinc/59/29/12/606592912.db2.gz TWUXRAMDIGHSFV-SNVBAGLBSA-N -1 3 352.348 3.866 20 0 FHADHM C[C@@H](Nc1cc(-c2nn[n-]n2)c2ccccc2n1)c1ccc(F)cc1F ZINC000736140307 606592913 /nfs/dbraw/zinc/59/29/13/606592913.db2.gz TWUXRAMDIGHSFV-SNVBAGLBSA-N -1 3 352.348 3.866 20 0 FHADHM Cc1cc(C)c(-c2nnn[n-]2)c(NC[C@H]2CCC[C@@H](C(F)(F)F)C2)n1 ZINC000822192833 606594663 /nfs/dbraw/zinc/59/46/63/606594663.db2.gz CIYBQZUZTLLDLZ-NWDGAFQWSA-N -1 3 354.380 3.659 20 0 FHADHM Cc1cc(C)c(-c2nn[n-]n2)c(NC[C@H]2CCC[C@@H](C(F)(F)F)C2)n1 ZINC000822192833 606594664 /nfs/dbraw/zinc/59/46/64/606594664.db2.gz CIYBQZUZTLLDLZ-NWDGAFQWSA-N -1 3 354.380 3.659 20 0 FHADHM FC(F)Oc1cc(-c2nnn[n-]2)ccc1CNc1ccc2scnc2c1 ZINC000822733238 606597232 /nfs/dbraw/zinc/59/72/32/606597232.db2.gz URDBFGBLJNCIGS-UHFFFAOYSA-N -1 3 374.376 3.690 20 0 FHADHM FC(F)Oc1cc(-c2nn[n-]n2)ccc1CNc1ccc2scnc2c1 ZINC000822733238 606597233 /nfs/dbraw/zinc/59/72/33/606597233.db2.gz URDBFGBLJNCIGS-UHFFFAOYSA-N -1 3 374.376 3.690 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)/C=C1\CC[C@@H](C)C1 ZINC000820087735 606618593 /nfs/dbraw/zinc/61/85/93/606618593.db2.gz YPSVPSYWJZFGPB-QAEAHILHSA-N -1 3 353.470 3.598 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)/C=C1\CC[C@@H](C)C1 ZINC000820087735 606618595 /nfs/dbraw/zinc/61/85/95/606618595.db2.gz YPSVPSYWJZFGPB-QAEAHILHSA-N -1 3 353.470 3.598 20 0 FHADHM CC(=CC(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1)c1cccc(Cl)c1 ZINC000819766340 606625915 /nfs/dbraw/zinc/62/59/15/606625915.db2.gz XCCFGYZHXZGXKL-RAXLEYEMSA-N -1 3 367.840 3.582 20 0 FHADHM CC(=CC(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1)c1cccc(Cl)c1 ZINC000819766340 606625917 /nfs/dbraw/zinc/62/59/17/606625917.db2.gz XCCFGYZHXZGXKL-RAXLEYEMSA-N -1 3 367.840 3.582 20 0 FHADHM O=C(CC1CCCCCC1)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000822941064 606627432 /nfs/dbraw/zinc/62/74/32/606627432.db2.gz OTJMCRNJBPYOKV-UHFFFAOYSA-N -1 3 353.470 3.718 20 0 FHADHM O=C(CC1CCCCCC1)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000822941064 606627434 /nfs/dbraw/zinc/62/74/34/606627434.db2.gz OTJMCRNJBPYOKV-UHFFFAOYSA-N -1 3 353.470 3.718 20 0 FHADHM Cc1[nH]ccc1C(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)cc1 ZINC000822009867 606628541 /nfs/dbraw/zinc/62/85/41/606628541.db2.gz FSUYPKZZPPQNBS-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM Cc1[nH]ccc1C(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)cc1 ZINC000822009867 606628543 /nfs/dbraw/zinc/62/85/43/606628543.db2.gz FSUYPKZZPPQNBS-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM CCc1nc(CNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)cs1 ZINC000821510104 606656548 /nfs/dbraw/zinc/65/65/48/606656548.db2.gz WUDYOXNBCRXDDY-UHFFFAOYSA-N -1 3 354.361 3.517 20 0 FHADHM CCc1nc(CNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)cs1 ZINC000821510104 606656549 /nfs/dbraw/zinc/65/65/49/606656549.db2.gz WUDYOXNBCRXDDY-UHFFFAOYSA-N -1 3 354.361 3.517 20 0 FHADHM O=C(Oc1c(Cl)cccc1Cl)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000823444934 606665872 /nfs/dbraw/zinc/66/58/72/606665872.db2.gz RBYVWDBPNWOQHP-UHFFFAOYSA-N -1 3 371.130 3.671 20 0 FHADHM O=C(Oc1c(Cl)cccc1Cl)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000823444934 606665873 /nfs/dbraw/zinc/66/58/73/606665873.db2.gz RBYVWDBPNWOQHP-UHFFFAOYSA-N -1 3 371.130 3.671 20 0 FHADHM CCCCCC(C)(C)CNC(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1 ZINC000821044184 606671914 /nfs/dbraw/zinc/67/19/14/606671914.db2.gz XRYYWOMKVPUYNZ-UHFFFAOYSA-N -1 3 358.490 3.615 20 0 FHADHM CCCCCC(C)(C)CNC(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1 ZINC000821044184 606671915 /nfs/dbraw/zinc/67/19/15/606671915.db2.gz XRYYWOMKVPUYNZ-UHFFFAOYSA-N -1 3 358.490 3.615 20 0 FHADHM CN(C(=O)c1c(F)cc(-c2nnn[n-]2)cc1F)c1cccc2ccccc21 ZINC000821571771 606674664 /nfs/dbraw/zinc/67/46/64/606674664.db2.gz DXYKZOWOGCKEND-UHFFFAOYSA-N -1 3 365.343 3.575 20 0 FHADHM CN(C(=O)c1c(F)cc(-c2nn[n-]n2)cc1F)c1cccc2ccccc21 ZINC000821571771 606674665 /nfs/dbraw/zinc/67/46/65/606674665.db2.gz DXYKZOWOGCKEND-UHFFFAOYSA-N -1 3 365.343 3.575 20 0 FHADHM CC(C)CC[C@@H](NC(=O)c1c(F)cc(-c2nnn[n-]2)cc1F)C(C)(C)C ZINC000820072494 606679746 /nfs/dbraw/zinc/67/97/46/606679746.db2.gz HSAGFZFKNFTSMJ-CQSZACIVSA-N -1 3 365.428 3.726 20 0 FHADHM CC(C)CC[C@@H](NC(=O)c1c(F)cc(-c2nn[n-]n2)cc1F)C(C)(C)C ZINC000820072494 606679747 /nfs/dbraw/zinc/67/97/47/606679747.db2.gz HSAGFZFKNFTSMJ-CQSZACIVSA-N -1 3 365.428 3.726 20 0 FHADHM C[C@H](NC(=O)N(C)C1CCC(C)(C)CC1)c1cccc(-c2nnn[n-]2)c1 ZINC000820341742 606719291 /nfs/dbraw/zinc/71/92/91/606719291.db2.gz RFDUSLVSFASLGD-ZDUSSCGKSA-N -1 3 356.474 3.538 20 0 FHADHM C[C@H](NC(=O)N(C)C1CCC(C)(C)CC1)c1cccc(-c2nn[n-]n2)c1 ZINC000820341742 606719293 /nfs/dbraw/zinc/71/92/93/606719293.db2.gz RFDUSLVSFASLGD-ZDUSSCGKSA-N -1 3 356.474 3.538 20 0 FHADHM CSCc1cc(F)ccc1CNc1c(F)cc(-c2nnn[n-]2)cc1F ZINC000821969810 606725057 /nfs/dbraw/zinc/72/50/57/606725057.db2.gz FOBPRSTUMUWYBN-UHFFFAOYSA-N -1 3 365.384 3.759 20 0 FHADHM CSCc1cc(F)ccc1CNc1c(F)cc(-c2nn[n-]n2)cc1F ZINC000821969810 606725058 /nfs/dbraw/zinc/72/50/58/606725058.db2.gz FOBPRSTUMUWYBN-UHFFFAOYSA-N -1 3 365.384 3.759 20 0 FHADHM Fc1ccc([C@H]2CCN(c3cc(-c4nnn[n-]4)c4ccccc4n3)C2)cc1 ZINC000822767030 606728546 /nfs/dbraw/zinc/72/85/46/606728546.db2.gz UDPCIMDICQSVSD-AWEZNQCLSA-N -1 3 360.396 3.548 20 0 FHADHM Fc1ccc([C@H]2CCN(c3cc(-c4nn[n-]n4)c4ccccc4n3)C2)cc1 ZINC000822767030 606728548 /nfs/dbraw/zinc/72/85/48/606728548.db2.gz UDPCIMDICQSVSD-AWEZNQCLSA-N -1 3 360.396 3.548 20 0 FHADHM C[C@@H](Nc1ncc(-c2nnn[n-]2)cc1Cl)c1cccc(N2CCCC2)c1 ZINC000820460762 606732766 /nfs/dbraw/zinc/73/27/66/606732766.db2.gz BQKTUBWQCFDOAL-GFCCVEGCSA-N -1 3 369.860 3.688 20 0 FHADHM C[C@@H](Nc1ncc(-c2nn[n-]n2)cc1Cl)c1cccc(N2CCCC2)c1 ZINC000820460762 606732767 /nfs/dbraw/zinc/73/27/67/606732767.db2.gz BQKTUBWQCFDOAL-GFCCVEGCSA-N -1 3 369.860 3.688 20 0 FHADHM O=C(OCc1cccc2ccccc21)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000823430741 606757972 /nfs/dbraw/zinc/75/79/72/606757972.db2.gz IXFIZDSJDQDBOG-UHFFFAOYSA-N -1 3 366.327 3.655 20 0 FHADHM O=C(OCc1cccc2ccccc21)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000823430741 606757973 /nfs/dbraw/zinc/75/79/73/606757973.db2.gz IXFIZDSJDQDBOG-UHFFFAOYSA-N -1 3 366.327 3.655 20 0 FHADHM O=C(OCc1ccc(C2CCCCC2)cc1)c1ccc(-c2nnn[n-]2)cn1 ZINC000823422616 606760373 /nfs/dbraw/zinc/76/03/73/606760373.db2.gz YNDYPPAPUUPFEJ-UHFFFAOYSA-N -1 3 363.421 3.666 20 0 FHADHM O=C(OCc1ccc(C2CCCCC2)cc1)c1ccc(-c2nn[n-]n2)cn1 ZINC000823422616 606760375 /nfs/dbraw/zinc/76/03/75/606760375.db2.gz YNDYPPAPUUPFEJ-UHFFFAOYSA-N -1 3 363.421 3.666 20 0 FHADHM CC(C)N(C)C(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000820112569 606771444 /nfs/dbraw/zinc/77/14/44/606771444.db2.gz ZBSDVRLINAXKBC-UHFFFAOYSA-N -1 3 352.398 3.531 20 0 FHADHM CC(C)N(C)C(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000820112569 606771445 /nfs/dbraw/zinc/77/14/45/606771445.db2.gz ZBSDVRLINAXKBC-UHFFFAOYSA-N -1 3 352.398 3.531 20 0 FHADHM CC(C)Sc1ccccc1NC(=O)NCc1ccc(-c2nnn[n-]2)cc1 ZINC000820183613 606771493 /nfs/dbraw/zinc/77/14/93/606771493.db2.gz HDGFALKSTGHAHB-UHFFFAOYSA-N -1 3 368.466 3.689 20 0 FHADHM CC(C)Sc1ccccc1NC(=O)NCc1ccc(-c2nn[n-]n2)cc1 ZINC000820183613 606771494 /nfs/dbraw/zinc/77/14/94/606771494.db2.gz HDGFALKSTGHAHB-UHFFFAOYSA-N -1 3 368.466 3.689 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1Oc1ccc(C(=O)Nc2ccccn2)cc1 ZINC000822146461 606776568 /nfs/dbraw/zinc/77/65/68/606776568.db2.gz YEKKTADIQDVWPS-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Fc1ccccc1-c1cnc(COc2cc(Cl)ccc2-c2nnn[n-]2)o1 ZINC000822791616 606779327 /nfs/dbraw/zinc/77/93/27/606779327.db2.gz KACXMAPZEBIJSV-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM Fc1ccccc1-c1cnc(COc2cc(Cl)ccc2-c2nn[n-]n2)o1 ZINC000822791616 606779329 /nfs/dbraw/zinc/77/93/29/606779329.db2.gz KACXMAPZEBIJSV-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(Oc2ncnc3sc4c(c32)CCC4)c1 ZINC000822574014 606789759 /nfs/dbraw/zinc/78/97/59/606789759.db2.gz NCTSBPIFHKVSRU-UHFFFAOYSA-N -1 3 370.825 3.806 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(Oc2ncnc3sc4c(c32)CCC4)c1 ZINC000822574014 606789760 /nfs/dbraw/zinc/78/97/60/606789760.db2.gz NCTSBPIFHKVSRU-UHFFFAOYSA-N -1 3 370.825 3.806 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)NCC1(CC(C)C)CC1 ZINC000821104450 606797752 /nfs/dbraw/zinc/79/77/52/606797752.db2.gz DHSDIDDZCMUDPQ-UHFFFAOYSA-N -1 3 370.501 3.615 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)NCC1(CC(C)C)CC1 ZINC000821104450 606797753 /nfs/dbraw/zinc/79/77/53/606797753.db2.gz DHSDIDDZCMUDPQ-UHFFFAOYSA-N -1 3 370.501 3.615 20 0 FHADHM Cc1ccc(Cl)c(NC(=O)CSc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000822240261 606807531 /nfs/dbraw/zinc/80/75/31/606807531.db2.gz ZROWLKNRKBFXNZ-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1ccc(Cl)c(NC(=O)CSc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000822240261 606807533 /nfs/dbraw/zinc/80/75/33/606807533.db2.gz ZROWLKNRKBFXNZ-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1ccc(Cl)c(NC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000822240064 606807721 /nfs/dbraw/zinc/80/77/21/606807721.db2.gz QULFGLOVZQPERI-NSHDSACASA-N -1 3 356.817 3.711 20 0 FHADHM Cc1ccc(Cl)c(NC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000822240064 606807722 /nfs/dbraw/zinc/80/77/22/606807722.db2.gz QULFGLOVZQPERI-NSHDSACASA-N -1 3 356.817 3.711 20 0 FHADHM CCCC[C@@H](NC(=O)CSCc1ccc(-c2nnn[n-]2)cc1)C1CCC1 ZINC000821042993 606816516 /nfs/dbraw/zinc/81/65/16/606816516.db2.gz KEBGKGUZEZCHKE-QGZVFWFLSA-N -1 3 373.526 3.575 20 0 FHADHM CCCC[C@@H](NC(=O)CSCc1ccc(-c2nn[n-]n2)cc1)C1CCC1 ZINC000821042993 606816518 /nfs/dbraw/zinc/81/65/18/606816518.db2.gz KEBGKGUZEZCHKE-QGZVFWFLSA-N -1 3 373.526 3.575 20 0 FHADHM C[C@H](SCC(=O)NCCC1CCCCC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820550166 606827724 /nfs/dbraw/zinc/82/77/24/606827724.db2.gz VHCIYFSXGQAHJC-AWEZNQCLSA-N -1 3 373.526 3.748 20 0 FHADHM C[C@H](SCC(=O)NCCC1CCCCC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820550166 606827725 /nfs/dbraw/zinc/82/77/25/606827725.db2.gz VHCIYFSXGQAHJC-AWEZNQCLSA-N -1 3 373.526 3.748 20 0 FHADHM Cc1ccc(NC(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)cc1O ZINC000822254707 606832258 /nfs/dbraw/zinc/83/22/58/606832258.db2.gz PGLMAMSRHXLGTA-UHFFFAOYSA-N -1 3 371.400 3.800 20 0 FHADHM Cc1ccc(NC(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)cc1O ZINC000822254707 606832259 /nfs/dbraw/zinc/83/22/59/606832259.db2.gz PGLMAMSRHXLGTA-UHFFFAOYSA-N -1 3 371.400 3.800 20 0 FHADHM Cc1cnn(CCCCCSc2ccc(-c3nnn[n-]3)cc2Cl)c1 ZINC000822402813 606851420 /nfs/dbraw/zinc/85/14/20/606851420.db2.gz HQLUJAYRBFLCNA-UHFFFAOYSA-N -1 3 362.890 3.988 20 0 FHADHM Cc1cnn(CCCCCSc2ccc(-c3nn[n-]n3)cc2Cl)c1 ZINC000822402813 606851421 /nfs/dbraw/zinc/85/14/21/606851421.db2.gz HQLUJAYRBFLCNA-UHFFFAOYSA-N -1 3 362.890 3.988 20 0 FHADHM FC(F)(F)COCCCSc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822718686 606852154 /nfs/dbraw/zinc/85/21/54/606852154.db2.gz OSQHYSFSIYGHDG-UHFFFAOYSA-N -1 3 352.769 3.581 20 0 FHADHM FC(F)(F)COCCCSc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822718686 606852156 /nfs/dbraw/zinc/85/21/56/606852156.db2.gz OSQHYSFSIYGHDG-UHFFFAOYSA-N -1 3 352.769 3.581 20 0 FHADHM Cc1cccn2cc(CSc3ccc(-c4nnn[n-]4)cc3Cl)nc12 ZINC000822366282 606853346 /nfs/dbraw/zinc/85/33/46/606853346.db2.gz GGNSAKHXTXFABF-UHFFFAOYSA-N -1 3 356.842 3.769 20 0 FHADHM Cc1cccn2cc(CSc3ccc(-c4nn[n-]n4)cc3Cl)nc12 ZINC000822366282 606853348 /nfs/dbraw/zinc/85/33/48/606853348.db2.gz GGNSAKHXTXFABF-UHFFFAOYSA-N -1 3 356.842 3.769 20 0 FHADHM O=C(Cc1cccc(-c2nnn[n-]2)c1)N(c1ccc(F)cc1)C1CCCC1 ZINC000823088439 606856137 /nfs/dbraw/zinc/85/61/37/606856137.db2.gz YEVZEXZJCAGCKY-UHFFFAOYSA-N -1 3 365.412 3.524 20 0 FHADHM O=C(Cc1cccc(-c2nn[n-]n2)c1)N(c1ccc(F)cc1)C1CCCC1 ZINC000823088439 606856138 /nfs/dbraw/zinc/85/61/38/606856138.db2.gz YEVZEXZJCAGCKY-UHFFFAOYSA-N -1 3 365.412 3.524 20 0 FHADHM CC[C@@H](Sc1cc(-c2nnn[n-]2)ccn1)C(=O)c1ccc(Cl)cc1 ZINC000820937699 606866749 /nfs/dbraw/zinc/86/67/49/606866749.db2.gz CBJYOUVQHLEJJP-CYBMUJFWSA-N -1 3 359.842 3.669 20 0 FHADHM CC[C@@H](Sc1cc(-c2nn[n-]n2)ccn1)C(=O)c1ccc(Cl)cc1 ZINC000820937699 606866751 /nfs/dbraw/zinc/86/67/51/606866751.db2.gz CBJYOUVQHLEJJP-CYBMUJFWSA-N -1 3 359.842 3.669 20 0 FHADHM CC[C@H](SCC(=O)Nc1sccc1-c1nnn[n-]1)c1ccccc1 ZINC000820938001 606873970 /nfs/dbraw/zinc/87/39/70/606873970.db2.gz GKUSOAWNVBKNRN-ZDUSSCGKSA-N -1 3 359.480 3.751 20 0 FHADHM CC[C@H](SCC(=O)Nc1sccc1-c1nn[n-]n1)c1ccccc1 ZINC000820938001 606873972 /nfs/dbraw/zinc/87/39/72/606873972.db2.gz GKUSOAWNVBKNRN-ZDUSSCGKSA-N -1 3 359.480 3.751 20 0 FHADHM CC(C)C[C@@H]1CCCCN1C(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000820062225 606880670 /nfs/dbraw/zinc/88/06/70/606880670.db2.gz KOKKRURBATWMIZ-KRWDZBQOSA-N -1 3 373.526 3.527 20 0 FHADHM CC(C)C[C@@H]1CCCCN1C(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000820062225 606880671 /nfs/dbraw/zinc/88/06/71/606880671.db2.gz KOKKRURBATWMIZ-KRWDZBQOSA-N -1 3 373.526 3.527 20 0 FHADHM Cc1cc([C@@H]2CCCN2c2ccc(C(F)(F)F)cc2-c2nnn[n-]2)no1 ZINC000822199178 606919628 /nfs/dbraw/zinc/91/96/28/606919628.db2.gz ZGGXRYRTBHJYDF-AWEZNQCLSA-N -1 3 364.331 3.523 20 0 FHADHM Cc1cc([C@@H]2CCCN2c2ccc(C(F)(F)F)cc2-c2nn[n-]n2)no1 ZINC000822199178 606919630 /nfs/dbraw/zinc/91/96/30/606919630.db2.gz ZGGXRYRTBHJYDF-AWEZNQCLSA-N -1 3 364.331 3.523 20 0 FHADHM COc1c(Cl)cc(NCc2ccc(F)c(-c3nnn[n-]3)c2)cc1Cl ZINC000821698536 606929503 /nfs/dbraw/zinc/92/95/03/606929503.db2.gz NSJJLGLYHRXNGE-UHFFFAOYSA-N -1 3 368.199 3.933 20 0 FHADHM COc1c(Cl)cc(NCc2ccc(F)c(-c3nn[n-]n3)c2)cc1Cl ZINC000821698536 606929505 /nfs/dbraw/zinc/92/95/05/606929505.db2.gz NSJJLGLYHRXNGE-UHFFFAOYSA-N -1 3 368.199 3.933 20 0 FHADHM FC(F)c1nc2ccccc2c(Sc2cccc(-c3nnn[n-]3)c2)n1 ZINC000822736732 606944966 /nfs/dbraw/zinc/94/49/66/606944966.db2.gz JIZBGLSMTDSUOS-UHFFFAOYSA-N -1 3 356.361 3.899 20 0 FHADHM FC(F)c1nc2ccccc2c(Sc2cccc(-c3nn[n-]n3)c2)n1 ZINC000822736732 606944967 /nfs/dbraw/zinc/94/49/67/606944967.db2.gz JIZBGLSMTDSUOS-UHFFFAOYSA-N -1 3 356.361 3.899 20 0 FHADHM CC(C)Oc1ccc(C(=O)N(C)c2cc(Cl)ccc2-c2nnn[n-]2)cc1 ZINC000820155955 606958378 /nfs/dbraw/zinc/95/83/78/606958378.db2.gz XARJMVDERAFWGO-UHFFFAOYSA-N -1 3 371.828 3.584 20 0 FHADHM CC(C)Oc1ccc(C(=O)N(C)c2cc(Cl)ccc2-c2nn[n-]n2)cc1 ZINC000820155955 606958380 /nfs/dbraw/zinc/95/83/80/606958380.db2.gz XARJMVDERAFWGO-UHFFFAOYSA-N -1 3 371.828 3.584 20 0 FHADHM CN(C(=O)C1(Cc2ccccc2)CC1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821569186 606960059 /nfs/dbraw/zinc/96/00/59/606960059.db2.gz BFCKZDXCMQFZKS-UHFFFAOYSA-N -1 3 367.840 3.506 20 0 FHADHM CN(C(=O)C1(Cc2ccccc2)CC1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821569186 606960060 /nfs/dbraw/zinc/96/00/60/606960060.db2.gz BFCKZDXCMQFZKS-UHFFFAOYSA-N -1 3 367.840 3.506 20 0 FHADHM CN(C(=O)c1cc2cccc(F)c2o1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821573539 606962661 /nfs/dbraw/zinc/96/26/61/606962661.db2.gz USOOCMVNFDJDAQ-UHFFFAOYSA-N -1 3 371.759 3.682 20 0 FHADHM CN(C(=O)c1cc2cccc(F)c2o1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821573539 606962663 /nfs/dbraw/zinc/96/26/63/606962663.db2.gz USOOCMVNFDJDAQ-UHFFFAOYSA-N -1 3 371.759 3.682 20 0 FHADHM Cc1cccc([C@@H](C)C(=O)N(C)c2cc(Cl)ccc2-c2nnn[n-]2)c1 ZINC000822289183 606965414 /nfs/dbraw/zinc/96/54/14/606965414.db2.gz UDWZBICVUXFODO-GFCCVEGCSA-N -1 3 355.829 3.595 20 0 FHADHM Cc1cccc([C@@H](C)C(=O)N(C)c2cc(Cl)ccc2-c2nn[n-]n2)c1 ZINC000822289183 606965415 /nfs/dbraw/zinc/96/54/15/606965415.db2.gz UDWZBICVUXFODO-GFCCVEGCSA-N -1 3 355.829 3.595 20 0 FHADHM CSc1ccccc1C(=O)N(C)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821984971 606965579 /nfs/dbraw/zinc/96/55/79/606965579.db2.gz WMUXMAJLXWXSEY-UHFFFAOYSA-N -1 3 359.842 3.519 20 0 FHADHM CSc1ccccc1C(=O)N(C)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821984971 606965580 /nfs/dbraw/zinc/96/55/80/606965580.db2.gz WMUXMAJLXWXSEY-UHFFFAOYSA-N -1 3 359.842 3.519 20 0 FHADHM Cc1ccc([C@@H]2CSCCN2Cc2ccc(F)c(-c3nnn[n-]3)c2)cc1 ZINC000822233313 606974220 /nfs/dbraw/zinc/97/42/20/606974220.db2.gz MBKNIMYVBOIGGU-SFHVURJKSA-N -1 3 369.469 3.604 20 0 FHADHM Cc1ccc([C@H]2CSCCN2Cc2ccc(F)c(-c3nnn[n-]3)c2)cc1 ZINC000822233312 606974515 /nfs/dbraw/zinc/97/45/15/606974515.db2.gz MBKNIMYVBOIGGU-GOSISDBHSA-N -1 3 369.469 3.604 20 0 FHADHM Cc1ccc(NC(=O)[C@@H](C)Sc2cccc(-c3nnn[n-]3)c2)cc1C ZINC000822242652 607012116 /nfs/dbraw/zinc/01/21/16/607012116.db2.gz SJURLPOEENTUON-CYBMUJFWSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1ccc(NC(=O)[C@@H](C)Sc2cccc(-c3nn[n-]n3)c2)cc1C ZINC000822242652 607012117 /nfs/dbraw/zinc/01/21/17/607012117.db2.gz SJURLPOEENTUON-CYBMUJFWSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1cc(C)cc(NC(=O)[C@H](C)Sc2cccc(-c3nnn[n-]3)c2)c1 ZINC000822196625 607015509 /nfs/dbraw/zinc/01/55/09/607015509.db2.gz QJQCVYWVDLYVIG-ZDUSSCGKSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1cc(C)cc(NC(=O)[C@H](C)Sc2cccc(-c3nn[n-]n3)c2)c1 ZINC000822196625 607015510 /nfs/dbraw/zinc/01/55/10/607015510.db2.gz QJQCVYWVDLYVIG-ZDUSSCGKSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1ccc(CS[C@@H](C)C(=O)Nc2ccccc2-c2nnn[n-]2)cc1C ZINC000822239843 607017408 /nfs/dbraw/zinc/01/74/08/607017408.db2.gz HCXHWHVDBVVHFH-AWEZNQCLSA-N -1 3 367.478 3.744 20 0 FHADHM Cc1ccc(CS[C@@H](C)C(=O)Nc2ccccc2-c2nn[n-]n2)cc1C ZINC000822239843 607017409 /nfs/dbraw/zinc/01/74/09/607017409.db2.gz HCXHWHVDBVVHFH-AWEZNQCLSA-N -1 3 367.478 3.744 20 0 FHADHM CCC(CC)CC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)CC(F)(F)F ZINC000820893960 607027503 /nfs/dbraw/zinc/02/75/03/607027503.db2.gz YWYYIFGKNNOCMC-UHFFFAOYSA-N -1 3 369.391 3.584 20 0 FHADHM CCC(CC)CC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)CC(F)(F)F ZINC000820893960 607027504 /nfs/dbraw/zinc/02/75/04/607027504.db2.gz YWYYIFGKNNOCMC-UHFFFAOYSA-N -1 3 369.391 3.584 20 0 FHADHM COc1ccc(CNc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1Cl ZINC000821821803 607038684 /nfs/dbraw/zinc/03/86/84/607038684.db2.gz XXWRLKARWLRMDQ-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM COc1ccc(CNc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1Cl ZINC000821821803 607038682 /nfs/dbraw/zinc/03/86/82/607038682.db2.gz XXWRLKARWLRMDQ-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)c(CSc2nc(-c3ccccc3)c[nH]2)c1 ZINC000822757670 607039671 /nfs/dbraw/zinc/03/96/71/607039671.db2.gz CASTWDQTYYIMGD-UHFFFAOYSA-N -1 3 352.398 3.688 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)c(CSc2nc(-c3ccccc3)c[nH]2)c1 ZINC000822757670 607039673 /nfs/dbraw/zinc/03/96/73/607039673.db2.gz CASTWDQTYYIMGD-UHFFFAOYSA-N -1 3 352.398 3.688 20 0 FHADHM CC1(C)C[C@@H](Nc2ncc(-c3nnn[n-]3)cc2Cl)c2ccc(F)cc2O1 ZINC000820590779 607041785 /nfs/dbraw/zinc/04/17/85/607041785.db2.gz ZQNQHAVHRIFPFI-CYBMUJFWSA-N -1 3 374.807 3.769 20 0 FHADHM CC1(C)C[C@@H](Nc2ncc(-c3nn[n-]n3)cc2Cl)c2ccc(F)cc2O1 ZINC000820590779 607041786 /nfs/dbraw/zinc/04/17/86/607041786.db2.gz ZQNQHAVHRIFPFI-CYBMUJFWSA-N -1 3 374.807 3.769 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1)[C@@H]1CC12CCC2 ZINC000823350138 607127948 /nfs/dbraw/zinc/12/79/48/607127948.db2.gz ALLBZFFFKLRZJG-KRWDZBQOSA-N -1 3 361.405 3.788 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1)[C@@H]1CC12CCC2 ZINC000823350138 607127951 /nfs/dbraw/zinc/12/79/51/607127951.db2.gz ALLBZFFFKLRZJG-KRWDZBQOSA-N -1 3 361.405 3.788 20 0 FHADHM FC(F)(F)c1ccc(N[C@H]2CCOC3(CCCC3)C2)c(-c2nnn[n-]2)c1 ZINC000822724020 607130016 /nfs/dbraw/zinc/13/00/16/607130016.db2.gz WNKUYORFIDDDPE-LBPRGKRZSA-N -1 3 367.375 3.789 20 0 FHADHM FC(F)(F)c1ccc(N[C@H]2CCOC3(CCCC3)C2)c(-c2nn[n-]n2)c1 ZINC000822724020 607130018 /nfs/dbraw/zinc/13/00/18/607130018.db2.gz WNKUYORFIDDDPE-LBPRGKRZSA-N -1 3 367.375 3.789 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1OCc1cc2ccccc2nc1Cl ZINC000822748077 607135457 /nfs/dbraw/zinc/13/54/57/607135457.db2.gz GMUUJUYDTYSVSF-UHFFFAOYSA-N -1 3 355.760 3.786 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1OCc1cc2ccccc2nc1Cl ZINC000822748077 607135459 /nfs/dbraw/zinc/13/54/59/607135459.db2.gz GMUUJUYDTYSVSF-UHFFFAOYSA-N -1 3 355.760 3.786 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1OCc1c(Cl)ccc2cccnc21 ZINC000822748151 607135648 /nfs/dbraw/zinc/13/56/48/607135648.db2.gz KIBRZJSKZKKCQB-UHFFFAOYSA-N -1 3 355.760 3.786 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1OCc1c(Cl)ccc2cccnc21 ZINC000822748151 607135650 /nfs/dbraw/zinc/13/56/50/607135650.db2.gz KIBRZJSKZKKCQB-UHFFFAOYSA-N -1 3 355.760 3.786 20 0 FHADHM CCCOc1cc(F)ccc1NC(=O)Nc1cc(-c2nnn[n-]2)ccc1C ZINC000821127040 607136240 /nfs/dbraw/zinc/13/62/40/607136240.db2.gz AJFKTDLZECADKH-UHFFFAOYSA-N -1 3 370.388 3.747 20 0 FHADHM CCCOc1cc(F)ccc1NC(=O)Nc1cc(-c2nn[n-]n2)ccc1C ZINC000821127040 607136242 /nfs/dbraw/zinc/13/62/42/607136242.db2.gz AJFKTDLZECADKH-UHFFFAOYSA-N -1 3 370.388 3.747 20 0 FHADHM Cc1ccc(-c2nc(COc3ccc(-c4nnn[n-]4)cc3F)co2)cc1 ZINC000822214111 607140300 /nfs/dbraw/zinc/14/03/00/607140300.db2.gz PYPPRYZWVZREKH-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM Cc1ccc(-c2nc(COc3ccc(-c4nn[n-]n4)cc3F)co2)cc1 ZINC000822214111 607140302 /nfs/dbraw/zinc/14/03/02/607140302.db2.gz PYPPRYZWVZREKH-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM CCc1cc(C(=O)N(CC)[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)oc1CC ZINC000821469337 607156433 /nfs/dbraw/zinc/15/64/33/607156433.db2.gz CUIJSRUDQHWPKD-ZDUSSCGKSA-N -1 3 367.453 3.808 20 0 FHADHM CCc1cc(C(=O)N(CC)[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)oc1CC ZINC000821469337 607156434 /nfs/dbraw/zinc/15/64/34/607156434.db2.gz CUIJSRUDQHWPKD-ZDUSSCGKSA-N -1 3 367.453 3.808 20 0 FHADHM CC1(C)[C@H](Nc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)[C@H]2CCCO[C@@H]21 ZINC000820586493 607173352 /nfs/dbraw/zinc/17/33/52/607173352.db2.gz WQVBBLVJSMOONR-HONMWMINSA-N -1 3 367.375 3.501 20 0 FHADHM CC1(C)[C@H](Nc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)[C@H]2CCCO[C@@H]21 ZINC000820586493 607173353 /nfs/dbraw/zinc/17/33/53/607173353.db2.gz WQVBBLVJSMOONR-HONMWMINSA-N -1 3 367.375 3.501 20 0 FHADHM CC[C@H](Nc1ccc(C(F)(F)F)cc1-c1nnn[n-]1)C1CCOCC1 ZINC000820925084 607173645 /nfs/dbraw/zinc/17/36/45/607173645.db2.gz DBLXMPYCYHSQOL-ZDUSSCGKSA-N -1 3 355.364 3.503 20 0 FHADHM CC[C@H](Nc1ccc(C(F)(F)F)cc1-c1nn[n-]n1)C1CCOCC1 ZINC000820925084 607173646 /nfs/dbraw/zinc/17/36/46/607173646.db2.gz DBLXMPYCYHSQOL-ZDUSSCGKSA-N -1 3 355.364 3.503 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)c1cc2cc(F)ccc2o1 ZINC000823318996 607189438 /nfs/dbraw/zinc/18/94/38/607189438.db2.gz OEMUQFXFZDGKDO-UHFFFAOYSA-N -1 3 357.732 3.658 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)c1cc2cc(F)ccc2o1 ZINC000823318996 607189439 /nfs/dbraw/zinc/18/94/39/607189439.db2.gz OEMUQFXFZDGKDO-UHFFFAOYSA-N -1 3 357.732 3.658 20 0 FHADHM CCCCOc1ccc(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000821077811 607190665 /nfs/dbraw/zinc/19/06/65/607190665.db2.gz UVKPHKRSIGQQRI-UHFFFAOYSA-N -1 3 371.828 3.951 20 0 FHADHM CCCCOc1ccc(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000821077811 607190666 /nfs/dbraw/zinc/19/06/66/607190666.db2.gz UVKPHKRSIGQQRI-UHFFFAOYSA-N -1 3 371.828 3.951 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)c1ccc(F)cc1C(F)(F)F ZINC000822220042 607192859 /nfs/dbraw/zinc/19/28/59/607192859.db2.gz ARYBVPJFRNXFLE-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)c1ccc(F)cc1C(F)(F)F ZINC000822220042 607192860 /nfs/dbraw/zinc/19/28/60/607192860.db2.gz ARYBVPJFRNXFLE-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM CC[C@@H](Cc1ccccc1)NC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820914280 607196367 /nfs/dbraw/zinc/19/63/67/607196367.db2.gz NKFQTDVUMVCAKF-AWEZNQCLSA-N -1 3 370.844 3.663 20 0 FHADHM CC[C@@H](Cc1ccccc1)NC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820914280 607196368 /nfs/dbraw/zinc/19/63/68/607196368.db2.gz NKFQTDVUMVCAKF-AWEZNQCLSA-N -1 3 370.844 3.663 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N1CCC[C@H]1c1ccsc1 ZINC000823314519 607198495 /nfs/dbraw/zinc/19/84/95/607198495.db2.gz OYXOZDNGSGJYMG-AWEZNQCLSA-N -1 3 374.857 3.951 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N1CCC[C@H]1c1ccsc1 ZINC000823314519 607198496 /nfs/dbraw/zinc/19/84/96/607198496.db2.gz OYXOZDNGSGJYMG-AWEZNQCLSA-N -1 3 374.857 3.951 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N[C@H](c1cccs1)C1CC1 ZINC000823318290 607198695 /nfs/dbraw/zinc/19/86/95/607198695.db2.gz BNBYAJPFOADYRZ-AWEZNQCLSA-N -1 3 374.857 3.854 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N[C@H](c1cccs1)C1CC1 ZINC000823318290 607198696 /nfs/dbraw/zinc/19/86/96/607198696.db2.gz BNBYAJPFOADYRZ-AWEZNQCLSA-N -1 3 374.857 3.854 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N(Cc1cccs1)C1CC1 ZINC000823315624 607198742 /nfs/dbraw/zinc/19/87/42/607198742.db2.gz ZTUANZOLQYIZAU-UHFFFAOYSA-N -1 3 374.857 3.778 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N(Cc1cccs1)C1CC1 ZINC000823315624 607198743 /nfs/dbraw/zinc/19/87/43/607198743.db2.gz ZTUANZOLQYIZAU-UHFFFAOYSA-N -1 3 374.857 3.778 20 0 FHADHM CC(C)(NC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1cccc(F)c1 ZINC000819988087 607198891 /nfs/dbraw/zinc/19/88/91/607198891.db2.gz SEPKGAFAKMLYNX-UHFFFAOYSA-N -1 3 374.807 3.716 20 0 FHADHM CC(C)(NC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1cccc(F)c1 ZINC000819988087 607198892 /nfs/dbraw/zinc/19/88/92/607198892.db2.gz SEPKGAFAKMLYNX-UHFFFAOYSA-N -1 3 374.807 3.716 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N[C@H](c1ccccc1)C1CC1 ZINC000823319375 607201125 /nfs/dbraw/zinc/20/11/25/607201125.db2.gz SSWWNQDREXKELH-MRXNPFEDSA-N -1 3 368.828 3.793 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N[C@H](c1ccccc1)C1CC1 ZINC000823319375 607201126 /nfs/dbraw/zinc/20/11/26/607201126.db2.gz SSWWNQDREXKELH-MRXNPFEDSA-N -1 3 368.828 3.793 20 0 FHADHM C[C@@H]1c2ccccc2CN1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820826032 607201547 /nfs/dbraw/zinc/20/15/47/607201547.db2.gz INGAPLCTYIKFHR-SNVBAGLBSA-N -1 3 354.801 3.629 20 0 FHADHM C[C@@H]1c2ccccc2CN1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820826032 607201548 /nfs/dbraw/zinc/20/15/48/607201548.db2.gz INGAPLCTYIKFHR-SNVBAGLBSA-N -1 3 354.801 3.629 20 0 FHADHM Cc1ccc(CN(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)C2CC2)o1 ZINC000822236334 607203787 /nfs/dbraw/zinc/20/37/87/607203787.db2.gz UTMORRTWZXKLEE-UHFFFAOYSA-N -1 3 372.816 3.618 20 0 FHADHM Cc1ccc(CN(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)C2CC2)o1 ZINC000822236334 607203788 /nfs/dbraw/zinc/20/37/88/607203788.db2.gz UTMORRTWZXKLEE-UHFFFAOYSA-N -1 3 372.816 3.618 20 0 FHADHM C[C@H](c1ccccc1)[C@H](C)NC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820374852 607204278 /nfs/dbraw/zinc/20/42/78/607204278.db2.gz ROGTVCORMXMVHE-RYUDHWBXSA-N -1 3 370.844 3.834 20 0 FHADHM C[C@H](c1ccccc1)[C@H](C)NC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820374852 607204279 /nfs/dbraw/zinc/20/42/79/607204279.db2.gz ROGTVCORMXMVHE-RYUDHWBXSA-N -1 3 370.844 3.834 20 0 FHADHM C[C@H](N[C@H](c1ccccc1)c1ccccn1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820414280 607208576 /nfs/dbraw/zinc/20/85/76/607208576.db2.gz XLQNGZXHQZIQDD-MGPUTAFESA-N -1 3 356.433 3.702 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)c1ccc(-c2ccco2)s1 ZINC000823343948 607239420 /nfs/dbraw/zinc/23/94/20/607239420.db2.gz LWZHABLSUDOTFO-UHFFFAOYSA-N -1 3 355.354 3.580 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)c1ccc(-c2ccco2)s1 ZINC000823343948 607239421 /nfs/dbraw/zinc/23/94/21/607239421.db2.gz LWZHABLSUDOTFO-UHFFFAOYSA-N -1 3 355.354 3.580 20 0 FHADHM CC[C@H](OC1CCCCC1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820937627 607243552 /nfs/dbraw/zinc/24/35/52/607243552.db2.gz ANLRTICGNKJOIK-HNNXBMFYSA-N -1 3 363.849 3.587 20 0 FHADHM CC[C@H](OC1CCCCC1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820937627 607243553 /nfs/dbraw/zinc/24/35/53/607243553.db2.gz ANLRTICGNKJOIK-HNNXBMFYSA-N -1 3 363.849 3.587 20 0 FHADHM C[C@@H](CSc1ccccc1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820293795 607243617 /nfs/dbraw/zinc/24/36/17/607243617.db2.gz OFQMZERAGNKOBA-NSHDSACASA-N -1 3 373.869 3.887 20 0 FHADHM C[C@@H](CSc1ccccc1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820293795 607243618 /nfs/dbraw/zinc/24/36/18/607243618.db2.gz OFQMZERAGNKOBA-NSHDSACASA-N -1 3 373.869 3.887 20 0 FHADHM C[C@@H]1CC[C@H](NC(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)c2ccccc21 ZINC000824914969 607774965 /nfs/dbraw/zinc/77/49/65/607774965.db2.gz AUMYLQITTQICRB-HWPZZCPQSA-N -1 3 369.375 3.513 20 0 FHADHM C[C@@H]1CC[C@H](NC(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)c2ccccc21 ZINC000824914969 607774966 /nfs/dbraw/zinc/77/49/66/607774966.db2.gz AUMYLQITTQICRB-HWPZZCPQSA-N -1 3 369.375 3.513 20 0 FHADHM CCc1cccc(CC(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCC3)c1 ZINC000825723032 607782395 /nfs/dbraw/zinc/78/23/95/607782395.db2.gz RDHSDIKQHLUQGL-UHFFFAOYSA-N -1 3 367.478 3.551 20 0 FHADHM CCc1cccc(CC(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCC3)c1 ZINC000825723032 607782396 /nfs/dbraw/zinc/78/23/96/607782396.db2.gz RDHSDIKQHLUQGL-UHFFFAOYSA-N -1 3 367.478 3.551 20 0 FHADHM FC(F)(F)c1csc(CSCc2ccccc2-c2nnn[n-]2)n1 ZINC000826368956 607785142 /nfs/dbraw/zinc/78/51/42/607785142.db2.gz HPFKNODXYSNXQO-UHFFFAOYSA-N -1 3 357.386 3.775 20 0 FHADHM FC(F)(F)c1csc(CSCc2ccccc2-c2nn[n-]n2)n1 ZINC000826368956 607785143 /nfs/dbraw/zinc/78/51/43/607785143.db2.gz HPFKNODXYSNXQO-UHFFFAOYSA-N -1 3 357.386 3.775 20 0 FHADHM CC[C@H](CC(=O)Nc1ccc(F)cc1-c1nnn[n-]1)c1ccc(OC)cc1 ZINC000825081153 607786321 /nfs/dbraw/zinc/78/63/21/607786321.db2.gz GWQCSWZHDPGVPO-GFCCVEGCSA-N -1 3 369.400 3.537 20 0 FHADHM CC[C@H](CC(=O)Nc1ccc(F)cc1-c1nn[n-]n1)c1ccc(OC)cc1 ZINC000825081153 607786322 /nfs/dbraw/zinc/78/63/22/607786322.db2.gz GWQCSWZHDPGVPO-GFCCVEGCSA-N -1 3 369.400 3.537 20 0 FHADHM Cc1cc(CCCC(=O)N(C)c2ccccc2-c2nnn[n-]2)c(C)s1 ZINC000826266295 607791050 /nfs/dbraw/zinc/79/10/50/607791050.db2.gz JYDCIIXLMWHZSX-UHFFFAOYSA-N -1 3 355.467 3.531 20 0 FHADHM Cc1cc(CCCC(=O)N(C)c2ccccc2-c2nn[n-]n2)c(C)s1 ZINC000826266295 607791051 /nfs/dbraw/zinc/79/10/51/607791051.db2.gz JYDCIIXLMWHZSX-UHFFFAOYSA-N -1 3 355.467 3.531 20 0 FHADHM Cc1ccc(C(=O)Oc2ccc(Oc3ccc(-c4nn[n-]n4)cc3)cc2)nc1 ZINC000826282453 607801154 /nfs/dbraw/zinc/80/11/54/607801154.db2.gz PDXSWVFNCKHZCB-UHFFFAOYSA-N -1 3 373.372 3.582 20 0 FHADHM C[C@@H](Cc1ccccc1Cl)C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000824456906 607815926 /nfs/dbraw/zinc/81/59/26/607815926.db2.gz AHWCKRAIXHJDDY-STQMWFEESA-N -1 3 369.856 3.576 20 0 FHADHM C[C@@H](Cc1ccccc1Cl)C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000824456906 607815927 /nfs/dbraw/zinc/81/59/27/607815927.db2.gz AHWCKRAIXHJDDY-STQMWFEESA-N -1 3 369.856 3.576 20 0 FHADHM COc1ccc2cccc(CC(=O)Nc3cccc(-c4nnn[n-]4)c3C)c2c1 ZINC000826213198 607822890 /nfs/dbraw/zinc/82/28/90/607822890.db2.gz OFXXJKLGXZXKRP-UHFFFAOYSA-N -1 3 373.416 3.518 20 0 FHADHM COc1ccc2cccc(CC(=O)Nc3cccc(-c4nn[n-]n4)c3C)c2c1 ZINC000826213198 607822891 /nfs/dbraw/zinc/82/28/91/607822891.db2.gz OFXXJKLGXZXKRP-UHFFFAOYSA-N -1 3 373.416 3.518 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)c2c(Cl)cc(-c3nnn[n-]3)cc2Cl)o1 ZINC000826283388 607833407 /nfs/dbraw/zinc/83/34/07/607833407.db2.gz PPNSBIUAMYYGET-QMMMGPOBSA-N -1 3 366.208 3.566 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)c2c(Cl)cc(-c3nn[n-]n3)cc2Cl)o1 ZINC000826283388 607833408 /nfs/dbraw/zinc/83/34/08/607833408.db2.gz PPNSBIUAMYYGET-QMMMGPOBSA-N -1 3 366.208 3.566 20 0 FHADHM COc1ccc([C@H]2CCCN2c2ccc3cc(-c4nnn[n-]4)ccc3n2)cc1 ZINC000826189699 607838638 /nfs/dbraw/zinc/83/86/38/607838638.db2.gz BPIXZHLIUSRIDZ-LJQANCHMSA-N -1 3 372.432 3.765 20 0 FHADHM COc1ccc([C@H]2CCCN2c2ccc3cc(-c4nn[n-]n4)ccc3n2)cc1 ZINC000826189699 607838639 /nfs/dbraw/zinc/83/86/39/607838639.db2.gz BPIXZHLIUSRIDZ-LJQANCHMSA-N -1 3 372.432 3.765 20 0 FHADHM Clc1cc(-c2nnn[n-]2)ccc1SCc1nc(C2CCCC2)no1 ZINC000826351067 607843915 /nfs/dbraw/zinc/84/39/15/607843915.db2.gz WDLJOOLLQMOCND-UHFFFAOYSA-N -1 3 362.846 3.853 20 0 FHADHM Clc1cc(-c2nn[n-]n2)ccc1SCc1nc(C2CCCC2)no1 ZINC000826351067 607843916 /nfs/dbraw/zinc/84/39/16/607843916.db2.gz WDLJOOLLQMOCND-UHFFFAOYSA-N -1 3 362.846 3.853 20 0 FHADHM CSc1ccc2cc(Cn3ccc(-c4nnn[n-]4)c3)c(Cl)nc2c1 ZINC000826230830 607890954 /nfs/dbraw/zinc/89/09/54/607890954.db2.gz LIXDEKUJIHCGFQ-UHFFFAOYSA-N -1 3 356.842 3.640 20 0 FHADHM CSc1ccc2cc(Cn3ccc(-c4nn[n-]n4)c3)c(Cl)nc2c1 ZINC000826230830 607890955 /nfs/dbraw/zinc/89/09/55/607890955.db2.gz LIXDEKUJIHCGFQ-UHFFFAOYSA-N -1 3 356.842 3.640 20 0 FHADHM O=C(NC1(c2cccc(-c3nnn[n-]3)c2)CC1)[C@@H]1CC[C@@H]2CCCC[C@H]2C1 ZINC000826428324 607909425 /nfs/dbraw/zinc/90/94/25/607909425.db2.gz YKLZDHPWRFMANP-YQQAZPJKSA-N -1 3 365.481 3.579 20 0 FHADHM O=C(NC1(c2cccc(-c3nn[n-]n3)c2)CC1)[C@@H]1CC[C@@H]2CCCC[C@H]2C1 ZINC000826428324 607909426 /nfs/dbraw/zinc/90/94/26/607909426.db2.gz YKLZDHPWRFMANP-YQQAZPJKSA-N -1 3 365.481 3.579 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@H]2C(=O)N2CCc3ccc(-c4nnn[n-]4)cc32)cc1 ZINC000824347842 607947842 /nfs/dbraw/zinc/94/78/42/607947842.db2.gz PGERBONHADNMTK-RTBURBONSA-N -1 3 373.460 3.683 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@H]2C(=O)N2CCc3ccc(-c4nn[n-]n4)cc32)cc1 ZINC000824347842 607947843 /nfs/dbraw/zinc/94/78/43/607947843.db2.gz PGERBONHADNMTK-RTBURBONSA-N -1 3 373.460 3.683 20 0 FHADHM CCC(CC)(C(=O)N1CCc2ccc(-c3nnn[n-]3)cc21)c1ccccc1 ZINC000825090099 607954155 /nfs/dbraw/zinc/95/41/55/607954155.db2.gz TTXPYXPEURGLGE-UHFFFAOYSA-N -1 3 361.449 3.514 20 0 FHADHM CCC(CC)(C(=O)N1CCc2ccc(-c3nn[n-]n3)cc21)c1ccccc1 ZINC000825090099 607954156 /nfs/dbraw/zinc/95/41/56/607954156.db2.gz TTXPYXPEURGLGE-UHFFFAOYSA-N -1 3 361.449 3.514 20 0 FHADHM Cc1nnc(SCc2ccc(-c3nnn[n-]3)cc2)n1[C@H]1CCC[C@H](C)C1 ZINC000826337427 607966107 /nfs/dbraw/zinc/96/61/07/607966107.db2.gz NVUWJHGTSNKFTI-LRDDRELGSA-N -1 3 369.498 3.810 20 0 FHADHM Cc1nnc(SCc2ccc(-c3nn[n-]n3)cc2)n1[C@H]1CCC[C@H](C)C1 ZINC000826337427 607966108 /nfs/dbraw/zinc/96/61/08/607966108.db2.gz NVUWJHGTSNKFTI-LRDDRELGSA-N -1 3 369.498 3.810 20 0 FHADHM Cc1cc([C@H](NC(=O)Nc2cccc(-c3nnn[n-]3)c2)C2CC2)ccc1F ZINC000826262605 607977557 /nfs/dbraw/zinc/97/75/57/607977557.db2.gz SYJJKTKRLQWJFW-QGZVFWFLSA-N -1 3 366.400 3.587 20 0 FHADHM Cc1cc([C@H](NC(=O)Nc2cccc(-c3nn[n-]n3)c2)C2CC2)ccc1F ZINC000826262605 607977558 /nfs/dbraw/zinc/97/75/58/607977558.db2.gz SYJJKTKRLQWJFW-QGZVFWFLSA-N -1 3 366.400 3.587 20 0 FHADHM CC(C)N(Cc1csc(C2CC2)n1)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000824293093 607983433 /nfs/dbraw/zinc/98/34/33/607983433.db2.gz FKQJRLYNNUAXQQ-UHFFFAOYSA-N -1 3 354.483 3.611 20 0 FHADHM CC(C)N(Cc1csc(C2CC2)n1)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000824293093 607983434 /nfs/dbraw/zinc/98/34/34/607983434.db2.gz FKQJRLYNNUAXQQ-UHFFFAOYSA-N -1 3 354.483 3.611 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)Nc1ccc(F)cc1-c1nnn[n-]1 ZINC000823943186 608005890 /nfs/dbraw/zinc/00/58/90/608005890.db2.gz OVVWGTYZGRABSK-CSKARUKUSA-N -1 3 357.776 3.701 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)Nc1ccc(F)cc1-c1nn[n-]n1 ZINC000823943186 608005891 /nfs/dbraw/zinc/00/58/91/608005891.db2.gz OVVWGTYZGRABSK-CSKARUKUSA-N -1 3 357.776 3.701 20 0 FHADHM FC(F)(F)c1cc(-c2nn[n-]n2)ccc1N1CCc2ccsc2C1 ZINC000826368401 608018972 /nfs/dbraw/zinc/01/89/72/608018972.db2.gz OCAMCSQFQBTWKG-UHFFFAOYSA-N -1 3 351.357 3.510 20 0 FHADHM C[C@H](NC(=O)c1cccc(-c2ccoc2)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824521239 608025648 /nfs/dbraw/zinc/02/56/48/608025648.db2.gz IOBZYYJIQVFGDH-ZDUSSCGKSA-N -1 3 359.389 3.618 20 0 FHADHM C[C@H](NC(=O)c1cccc(-c2ccoc2)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824521239 608025649 /nfs/dbraw/zinc/02/56/49/608025649.db2.gz IOBZYYJIQVFGDH-ZDUSSCGKSA-N -1 3 359.389 3.618 20 0 FHADHM CCN(CC)C(=O)c1ccc(Oc2ccccc2-c2nnn[n-]2)c(Cl)c1 ZINC000825406584 608046995 /nfs/dbraw/zinc/04/69/95/608046995.db2.gz PNSLRYCAWNZXFZ-UHFFFAOYSA-N -1 3 371.828 3.794 20 0 FHADHM CCN(CC)C(=O)c1ccc(Oc2ccccc2-c2nn[n-]n2)c(Cl)c1 ZINC000825406584 608046996 /nfs/dbraw/zinc/04/69/96/608046996.db2.gz PNSLRYCAWNZXFZ-UHFFFAOYSA-N -1 3 371.828 3.794 20 0 FHADHM C[C@@H](c1ccccc1Cl)N1CCO[C@@H](c2cccc(-c3nnn[n-]3)c2)C1 ZINC000824772608 608066138 /nfs/dbraw/zinc/06/61/38/608066138.db2.gz VRNKGADFIMEQGL-SCLBCKFNSA-N -1 3 369.856 3.655 20 0 FHADHM C[C@@H](c1ccccc1Cl)N1CCO[C@@H](c2cccc(-c3nn[n-]n3)c2)C1 ZINC000824772608 608066139 /nfs/dbraw/zinc/06/61/39/608066139.db2.gz VRNKGADFIMEQGL-SCLBCKFNSA-N -1 3 369.856 3.655 20 0 FHADHM Fc1cccc(N2CCCC[C@@H]2c2nc3ccccc3o2)c1-c1nnn[n-]1 ZINC000826377425 608077471 /nfs/dbraw/zinc/07/74/71/608077471.db2.gz RMPOSMRLOZVNKD-OAHLLOKOSA-N -1 3 364.384 3.879 20 0 FHADHM Fc1cccc(N2CCCC[C@@H]2c2nc3ccccc3o2)c1-c1nn[n-]n1 ZINC000826377425 608077472 /nfs/dbraw/zinc/07/74/72/608077472.db2.gz RMPOSMRLOZVNKD-OAHLLOKOSA-N -1 3 364.384 3.879 20 0 FHADHM COc1ccccc1[C@@H]1CCCCN1c1cccc(F)c1-c1nnn[n-]1 ZINC000826218892 608124173 /nfs/dbraw/zinc/12/41/73/608124173.db2.gz NQBKNOKEZHPYCF-HNNXBMFYSA-N -1 3 353.401 3.746 20 0 FHADHM COc1ccccc1[C@@H]1CCCCN1c1cccc(F)c1-c1nn[n-]n1 ZINC000826218892 608124174 /nfs/dbraw/zinc/12/41/74/608124174.db2.gz NQBKNOKEZHPYCF-HNNXBMFYSA-N -1 3 353.401 3.746 20 0 FHADHM Cc1cc([C@@H]2CN(c3ccc(-c4nnn[n-]4)c(Cl)c3)CCO2)ccc1F ZINC000826266157 608153501 /nfs/dbraw/zinc/15/35/01/608153501.db2.gz DWXWUEKNNLBMOQ-KRWDZBQOSA-N -1 3 373.819 3.546 20 0 FHADHM Cc1cc([C@@H]2CN(c3ccc(-c4nn[n-]n4)c(Cl)c3)CCO2)ccc1F ZINC000826266157 608153502 /nfs/dbraw/zinc/15/35/02/608153502.db2.gz DWXWUEKNNLBMOQ-KRWDZBQOSA-N -1 3 373.819 3.546 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)c1cc(F)c(Cl)cc1F ZINC000826452767 608160581 /nfs/dbraw/zinc/16/05/81/608160581.db2.gz HVWBMJIDAQZYHF-UHFFFAOYSA-N -1 3 370.146 3.704 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)c1cc(F)c(Cl)cc1F ZINC000826452767 608160583 /nfs/dbraw/zinc/16/05/83/608160583.db2.gz HVWBMJIDAQZYHF-UHFFFAOYSA-N -1 3 370.146 3.704 20 0 FHADHM CC[C@H](Oc1cccc(C)c1)C(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000825159155 608182603 /nfs/dbraw/zinc/18/26/03/608182603.db2.gz KDWKXEFCXLHLMV-KSSFIOAISA-N -1 3 366.421 3.637 20 0 FHADHM CC[C@H](Oc1cccc(C)c1)C(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000825159155 608182605 /nfs/dbraw/zinc/18/26/05/608182605.db2.gz KDWKXEFCXLHLMV-KSSFIOAISA-N -1 3 366.421 3.637 20 0 FHADHM C[C@H](OC(=O)c1sccc1-c1nnn[n-]1)c1ccc(F)cc1Cl ZINC000826232359 608185899 /nfs/dbraw/zinc/18/58/99/608185899.db2.gz FJYVATUMKQLHFD-ZETCQYMHSA-N -1 3 352.778 3.639 20 0 FHADHM O=C(N[C@@H]1CC12CCCCC2)c1c(Cl)cc(-c2nnn[n-]2)cc1Cl ZINC000826428700 608198939 /nfs/dbraw/zinc/19/89/39/608198939.db2.gz IWSKUVXTMVGFKB-GFCCVEGCSA-N -1 3 366.252 3.626 20 0 FHADHM O=C(N[C@@H]1CC12CCCCC2)c1c(Cl)cc(-c2nn[n-]n2)cc1Cl ZINC000826428700 608198940 /nfs/dbraw/zinc/19/89/40/608198940.db2.gz IWSKUVXTMVGFKB-GFCCVEGCSA-N -1 3 366.252 3.626 20 0 FHADHM COc1ccc(C=O)cc1CSc1cccc(Cl)c1-c1nnn[n-]1 ZINC000826190937 608207537 /nfs/dbraw/zinc/20/75/37/608207537.db2.gz RIWKFVVJRKCACR-UHFFFAOYSA-N -1 3 360.826 3.634 20 0 FHADHM COc1ccc(C=O)cc1CSc1cccc(Cl)c1-c1nn[n-]n1 ZINC000826190937 608207538 /nfs/dbraw/zinc/20/75/38/608207538.db2.gz RIWKFVVJRKCACR-UHFFFAOYSA-N -1 3 360.826 3.634 20 0 FHADHM FC(F)(F)COCCCSc1cccc(Cl)c1-c1nnn[n-]1 ZINC000826367969 608207713 /nfs/dbraw/zinc/20/77/13/608207713.db2.gz WMPCFHOUFBGARE-UHFFFAOYSA-N -1 3 352.769 3.581 20 0 FHADHM FC(F)(F)COCCCSc1cccc(Cl)c1-c1nn[n-]n1 ZINC000826367969 608207715 /nfs/dbraw/zinc/20/77/15/608207715.db2.gz WMPCFHOUFBGARE-UHFFFAOYSA-N -1 3 352.769 3.581 20 0 FHADHM Cc1cccc2oc(CCNc3ccc4cc(-c5nnn[n-]5)ccc4n3)nc21 ZINC000826304931 608230533 /nfs/dbraw/zinc/23/05/33/608230533.db2.gz DWBHMKOBIBJLFC-UHFFFAOYSA-N -1 3 371.404 3.519 20 0 FHADHM Cc1cccc2oc(CCNc3ccc4cc(-c5nn[n-]n5)ccc4n3)nc21 ZINC000826304931 608230534 /nfs/dbraw/zinc/23/05/34/608230534.db2.gz DWBHMKOBIBJLFC-UHFFFAOYSA-N -1 3 371.404 3.519 20 0 FHADHM Cc1cnc([C@H](Nc2ccc3cc(-c4nnn[n-]4)ccc3n2)C2CC2)s1 ZINC000826317440 608231018 /nfs/dbraw/zinc/23/10/18/608231018.db2.gz CURONSWFYFQPEG-MRXNPFEDSA-N -1 3 363.450 3.743 20 0 FHADHM Cc1cnc([C@H](Nc2ccc3cc(-c4nn[n-]n4)ccc3n2)C2CC2)s1 ZINC000826317440 608231020 /nfs/dbraw/zinc/23/10/20/608231020.db2.gz CURONSWFYFQPEG-MRXNPFEDSA-N -1 3 363.450 3.743 20 0 FHADHM C[C@@H](Nc1ccc2cc(-c3nnn[n-]3)ccc2n1)c1ccc(F)cc1F ZINC000824658655 608231435 /nfs/dbraw/zinc/23/14/35/608231435.db2.gz ZSGIPVQUJATUQS-SNVBAGLBSA-N -1 3 352.348 3.866 20 0 FHADHM C[C@@H](Nc1ccc2cc(-c3nn[n-]n3)ccc2n1)c1ccc(F)cc1F ZINC000824658655 608231437 /nfs/dbraw/zinc/23/14/37/608231437.db2.gz ZSGIPVQUJATUQS-SNVBAGLBSA-N -1 3 352.348 3.866 20 0 FHADHM COc1ccc([C@@H](OC)[C@@H](C)Nc2ccc(Cl)cc2-c2nnn[n-]2)cc1 ZINC000826190084 608239673 /nfs/dbraw/zinc/23/96/73/608239673.db2.gz PIJHJWBPXCQINY-DIFFPNOSSA-N -1 3 373.844 3.717 20 0 FHADHM COc1ccc([C@@H](OC)[C@@H](C)Nc2ccc(Cl)cc2-c2nn[n-]n2)cc1 ZINC000826190084 608239674 /nfs/dbraw/zinc/23/96/74/608239674.db2.gz PIJHJWBPXCQINY-DIFFPNOSSA-N -1 3 373.844 3.717 20 0 FHADHM Cc1cccc([C@@H](NCc2cc(-c3nnn[n-]3)cs2)c2ccccn2)c1 ZINC000826296544 608241545 /nfs/dbraw/zinc/24/15/45/608241545.db2.gz AQASSNKANTYFES-GOSISDBHSA-N -1 3 362.462 3.511 20 0 FHADHM Cc1cccc([C@@H](NCc2cc(-c3nn[n-]n3)cs2)c2ccccn2)c1 ZINC000826296544 608241546 /nfs/dbraw/zinc/24/15/46/608241546.db2.gz AQASSNKANTYFES-GOSISDBHSA-N -1 3 362.462 3.511 20 0 FHADHM CC(C)[C@@H]1C[C@@H](Nc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)CCO1 ZINC000824213323 608242408 /nfs/dbraw/zinc/24/24/08/608242408.db2.gz ABGRSIJQFRGLOL-FZMZJTMJSA-N -1 3 355.364 3.501 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccc2[nH]ccc2c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824716576 608247601 /nfs/dbraw/zinc/24/76/01/608247601.db2.gz YGMWBTUSMJAHCP-ZCMXANCESA-N -1 3 359.389 3.666 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccc2[nH]ccc2c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824716576 608247603 /nfs/dbraw/zinc/24/76/03/608247603.db2.gz YGMWBTUSMJAHCP-ZCMXANCESA-N -1 3 359.389 3.666 20 0 FHADHM CC(C)(C)c1ccc2c(c1)CCCN2C(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000824135560 608251040 /nfs/dbraw/zinc/25/10/40/608251040.db2.gz GKTCWYORRBRSET-UHFFFAOYSA-N -1 3 361.449 3.757 20 0 FHADHM CC(C)(C)c1ccc2c(c1)CCCN2C(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC000824135560 608251041 /nfs/dbraw/zinc/25/10/41/608251041.db2.gz GKTCWYORRBRSET-UHFFFAOYSA-N -1 3 361.449 3.757 20 0 FHADHM C[C@H]1CCC[C@H](OCCCCCC(=O)Nc2cccc(-c3nnn[n-]3)c2)C1 ZINC000160668635 608261739 /nfs/dbraw/zinc/26/17/39/608261739.db2.gz YFOIJXMWRCUGKV-YJBOKZPZSA-N -1 3 371.485 3.961 20 0 FHADHM C[C@H]1CCC[C@H](OCCCCCC(=O)Nc2cccc(-c3nn[n-]n3)c2)C1 ZINC000160668635 608261742 /nfs/dbraw/zinc/26/17/42/608261742.db2.gz YFOIJXMWRCUGKV-YJBOKZPZSA-N -1 3 371.485 3.961 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N[C@@H]1CCCc2cc(F)ccc21 ZINC000826278104 608273080 /nfs/dbraw/zinc/27/30/80/608273080.db2.gz RFSDUZDMNQHREE-MRXNPFEDSA-N -1 3 366.400 3.513 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N[C@@H]1CCCc2cc(F)ccc21 ZINC000826278104 608273082 /nfs/dbraw/zinc/27/30/82/608273082.db2.gz RFSDUZDMNQHREE-MRXNPFEDSA-N -1 3 366.400 3.513 20 0 FHADHM COc1ccc(Cl)cc1[C@H](C)NCc1cc(-c2nn[n-]n2)ccc1F ZINC000826208488 608284697 /nfs/dbraw/zinc/28/46/97/608284697.db2.gz MYYXCIJGWQRREN-JTQLQIEISA-N -1 3 361.808 3.519 20 0 FHADHM Clc1cnc(NCc2ccc(-c3ccccc3-c3nnn[n-]3)cc2)nc1 ZINC000826353716 608294337 /nfs/dbraw/zinc/29/43/37/608294337.db2.gz BHKCSLSGFKVQCL-UHFFFAOYSA-N -1 3 363.812 3.589 20 0 FHADHM Clc1cnc(NCc2ccc(-c3ccccc3-c3nn[n-]n3)cc2)nc1 ZINC000826353716 608294338 /nfs/dbraw/zinc/29/43/38/608294338.db2.gz BHKCSLSGFKVQCL-UHFFFAOYSA-N -1 3 363.812 3.589 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)[C@H](c1ccccc1)C1CC1 ZINC000826453151 608311901 /nfs/dbraw/zinc/31/19/01/608311901.db2.gz YFUZKFAGSXAAKS-MRXNPFEDSA-N -1 3 353.813 3.652 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)[C@H](c1ccccc1)C1CC1 ZINC000826453151 608311902 /nfs/dbraw/zinc/31/19/02/608311902.db2.gz YFUZKFAGSXAAKS-MRXNPFEDSA-N -1 3 353.813 3.652 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CNc1ccccc1CC(F)(F)F ZINC000826170722 608320481 /nfs/dbraw/zinc/32/04/81/608320481.db2.gz MXSIWALEARBJKP-UHFFFAOYSA-N -1 3 363.343 3.592 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CNc1ccccc1CC(F)(F)F ZINC000826170722 608320483 /nfs/dbraw/zinc/32/04/83/608320483.db2.gz MXSIWALEARBJKP-UHFFFAOYSA-N -1 3 363.343 3.592 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CNc1cccc(CC(F)(F)F)c1 ZINC000826170591 608321036 /nfs/dbraw/zinc/32/10/36/608321036.db2.gz HDHWJOAJAZSACP-UHFFFAOYSA-N -1 3 363.343 3.592 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CNc1cccc(CC(F)(F)F)c1 ZINC000826170591 608321038 /nfs/dbraw/zinc/32/10/38/608321038.db2.gz HDHWJOAJAZSACP-UHFFFAOYSA-N -1 3 363.343 3.592 20 0 FHADHM CS[C@@H](C)CCC(=O)Nc1sc2c(c1-c1nnn[n-]1)CC[C@H](C)C2 ZINC000826225620 608338843 /nfs/dbraw/zinc/33/88/43/608338843.db2.gz GPNFCQMCFBCUGF-UWVGGRQHSA-N -1 3 365.528 3.523 20 0 FHADHM CS[C@@H](C)CCC(=O)Nc1sc2c(c1-c1nn[n-]n1)CC[C@H](C)C2 ZINC000826225620 608338844 /nfs/dbraw/zinc/33/88/44/608338844.db2.gz GPNFCQMCFBCUGF-UWVGGRQHSA-N -1 3 365.528 3.523 20 0 FHADHM CCC[C@H](C)NC(=O)NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000825234061 608342087 /nfs/dbraw/zinc/34/20/87/608342087.db2.gz VZGYLHKMEVUVOB-AWEZNQCLSA-N -1 3 364.453 3.522 20 0 FHADHM CCC[C@H](C)NC(=O)NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000825234061 608342089 /nfs/dbraw/zinc/34/20/89/608342089.db2.gz VZGYLHKMEVUVOB-AWEZNQCLSA-N -1 3 364.453 3.522 20 0 FHADHM CCN(C(=O)c1ccc(C)cc1F)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825379882 608345241 /nfs/dbraw/zinc/34/52/41/608345241.db2.gz LCRWCSIZCINNBP-UHFFFAOYSA-N -1 3 359.792 3.634 20 0 FHADHM CCN(C(=O)c1ccc(C)cc1F)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825379882 608345243 /nfs/dbraw/zinc/34/52/43/608345243.db2.gz LCRWCSIZCINNBP-UHFFFAOYSA-N -1 3 359.792 3.634 20 0 FHADHM CCc1cc(C)c(C(=O)N(CC)c2ccc(-c3nnn[n-]3)c(Cl)c2)o1 ZINC000825700685 608346060 /nfs/dbraw/zinc/34/60/60/608346060.db2.gz PJQJJHHYUSHTPO-UHFFFAOYSA-N -1 3 359.817 3.651 20 0 FHADHM CCc1cc(C)c(C(=O)N(CC)c2ccc(-c3nn[n-]n3)c(Cl)c2)o1 ZINC000825700685 608346061 /nfs/dbraw/zinc/34/60/61/608346061.db2.gz PJQJJHHYUSHTPO-UHFFFAOYSA-N -1 3 359.817 3.651 20 0 FHADHM C[C@H](NC(=S)Nc1ccccc1-c1nnn[n-]1)c1ccccc1Cl ZINC000826232235 608388985 /nfs/dbraw/zinc/38/89/85/608388985.db2.gz JLBSBWXQMAMNMG-JTQLQIEISA-N -1 3 358.858 3.568 20 0 FHADHM C[C@H](NC(=S)Nc1ccccc1-c1nn[n-]n1)c1ccccc1Cl ZINC000826232235 608388987 /nfs/dbraw/zinc/38/89/87/608388987.db2.gz JLBSBWXQMAMNMG-JTQLQIEISA-N -1 3 358.858 3.568 20 0 FHADHM Cc1cccc(-c2nnc(SCc3cccc(-c4nnn[n-]4)c3F)o2)c1 ZINC000826295630 608394577 /nfs/dbraw/zinc/39/45/77/608394577.db2.gz QHERSBAYZMHVSA-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM Cc1cccc(-c2nnc(SCc3cccc(-c4nn[n-]n4)c3F)o2)c1 ZINC000826295630 608394579 /nfs/dbraw/zinc/39/45/79/608394579.db2.gz QHERSBAYZMHVSA-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM Fc1c(CSc2nnc(-c3ccccc3)s2)cccc1-c1nnn[n-]1 ZINC000826371830 608397394 /nfs/dbraw/zinc/39/73/94/608397394.db2.gz WIOMHIYGDOASBG-UHFFFAOYSA-N -1 3 370.438 3.817 20 0 FHADHM Fc1c(CSc2nnc(-c3ccccc3)s2)cccc1-c1nn[n-]n1 ZINC000826371830 608397396 /nfs/dbraw/zinc/39/73/96/608397396.db2.gz WIOMHIYGDOASBG-UHFFFAOYSA-N -1 3 370.438 3.817 20 0 FHADHM O=C(OCc1cccc(-c2nnn[n-]2)c1F)[C@@H]1C[C@@H]1c1cccc(Cl)c1 ZINC000826465991 608445230 /nfs/dbraw/zinc/44/52/30/608445230.db2.gz LAEWQHWAPOZMNX-HUUCEWRRSA-N -1 3 372.787 3.506 20 0 FHADHM O=C(OCc1cccc(-c2nn[n-]n2)c1F)[C@@H]1C[C@@H]1c1cccc(Cl)c1 ZINC000826465991 608445233 /nfs/dbraw/zinc/44/52/33/608445233.db2.gz LAEWQHWAPOZMNX-HUUCEWRRSA-N -1 3 372.787 3.506 20 0 FHADHM CC(C)Oc1ccccc1[C@H](C)NCc1cccc(-c2nnn[n-]2)c1F ZINC000824333000 608452250 /nfs/dbraw/zinc/45/22/50/608452250.db2.gz CHCGLYONAJGEKM-ZDUSSCGKSA-N -1 3 355.417 3.644 20 0 FHADHM C[C@@H](NCc1ncc(-c2cccc(F)c2)o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824634247 608459265 /nfs/dbraw/zinc/45/92/65/608459265.db2.gz UIIAYDCEFXCGQH-GFCCVEGCSA-N -1 3 364.384 3.512 20 0 FHADHM C[C@@H](NCc1ncc(-c2cccc(F)c2)o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824634247 608459266 /nfs/dbraw/zinc/45/92/66/608459266.db2.gz UIIAYDCEFXCGQH-GFCCVEGCSA-N -1 3 364.384 3.512 20 0 FHADHM c1ccc2sc(CN3CC=C(c4ccc(-c5nn[n-]n5)cc4)CC3)nc2c1 ZINC000823868402 608463008 /nfs/dbraw/zinc/46/30/08/608463008.db2.gz ZQLCIMIJRLGGMJ-UHFFFAOYSA-N -1 3 374.473 3.766 20 0 FHADHM CC(C)CCc1nc(CN[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cs1 ZINC000824249176 608466082 /nfs/dbraw/zinc/46/60/82/608466082.db2.gz JLHMWDRUMJIRKX-CYBMUJFWSA-N -1 3 356.499 3.763 20 0 FHADHM CC(C)CCc1nc(CN[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cs1 ZINC000824249177 608466354 /nfs/dbraw/zinc/46/63/54/608466354.db2.gz JLHMWDRUMJIRKX-ZDUSSCGKSA-N -1 3 356.499 3.763 20 0 FHADHM Cc1ccc(-c2cnc(CN[C@@H](C)c3ccc(-c4nnn[n-]4)cc3)o2)cc1 ZINC000826273611 608467167 /nfs/dbraw/zinc/46/71/67/608467167.db2.gz MQCSFUWCTIFRHZ-AWEZNQCLSA-N -1 3 360.421 3.681 20 0 FHADHM Cc1ccc(-c2cnc(CN[C@@H](C)c3ccc(-c4nn[n-]n4)cc3)o2)cc1 ZINC000826273611 608467168 /nfs/dbraw/zinc/46/71/68/608467168.db2.gz MQCSFUWCTIFRHZ-AWEZNQCLSA-N -1 3 360.421 3.681 20 0 FHADHM CCCc1nc(CN2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)cs1 ZINC000825352370 608467396 /nfs/dbraw/zinc/46/73/96/608467396.db2.gz MTDQQWXUUKVADU-UHFFFAOYSA-N -1 3 366.494 3.565 20 0 FHADHM CCCc1nc(CN2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)cs1 ZINC000825352370 608467397 /nfs/dbraw/zinc/46/73/97/608467397.db2.gz MTDQQWXUUKVADU-UHFFFAOYSA-N -1 3 366.494 3.565 20 0 FHADHM Cc1oc(-c2cccs2)nc1CN[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000826340605 608468245 /nfs/dbraw/zinc/46/82/45/608468245.db2.gz DVFDCWALOQSKEJ-LLVKDONJSA-N -1 3 366.450 3.742 20 0 FHADHM Cc1oc(-c2ccsc2)nc1CN[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000826340885 608481273 /nfs/dbraw/zinc/48/12/73/608481273.db2.gz OGPOYPNVKUWYES-LLVKDONJSA-N -1 3 366.450 3.742 20 0 FHADHM c1c(CN[C@H]2CCCc3cc(-c4nn[n-]n4)ccc32)noc1-c1ccccc1 ZINC000826518923 608508416 /nfs/dbraw/zinc/50/84/16/608508416.db2.gz CQJPCRXRMTWGDV-IBGZPJMESA-N -1 3 372.432 3.689 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)Cc1cc(F)c(F)cc1F ZINC000824293675 608532166 /nfs/dbraw/zinc/53/21/66/608532166.db2.gz WJPUWENQSXMRGE-UHFFFAOYSA-N -1 3 361.371 3.695 20 0 FHADHM Fc1ccc([C@@H](CC(F)(F)F)NCc2ccc(-c3nnn[n-]3)s2)cc1 ZINC000826373457 608569471 /nfs/dbraw/zinc/56/94/71/608569471.db2.gz MUSKHBZYEIYPJV-GFCCVEGCSA-N -1 3 371.363 3.851 20 0 FHADHM CCCOc1ccccc1NC(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000825341940 608573383 /nfs/dbraw/zinc/57/33/83/608573383.db2.gz MVNWEJBWVFXWOE-UHFFFAOYSA-N -1 3 357.801 3.561 20 0 FHADHM CCCOc1ccccc1NC(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000825341940 608573385 /nfs/dbraw/zinc/57/33/85/608573385.db2.gz MVNWEJBWVFXWOE-UHFFFAOYSA-N -1 3 357.801 3.561 20 0 FHADHM O=C(c1ccc(Cl)c(-c2nnn[n-]2)c1)N1CCCCc2ccccc21 ZINC000826473360 608576190 /nfs/dbraw/zinc/57/61/90/608576190.db2.gz UYNSKKKUACQPRY-UHFFFAOYSA-N -1 3 353.813 3.503 20 0 FHADHM O=C(c1ccc(Cl)c(-c2nn[n-]n2)c1)N1CCCCc2ccccc21 ZINC000826473360 608576191 /nfs/dbraw/zinc/57/61/91/608576191.db2.gz UYNSKKKUACQPRY-UHFFFAOYSA-N -1 3 353.813 3.503 20 0 FHADHM Cc1cccc(NC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)c1F ZINC000826298982 608591545 /nfs/dbraw/zinc/59/15/45/608591545.db2.gz NACAOCYZQSRGKP-UHFFFAOYSA-N -1 3 369.400 3.502 20 0 FHADHM Cc1cccc(NC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)c1F ZINC000826298982 608591547 /nfs/dbraw/zinc/59/15/47/608591547.db2.gz NACAOCYZQSRGKP-UHFFFAOYSA-N -1 3 369.400 3.502 20 0 FHADHM Brc1ccc([C@H]2CCCN2Cc2ccc(-c3nnn[n-]3)o2)cc1 ZINC000823826322 608613550 /nfs/dbraw/zinc/61/35/50/608613550.db2.gz HMRWZGXLOQJVHG-CQSZACIVSA-N -1 3 374.242 3.559 20 0 FHADHM Brc1ccc([C@H]2CCCN2Cc2ccc(-c3nn[n-]n3)o2)cc1 ZINC000823826322 608613552 /nfs/dbraw/zinc/61/35/52/608613552.db2.gz HMRWZGXLOQJVHG-CQSZACIVSA-N -1 3 374.242 3.559 20 0 FHADHM C[C@@H](Nc1cnccc1-c1nnn[n-]1)c1cc(F)c(Cl)cc1Cl ZINC000824663242 608767752 /nfs/dbraw/zinc/76/77/52/608767752.db2.gz XBMVIWNHGBFUDS-SSDOTTSWSA-N -1 3 353.188 3.881 20 0 FHADHM C[C@@H](Nc1cnccc1-c1nn[n-]n1)c1cc(F)c(Cl)cc1Cl ZINC000824663242 608767753 /nfs/dbraw/zinc/76/77/53/608767753.db2.gz XBMVIWNHGBFUDS-SSDOTTSWSA-N -1 3 353.188 3.881 20 0 FHADHM CCCCOc1ccc([C@@H](C)Nc2cnccc2-c2nnn[n-]2)cc1OC ZINC000825290656 608774543 /nfs/dbraw/zinc/77/45/43/608774543.db2.gz DBFMUBASIDIHCW-CYBMUJFWSA-N -1 3 368.441 3.622 20 0 FHADHM CCCCOc1ccc([C@@H](C)Nc2cnccc2-c2nn[n-]n2)cc1OC ZINC000825290656 608774546 /nfs/dbraw/zinc/77/45/46/608774546.db2.gz DBFMUBASIDIHCW-CYBMUJFWSA-N -1 3 368.441 3.622 20 0 FHADHM C[C@@H](N[C@@H](c1ccccc1)c1cccnc1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824537420 609139554 /nfs/dbraw/zinc/13/95/54/609139554.db2.gz DXKYXNQJWFUKPR-VLIAUNLRSA-N -1 3 374.423 3.841 20 0 FHADHM C[C@@H](N[C@@H](c1ccccc1)c1cccnc1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824537420 609139555 /nfs/dbraw/zinc/13/95/55/609139555.db2.gz DXKYXNQJWFUKPR-VLIAUNLRSA-N -1 3 374.423 3.841 20 0 FHADHM C[C@@H](NCc1coc(-c2ccccc2)n1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824626663 609146503 /nfs/dbraw/zinc/14/65/03/609146503.db2.gz QSLYCARBYLSESS-GFCCVEGCSA-N -1 3 364.384 3.512 20 0 FHADHM C[C@@H](NCc1coc(-c2ccccc2)n1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824626663 609146505 /nfs/dbraw/zinc/14/65/05/609146505.db2.gz QSLYCARBYLSESS-GFCCVEGCSA-N -1 3 364.384 3.512 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@H]2/C=C\c2ccccc2)cccc1-c1nnn[n-]1 ZINC000826241354 609160008 /nfs/dbraw/zinc/16/00/08/609160008.db2.gz ANGCVWHULUTBCV-QOHRORDFSA-N -1 3 374.448 3.885 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@H]2/C=C\c2ccccc2)cccc1-c1nn[n-]n1 ZINC000826241354 609160009 /nfs/dbraw/zinc/16/00/09/609160009.db2.gz ANGCVWHULUTBCV-QOHRORDFSA-N -1 3 374.448 3.885 20 0 FHADHM CC(=O)Nc1ccc(N[C@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)cc1Cl ZINC000823999842 609163955 /nfs/dbraw/zinc/16/39/55/609163955.db2.gz JFGNGBLQRVFGAD-SECBINFHSA-N -1 3 374.807 3.791 20 0 FHADHM CC(=O)Nc1ccc(N[C@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)cc1Cl ZINC000823999842 609163956 /nfs/dbraw/zinc/16/39/56/609163956.db2.gz JFGNGBLQRVFGAD-SECBINFHSA-N -1 3 374.807 3.791 20 0 FHADHM CC(C)C[C@@H]1C[C@@H](Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)CCO1 ZINC000824243625 609170838 /nfs/dbraw/zinc/17/08/38/609170838.db2.gz KSHWWBSCVWTGAT-QWHCGFSZSA-N -1 3 369.391 3.891 20 0 FHADHM CC(C)C[C@@H]1C[C@@H](Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)CCO1 ZINC000824243625 609170840 /nfs/dbraw/zinc/17/08/40/609170840.db2.gz KSHWWBSCVWTGAT-QWHCGFSZSA-N -1 3 369.391 3.891 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)CCc2cc(C)cc(C)c2)s1 ZINC000825694551 609176268 /nfs/dbraw/zinc/17/62/68/609176268.db2.gz TZKDPFUJYOIRSL-UHFFFAOYSA-N -1 3 355.467 3.679 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)CCc2cc(C)cc(C)c2)s1 ZINC000825694551 609176270 /nfs/dbraw/zinc/17/62/70/609176270.db2.gz TZKDPFUJYOIRSL-UHFFFAOYSA-N -1 3 355.467 3.679 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NCc1ncc(-c2cccs2)o1 ZINC000825480604 609177521 /nfs/dbraw/zinc/17/75/21/609177521.db2.gz CDUSNTWXCZIYDK-UHFFFAOYSA-N -1 3 367.438 3.627 20 0 FHADHM CCOC(=O)N(C)c1ccc(N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000825517389 609180408 /nfs/dbraw/zinc/18/04/08/609180408.db2.gz BLEYJPVKKVRTIW-ZDUSSCGKSA-N -1 3 366.425 3.633 20 0 FHADHM CCOC(=O)N(C)c1ccc(N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000825517389 609180409 /nfs/dbraw/zinc/18/04/09/609180409.db2.gz BLEYJPVKKVRTIW-ZDUSSCGKSA-N -1 3 366.425 3.633 20 0 FHADHM Cc1cc(NCc2ccc(-c3nnn[n-]3)cc2)nn1-c1cc(C)cc(C)c1 ZINC000826264156 609180734 /nfs/dbraw/zinc/18/07/34/609180734.db2.gz DSJYRSUHPGAJAU-UHFFFAOYSA-N -1 3 359.437 3.590 20 0 FHADHM Cc1cc(NCc2ccc(-c3nn[n-]n3)cc2)nn1-c1cc(C)cc(C)c1 ZINC000826264156 609180735 /nfs/dbraw/zinc/18/07/35/609180735.db2.gz DSJYRSUHPGAJAU-UHFFFAOYSA-N -1 3 359.437 3.590 20 0 FHADHM Cc1cc(NCc2cc(-c3nnn[n-]3)cs2)nn1-c1ccccc1Cl ZINC000826271063 609187927 /nfs/dbraw/zinc/18/79/27/609187927.db2.gz ANZZCAQELNVMMK-UHFFFAOYSA-N -1 3 371.857 3.688 20 0 FHADHM Cc1cc(NCc2cc(-c3nn[n-]n3)cs2)nn1-c1ccccc1Cl ZINC000826271063 609187929 /nfs/dbraw/zinc/18/79/29/609187929.db2.gz ANZZCAQELNVMMK-UHFFFAOYSA-N -1 3 371.857 3.688 20 0 FHADHM Cc1cccc(-c2n[nH]cc2CNc2ccc(Cl)c(-c3nnn[n-]3)c2)c1 ZINC000826295792 609200160 /nfs/dbraw/zinc/20/01/60/609200160.db2.gz XWGCZDPSNAVEES-UHFFFAOYSA-N -1 3 365.828 3.831 20 0 FHADHM Cc1cccc(-c2n[nH]cc2CNc2ccc(Cl)c(-c3nn[n-]n3)c2)c1 ZINC000826295792 609200161 /nfs/dbraw/zinc/20/01/61/609200161.db2.gz XWGCZDPSNAVEES-UHFFFAOYSA-N -1 3 365.828 3.831 20 0 FHADHM C[C@@H](Nc1ccc2c(cnn2C(F)F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824657182 609279151 /nfs/dbraw/zinc/27/91/51/609279151.db2.gz PGUAHZQZMRWIFY-SNVBAGLBSA-N -1 3 355.352 3.785 20 0 FHADHM C[C@@H](Nc1ccc2c(cnn2C(F)F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824657182 609279152 /nfs/dbraw/zinc/27/91/52/609279152.db2.gz PGUAHZQZMRWIFY-SNVBAGLBSA-N -1 3 355.352 3.785 20 0 FHADHM Cc1cnn(-c2ccc(N[C@H](C)c3cccc(-c4nnn[n-]4)c3)cc2F)c1 ZINC000826319657 609280322 /nfs/dbraw/zinc/28/03/22/609280322.db2.gz MGEPTFJJLIQXBC-CYBMUJFWSA-N -1 3 363.400 3.673 20 0 FHADHM Cc1cnn(-c2ccc(N[C@H](C)c3cccc(-c4nn[n-]n4)c3)cc2F)c1 ZINC000826319657 609280324 /nfs/dbraw/zinc/28/03/24/609280324.db2.gz MGEPTFJJLIQXBC-CYBMUJFWSA-N -1 3 363.400 3.673 20 0 FHADHM COc1cc(Br)cc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000826177029 609281504 /nfs/dbraw/zinc/28/15/04/609281504.db2.gz OTDSDBCENFBLDL-JTQLQIEISA-N -1 3 374.242 3.811 20 0 FHADHM COc1cc(Br)cc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000826177029 609281506 /nfs/dbraw/zinc/28/15/06/609281506.db2.gz OTDSDBCENFBLDL-JTQLQIEISA-N -1 3 374.242 3.811 20 0 FHADHM O=C(c1ccc(Cl)c(-c2nnn[n-]2)c1)N1CCC[C@H]1c1cccc(F)c1 ZINC000826473420 609290932 /nfs/dbraw/zinc/29/09/32/609290932.db2.gz XPUJJUCGRJGKLM-INIZCTEOSA-N -1 3 371.803 3.637 20 0 FHADHM O=C(c1ccc(Cl)c(-c2nn[n-]n2)c1)N1CCC[C@H]1c1cccc(F)c1 ZINC000826473420 609290933 /nfs/dbraw/zinc/29/09/33/609290933.db2.gz XPUJJUCGRJGKLM-INIZCTEOSA-N -1 3 371.803 3.637 20 0 FHADHM C[C@@H]1CCCCN1C(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000824935443 609303742 /nfs/dbraw/zinc/30/37/42/609303742.db2.gz BJQWTBBTVDZBPB-CQSZACIVSA-N -1 3 363.421 3.674 20 0 FHADHM C[C@@H]1CCCCN1C(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000824935443 609303743 /nfs/dbraw/zinc/30/37/43/609303743.db2.gz BJQWTBBTVDZBPB-CQSZACIVSA-N -1 3 363.421 3.674 20 0 FHADHM CCCCN(C)C(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000825281908 609311022 /nfs/dbraw/zinc/31/10/22/609311022.db2.gz NFHOJRBITWEITJ-UHFFFAOYSA-N -1 3 351.410 3.531 20 0 FHADHM CCCCN(C)C(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000825281908 609311024 /nfs/dbraw/zinc/31/10/24/609311024.db2.gz NFHOJRBITWEITJ-UHFFFAOYSA-N -1 3 351.410 3.531 20 0 FHADHM C[C@H](N[C@H]1CCOc2c(Cl)cccc21)c1ccc(-c2nn[n-]n2)cc1F ZINC000824554322 609329953 /nfs/dbraw/zinc/32/99/53/609329953.db2.gz OTKLZEIDAQZZII-QFYYESIMSA-N -1 3 373.819 3.834 20 0 FHADHM C[C@H](NCc1coc(-c2ccccc2)n1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824624588 609337188 /nfs/dbraw/zinc/33/71/88/609337188.db2.gz AJNSEDVXJIWRQB-LBPRGKRZSA-N -1 3 364.384 3.512 20 0 FHADHM C[C@H](NCc1coc(-c2ccccc2)n1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824624588 609337189 /nfs/dbraw/zinc/33/71/89/609337189.db2.gz AJNSEDVXJIWRQB-LBPRGKRZSA-N -1 3 364.384 3.512 20 0 FHADHM Cn1cc(CNc2ccc(Cl)cc2)c(-c2ccc(-c3nnn[n-]3)cc2)n1 ZINC000826361963 609343590 /nfs/dbraw/zinc/34/35/90/609343590.db2.gz XSBJQNFSQZUETG-UHFFFAOYSA-N -1 3 365.828 3.533 20 0 FHADHM Cn1cc(CNc2ccc(Cl)cc2)c(-c2ccc(-c3nn[n-]n3)cc2)n1 ZINC000826361963 609343591 /nfs/dbraw/zinc/34/35/91/609343591.db2.gz XSBJQNFSQZUETG-UHFFFAOYSA-N -1 3 365.828 3.533 20 0 FHADHM CCCCCn1cc(CN[C@H](C)c2ccc(-c3nn[n-]n3)cc2F)c(C)n1 ZINC000825276399 609345722 /nfs/dbraw/zinc/34/57/22/609345722.db2.gz XBYQPHOCGLEOPS-CQSZACIVSA-N -1 3 371.464 3.552 20 0 FHADHM CCOc1ccc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2F)cc1OCC ZINC000825643301 609346265 /nfs/dbraw/zinc/34/62/65/609346265.db2.gz LFSVZPMVNDUFDP-LBPRGKRZSA-N -1 3 371.416 3.976 20 0 FHADHM CCOc1ccc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2F)cc1OCC ZINC000825643301 609346267 /nfs/dbraw/zinc/34/62/67/609346267.db2.gz LFSVZPMVNDUFDP-LBPRGKRZSA-N -1 3 371.416 3.976 20 0 FHADHM FC(F)(F)[C@H](CCc1ccccc1)NCc1ccc(-c2nnn[n-]2)s1 ZINC000826367042 609346871 /nfs/dbraw/zinc/34/68/71/609346871.db2.gz JICAUWFADWYGFO-AWEZNQCLSA-N -1 3 367.400 3.582 20 0 FHADHM CCC(=O)Nc1ccc(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2F)cc1 ZINC000825034929 609348764 /nfs/dbraw/zinc/34/87/64/609348764.db2.gz ULPHOBDCVNCKJE-LLVKDONJSA-N -1 3 354.389 3.527 20 0 FHADHM CCC(=O)Nc1ccc(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000825034929 609348767 /nfs/dbraw/zinc/34/87/67/609348767.db2.gz ULPHOBDCVNCKJE-LLVKDONJSA-N -1 3 354.389 3.527 20 0 FHADHM C[C@H](Nc1ccc2c(cnn2C(F)F)c1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824656162 609349088 /nfs/dbraw/zinc/34/90/88/609349088.db2.gz IGVHFMVICZHWFF-VIFPVBQESA-N -1 3 373.342 3.924 20 0 FHADHM C[C@H](Nc1ccc2c(cnn2C(F)F)c1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824656162 609349089 /nfs/dbraw/zinc/34/90/89/609349089.db2.gz IGVHFMVICZHWFF-VIFPVBQESA-N -1 3 373.342 3.924 20 0 FHADHM Cc1c(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2F)cnn1-c1ccccc1 ZINC000826242348 609349700 /nfs/dbraw/zinc/34/97/00/609349700.db2.gz LITPKYNAHWXYDG-GFCCVEGCSA-N -1 3 363.400 3.673 20 0 FHADHM Cc1c(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2F)cnn1-c1ccccc1 ZINC000826242348 609349701 /nfs/dbraw/zinc/34/97/01/609349701.db2.gz LITPKYNAHWXYDG-GFCCVEGCSA-N -1 3 363.400 3.673 20 0 FHADHM COCCCOc1ccccc1N[C@H](C)c1ccc(-c2nnn[n-]2)cc1F ZINC000826157468 609349722 /nfs/dbraw/zinc/34/97/22/609349722.db2.gz WUMYNISMRAPXOY-CYBMUJFWSA-N -1 3 371.416 3.594 20 0 FHADHM COCCCOc1ccccc1N[C@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000826157468 609349724 /nfs/dbraw/zinc/34/97/24/609349724.db2.gz WUMYNISMRAPXOY-CYBMUJFWSA-N -1 3 371.416 3.594 20 0 FHADHM Brc1cc(-c2nn[n-]n2)ccc1CN1CCC[C@@H]1c1ccco1 ZINC000823821660 609361103 /nfs/dbraw/zinc/36/11/03/609361103.db2.gz XFTKJCXAAKTTJQ-CQSZACIVSA-N -1 3 374.242 3.559 20 0 FHADHM COc1cc(Nc2ncc(-c3nnn[n-]3)cc2Cl)cc(OC)c1C(C)C ZINC000826181123 609437652 /nfs/dbraw/zinc/43/76/52/609437652.db2.gz LUJVLHYEYTUNKZ-UHFFFAOYSA-N -1 3 374.832 3.799 20 0 FHADHM COc1cc(Nc2ncc(-c3nn[n-]n3)cc2Cl)cc(OC)c1C(C)C ZINC000826181123 609437654 /nfs/dbraw/zinc/43/76/54/609437654.db2.gz LUJVLHYEYTUNKZ-UHFFFAOYSA-N -1 3 374.832 3.799 20 0 FHADHM C[C@@H](NC(=O)NC(C)(C)C)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824492005 609441292 /nfs/dbraw/zinc/44/12/92/609441292.db2.gz WLFVSAXMFWNCBM-CYBMUJFWSA-N -1 3 364.453 3.692 20 0 FHADHM C[C@@H](NC(=O)NC(C)(C)C)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824492005 609441293 /nfs/dbraw/zinc/44/12/93/609441293.db2.gz WLFVSAXMFWNCBM-CYBMUJFWSA-N -1 3 364.453 3.692 20 0 FHADHM CC[C@H](C)NC(=O)N[C@H](C)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000825068446 609441359 /nfs/dbraw/zinc/44/13/59/609441359.db2.gz RUDJLNHTPWKRIS-UONOGXRCSA-N -1 3 364.453 3.692 20 0 FHADHM CC[C@H](C)NC(=O)N[C@H](C)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000825068446 609441361 /nfs/dbraw/zinc/44/13/61/609441361.db2.gz RUDJLNHTPWKRIS-UONOGXRCSA-N -1 3 364.453 3.692 20 0 FHADHM O=C(Nc1cccc(CCCc2ccccc2)c1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC000826456594 609455547 /nfs/dbraw/zinc/45/55/47/609455547.db2.gz NMMLSPXTBWSOIH-UHFFFAOYSA-N -1 3 372.432 3.622 20 0 FHADHM O=C(Nc1cccc(CCCc2ccccc2)c1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC000826456594 609455549 /nfs/dbraw/zinc/45/55/49/609455549.db2.gz NMMLSPXTBWSOIH-UHFFFAOYSA-N -1 3 372.432 3.622 20 0 FHADHM CC(C)(C)C(=O)c1ccc(NCc2cccc(-c3nnn[n-]3)c2F)cc1 ZINC000824072668 609477426 /nfs/dbraw/zinc/47/74/26/609477426.db2.gz XJQZAILDECYPJR-UHFFFAOYSA-N -1 3 353.401 3.847 20 0 FHADHM CC(C)(C)C(=O)c1ccc(NCc2cccc(-c3nn[n-]n3)c2F)cc1 ZINC000824072668 609477428 /nfs/dbraw/zinc/47/74/28/609477428.db2.gz XJQZAILDECYPJR-UHFFFAOYSA-N -1 3 353.401 3.847 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NCc1ccnc2ccccc12 ZINC000824324379 609479084 /nfs/dbraw/zinc/47/90/84/609479084.db2.gz NBAKXRCHZBXHFR-UHFFFAOYSA-N -1 3 360.421 3.814 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NCc1ccnc2ccccc12 ZINC000824324379 609479086 /nfs/dbraw/zinc/47/90/86/609479086.db2.gz NBAKXRCHZBXHFR-UHFFFAOYSA-N -1 3 360.421 3.814 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@@H](C)c1ccccc1 ZINC000824255456 609480043 /nfs/dbraw/zinc/48/00/43/609480043.db2.gz KLVKWGDMRDQBAK-INIZCTEOSA-N -1 3 363.465 3.655 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@@H](C)c1ccccc1 ZINC000824255456 609480045 /nfs/dbraw/zinc/48/00/45/609480045.db2.gz KLVKWGDMRDQBAK-INIZCTEOSA-N -1 3 363.465 3.655 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NCc1ccc(-c2ccncc2)cc1F ZINC000826278946 609480734 /nfs/dbraw/zinc/48/07/34/609480734.db2.gz ZRLRYKXIGRCFTF-UHFFFAOYSA-N -1 3 360.396 3.988 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NCc1ccc(-c2ccncc2)cc1F ZINC000826278946 609480736 /nfs/dbraw/zinc/48/07/36/609480736.db2.gz ZRLRYKXIGRCFTF-UHFFFAOYSA-N -1 3 360.396 3.988 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NCc1cccc(-c2ccccn2)c1 ZINC000826186639 609483695 /nfs/dbraw/zinc/48/36/95/609483695.db2.gz DPSODWCLKHKQMX-UHFFFAOYSA-N -1 3 358.405 3.549 20 0 FHADHM Cc1c(NCc2ccc(-c3ccncc3)cc2F)cccc1-c1nnn[n-]1 ZINC000826242186 609486004 /nfs/dbraw/zinc/48/60/04/609486004.db2.gz DOIMNNSKJNABCI-UHFFFAOYSA-N -1 3 360.396 3.988 20 0 FHADHM Cc1c(NCc2ccc(-c3ccncc3)cc2F)cccc1-c1nn[n-]n1 ZINC000826242186 609486006 /nfs/dbraw/zinc/48/60/06/609486006.db2.gz DOIMNNSKJNABCI-UHFFFAOYSA-N -1 3 360.396 3.988 20 0 FHADHM Clc1ccc(NCc2cc(-c3nnn[n-]3)cs2)cc1Br ZINC000826352588 609487782 /nfs/dbraw/zinc/48/77/82/609487782.db2.gz GYZPKOUMQBVMSC-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM Clc1ccc(NCc2cc(-c3nn[n-]n3)cs2)cc1Br ZINC000826352588 609487783 /nfs/dbraw/zinc/48/77/83/609487783.db2.gz GYZPKOUMQBVMSC-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM c1cc(-c2nnn[n-]2)sc1CNc1cccc(Oc2ccccn2)c1 ZINC000826522725 609487923 /nfs/dbraw/zinc/48/79/23/609487923.db2.gz LWENILPUYVSJPO-UHFFFAOYSA-N -1 3 350.407 3.728 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)/C(C)=C(\C)CC ZINC000825605274 609512275 /nfs/dbraw/zinc/51/22/75/609512275.db2.gz SYZRHQHJUKTMKG-MDZDMXLPSA-N -1 3 350.806 3.571 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)/C(C)=C(\C)CC ZINC000825605274 609512276 /nfs/dbraw/zinc/51/22/76/609512276.db2.gz SYZRHQHJUKTMKG-MDZDMXLPSA-N -1 3 350.806 3.571 20 0 FHADHM Cc1c(Cl)cnc(N[C@@H]2CCSc3ccccc32)c1-c1nnn[n-]1 ZINC000826239825 609522336 /nfs/dbraw/zinc/52/23/36/609522336.db2.gz RGBIIXOBERXXDZ-GFCCVEGCSA-N -1 3 358.858 3.873 20 0 FHADHM Cc1c(Cl)cnc(N[C@@H]2CCSc3ccccc32)c1-c1nn[n-]n1 ZINC000826239825 609522337 /nfs/dbraw/zinc/52/23/37/609522337.db2.gz RGBIIXOBERXXDZ-GFCCVEGCSA-N -1 3 358.858 3.873 20 0 FHADHM COc1ccccc1[C@H](Nc1nccc(C)c1-c1nnn[n-]1)c1ccccc1 ZINC000826219100 609549605 /nfs/dbraw/zinc/54/96/05/609549605.db2.gz SXAXBIWIUBHWGN-LJQANCHMSA-N -1 3 372.432 3.780 20 0 FHADHM COc1ccccc1[C@H](Nc1nccc(C)c1-c1nn[n-]n1)c1ccccc1 ZINC000826219100 609549608 /nfs/dbraw/zinc/54/96/08/609549608.db2.gz SXAXBIWIUBHWGN-LJQANCHMSA-N -1 3 372.432 3.780 20 0 FHADHM Cc1ccnc(N2CC=C(c3ccc(Cl)cc3)CC2)c1-c1nnn[n-]1 ZINC000826310330 609572588 /nfs/dbraw/zinc/57/25/88/609572588.db2.gz SDJITTRBKOPOHC-UHFFFAOYSA-N -1 3 352.829 3.517 20 0 FHADHM Cc1ccnc(N2CC=C(c3ccc(Cl)cc3)CC2)c1-c1nn[n-]n1 ZINC000826310330 609572590 /nfs/dbraw/zinc/57/25/90/609572590.db2.gz SDJITTRBKOPOHC-UHFFFAOYSA-N -1 3 352.829 3.517 20 0 FHADHM Cc1nc(-c2ccccc2)sc1NC(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000826322776 609591650 /nfs/dbraw/zinc/59/16/50/609591650.db2.gz BBGQLRRGPIPXPE-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1nc(-c2ccccc2)sc1NC(=O)c1cccc(-c2nn[n-]n2)c1 ZINC000826322776 609591651 /nfs/dbraw/zinc/59/16/51/609591651.db2.gz BBGQLRRGPIPXPE-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM COc1cccc([C@H]2C[C@H](C)CN2c2ncc(-c3nnn[n-]3)cc2Cl)c1 ZINC000826215207 609592904 /nfs/dbraw/zinc/59/29/04/609592904.db2.gz JHKKQFZJZYGZHJ-MEDUHNTESA-N -1 3 370.844 3.511 20 0 FHADHM COc1cccc([C@H]2C[C@H](C)CN2c2ncc(-c3nn[n-]n3)cc2Cl)c1 ZINC000826215207 609592906 /nfs/dbraw/zinc/59/29/06/609592906.db2.gz JHKKQFZJZYGZHJ-MEDUHNTESA-N -1 3 370.844 3.511 20 0 FHADHM C[C@@H]1C[C@@H](CCNc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)CCO1 ZINC000824885569 609596079 /nfs/dbraw/zinc/59/60/79/609596079.db2.gz SVBXVEADZJEMTJ-MNOVXSKESA-N -1 3 355.364 3.503 20 0 FHADHM C[C@H]1C[C@H](CCNc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)CCO1 ZINC000824885325 609596532 /nfs/dbraw/zinc/59/65/32/609596532.db2.gz RTSXFRYQOHXFNI-WDEREUQCSA-N -1 3 355.364 3.503 20 0 FHADHM C[C@H]1C[C@H](CCNc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)CCO1 ZINC000824885325 609596534 /nfs/dbraw/zinc/59/65/34/609596534.db2.gz RTSXFRYQOHXFNI-WDEREUQCSA-N -1 3 355.364 3.503 20 0 FHADHM O=C(CCc1ccc(-c2nnn[n-]2)cc1)Nc1ncccc1-c1ccccc1 ZINC000826408497 609608939 /nfs/dbraw/zinc/60/89/39/609608939.db2.gz IXNXGMAOENXUOE-UHFFFAOYSA-N -1 3 370.416 3.500 20 0 FHADHM O=C(CCc1ccc(-c2nn[n-]n2)cc1)Nc1ncccc1-c1ccccc1 ZINC000826408497 609608940 /nfs/dbraw/zinc/60/89/40/609608940.db2.gz IXNXGMAOENXUOE-UHFFFAOYSA-N -1 3 370.416 3.500 20 0 FHADHM COc1ccc([C@@H]2CCCN2CCOc2cccc(C(=O)[O-])c2)cc1OC ZINC000582970689 936333371 /nfs/dbraw/zinc/33/33/71/936333371.db2.gz RFHTYFZSPTUFNP-SFHVURJKSA-N -1 3 371.433 3.618 20 0 FHADHM COc1cc(C(=O)N2C[C@H](c3ccc(F)cc3)C[C@@H]2C)cc(OC)c1[O-] ZINC000162216627 936357610 /nfs/dbraw/zinc/35/76/10/936357610.db2.gz VPDJSCVIUULCRX-SWLSCSKDSA-N -1 3 359.397 3.567 20 0 FHADHM O=S(=O)([N-]c1ccc(O)cc1F)c1ccc(Cl)c(F)c1Cl ZINC000231729574 927047584 /nfs/dbraw/zinc/04/75/84/927047584.db2.gz GVVDLUWUDLFHOX-UHFFFAOYSA-N -1 3 354.161 3.778 20 0 FHADHM Cc1nc(-c2ccc(C)cc2C)sc1C(=O)NN=c1nc(C)cc(C)[n-]1 ZINC000063643463 927363183 /nfs/dbraw/zinc/36/31/83/927363183.db2.gz LAIZFCHOGKVYDR-UHFFFAOYSA-N -1 3 367.478 3.899 20 0 FHADHM Cc1cc([N-]S(=O)(=O)c2cccc(F)c2)c(F)cc1Br ZINC000312430997 927467627 /nfs/dbraw/zinc/46/76/27/927467627.db2.gz VSWQGXLSCZRPIH-UHFFFAOYSA-N -1 3 362.195 3.837 20 0 FHADHM Cc1ccc(-c2ccc(C)c(-n3c([O-])c(CC(F)(F)F)[nH]c3=O)c2)o1 ZINC000583160930 937191904 /nfs/dbraw/zinc/19/19/04/937191904.db2.gz XOUYCEZINVPNGF-GFCCVEGCSA-N -1 3 352.312 3.941 20 0 FHADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)[C@H](C)c3ccccc3F)cc2)n1 ZINC000108967550 927816698 /nfs/dbraw/zinc/81/66/98/927816698.db2.gz MCEWFDOEVQUOSJ-CYBMUJFWSA-N -1 3 351.381 3.627 20 0 FHADHM O=C(NCc1ncccc1[O-])Nc1ccc(Br)cc1Cl ZINC000471141969 927832219 /nfs/dbraw/zinc/83/22/19/927832219.db2.gz HYMOYWOQQANCPI-UHFFFAOYSA-N -1 3 356.607 3.525 20 0 FHADHM O=C(OCc1noc(-c2ccccc2[O-])n1)C12CC(c3ccccc3)(C1)C2 ZINC000784928137 927841308 /nfs/dbraw/zinc/84/13/08/927841308.db2.gz ZWYABUOEDCRRRJ-UHFFFAOYSA-N -1 3 362.385 3.607 20 0 FHADHM Cc1nc(-c2ccccc2)sc1C(=O)Nc1nnc(C(F)(F)F)[n-]1 ZINC000029389131 927849488 /nfs/dbraw/zinc/84/94/88/927849488.db2.gz ZFCSSRMBMHXPPR-UHFFFAOYSA-N -1 3 353.329 3.508 20 0 FHADHM Cc1nc(-c2ccccc2)sc1C(=O)Nc1nc(C(F)(F)F)n[n-]1 ZINC000029389131 927849497 /nfs/dbraw/zinc/84/94/97/927849497.db2.gz ZFCSSRMBMHXPPR-UHFFFAOYSA-N -1 3 353.329 3.508 20 0 FHADHM O=C(c1ccccc1[O-])N1CCC[C@@H]1C(=O)N1CCCC2(CCCCC2)C1 ZINC000111660052 927867222 /nfs/dbraw/zinc/86/72/22/927867222.db2.gz ZNLXGXYLMYIQKQ-GOSISDBHSA-N -1 3 370.493 3.570 20 0 FHADHM Cc1cc(C)n(-c2ccc([N-]S(=O)(=O)c3cccc(Cl)c3)cc2)n1 ZINC000029403595 927873941 /nfs/dbraw/zinc/87/39/41/927873941.db2.gz ZUDAFYUEQPMYEX-UHFFFAOYSA-N -1 3 361.854 3.943 20 0 FHADHM Cc1cc(C)n(-c2ccc([N-]S(=O)(=O)c3ccc(F)c(F)c3)cc2)n1 ZINC000029403581 927874055 /nfs/dbraw/zinc/87/40/55/927874055.db2.gz YFXKUJTXAWWXIV-UHFFFAOYSA-N -1 3 363.389 3.568 20 0 FHADHM O=C(NCc1ccc([O-])c(F)c1)N1CC[C@H](Oc2ccc(Cl)cc2)C1 ZINC000458425125 937232105 /nfs/dbraw/zinc/23/21/05/937232105.db2.gz SLHXJVZHCMNTLN-HNNXBMFYSA-N -1 3 364.804 3.548 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NCC3(Cc4ccccc4)CC3)nc2)n1 ZINC000154700276 937245867 /nfs/dbraw/zinc/24/58/67/937245867.db2.gz HTRAMZGYCVSJIB-UHFFFAOYSA-N -1 3 360.461 3.829 20 0 FHADHM O=C(NCc1ncccc1[O-])Nc1cccc(OCc2ccc(F)cc2)c1 ZINC000471174206 928550233 /nfs/dbraw/zinc/55/02/33/928550233.db2.gz VHYCXKUVNHHHGR-UHFFFAOYSA-N -1 3 367.380 3.827 20 0 FHADHM CC(=O)Nc1cc(S(=O)(=O)[N-]c2cccc(Cl)c2F)ccc1C ZINC000134446082 928912903 /nfs/dbraw/zinc/91/29/03/928912903.db2.gz AYXJYIAZDWYTAE-UHFFFAOYSA-N -1 3 356.806 3.547 20 0 FHADHM CSc1ccc(Cl)cc1[N-]C(=O)c1csc(S(C)(=O)=O)c1 ZINC000179772673 929019878 /nfs/dbraw/zinc/01/98/78/929019878.db2.gz GNVHPBDEYPBLLI-UHFFFAOYSA-N -1 3 361.897 3.779 20 0 FHADHM Cc1cn2cc(C(=O)[N-]c3nnc(Cc4ccc(F)cc4)s3)sc2n1 ZINC000533508803 929310060 /nfs/dbraw/zinc/31/00/60/929310060.db2.gz FRYXTODNBFCQKB-UHFFFAOYSA-N -1 3 373.438 3.538 20 0 FHADHM Cc1nc([N-]S(=O)(=O)c2ccc3c(c2)C[C@@H](C)O3)c(Cl)cc1Cl ZINC000180211285 929419935 /nfs/dbraw/zinc/41/99/35/929419935.db2.gz ZWRYKWSXVZRQOS-MRVPVSSYSA-N -1 3 373.261 3.821 20 0 FHADHM COc1ccc2c(c1)[C@@H](C(=O)Nc1ccc(Br)cc1[O-])CC2 ZINC000683303839 929607688 /nfs/dbraw/zinc/60/76/88/929607688.db2.gz MXANMJSEELUJTB-ZDUSSCGKSA-N -1 3 362.223 3.832 20 0 FHADHM CC(C)(C)OC(=O)Nc1ccccc1CC(=O)NCc1ccc([O-])c(F)c1 ZINC000160311768 929686061 /nfs/dbraw/zinc/68/60/61/929686061.db2.gz HJLCLPYMXPRPLN-UHFFFAOYSA-N -1 3 374.412 3.737 20 0 FHADHM CC(=O)Nc1ccc(S(=O)(=O)[N-]c2c(C)c(C)ccc2Cl)c(F)c1 ZINC000683719899 929916516 /nfs/dbraw/zinc/91/65/16/929916516.db2.gz MHEMNOFLUVCQNR-UHFFFAOYSA-N -1 3 370.833 3.855 20 0 FHADHM O=S(=O)([N-]Cc1ccc(F)c(Cl)c1)c1cnc(Cl)c(Cl)c1 ZINC000083935162 930171614 /nfs/dbraw/zinc/17/16/14/930171614.db2.gz DZDHWLKXYPLOLE-UHFFFAOYSA-N -1 3 369.632 3.659 20 0 FHADHM O=C([O-])[C@@H]1CN(Cc2csc(Br)c2)C[C@H]1c1ccccc1 ZINC000580073847 930212951 /nfs/dbraw/zinc/21/29/51/930212951.db2.gz SUKXPQPFCOOPFP-UONOGXRCSA-N -1 3 366.280 3.811 20 0 FHADHM [O-]C(=NO[C@@H]1CCCCO1)Nc1ccc(Cl)cc1OCC(F)(F)F 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3.715 20 0 FHADHM O=S(=O)([N-]c1ccc(OC[C@@H]2CCCO2)cc1)c1ccc2c(c1)CCC2 ZINC000055631573 931166176 /nfs/dbraw/zinc/16/61/76/931166176.db2.gz SLSBBWJULVQJFM-IBGZPJMESA-N -1 3 373.474 3.534 20 0 FHADHM Cc1cc(=O)[n-]c([C@H](C)Sc2nnc(-c3ccccc3Cl)n2C)n1 ZINC000155851884 931207717 /nfs/dbraw/zinc/20/77/17/931207717.db2.gz SIZOKDDZHQVMLY-JTQLQIEISA-N -1 3 361.858 3.793 20 0 FHADHM CC(C)C(C)(C)C(=O)N1CCC(C(=O)Nc2cc(Cl)ccc2[O-])CC1 ZINC000276001340 931348662 /nfs/dbraw/zinc/34/86/62/931348662.db2.gz MMTKZTCTFAECNN-UHFFFAOYSA-N -1 3 366.889 3.905 20 0 FHADHM CS(=O)(=O)[N-]c1nc2cc(Cl)ccc2n1CCCc1ccccc1 ZINC000548146773 931361197 /nfs/dbraw/zinc/36/11/97/931361197.db2.gz SHBNPANEPJIYNA-UHFFFAOYSA-N -1 3 363.870 3.694 20 0 FHADHM COC(=O)c1ccc(C(=O)Nc2nc(-c3ccc4c(c3)CCC4)cs2)[n-]1 ZINC000580966394 931424390 /nfs/dbraw/zinc/42/43/90/931424390.db2.gz WFOBBNXQQRIULX-UHFFFAOYSA-N -1 3 367.430 3.666 20 0 FHADHM CC[C@H](Nc1ccc(OC)c([N-]S(C)(=O)=O)c1)c1ccc(F)cc1 ZINC000160716533 931440962 /nfs/dbraw/zinc/44/09/62/931440962.db2.gz OIPXVPJIKONNBG-HNNXBMFYSA-N -1 3 352.431 3.769 20 0 FHADHM CCSc1cccc(F)c1[N-]S(=O)(=O)c1cccc(C(=O)OC)c1 ZINC000581164276 931631594 /nfs/dbraw/zinc/63/15/94/931631594.db2.gz DINXDXZVHSDVEK-UHFFFAOYSA-N -1 3 369.439 3.525 20 0 FHADHM Cc1nc([C@H]2CCCCN2Cc2cccc([O-])c2Br)no1 ZINC000656422630 931668350 /nfs/dbraw/zinc/66/83/50/931668350.db2.gz IVCYTAYXCKURNR-GFCCVEGCSA-N -1 3 352.232 3.573 20 0 FHADHM C[C@@H](C(=O)Nc1cc(I)ccc1[O-])c1ccsc1 ZINC000610490467 931742537 /nfs/dbraw/zinc/74/25/37/931742537.db2.gz ATUWYDHSEFXJRH-MRVPVSSYSA-N -1 3 373.215 3.801 20 0 FHADHM CCn1c2ccc(C(=O)[O-])cc2nc1CN1CCC[C@@H]1Cc1ccccc1 ZINC000581256408 931743738 /nfs/dbraw/zinc/74/37/38/931743738.db2.gz UZTJOLYQXADVSJ-GOSISDBHSA-N -1 3 363.461 3.962 20 0 FHADHM Cc1nn(C)cc1[C@H]1CCCN1Cc1cccc([O-])c1Br ZINC000656450549 931746460 /nfs/dbraw/zinc/74/64/60/931746460.db2.gz UGPRITBTHZSHJE-CQSZACIVSA-N -1 3 350.260 3.534 20 0 FHADHM C[C@H](C(=O)Nc1cc(I)ccc1[O-])c1cccs1 ZINC000610490605 931766111 /nfs/dbraw/zinc/76/61/11/931766111.db2.gz RZMXGPIXKYFXQA-QMMMGPOBSA-N -1 3 373.215 3.801 20 0 FHADHM Cc1cccc(NC(=O)CN(C)C(=O)c2ccc(C(C)C)cc2[O-])c1C ZINC000048382200 931881551 /nfs/dbraw/zinc/88/15/51/931881551.db2.gz TWEYLRAGBREWOV-UHFFFAOYSA-N -1 3 354.450 3.843 20 0 FHADHM O=c1cc(C(F)(F)F)nc(CNc2ccc3c(c2)C(=O)CCCC3)[n-]1 ZINC000581363521 931899980 /nfs/dbraw/zinc/89/99/80/931899980.db2.gz AHVDGTNYFCKMHN-UHFFFAOYSA-N -1 3 351.328 3.722 20 0 FHADHM N#C/C(=C\c1ccc([O-])cc1)C(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl ZINC000188450592 931954192 /nfs/dbraw/zinc/95/41/92/931954192.db2.gz DKEJSOSZHNQEQG-RCLKMUNOSA-N -1 3 372.211 3.987 20 0 FHADHM CCN(CC)c1ncc(CN2CCC(C(=O)c3ccc([O-])cc3)CC2)s1 ZINC000124026720 932023684 /nfs/dbraw/zinc/02/36/84/932023684.db2.gz BEVTYQRZHLZRID-UHFFFAOYSA-N -1 3 373.522 3.790 20 0 FHADHM C[C@@H](CN(Cc1cncn1Cc1ccccc1)Cc1ccccc1)C(=O)[O-] ZINC000581434839 932063564 /nfs/dbraw/zinc/06/35/64/932063564.db2.gz OIYKEOCIIXZPCB-SFHVURJKSA-N -1 3 363.461 3.654 20 0 FHADHM O=S(=O)([N-][C@@H]1C[C@@H]1c1cccc(F)c1)c1c(Cl)cccc1Cl ZINC000581436765 932073255 /nfs/dbraw/zinc/07/32/55/932073255.db2.gz VFSYAIBWGQCZAF-BXUZGUMPSA-N -1 3 360.237 3.967 20 0 FHADHM COCc1csc(CN[C@@H](C(=O)[O-])c2cccc(Br)c2)c1 ZINC000656565708 932081626 /nfs/dbraw/zinc/08/16/26/932081626.db2.gz RKJMFCUPACVXLY-CQSZACIVSA-N -1 3 370.268 3.573 20 0 FHADHM CC1(C)[C@H](CCC(=O)[O-])C[C@@H]1NCc1ccc(F)cc1Br ZINC000656568690 932095204 /nfs/dbraw/zinc/09/52/04/932095204.db2.gz NKAVPKDCGAFTSZ-RISCZKNCSA-N -1 3 358.251 3.957 20 0 FHADHM CO[C@@H](CS(=O)(=O)[N-]c1cccc(-c2ncc(C)o2)c1)C1CCCC1 ZINC000656622560 932199486 /nfs/dbraw/zinc/19/94/86/932199486.db2.gz GESSEOBDZWFNFJ-KRWDZBQOSA-N -1 3 364.467 3.597 20 0 FHADHM CO[C@@H](CS(=O)(=O)[N-]c1cc(-c2ncco2)ccc1C)C1CCCC1 ZINC000656625689 932217157 /nfs/dbraw/zinc/21/71/57/932217157.db2.gz HMCLUSWILNQQAJ-KRWDZBQOSA-N -1 3 364.467 3.597 20 0 FHADHM O=C(NCc1ncccc1[O-])c1ccc(COc2ccc(Cl)cc2)cc1 ZINC000684350165 932351370 /nfs/dbraw/zinc/35/13/70/932351370.db2.gz GUILHGZXHOYXOB-UHFFFAOYSA-N -1 3 368.820 3.950 20 0 FHADHM CO[C@@H](CS(=O)(=O)[N-]c1ccc(-c2ccccn2)cc1)C1CCCC1 ZINC000656735052 932367353 /nfs/dbraw/zinc/36/73/53/932367353.db2.gz QOZOWROQXYJEIW-IBGZPJMESA-N -1 3 360.479 3.696 20 0 FHADHM O=S(=O)([N-]Cc1cccc(C(F)(F)F)c1)c1ccc(Cl)cc1F ZINC000022455993 932376087 /nfs/dbraw/zinc/37/60/87/932376087.db2.gz WBBFKSHKXVJMMJ-UHFFFAOYSA-N -1 3 367.751 3.976 20 0 FHADHM O=S(=O)([N-]c1ccc(CC(F)(F)F)cc1)c1ccc2c(c1)CCO2 ZINC000157858164 932410422 /nfs/dbraw/zinc/41/04/22/932410422.db2.gz MPCFFFUUCNJUSF-UHFFFAOYSA-N -1 3 357.353 3.527 20 0 FHADHM CCc1ccc(-c2nc([C@@H](NC(=O)c3ccccc3)C3CC3)no2)c([O-])c1 ZINC000581693470 932508783 /nfs/dbraw/zinc/50/87/83/932508783.db2.gz ZEWVOCRKGBCKCR-SFHVURJKSA-N -1 3 363.417 3.886 20 0 FHADHM Cc1nc(C)c(CC(=O)O[C@H](C)c2ccc(Cl)c(Cl)c2)c(=O)[n-]1 ZINC000051169508 932514146 /nfs/dbraw/zinc/51/41/46/932514146.db2.gz YZZBXYITSAKWOJ-SECBINFHSA-N -1 3 355.221 3.540 20 0 FHADHM O=C([N-]c1nnc(/C=C\c2ccco2)s1)c1coc(Br)c1 ZINC000255366362 932518571 /nfs/dbraw/zinc/51/85/71/932518571.db2.gz RYNOLPUBVVMNTA-ARJAWSKDSA-N -1 3 366.196 3.909 20 0 FHADHM O=c1[n-]c(SCCCC2CCOCC2)nc2c1cnn2-c1ccccc1 ZINC000581706493 932532143 /nfs/dbraw/zinc/53/21/43/932532143.db2.gz SPBGECWVBLBJFJ-UHFFFAOYSA-N -1 3 370.478 3.820 20 0 FHADHM Cc1ccc(S(=O)(=O)[N-]c2c(F)cccc2N2CCCC2)cc1F ZINC000127279716 932591560 /nfs/dbraw/zinc/59/15/60/932591560.db2.gz MPTITXOYLRFJDE-UHFFFAOYSA-N -1 3 352.406 3.674 20 0 FHADHM CC(C)(C)O[C@@H](C(=O)Nc1cc(-c2nnn[n-]2)ccc1F)c1ccccc1 ZINC000891470206 932624677 /nfs/dbraw/zinc/62/46/77/932624677.db2.gz CVXWPWMUBFETEN-MRXNPFEDSA-N -1 3 369.400 3.501 20 0 FHADHM CC(C)(C)O[C@@H](C(=O)Nc1cc(-c2nn[n-]n2)ccc1F)c1ccccc1 ZINC000891470206 932624682 /nfs/dbraw/zinc/62/46/82/932624682.db2.gz CVXWPWMUBFETEN-MRXNPFEDSA-N -1 3 369.400 3.501 20 0 FHADHM Cc1c2cc(F)ccc2oc1S(=O)(=O)[N-]CCc1c[nH]c2ccccc12 ZINC000471695655 932635583 /nfs/dbraw/zinc/63/55/83/932635583.db2.gz XYGIOBHJZQWTBH-UHFFFAOYSA-N -1 3 372.421 3.883 20 0 FHADHM O=C(NCc1ncccc1[O-])NCC1(c2ccc(F)cc2)CCCCC1 ZINC000471726789 932717428 /nfs/dbraw/zinc/71/74/28/932717428.db2.gz OBSQPZQCLWHEQP-UHFFFAOYSA-N -1 3 357.429 3.628 20 0 FHADHM O=C(NCc1ncccc1[O-])NCC1(c2cccc(F)c2)CCCCC1 ZINC000471732858 932727528 /nfs/dbraw/zinc/72/75/28/932727528.db2.gz APQSJHPPECNXGZ-UHFFFAOYSA-N -1 3 357.429 3.628 20 0 FHADHM CN1CCN([C@@H](C/N=C/c2cc(Cl)ccc2[O-])c2cccs2)CC1 ZINC000022593376 932842187 /nfs/dbraw/zinc/84/21/87/932842187.db2.gz BFQBCXOVSDLHMR-DORSJAEJSA-N -1 3 363.914 3.515 20 0 FHADHM Cc1c2cc(F)ccc2oc1S(=O)(=O)[N-][C@H](C)Cc1cccs1 ZINC000471795254 932941773 /nfs/dbraw/zinc/94/17/73/932941773.db2.gz YXYVDJVZFJWHFM-SNVBAGLBSA-N -1 3 353.440 3.851 20 0 FHADHM COC(=O)c1cccc2[n-]c(NC(=O)c3ccc(SC4CC4)cc3)nc21 ZINC000544005298 932975139 /nfs/dbraw/zinc/97/51/39/932975139.db2.gz BRXYRDFMVMUZHR-UHFFFAOYSA-N -1 3 367.430 3.856 20 0 FHADHM O=C([N-]c1ccc(Cl)c(F)c1)c1nc(COCc2ccccc2)no1 ZINC000581973215 933149337 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COc1cc(C)c([N-]S(=O)(=O)c2cc(C)c(F)c(C)c2)cc1OC ZINC000078235067 936062912 /nfs/dbraw/zinc/06/29/12/936062912.db2.gz STKDQROYPCEOHB-UHFFFAOYSA-N -1 3 353.415 3.569 20 0 FHADHM CC1(C)C[C@H](c2ccccc2)N(C(=O)NCc2nc(C(F)(F)F)n[n-]2)C1 ZINC000425747642 945143123 /nfs/dbraw/zinc/14/31/23/945143123.db2.gz VYBXNRRRHCJLIX-GFCCVEGCSA-N -1 3 367.375 3.506 20 0 FHADHM CC(C)N(CC1CC1)C(=O)c1c[n-]c2c(OC(F)(F)F)cccc2c1=O ZINC000582764426 936088921 /nfs/dbraw/zinc/08/89/21/936088921.db2.gz RXPVSLJQONARJT-UHFFFAOYSA-N -1 3 368.355 3.687 20 0 FHADHM O=C(Nc1cccc(N2CCCCCC2)c1)c1cc(=O)[n-]c(C2CC2)n1 ZINC000582853689 936218278 /nfs/dbraw/zinc/21/82/78/936218278.db2.gz CJTSVXBMYHIVOE-UHFFFAOYSA-N -1 3 352.438 3.692 20 0 FHADHM CC1(C)CCC[C@H](Sc2nc3c(cnn3-c3ccccc3)c(=O)[n-]2)C1=O ZINC000582891749 936268046 /nfs/dbraw/zinc/26/80/46/936268046.db2.gz LBONZAAPVWJXIE-AWEZNQCLSA-N -1 3 368.462 3.761 20 0 FHADHM CC(C)Cn1ccc2cc(N3C(=O)NC(CC(F)(F)F)C3=O)ccc21 ZINC000278262680 938259770 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O=S(=O)([N-]C[C@H]1COc2ccccc2C1)c1c(Cl)cccc1Cl ZINC000052537070 938377116 /nfs/dbraw/zinc/37/71/16/938377116.db2.gz QMJNOZMKLYPVCK-NSHDSACASA-N -1 3 372.273 3.523 20 0 FHADHM COc1cccc([C@@H](C)CCCC(=O)N=c2cc(-c3ccncc3)[n-][nH]2)c1 ZINC000448114726 938379027 /nfs/dbraw/zinc/37/90/27/938379027.db2.gz WXPDTRUIOLBJMB-HNNXBMFYSA-N -1 3 364.449 3.815 20 0 FHADHM Cc1ccc(S(=O)(=O)[N-]Cc2ccc(F)cc2C(F)(F)F)c(F)c1 ZINC000519150986 945173744 /nfs/dbraw/zinc/17/37/44/945173744.db2.gz WUNGGBDQAHQTQA-UHFFFAOYSA-N -1 3 365.323 3.771 20 0 FHADHM CC[C@@H](OC1CCCC1)C(=O)NCc1ccc([O-])c(Br)c1 ZINC000151524476 938563436 /nfs/dbraw/zinc/56/34/36/938563436.db2.gz DGBOFVQXTYAGDB-OAHLLOKOSA-N -1 3 356.260 3.509 20 0 FHADHM Cc1ccc2cccc(C(=O)NCc3ccc([O-])c(Br)c3)c2n1 ZINC000151541908 938570205 /nfs/dbraw/zinc/57/02/05/938570205.db2.gz ARXUFAWMURQCFU-UHFFFAOYSA-N -1 3 371.234 3.941 20 0 FHADHM CC(C)(C)c1ncsc1C(=O)NCc1ccc([O-])c(Br)c1 ZINC000151595746 938595137 /nfs/dbraw/zinc/59/51/37/938595137.db2.gz 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ZINC000056128039 938698853 /nfs/dbraw/zinc/69/88/53/938698853.db2.gz TZBRVJZNAUVMHY-CQSZACIVSA-N -1 3 365.323 3.937 20 0 FHADHM CC[C@@H]([N-]S(=O)(=O)c1cc2nc(Cl)ncc2s1)C1CCCC1 ZINC001211846188 945197611 /nfs/dbraw/zinc/19/76/11/945197611.db2.gz NUQUPXLBAPQZEG-SNVBAGLBSA-N -1 3 359.904 3.592 20 0 FHADHM COc1cc(C(=O)N[C@@H]2C[C@H]2c2ccc3ccccc3c2)cc(OC)c1[O-] ZINC000437281075 945212802 /nfs/dbraw/zinc/21/28/02/945212802.db2.gz PPKJJMQVGAKYLV-ZWKOTPCHSA-N -1 3 363.413 3.849 20 0 FHADHM COC(=O)c1cccc2[n-]c(NC(=O)[C@@H]3C[C@@H]3c3ccccc3Cl)nc21 ZINC000219865559 938964384 /nfs/dbraw/zinc/96/43/84/938964384.db2.gz PLENDHMCARWSKX-CHWSQXEVSA-N -1 3 369.808 3.745 20 0 FHADHM COC(=O)c1cccc2[n-]c(NC(=O)c3ccccc3C(F)(F)F)nc21 ZINC000157802920 938965308 /nfs/dbraw/zinc/96/53/08/938965308.db2.gz HWRYYCLTSNZOCJ-UHFFFAOYSA-N -1 3 363.295 3.621 20 0 FHADHM O=S(=O)([N-][C@@H](c1cccc(OC(F)(F)F)c1)C1CC1)c1ccco1 ZINC000511276623 938980046 /nfs/dbraw/zinc/98/00/46/938980046.db2.gz LVNYSSQDIXKPTH-CQSZACIVSA-N -1 3 361.341 3.608 20 0 FHADHM O=S(=O)([N-]C[C@H](c1ccccc1)C1CC1)c1cnccc1C(F)(F)F ZINC000431609340 938999518 /nfs/dbraw/zinc/99/95/18/938999518.db2.gz MWVNEDWXPZJPNA-CQSZACIVSA-N -1 3 370.396 3.573 20 0 FHADHM COc1cc(CNC(=O)c2cc([O-])ccc2Cl)ccc1OC(F)F ZINC000685570558 939001863 /nfs/dbraw/zinc/00/18/63/939001863.db2.gz CCXBOMNAAJRIPD-UHFFFAOYSA-N -1 3 357.740 3.586 20 0 FHADHM COc1cccc([C@@H](CNC(=O)c2cc([O-])c3ccccc3c2)OC)c1 ZINC001167680128 939020260 /nfs/dbraw/zinc/02/02/60/939020260.db2.gz LDSNLYWJRXEOSX-HXUWFJFHSA-N -1 3 351.402 3.672 20 0 FHADHM Cc1nc2c(cccc2C(=O)NCc2ccc([O-])c(Br)c2)o1 ZINC000472358327 939055993 /nfs/dbraw/zinc/05/59/93/939055993.db2.gz GQIURMHQLJBEQB-UHFFFAOYSA-N -1 3 361.195 3.534 20 0 FHADHM Cc1ccccc1S(=O)(=O)[N-]c1ccc(OCc2ccncc2)cc1 ZINC000519217335 945225308 /nfs/dbraw/zinc/22/53/08/945225308.db2.gz BKKSLNKAPYNDPX-UHFFFAOYSA-N -1 3 354.431 3.770 20 0 FHADHM COC1CCC(C[N-]S(=O)(=O)c2c(Cl)ccc(C)c2Cl)CC1 ZINC000427252219 945229542 /nfs/dbraw/zinc/22/95/42/945229542.db2.gz GCKFLUNUDPIGME-UHFFFAOYSA-N -1 3 366.310 3.785 20 0 FHADHM CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)Nc1cc(Cl)ccc1[O-] ZINC000179459020 939168545 /nfs/dbraw/zinc/16/85/45/939168545.db2.gz QZVXNGXYRQTYNP-NWDGAFQWSA-N -1 3 354.834 3.678 20 0 FHADHM O=C([O-])[C@]1(C(F)(F)F)CCN(Cc2ccc(Cl)c3cccnc23)C1 ZINC000326408093 939180307 /nfs/dbraw/zinc/18/03/07/939180307.db2.gz KBDBMZNPFQZJMV-HNNXBMFYSA-N -1 3 358.747 3.727 20 0 FHADHM Cc1cc(N(C)C)ccc1[N-]S(=O)(=O)c1ccc(C(=O)C(C)C)cc1 ZINC000437315621 945234615 /nfs/dbraw/zinc/23/46/15/945234615.db2.gz ZHCLGGCNYATDDU-UHFFFAOYSA-N -1 3 360.479 3.701 20 0 FHADHM CCC1(C[N-]S(=O)(=O)c2sc(C)cc2Br)CCC1 ZINC000437321434 945239273 /nfs/dbraw/zinc/23/92/73/945239273.db2.gz IPGQMDVSMWWGQE-UHFFFAOYSA-N -1 3 352.319 3.678 20 0 FHADHM C[C@H](CC(=O)N=c1cc([C@H]2CCCO2)[n-][nH]1)c1cccc(C(F)(F)F)c1 ZINC000473858094 945242298 /nfs/dbraw/zinc/24/22/98/945242298.db2.gz PMHANTSACPVREH-IAQYHMDHSA-N -1 3 367.371 3.834 20 0 FHADHM O=C1[N-]C(=O)C(=Cc2csc(-c3cccc(Br)c3)n2)S1 ZINC000007154961 945264619 /nfs/dbraw/zinc/26/46/19/945264619.db2.gz IIBDFOKVHKEHBH-YHYXMXQVSA-N -1 3 367.249 3.897 20 0 FHADHM CCOc1ccc(S(=O)(=O)[N-]c2cccc(-c3ncco3)c2C)cc1 ZINC000427312021 945278064 /nfs/dbraw/zinc/27/80/64/945278064.db2.gz GWPVNMLUGPCORD-UHFFFAOYSA-N -1 3 358.419 3.850 20 0 FHADHM CCOCCCC[N-]S(=O)(=O)c1csc(-c2ccc(Cl)cc2)n1 ZINC000500433040 945284744 /nfs/dbraw/zinc/28/47/44/945284744.db2.gz MSVIDWRBYUNXLH-UHFFFAOYSA-N -1 3 374.915 3.559 20 0 FHADHM O=C(OCc1noc(-c2ccccc2[O-])n1)c1ccc2cc(O)ccc2c1 ZINC000782611333 940016027 /nfs/dbraw/zinc/01/60/27/940016027.db2.gz OKXCDGBGFGBXLV-UHFFFAOYSA-N -1 3 362.341 3.658 20 0 FHADHM O=C(Nc1ccc(Cl)cc1[O-])[C@H]1Cc2cc(Br)ccc2O1 ZINC000472439152 940138000 /nfs/dbraw/zinc/13/80/00/940138000.db2.gz KXAJVISEVGTOQE-CQSZACIVSA-N -1 3 368.614 3.750 20 0 FHADHM CC(C)OCc1ccccc1CNCc1ncc(Br)cc1[O-] ZINC000892505992 940173269 /nfs/dbraw/zinc/17/32/69/940173269.db2.gz QNPBWJFMXOITPV-UHFFFAOYSA-N -1 3 365.271 3.765 20 0 FHADHM CC(=O)c1ccc(C(=O)N2CCC[C@@H]2CC(=O)c2ccc(F)cc2)cc1[O-] ZINC000612722808 940240871 /nfs/dbraw/zinc/24/08/71/940240871.db2.gz LFWYVXFWQHYICI-QGZVFWFLSA-N -1 3 369.392 3.612 20 0 FHADHM CSc1ccc([O-])c(C(=O)NC[C@H](c2ccccc2)C(C)(C)CO)c1 ZINC000612749907 940252609 /nfs/dbraw/zinc/25/26/09/940252609.db2.gz DYAOTZNZTFOGRW-QGZVFWFLSA-N -1 3 359.491 3.646 20 0 FHADHM Cc1cc(=O)[n-]c(C(C)(C)NC(=O)C[C@@H]2C[C@@H](C)c3c2cccc3C)n1 ZINC000636110814 940254750 /nfs/dbraw/zinc/25/47/50/940254750.db2.gz MPHNRNARDPKAPL-HIFRSBDPSA-N -1 3 353.466 3.831 20 0 FHADHM CCC(CC)NC(=O)c1ccc(S(=O)(=O)[N-]c2ccccc2F)cc1 ZINC000015615466 940257515 /nfs/dbraw/zinc/25/75/15/940257515.db2.gz BDFACAOOHNKTPT-UHFFFAOYSA-N -1 3 364.442 3.545 20 0 FHADHM C[C@H](C/N=C/c1cc(Cl)cc([N+](=O)[O-])c1[O-])N1CCc2ccccc2C1 ZINC000026432382 945307079 /nfs/dbraw/zinc/30/70/79/945307079.db2.gz ZRHGNPAMAOQPNY-SRRANQMSSA-N -1 3 373.840 3.820 20 0 FHADHM Cc1c([N-]S(=O)(=O)c2ccc(N(C)C)cc2)cccc1-c1ncco1 ZINC000427352096 945308320 /nfs/dbraw/zinc/30/83/20/945308320.db2.gz LAFZWZKJNYNRGB-UHFFFAOYSA-N -1 3 357.435 3.517 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)NCC(C)(C)C(F)(F)F)cc2)cc(=O)[n-]1 ZINC000548976065 940401926 /nfs/dbraw/zinc/40/19/26/940401926.db2.gz CADDGQNTLAFELS-UHFFFAOYSA-N -1 3 368.359 3.868 20 0 FHADHM Cc1c([O-])ccc2c(CN(C)Cc3nc4c(s3)CCCC4)cc(=O)oc12 ZINC000177782040 940432256 /nfs/dbraw/zinc/43/22/56/940432256.db2.gz YGWJEZRWISKBKN-UHFFFAOYSA-N -1 3 370.474 3.774 20 0 FHADHM O=C(NCc1cccc(OCC(F)(F)F)c1)c1cc([O-])ccc1Cl ZINC000431740476 940453529 /nfs/dbraw/zinc/45/35/29/940453529.db2.gz HDSAOQBFXXUFOT-UHFFFAOYSA-N -1 3 359.731 3.917 20 0 FHADHM CC(=O)N(c1nc(C=Cc2cc(=O)[n-]c(C(C)(C)C)n2)cs1)C1CC1 ZINC000414087062 940491999 /nfs/dbraw/zinc/49/19/99/940491999.db2.gz ZXYVUUWTYUZGCJ-WAYWQWQTSA-N -1 3 358.467 3.622 20 0 FHADHM Cc1cc(F)ccc1N1CCC[C@@H](NC(=O)c2cc([O-])ccc2Cl)C1 ZINC000431784325 940500087 /nfs/dbraw/zinc/50/00/87/940500087.db2.gz KDMXDHUSFCXQND-CQSZACIVSA-N -1 3 362.832 3.892 20 0 FHADHM O=C(CCCc1ccc([O-])c(F)c1)N[C@@H](c1nccs1)C(F)(F)F ZINC000507576942 945328849 /nfs/dbraw/zinc/32/88/49/945328849.db2.gz XBRYTYFWWAZAGJ-ZDUSSCGKSA-N -1 3 362.348 3.730 20 0 FHADHM CC(C)c1nc([C@H]2CCCCCN2C(=O)c2ccc3[nH][n-]c(=O)c3c2)no1 ZINC000613337966 940610345 /nfs/dbraw/zinc/61/03/45/940610345.db2.gz CYEVOXQEHFKRAP-OAHLLOKOSA-N -1 3 369.425 3.532 20 0 FHADHM C[C@H](Oc1ccc(Cl)c(Cl)c1)C(=O)Nc1n[n-]c(-c2ccco2)n1 ZINC000613341434 940613876 /nfs/dbraw/zinc/61/38/76/940613876.db2.gz PZTSTNXWIAIWLT-QMMMGPOBSA-N -1 3 367.192 3.778 20 0 FHADHM O=C(Nc1cccc(Oc2ccccn2)c1)c1c[n-]c2ccccc2c1=O ZINC000173587880 940642307 /nfs/dbraw/zinc/64/23/07/940642307.db2.gz AHXIFIXFSHJEOH-UHFFFAOYSA-N -1 3 357.369 3.968 20 0 FHADHM O=C(c1cc([O-])ccc1Cl)N1CC[C@@H](Oc2cccc(Cl)c2)C1 ZINC000431820152 940657994 /nfs/dbraw/zinc/65/79/94/940657994.db2.gz AQLDBYVZQWOZCK-CQSZACIVSA-N -1 3 352.217 3.993 20 0 FHADHM O=S(=O)([N-]c1c(F)cccc1N1CCCC1)c1cc(F)c(F)c(F)c1 ZINC000174004500 940694193 /nfs/dbraw/zinc/69/41/93/940694193.db2.gz WKXKSBLCSBIBMO-UHFFFAOYSA-N -1 3 374.359 3.644 20 0 FHADHM Cc1c(F)cccc1S(=O)(=O)[N-]c1c(F)cccc1N1CCCC1 ZINC000174004552 940694359 /nfs/dbraw/zinc/69/43/59/940694359.db2.gz VNEFWPIRZDDRFC-UHFFFAOYSA-N -1 3 352.406 3.674 20 0 FHADHM CC(C)C[C@@H](C(=O)N1CCc2c(=O)[n-]cnc2C1)c1ccc(Cl)cc1 ZINC000613429254 940699823 /nfs/dbraw/zinc/69/98/23/940699823.db2.gz MTLGOYNTQNRXCX-MRXNPFEDSA-N -1 3 359.857 3.550 20 0 FHADHM Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)NCc1ccc([O-])c(F)c1 ZINC000174208957 940710334 /nfs/dbraw/zinc/71/03/34/940710334.db2.gz RQNDWLRJZACGBV-UHFFFAOYSA-N -1 3 359.788 3.609 20 0 FHADHM Cc1ccc(CC(=O)[N-]O[C@H](C)C(=O)Nc2cccc(Cl)c2C)cc1 ZINC000178161853 940731715 /nfs/dbraw/zinc/73/17/15/940731715.db2.gz HUMDZUNKPVUUOH-CQSZACIVSA-N -1 3 360.841 3.574 20 0 FHADHM Cc1ccc(CC(=O)[N-]O[C@@H](C)c2nc(-c3ccccc3C)no2)cc1 ZINC000178162822 940736106 /nfs/dbraw/zinc/73/61/06/940736106.db2.gz GDFLROCQEXHJOL-HNNXBMFYSA-N -1 3 351.406 3.705 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(N3CCc4sccc4C3)nc2)c([O-])c1 ZINC000613506416 940794358 /nfs/dbraw/zinc/79/43/58/940794358.db2.gz DDFPWZZVDQVKCF-UHFFFAOYSA-N -1 3 365.458 3.972 20 0 FHADHM O=S(=O)(/C=C\c1ccc(F)cc1)[N-]c1ccccc1OCC(F)F ZINC000255895910 940821956 /nfs/dbraw/zinc/82/19/56/940821956.db2.gz CSRZLNVRFXUNBA-KTKRTIGZSA-N -1 3 357.353 3.882 20 0 FHADHM COC(=O)[C@@H](NC(=O)c1cc([O-])c2ccccc2c1)c1cc(C)cc(C)c1 ZINC000472563579 940824614 /nfs/dbraw/zinc/82/46/14/940824614.db2.gz LCBRHWOYQRRNGE-FQEVSTJZSA-N -1 3 363.413 3.806 20 0 FHADHM CC(C)OC(=O)c1ccc(Cl)c([N-]S(=O)(=O)c2ccsc2)c1 ZINC000506807741 945358970 /nfs/dbraw/zinc/35/89/70/945358970.db2.gz UBNWXALQGKUCPX-UHFFFAOYSA-N -1 3 359.856 3.768 20 0 FHADHM CCSc1cccc(F)c1[N-]S(=O)(=O)c1ccc2c(c1)OCCO2 ZINC000685916374 941016027 /nfs/dbraw/zinc/01/60/27/941016027.db2.gz WXSWNHKSIWRMLH-UHFFFAOYSA-N -1 3 369.439 3.510 20 0 FHADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)[C@H](c3ccccc3)C3CC3)c2)n1 ZINC000162372952 941025656 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COc1ccc(-c2noc(C=C([O-])c3ccccc3Cl)n2)c(OC)c1 ZINC001211646942 941341838 /nfs/dbraw/zinc/34/18/38/941341838.db2.gz DQWYJQZBLUEFBK-UHFFFAOYSA-N -1 3 358.781 3.833 20 0 FHADHM N#Cc1ccc(S(=O)(=O)[N-]c2cc([N+](=O)[O-])ccc2Cl)cc1Cl ZINC000181118825 941359679 /nfs/dbraw/zinc/35/96/79/941359679.db2.gz WCUWULSAMFAVBQ-UHFFFAOYSA-N -1 3 372.189 3.574 20 0 FHADHM Cc1cc([C@H](C)N2CCC(Cc3nc([C@@H]4C[C@H]4C)no3)CC2)oc1C(=O)[O-] ZINC000659798456 941401917 /nfs/dbraw/zinc/40/19/17/941401917.db2.gz DMRIGEBUAABOAX-OSAQELSMSA-N -1 3 373.453 3.808 20 0 FHADHM Cc1[nH]c2ccccc2c1C1CCN(C(=O)c2ccc(O)cc2[O-])CC1 ZINC000182152556 941408637 /nfs/dbraw/zinc/40/86/37/941408637.db2.gz KIIQUFMUJOMRMI-UHFFFAOYSA-N -1 3 350.418 3.907 20 0 FHADHM CCCN(C(=O)c1ccc(C(C)=O)c([O-])c1)[C@@H]1CCCc2cccnc21 ZINC000613626298 941490813 /nfs/dbraw/zinc/49/08/13/941490813.db2.gz JVKQYUMWCPFXBQ-GOSISDBHSA-N -1 3 352.434 3.920 20 0 FHADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)c3cnc(CC4CC4)s3)c2)n1 ZINC000892736533 941496414 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353.184 3.895 20 0 FHADHM CCCCOc1ccc(OC)cc1NC(=O)c1cc(F)cc2n[n-]nc21 ZINC000503977648 943449022 /nfs/dbraw/zinc/44/90/22/943449022.db2.gz SHJHHIAZFDXGOS-UHFFFAOYSA-N -1 3 358.373 3.537 20 0 FHADHM Cc1c(-c2ccncc2)[n-][nH]c1=NC(=O)c1csc(-c2cccs2)n1 ZINC000364078891 943512992 /nfs/dbraw/zinc/51/29/92/943512992.db2.gz RZNVKXJTJOPYEE-UHFFFAOYSA-N -1 3 367.459 3.639 20 0 FHADHM CCc1c(C(=O)N=c2cc(-c3ccccc3)[n-][nH]2)cnn1Cc1ccccc1 ZINC000435674237 943553162 /nfs/dbraw/zinc/55/31/62/943553162.db2.gz FUZKCGLVVRWHAZ-UHFFFAOYSA-N -1 3 371.444 3.558 20 0 FHADHM O=C(Nc1ccc(Br)cc1[O-])c1cc(=O)[nH]c2ccccc21 ZINC000515205918 943566144 /nfs/dbraw/zinc/56/61/44/943566144.db2.gz OBIWSRLIPAAZPZ-UHFFFAOYSA-N -1 3 359.179 3.661 20 0 FHADHM Cc1c(C(=O)Nc2ccc(Br)cc2[O-])[nH]c2c1C(=O)CCC2 ZINC000515205948 943566332 /nfs/dbraw/zinc/56/63/32/943566332.db2.gz UWKNHDCOYPLQOR-UHFFFAOYSA-N -1 3 363.211 3.563 20 0 FHADHM COc1cc(C)c([N-]S(=O)(=O)c2ccc(OC)c(Cl)c2)cc1C ZINC000435724906 943580727 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Cc1nc(-c2ccc(NC(=O)N[C@@H](C)c3cccc(O)c3)cc2)cc(=O)[n-]1 ZINC000436108666 944022614 /nfs/dbraw/zinc/02/26/14/944022614.db2.gz XQJKZMCPMADBOB-LBPRGKRZSA-N -1 3 364.405 3.746 20 0 FHADHM O=C([O-])c1cccc(Cl)c1CN1CCC(OC[C@H]2CCCCO2)CC1 ZINC000515660180 944104257 /nfs/dbraw/zinc/10/42/57/944104257.db2.gz PVZFLJOJWRXIDM-OAHLLOKOSA-N -1 3 367.873 3.588 20 0 FHADHM Cc1noc(C)c1S(=O)(=O)[N-]CC1(Sc2ccccc2)CCCC1 ZINC000518317527 944263359 /nfs/dbraw/zinc/26/33/59/944263359.db2.gz SBCHXYKPSQONBC-UHFFFAOYSA-N -1 3 366.508 3.675 20 0 FHADHM O=C(N=c1cc(-c2ccccc2)[n-][nH]1)c1cccc(-c2noc(C3CC3)n2)c1 ZINC000439017879 944272178 /nfs/dbraw/zinc/27/21/78/944272178.db2.gz GPHZFIOZXCNTMD-UHFFFAOYSA-N -1 3 371.400 3.678 20 0 FHADHM O=C(Nc1c([O-])cccc1Cl)C1CCN(C(=O)Nc2ccccc2)CC1 ZINC000518396748 944336239 /nfs/dbraw/zinc/33/62/39/944336239.db2.gz IMTQAXHOEFAUBN-UHFFFAOYSA-N -1 3 373.840 3.928 20 0 FHADHM CCOC(=O)c1sc2ccsc2c1CNC(=O)c1ccccc1[O-] ZINC000436482363 944347350 /nfs/dbraw/zinc/34/73/50/944347350.db2.gz HYMAAAMLBNGWSG-UHFFFAOYSA-N -1 3 361.444 3.775 20 0 FHADHM C[C@@H]1CCC[C@@H]1NC(=O)C[C@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436484034 944369462 /nfs/dbraw/zinc/36/94/62/944369462.db2.gz DAXUQWKLLXQYAP-XPGWFJOJSA-N -1 3 366.461 3.558 20 0 FHADHM CC(C)c1ccc(C(=O)NCCc2nc3ccc(F)cc3n2C)c([O-])c1 ZINC000436486769 944370404 /nfs/dbraw/zinc/37/04/04/944370404.db2.gz JUZFYSVXUSHPCH-UHFFFAOYSA-N -1 3 355.413 3.514 20 0 FHADHM CC(C)c1nn(Cc2ccccc2)c(Cl)c1C=Cc1nccc(=O)[n-]1 ZINC000162631567 944376025 /nfs/dbraw/zinc/37/60/25/944376025.db2.gz XFWKQUOLHAQGBM-CMDGGOBGSA-N -1 3 354.841 3.962 20 0 FHADHM Cc1ccccc1-c1cc(=NC(=O)[C@@H]2C[C@@H]2c2cc(F)ccc2F)[nH][n-]1 ZINC000439146896 944379175 /nfs/dbraw/zinc/37/91/75/944379175.db2.gz KNTISNMTPAAERX-GDBMZVCRSA-N -1 3 353.372 3.827 20 0 FHADHM CC[C@H]1C[C@]1(NC(=O)c1cc(OC)c([O-])c(OC)c1)c1cccc(C)c1 ZINC000436514606 944384857 /nfs/dbraw/zinc/38/48/57/944384857.db2.gz SDOZTWWXRBJXKG-YCRPNKLZSA-N -1 3 355.434 3.773 20 0 FHADHM COc1ccc(C(=O)N[C@H](C)c2ccc(OCC(F)(F)F)cc2)c([O-])c1 ZINC000436534313 944401624 /nfs/dbraw/zinc/40/16/24/944401624.db2.gz OOYYPYGMJFQOSG-LLVKDONJSA-N -1 3 369.339 3.833 20 0 FHADHM C[C@@H]1CCN(C)CCN1C(=O)c1cc(-c2ccccc2)cc(Cl)c1[O-] ZINC000436548785 944407603 /nfs/dbraw/zinc/40/76/03/944407603.db2.gz UZWBIJXMLAPTIP-CQSZACIVSA-N -1 3 358.869 3.879 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc3[nH]c([C@H]4CCCO4)nc3c2)c([O-])c1C ZINC000436537894 944414330 /nfs/dbraw/zinc/41/43/30/944414330.db2.gz GQTPYITZPLOPAP-QGZVFWFLSA-N -1 3 351.406 3.989 20 0 FHADHM Cc1cc(=O)[n-]c(CNc2nc(C)nc3sc4c(c32)CC[C@@H](C)C4)n1 ZINC000894377384 944414462 /nfs/dbraw/zinc/41/44/62/944414462.db2.gz MZADBWNDFJFRFG-SECBINFHSA-N -1 3 355.467 3.541 20 0 FHADHM CCC[C@H](NC(=O)c1ccc(C(C)C)cc1[O-])c1nnc2ccccn21 ZINC000436536109 944414483 /nfs/dbraw/zinc/41/44/83/944414483.db2.gz OOMYLVQDUQVJAT-INIZCTEOSA-N -1 3 352.438 3.830 20 0 FHADHM COc1ccc(C(=O)NCc2ccnc(Oc3ccc(F)cc3)c2)c([O-])c1 ZINC000436539024 944417965 /nfs/dbraw/zinc/41/79/65/944417965.db2.gz UXFLEYBCIABELM-UHFFFAOYSA-N -1 3 368.364 3.657 20 0 FHADHM Cc1ccc(CN2CCOCC2)cc1NC(=O)c1ccc(C(C)C)cc1[O-] ZINC000436540380 944418577 /nfs/dbraw/zinc/41/85/77/944418577.db2.gz WTIVNEIARRDHKE-UHFFFAOYSA-N -1 3 368.477 3.909 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(Oc3cccc(C(N)=O)c3)cc2)c([O-])c1 ZINC000436558922 944426450 /nfs/dbraw/zinc/42/64/50/944426450.db2.gz RPKYKYCKVMBKFL-UHFFFAOYSA-N -1 3 362.385 3.844 20 0 FHADHM Cc1cc(OC(C)C)ccc1[N-]S(=O)(=O)c1ccc2c(c1)C[C@H](C)O2 ZINC000518493816 944440213 /nfs/dbraw/zinc/44/02/13/944440213.db2.gz SIFNZYCBCOZYSF-AWEZNQCLSA-N -1 3 361.463 3.906 20 0 FHADHM CC(=O)c1ccc(C(=O)N2CCC(Cc3cccc(F)c3)CC2)cc1[O-] ZINC000436596704 944440912 /nfs/dbraw/zinc/44/09/12/944440912.db2.gz ROUMINUVZJYLAM-UHFFFAOYSA-N -1 3 355.409 3.829 20 0 FHADHM CCOC[C@@H]1CCN(C(=O)c2cc(CCc3ccccc3)ccc2[O-])C1 ZINC000436579345 944444491 /nfs/dbraw/zinc/44/44/91/944444491.db2.gz ZDTFLJUMLCLYRH-LJQANCHMSA-N -1 3 353.462 3.676 20 0 FHADHM Cc1ccc(C(=O)N[C@@H](C)c2nc(-c3ccc(F)c(C)c3)no2)c([O-])c1 ZINC000436580251 944445554 /nfs/dbraw/zinc/44/55/54/944445554.db2.gz BLSCSCGIYJZQKS-LBPRGKRZSA-N -1 3 355.369 3.689 20 0 FHADHM CN(CCOCC1CC1)C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436586674 944449077 /nfs/dbraw/zinc/44/90/77/944449077.db2.gz UJEBAVNAMHTKIB-UHFFFAOYSA-N -1 3 353.462 3.676 20 0 FHADHM CCc1ccc(-c2noc([C@H](C)NC(=O)c3ccc(OC)cc3[O-])n2)cc1 ZINC000436588194 944450423 /nfs/dbraw/zinc/45/04/23/944450423.db2.gz YWPOFFOUFXBNQG-LBPRGKRZSA-N -1 3 367.405 3.504 20 0 FHADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000436603636 944454620 /nfs/dbraw/zinc/45/46/20/944454620.db2.gz MIGNUWKHFBJXTE-VQTJNVASSA-N -1 3 365.473 3.872 20 0 FHADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1CCOCC12CCCC2 ZINC000436603296 944454780 /nfs/dbraw/zinc/45/47/80/944454780.db2.gz MKDNCVSIGFRVHK-UHFFFAOYSA-N -1 3 353.418 3.970 20 0 FHADHM Cc1cccc(C[C@H](CNCc2nc3c(s2)C[C@H](C)CC3)C(=O)[O-])c1 ZINC000426668443 944455702 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CC(=O)c1ccc(C(=O)N[C@H](C)c2cccc(N3CCCC3)c2)cc1[O-] ZINC000436658051 944488275 /nfs/dbraw/zinc/48/82/75/944488275.db2.gz KSVOJHPSHRIZAE-CQSZACIVSA-N -1 3 352.434 3.686 20 0 FHADHM CC[C@H](C)NC(=O)c1cccc(CNC(=O)c2ccc(C(C)C)cc2[O-])c1 ZINC000436648313 944496858 /nfs/dbraw/zinc/49/68/58/944496858.db2.gz PJCYZIDKVDCYJW-HNNXBMFYSA-N -1 3 368.477 3.974 20 0 FHADHM COc1ccc(C2(NC(=O)c3cc(OC)c([O-])c(OC)c3)CCCC2)cc1 ZINC000436663418 944497954 /nfs/dbraw/zinc/49/79/54/944497954.db2.gz LSEAVUKZBKFHSW-UHFFFAOYSA-N -1 3 371.433 3.617 20 0 FHADHM CC(=O)c1ccc(C(=O)N[C@@H](C)Cc2ccccc2C(F)(F)F)cc1[O-] ZINC000436671094 944504665 /nfs/dbraw/zinc/50/46/65/944504665.db2.gz JFONWFJPAUYVFH-NSHDSACASA-N -1 3 365.351 3.975 20 0 FHADHM CCCCOc1ccccc1NC(=O)CCNC(=O)c1ccc(C)cc1[O-] ZINC000436660189 944511497 /nfs/dbraw/zinc/51/14/97/944511497.db2.gz CBBVEUIGMMNWHW-UHFFFAOYSA-N -1 3 370.449 3.638 20 0 FHADHM CCCOc1cccc(-c2noc(-c3cc(OC)c([O-])c(OC)c3)n2)c1 ZINC000436686928 944525140 /nfs/dbraw/zinc/52/51/40/944525140.db2.gz FWRAZZFUUYKVBR-UHFFFAOYSA-N -1 3 356.378 3.915 20 0 FHADHM CCc1ccc(C(=O)N2CCC[C@@H](Oc3ccccc3OC)C2)c([O-])c1 ZINC000436689659 944528554 /nfs/dbraw/zinc/52/85/54/944528554.db2.gz WVFXVHOUXUZISW-MRXNPFEDSA-N -1 3 355.434 3.647 20 0 FHADHM Cc1ccc(-c2nc(SCc3noc(-c4ccccc4[O-])n3)n[nH]2)cc1 ZINC000436708985 944531008 /nfs/dbraw/zinc/53/10/08/944531008.db2.gz WSHLXLGYFUGIQP-UHFFFAOYSA-N -1 3 365.418 3.828 20 0 FHADHM O=C(Nc1ccc([O-])c(-c2nc3ccccc3s2)c1)[C@@H]1CC[C@@H](O)C1 ZINC000436708635 944531990 /nfs/dbraw/zinc/53/19/90/944531990.db2.gz SMNFCCBEBVFOHP-DGCLKSJQSA-N -1 3 354.431 3.768 20 0 FHADHM [O-]c1ccccc1-c1nc(CSc2ccc(Br)cn2)no1 ZINC000436709599 944532133 /nfs/dbraw/zinc/53/21/33/944532133.db2.gz YNTWXOSPKQMRPO-UHFFFAOYSA-N -1 3 364.224 3.892 20 0 FHADHM CC(C)(C)c1ccc(CN2CCN(C(=O)c3ccc([O-])cc3)CC2)s1 ZINC000436695078 944533435 /nfs/dbraw/zinc/53/34/35/944533435.db2.gz JPNRNKCBOPSRBW-UHFFFAOYSA-N -1 3 358.507 3.709 20 0 FHADHM CC1(C)Cc2ccc(C(=O)Nc3ccc([C@@H]4CCOC4)cc3)c([O-])c2O1 ZINC000436700785 944540506 /nfs/dbraw/zinc/54/05/06/944540506.db2.gz XKXSKFDNCJRLFY-OAHLLOKOSA-N -1 3 353.418 3.862 20 0 FHADHM [O-]c1ccccc1-c1nc(CSc2nccn2-c2ccccc2)no1 ZINC000436703707 944543429 /nfs/dbraw/zinc/54/34/29/944543429.db2.gz HTWBOPRAGQJVPJ-UHFFFAOYSA-N -1 3 350.403 3.920 20 0 FHADHM O=C(NCc1nccc(C(F)F)n1)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436737055 944566198 /nfs/dbraw/zinc/56/61/98/944566198.db2.gz HUNDJJPHRWGEMJ-UHFFFAOYSA-N -1 3 369.371 3.641 20 0 FHADHM CCCC[C@H](CC)CNC(=O)c1cc(NC(=O)c2cnoc2C)ccc1[O-] ZINC000436728387 944575331 /nfs/dbraw/zinc/57/53/31/944575331.db2.gz KWTCYKPXWORJBW-AWEZNQCLSA-N -1 3 373.453 3.887 20 0 FHADHM CCc1ncc(S(=O)(=O)[N-][C@H](C)c2ccccc2OC(C)C)s1 ZINC000516222158 944583548 /nfs/dbraw/zinc/58/35/48/944583548.db2.gz YCVAZPUHCMIQEB-GFCCVEGCSA-N -1 3 354.497 3.532 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N[C@H](C)c2ccc3c(c2)CCCC3)c1 ZINC000436784244 944626875 /nfs/dbraw/zinc/62/68/75/944626875.db2.gz PDXCSNZKWPXHSL-CYBMUJFWSA-N -1 3 352.434 3.720 20 0 FHADHM COc1ccc(-c2cc(C(=O)Nc3cc(Cl)ccc3[O-])n[nH]2)cc1OC ZINC000436786578 944634101 /nfs/dbraw/zinc/63/41/01/944634101.db2.gz SSTRCQCPUZCRLY-UHFFFAOYSA-N -1 3 373.796 3.705 20 0 FHADHM CC(C)[C@@H](C(=O)Nc1ccc(-c2nnn[n-]2)cc1)c1cccc(Cl)c1 ZINC000487744591 944634871 /nfs/dbraw/zinc/63/48/71/944634871.db2.gz XYEUYYNDXBFNTD-MRXNPFEDSA-N -1 3 355.829 3.898 20 0 FHADHM CC(C)[C@@H](C(=O)Nc1ccc(-c2nn[n-]n2)cc1)c1cccc(Cl)c1 ZINC000487744591 944634873 /nfs/dbraw/zinc/63/48/73/944634873.db2.gz XYEUYYNDXBFNTD-MRXNPFEDSA-N -1 3 355.829 3.898 20 0 FHADHM CC(C)(C)c1ccc(SCC(=O)Nc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000641980279 944639622 /nfs/dbraw/zinc/63/96/22/944639622.db2.gz GWBNQHXAJNBJLY-UHFFFAOYSA-N -1 3 367.478 3.895 20 0 FHADHM CC(C)(C)c1ccc(SCC(=O)Nc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000641980279 944639633 /nfs/dbraw/zinc/63/96/33/944639633.db2.gz GWBNQHXAJNBJLY-UHFFFAOYSA-N -1 3 367.478 3.895 20 0 FHADHM CCc1ccc(C(=O)Nc2ccccc2C(=O)N2CCCCC2)c([O-])c1 ZINC000436794147 944645721 /nfs/dbraw/zinc/64/57/21/944645721.db2.gz AKBMCXIYWCVJOF-UHFFFAOYSA-N -1 3 352.434 3.833 20 0 FHADHM CC(C)c1ccc(C(=O)NCc2nc(-c3cccc(F)c3)no2)c([O-])c1 ZINC000436815621 944652449 /nfs/dbraw/zinc/65/24/49/944652449.db2.gz OZABTYKSCUVNPX-UHFFFAOYSA-N -1 3 355.369 3.635 20 0 FHADHM O=C(NC[C@@H](OCC1CC1)c1ccc(Cl)cc1)c1ccc(O)cc1[O-] ZINC000436818619 944655455 /nfs/dbraw/zinc/65/54/55/944655455.db2.gz KTVLSADFORXBPL-GOSISDBHSA-N -1 3 361.825 3.649 20 0 FHADHM CCc1ccc(C(=O)NCC(=O)Nc2cc(Cl)ccc2Cl)c([O-])c1 ZINC000436803100 944656224 /nfs/dbraw/zinc/65/62/24/944656224.db2.gz MNXHEOQTRYOCQZ-UHFFFAOYSA-N -1 3 367.232 3.630 20 0 FHADHM O=C(CCCc1ccc(Cl)c(Cl)c1)N=c1cc([C@@H]2CCCO2)[n-][nH]1 ZINC000473844397 944661121 /nfs/dbraw/zinc/66/11/21/944661121.db2.gz RMBFHLQELLAMHA-HNNXBMFYSA-N -1 3 368.264 3.951 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N[C@@H]2C[C@H](C(C)C)c3ccccc32)c1 ZINC000436807859 944662693 /nfs/dbraw/zinc/66/26/93/944662693.db2.gz NBRCPJYTWIRZPD-IEBWSBKVSA-N -1 3 352.434 3.965 20 0 FHADHM Cc1ccc(C(=O)N(C)Cc2ccc(Br)c(F)c2)c([O-])c1 ZINC000436811176 944665825 /nfs/dbraw/zinc/66/58/25/944665825.db2.gz ZXHVUJJXXRYATJ-UHFFFAOYSA-N -1 3 352.203 3.874 20 0 FHADHM CCc1ccc(C(=O)Nc2cc(F)ccc2OC[C@@H]2CCCO2)c([O-])c1 ZINC000436827645 944673235 /nfs/dbraw/zinc/67/32/35/944673235.db2.gz VDFITFGHQGSJBX-HNNXBMFYSA-N -1 3 359.397 3.904 20 0 FHADHM CCc1ccc(C(=O)N(C)CCCOc2cc(OC)cc(OC)c2)c([O-])c1 ZINC000436833295 944678459 /nfs/dbraw/zinc/67/84/59/944678459.db2.gz VNWPFMHXLDPQTN-UHFFFAOYSA-N -1 3 373.449 3.513 20 0 FHADHM O=C(Cc1cnc2ccccc2c1)N=c1cc(-c2cc(F)cc(F)c2)[n-][nH]1 ZINC000439506246 944690304 /nfs/dbraw/zinc/69/03/04/944690304.db2.gz CVCIWTYHIOBZQP-UHFFFAOYSA-N -1 3 364.355 3.506 20 0 FHADHM Cc1ccc([C@@H](NCc2cnn(-c3ccc(Cl)cc3)c2)C(=O)[O-])cc1 ZINC000426677508 944691242 /nfs/dbraw/zinc/69/12/42/944691242.db2.gz LZOSXQXRMSRVCP-GOSISDBHSA-N -1 3 355.825 3.750 20 0 FHADHM CC(C)Cc1ccc(CCCC(=O)N=c2cc([C@H]3CCCO3)[n-][nH]2)cc1 ZINC000473847280 944691278 /nfs/dbraw/zinc/69/12/78/944691278.db2.gz DEJVNVPRUOMGHC-LJQANCHMSA-N -1 3 355.482 3.843 20 0 FHADHM Cc1cc(C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)nc(C(F)(F)F)n1 ZINC000436821742 944691657 /nfs/dbraw/zinc/69/16/57/944691657.db2.gz YDOSJHYJGBHYNN-UHFFFAOYSA-N -1 3 365.233 3.781 20 0 FHADHM Cc1ccc(C(=O)Nc2cc(F)c(Cl)cc2N2CCOCC2)c([O-])c1 ZINC000436854313 944699647 /nfs/dbraw/zinc/69/96/47/944699647.db2.gz RXCOWRSBGRECER-UHFFFAOYSA-N -1 3 364.804 3.582 20 0 FHADHM CCc1ccc(C(=O)N2CCO[C@@H](c3ccc(F)cc3Cl)C2)c([O-])c1 ZINC000436841595 944707477 /nfs/dbraw/zinc/70/74/77/944707477.db2.gz VQSXDLZNXFOLBK-GOSISDBHSA-N -1 3 363.816 3.961 20 0 FHADHM C[C@@H](c1ccc(F)c(Cl)c1)N1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436846487 944715062 /nfs/dbraw/zinc/71/50/62/944715062.db2.gz XQSZPQPSFSXILE-ZDUSSCGKSA-N -1 3 362.832 3.704 20 0 FHADHM CCc1nc(C)c([C@@H](C)N(C)C(=O)c2cc(OC)c([O-])c(OC)c2)s1 ZINC000164180176 944738062 /nfs/dbraw/zinc/73/80/62/944738062.db2.gz GJYBQAJUPGLMKI-LLVKDONJSA-N -1 3 364.467 3.570 20 0 FHADHM O=C(Cc1ccc(-c2ccccc2)cc1)Nc1cccc(-c2nnn[n-]2)c1 ZINC000020501480 944742850 /nfs/dbraw/zinc/74/28/50/944742850.db2.gz CVGCAJLAZZKYDK-UHFFFAOYSA-N -1 3 355.401 3.715 20 0 FHADHM O=C(Cc1ccc(-c2ccccc2)cc1)Nc1cccc(-c2nn[n-]n2)c1 ZINC000020501480 944742860 /nfs/dbraw/zinc/74/28/60/944742860.db2.gz CVGCAJLAZZKYDK-UHFFFAOYSA-N -1 3 355.401 3.715 20 0 FHADHM CC[C@H](CC1CCCCC1)C(=O)N1CCN(C(=O)c2ccc([O-])cc2)CC1 ZINC000436874458 944743417 /nfs/dbraw/zinc/74/34/17/944743417.db2.gz QQWFHJPBUCZERF-GOSISDBHSA-N -1 3 372.509 3.673 20 0 FHADHM C[C@H](Sc1ccccc1-c1nnn[n-]1)c1nnc(-c2cccs2)o1 ZINC000736190469 944757516 /nfs/dbraw/zinc/75/75/16/944757516.db2.gz FMEQNAIZYGIXSC-VIFPVBQESA-N -1 3 356.436 3.832 20 0 FHADHM C[C@H](Sc1ccccc1-c1nn[n-]n1)c1nnc(-c2cccs2)o1 ZINC000736190469 944757522 /nfs/dbraw/zinc/75/75/22/944757522.db2.gz FMEQNAIZYGIXSC-VIFPVBQESA-N -1 3 356.436 3.832 20 0 FHADHM COc1cc(-c2nc(-c3ccnc(C(F)(F)F)c3)no2)cc(OC)c1[O-] ZINC000436885067 944759138 /nfs/dbraw/zinc/75/91/38/944759138.db2.gz MVIDLUCNAVBVJH-UHFFFAOYSA-N -1 3 367.283 3.540 20 0 FHADHM COc1ccccc1[C@H](NCc1ccc(Br)cc1C)C(=O)[O-] ZINC000426763430 944763648 /nfs/dbraw/zinc/76/36/48/944763648.db2.gz BRACFAMHKVCPCG-INIZCTEOSA-N -1 3 364.239 3.682 20 0 FHADHM Cc1cc(CN[C@H](C(=O)[O-])c2ccc(F)cc2)sc1Br ZINC000426765905 944764915 /nfs/dbraw/zinc/76/49/15/944764915.db2.gz UIBIUMGWRKTLHO-LBPRGKRZSA-N -1 3 358.232 3.874 20 0 FHADHM COc1ccccc1[C@@H](NCc1ccc(C(F)(F)F)cc1C)C(=O)[O-] ZINC000426766064 944765301 /nfs/dbraw/zinc/76/53/01/944765301.db2.gz WAPNPNSYDMAHET-MRXNPFEDSA-N -1 3 353.340 3.938 20 0 FHADHM CSc1cc(C(=O)Nc2cc(Cl)ccc2[O-])ccc1NC(C)=O ZINC000518785423 944765571 /nfs/dbraw/zinc/76/55/71/944765571.db2.gz WOAGEUMOUJZSDS-UHFFFAOYSA-N -1 3 350.827 3.978 20 0 FHADHM CC1(C)[C@H](NC(=O)c2cc(Cc3ccccc3)ccc2[O-])[C@@H]2CCO[C@@H]21 ZINC000436903868 944771531 /nfs/dbraw/zinc/77/15/31/944771531.db2.gz XKQJMPURFPXLPK-DBVUQKKJSA-N -1 3 351.446 3.526 20 0 FHADHM C[C@]1(C(=O)[O-])CCCC[C@@H]1NCc1csc(COc2ccccc2)n1 ZINC000426752930 944773001 /nfs/dbraw/zinc/77/30/01/944773001.db2.gz GHBSSYLMTPOPED-LPHOPBHVSA-N -1 3 360.479 3.845 20 0 FHADHM C[C@H]1CCC[C@H](C)N(C(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)C1 ZINC000736245124 944776822 /nfs/dbraw/zinc/77/68/22/944776822.db2.gz QTCLZANGJYCYRL-QWRGUYRKSA-N -1 3 364.906 3.727 20 0 FHADHM C[C@H]1CCC[C@H](C)N(C(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)C1 ZINC000736245124 944776832 /nfs/dbraw/zinc/77/68/32/944776832.db2.gz QTCLZANGJYCYRL-QWRGUYRKSA-N -1 3 364.906 3.727 20 0 FHADHM COc1ccc([O-])c(-c2nc(-c3ccc(NC(=O)NC(C)C)cc3)no2)c1 ZINC000436910435 944779624 /nfs/dbraw/zinc/77/96/24/944779624.db2.gz CTKADRASUFZBSG-UHFFFAOYSA-N -1 3 368.393 3.648 20 0 FHADHM CN(C[C@H]1CCCC[C@@H]1O)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436901202 944789959 /nfs/dbraw/zinc/78/99/59/944789959.db2.gz AFEYRCITFMGQSV-QUCCMNQESA-N -1 3 353.462 3.606 20 0 FHADHM COc1ccc([C@@H](NCc2cc(Cl)cc3cccnc32)C(=O)[O-])cc1F ZINC000426775850 944793912 /nfs/dbraw/zinc/79/39/12/944793912.db2.gz DADVVWKPGOYKOA-GOSISDBHSA-N -1 3 374.799 3.951 20 0 FHADHM CCCN(CC)C(=O)C[C@@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436914591 944798151 /nfs/dbraw/zinc/79/81/51/944798151.db2.gz ZTNQYZVGGHJHAE-LJQANCHMSA-N -1 3 354.450 3.512 20 0 FHADHM Cc1ccc(-c2nc(-c3ccc(NC(=O)NC(C)C)cc3)no2)c([O-])c1 ZINC000436916089 944798360 /nfs/dbraw/zinc/79/83/60/944798360.db2.gz UWLZGSWXQREPIU-UHFFFAOYSA-N -1 3 352.394 3.948 20 0 FHADHM O=C([O-])[C@@H](NCc1ccc(OCC(F)(F)F)cc1)c1cccc(F)c1 ZINC000426766740 944804073 /nfs/dbraw/zinc/80/40/73/944804073.db2.gz GTNGHJXKUZYOLP-HNNXBMFYSA-N -1 3 357.303 3.682 20 0 FHADHM CCOc1cc(CN[C@@H](C(=O)[O-])c2cccc(F)c2)ccc1OC(F)F ZINC000426767450 944805144 /nfs/dbraw/zinc/80/51/44/944805144.db2.gz NBOJWFMROQWJEM-MRXNPFEDSA-N -1 3 369.339 3.741 20 0 FHADHM COc1cccc([C@H](CC(=O)[O-])NCc2ccc3nc(C)ccc3c2)c1 ZINC000426767879 944805392 /nfs/dbraw/zinc/80/53/92/944805392.db2.gz RMBVJPPBEHYMEX-FQEVSTJZSA-N -1 3 350.418 3.857 20 0 FHADHM O=S(=O)([N-]c1ccc(F)cc1)c1ccc(OC(F)F)c(Cl)c1 ZINC000032585527 944805399 /nfs/dbraw/zinc/80/53/99/944805399.db2.gz GVOPSPGMSLSUMD-UHFFFAOYSA-N -1 3 351.733 3.881 20 0 FHADHM CC(C)c1ccc(C(=O)N2CC[C@@](CO)(Cc3ccc(F)cc3)C2)c([O-])c1 ZINC000436928070 944813828 /nfs/dbraw/zinc/81/38/28/944813828.db2.gz RJZMLEWYHPYTCJ-JOCHJYFZSA-N -1 3 371.452 3.722 20 0 FHADHM COc1cc(NC(=O)c2cc3c(cc2[O-])CCCC3)c(OC)c(C)c1OC ZINC000436929340 944814632 /nfs/dbraw/zinc/81/46/32/944814632.db2.gz UFBORAPJOKFIJM-UHFFFAOYSA-N -1 3 371.433 3.858 20 0 FHADHM COc1ccc(C(=O)NC[C@H](Cc2ccccc2)C(F)(F)F)c([O-])c1 ZINC000436938575 944825585 /nfs/dbraw/zinc/82/55/85/944825585.db2.gz JSCXVOADTDFPGR-ZDUSSCGKSA-N -1 3 353.340 3.552 20 0 FHADHM CC(C)[C@H](CC(=O)[O-])NCc1csc(COc2ccc(Cl)cc2)n1 ZINC000426829718 944826864 /nfs/dbraw/zinc/82/68/64/944826864.db2.gz RDNWNCTZOLBUAL-HNNXBMFYSA-N -1 3 368.886 3.964 20 0 FHADHM COC(=O)CCCCCNC(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436947731 944836369 /nfs/dbraw/zinc/83/63/69/944836369.db2.gz HIAMDPKNJAUFHC-UHFFFAOYSA-N -1 3 357.406 3.648 20 0 FHADHM Cc1nnc([C@H](C)NC(=O)c2cc(CCc3ccccc3)ccc2[O-])s1 ZINC000436962156 944838083 /nfs/dbraw/zinc/83/80/83/944838083.db2.gz WLAHKTAMPFTOBO-ZDUSSCGKSA-N -1 3 367.474 3.828 20 0 FHADHM CCc1ccc([C@H](NCc2ccc(OC)c(OC(F)F)c2)C(=O)[O-])cc1 ZINC000426817960 944840651 /nfs/dbraw/zinc/84/06/51/944840651.db2.gz QMLCGFJPBGMYFL-KRWDZBQOSA-N -1 3 365.376 3.775 20 0 FHADHM Cc1cc(N2CCOCC2)ccc1NC(=O)c1ccc2c(c1[O-])CCCC2 ZINC000436950710 944846347 /nfs/dbraw/zinc/84/63/47/944846347.db2.gz OJMGYNLUWQDNJE-UHFFFAOYSA-N -1 3 366.461 3.668 20 0 FHADHM CCc1ccc([C@H](NCc2cnn(Cc3ccc(F)cc3)c2)C(=O)[O-])cc1 ZINC000426824105 944846444 /nfs/dbraw/zinc/84/64/44/944846444.db2.gz LGTROSKVLIQXLV-FQEVSTJZSA-N -1 3 367.424 3.548 20 0 FHADHM CCc1ccc([C@H](NCc2cc(Cl)c(OC)c(OC)c2)C(=O)[O-])cc1 ZINC000426824350 944847919 /nfs/dbraw/zinc/84/79/19/944847919.db2.gz HRWOBLKDTBCELV-KRWDZBQOSA-N -1 3 363.841 3.835 20 0 FHADHM Cc1cc([C@H](NCc2cc3ccccc3[nH]c2=O)C(=O)[O-])ccc1Cl ZINC000426830115 944853850 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O=C(Nc1cc(Cl)ccc1[O-])c1n[nH]c(C2CC2)c1Br ZINC000049175897 945898506 /nfs/dbraw/zinc/89/85/06/945898506.db2.gz HFPHMLBFSGLBTD-UHFFFAOYSA-N -1 3 356.607 3.661 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H]3CCOC4(CCCC4)C3)nc2)n1 ZINC000301693083 945917113 /nfs/dbraw/zinc/91/71/13/945917113.db2.gz LKORZRZEQNNICZ-INIZCTEOSA-N -1 3 354.454 3.710 20 0 FHADHM Cc1nc(-c2cccc([N-]S(=O)(=O)c3ccc4c(c3)CCO4)c2)cs1 ZINC000045343315 946020419 /nfs/dbraw/zinc/02/04/19/946020419.db2.gz TZFWZZYPFPTMHV-UHFFFAOYSA-N -1 3 372.471 3.854 20 0 FHADHM O=C([N-]c1nnc(C(F)(F)F)s1)c1cscc1Br ZINC000507733503 946086429 /nfs/dbraw/zinc/08/64/29/946086429.db2.gz RHMFWYJALSIWJT-UHFFFAOYSA-N -1 3 358.164 3.633 20 0 FHADHM C[C@@H]1CCCCCN1C(=O)c1c[n-]c2ccc(Br)cc2c1=O ZINC000444271620 946155565 /nfs/dbraw/zinc/15/55/65/946155565.db2.gz USAPHPOTARKOEY-LLVKDONJSA-N -1 3 363.255 3.695 20 0 FHADHM Cc1c(C)c(C)c(S(=O)(=O)[N-]c2ccc(NC(N)=O)cc2)c(C)c1C ZINC000045800233 946167908 /nfs/dbraw/zinc/16/79/08/946167908.db2.gz 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CC(=O)Nc1cc(NC(=O)c2ccc3c(c2[O-])OC(C)(C)C3)ccc1Cl ZINC000103520998 946313339 /nfs/dbraw/zinc/31/33/39/946313339.db2.gz UTOBAOQNLXJRGT-UHFFFAOYSA-N -1 3 374.824 3.970 20 0 FHADHM O=C(Nc1cccc(Nc2ccccc2)c1)c1cc(-c2nnn[n-]2)cs1 ZINC000823368327 946416897 /nfs/dbraw/zinc/41/68/97/946416897.db2.gz UTDPOWGYASWKEN-UHFFFAOYSA-N -1 3 362.418 3.924 20 0 FHADHM O=C(Nc1cccc(Nc2ccccc2)c1)c1cc(-c2nn[n-]n2)cs1 ZINC000823368327 946416905 /nfs/dbraw/zinc/41/69/05/946416905.db2.gz UTDPOWGYASWKEN-UHFFFAOYSA-N -1 3 362.418 3.924 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CCOC34CCCCC4)nc2)n1 ZINC000896992610 946417088 /nfs/dbraw/zinc/41/70/88/946417088.db2.gz VBZLFNSAXWABOE-MRXNPFEDSA-N -1 3 354.454 3.710 20 0 FHADHM CC(C)(C(=O)Nc1ccc(-c2nnn[n-]2)cc1)c1ccc(Cl)cc1F ZINC000475505736 946504571 /nfs/dbraw/zinc/50/45/71/946504571.db2.gz DJZUUDVFXKNOCB-UHFFFAOYSA-N -1 3 359.792 3.576 20 0 FHADHM CC(C)(C(=O)Nc1ccc(-c2nn[n-]n2)cc1)c1ccc(Cl)cc1F ZINC000475505736 946504582 /nfs/dbraw/zinc/50/45/82/946504582.db2.gz DJZUUDVFXKNOCB-UHFFFAOYSA-N -1 3 359.792 3.576 20 0 FHADHM O=C(Cc1c[nH]c2cccc(Br)c12)[N-]OCc1ccccc1 ZINC000179070508 946514267 /nfs/dbraw/zinc/51/42/67/946514267.db2.gz PHPZPJAXZHXVNT-UHFFFAOYSA-N -1 3 359.223 3.721 20 0 FHADHM CCCc1sc(C(=O)Nc2ccc(Cc3nnn[n-]3)cc2)cc1CC ZINC000473898955 946534219 /nfs/dbraw/zinc/53/42/19/946534219.db2.gz YCIBNYRBZPFMJA-UHFFFAOYSA-N -1 3 355.467 3.619 20 0 FHADHM CCCc1sc(C(=O)Nc2ccc(Cc3nn[n-]n3)cc2)cc1CC ZINC000473898955 946534227 /nfs/dbraw/zinc/53/42/27/946534227.db2.gz YCIBNYRBZPFMJA-UHFFFAOYSA-N -1 3 355.467 3.619 20 0 FHADHM COc1cccc(NC(=O)C(C#N)=C([O-])c2sc(C(C)(C)C)nc2C)c1 ZINC000147050134 946580215 /nfs/dbraw/zinc/58/02/15/946580215.db2.gz BMOPSGRYRTVHPF-AWEZNQCLSA-N -1 3 371.462 3.719 20 0 FHADHM CC(C)(CO)[C@H](CNc1c(Cl)cccc1-c1nnn[n-]1)c1ccccc1 ZINC000824163127 946605394 /nfs/dbraw/zinc/60/53/94/946605394.db2.gz YVLKKBURVUAFFH-OAHLLOKOSA-N -1 3 371.872 3.734 20 0 FHADHM CC(C)(CO)[C@H](CNc1c(Cl)cccc1-c1nn[n-]n1)c1ccccc1 ZINC000824163127 946605400 /nfs/dbraw/zinc/60/54/00/946605400.db2.gz YVLKKBURVUAFFH-OAHLLOKOSA-N -1 3 371.872 3.734 20 0 FHADHM CC(C)[C@H](Sc1cccc(Cl)c1-c1nnn[n-]1)C(=O)NC(C)(C)C ZINC000824207067 946623939 /nfs/dbraw/zinc/62/39/39/946623939.db2.gz OSQIJVMCFZAEKM-ZDUSSCGKSA-N -1 3 367.906 3.552 20 0 FHADHM CC(C)[C@H](Sc1cccc(Cl)c1-c1nn[n-]n1)C(=O)NC(C)(C)C ZINC000824207067 946623944 /nfs/dbraw/zinc/62/39/44/946623944.db2.gz OSQIJVMCFZAEKM-ZDUSSCGKSA-N -1 3 367.906 3.552 20 0 FHADHM COc1cc([C@H](C)N[C@@H](C)c2nc(C)cc(=O)[n-]2)ccc1OCC(C)C ZINC000192727563 946631400 /nfs/dbraw/zinc/63/14/00/946631400.db2.gz YABUFBPOWTXANM-GJZGRUSLSA-N -1 3 359.470 3.946 20 0 FHADHM Cc1cnccc1[N-]S(=O)(=O)c1ccc(OCc2ccccc2)cc1 ZINC000112496800 946631597 /nfs/dbraw/zinc/63/15/97/946631597.db2.gz LCASDTHOXCYKGT-UHFFFAOYSA-N -1 3 354.431 3.770 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)CCCc1ccsc1 ZINC000824292880 946644929 /nfs/dbraw/zinc/64/49/29/946644929.db2.gz CBZZZZKZIPHCQB-UHFFFAOYSA-N -1 3 369.494 3.688 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)CCCc1ccsc1 ZINC000824292880 946644934 /nfs/dbraw/zinc/64/49/34/946644934.db2.gz CBZZZZKZIPHCQB-UHFFFAOYSA-N -1 3 369.494 3.688 20 0 FHADHM Brc1cccc(-c2nnn[n-]2)c1N1CCC=C(c2ccco2)C1 ZINC001573280326 946659668 /nfs/dbraw/zinc/65/96/68/946659668.db2.gz STPUFELQLGJKTF-UHFFFAOYSA-N -1 3 372.226 3.516 20 0 FHADHM Brc1cccc(-c2nn[n-]n2)c1N1CCC=C(c2ccco2)C1 ZINC001573280326 946659675 /nfs/dbraw/zinc/65/96/75/946659675.db2.gz STPUFELQLGJKTF-UHFFFAOYSA-N -1 3 372.226 3.516 20 0 FHADHM Cc1cc(S(=O)(=O)[N-]CCc2nc3ccccc3s2)sc1Cl ZINC000473914046 946664255 /nfs/dbraw/zinc/66/42/55/946664255.db2.gz UZBYSAUSIOFCHJ-UHFFFAOYSA-N -1 3 372.924 3.841 20 0 FHADHM CC(C)c1nccc(Sc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)n1 ZINC000824364692 946669362 /nfs/dbraw/zinc/66/93/62/946669362.db2.gz QEWQMKWLITZQPC-UHFFFAOYSA-N -1 3 366.372 3.950 20 0 FHADHM CC(C)c1nccc(Sc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)n1 ZINC000824364692 946669365 /nfs/dbraw/zinc/66/93/65/946669365.db2.gz QEWQMKWLITZQPC-UHFFFAOYSA-N -1 3 366.372 3.950 20 0 FHADHM C[C@@H](CN(C)c1ccc(C(F)(F)F)cc1-c1nnn[n-]1)c1nccs1 ZINC000824414312 946700799 /nfs/dbraw/zinc/70/07/99/946700799.db2.gz ZFMZTIFNIZZFLI-VIFPVBQESA-N -1 3 368.388 3.582 20 0 FHADHM C[C@@H](CN(C)c1ccc(C(F)(F)F)cc1-c1nn[n-]n1)c1nccs1 ZINC000824414312 946700808 /nfs/dbraw/zinc/70/08/08/946700808.db2.gz ZFMZTIFNIZZFLI-VIFPVBQESA-N -1 3 368.388 3.582 20 0 FHADHM C[C@H](NC(=O)[C@@H]1C[C@H]1C1CC1)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824470487 946722494 /nfs/dbraw/zinc/72/24/94/946722494.db2.gz IUKSCTDVWKZRAC-QTJFZDIUSA-N -1 3 373.460 3.757 20 0 FHADHM C[C@H](NC(=O)[C@@H]1C[C@H]1C1CC1)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824470487 946722512 /nfs/dbraw/zinc/72/25/12/946722512.db2.gz IUKSCTDVWKZRAC-QTJFZDIUSA-N -1 3 373.460 3.757 20 0 FHADHM CNC(=O)c1sc2[n-]c(-c3cc(C)c4ccccc4n3)nc(=O)c2c1C ZINC000487500516 946730165 /nfs/dbraw/zinc/73/01/65/946730165.db2.gz NIXJLSIFTFBLNV-UHFFFAOYSA-N -1 3 364.430 3.589 20 0 FHADHM CCOC(=O)c1ccc(NC(=O)C2CCC(C(F)(F)F)CC2)c([O-])c1 ZINC000444333557 946736873 /nfs/dbraw/zinc/73/68/73/946736873.db2.gz ZWTWAUGUEVZXMF-UHFFFAOYSA-N -1 3 359.344 3.876 20 0 FHADHM C[C@@H](NC(=O)c1ccco1)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824521258 946758409 /nfs/dbraw/zinc/75/84/09/946758409.db2.gz IZFIVTJZHKDWHJ-CYBMUJFWSA-N -1 3 359.389 3.618 20 0 FHADHM C[C@@H](NC(=O)c1ccco1)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824521258 946758420 /nfs/dbraw/zinc/75/84/20/946758420.db2.gz IZFIVTJZHKDWHJ-CYBMUJFWSA-N -1 3 359.389 3.618 20 0 FHADHM Cc1cc(S(=O)(=O)[N-][C@@H]2CCO[C@H](C(C)(C)C)C2)sc1Cl ZINC000473937075 946824934 /nfs/dbraw/zinc/82/49/34/946824934.db2.gz OTDXDPDZWOQZIW-MNOVXSKESA-N -1 3 351.921 3.582 20 0 FHADHM CC(=O)c1c(C)cc(OCc2cn3ccccc3c2-c2nnn[n-]2)cc1C ZINC001573551797 946870784 /nfs/dbraw/zinc/87/07/84/946870784.db2.gz KGAYQYSYRWZLHT-UHFFFAOYSA-N -1 3 361.405 3.518 20 0 FHADHM CC(=O)c1c(C)cc(OCc2cn3ccccc3c2-c2nn[n-]n2)cc1C ZINC001573551797 946870795 /nfs/dbraw/zinc/87/07/95/946870795.db2.gz KGAYQYSYRWZLHT-UHFFFAOYSA-N -1 3 361.405 3.518 20 0 FHADHM C[C@@H](Nc1ccc(Br)cc1-c1nnn[n-]1)c1cccc(O)c1 ZINC000824655679 946888388 /nfs/dbraw/zinc/88/83/88/946888388.db2.gz DVEGZNRDTYGUNF-SECBINFHSA-N -1 3 360.215 3.508 20 0 FHADHM C[C@@H](Nc1ccc(Br)cc1-c1nn[n-]n1)c1cccc(O)c1 ZINC000824655679 946888410 /nfs/dbraw/zinc/88/84/10/946888410.db2.gz DVEGZNRDTYGUNF-SECBINFHSA-N -1 3 360.215 3.508 20 0 FHADHM Cc1nn(Cc2ccccc2Cl)c(C)c1CNCc1ncccc1[O-] ZINC000475342035 946912535 /nfs/dbraw/zinc/91/25/35/946912535.db2.gz JSHJDMLLDUHFAG-UHFFFAOYSA-N -1 3 356.857 3.592 20 0 FHADHM O=C(c1ccc(O)cc1[O-])N(Cc1ccc(C(F)(F)F)cc1)C1CC1 ZINC000193119385 946931637 /nfs/dbraw/zinc/93/16/37/946931637.db2.gz MRMRCDMBAUNTME-UHFFFAOYSA-N -1 3 351.324 3.921 20 0 FHADHM CC(C)c1ccc(C(=O)NC[C@@]2(O)CCC[C@@H](C(F)(F)F)C2)c([O-])c1 ZINC000444499663 946963088 /nfs/dbraw/zinc/96/30/88/946963088.db2.gz GWOWDBMWIFSMBI-CXAGYDPISA-N -1 3 359.388 3.729 20 0 FHADHM CCCN(C(=O)c1cnc2c(cnn2C)c1[O-])[C@@H](CC)c1ccccc1 ZINC000511916678 946965431 /nfs/dbraw/zinc/96/54/31/946965431.db2.gz OLIDBNCUHUIFRR-KRWDZBQOSA-N -1 3 352.438 3.677 20 0 FHADHM CCCN(C(=O)c1cnc2c(cnn2C)c1[O-])[C@H](CC)c1ccccc1 ZINC000511916679 946965681 /nfs/dbraw/zinc/96/56/81/946965681.db2.gz OLIDBNCUHUIFRR-QGZVFWFLSA-N -1 3 352.438 3.677 20 0 FHADHM COc1ccc(C(=O)N[C@@H](C)c2ccc(Br)s2)c([O-])c1 ZINC000444541139 946984312 /nfs/dbraw/zinc/98/43/12/946984312.db2.gz HHZJSPQCNJVADF-QMMMGPOBSA-N -1 3 356.241 3.716 20 0 FHADHM O=C(OCc1noc(-c2ccccc2[O-])n1)c1csc(-c2ccoc2)n1 ZINC000783577247 947052918 /nfs/dbraw/zinc/05/29/18/947052918.db2.gz QFTNHLOCECWWPK-UHFFFAOYSA-N -1 3 369.358 3.516 20 0 FHADHM CC[C@@H](C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccc(OC)cc1 ZINC000825039254 947055658 /nfs/dbraw/zinc/05/56/58/947055658.db2.gz OULDCMPLYJKPRY-SCLBCKFNSA-N -1 3 366.421 3.673 20 0 FHADHM CC[C@@H](C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccc(OC)cc1 ZINC000825039254 947055668 /nfs/dbraw/zinc/05/56/68/947055668.db2.gz OULDCMPLYJKPRY-SCLBCKFNSA-N -1 3 366.421 3.673 20 0 FHADHM CC[C@H](C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccc(OC)cc1 ZINC000825039833 947057845 /nfs/dbraw/zinc/05/78/45/947057845.db2.gz XCRKFGNNRBRFLU-AWEZNQCLSA-N -1 3 371.828 3.661 20 0 FHADHM CC[C@H](C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccc(OC)cc1 ZINC000825039833 947057859 /nfs/dbraw/zinc/05/78/59/947057859.db2.gz XCRKFGNNRBRFLU-AWEZNQCLSA-N -1 3 371.828 3.661 20 0 FHADHM O=C(c1ccc2c(c1)C(=O)[N-]C2=O)N1CCCC[C@@H]1c1cccc(Cl)c1 ZINC000444663062 947080203 /nfs/dbraw/zinc/08/02/03/947080203.db2.gz JYDFEHATVYLVPA-QGZVFWFLSA-N -1 3 368.820 3.591 20 0 FHADHM O=C([O-])c1cc(F)ccc1CN1CCC(OCc2ccc(F)cc2)CC1 ZINC000652434856 947109298 /nfs/dbraw/zinc/10/92/98/947109298.db2.gz GKVITFGWPVDFIV-UHFFFAOYSA-N -1 3 361.388 3.844 20 0 FHADHM CCC[C@@H](C(=O)Oc1c(Cl)cc(-c2nnn[n-]2)cc1OC)C(C)C ZINC000825224962 947126765 /nfs/dbraw/zinc/12/67/65/947126765.db2.gz IFERAWGOHZFQPL-LLVKDONJSA-N -1 3 352.822 3.506 20 0 FHADHM CCC[C@@H](C(=O)Oc1c(Cl)cc(-c2nn[n-]n2)cc1OC)C(C)C ZINC000825224962 947126770 /nfs/dbraw/zinc/12/67/70/947126770.db2.gz IFERAWGOHZFQPL-LLVKDONJSA-N -1 3 352.822 3.506 20 0 FHADHM CCCc1c(NCc2cc(-c3nnn[n-]3)cs2)cnn1-c1ccccc1 ZINC000825348515 947161287 /nfs/dbraw/zinc/16/12/87/947161287.db2.gz OHELGGDCRUJFGB-UHFFFAOYSA-N -1 3 365.466 3.679 20 0 FHADHM CCCc1c(NCc2cc(-c3nn[n-]n3)cs2)cnn1-c1ccccc1 ZINC000825348515 947161294 /nfs/dbraw/zinc/16/12/94/947161294.db2.gz OHELGGDCRUJFGB-UHFFFAOYSA-N -1 3 365.466 3.679 20 0 FHADHM CCOCCN(CCc1ccc(Cl)cc1)Cc1ccc(C(=O)[O-])o1 ZINC000652472244 947200869 /nfs/dbraw/zinc/20/08/69/947200869.db2.gz BXOYUWXOXYHARR-UHFFFAOYSA-N -1 3 351.830 3.712 20 0 FHADHM CCC1([N-]S(=O)(=O)c2ccc(Cl)cc2C(F)(F)F)CCOCC1 ZINC000330551574 947205279 /nfs/dbraw/zinc/20/52/79/947205279.db2.gz XIJLGUHENYIURK-UHFFFAOYSA-N -1 3 371.808 3.596 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]C2CCC(F)(F)CC2)c(Cl)c1Cl ZINC000330521685 947208398 /nfs/dbraw/zinc/20/83/98/947208398.db2.gz HUBMALPHFCBHIS-UHFFFAOYSA-N -1 3 374.236 3.858 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N(C)Cc3ccc(OC)c(F)c3)nc2)n1 ZINC000301182528 947220183 /nfs/dbraw/zinc/22/01/83/947220183.db2.gz QUUNHVOCRNZGON-UHFFFAOYSA-N -1 3 368.412 3.591 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NCCOc3ccc(Cl)cc3)nc2)n1 ZINC000301193273 947226750 /nfs/dbraw/zinc/22/67/50/947226750.db2.gz XLQJLCASWWFFTC-UHFFFAOYSA-N -1 3 370.840 3.951 20 0 FHADHM Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)N1CCC(CC(F)(F)F)CC1 ZINC000330623005 947230018 /nfs/dbraw/zinc/23/00/18/947230018.db2.gz DKDPCNLIVUIPSR-UHFFFAOYSA-N -1 3 359.392 3.593 20 0 FHADHM CCCC(=O)N1CCCC[C@@H]1C(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000125381210 947241775 /nfs/dbraw/zinc/24/17/75/947241775.db2.gz VBRBQCPTMPPBKN-CYBMUJFWSA-N -1 3 358.360 3.531 20 0 FHADHM O=S(=O)([N-]Cc1ccn(C2CCCC2)n1)c1c(Cl)cccc1Cl ZINC000125668168 947257189 /nfs/dbraw/zinc/25/71/89/947257189.db2.gz LOISNBNWWJIUKZ-UHFFFAOYSA-N -1 3 374.293 3.784 20 0 FHADHM Cc1nn(C)c2sc(C(=O)[N-]c3nnc(Cc4ccccc4)s3)cc12 ZINC000028958889 947272032 /nfs/dbraw/zinc/27/20/32/947272032.db2.gz PCOUILWPJLDUCG-UHFFFAOYSA-N -1 3 369.475 3.638 20 0 FHADHM CCOc1ccccc1[C@@H](C)Nc1ncc(Cl)c(C)c1-c1nnn[n-]1 ZINC000825653697 947279841 /nfs/dbraw/zinc/27/98/41/947279841.db2.gz IHOCXTULQZMUCP-LLVKDONJSA-N -1 3 358.833 3.795 20 0 FHADHM CCOc1ccccc1[C@@H](C)Nc1ncc(Cl)c(C)c1-c1nn[n-]n1 ZINC000825653697 947279855 /nfs/dbraw/zinc/27/98/55/947279855.db2.gz IHOCXTULQZMUCP-LLVKDONJSA-N -1 3 358.833 3.795 20 0 FHADHM O=c1[n-]c(Sc2ccc(F)c(F)c2)nc2c1cnn2-c1ccccc1 ZINC000301357401 947305816 /nfs/dbraw/zinc/30/58/16/947305816.db2.gz PCILLPZFFCQDGH-UHFFFAOYSA-N -1 3 356.357 3.951 20 0 FHADHM CN(C)c1ccc(C(F)(F)F)cc1NCc1cccc(-c2nnn[n-]2)c1 ZINC000825875647 947351997 /nfs/dbraw/zinc/35/19/97/947351997.db2.gz UJUOSNGFJZPPFO-UHFFFAOYSA-N -1 3 362.359 3.564 20 0 FHADHM CN(C)c1ccc(C(F)(F)F)cc1NCc1cccc(-c2nn[n-]n2)c1 ZINC000825875647 947352015 /nfs/dbraw/zinc/35/20/15/947352015.db2.gz UJUOSNGFJZPPFO-UHFFFAOYSA-N -1 3 362.359 3.564 20 0 FHADHM CC[C@@H](CC1CCCCC1)C(=O)Nc1ccccc1[N-]S(C)(=O)=O ZINC000331349569 947402269 /nfs/dbraw/zinc/40/22/69/947402269.db2.gz NLTSRIUQPVKPHA-HNNXBMFYSA-N -1 3 352.500 3.993 20 0 FHADHM O=S(=O)([N-]Cc1ccc(Br)s1)c1ccc(Cl)s1 ZINC000028060318 947410284 /nfs/dbraw/zinc/41/02/84/947410284.db2.gz JDDVBBSRTQNXGM-UHFFFAOYSA-N -1 3 372.718 3.704 20 0 FHADHM C[C@@H](Oc1ccc(C(F)(F)F)cc1)C(=O)NCc1ccc([O-])c(F)c1 ZINC000188554580 947439054 /nfs/dbraw/zinc/43/90/54/947439054.db2.gz NRJYVSSKSNUKQW-SNVBAGLBSA-N -1 3 357.303 3.634 20 0 FHADHM O=S(=O)([N-]CCc1csc(-c2ccc(Cl)cc2)n1)c1ccco1 ZINC000188791874 947540925 /nfs/dbraw/zinc/54/09/25/947540925.db2.gz CGWYHNQHRKOHBT-UHFFFAOYSA-N -1 3 368.867 3.578 20 0 FHADHM O=C([O-])CC[C@H](CNCc1ccc(Br)cc1F)C(F)(F)F ZINC000663261852 947583694 /nfs/dbraw/zinc/58/36/94/947583694.db2.gz NHLPURXWHWOACN-SECBINFHSA-N -1 3 372.156 3.721 20 0 FHADHM COCc1cccc(CN[C@@H](C(=O)[O-])c2cccc(C(F)(F)F)c2)c1 ZINC000663260904 947589787 /nfs/dbraw/zinc/58/97/87/947589787.db2.gz DXJFEEZDJNTNHR-MRXNPFEDSA-N -1 3 353.340 3.767 20 0 FHADHM Cc1nc(-c2ccsc2)ccc1C(=O)Nc1n[n-]c(-c2ccco2)n1 ZINC000523823880 947642355 /nfs/dbraw/zinc/64/23/55/947642355.db2.gz KDFUOEBMYHDYTA-UHFFFAOYSA-N -1 3 351.391 3.749 20 0 FHADHM CO[C@H](CS(=O)(=O)[N-]c1c(C)c2ccccc2nc1SC)C(C)C ZINC000663300073 947693053 /nfs/dbraw/zinc/69/30/53/947693053.db2.gz PXFMPWJRDDWDGT-OAHLLOKOSA-N -1 3 368.524 3.678 20 0 FHADHM CC(=CC(=O)N(c1ccc(-c2nnn[n-]2)cc1)C1CCC1)c1cccs1 ZINC001573362024 947698118 /nfs/dbraw/zinc/69/81/18/947698118.db2.gz HGGGVNDUVAGXLS-OUKQBFOZSA-N -1 3 365.462 3.917 20 0 FHADHM CC(=CC(=O)N(c1ccc(-c2nn[n-]n2)cc1)C1CCC1)c1cccs1 ZINC001573362024 947698121 /nfs/dbraw/zinc/69/81/21/947698121.db2.gz HGGGVNDUVAGXLS-OUKQBFOZSA-N -1 3 365.462 3.917 20 0 FHADHM Cc1c(Cl)cnc(N[C@@H](C)c2cccc(F)c2F)c1-c1nnn[n-]1 ZINC000826239039 947704703 /nfs/dbraw/zinc/70/47/03/947704703.db2.gz WLWCBUOUCKTHFN-QMMMGPOBSA-N -1 3 350.760 3.675 20 0 FHADHM Cc1c(Cl)cnc(N[C@@H](C)c2cccc(F)c2F)c1-c1nn[n-]n1 ZINC000826239039 947704714 /nfs/dbraw/zinc/70/47/14/947704714.db2.gz WLWCBUOUCKTHFN-QMMMGPOBSA-N -1 3 350.760 3.675 20 0 FHADHM Cc1c(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cnn1-c1ccccc1F ZINC000826242389 947721073 /nfs/dbraw/zinc/72/10/73/947721073.db2.gz MUAOAWMVVBJBPR-LBPRGKRZSA-N -1 3 363.400 3.673 20 0 FHADHM Cc1c(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cnn1-c1ccccc1F ZINC000826242389 947721078 /nfs/dbraw/zinc/72/10/78/947721078.db2.gz MUAOAWMVVBJBPR-LBPRGKRZSA-N -1 3 363.400 3.673 20 0 FHADHM C/C(=C\C1CCC(C)CC1)C(=O)NC1(c2cccc(-c3nnn[n-]3)c2)CC1 ZINC001573364570 947723353 /nfs/dbraw/zinc/72/33/53/947723353.db2.gz HTIKBCFLNSHHFO-NTCAYCPXSA-N -1 3 365.481 3.745 20 0 FHADHM C/C(=C\C1CCC(C)CC1)C(=O)NC1(c2cccc(-c3nn[n-]n3)c2)CC1 ZINC001573364570 947723356 /nfs/dbraw/zinc/72/33/56/947723356.db2.gz HTIKBCFLNSHHFO-NTCAYCPXSA-N -1 3 365.481 3.745 20 0 FHADHM CC(=CC(=O)N(c1cccc(-c2nnn[n-]2)c1)C1CCC1)c1ccccc1 ZINC001573365887 947735015 /nfs/dbraw/zinc/73/50/15/947735015.db2.gz USRXEAXHFHHRJV-FYWRMAATSA-N -1 3 359.433 3.856 20 0 FHADHM CC(=CC(=O)N(c1cccc(-c2nn[n-]n2)c1)C1CCC1)c1ccccc1 ZINC001573365887 947735019 /nfs/dbraw/zinc/73/50/19/947735019.db2.gz USRXEAXHFHHRJV-FYWRMAATSA-N -1 3 359.433 3.856 20 0 FHADHM COc1ccc(NC(=O)Nc2ccc(-c3cc(=O)[n-]c(C)n3)cc2)cc1 ZINC000520469083 947736315 /nfs/dbraw/zinc/73/63/15/947736315.db2.gz DYTVSXDSEADBKI-UHFFFAOYSA-N -1 3 350.378 3.810 20 0 FHADHM CC(=CC(=O)Oc1ccc(-c2nnn[n-]2)cc1)c1ccc(C(F)(F)F)cc1 ZINC001573366905 947749942 /nfs/dbraw/zinc/74/99/42/947749942.db2.gz UYWQKJPXWHTZMH-ZHACJKMWSA-N -1 3 374.322 3.894 20 0 FHADHM CC(=CC(=O)Oc1ccc(-c2nn[n-]n2)cc1)c1ccc(C(F)(F)F)cc1 ZINC001573366905 947749950 /nfs/dbraw/zinc/74/99/50/947749950.db2.gz UYWQKJPXWHTZMH-ZHACJKMWSA-N -1 3 374.322 3.894 20 0 FHADHM Cc1ccc(CN[C@@H](c2cccc(-c3nnn[n-]3)c2)C(F)(F)F)cc1F ZINC000826288831 947840115 /nfs/dbraw/zinc/84/01/15/947840115.db2.gz YMJUWMRYADMQRD-HNNXBMFYSA-N -1 3 365.334 3.707 20 0 FHADHM Cc1ccc(CN[C@@H](c2cccc(-c3nn[n-]n3)c2)C(F)(F)F)cc1F ZINC000826288831 947840120 /nfs/dbraw/zinc/84/01/20/947840120.db2.gz YMJUWMRYADMQRD-HNNXBMFYSA-N -1 3 365.334 3.707 20 0 FHADHM Cc1cccc([C@H]2CCN(c3nc(C(F)(F)F)ccc3-c3nnn[n-]3)C2)c1 ZINC000826297633 947861426 /nfs/dbraw/zinc/86/14/26/947861426.db2.gz NICJNGNZPPSXJK-ZDUSSCGKSA-N -1 3 374.370 3.583 20 0 FHADHM Cc1cccc([C@H]2CCN(c3nc(C(F)(F)F)ccc3-c3nn[n-]n3)C2)c1 ZINC000826297633 947861433 /nfs/dbraw/zinc/86/14/33/947861433.db2.gz NICJNGNZPPSXJK-ZDUSSCGKSA-N -1 3 374.370 3.583 20 0 FHADHM Cc1ccnc(N2CC=C(c3cccc4ccccc43)C2)c1-c1nnn[n-]1 ZINC000826310091 947893115 /nfs/dbraw/zinc/89/31/15/947893115.db2.gz KYEAETVWEYIOOF-UHFFFAOYSA-N -1 3 354.417 3.627 20 0 FHADHM Cc1ccnc(N2CC=C(c3cccc4ccccc43)C2)c1-c1nn[n-]n1 ZINC000826310091 947893121 /nfs/dbraw/zinc/89/31/21/947893121.db2.gz KYEAETVWEYIOOF-UHFFFAOYSA-N -1 3 354.417 3.627 20 0 FHADHM CCc1ccc(C(=O)Nc2ccc(Cl)c(C(=O)NC3CC3)c2)c([O-])c1 ZINC000189991436 947908295 /nfs/dbraw/zinc/90/82/95/947908295.db2.gz NDJJYCSJRJKYHU-UHFFFAOYSA-N -1 3 358.825 3.753 20 0 FHADHM Cc1cnc(CN[C@@H](C)c2ccc(-c3cccc(-c4nnn[n-]4)c3)cc2)o1 ZINC000826318757 947932273 /nfs/dbraw/zinc/93/22/73/947932273.db2.gz XTUCMQKOYNFXAV-AWEZNQCLSA-N -1 3 360.421 3.681 20 0 FHADHM Cc1cnc(CN[C@@H](C)c2ccc(-c3cccc(-c4nn[n-]n4)c3)cc2)o1 ZINC000826318757 947932281 /nfs/dbraw/zinc/93/22/81/947932281.db2.gz XTUCMQKOYNFXAV-AWEZNQCLSA-N -1 3 360.421 3.681 20 0 FHADHM Cc1nc(-c2ccc(CNc3nccc(C)c3-c3nnn[n-]3)cc2)cs1 ZINC000826322255 947942863 /nfs/dbraw/zinc/94/28/63/947942863.db2.gz DXJWEAJKMNAPMQ-UHFFFAOYSA-N -1 3 363.450 3.614 20 0 FHADHM Cc1nc(-c2ccc(CNc3nccc(C)c3-c3nn[n-]n3)cc2)cs1 ZINC000826322255 947942869 /nfs/dbraw/zinc/94/28/69/947942869.db2.gz DXJWEAJKMNAPMQ-UHFFFAOYSA-N -1 3 363.450 3.614 20 0 FHADHM CCc1ccc(C(=O)Nc2ccc(CCC(=O)N3CCCC3)cc2)c([O-])c1 ZINC000190316351 947965114 /nfs/dbraw/zinc/96/51/14/947965114.db2.gz SYFRAWYPNRVCKN-UHFFFAOYSA-N -1 3 366.461 3.762 20 0 FHADHM Cc1sc2[n-]c([C@@H](C)OC(=O)C=Cc3ccsc3)nc(=O)c2c1C ZINC000005174219 948029393 /nfs/dbraw/zinc/02/93/93/948029393.db2.gz VIAXMAWKPUCKFJ-ORAHPGNNSA-N -1 3 360.460 3.981 20 0 FHADHM CCc1ccc([C@@H]2CN(C(=O)c3cc(SC)ccc3[O-])CCO2)cc1 ZINC000613925549 948109168 /nfs/dbraw/zinc/10/91/68/948109168.db2.gz PRTKMGXXEYOOQI-IBGZPJMESA-N -1 3 357.475 3.890 20 0 FHADHM Fc1ccc(CN[C@@H](c2cccc(-c3nnn[n-]3)c2)C(F)(F)F)c(F)c1 ZINC000826375100 948162942 /nfs/dbraw/zinc/16/29/42/948162942.db2.gz ZNJNDSYNKKJBLI-AWEZNQCLSA-N -1 3 369.297 3.538 20 0 FHADHM Fc1ccc(CN[C@@H](c2cccc(-c3nn[n-]n3)c2)C(F)(F)F)c(F)c1 ZINC000826375100 948162946 /nfs/dbraw/zinc/16/29/46/948162946.db2.gz ZNJNDSYNKKJBLI-AWEZNQCLSA-N -1 3 369.297 3.538 20 0 FHADHM O=C(CCCc1ccc2ccccc2c1)NCc1cccc(-c2nnn[n-]2)c1 ZINC000826406834 948237114 /nfs/dbraw/zinc/23/71/14/948237114.db2.gz PELMVFSPKYRRDH-UHFFFAOYSA-N -1 3 371.444 3.659 20 0 FHADHM O=C(CCCc1ccc2ccccc2c1)NCc1cccc(-c2nn[n-]n2)c1 ZINC000826406834 948237119 /nfs/dbraw/zinc/23/71/19/948237119.db2.gz PELMVFSPKYRRDH-UHFFFAOYSA-N -1 3 371.444 3.659 20 0 FHADHM CC[C@@H](C)C(=O)N1CCC[C@@H](C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)C1 ZINC000134219102 948270099 /nfs/dbraw/zinc/27/00/99/948270099.db2.gz HIFCNRUGMJMWFM-VXGBXAGGSA-N -1 3 372.387 3.634 20 0 FHADHM CC[C@@H](NCc1c(Cl)cccc1OCc1cccc(OC)c1)C(=O)[O-] ZINC000417584132 948287390 /nfs/dbraw/zinc/28/73/90/948287390.db2.gz AXIFNEPTLZNNDL-QGZVFWFLSA-N -1 3 363.841 3.880 20 0 FHADHM COC(=O)c1ccc(C(=O)Nc2ccccc2Oc2cccc(F)c2)[n-]1 ZINC000432413723 948360677 /nfs/dbraw/zinc/36/06/77/948360677.db2.gz HWUFLDUUQNFZNJ-UHFFFAOYSA-N -1 3 354.337 3.985 20 0 FHADHM O=S(=O)([N-][C@@H]1C[C@H]1c1ccccc1)c1c2ncsc2ccc1Cl ZINC001211699989 948375010 /nfs/dbraw/zinc/37/50/10/948375010.db2.gz QCMJPZXDAWWNPW-WCQYABFASA-N -1 3 364.879 3.784 20 0 FHADHM Cc1ccc(Cl)c(S(=O)(=O)[N-][C@@H]2COc3ccccc3C2)c1Cl ZINC000614619380 948397695 /nfs/dbraw/zinc/39/76/95/948397695.db2.gz GORALPJCOMSUCO-LBPRGKRZSA-N -1 3 372.273 3.584 20 0 FHADHM Cc1cccc([C@H]2CCCCCN2C(=O)c2cnc3c(cnn3C)c2[O-])c1 ZINC000512107278 948435173 /nfs/dbraw/zinc/43/51/73/948435173.db2.gz CGYORGYQQZANQB-GOSISDBHSA-N -1 3 364.449 3.740 20 0 FHADHM c1ccc2c(c1)cccc2-c1nnc(COc2ccccc2-c2nnn[n-]2)o1 ZINC000826519839 948449033 /nfs/dbraw/zinc/44/90/33/948449033.db2.gz QMMYYVOXXCIABL-UHFFFAOYSA-N -1 3 370.372 3.649 20 0 FHADHM c1ccc2c(c1)cccc2-c1nnc(COc2ccccc2-c2nn[n-]n2)o1 ZINC000826519839 948449036 /nfs/dbraw/zinc/44/90/36/948449036.db2.gz QMMYYVOXXCIABL-UHFFFAOYSA-N -1 3 370.372 3.649 20 0 FHADHM CC(C)(C)c1ccc(C(F)(F)C(=O)Nc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC001442672367 948520578 /nfs/dbraw/zinc/52/05/78/948520578.db2.gz FVIARQXAZWIEIA-UHFFFAOYSA-N -1 3 371.391 3.895 20 0 FHADHM CC(C)(C)c1ccc(C(F)(F)C(=O)Nc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC001442672367 948520583 /nfs/dbraw/zinc/52/05/83/948520583.db2.gz FVIARQXAZWIEIA-UHFFFAOYSA-N -1 3 371.391 3.895 20 0 FHADHM CC(C)[C@H](CCc1ccccc1)C(=O)Nc1cc(-c2nnn[n-]2)ccc1F ZINC001460788443 948526205 /nfs/dbraw/zinc/52/62/05/948526205.db2.gz SXSXADRWNIFAFG-INIZCTEOSA-N -1 3 367.428 3.849 20 0 FHADHM CC(C)[C@H](CCc1ccccc1)C(=O)Nc1cc(-c2nn[n-]n2)ccc1F ZINC001460788443 948526210 /nfs/dbraw/zinc/52/62/10/948526210.db2.gz SXSXADRWNIFAFG-INIZCTEOSA-N -1 3 367.428 3.849 20 0 FHADHM CC[C@@H](C)c1ccccc1OCC(=O)Nc1cc(-c2nnn[n-]2)ccc1F ZINC001460783662 948526969 /nfs/dbraw/zinc/52/69/69/948526969.db2.gz GYMAEIPVNFRUBE-GFCCVEGCSA-N -1 3 369.400 3.537 20 0 FHADHM CC[C@@H](C)c1ccccc1OCC(=O)Nc1cc(-c2nn[n-]n2)ccc1F ZINC001460783662 948526975 /nfs/dbraw/zinc/52/69/75/948526975.db2.gz GYMAEIPVNFRUBE-GFCCVEGCSA-N -1 3 369.400 3.537 20 0 FHADHM C[C@@H]1CC[C@@](C)(/C=C\C(=O)NCc2ccc(-c3nnn[n-]3)cc2)C1(C)C ZINC001464879548 948530368 /nfs/dbraw/zinc/53/03/68/948530368.db2.gz IARSHWQEYPNTAA-LQLNPQEYSA-N -1 3 353.470 3.502 20 0 FHADHM C[C@@H]1CC[C@@](C)(/C=C\C(=O)NCc2ccc(-c3nn[n-]n3)cc2)C1(C)C ZINC001464879548 948530375 /nfs/dbraw/zinc/53/03/75/948530375.db2.gz IARSHWQEYPNTAA-LQLNPQEYSA-N -1 3 353.470 3.502 20 0 FHADHM C[C@@H](CC(=O)Nc1cc(-c2nnn[n-]2)ccc1F)Cc1ccc(Cl)cc1 ZINC001528093351 948541304 /nfs/dbraw/zinc/54/13/04/948541304.db2.gz FYLVYVPUBNLWRO-LLVKDONJSA-N -1 3 373.819 3.867 20 0 FHADHM C[C@@H](CC(=O)Nc1cc(-c2nn[n-]n2)ccc1F)Cc1ccc(Cl)cc1 ZINC001528093351 948541313 /nfs/dbraw/zinc/54/13/13/948541313.db2.gz FYLVYVPUBNLWRO-LLVKDONJSA-N -1 3 373.819 3.867 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)c1ccc(-c2cccc(F)c2)s1 ZINC001539570275 948548947 /nfs/dbraw/zinc/54/89/47/948548947.db2.gz WABCKOUCUJBWAC-UHFFFAOYSA-N -1 3 365.393 3.987 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)c1ccc(-c2cccc(F)c2)s1 ZINC001539570275 948548950 /nfs/dbraw/zinc/54/89/50/948548950.db2.gz WABCKOUCUJBWAC-UHFFFAOYSA-N -1 3 365.393 3.987 20 0 FHADHM O=S(=O)([N-]Cc1coc2ccccc12)c1ccc(Br)s1 ZINC000512149942 948559860 /nfs/dbraw/zinc/55/98/60/948559860.db2.gz WOGXJXZFNHMXGC-UHFFFAOYSA-N -1 3 372.265 3.735 20 0 FHADHM CCOc1ccc(S(=O)(=O)[N-]c2cc3cccnc3c(OC)c2)c(C)c1 ZINC000427621018 948583208 /nfs/dbraw/zinc/58/32/08/948583208.db2.gz AJTVPZAKYJHRLD-UHFFFAOYSA-N -1 3 372.446 3.751 20 0 FHADHM CCOC(=O)c1nnc([C@H](CC(C)C)NCc2ccc(SC)s2)[n-]1 ZINC000895105715 948604602 /nfs/dbraw/zinc/60/46/02/948604602.db2.gz OJGHWKXVERVPNH-LBPRGKRZSA-N -1 3 368.528 3.642 20 0 FHADHM CC(C)[C@@H](NC(=O)c1ccc(F)c(-c2nnn[n-]2)c1)c1ccccc1Cl ZINC001574079594 948769975 /nfs/dbraw/zinc/76/99/75/948769975.db2.gz LJEKQLHKOOTZNT-MRXNPFEDSA-N -1 3 373.819 3.786 20 0 FHADHM CC(C)[C@@H](NC(=O)c1ccc(F)c(-c2nn[n-]n2)c1)c1ccccc1Cl ZINC001574079594 948769989 /nfs/dbraw/zinc/76/99/89/948769989.db2.gz LJEKQLHKOOTZNT-MRXNPFEDSA-N -1 3 373.819 3.786 20 0 FHADHM O=S(=O)([N-]C1CCCCCC1)c1ccc(F)cc1Br ZINC000037408707 205026425 /nfs/dbraw/zinc/02/64/25/205026425.db2.gz QIEXXMZKAHCEGX-UHFFFAOYSA-N -1 3 350.253 3.589 20 0 FHADHM O=S(=O)([N-]c1ccccc1Br)c1cnc2ccccc2c1 ZINC000064708343 205303047 /nfs/dbraw/zinc/30/30/47/205303047.db2.gz ARRZMHTUYQWCDN-UHFFFAOYSA-N -1 3 363.236 3.798 20 0 FHADHM O=C(Nc1ccc(Br)cc1[O-])c1cnc(-c2ccccc2)nc1 ZINC000066916415 205366487 /nfs/dbraw/zinc/36/64/87/205366487.db2.gz 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ZINC000499497938 515347924 /nfs/dbraw/zinc/34/79/24/515347924.db2.gz BDHXTAZAIKZCAO-LBPRGKRZSA-N -1 3 371.466 3.509 20 0 FHADHM CC[C@H](c1n[n-]c(=NC(=O)NCCN(C)C(C)C)s1)c1ccccc1 ZINC000524702368 516793662 /nfs/dbraw/zinc/79/36/62/516793662.db2.gz DZSBYDMSOARYGH-HNNXBMFYSA-N -1 3 361.515 3.542 20 0 FHADHM CCCc1ccc(-c2cc(=NC(=O)c3ccc4c(c3)nnn4C)[nH][n-]2)cc1 ZINC000519169265 516910386 /nfs/dbraw/zinc/91/03/86/516910386.db2.gz VCMCELDXJMFDJR-UHFFFAOYSA-N -1 3 360.421 3.563 20 0 FHADHM CCCCCc1n[n-]c(=NC(=O)NC[C@H](C)N2CCC(C)CC2)s1 ZINC000519262068 516938531 /nfs/dbraw/zinc/93/85/31/516938531.db2.gz RMLSFYFGABHZCW-AWEZNQCLSA-N -1 3 353.536 3.513 20 0 FHADHM Cc1cn(-c2ncccc2F)nc1NC(=O)c1cc2c(cc1[O-])CCCC2 ZINC000533450179 517472391 /nfs/dbraw/zinc/47/23/91/517472391.db2.gz RQWXLIDBKLTVGR-UHFFFAOYSA-N -1 3 366.396 3.552 20 0 FHADHM CCCc1ccc(-c2cc(=NC(=O)c3cnn(CCCOC)c3)[nH][n-]2)cc1 ZINC000530262539 517665505 /nfs/dbraw/zinc/66/55/05/517665505.db2.gz SVHXITFXYUPEOU-UHFFFAOYSA-N -1 3 367.453 3.515 20 0 FHADHM O=C(N=c1cc([C@H]2CCCO2)[n-][nH]1)c1ccccc1NCc1cccnc1 ZINC000527500703 517713112 /nfs/dbraw/zinc/71/31/12/517713112.db2.gz ARNSOCJCTMFCHK-GOSISDBHSA-N -1 3 363.421 3.521 20 0 FHADHM Cc1[n-][nH]c(=NC(=O)[C@@H]2C[C@H]2c2cncn2C)c1-c1cccc(Cl)c1 ZINC000629965431 522552720 /nfs/dbraw/zinc/55/27/20/522552720.db2.gz VVXDNAUDLAPTTB-ZIAGYGMSSA-N -1 3 355.829 3.514 20 0 FHADHM Cc1nc(CCNC(=O)c2c[n-]nc2-c2ccc(Cl)s2)sc1C ZINC000186554993 567947413 /nfs/dbraw/zinc/94/74/13/567947413.db2.gz XXSXBAWNBSLVCP-UHFFFAOYSA-N -1 3 366.899 3.837 20 0 FHADHM CCSCc1ccc(C(=O)NCc2cc(=O)[n-]c(C3CCC3)n2)cc1 ZINC000602192832 567949175 /nfs/dbraw/zinc/94/91/75/567949175.db2.gz AXOMTXRWMAHWKQ-UHFFFAOYSA-N -1 3 357.479 3.633 20 0 FHADHM CCC[C@@H](CC)NC(=O)c1cc(=O)c2cc(Br)ccc2[n-]1 ZINC000602753505 568030792 /nfs/dbraw/zinc/03/07/92/568030792.db2.gz UKFDXXZICAHXGK-LLVKDONJSA-N -1 3 351.244 3.599 20 0 FHADHM CC(C)C[C@@H]1COCCN1C(=O)c1ccc(C(=O)c2cccc([O-])c2)cc1 ZINC000186981766 568034967 /nfs/dbraw/zinc/03/49/67/568034967.db2.gz YPMIKYMRECLLRC-LJQANCHMSA-N -1 3 367.445 3.510 20 0 FHADHM C[C@@H](SCCC(N)=O)c1nc(=O)c2c(-c3ccccc3)csc2[n-]1 ZINC000603585065 568122698 /nfs/dbraw/zinc/12/26/98/568122698.db2.gz STPGWXHVEMMBOH-SNVBAGLBSA-N -1 3 359.476 3.734 20 0 FHADHM CCOC(=O)c1ccc(S(=O)(=O)[N-]c2c(C)cc(C)cc2Cl)cc1 ZINC000603778942 568165767 /nfs/dbraw/zinc/16/57/67/568165767.db2.gz ANGVCZSFZDXFLW-UHFFFAOYSA-N -1 3 367.854 3.934 20 0 FHADHM Cc1[n-][nH]c(=O)c1CCNc1nc(C)nc2sc(-c3ccccc3)cc21 ZINC000603928291 568182725 /nfs/dbraw/zinc/18/27/25/568182725.db2.gz QNIQOWLXENOAND-AWEZNQCLSA-N -1 3 365.462 3.591 20 0 FHADHM O=c1cc(CN[C@H](c2c[nH]c3ccccc32)C(F)(F)F)nc(C2CC2)[n-]1 ZINC000563105905 568191656 /nfs/dbraw/zinc/19/16/56/568191656.db2.gz MPGLEZAQKJOVIC-MRXNPFEDSA-N -1 3 362.355 3.934 20 0 FHADHM COC(=O)c1cc2cc([N-]S(=O)(=O)c3ccc(C)cc3C)ccc2o1 ZINC000603978747 568193496 /nfs/dbraw/zinc/19/34/96/568193496.db2.gz MLDPAUYJFOIUPF-UHFFFAOYSA-N -1 3 359.403 3.637 20 0 FHADHM Cc1cc(Cl)ccc1Cc1cnc([N-]C(=O)c2cnns2)s1 ZINC000057034864 568234816 /nfs/dbraw/zinc/23/48/16/568234816.db2.gz GFQNATPVDYIDHZ-UHFFFAOYSA-N -1 3 350.856 3.800 20 0 FHADHM CCc1ccc([O-])c(C(=O)NCCc2nc3ccccc3n2C(F)F)c1 ZINC000604266211 568237488 /nfs/dbraw/zinc/23/74/88/568237488.db2.gz WDIXUDWFSJNOGE-UHFFFAOYSA-N -1 3 359.376 3.672 20 0 FHADHM CS(=O)(=O)[N-]c1cc(-c2nc(C3CCCCCC3)no2)ccc1F ZINC000563146379 568270170 /nfs/dbraw/zinc/27/01/70/568270170.db2.gz FIVXKYVWGDPSCD-UHFFFAOYSA-N -1 3 353.419 3.685 20 0 FHADHM CSCc1c2ccccc2oc1C(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000604490444 568303052 /nfs/dbraw/zinc/30/30/52/568303052.db2.gz PZJFINHUKRXULB-UHFFFAOYSA-N -1 3 365.418 3.728 20 0 FHADHM CSCc1c2ccccc2oc1C(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000604490444 568303053 /nfs/dbraw/zinc/30/30/53/568303053.db2.gz PZJFINHUKRXULB-UHFFFAOYSA-N -1 3 365.418 3.728 20 0 FHADHM CSc1ccc([O-])c(C(=O)N2C[C@H](C)O[C@@H](c3ccc(F)cc3)C2)c1 ZINC000669182680 568311954 /nfs/dbraw/zinc/31/19/54/568311954.db2.gz 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ZINC000604670959 568345079 /nfs/dbraw/zinc/34/50/79/568345079.db2.gz IZFDDOACHBXKPE-UHFFFAOYSA-N -1 3 366.486 3.772 20 0 FHADHM Cc1csc(C(C)(C)[N-]S(=O)(=O)c2cc(Cl)cc(Cl)c2)n1 ZINC000604770722 568363009 /nfs/dbraw/zinc/36/30/09/568363009.db2.gz DKUBJFMOYZOTOW-UHFFFAOYSA-N -1 3 365.307 3.972 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)NC(C)(C)c3nccs3)cc2)cc(=O)[n-]1 ZINC000604774687 568363047 /nfs/dbraw/zinc/36/30/47/568363047.db2.gz NPCOLYWBPGXBCL-UHFFFAOYSA-N -1 3 369.450 3.671 20 0 FHADHM CC[C@@H](Cc1ccc(Cl)cc1)NC(=O)c1c[n-]c2ccccc2c1=O ZINC000604755766 568364820 /nfs/dbraw/zinc/36/48/20/568364820.db2.gz CXTXLERZBVWJOA-HNNXBMFYSA-N -1 3 354.837 3.933 20 0 FHADHM COc1ccccc1-c1cc(=NC(=O)[C@@H]2C[C@@H]2c2c(F)cccc2F)[nH][n-]1 ZINC000604789399 568367272 /nfs/dbraw/zinc/36/72/72/568367272.db2.gz ZAVPUQHUPZKBEF-QWHCGFSZSA-N -1 3 369.371 3.528 20 0 FHADHM Cc1ccc(CN2C[C@@H](C(=O)Nc3cc(Cl)cc(C)c3[O-])CC2=O)cc1 ZINC000604902145 568385105 /nfs/dbraw/zinc/38/51/05/568385105.db2.gz NZDCYJPYYZXRRL-HNNXBMFYSA-N -1 3 372.852 3.650 20 0 FHADHM Brc1ccsc1CSc1n[n-]c(-c2ccccn2)n1 ZINC000604932505 568395132 /nfs/dbraw/zinc/39/51/32/568395132.db2.gz OTQRNNFLUFKEPY-UHFFFAOYSA-N -1 3 353.270 3.983 20 0 FHADHM CC(C)[C@@H](Sc1n[n-]c(-c2ccccn2)n1)C(=O)NC1CCCCCC1 ZINC000604933122 568395424 /nfs/dbraw/zinc/39/54/24/568395424.db2.gz BFBZSWNZJBJCEN-MRXNPFEDSA-N -1 3 373.526 3.822 20 0 FHADHM O=S(=O)([N-]c1ccc(-n2ccc(C(F)(F)F)n2)cc1)c1ccccc1 ZINC000006707134 568408871 /nfs/dbraw/zinc/40/88/71/568408871.db2.gz QGSMGQPFDNWYMI-UHFFFAOYSA-N -1 3 367.352 3.692 20 0 FHADHM COc1ccc(Cl)cc1-c1cc(=NC(=O)c2cc(F)ccc2C)[nH][n-]1 ZINC000605022104 568525550 /nfs/dbraw/zinc/52/55/50/568525550.db2.gz PCEWYJAWPPFJAC-UHFFFAOYSA-N -1 3 359.788 3.860 20 0 FHADHM CCCOc1ccc(S(=O)(=O)[N-]c2ccc(-c3cncnc3)cc2)cc1 ZINC000605118857 568573604 /nfs/dbraw/zinc/57/36/04/568573604.db2.gz KJRRFBBESIHTEP-UHFFFAOYSA-N -1 3 369.446 3.733 20 0 FHADHM Cc1cccc([C@H](C)C(=O)N(CC(C)C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737386617 598831751 /nfs/dbraw/zinc/83/17/51/598831751.db2.gz YASHCBOLYJWSQN-INIZCTEOSA-N -1 3 363.465 3.968 20 0 FHADHM Cc1cccc([C@H](C)C(=O)N(CC(C)C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737386617 598831753 /nfs/dbraw/zinc/83/17/53/598831753.db2.gz YASHCBOLYJWSQN-INIZCTEOSA-N -1 3 363.465 3.968 20 0 FHADHM Cc1cccc([C@H](C)C(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(F)F)c1 ZINC000737385442 598832699 /nfs/dbraw/zinc/83/26/99/598832699.db2.gz SOCLBOYFFMZKNW-NSHDSACASA-N -1 3 373.363 3.519 20 0 FHADHM Cc1cccc([C@H](C)C(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(F)F)c1 ZINC000737385442 598832700 /nfs/dbraw/zinc/83/27/00/598832700.db2.gz SOCLBOYFFMZKNW-NSHDSACASA-N -1 3 373.363 3.519 20 0 FHADHM CC(C)(C)CC(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000735593591 598835068 /nfs/dbraw/zinc/83/50/68/598835068.db2.gz KUGFBUXTACZQHW-UHFFFAOYSA-N -1 3 355.467 3.648 20 0 FHADHM CC(C)(C)/C=C/C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)nc1 ZINC000735592555 598903951 /nfs/dbraw/zinc/90/39/51/598903951.db2.gz BFAMGLVWIMVTFL-MDZDMXLPSA-N -1 3 364.409 3.595 20 0 FHADHM CC(C)(C)/C=C/C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)nc1 ZINC000735592555 598903953 /nfs/dbraw/zinc/90/39/53/598903953.db2.gz BFAMGLVWIMVTFL-MDZDMXLPSA-N -1 3 364.409 3.595 20 0 FHADHM CC[C@H](CC1CCCCC1)C(=O)NCc1ccc(-c2nnn[n-]2)cc1F ZINC000736350047 598905722 /nfs/dbraw/zinc/90/57/22/598905722.db2.gz KXQNJQMAMAOJDM-CQSZACIVSA-N -1 3 359.449 3.619 20 0 FHADHM CC[C@H](CC1CCCCC1)C(=O)NCc1ccc(-c2nn[n-]n2)cc1F ZINC000736350047 598905723 /nfs/dbraw/zinc/90/57/23/598905723.db2.gz KXQNJQMAMAOJDM-CQSZACIVSA-N -1 3 359.449 3.619 20 0 FHADHM C[C@@H]1C[C@H]1c1ccc(CN(c2ncc(-c3nnn[n-]3)cc2Cl)C2CC2)o1 ZINC000736242007 598936632 /nfs/dbraw/zinc/93/66/32/598936632.db2.gz YKSSWDYGXSWPBW-QMTHXVAHSA-N -1 3 370.844 3.801 20 0 FHADHM C[C@@H]1C[C@H]1c1ccc(CN(c2ncc(-c3nn[n-]n3)cc2Cl)C2CC2)o1 ZINC000736242007 598936633 /nfs/dbraw/zinc/93/66/33/598936633.db2.gz YKSSWDYGXSWPBW-QMTHXVAHSA-N -1 3 370.844 3.801 20 0 FHADHM Clc1ccc([C@@H]2CCCN2c2ncc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000737571184 598937868 /nfs/dbraw/zinc/93/78/68/598937868.db2.gz VNIRDZBAAGCRLG-AWEZNQCLSA-N -1 3 361.236 3.910 20 0 FHADHM Clc1ccc([C@@H]2CCCN2c2ncc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000737571184 598937869 /nfs/dbraw/zinc/93/78/69/598937869.db2.gz VNIRDZBAAGCRLG-AWEZNQCLSA-N -1 3 361.236 3.910 20 0 FHADHM Clc1ccc([C@H]2CCCN2c2ncc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000737571185 598938357 /nfs/dbraw/zinc/93/83/57/598938357.db2.gz VNIRDZBAAGCRLG-CQSZACIVSA-N -1 3 361.236 3.910 20 0 FHADHM Clc1ccc([C@H]2CCCN2c2ncc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000737571185 598938359 /nfs/dbraw/zinc/93/83/59/598938359.db2.gz VNIRDZBAAGCRLG-CQSZACIVSA-N -1 3 361.236 3.910 20 0 FHADHM CC[C@H]1CCC[C@H](NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)C1 ZINC000736401136 598939531 /nfs/dbraw/zinc/93/95/31/598939531.db2.gz VWWCODCSNWFYQC-QWRGUYRKSA-N -1 3 364.906 3.775 20 0 FHADHM CC[C@H]1CCC[C@H](NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)C1 ZINC000736401136 598939534 /nfs/dbraw/zinc/93/95/34/598939534.db2.gz VWWCODCSNWFYQC-QWRGUYRKSA-N -1 3 364.906 3.775 20 0 FHADHM CC(C)C[C@@H](C(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000735756814 598939570 /nfs/dbraw/zinc/93/95/70/598939570.db2.gz QWTHTQYWBHTQEF-LJQANCHMSA-N -1 3 363.465 3.655 20 0 FHADHM CC(C)C[C@@H](C(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000735756814 598939571 /nfs/dbraw/zinc/93/95/71/598939571.db2.gz QWTHTQYWBHTQEF-LJQANCHMSA-N -1 3 363.465 3.655 20 0 FHADHM CC[C@@H]1CCCN(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)C1 ZINC000820981852 599293569 /nfs/dbraw/zinc/29/35/69/599293569.db2.gz XCQLMELOUIAHQC-SNVBAGLBSA-N -1 3 368.363 3.539 20 0 FHADHM CC[C@@H]1CCCN(C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)C1 ZINC000820981852 599293571 /nfs/dbraw/zinc/29/35/71/599293571.db2.gz XCQLMELOUIAHQC-SNVBAGLBSA-N -1 3 368.363 3.539 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N[C@]1(C)CCCc2ccccc21 ZINC000737295482 598966805 /nfs/dbraw/zinc/96/68/05/598966805.db2.gz YCKJOGJMXUTCDJ-HXUWFJFHSA-N -1 3 362.437 3.548 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N[C@]1(C)CCCc2ccccc21 ZINC000737295482 598966807 /nfs/dbraw/zinc/96/68/07/598966807.db2.gz YCKJOGJMXUTCDJ-HXUWFJFHSA-N -1 3 362.437 3.548 20 0 FHADHM Cc1c2ccccc2oc1COC(=O)C=Cc1ccccc1-c1nnn[n-]1 ZINC000737215509 598974699 /nfs/dbraw/zinc/97/46/99/598974699.db2.gz KDQDIPKKZNRGLG-KHPPLWFESA-N -1 3 360.373 3.678 20 0 FHADHM Cc1c2ccccc2oc1COC(=O)C=Cc1ccccc1-c1nn[n-]n1 ZINC000737215509 598974701 /nfs/dbraw/zinc/97/47/01/598974701.db2.gz KDQDIPKKZNRGLG-KHPPLWFESA-N -1 3 360.373 3.678 20 0 FHADHM C[C@@H](S[C@@H](C(N)=O)c1ccc(-c2nnn[n-]2)cc1)c1ccc(Cl)cc1 ZINC000736192493 599012582 /nfs/dbraw/zinc/01/25/82/599012582.db2.gz ZOUUQLNKKBWJRZ-MEBBXXQBSA-N -1 3 373.869 3.541 20 0 FHADHM C[C@@H](S[C@@H](C(N)=O)c1ccc(-c2nn[n-]n2)cc1)c1ccc(Cl)cc1 ZINC000736192493 599012583 /nfs/dbraw/zinc/01/25/83/599012583.db2.gz ZOUUQLNKKBWJRZ-MEBBXXQBSA-N -1 3 373.869 3.541 20 0 FHADHM COC(=O)C[C@@H](C)SCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000736910475 599014299 /nfs/dbraw/zinc/01/42/99/599014299.db2.gz FDAXETAJOTVZJM-CYBMUJFWSA-N -1 3 368.462 3.719 20 0 FHADHM COC(=O)C[C@@H](C)SCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000736910475 599014301 /nfs/dbraw/zinc/01/43/01/599014301.db2.gz FDAXETAJOTVZJM-CYBMUJFWSA-N -1 3 368.462 3.719 20 0 FHADHM C[C@@H](Sc1ccc(-c2nnn[n-]2)cn1)c1ncc(-c2ccccc2)o1 ZINC000736192881 599032339 /nfs/dbraw/zinc/03/23/39/599032339.db2.gz NAVXCKSLOFLGMY-LLVKDONJSA-N -1 3 350.407 3.770 20 0 FHADHM C[C@@H](Sc1ccc(-c2nn[n-]n2)cn1)c1ncc(-c2ccccc2)o1 ZINC000736192881 599032341 /nfs/dbraw/zinc/03/23/41/599032341.db2.gz NAVXCKSLOFLGMY-LLVKDONJSA-N -1 3 350.407 3.770 20 0 FHADHM C[C@H]1CN(c2c(Cl)cccc2-c2nnn[n-]2)C[C@H](c2ccc(F)cc2)O1 ZINC000820768346 599039020 /nfs/dbraw/zinc/03/90/20/599039020.db2.gz MWIHIFUVERPACQ-MEDUHNTESA-N -1 3 373.819 3.626 20 0 FHADHM C[C@H]1CN(c2c(Cl)cccc2-c2nn[n-]n2)C[C@H](c2ccc(F)cc2)O1 ZINC000820768346 599039021 /nfs/dbraw/zinc/03/90/21/599039021.db2.gz MWIHIFUVERPACQ-MEDUHNTESA-N -1 3 373.819 3.626 20 0 FHADHM CN(Cc1cccc(Cl)c1)c1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000736828620 599039568 /nfs/dbraw/zinc/03/95/68/599039568.db2.gz PLBJGNIAWOGLPL-UHFFFAOYSA-N -1 3 368.750 3.570 20 0 FHADHM CN(Cc1cccc(Cl)c1)c1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000736828620 599039572 /nfs/dbraw/zinc/03/95/72/599039572.db2.gz PLBJGNIAWOGLPL-UHFFFAOYSA-N -1 3 368.750 3.570 20 0 FHADHM CO[C@@H](CNc1cc(Cl)ccc1-c1nnn[n-]1)c1ccc(Cl)cc1 ZINC000821677389 599044176 /nfs/dbraw/zinc/04/41/76/599044176.db2.gz WBEJOLDHXHCECD-HNNXBMFYSA-N -1 3 364.236 3.973 20 0 FHADHM CO[C@@H](CNc1cc(Cl)ccc1-c1nn[n-]n1)c1ccc(Cl)cc1 ZINC000821677389 599044179 /nfs/dbraw/zinc/04/41/79/599044179.db2.gz WBEJOLDHXHCECD-HNNXBMFYSA-N -1 3 364.236 3.973 20 0 FHADHM C[C@H]1C[C@@H]1c1ccc(CNc2nc(C(F)(F)F)ccc2-c2nnn[n-]2)o1 ZINC000736240396 599045892 /nfs/dbraw/zinc/04/58/92/599045892.db2.gz UTLJHRIDKYCIIC-KWQFWETISA-N -1 3 364.331 3.609 20 0 FHADHM C[C@H]1C[C@@H]1c1ccc(CNc2nc(C(F)(F)F)ccc2-c2nn[n-]n2)o1 ZINC000736240396 599045894 /nfs/dbraw/zinc/04/58/94/599045894.db2.gz UTLJHRIDKYCIIC-KWQFWETISA-N -1 3 364.331 3.609 20 0 FHADHM Cc1ccc([C@@H](C)Nc2nc(C(F)(F)F)ccc2-c2nnn[n-]2)s1 ZINC000737318313 599046495 /nfs/dbraw/zinc/04/64/95/599046495.db2.gz AAGMXVMPGKTUSM-MRVPVSSYSA-N -1 3 354.361 3.824 20 0 FHADHM Cc1ccc([C@@H](C)Nc2nc(C(F)(F)F)ccc2-c2nn[n-]n2)s1 ZINC000737318313 599046500 /nfs/dbraw/zinc/04/65/00/599046500.db2.gz AAGMXVMPGKTUSM-MRVPVSSYSA-N -1 3 354.361 3.824 20 0 FHADHM Fc1cccc2c1CC[C@H]2Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000737663223 599049894 /nfs/dbraw/zinc/04/98/94/599049894.db2.gz HXKJLUBIULENPE-GFCCVEGCSA-N -1 3 364.306 3.519 20 0 FHADHM Fc1cccc2c1CC[C@H]2Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000737663223 599049899 /nfs/dbraw/zinc/04/98/99/599049899.db2.gz HXKJLUBIULENPE-GFCCVEGCSA-N -1 3 364.306 3.519 20 0 FHADHM Fc1cc(F)c2ncc(-c3nnn[n-]3)c(N3CCC4(C3)CCCCC4)c2c1 ZINC000822753989 599051694 /nfs/dbraw/zinc/05/16/94/599051694.db2.gz VJQIEDHCNMWZJO-UHFFFAOYSA-N -1 3 370.407 3.854 20 0 FHADHM Fc1cc(F)c2ncc(-c3nn[n-]n3)c(N3CCC4(C3)CCCCC4)c2c1 ZINC000822753989 599051696 /nfs/dbraw/zinc/05/16/96/599051696.db2.gz VJQIEDHCNMWZJO-UHFFFAOYSA-N -1 3 370.407 3.854 20 0 FHADHM C[C@@H](CCc1cccn1C)Nc1ccc(-c2nn[n-]n2)cc1C(F)(F)F ZINC000820253315 599054500 /nfs/dbraw/zinc/05/45/00/599054500.db2.gz HWGXHDKDFFNRGW-NSHDSACASA-N -1 3 364.375 3.657 20 0 FHADHM Cc1ccc2c(c1)[C@H](Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1)CC2 ZINC000737372460 599055059 /nfs/dbraw/zinc/05/50/59/599055059.db2.gz YIQIWHOGVQOACJ-CYBMUJFWSA-N -1 3 360.343 3.688 20 0 FHADHM Cc1ccc2c(c1)[C@H](Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1)CC2 ZINC000737372460 599055060 /nfs/dbraw/zinc/05/50/60/599055060.db2.gz YIQIWHOGVQOACJ-CYBMUJFWSA-N -1 3 360.343 3.688 20 0 FHADHM Cc1cccc(O[C@H](C)CNc2cc(-c3nnn[n-]3)c3ccccc3n2)c1 ZINC000822328430 599057562 /nfs/dbraw/zinc/05/75/62/599057562.db2.gz PUMFQMDGTGYKOA-CQSZACIVSA-N -1 3 360.421 3.603 20 0 FHADHM Cc1cccc(O[C@H](C)CNc2cc(-c3nn[n-]n3)c3ccccc3n2)c1 ZINC000822328430 599057565 /nfs/dbraw/zinc/05/75/65/599057565.db2.gz PUMFQMDGTGYKOA-CQSZACIVSA-N -1 3 360.421 3.603 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1SCc1cc(Cl)nc(Cl)c1 ZINC000737644737 599064511 /nfs/dbraw/zinc/06/45/11/599064511.db2.gz LFSFOHQLNIOXEH-UHFFFAOYSA-N -1 3 356.213 4.000 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1SCc1cc(Cl)nc(Cl)c1 ZINC000737644737 599064512 /nfs/dbraw/zinc/06/45/12/599064512.db2.gz LFSFOHQLNIOXEH-UHFFFAOYSA-N -1 3 356.213 4.000 20 0 FHADHM C[C@@H](Sc1ccc(-c2nnn[n-]2)cc1F)c1nnc(-c2ccccc2)o1 ZINC000736194208 599065568 /nfs/dbraw/zinc/06/55/68/599065568.db2.gz XTKOSFYTUTWLQR-SNVBAGLBSA-N -1 3 368.397 3.909 20 0 FHADHM C[C@@H](Sc1ccc(-c2nn[n-]n2)cc1F)c1nnc(-c2ccccc2)o1 ZINC000736194208 599065571 /nfs/dbraw/zinc/06/55/71/599065571.db2.gz XTKOSFYTUTWLQR-SNVBAGLBSA-N -1 3 368.397 3.909 20 0 FHADHM Cc1c(NCc2ncc(-c3cccc(F)c3)o2)cccc1-c1nnn[n-]1 ZINC000822122076 607258211 /nfs/dbraw/zinc/25/82/11/607258211.db2.gz JPOLWABQKCMXDZ-UHFFFAOYSA-N -1 3 350.357 3.581 20 0 FHADHM Cc1c(NCc2ncc(-c3cccc(F)c3)o2)cccc1-c1nn[n-]n1 ZINC000822122076 607258212 /nfs/dbraw/zinc/25/82/12/607258212.db2.gz JPOLWABQKCMXDZ-UHFFFAOYSA-N -1 3 350.357 3.581 20 0 FHADHM Fc1cccc(N[C@H]2COc3c2ccc(Cl)c3Cl)c1-c1nnn[n-]1 ZINC000822792464 599076545 /nfs/dbraw/zinc/07/65/45/599076545.db2.gz XNEVRHFIZBVLCM-NSHDSACASA-N -1 3 366.183 3.858 20 0 FHADHM Fc1cccc(N[C@H]2COc3c2ccc(Cl)c3Cl)c1-c1nn[n-]n1 ZINC000822792464 599076548 /nfs/dbraw/zinc/07/65/48/599076548.db2.gz XNEVRHFIZBVLCM-NSHDSACASA-N -1 3 366.183 3.858 20 0 FHADHM C[C@H]1C[C@@H](c2ccccc2F)N(c2ncc(-c3nnn[n-]3)cc2Cl)C1 ZINC000820668472 599077259 /nfs/dbraw/zinc/07/72/59/599077259.db2.gz SZJCAYCHJGWQAA-BONVTDFDSA-N -1 3 358.808 3.642 20 0 FHADHM C[C@H]1C[C@@H](c2ccccc2F)N(c2ncc(-c3nn[n-]n3)cc2Cl)C1 ZINC000820668472 599077261 /nfs/dbraw/zinc/07/72/61/599077261.db2.gz SZJCAYCHJGWQAA-BONVTDFDSA-N -1 3 358.808 3.642 20 0 FHADHM Fc1cccc(Nc2cnn(Cc3ccc(Cl)cc3)c2)c1-c1nnn[n-]1 ZINC000822790978 599088664 /nfs/dbraw/zinc/08/86/64/599088664.db2.gz CFESWHZOHCMLLF-UHFFFAOYSA-N -1 3 369.791 3.648 20 0 FHADHM Fc1cccc(Nc2cnn(Cc3ccc(Cl)cc3)c2)c1-c1nn[n-]n1 ZINC000822790978 599088668 /nfs/dbraw/zinc/08/86/68/599088668.db2.gz CFESWHZOHCMLLF-UHFFFAOYSA-N -1 3 369.791 3.648 20 0 FHADHM C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)N1C(=O)C=Cc1ccccc1-c1nnn[n-]1 ZINC000736235680 599090484 /nfs/dbraw/zinc/09/04/84/599090484.db2.gz PLAIXLZHMRYMBV-KZUZWCRRSA-N -1 3 373.460 3.673 20 0 FHADHM C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)N1C(=O)C=Cc1ccccc1-c1nn[n-]n1 ZINC000736235680 599090486 /nfs/dbraw/zinc/09/04/86/599090486.db2.gz PLAIXLZHMRYMBV-KZUZWCRRSA-N -1 3 373.460 3.673 20 0 FHADHM C[C@H](CNc1ccc(-c2nn[n-]n2)cc1)Oc1ccc(Br)cc1 ZINC000820276203 599091185 /nfs/dbraw/zinc/09/11/85/599091185.db2.gz UOKGFVIKQYTUAO-LLVKDONJSA-N -1 3 374.242 3.509 20 0 FHADHM C[C@@H](Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1cccc(-n2ccnc2)c1 ZINC000820457324 599094282 /nfs/dbraw/zinc/09/42/82/599094282.db2.gz ZQFBDDAVIGWNAO-GFCCVEGCSA-N -1 3 365.828 3.879 20 0 FHADHM C[C@@H](Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1cccc(-n2ccnc2)c1 ZINC000820457324 599094284 /nfs/dbraw/zinc/09/42/84/599094284.db2.gz ZQFBDDAVIGWNAO-GFCCVEGCSA-N -1 3 365.828 3.879 20 0 FHADHM CCO[C@H]1C[C@H](Nc2cc(-c3nnn[n-]3)c3ccccc3n2)C12CCCC2 ZINC000821359196 599101124 /nfs/dbraw/zinc/10/11/24/599101124.db2.gz MNCLRXGWULCFNY-IRXDYDNUSA-N -1 3 364.453 3.565 20 0 FHADHM CCO[C@H]1C[C@H](Nc2cc(-c3nn[n-]n3)c3ccccc3n2)C12CCCC2 ZINC000821359196 599101127 /nfs/dbraw/zinc/10/11/27/599101127.db2.gz MNCLRXGWULCFNY-IRXDYDNUSA-N -1 3 364.453 3.565 20 0 FHADHM C[C@@H](C(=O)Oc1ccc(-c2ccc(-c3nnn[n-]3)cc2)cc1)C(F)(F)F ZINC000819882964 599134703 /nfs/dbraw/zinc/13/47/03/599134703.db2.gz DGSHYGHOWKHRJY-JTQLQIEISA-N -1 3 362.311 3.638 20 0 FHADHM C[C@@H](C(=O)Oc1ccc(-c2ccc(-c3nn[n-]n3)cc2)cc1)C(F)(F)F ZINC000819882964 599134705 /nfs/dbraw/zinc/13/47/05/599134705.db2.gz DGSHYGHOWKHRJY-JTQLQIEISA-N -1 3 362.311 3.638 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NC(=O)CCCC1CCCC1 ZINC000820151685 599143809 /nfs/dbraw/zinc/14/38/09/599143809.db2.gz MRLGXHLNDQNZIK-UHFFFAOYSA-N -1 3 357.458 3.953 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NC(=O)CCCC1CCCC1 ZINC000820151685 599143810 /nfs/dbraw/zinc/14/38/10/599143810.db2.gz MRLGXHLNDQNZIK-UHFFFAOYSA-N -1 3 357.458 3.953 20 0 FHADHM Cc1cccc([C@@H](C)NC(=O)Nc2cc(-c3nnn[n-]3)ccc2C)c1C ZINC000737292501 599146181 /nfs/dbraw/zinc/14/61/81/599146181.db2.gz UFNROCPIMOHONH-CQSZACIVSA-N -1 3 350.426 3.675 20 0 FHADHM Cc1cccc([C@@H](C)NC(=O)Nc2cc(-c3nn[n-]n3)ccc2C)c1C ZINC000737292501 599146183 /nfs/dbraw/zinc/14/61/83/599146183.db2.gz UFNROCPIMOHONH-CQSZACIVSA-N -1 3 350.426 3.675 20 0 FHADHM Cc1cc(F)cc(C(=O)N(CC(C)C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000822203321 599147776 /nfs/dbraw/zinc/14/77/76/599147776.db2.gz OKMPKNNQUXYMRP-UHFFFAOYSA-N -1 3 353.401 3.617 20 0 FHADHM Cc1cc(F)cc(C(=O)N(CC(C)C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000822203321 599147778 /nfs/dbraw/zinc/14/77/78/599147778.db2.gz OKMPKNNQUXYMRP-UHFFFAOYSA-N -1 3 353.401 3.617 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)C1CCC(c2ccccc2)CC1 ZINC000823332751 599152404 /nfs/dbraw/zinc/15/24/04/599152404.db2.gz QOMVYBANCKADQU-UHFFFAOYSA-N -1 3 365.412 3.918 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)C1CCC(c2ccccc2)CC1 ZINC000823332751 599152408 /nfs/dbraw/zinc/15/24/08/599152408.db2.gz QOMVYBANCKADQU-UHFFFAOYSA-N -1 3 365.412 3.918 20 0 FHADHM CCCCC[C@@H](C)CC(=O)Nc1ccnn1-c1ccc(-c2nn[n-]n2)cc1 ZINC000821049706 599153353 /nfs/dbraw/zinc/15/33/53/599153353.db2.gz NABDFAVROCUDRG-CQSZACIVSA-N -1 3 367.457 3.597 20 0 FHADHM Cc1ccc(OC(F)F)c([C@@H](C)OC(=O)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000737365111 599156970 /nfs/dbraw/zinc/15/69/70/599156970.db2.gz PRGFNHKBFSCLBQ-LLVKDONJSA-N -1 3 374.347 3.695 20 0 FHADHM Cc1ccc(OC(F)F)c([C@@H](C)OC(=O)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000737365111 599156972 /nfs/dbraw/zinc/15/69/72/599156972.db2.gz PRGFNHKBFSCLBQ-LLVKDONJSA-N -1 3 374.347 3.695 20 0 FHADHM Cc1ccc(OC(F)F)c([C@H](C)OC(=O)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737363936 599157007 /nfs/dbraw/zinc/15/70/07/599157007.db2.gz HCJQJZXJLXCLNK-NSHDSACASA-N -1 3 374.347 3.695 20 0 FHADHM Cc1ccc(OC(F)F)c([C@H](C)OC(=O)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737363936 599157009 /nfs/dbraw/zinc/15/70/09/599157009.db2.gz HCJQJZXJLXCLNK-NSHDSACASA-N -1 3 374.347 3.695 20 0 FHADHM Cc1sc(NC(=O)C[C@@H](C)c2cccc(F)c2)c(-c2nnn[n-]2)c1C ZINC000737563695 599158640 /nfs/dbraw/zinc/15/86/40/599158640.db2.gz SDMDMUIJEBUNGN-SECBINFHSA-N -1 3 359.430 3.816 20 0 FHADHM Cc1sc(NC(=O)C[C@@H](C)c2cccc(F)c2)c(-c2nn[n-]n2)c1C ZINC000737563695 599158644 /nfs/dbraw/zinc/15/86/44/599158644.db2.gz SDMDMUIJEBUNGN-SECBINFHSA-N -1 3 359.430 3.816 20 0 FHADHM CCC[C@@H](CC1CCCC1)C(=O)NCc1cc(-c2nnn[n-]2)ccc1F ZINC000821015362 599163699 /nfs/dbraw/zinc/16/36/99/599163699.db2.gz PKJPPECHFHLKIO-HNNXBMFYSA-N -1 3 359.449 3.619 20 0 FHADHM CCC[C@@H](CC1CCCC1)C(=O)NCc1cc(-c2nn[n-]n2)ccc1F ZINC000821015362 599163701 /nfs/dbraw/zinc/16/37/01/599163701.db2.gz PKJPPECHFHLKIO-HNNXBMFYSA-N -1 3 359.449 3.619 20 0 FHADHM CC[C@H](CC1CCCCC1)C(=O)NCc1cc(-c2nnn[n-]2)ccc1F ZINC000820902780 599181094 /nfs/dbraw/zinc/18/10/94/599181094.db2.gz NNSPXXSVBGEWHU-CQSZACIVSA-N -1 3 359.449 3.619 20 0 FHADHM CC[C@H](CC1CCCCC1)C(=O)NCc1cc(-c2nn[n-]n2)ccc1F ZINC000820902780 599181097 /nfs/dbraw/zinc/18/10/97/599181097.db2.gz NNSPXXSVBGEWHU-CQSZACIVSA-N -1 3 359.449 3.619 20 0 FHADHM C[C@@H](NC(=O)[C@H](C)c1cccc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736094915 599181983 /nfs/dbraw/zinc/18/19/83/599181983.db2.gz AXMLJFHJMKGNAU-VXGBXAGGSA-N -1 3 355.829 3.501 20 0 FHADHM C[C@@H](NC(=O)[C@H](C)c1cccc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736094915 599181985 /nfs/dbraw/zinc/18/19/85/599181985.db2.gz AXMLJFHJMKGNAU-VXGBXAGGSA-N -1 3 355.829 3.501 20 0 FHADHM CC(C)(C)NC(=O)c1cccc(Oc2ccc(Cl)cc2-c2nnn[n-]2)c1 ZINC000735623360 599192158 /nfs/dbraw/zinc/19/21/58/599192158.db2.gz MOMRBWIWPRICQQ-UHFFFAOYSA-N -1 3 371.828 3.841 20 0 FHADHM CC(C)(C)NC(=O)c1cccc(Oc2ccc(Cl)cc2-c2nn[n-]n2)c1 ZINC000735623360 599192161 /nfs/dbraw/zinc/19/21/61/599192161.db2.gz MOMRBWIWPRICQQ-UHFFFAOYSA-N -1 3 371.828 3.841 20 0 FHADHM CN(C(=O)c1ccc(-c2nnn[n-]2)cc1)c1ccc(-c2ccccc2)cc1 ZINC000821573614 599192545 /nfs/dbraw/zinc/19/25/45/599192545.db2.gz XPXCQMICERRENI-UHFFFAOYSA-N -1 3 355.401 3.810 20 0 FHADHM CN(C(=O)c1ccc(-c2nn[n-]n2)cc1)c1ccc(-c2ccccc2)cc1 ZINC000821573614 599192548 /nfs/dbraw/zinc/19/25/48/599192548.db2.gz XPXCQMICERRENI-UHFFFAOYSA-N -1 3 355.401 3.810 20 0 FHADHM Cc1cc(NC(=O)CCc2ccc(-c3nnn[n-]3)cc2)c2cccnc2c1C ZINC000822207210 599197689 /nfs/dbraw/zinc/19/76/89/599197689.db2.gz OFMOROXISVHCCL-UHFFFAOYSA-N -1 3 372.432 3.603 20 0 FHADHM Cc1cc(NC(=O)CCc2ccc(-c3nn[n-]n3)cc2)c2cccnc2c1C ZINC000822207210 599197690 /nfs/dbraw/zinc/19/76/90/599197690.db2.gz OFMOROXISVHCCL-UHFFFAOYSA-N -1 3 372.432 3.603 20 0 FHADHM COCCCCCOC(=O)c1ccccc1-c1ccccc1-c1nnn[n-]1 ZINC000736978145 599214892 /nfs/dbraw/zinc/21/48/92/599214892.db2.gz FWFYQYKBKFTLJP-UHFFFAOYSA-N -1 3 366.421 3.507 20 0 FHADHM COCCCCCOC(=O)c1ccccc1-c1ccccc1-c1nn[n-]n1 ZINC000736978145 599214894 /nfs/dbraw/zinc/21/48/94/599214894.db2.gz FWFYQYKBKFTLJP-UHFFFAOYSA-N -1 3 366.421 3.507 20 0 FHADHM Cc1cc(C(=O)Nc2cccc(-c3nnn[n-]3)c2C)cc(C)c1OC(F)F ZINC000822177419 607266837 /nfs/dbraw/zinc/26/68/37/607266837.db2.gz YSSLDGGBJGSMCB-UHFFFAOYSA-N -1 3 373.363 3.646 20 0 FHADHM Cc1cc(C(=O)Nc2cccc(-c3nn[n-]n3)c2C)cc(C)c1OC(F)F ZINC000822177419 607266838 /nfs/dbraw/zinc/26/68/38/607266838.db2.gz YSSLDGGBJGSMCB-UHFFFAOYSA-N -1 3 373.363 3.646 20 0 FHADHM Cc1c(NC(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)cccc1-c1nnn[n-]1 ZINC000822061517 607267082 /nfs/dbraw/zinc/26/70/82/607267082.db2.gz OSQBQYYURPYYRH-LSDHHAIUSA-N -1 3 353.813 3.571 20 0 FHADHM Cc1c(NC(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)cccc1-c1nn[n-]n1 ZINC000822061517 607267083 /nfs/dbraw/zinc/26/70/83/607267083.db2.gz OSQBQYYURPYYRH-LSDHHAIUSA-N -1 3 353.813 3.571 20 0 FHADHM CCCC[C@@H](CC)CNC(=S)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821039477 599238604 /nfs/dbraw/zinc/23/86/04/599238604.db2.gz CFNXGIJGUBQTEK-ZIAGYGMSSA-N -1 3 360.531 3.608 20 0 FHADHM CCCC[C@@H](CC)CNC(=S)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821039477 599238606 /nfs/dbraw/zinc/23/86/06/599238606.db2.gz CFNXGIJGUBQTEK-ZIAGYGMSSA-N -1 3 360.531 3.608 20 0 FHADHM C[C@H]1C[C@H](c2ccccc2F)N(C(=O)Nc2ccc(-c3nnn[n-]3)cc2)C1 ZINC000820666690 599240656 /nfs/dbraw/zinc/24/06/56/599240656.db2.gz JALMHLUJGJIADM-YVEFUNNKSA-N -1 3 366.400 3.621 20 0 FHADHM C[C@H]1C[C@H](c2ccccc2F)N(C(=O)Nc2ccc(-c3nn[n-]n3)cc2)C1 ZINC000820666690 599240658 /nfs/dbraw/zinc/24/06/58/599240658.db2.gz JALMHLUJGJIADM-YVEFUNNKSA-N -1 3 366.400 3.621 20 0 FHADHM Cc1ccc(CCC(=O)Nc2cccc(-c3nnn[n-]3)c2C)cc1Cl ZINC000822234960 607270237 /nfs/dbraw/zinc/27/02/37/607270237.db2.gz MXEMKSUDPYLIRN-UHFFFAOYSA-N -1 3 355.829 3.708 20 0 FHADHM Cc1ccc(CCC(=O)Nc2cccc(-c3nn[n-]n3)c2C)cc1Cl ZINC000822234960 607270238 /nfs/dbraw/zinc/27/02/38/607270238.db2.gz MXEMKSUDPYLIRN-UHFFFAOYSA-N -1 3 355.829 3.708 20 0 FHADHM C[C@H]1CN(C(=O)Nc2cccc(-c3nnn[n-]3)c2)CC[C@H]1c1ccccc1 ZINC000820743479 599242663 /nfs/dbraw/zinc/24/26/63/599242663.db2.gz UQZOGIWXBMUXDJ-KBXCAEBGSA-N -1 3 362.437 3.524 20 0 FHADHM C[C@H]1CN(C(=O)Nc2cccc(-c3nn[n-]n3)c2)CC[C@H]1c1ccccc1 ZINC000820743479 599242666 /nfs/dbraw/zinc/24/26/66/599242666.db2.gz UQZOGIWXBMUXDJ-KBXCAEBGSA-N -1 3 362.437 3.524 20 0 FHADHM Cc1ccc(-c2cncc(C(=O)Nc3cccc(-c4nnn[n-]4)c3C)c2)cc1 ZINC000822213954 607271229 /nfs/dbraw/zinc/27/12/29/607271229.db2.gz IVVBYSDGNHTSQR-UHFFFAOYSA-N -1 3 370.416 3.798 20 0 FHADHM Cc1ccc(-c2cncc(C(=O)Nc3cccc(-c4nn[n-]n4)c3C)c2)cc1 ZINC000822213954 607271230 /nfs/dbraw/zinc/27/12/30/607271230.db2.gz IVVBYSDGNHTSQR-UHFFFAOYSA-N -1 3 370.416 3.798 20 0 FHADHM Cc1ccc(SCC(=O)Nc2cccc(-c3nnn[n-]3)c2C)c(C)c1 ZINC000822266758 607271824 /nfs/dbraw/zinc/27/18/24/607271824.db2.gz HINNAMWCDOUCJQ-UHFFFAOYSA-N -1 3 353.451 3.523 20 0 FHADHM Cc1ccc(SCC(=O)Nc2cccc(-c3nn[n-]n3)c2C)c(C)c1 ZINC000822266758 607271825 /nfs/dbraw/zinc/27/18/25/607271825.db2.gz HINNAMWCDOUCJQ-UHFFFAOYSA-N -1 3 353.451 3.523 20 0 FHADHM Cc1ccc(C)c(SCC(=O)Nc2cccc(-c3nnn[n-]3)c2C)c1 ZINC000822231813 607269341 /nfs/dbraw/zinc/26/93/41/607269341.db2.gz IIYXZLWRHURNET-UHFFFAOYSA-N -1 3 353.451 3.523 20 0 FHADHM Cc1ccc(C)c(SCC(=O)Nc2cccc(-c3nn[n-]n3)c2C)c1 ZINC000822231813 607269342 /nfs/dbraw/zinc/26/93/42/607269342.db2.gz IIYXZLWRHURNET-UHFFFAOYSA-N -1 3 353.451 3.523 20 0 FHADHM Cc1ccc(OCCCC(=O)Nc2cccc(-c3nnn[n-]3)c2C)cc1C ZINC000822263315 607269380 /nfs/dbraw/zinc/26/93/80/607269380.db2.gz LUUBFHXIDVRAHB-UHFFFAOYSA-N -1 3 365.437 3.590 20 0 FHADHM Cc1ccc(OCCCC(=O)Nc2cccc(-c3nn[n-]n3)c2C)cc1C ZINC000822263315 607269381 /nfs/dbraw/zinc/26/93/81/607269381.db2.gz LUUBFHXIDVRAHB-UHFFFAOYSA-N -1 3 365.437 3.590 20 0 FHADHM Cc1ccc(C(C)(C)CN(C)C(=O)Nc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000822227769 599246037 /nfs/dbraw/zinc/24/60/37/599246037.db2.gz VIHHUBJLHJDCOG-UHFFFAOYSA-N -1 3 364.453 3.617 20 0 FHADHM Cc1ccc(C(C)(C)CN(C)C(=O)Nc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000822227769 599246040 /nfs/dbraw/zinc/24/60/40/599246040.db2.gz VIHHUBJLHJDCOG-UHFFFAOYSA-N -1 3 364.453 3.617 20 0 FHADHM CC[C@H](NC(=O)Nc1cccc(-c2nnn[n-]2)c1)C(C)(C)c1ccccc1 ZINC000820920000 599247351 /nfs/dbraw/zinc/24/73/51/599247351.db2.gz ITKDYIKMYKSHCD-KRWDZBQOSA-N -1 3 364.453 3.745 20 0 FHADHM CC[C@H](NC(=O)Nc1cccc(-c2nn[n-]n2)c1)C(C)(C)c1ccccc1 ZINC000820920000 599247354 /nfs/dbraw/zinc/24/73/54/599247354.db2.gz ITKDYIKMYKSHCD-KRWDZBQOSA-N -1 3 364.453 3.745 20 0 FHADHM CCCOc1ccccc1NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821139450 599249455 /nfs/dbraw/zinc/24/94/55/599249455.db2.gz ZQRRWUCHRKUAMS-ZDUSSCGKSA-N -1 3 366.425 3.538 20 0 FHADHM CCCOc1ccccc1NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821139450 599249458 /nfs/dbraw/zinc/24/94/58/599249458.db2.gz ZQRRWUCHRKUAMS-ZDUSSCGKSA-N -1 3 366.425 3.538 20 0 FHADHM CCC[C@H]1[C@@H](C)CCCN1C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000821034358 599249732 /nfs/dbraw/zinc/24/97/32/599249732.db2.gz KUMUUCZGPHUTLQ-NHYWBVRUSA-N -1 3 362.865 3.953 20 0 FHADHM CCC[C@H]1[C@@H](C)CCCN1C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000821034358 599249734 /nfs/dbraw/zinc/24/97/34/599249734.db2.gz KUMUUCZGPHUTLQ-NHYWBVRUSA-N -1 3 362.865 3.953 20 0 FHADHM CN(Cc1ccccc1Cl)c1c(-c2nnn[n-]2)cnc2ccccc21 ZINC000736828857 599255355 /nfs/dbraw/zinc/25/53/55/599255355.db2.gz QXNTYKAMQLKQHK-UHFFFAOYSA-N -1 3 350.813 3.705 20 0 FHADHM CN(Cc1ccccc1Cl)c1c(-c2nn[n-]n2)cnc2ccccc21 ZINC000736828857 599255357 /nfs/dbraw/zinc/25/53/57/599255357.db2.gz QXNTYKAMQLKQHK-UHFFFAOYSA-N -1 3 350.813 3.705 20 0 FHADHM Cc1c(NC(=O)N[C@H](C)c2ccccc2Cl)cccc1-c1nnn[n-]1 ZINC000822090724 607289118 /nfs/dbraw/zinc/28/91/18/607289118.db2.gz MJKYVSCOOVGDOM-LLVKDONJSA-N -1 3 356.817 3.711 20 0 FHADHM Cc1c(NC(=O)N[C@H](C)c2ccccc2Cl)cccc1-c1nn[n-]n1 ZINC000822090724 607289119 /nfs/dbraw/zinc/28/91/19/607289119.db2.gz MJKYVSCOOVGDOM-LLVKDONJSA-N -1 3 356.817 3.711 20 0 FHADHM Cc1cc(C)cc([C@H](C)NC(=O)Nc2cccc(-c3nnn[n-]3)c2C)c1 ZINC000822196475 607283522 /nfs/dbraw/zinc/28/35/22/607283522.db2.gz KVYHDEFTIUSTFU-AWEZNQCLSA-N -1 3 350.426 3.675 20 0 FHADHM Cc1cc(C)cc([C@H](C)NC(=O)Nc2cccc(-c3nn[n-]n3)c2C)c1 ZINC000822196475 607283523 /nfs/dbraw/zinc/28/35/23/607283523.db2.gz KVYHDEFTIUSTFU-AWEZNQCLSA-N -1 3 350.426 3.675 20 0 FHADHM Cc1c(NC(=O)N[C@@H](c2ccc(F)cc2)C(C)C)cccc1-c1nnn[n-]1 ZINC000822092654 607284167 /nfs/dbraw/zinc/28/41/67/607284167.db2.gz YELAUUDXEHNNIT-QGZVFWFLSA-N -1 3 368.416 3.833 20 0 FHADHM Cc1c(NC(=O)N[C@@H](c2ccc(F)cc2)C(C)C)cccc1-c1nn[n-]n1 ZINC000822092654 607284168 /nfs/dbraw/zinc/28/41/68/607284168.db2.gz YELAUUDXEHNNIT-QGZVFWFLSA-N -1 3 368.416 3.833 20 0 FHADHM CC[C@H](NC(=O)Nc1cccc(-c2nnn[n-]2)c1C)c1ccc(C)cc1 ZINC000820919460 607284651 /nfs/dbraw/zinc/28/46/51/607284651.db2.gz CHFFZSFBBQOYTN-INIZCTEOSA-N -1 3 350.426 3.756 20 0 FHADHM CC[C@H](NC(=O)Nc1cccc(-c2nn[n-]n2)c1C)c1ccc(C)cc1 ZINC000820919460 607284652 /nfs/dbraw/zinc/28/46/52/607284652.db2.gz CHFFZSFBBQOYTN-INIZCTEOSA-N -1 3 350.426 3.756 20 0 FHADHM Cc1c(NC(=O)N2CC(C)(C)[C@@H]2c2ccccc2)cccc1-c1nnn[n-]1 ZINC000822085378 607284811 /nfs/dbraw/zinc/28/48/11/607284811.db2.gz YQUHOOKVRLHEKB-KRWDZBQOSA-N -1 3 362.437 3.790 20 0 FHADHM Cc1c(NC(=O)N2CC(C)(C)[C@@H]2c2ccccc2)cccc1-c1nn[n-]n1 ZINC000822085378 607284812 /nfs/dbraw/zinc/28/48/12/607284812.db2.gz YQUHOOKVRLHEKB-KRWDZBQOSA-N -1 3 362.437 3.790 20 0 FHADHM Cc1ccc([C@@H](C)NC(=O)Nc2cccc(-c3nnn[n-]3)c2C)c(C)c1 ZINC000822228858 607286880 /nfs/dbraw/zinc/28/68/80/607286880.db2.gz HDKJZWHMIKGJGH-CQSZACIVSA-N -1 3 350.426 3.675 20 0 FHADHM Cc1ccc([C@@H](C)NC(=O)Nc2cccc(-c3nn[n-]n3)c2C)c(C)c1 ZINC000822228858 607286881 /nfs/dbraw/zinc/28/68/81/607286881.db2.gz HDKJZWHMIKGJGH-CQSZACIVSA-N -1 3 350.426 3.675 20 0 FHADHM C[C@H](NC(=O)c1ccc(-c2nnn[n-]2)cc1)c1cccc(Cl)c1Cl ZINC000736116493 599261541 /nfs/dbraw/zinc/26/15/41/599261541.db2.gz AVZGFUZAVYBJJN-VIFPVBQESA-N -1 3 362.220 3.665 20 0 FHADHM C[C@H](NC(=O)c1ccc(-c2nn[n-]n2)cc1)c1cccc(Cl)c1Cl ZINC000736116493 599261543 /nfs/dbraw/zinc/26/15/43/599261543.db2.gz AVZGFUZAVYBJJN-VIFPVBQESA-N -1 3 362.220 3.665 20 0 FHADHM Cc1ccccc1[C@@H](NC(=O)Nc1cccc(-c2nnn[n-]2)c1C)C1CC1 ZINC000822352395 607290324 /nfs/dbraw/zinc/29/03/24/607290324.db2.gz YOUCNLWAMLTYLC-SFHVURJKSA-N -1 3 362.437 3.756 20 0 FHADHM Cc1ccccc1[C@@H](NC(=O)Nc1cccc(-c2nn[n-]n2)c1C)C1CC1 ZINC000822352395 607290325 /nfs/dbraw/zinc/29/03/25/607290325.db2.gz YOUCNLWAMLTYLC-SFHVURJKSA-N -1 3 362.437 3.756 20 0 FHADHM CC[C@@H](Oc1ccccc1Cl)C(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000820937652 607294620 /nfs/dbraw/zinc/29/46/20/607294620.db2.gz BESCZACVRMFBPP-OAHLLOKOSA-N -1 3 371.828 3.625 20 0 FHADHM CC[C@@H](Oc1ccccc1Cl)C(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000820937652 607294621 /nfs/dbraw/zinc/29/46/21/607294621.db2.gz BESCZACVRMFBPP-OAHLLOKOSA-N -1 3 371.828 3.625 20 0 FHADHM Cc1c(NC(=O)C(C)(C)c2cccc(Cl)c2)cccc1-c1nnn[n-]1 ZINC000822060974 607297162 /nfs/dbraw/zinc/29/71/62/607297162.db2.gz KFNQKKQFOLBLHD-UHFFFAOYSA-N -1 3 355.829 3.745 20 0 FHADHM Cc1c(NC(=O)C(C)(C)c2cccc(Cl)c2)cccc1-c1nn[n-]n1 ZINC000822060974 607297163 /nfs/dbraw/zinc/29/71/63/607297163.db2.gz KFNQKKQFOLBLHD-UHFFFAOYSA-N -1 3 355.829 3.745 20 0 FHADHM CCCCCc1ccc(NCc2cnc3ccc(-c4nnn[n-]4)cn23)cc1 ZINC000821062581 607307709 /nfs/dbraw/zinc/30/77/09/607307709.db2.gz YNOQUSNWWUGHBD-UHFFFAOYSA-N -1 3 361.453 3.859 20 0 FHADHM CCCCCc1ccc(NCc2cnc3ccc(-c4nn[n-]n4)cn23)cc1 ZINC000821062581 607307710 /nfs/dbraw/zinc/30/77/10/607307710.db2.gz YNOQUSNWWUGHBD-UHFFFAOYSA-N -1 3 361.453 3.859 20 0 FHADHM Cc1c(NCc2cc(-c3nnn[n-]3)cs2)cccc1OCC(F)(F)F ZINC000822122127 607316357 /nfs/dbraw/zinc/31/63/57/607316357.db2.gz JZYRMRIEGZKDLP-UHFFFAOYSA-N -1 3 369.372 3.790 20 0 FHADHM Cc1c(NCc2cc(-c3nn[n-]n3)cs2)cccc1OCC(F)(F)F ZINC000822122127 607316358 /nfs/dbraw/zinc/31/63/58/607316358.db2.gz JZYRMRIEGZKDLP-UHFFFAOYSA-N -1 3 369.372 3.790 20 0 FHADHM Fc1ccc(OCC(F)(F)F)c(NCc2cc(-c3nnn[n-]3)cs2)c1 ZINC000822782978 607311714 /nfs/dbraw/zinc/31/17/14/607311714.db2.gz OGJWFKSWZGJUBC-UHFFFAOYSA-N -1 3 373.335 3.621 20 0 FHADHM Fc1ccc(OCC(F)(F)F)c(NCc2cc(-c3nn[n-]n3)cs2)c1 ZINC000822782978 607311715 /nfs/dbraw/zinc/31/17/15/607311715.db2.gz OGJWFKSWZGJUBC-UHFFFAOYSA-N -1 3 373.335 3.621 20 0 FHADHM CCc1ccccc1C(=O)Nc1sc2c(c1-c1nnn[n-]1)CC[C@@H](C)C2 ZINC000821492765 607303906 /nfs/dbraw/zinc/30/39/06/607303906.db2.gz WQHQPCQMGKYXKB-LLVKDONJSA-N -1 3 367.478 3.868 20 0 FHADHM CCc1ccccc1C(=O)Nc1sc2c(c1-c1nn[n-]n1)CC[C@@H](C)C2 ZINC000821492765 607303907 /nfs/dbraw/zinc/30/39/07/607303907.db2.gz WQHQPCQMGKYXKB-LLVKDONJSA-N -1 3 367.478 3.868 20 0 FHADHM O=C(NCCC1CC1)Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000823181626 599267909 /nfs/dbraw/zinc/26/79/09/599267909.db2.gz BLNBPVYAFKMRHB-UHFFFAOYSA-N -1 3 364.409 3.581 20 0 FHADHM O=C(NCCC1CC1)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000823181626 599267911 /nfs/dbraw/zinc/26/79/11/599267911.db2.gz BLNBPVYAFKMRHB-UHFFFAOYSA-N -1 3 364.409 3.581 20 0 FHADHM CN(c1ccccc1NCc1cc(-c2nnn[n-]2)cs1)C1CCCC1 ZINC000821619486 607318271 /nfs/dbraw/zinc/31/82/71/607318271.db2.gz YZIUFQKPCXQPAB-UHFFFAOYSA-N -1 3 354.483 3.919 20 0 FHADHM CN(c1ccccc1NCc1cc(-c2nn[n-]n2)cs1)C1CCCC1 ZINC000821619486 607318272 /nfs/dbraw/zinc/31/82/72/607318272.db2.gz YZIUFQKPCXQPAB-UHFFFAOYSA-N -1 3 354.483 3.919 20 0 FHADHM C[C@H](Sc1ccc2c(c1)OCCCO2)c1ccc(-c2nnn[n-]2)cc1 ZINC000736194148 599284666 /nfs/dbraw/zinc/28/46/66/599284666.db2.gz WOYURQFJAJUZAW-LBPRGKRZSA-N -1 3 354.435 3.881 20 0 FHADHM C[C@H](Sc1ccc2c(c1)OCCCO2)c1ccc(-c2nn[n-]n2)cc1 ZINC000736194148 599284669 /nfs/dbraw/zinc/28/46/69/599284669.db2.gz WOYURQFJAJUZAW-LBPRGKRZSA-N -1 3 354.435 3.881 20 0 FHADHM C[C@@H](Sc1nnc(-c2cccs2)o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736192411 599287542 /nfs/dbraw/zinc/28/75/42/599287542.db2.gz MQBMUQNDFBJHMV-SECBINFHSA-N -1 3 356.436 3.832 20 0 FHADHM C[C@@H](Sc1nnc(-c2cccs2)o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736192411 599287544 /nfs/dbraw/zinc/28/75/44/599287544.db2.gz MQBMUQNDFBJHMV-SECBINFHSA-N -1 3 356.436 3.832 20 0 FHADHM Cc1occc1-c1nnc(S[C@H](C)c2ccc(-c3nnn[n-]3)cc2)o1 ZINC000737551573 599288719 /nfs/dbraw/zinc/28/87/19/599288719.db2.gz JCZOZXTWOWSMEU-SNVBAGLBSA-N -1 3 354.395 3.671 20 0 FHADHM Cc1occc1-c1nnc(S[C@H](C)c2ccc(-c3nn[n-]n3)cc2)o1 ZINC000737551573 599288720 /nfs/dbraw/zinc/28/87/20/599288720.db2.gz JCZOZXTWOWSMEU-SNVBAGLBSA-N -1 3 354.395 3.671 20 0 FHADHM Clc1ccc(-c2oncc2CNc2ccc(-c3nn[n-]n3)cc2)s1 ZINC000822574814 607331905 /nfs/dbraw/zinc/33/19/05/607331905.db2.gz ZQUMOHHOXYFIQX-UHFFFAOYSA-N -1 3 358.814 3.849 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)N[C@@H](c1ccccc1)C1CCC1 ZINC000737798584 598232465 /nfs/dbraw/zinc/23/24/65/598232465.db2.gz MGMZSEXRDIIMRO-ODLZTCLXSA-N -1 3 359.433 3.538 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)N[C@@H](c1ccccc1)C1CCC1 ZINC000737798584 598232467 /nfs/dbraw/zinc/23/24/67/598232467.db2.gz MGMZSEXRDIIMRO-ODLZTCLXSA-N -1 3 359.433 3.538 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1NCc1ccccc1OC(F)(F)F ZINC000737643773 598236329 /nfs/dbraw/zinc/23/63/29/598236329.db2.gz FQTLJLRLGWCXAB-UHFFFAOYSA-N -1 3 353.279 3.517 20 0 FHADHM C[C@@H](Nc1ccc(-c2nn[n-]n2)cc1F)c1cccc(Br)c1 ZINC000736140333 598236666 /nfs/dbraw/zinc/23/66/66/598236666.db2.gz UFUPKJKAQDBSKZ-SECBINFHSA-N -1 3 362.206 3.941 20 0 FHADHM CCc1cccc2c1OCC[C@@H]2Nc1c(F)cc(-c2nnn[n-]2)cc1F ZINC000736695316 598248313 /nfs/dbraw/zinc/24/83/13/598248313.db2.gz LFNMCBGAVKVUDQ-HNNXBMFYSA-N -1 3 357.364 3.643 20 0 FHADHM CCc1cccc2c1OCC[C@@H]2Nc1c(F)cc(-c2nn[n-]n2)cc1F ZINC000736695316 598248315 /nfs/dbraw/zinc/24/83/15/598248315.db2.gz LFNMCBGAVKVUDQ-HNNXBMFYSA-N -1 3 357.364 3.643 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)C[C@H](CC)C(C)C ZINC000736629689 598277525 /nfs/dbraw/zinc/27/75/25/598277525.db2.gz ZLXIMHFTUWPRIX-NSHDSACASA-N -1 3 366.849 3.897 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)C[C@H](CC)C(C)C ZINC000736629689 598277527 /nfs/dbraw/zinc/27/75/27/598277527.db2.gz ZLXIMHFTUWPRIX-NSHDSACASA-N -1 3 366.849 3.897 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)NC1(c2ccc(F)cc2)CCCC1 ZINC000738179521 598283374 /nfs/dbraw/zinc/28/33/74/598283374.db2.gz UTBUEWIDTQEUOX-UHFFFAOYSA-N -1 3 366.400 3.597 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)NC1(c2ccc(F)cc2)CCCC1 ZINC000738179521 598283375 /nfs/dbraw/zinc/28/33/75/598283375.db2.gz UTBUEWIDTQEUOX-UHFFFAOYSA-N -1 3 366.400 3.597 20 0 FHADHM O=C(CCSc1cccc(Cl)c1)Nc1cccc(-c2nnn[n-]2)c1 ZINC000485648046 598293548 /nfs/dbraw/zinc/29/35/48/598293548.db2.gz CEIQKPGIJSEYPE-UHFFFAOYSA-N -1 3 359.842 3.641 20 0 FHADHM O=C(CCSc1cccc(Cl)c1)Nc1cccc(-c2nn[n-]n2)c1 ZINC000485648046 598293549 /nfs/dbraw/zinc/29/35/49/598293549.db2.gz CEIQKPGIJSEYPE-UHFFFAOYSA-N -1 3 359.842 3.641 20 0 FHADHM Cc1csc(-c2cccc(OC(=O)c3ccc(-c4nnn[n-]4)cc3)c2)n1 ZINC000737447468 598311845 /nfs/dbraw/zinc/31/18/45/598311845.db2.gz CIIFCNLGSSYKHC-UHFFFAOYSA-N -1 3 363.402 3.518 20 0 FHADHM Cc1csc(-c2cccc(OC(=O)c3ccc(-c4nn[n-]n4)cc3)c2)n1 ZINC000737447468 598311846 /nfs/dbraw/zinc/31/18/46/598311846.db2.gz CIIFCNLGSSYKHC-UHFFFAOYSA-N -1 3 363.402 3.518 20 0 FHADHM CC(C)CC[C@@H](C)NC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000735796678 598316695 /nfs/dbraw/zinc/31/66/95/598316695.db2.gz GLYYSTRUVRUHCF-SNVBAGLBSA-N -1 3 352.895 3.631 20 0 FHADHM CC(C)CC[C@@H](C)NC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000735796678 598316697 /nfs/dbraw/zinc/31/66/97/598316697.db2.gz GLYYSTRUVRUHCF-SNVBAGLBSA-N -1 3 352.895 3.631 20 0 FHADHM Cc1ccccc1[C@@H](C)NC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000737421390 598317875 /nfs/dbraw/zinc/31/78/75/598317875.db2.gz LYFXPXNYPUCBJI-LLVKDONJSA-N -1 3 372.885 3.876 20 0 FHADHM Cc1ccccc1[C@@H](C)NC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000737421390 598317877 /nfs/dbraw/zinc/31/78/77/598317877.db2.gz LYFXPXNYPUCBJI-LLVKDONJSA-N -1 3 372.885 3.876 20 0 FHADHM C[C@H](c1ccccc1)N(C)C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736203401 598318411 /nfs/dbraw/zinc/31/84/11/598318411.db2.gz NJOIPNLDPWVFMC-LLVKDONJSA-N -1 3 372.885 3.910 20 0 FHADHM C[C@H](c1ccccc1)N(C)C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736203401 598318413 /nfs/dbraw/zinc/31/84/13/598318413.db2.gz NJOIPNLDPWVFMC-LLVKDONJSA-N -1 3 372.885 3.910 20 0 FHADHM CC[C@@H](COC(=O)CCc1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000736351913 598331464 /nfs/dbraw/zinc/33/14/64/598331464.db2.gz IXILDXRXAMNIEJ-INIZCTEOSA-N -1 3 350.422 3.536 20 0 FHADHM CC[C@@H](COC(=O)CCc1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000736351913 598331466 /nfs/dbraw/zinc/33/14/66/598331466.db2.gz IXILDXRXAMNIEJ-INIZCTEOSA-N -1 3 350.422 3.536 20 0 FHADHM c1ccc(-c2nnc(SCc3ccc(-c4nnn[n-]4)cc3)s2)cc1 ZINC000738423838 598360088 /nfs/dbraw/zinc/36/00/88/598360088.db2.gz VNESSLVJBIYJIU-UHFFFAOYSA-N -1 3 352.448 3.678 20 0 FHADHM c1ccc(-c2nnc(SCc3ccc(-c4nn[n-]n4)cc3)s2)cc1 ZINC000738423838 598360089 /nfs/dbraw/zinc/36/00/89/598360089.db2.gz VNESSLVJBIYJIU-UHFFFAOYSA-N -1 3 352.448 3.678 20 0 FHADHM O=C(OCc1ccccc1-c1nnn[n-]1)c1cc2cc(Cl)ccc2o1 ZINC000738234770 598367280 /nfs/dbraw/zinc/36/72/80/598367280.db2.gz MAHWYKCSPLUTOT-UHFFFAOYSA-N -1 3 354.753 3.623 20 0 FHADHM O=C(OCc1ccccc1-c1nn[n-]n1)c1cc2cc(Cl)ccc2o1 ZINC000738234770 598367282 /nfs/dbraw/zinc/36/72/82/598367282.db2.gz MAHWYKCSPLUTOT-UHFFFAOYSA-N -1 3 354.753 3.623 20 0 FHADHM O=C(OCc1ccc(-c2nnn[n-]2)cc1)c1cc2cc(Cl)ccc2o1 ZINC000738232913 598367548 /nfs/dbraw/zinc/36/75/48/598367548.db2.gz XHMUBCMLQDJPKX-UHFFFAOYSA-N -1 3 354.753 3.623 20 0 FHADHM O=C(OCc1ccc(-c2nn[n-]n2)cc1)c1cc2cc(Cl)ccc2o1 ZINC000738232913 598367550 /nfs/dbraw/zinc/36/75/50/598367550.db2.gz XHMUBCMLQDJPKX-UHFFFAOYSA-N -1 3 354.753 3.623 20 0 FHADHM C[C@H](Nc1ncc(-c2nnn[n-]2)cc1Cl)c1ccccc1OC(F)F ZINC000736135516 598387436 /nfs/dbraw/zinc/38/74/36/598387436.db2.gz AVOKPFWVGNSSIG-QMMMGPOBSA-N -1 3 366.759 3.690 20 0 FHADHM C[C@H](Nc1ncc(-c2nn[n-]n2)cc1Cl)c1ccccc1OC(F)F ZINC000736135516 598387437 /nfs/dbraw/zinc/38/74/37/598387437.db2.gz AVOKPFWVGNSSIG-QMMMGPOBSA-N -1 3 366.759 3.690 20 0 FHADHM Clc1ccc2c(CCNc3ncc(-c4nnn[n-]4)cc3Cl)c[nH]c2c1 ZINC000737573464 598392838 /nfs/dbraw/zinc/39/28/38/598392838.db2.gz LPNSQKWZKOKNMJ-UHFFFAOYSA-N -1 3 374.235 3.704 20 0 FHADHM Clc1ccc2c(CCNc3ncc(-c4nn[n-]n4)cc3Cl)c[nH]c2c1 ZINC000737573464 598392840 /nfs/dbraw/zinc/39/28/40/598392840.db2.gz LPNSQKWZKOKNMJ-UHFFFAOYSA-N -1 3 374.235 3.704 20 0 FHADHM Cc1ccc(C)c(CS[C@H](C)C(=O)Nc2ccccc2-c2nnn[n-]2)c1 ZINC000737323211 598393361 /nfs/dbraw/zinc/39/33/61/598393361.db2.gz QJPRTNLWTYVHHT-CQSZACIVSA-N -1 3 367.478 3.744 20 0 FHADHM Cc1ccc(C)c(CS[C@H](C)C(=O)Nc2ccccc2-c2nn[n-]n2)c1 ZINC000737323211 598393364 /nfs/dbraw/zinc/39/33/64/598393364.db2.gz QJPRTNLWTYVHHT-CQSZACIVSA-N -1 3 367.478 3.744 20 0 FHADHM C[C@H](NC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccccc1 ZINC000736128074 598417816 /nfs/dbraw/zinc/41/78/16/598417816.db2.gz USBIAIPCYKABQR-JTQLQIEISA-N -1 3 358.858 3.568 20 0 FHADHM C[C@H](NC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccccc1 ZINC000736128074 598417818 /nfs/dbraw/zinc/41/78/18/598417818.db2.gz USBIAIPCYKABQR-JTQLQIEISA-N -1 3 358.858 3.568 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)Nc1ccc(F)c(F)c1 ZINC000735873611 598425736 /nfs/dbraw/zinc/42/57/36/598425736.db2.gz IQOQYIMABNNLGB-UHFFFAOYSA-N -1 3 372.379 3.587 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)Nc1ccc(F)c(F)c1 ZINC000735873611 598425738 /nfs/dbraw/zinc/42/57/38/598425738.db2.gz IQOQYIMABNNLGB-UHFFFAOYSA-N -1 3 372.379 3.587 20 0 FHADHM CCc1ccccc1NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C(C)C ZINC000736701366 598426409 /nfs/dbraw/zinc/42/64/09/598426409.db2.gz AOWZJXKGCJVLLT-UHFFFAOYSA-N -1 3 364.453 3.872 20 0 FHADHM CCc1ccccc1NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C(C)C ZINC000736701366 598426410 /nfs/dbraw/zinc/42/64/10/598426410.db2.gz AOWZJXKGCJVLLT-UHFFFAOYSA-N -1 3 364.453 3.872 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H]1CCC[C@@H](C)[C@@H]1C ZINC000736263472 598427807 /nfs/dbraw/zinc/42/78/07/598427807.db2.gz ROPMWUHADPQECY-RVKKMQEKSA-N -1 3 370.501 3.611 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H]1CCC[C@@H](C)[C@@H]1C ZINC000736263472 598427808 /nfs/dbraw/zinc/42/78/08/598427808.db2.gz ROPMWUHADPQECY-RVKKMQEKSA-N -1 3 370.501 3.611 20 0 FHADHM CC[C@H]1CCCC[C@@H]1NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C(C)C ZINC000736399625 598429549 /nfs/dbraw/zinc/42/95/49/598429549.db2.gz JDBSSDHOKWRBAL-WMZOPIPTSA-N -1 3 370.501 3.756 20 0 FHADHM CC[C@H]1CCCC[C@@H]1NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C(C)C ZINC000736399625 598429550 /nfs/dbraw/zinc/42/95/50/598429550.db2.gz JDBSSDHOKWRBAL-WMZOPIPTSA-N -1 3 370.501 3.756 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@H](C)c1ccccc1 ZINC000735874655 598432572 /nfs/dbraw/zinc/43/25/72/598432572.db2.gz TYUYUUKWSHKEMJ-OAHLLOKOSA-N -1 3 364.453 3.548 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@H](C)c1ccccc1 ZINC000735874655 598432574 /nfs/dbraw/zinc/43/25/74/598432574.db2.gz TYUYUUKWSHKEMJ-OAHLLOKOSA-N -1 3 364.453 3.548 20 0 FHADHM Cc1ccc(Oc2ccccc2NC(=O)c2ccc(-c3nnn[n-]3)cn2)cc1 ZINC000737366615 598437065 /nfs/dbraw/zinc/43/70/65/598437065.db2.gz UPSHTTXCSWYCQC-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccc(Oc2ccccc2NC(=O)c2ccc(-c3nn[n-]n3)cn2)cc1 ZINC000737366615 598437067 /nfs/dbraw/zinc/43/70/67/598437067.db2.gz UPSHTTXCSWYCQC-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM CCn1c(COc2ccc(-c3nnn[n-]3)cc2Cl)nc2cc(F)ccc21 ZINC000736714915 598439970 /nfs/dbraw/zinc/43/99/70/598439970.db2.gz WKJIGPUMQZHMTB-UHFFFAOYSA-N -1 3 372.791 3.608 20 0 FHADHM CCn1c(COc2ccc(-c3nn[n-]n3)cc2Cl)nc2cc(F)ccc21 ZINC000736714915 598439972 /nfs/dbraw/zinc/43/99/72/598439972.db2.gz WKJIGPUMQZHMTB-UHFFFAOYSA-N -1 3 372.791 3.608 20 0 FHADHM Cc1ccccc1-c1nc(C(=O)Nc2cccc(-c3nnn[n-]3)c2)cs1 ZINC000066603783 598440550 /nfs/dbraw/zinc/44/05/50/598440550.db2.gz WNTPQTWQJHOQAG-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1ccccc1-c1nc(C(=O)Nc2cccc(-c3nn[n-]n3)c2)cs1 ZINC000066603783 598440552 /nfs/dbraw/zinc/44/05/52/598440552.db2.gz WNTPQTWQJHOQAG-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM CN(C(=O)[C@H]1C[C@@H]1c1cccc2ccccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000736733214 598448506 /nfs/dbraw/zinc/44/85/06/598448506.db2.gz SVQZPMHYGFOQFR-UXHICEINSA-N -1 3 369.428 3.786 20 0 FHADHM CN(C(=O)[C@H]1C[C@@H]1c1cccc2ccccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000736733214 598448508 /nfs/dbraw/zinc/44/85/08/598448508.db2.gz SVQZPMHYGFOQFR-UXHICEINSA-N -1 3 369.428 3.786 20 0 FHADHM Cc1cc(O)c(C(C)C)cc1NC(=O)c1ccc(-c2nnn[n-]2)cc1C ZINC000826271215 607357456 /nfs/dbraw/zinc/35/74/56/607357456.db2.gz IGZJXEBYSQYQHH-UHFFFAOYSA-N -1 3 351.410 3.565 20 0 FHADHM Cc1cc(O)c(C(C)C)cc1NC(=O)c1ccc(-c2nn[n-]n2)cc1C ZINC000826271215 607357458 /nfs/dbraw/zinc/35/74/58/607357458.db2.gz IGZJXEBYSQYQHH-UHFFFAOYSA-N -1 3 351.410 3.565 20 0 FHADHM COc1cc(Cl)ccc1CNc1ccc(Cl)cc1-c1nnn[n-]1 ZINC000737047680 598469249 /nfs/dbraw/zinc/46/92/49/598469249.db2.gz PMDVZARYUZMCMQ-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM COc1cc(Cl)ccc1CNc1ccc(Cl)cc1-c1nn[n-]n1 ZINC000737047680 598469250 /nfs/dbraw/zinc/46/92/50/598469250.db2.gz PMDVZARYUZMCMQ-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM Cc1ccc(NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)cc1F ZINC000737357719 598475044 /nfs/dbraw/zinc/47/50/44/598475044.db2.gz SMBSPTRFXBWBKG-UHFFFAOYSA-N -1 3 366.400 3.511 20 0 FHADHM Cc1ccc(NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)cc1F ZINC000737357719 598475045 /nfs/dbraw/zinc/47/50/45/598475045.db2.gz SMBSPTRFXBWBKG-UHFFFAOYSA-N -1 3 366.400 3.511 20 0 FHADHM O=C(OCc1cccc(-c2nnn[n-]2)c1)[C@@H]1C[C@H]1c1cccc2ccccc21 ZINC000738232606 598475764 /nfs/dbraw/zinc/47/57/64/598475764.db2.gz MNMAQYOQWSWQRJ-VQTJNVASSA-N -1 3 370.412 3.867 20 0 FHADHM O=C(OCc1cccc(-c2nn[n-]n2)c1)[C@@H]1C[C@H]1c1cccc2ccccc21 ZINC000738232606 598475766 /nfs/dbraw/zinc/47/57/66/598475766.db2.gz MNMAQYOQWSWQRJ-VQTJNVASSA-N -1 3 370.412 3.867 20 0 FHADHM CC(C)Oc1cccc(CC(=O)O[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000735913838 598484102 /nfs/dbraw/zinc/48/41/02/598484102.db2.gz SIBSTCGNYWKRLH-AWEZNQCLSA-N -1 3 366.421 3.501 20 0 FHADHM CC(C)Oc1cccc(CC(=O)O[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000735913838 598484103 /nfs/dbraw/zinc/48/41/03/598484103.db2.gz SIBSTCGNYWKRLH-AWEZNQCLSA-N -1 3 366.421 3.501 20 0 FHADHM CC(C)OCc1ccc(C(=O)O[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000735903042 598485164 /nfs/dbraw/zinc/48/51/64/598485164.db2.gz CWFQYUNNYGPZFR-AWEZNQCLSA-N -1 3 366.421 3.710 20 0 FHADHM CC(C)OCc1ccc(C(=O)O[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000735903042 598485165 /nfs/dbraw/zinc/48/51/65/598485165.db2.gz CWFQYUNNYGPZFR-AWEZNQCLSA-N -1 3 366.421 3.710 20 0 FHADHM C[C@H](OC(=O)Cc1ccc(-n2cccc2)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000736155438 598485756 /nfs/dbraw/zinc/48/57/56/598485756.db2.gz NNGCOSNUYZBJLX-HNNXBMFYSA-N -1 3 373.416 3.504 20 0 FHADHM C[C@H](OC(=O)Cc1ccc(-n2cccc2)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000736155438 598485757 /nfs/dbraw/zinc/48/57/57/598485757.db2.gz NNGCOSNUYZBJLX-HNNXBMFYSA-N -1 3 373.416 3.504 20 0 FHADHM C[C@@H](OC(=O)Cc1ccc(-n2cccc2)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000736155439 598485775 /nfs/dbraw/zinc/48/57/75/598485775.db2.gz NNGCOSNUYZBJLX-OAHLLOKOSA-N -1 3 373.416 3.504 20 0 FHADHM C[C@@H](OC(=O)Cc1ccc(-n2cccc2)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000736155439 598485777 /nfs/dbraw/zinc/48/57/77/598485777.db2.gz NNGCOSNUYZBJLX-OAHLLOKOSA-N -1 3 373.416 3.504 20 0 FHADHM Cc1nc(CN(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)nc2ccccc12 ZINC000737472141 598486947 /nfs/dbraw/zinc/48/69/47/598486947.db2.gz QDUIPMGMBAWMES-UHFFFAOYSA-N -1 3 373.464 3.529 20 0 FHADHM Clc1ccccc1-c1nnc(SCc2cccc(-c3nnn[n-]3)c2)o1 ZINC000737576488 598486997 /nfs/dbraw/zinc/48/69/97/598486997.db2.gz XVUXGHMYFQYPIM-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1ccccc1-c1nnc(SCc2cccc(-c3nn[n-]n3)c2)o1 ZINC000737576488 598486998 /nfs/dbraw/zinc/48/69/98/598486998.db2.gz XVUXGHMYFQYPIM-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccc(Cl)s1)c1cccc(-c2nnn[n-]2)c1 ZINC000736150078 598487181 /nfs/dbraw/zinc/48/71/81/598487181.db2.gz ILDPDEOJWJVMBK-PCGIRMHASA-N -1 3 360.826 3.899 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccc(Cl)s1)c1cccc(-c2nn[n-]n2)c1 ZINC000736150078 598487183 /nfs/dbraw/zinc/48/71/83/598487183.db2.gz ILDPDEOJWJVMBK-PCGIRMHASA-N -1 3 360.826 3.899 20 0 FHADHM Cc1cc(OCC(=O)O[C@@H](C)c2cccc(-c3nnn[n-]3)c2)ccc1Cl ZINC000737277850 598488572 /nfs/dbraw/zinc/48/85/72/598488572.db2.gz AVMMUGGCBHPDIM-LBPRGKRZSA-N -1 3 372.812 3.512 20 0 FHADHM Cc1cc(OCC(=O)O[C@@H](C)c2cccc(-c3nn[n-]n3)c2)ccc1Cl ZINC000737277850 598488573 /nfs/dbraw/zinc/48/85/73/598488573.db2.gz AVMMUGGCBHPDIM-LBPRGKRZSA-N -1 3 372.812 3.512 20 0 FHADHM C[C@H](OC(=O)/C=C\Sc1ccccc1)c1cccc(-c2nnn[n-]2)c1 ZINC000736153672 598488771 /nfs/dbraw/zinc/48/87/71/598488771.db2.gz RIBDHIWEBWRBOS-OEYXZAGESA-N -1 3 352.419 3.777 20 0 FHADHM C[C@H](OC(=O)/C=C\Sc1ccccc1)c1cccc(-c2nn[n-]n2)c1 ZINC000736153672 598488772 /nfs/dbraw/zinc/48/87/72/598488772.db2.gz RIBDHIWEBWRBOS-OEYXZAGESA-N -1 3 352.419 3.777 20 0 FHADHM Cc1ccccc1SCC(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000737432448 598492478 /nfs/dbraw/zinc/49/24/78/598492478.db2.gz YVPLIKKKSRDORQ-CYBMUJFWSA-N -1 3 354.435 3.572 20 0 FHADHM Cc1ccccc1SCC(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000737432448 598492480 /nfs/dbraw/zinc/49/24/80/598492480.db2.gz YVPLIKKKSRDORQ-CYBMUJFWSA-N -1 3 354.435 3.572 20 0 FHADHM CC(C)C[C@@H](C)CC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)CC(C)C ZINC000735761866 598494768 /nfs/dbraw/zinc/49/47/68/598494768.db2.gz QNKGSAWYKRDYAM-MRXNPFEDSA-N -1 3 357.502 3.924 20 0 FHADHM CC(C)C[C@@H](C)CC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)CC(C)C ZINC000735761866 598494770 /nfs/dbraw/zinc/49/47/70/598494770.db2.gz QNKGSAWYKRDYAM-MRXNPFEDSA-N -1 3 357.502 3.924 20 0 FHADHM c1ccc2c(c1)nccc2SCCCOc1ccc(-c2nn[n-]n2)cc1 ZINC000738437997 598504773 /nfs/dbraw/zinc/50/47/73/598504773.db2.gz UOWMEUXMJREXRI-UHFFFAOYSA-N -1 3 363.446 3.976 20 0 FHADHM CCCOc1ccc(CNc2ccc(Cl)cc2-c2nnn[n-]2)cc1OC ZINC000736490284 598507943 /nfs/dbraw/zinc/50/79/43/598507943.db2.gz KJRTZLFAEPJNBV-UHFFFAOYSA-N -1 3 373.844 3.930 20 0 FHADHM CCCOc1ccc(CNc2ccc(Cl)cc2-c2nn[n-]n2)cc1OC ZINC000736490284 598507945 /nfs/dbraw/zinc/50/79/45/598507945.db2.gz KJRTZLFAEPJNBV-UHFFFAOYSA-N -1 3 373.844 3.930 20 0 FHADHM CCCCS[C@@H](C)C(=O)Nc1sc(C)c(CC)c1-c1nnn[n-]1 ZINC000736462386 598513121 /nfs/dbraw/zinc/51/31/21/598513121.db2.gz FBEDUEOPCPROQX-JTQLQIEISA-N -1 3 353.517 3.659 20 0 FHADHM CCCCS[C@@H](C)C(=O)Nc1sc(C)c(CC)c1-c1nn[n-]n1 ZINC000736462386 598513123 /nfs/dbraw/zinc/51/31/23/598513123.db2.gz FBEDUEOPCPROQX-JTQLQIEISA-N -1 3 353.517 3.659 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H](CC)c2ccccc2)c1-c1nnn[n-]1 ZINC000736669735 598516617 /nfs/dbraw/zinc/51/66/17/598516617.db2.gz IYPBVIWYXIHGKQ-CQSZACIVSA-N -1 3 355.467 3.931 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H](CC)c2ccccc2)c1-c1nn[n-]n1 ZINC000736669735 598516619 /nfs/dbraw/zinc/51/66/19/598516619.db2.gz IYPBVIWYXIHGKQ-CQSZACIVSA-N -1 3 355.467 3.931 20 0 FHADHM CCCC[C@@H]1CCC[C@H]1NC(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000736441742 598519800 /nfs/dbraw/zinc/51/98/00/598519800.db2.gz UEOUPACUCMLZLD-NVXWUHKLSA-N -1 3 373.526 3.575 20 0 FHADHM CCCC[C@@H]1CCC[C@H]1NC(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000736441742 598519801 /nfs/dbraw/zinc/51/98/01/598519801.db2.gz UEOUPACUCMLZLD-NVXWUHKLSA-N -1 3 373.526 3.575 20 0 FHADHM O[C@@H](CCc1cccc(Nc2ccc(-c3nnn[n-]3)cn2)c1)c1ccccc1 ZINC000738380081 598521564 /nfs/dbraw/zinc/52/15/64/598521564.db2.gz DLTQWTLZYFFTTA-IBGZPJMESA-N -1 3 372.432 3.672 20 0 FHADHM O[C@@H](CCc1cccc(Nc2ccc(-c3nn[n-]n3)cn2)c1)c1ccccc1 ZINC000738380081 598521565 /nfs/dbraw/zinc/52/15/65/598521565.db2.gz DLTQWTLZYFFTTA-IBGZPJMESA-N -1 3 372.432 3.672 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1N[C@H]1CCc2c1cccc2Br ZINC000737640767 598523248 /nfs/dbraw/zinc/52/32/48/598523248.db2.gz PLXZXHAQAHJNNW-AWEZNQCLSA-N -1 3 374.217 3.868 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@@H]1NC(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000735796719 598527712 /nfs/dbraw/zinc/52/77/12/598527712.db2.gz HDQMGDLQECDLBF-ZVZYQTTQSA-N -1 3 370.501 3.832 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@@H]1NC(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000735796719 598527713 /nfs/dbraw/zinc/52/77/13/598527713.db2.gz HDQMGDLQECDLBF-ZVZYQTTQSA-N -1 3 370.501 3.832 20 0 FHADHM C[C@H](NC(=S)Nc1ccccc1-c1nnn[n-]1)C(C)(C)c1ccccc1 ZINC000736126034 598537175 /nfs/dbraw/zinc/53/71/75/598537175.db2.gz LSFMLKUWBILHON-ZDUSSCGKSA-N -1 3 366.494 3.519 20 0 FHADHM C[C@H](NC(=S)Nc1ccccc1-c1nn[n-]n1)C(C)(C)c1ccccc1 ZINC000736126034 598537177 /nfs/dbraw/zinc/53/71/77/598537177.db2.gz LSFMLKUWBILHON-ZDUSSCGKSA-N -1 3 366.494 3.519 20 0 FHADHM C[C@H]1CCC[C@@H](CC(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(F)F)C1 ZINC000736247187 598543683 /nfs/dbraw/zinc/54/36/83/598543683.db2.gz AZHDAALLUXKNMO-WDEREUQCSA-N -1 3 365.384 3.623 20 0 FHADHM C[C@H]1CCC[C@@H](CC(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(F)F)C1 ZINC000736247187 598543684 /nfs/dbraw/zinc/54/36/84/598543684.db2.gz AZHDAALLUXKNMO-WDEREUQCSA-N -1 3 365.384 3.623 20 0 FHADHM O=C(OCc1ccccc1-c1nnn[n-]1)[C@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000738235795 598544480 /nfs/dbraw/zinc/54/44/80/598544480.db2.gz WUTQCYHBPNAUDD-UXHICEINSA-N -1 3 370.412 3.867 20 0 FHADHM O=C(OCc1ccccc1-c1nn[n-]n1)[C@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000738235795 598544481 /nfs/dbraw/zinc/54/44/81/598544481.db2.gz WUTQCYHBPNAUDD-UXHICEINSA-N -1 3 370.412 3.867 20 0 FHADHM O=C(OCc1ccc(-c2nnn[n-]2)cc1)[C@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000738236301 598544632 /nfs/dbraw/zinc/54/46/32/598544632.db2.gz ITVKJHUYVMZIRP-UXHICEINSA-N -1 3 370.412 3.867 20 0 FHADHM O=C(OCc1ccc(-c2nn[n-]n2)cc1)[C@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000738236301 598544633 /nfs/dbraw/zinc/54/46/33/598544633.db2.gz ITVKJHUYVMZIRP-UXHICEINSA-N -1 3 370.412 3.867 20 0 FHADHM CC(C)(C)c1ccc(C(=O)COc2ccc(-c3nnn[n-]3)c(F)c2)cc1 ZINC000735648616 598549884 /nfs/dbraw/zinc/54/98/84/598549884.db2.gz UKVKTOHZAYJKAT-UHFFFAOYSA-N -1 3 354.385 3.565 20 0 FHADHM CC(C)(C)c1ccc(C(=O)COc2ccc(-c3nn[n-]n3)c(F)c2)cc1 ZINC000735648616 598549885 /nfs/dbraw/zinc/54/98/85/598549885.db2.gz UKVKTOHZAYJKAT-UHFFFAOYSA-N -1 3 354.385 3.565 20 0 FHADHM CC[C@H](C)c1ccc(C(=O)COc2ccc(-c3nnn[n-]3)c(F)c2)cc1 ZINC000736325118 598551410 /nfs/dbraw/zinc/55/14/10/598551410.db2.gz FGPPOWGYZDSUMP-LBPRGKRZSA-N -1 3 354.385 3.781 20 0 FHADHM CC[C@H](C)c1ccc(C(=O)COc2ccc(-c3nn[n-]n3)c(F)c2)cc1 ZINC000736325118 598551412 /nfs/dbraw/zinc/55/14/12/598551412.db2.gz FGPPOWGYZDSUMP-LBPRGKRZSA-N -1 3 354.385 3.781 20 0 FHADHM FC(F)(F)c1ccccc1[C@@H]1CCCN1c1ccc(-c2nnn[n-]2)cn1 ZINC000737635446 598551822 /nfs/dbraw/zinc/55/18/22/598551822.db2.gz GDOXIQYVDAXVGN-AWEZNQCLSA-N -1 3 360.343 3.622 20 0 FHADHM FC(F)(F)c1ccccc1[C@@H]1CCCN1c1ccc(-c2nn[n-]n2)cn1 ZINC000737635446 598551823 /nfs/dbraw/zinc/55/18/23/598551823.db2.gz GDOXIQYVDAXVGN-AWEZNQCLSA-N -1 3 360.343 3.622 20 0 FHADHM Cc1nnc(Nc2ccc(NC3CCCCC3)cc2)c(-c2nnn[n-]2)c1C ZINC000737534070 598551850 /nfs/dbraw/zinc/55/18/50/598551850.db2.gz SEKXUSCPKRLIAJ-UHFFFAOYSA-N -1 3 364.457 3.762 20 0 FHADHM Cc1nnc(Nc2ccc(NC3CCCCC3)cc2)c(-c2nn[n-]n2)c1C ZINC000737534070 598551851 /nfs/dbraw/zinc/55/18/51/598551851.db2.gz SEKXUSCPKRLIAJ-UHFFFAOYSA-N -1 3 364.457 3.762 20 0 FHADHM Cc1ccoc1C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000737442257 598555653 /nfs/dbraw/zinc/55/56/53/598555653.db2.gz OSNBQWALTXHYJI-UHFFFAOYSA-N -1 3 361.361 3.813 20 0 FHADHM Cc1ccoc1C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000737442257 598555654 /nfs/dbraw/zinc/55/56/54/598555654.db2.gz OSNBQWALTXHYJI-UHFFFAOYSA-N -1 3 361.361 3.813 20 0 FHADHM CCCCCNC(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736450375 598562963 /nfs/dbraw/zinc/56/29/63/598562963.db2.gz APTBTQXIXCWXGH-UHFFFAOYSA-N -1 3 366.425 3.971 20 0 FHADHM CCCCCNC(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736450375 598562964 /nfs/dbraw/zinc/56/29/64/598562964.db2.gz APTBTQXIXCWXGH-UHFFFAOYSA-N -1 3 366.425 3.971 20 0 FHADHM CCN(C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1)C1CC1 ZINC000736504590 598565071 /nfs/dbraw/zinc/56/50/71/598565071.db2.gz BTOFMZGOFJKOEG-UHFFFAOYSA-N -1 3 364.409 3.675 20 0 FHADHM CCN(C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1)C1CC1 ZINC000736504590 598565073 /nfs/dbraw/zinc/56/50/73/598565073.db2.gz BTOFMZGOFJKOEG-UHFFFAOYSA-N -1 3 364.409 3.675 20 0 FHADHM CN(Cc1cccc(-c2nnn[n-]2)c1)C(=O)CCCCCc1cccs1 ZINC000736820027 598568414 /nfs/dbraw/zinc/56/84/14/598568414.db2.gz IWOARWGBGCNGTH-UHFFFAOYSA-N -1 3 369.494 3.690 20 0 FHADHM CN(Cc1cccc(-c2nn[n-]n2)c1)C(=O)CCCCCc1cccs1 ZINC000736820027 598568415 /nfs/dbraw/zinc/56/84/15/598568415.db2.gz IWOARWGBGCNGTH-UHFFFAOYSA-N -1 3 369.494 3.690 20 0 FHADHM COc1cccc(CCNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)c1 ZINC000737131989 598575241 /nfs/dbraw/zinc/57/52/41/598575241.db2.gz SZXZZEVSUZIEEM-UHFFFAOYSA-N -1 3 363.343 3.549 20 0 FHADHM COc1cccc(CCNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)c1 ZINC000737131989 598575242 /nfs/dbraw/zinc/57/52/42/598575242.db2.gz SZXZZEVSUZIEEM-UHFFFAOYSA-N -1 3 363.343 3.549 20 0 FHADHM FC(F)(F)c1cc(N2CC[C@@H](c3ccccc3)C2)ccc1-c1nnn[n-]1 ZINC000737632196 598578327 /nfs/dbraw/zinc/57/83/27/598578327.db2.gz KZZBFROMLABLQG-CYBMUJFWSA-N -1 3 359.355 3.879 20 0 FHADHM FC(F)(F)c1cc(N2CC[C@@H](c3ccccc3)C2)ccc1-c1nn[n-]n1 ZINC000737632196 598578329 /nfs/dbraw/zinc/57/83/29/598578329.db2.gz KZZBFROMLABLQG-CYBMUJFWSA-N -1 3 359.355 3.879 20 0 FHADHM Cc1c(NC(=O)c2cc(-c3ccccc3)ns2)cccc1-c1nnn[n-]1 ZINC000822105789 607361865 /nfs/dbraw/zinc/36/18/65/607361865.db2.gz XGGHNPXYSNJJND-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1c(NC(=O)c2cc(-c3ccccc3)ns2)cccc1-c1nn[n-]n1 ZINC000822105789 607361867 /nfs/dbraw/zinc/36/18/67/607361867.db2.gz XGGHNPXYSNJJND-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM O=C(CCCCCc1cccs1)OCc1cccc(-c2nnn[n-]2)c1 ZINC000737826720 598583743 /nfs/dbraw/zinc/58/37/43/598583743.db2.gz UHOQAFUHPVRWAY-UHFFFAOYSA-N -1 3 356.451 3.775 20 0 FHADHM O=C(CCCCCc1cccs1)OCc1cccc(-c2nn[n-]n2)c1 ZINC000737826720 598583745 /nfs/dbraw/zinc/58/37/45/598583745.db2.gz UHOQAFUHPVRWAY-UHFFFAOYSA-N -1 3 356.451 3.775 20 0 FHADHM O=C(CCCCCc1cccs1)OCc1ccc(-c2nnn[n-]2)cc1F ZINC000737826662 598584098 /nfs/dbraw/zinc/58/40/98/598584098.db2.gz SYLOFMSKUNCVPO-UHFFFAOYSA-N -1 3 374.441 3.914 20 0 FHADHM O=C(CCCCCc1cccs1)OCc1ccc(-c2nn[n-]n2)cc1F ZINC000737826662 598584100 /nfs/dbraw/zinc/58/41/00/598584100.db2.gz SYLOFMSKUNCVPO-UHFFFAOYSA-N -1 3 374.441 3.914 20 0 FHADHM Fc1ccc(Br)cc1CNc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000737647017 598602553 /nfs/dbraw/zinc/60/25/53/598602553.db2.gz AGTZMGMLXQFHKP-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1ccc(Br)cc1CNc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000737647017 598602554 /nfs/dbraw/zinc/60/25/54/598602554.db2.gz AGTZMGMLXQFHKP-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Clc1cccc(-c2noc(C=Cc3ccccc3-c3nnn[n-]3)n2)c1 ZINC000737576080 598609080 /nfs/dbraw/zinc/60/90/80/598609080.db2.gz TZALOPANWCLOSD-CMDGGOBGSA-N -1 3 350.769 3.741 20 0 FHADHM Clc1cccc(-c2noc(C=Cc3ccccc3-c3nn[n-]n3)n2)c1 ZINC000737576080 598609082 /nfs/dbraw/zinc/60/90/82/598609082.db2.gz TZALOPANWCLOSD-CMDGGOBGSA-N -1 3 350.769 3.741 20 0 FHADHM CCC[C@H]1CCCC[C@H]1NC(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000736436572 598609230 /nfs/dbraw/zinc/60/92/30/598609230.db2.gz RWKMHTIXUJKLIL-DOTOQJQBSA-N -1 3 373.526 3.575 20 0 FHADHM CCC[C@H]1CCCC[C@H]1NC(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000736436572 598609232 /nfs/dbraw/zinc/60/92/32/598609232.db2.gz RWKMHTIXUJKLIL-DOTOQJQBSA-N -1 3 373.526 3.575 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)N1CCC[C@@H]1c1cccc(F)c1 ZINC000738162714 598624903 /nfs/dbraw/zinc/62/49/03/598624903.db2.gz LMMFOMDBXWBSAW-MRXNPFEDSA-N -1 3 370.363 3.514 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)N1CCC[C@@H]1c1cccc(F)c1 ZINC000738162714 598624905 /nfs/dbraw/zinc/62/49/05/598624905.db2.gz LMMFOMDBXWBSAW-MRXNPFEDSA-N -1 3 370.363 3.514 20 0 FHADHM Fc1ccc(NCc2ccccc2OC(F)(F)F)c(-c2nnn[n-]2)c1 ZINC000737656997 598632638 /nfs/dbraw/zinc/63/26/38/598632638.db2.gz SAQFXDOPNHOMPU-UHFFFAOYSA-N -1 3 353.279 3.517 20 0 FHADHM Fc1ccc(NCc2ccccc2OC(F)(F)F)c(-c2nn[n-]n2)c1 ZINC000737656997 598632640 /nfs/dbraw/zinc/63/26/40/598632640.db2.gz SAQFXDOPNHOMPU-UHFFFAOYSA-N -1 3 353.279 3.517 20 0 FHADHM C[C@H](SCCCc1ccccc1)C(=O)Nc1ccccc1-c1nnn[n-]1 ZINC000736187492 598643210 /nfs/dbraw/zinc/64/32/10/598643210.db2.gz BGDQBYSHJIGGMX-AWEZNQCLSA-N -1 3 367.478 3.560 20 0 FHADHM C[C@H](SCCCc1ccccc1)C(=O)Nc1ccccc1-c1nn[n-]n1 ZINC000736187492 598643211 /nfs/dbraw/zinc/64/32/11/598643211.db2.gz BGDQBYSHJIGGMX-AWEZNQCLSA-N -1 3 367.478 3.560 20 0 FHADHM Cc1cc(C)cc(NC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)c1 ZINC000737252271 598644905 /nfs/dbraw/zinc/64/49/05/598644905.db2.gz YEPCXDHCCUTOBQ-UHFFFAOYSA-N -1 3 365.437 3.671 20 0 FHADHM Cc1cc(C)cc(NC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)c1 ZINC000737252271 598644907 /nfs/dbraw/zinc/64/49/07/598644907.db2.gz YEPCXDHCCUTOBQ-UHFFFAOYSA-N -1 3 365.437 3.671 20 0 FHADHM CCC[C@H](C)NC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736424704 598647074 /nfs/dbraw/zinc/64/70/74/598647074.db2.gz RNHPDBOJTAAMSP-ZDUSSCGKSA-N -1 3 351.410 3.577 20 0 FHADHM CCC[C@H](C)NC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736424704 598647076 /nfs/dbraw/zinc/64/70/76/598647076.db2.gz RNHPDBOJTAAMSP-ZDUSSCGKSA-N -1 3 351.410 3.577 20 0 FHADHM O=C(C[C@@H](c1ccccc1)C(F)(F)F)Nc1sccc1-c1nnn[n-]1 ZINC000737809827 598647927 /nfs/dbraw/zinc/64/79/27/598647927.db2.gz UMPHCDDWWOVDDR-NSHDSACASA-N -1 3 367.356 3.603 20 0 FHADHM O=C(C[C@@H](c1ccccc1)C(F)(F)F)Nc1sccc1-c1nn[n-]n1 ZINC000737809827 598647929 /nfs/dbraw/zinc/64/79/29/598647929.db2.gz UMPHCDDWWOVDDR-NSHDSACASA-N -1 3 367.356 3.603 20 0 FHADHM Cc1ccc(NC(=O)CSc2ccc(-c3nnn[n-]3)cc2)c(Cl)c1 ZINC000737355954 598648015 /nfs/dbraw/zinc/64/80/15/598648015.db2.gz BTQQXHABIAHEFT-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1ccc(NC(=O)CSc2ccc(-c3nn[n-]n3)cc2)c(Cl)c1 ZINC000737355954 598648016 /nfs/dbraw/zinc/64/80/16/598648016.db2.gz BTQQXHABIAHEFT-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM CC[C@@H](Sc1ccccc1)C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736393409 598649545 /nfs/dbraw/zinc/64/95/45/598649545.db2.gz YIHZQLJYIKMBOZ-CXAGYDPISA-N -1 3 367.478 3.615 20 0 FHADHM CC[C@@H](Sc1ccccc1)C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736393409 598649547 /nfs/dbraw/zinc/64/95/47/598649547.db2.gz YIHZQLJYIKMBOZ-CXAGYDPISA-N -1 3 367.478 3.615 20 0 FHADHM COc1ccccc1[C@H](C)CC(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000737141663 598650616 /nfs/dbraw/zinc/65/06/16/598650616.db2.gz JCIPZKIZLLOZFW-LLVKDONJSA-N -1 3 371.828 3.661 20 0 FHADHM COc1ccccc1[C@H](C)CC(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000737141663 598650617 /nfs/dbraw/zinc/65/06/17/598650617.db2.gz JCIPZKIZLLOZFW-LLVKDONJSA-N -1 3 371.828 3.661 20 0 FHADHM CC(C)CN(C(=O)CSc1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000735819144 598651606 /nfs/dbraw/zinc/65/16/06/598651606.db2.gz UKCLMVHVSVUSHY-UHFFFAOYSA-N -1 3 367.478 3.648 20 0 FHADHM CC(C)CN(C(=O)CSc1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000735819144 598651608 /nfs/dbraw/zinc/65/16/08/598651608.db2.gz UKCLMVHVSVUSHY-UHFFFAOYSA-N -1 3 367.478 3.648 20 0 FHADHM CC(C)[C@H](CC(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000736103695 598651992 /nfs/dbraw/zinc/65/19/92/598651992.db2.gz XSQNTEGMOAKYJR-KXBFYZLASA-N -1 3 363.465 3.874 20 0 FHADHM CC(C)[C@H](CC(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000736103695 598651993 /nfs/dbraw/zinc/65/19/93/598651993.db2.gz XSQNTEGMOAKYJR-KXBFYZLASA-N -1 3 363.465 3.874 20 0 FHADHM CCCCN(C)C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736453504 598651996 /nfs/dbraw/zinc/65/19/96/598651996.db2.gz OHRHMKKYFWDINX-UHFFFAOYSA-N -1 3 351.410 3.531 20 0 FHADHM CCCCN(C)C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736453504 598651997 /nfs/dbraw/zinc/65/19/97/598651997.db2.gz OHRHMKKYFWDINX-UHFFFAOYSA-N -1 3 351.410 3.531 20 0 FHADHM CCCC(=O)Nc1cccc(CNc2ccc(-c3nnn[n-]3)c(Cl)c2)c1 ZINC000736417697 598652877 /nfs/dbraw/zinc/65/28/77/598652877.db2.gz UVQDFFKZECPLGN-UHFFFAOYSA-N -1 3 370.844 3.871 20 0 FHADHM CCCC(=O)Nc1cccc(CNc2ccc(-c3nn[n-]n3)c(Cl)c2)c1 ZINC000736417697 598652878 /nfs/dbraw/zinc/65/28/78/598652878.db2.gz UVQDFFKZECPLGN-UHFFFAOYSA-N -1 3 370.844 3.871 20 0 FHADHM CCC[C@@H](C)N(C)C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736421380 598653205 /nfs/dbraw/zinc/65/32/05/598653205.db2.gz BCIHQCFSVHFNFB-CQSZACIVSA-N -1 3 365.437 3.920 20 0 FHADHM CCC[C@@H](C)N(C)C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736421380 598653207 /nfs/dbraw/zinc/65/32/07/598653207.db2.gz BCIHQCFSVHFNFB-CQSZACIVSA-N -1 3 365.437 3.920 20 0 FHADHM CCCN(CC)C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736472740 598653246 /nfs/dbraw/zinc/65/32/46/598653246.db2.gz XYONSLKWHFYDOD-UHFFFAOYSA-N -1 3 351.410 3.531 20 0 FHADHM CCCN(CC)C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736472740 598653248 /nfs/dbraw/zinc/65/32/48/598653248.db2.gz XYONSLKWHFYDOD-UHFFFAOYSA-N -1 3 351.410 3.531 20 0 FHADHM CC[C@H](C)[C@@H](C)NC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736328298 598657005 /nfs/dbraw/zinc/65/70/05/598657005.db2.gz HCOBTYCXSMHLHN-UONOGXRCSA-N -1 3 365.437 3.823 20 0 FHADHM CC[C@H](C)[C@@H](C)NC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736328298 598657007 /nfs/dbraw/zinc/65/70/07/598657007.db2.gz HCOBTYCXSMHLHN-UONOGXRCSA-N -1 3 365.437 3.823 20 0 FHADHM CCc1c(C)sc(NC(=O)C(C)(C)c2ccc(F)cc2)c1-c1nnn[n-]1 ZINC000736670325 598657979 /nfs/dbraw/zinc/65/79/79/598657979.db2.gz MQEZMZQBVKXUAG-UHFFFAOYSA-N -1 3 373.457 3.854 20 0 FHADHM CCc1c(C)sc(NC(=O)C(C)(C)c2ccc(F)cc2)c1-c1nn[n-]n1 ZINC000736670325 598657981 /nfs/dbraw/zinc/65/79/81/598657981.db2.gz MQEZMZQBVKXUAG-UHFFFAOYSA-N -1 3 373.457 3.854 20 0 FHADHM O=C(CSc1ccc(-c2nnn[n-]2)cc1)Nc1cccc(C(F)F)c1 ZINC000737948291 598659124 /nfs/dbraw/zinc/65/91/24/598659124.db2.gz SJGUHIOBFJTESD-UHFFFAOYSA-N -1 3 361.377 3.535 20 0 FHADHM O=C(CSc1ccc(-c2nn[n-]n2)cc1)Nc1cccc(C(F)F)c1 ZINC000737948291 598659126 /nfs/dbraw/zinc/65/91/26/598659126.db2.gz SJGUHIOBFJTESD-UHFFFAOYSA-N -1 3 361.377 3.535 20 0 FHADHM COc1ccc2ccc(OCc3ccc(F)cc3-c3nnn[n-]3)cc2c1 ZINC000737120412 598674230 /nfs/dbraw/zinc/67/42/30/598674230.db2.gz ONIMHWAKORQPRM-UHFFFAOYSA-N -1 3 350.353 3.747 20 0 FHADHM COc1ccc2ccc(OCc3ccc(F)cc3-c3nn[n-]n3)cc2c1 ZINC000737120412 598674232 /nfs/dbraw/zinc/67/42/32/598674232.db2.gz ONIMHWAKORQPRM-UHFFFAOYSA-N -1 3 350.353 3.747 20 0 FHADHM Cc1cc(C)c(-c2nnn[n-]2)c(N2CC[C@H](c3ccc(Cl)cc3)C2)n1 ZINC000737247071 598679437 /nfs/dbraw/zinc/67/94/37/598679437.db2.gz YPIRHEOEEMAFRQ-AWEZNQCLSA-N -1 3 354.845 3.526 20 0 FHADHM Cc1cc(C)c(-c2nn[n-]n2)c(N2CC[C@H](c3ccc(Cl)cc3)C2)n1 ZINC000737247071 598679438 /nfs/dbraw/zinc/67/94/38/598679438.db2.gz YPIRHEOEEMAFRQ-AWEZNQCLSA-N -1 3 354.845 3.526 20 0 FHADHM CN(Cc1ccc(F)cc1-c1nnn[n-]1)Cc1c(Cl)cccc1Cl ZINC000736820197 598684198 /nfs/dbraw/zinc/68/41/98/598684198.db2.gz SIDLQDXITPHRQU-UHFFFAOYSA-N -1 3 366.227 3.945 20 0 FHADHM CN(Cc1ccc(F)cc1-c1nn[n-]n1)Cc1c(Cl)cccc1Cl ZINC000736820197 598684200 /nfs/dbraw/zinc/68/42/00/598684200.db2.gz SIDLQDXITPHRQU-UHFFFAOYSA-N -1 3 366.227 3.945 20 0 FHADHM Fc1ccc(CSCc2ccc(-n3cccn3)cc2)c(-c2nnn[n-]2)c1 ZINC000737650523 598695681 /nfs/dbraw/zinc/69/56/81/598695681.db2.gz SGXYVPSSMPUXDB-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM Fc1ccc(CSCc2ccc(-n3cccn3)cc2)c(-c2nn[n-]n2)c1 ZINC000737650523 598695683 /nfs/dbraw/zinc/69/56/83/598695683.db2.gz SGXYVPSSMPUXDB-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nnn[n-]1)c1cc(Cl)ccc1Cl ZINC000738231365 598703568 /nfs/dbraw/zinc/70/35/68/598703568.db2.gz LSZVACOHMUIUQC-UHFFFAOYSA-N -1 3 367.167 3.670 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nn[n-]n1)c1cc(Cl)ccc1Cl ZINC000738231365 598703570 /nfs/dbraw/zinc/70/35/70/598703570.db2.gz LSZVACOHMUIUQC-UHFFFAOYSA-N -1 3 367.167 3.670 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nnn[n-]1)c1ccc(Cl)c(Cl)c1 ZINC000738236312 598704345 /nfs/dbraw/zinc/70/43/45/598704345.db2.gz SXAXEXCLRQPLPI-UHFFFAOYSA-N -1 3 367.167 3.670 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nn[n-]n1)c1ccc(Cl)c(Cl)c1 ZINC000738236312 598704347 /nfs/dbraw/zinc/70/43/47/598704347.db2.gz SXAXEXCLRQPLPI-UHFFFAOYSA-N -1 3 367.167 3.670 20 0 FHADHM C[C@@H](OC(=O)CSc1ccc(-c2nnn[n-]2)cc1)c1ccccc1Cl ZINC000736156471 598713591 /nfs/dbraw/zinc/71/35/91/598713591.db2.gz WJZTZCGUJNISOK-LLVKDONJSA-N -1 3 374.853 3.917 20 0 FHADHM C[C@@H](OC(=O)CSc1ccc(-c2nn[n-]n2)cc1)c1ccccc1Cl ZINC000736156471 598713593 /nfs/dbraw/zinc/71/35/93/598713593.db2.gz WJZTZCGUJNISOK-LLVKDONJSA-N -1 3 374.853 3.917 20 0 FHADHM CC[C@H](CC(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2)c1ccccc1 ZINC000736333052 598734467 /nfs/dbraw/zinc/73/44/67/598734467.db2.gz PHNFIKPRUHPNRL-GFCCVEGCSA-N -1 3 367.478 3.939 20 0 FHADHM CC[C@H](CC(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2)c1ccccc1 ZINC000736333052 598734468 /nfs/dbraw/zinc/73/44/68/598734468.db2.gz PHNFIKPRUHPNRL-GFCCVEGCSA-N -1 3 367.478 3.939 20 0 FHADHM C[C@H](CSc1ccccc1)C(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000736047900 598734731 /nfs/dbraw/zinc/73/47/31/598734731.db2.gz TTZYIEXOBMFODI-KGLIPLIRSA-N -1 3 368.462 3.899 20 0 FHADHM C[C@H](CSc1ccccc1)C(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000736047900 598734732 /nfs/dbraw/zinc/73/47/32/598734732.db2.gz TTZYIEXOBMFODI-KGLIPLIRSA-N -1 3 368.462 3.899 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)C(C)(C)c1ccccc1Cl ZINC000737287488 598738134 /nfs/dbraw/zinc/73/81/34/598738134.db2.gz DDHDOZSRBIDUFY-UHFFFAOYSA-N -1 3 355.829 3.745 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)C(C)(C)c1ccccc1Cl ZINC000737287488 598738136 /nfs/dbraw/zinc/73/81/36/598738136.db2.gz DDHDOZSRBIDUFY-UHFFFAOYSA-N -1 3 355.829 3.745 20 0 FHADHM Fc1cccc(N[C@H](c2nccs2)c2ccccc2)c1-c1nnn[n-]1 ZINC000737659250 598758017 /nfs/dbraw/zinc/75/80/17/598758017.db2.gz BQKCYRPOHTUGEA-HNNXBMFYSA-N -1 3 352.398 3.664 20 0 FHADHM Fc1cccc(N[C@H](c2nccs2)c2ccccc2)c1-c1nn[n-]n1 ZINC000737659250 598758019 /nfs/dbraw/zinc/75/80/19/598758019.db2.gz BQKCYRPOHTUGEA-HNNXBMFYSA-N -1 3 352.398 3.664 20 0 FHADHM CC(C)CN(Cc1cc(-c2ccco2)on1)c1ccc(-c2nn[n-]n2)cc1 ZINC000735829273 598759796 /nfs/dbraw/zinc/75/97/96/598759796.db2.gz FYNMKMQNCZWAKW-UHFFFAOYSA-N -1 3 364.409 3.777 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N(Cc1ccccc1F)C(C)C ZINC000737291392 598782623 /nfs/dbraw/zinc/78/26/23/598782623.db2.gz KGAKLXORAYJFHR-UHFFFAOYSA-N -1 3 368.416 3.757 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N(Cc1ccccc1F)C(C)C ZINC000737291392 598782626 /nfs/dbraw/zinc/78/26/26/598782626.db2.gz KGAKLXORAYJFHR-UHFFFAOYSA-N -1 3 368.416 3.757 20 0 FHADHM CC(C)[C@H](c1ccccc1)N(C)C(=O)C=Cc1ccccc1-c1nnn[n-]1 ZINC000735736379 598790680 /nfs/dbraw/zinc/79/06/80/598790680.db2.gz UBCGIWIUHCNZTL-CLEWGBKMSA-N -1 3 361.449 3.736 20 0 FHADHM CC(C)[C@H](c1ccccc1)N(C)C(=O)C=Cc1ccccc1-c1nn[n-]n1 ZINC000735736379 598790683 /nfs/dbraw/zinc/79/06/83/598790683.db2.gz UBCGIWIUHCNZTL-CLEWGBKMSA-N -1 3 361.449 3.736 20 0 FHADHM O=C(Oc1ccc(-c2ccc(-c3nnn[n-]3)cc2)cc1)C1CCSCC1 ZINC000738251445 598790773 /nfs/dbraw/zinc/79/07/73/598790773.db2.gz OOEFLMDTRBXROT-UHFFFAOYSA-N -1 3 366.446 3.582 20 0 FHADHM O=C(Oc1ccc(-c2ccc(-c3nn[n-]n3)cc2)cc1)C1CCSCC1 ZINC000738251445 598790774 /nfs/dbraw/zinc/79/07/74/598790774.db2.gz OOEFLMDTRBXROT-UHFFFAOYSA-N -1 3 366.446 3.582 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)C(C)(C)Oc1cccc(Cl)c1 ZINC000737288512 598792146 /nfs/dbraw/zinc/79/21/46/598792146.db2.gz KRTRXHBKDGSMPJ-UHFFFAOYSA-N -1 3 371.828 3.625 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)C(C)(C)Oc1cccc(Cl)c1 ZINC000737288512 598792147 /nfs/dbraw/zinc/79/21/47/598792147.db2.gz KRTRXHBKDGSMPJ-UHFFFAOYSA-N -1 3 371.828 3.625 20 0 FHADHM COc1ccc(Cl)cc1CNc1ccc(Cl)cc1-c1nn[n-]n1 ZINC000737100405 598792918 /nfs/dbraw/zinc/79/29/18/598792918.db2.gz XOCWILQTDXGPGB-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM COc1ccc(Cl)cc1CNc1ccc(Cl)cc1-c1nnn[n-]1 ZINC000737100405 598792917 /nfs/dbraw/zinc/79/29/17/598792917.db2.gz XOCWILQTDXGPGB-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM CCCC(=O)Nc1cccc(CNc2ccc(Cl)cc2-c2nnn[n-]2)c1 ZINC000736416960 598793157 /nfs/dbraw/zinc/79/31/57/598793157.db2.gz PZKDYOKVHOHJEN-UHFFFAOYSA-N -1 3 370.844 3.871 20 0 FHADHM CCCC(=O)Nc1cccc(CNc2ccc(Cl)cc2-c2nn[n-]n2)c1 ZINC000736416960 598793159 /nfs/dbraw/zinc/79/31/59/598793159.db2.gz PZKDYOKVHOHJEN-UHFFFAOYSA-N -1 3 370.844 3.871 20 0 FHADHM Clc1ccc(NCc2ccc(Br)s2)c(-c2nnn[n-]2)c1 ZINC000737573301 598793847 /nfs/dbraw/zinc/79/38/47/598793847.db2.gz FTKVYUZNKDNANW-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM Clc1ccc(NCc2ccc(Br)s2)c(-c2nn[n-]n2)c1 ZINC000737573301 598793849 /nfs/dbraw/zinc/79/38/49/598793849.db2.gz FTKVYUZNKDNANW-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM COc1ccc([C@H]2CCN(c3ccc(Cl)cc3-c3nnn[n-]3)C2)cc1 ZINC000737077454 598795863 /nfs/dbraw/zinc/79/58/63/598795863.db2.gz UIZJRFACZTVVSK-ZDUSSCGKSA-N -1 3 355.829 3.523 20 0 FHADHM COc1ccc([C@H]2CCN(c3ccc(Cl)cc3-c3nn[n-]n3)C2)cc1 ZINC000737077454 598795865 /nfs/dbraw/zinc/79/58/65/598795865.db2.gz UIZJRFACZTVVSK-ZDUSSCGKSA-N -1 3 355.829 3.523 20 0 FHADHM CC(C)[C@@H](C)C(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000735703788 598804810 /nfs/dbraw/zinc/80/48/10/598804810.db2.gz WBSUOTPXQCXYAO-CYBMUJFWSA-N -1 3 351.410 3.890 20 0 FHADHM CC(C)[C@@H](C)C(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735703788 598804811 /nfs/dbraw/zinc/80/48/11/598804811.db2.gz WBSUOTPXQCXYAO-CYBMUJFWSA-N -1 3 351.410 3.890 20 0 FHADHM CCCC(=O)N(Cc1ccccc1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000736412708 598807394 /nfs/dbraw/zinc/80/73/94/598807394.db2.gz UAQWKBATZIBXGG-UHFFFAOYSA-N -1 3 355.829 3.853 20 0 FHADHM CCCC(=O)N(Cc1ccccc1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000736412708 598807395 /nfs/dbraw/zinc/80/73/95/598807395.db2.gz UAQWKBATZIBXGG-UHFFFAOYSA-N -1 3 355.829 3.853 20 0 FHADHM CCOc1ccc([C@@H](Nc2ncccc2-c2nnn[n-]2)c2ccccc2)cc1 ZINC000736637136 598814488 /nfs/dbraw/zinc/81/44/88/598814488.db2.gz NCYLGMQLPRRHPH-IBGZPJMESA-N -1 3 372.432 3.862 20 0 FHADHM CCOc1ccc([C@@H](Nc2ncccc2-c2nn[n-]n2)c2ccccc2)cc1 ZINC000736637136 598814490 /nfs/dbraw/zinc/81/44/90/598814490.db2.gz NCYLGMQLPRRHPH-IBGZPJMESA-N -1 3 372.432 3.862 20 0 FHADHM CC(C(=O)Nc1cccc(-c2nnn[n-]2)c1)(c1ccccc1)c1ccccc1 ZINC000104220425 598815146 /nfs/dbraw/zinc/81/51/46/598815146.db2.gz FIAGTGUMWDYRTJ-UHFFFAOYSA-N -1 3 369.428 3.811 20 0 FHADHM CC(C(=O)Nc1cccc(-c2nn[n-]n2)c1)(c1ccccc1)c1ccccc1 ZINC000104220425 598815147 /nfs/dbraw/zinc/81/51/47/598815147.db2.gz FIAGTGUMWDYRTJ-UHFFFAOYSA-N -1 3 369.428 3.811 20 0 FHADHM Cc1ccc(C(=O)Nc2cccc(Oc3ccc(-c4nnn[n-]4)cc3)c2)n1C ZINC000737314434 598821796 /nfs/dbraw/zinc/82/17/96/598821796.db2.gz DFAYZUYKVYIJRS-UHFFFAOYSA-N -1 3 374.404 3.558 20 0 FHADHM Cc1ccc(C(=O)Nc2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)n1C ZINC000737314434 598821797 /nfs/dbraw/zinc/82/17/97/598821797.db2.gz DFAYZUYKVYIJRS-UHFFFAOYSA-N -1 3 374.404 3.558 20 0 FHADHM CC(C)Oc1c(Cl)cccc1NC(=O)c1sccc1-c1nnn[n-]1 ZINC000735905293 599300182 /nfs/dbraw/zinc/30/01/82/599300182.db2.gz ZUKIXCHIEFLFKY-UHFFFAOYSA-N -1 3 363.830 3.621 20 0 FHADHM CC(C)Oc1c(Cl)cccc1NC(=O)c1sccc1-c1nn[n-]n1 ZINC000735905293 599300184 /nfs/dbraw/zinc/30/01/84/599300184.db2.gz ZUKIXCHIEFLFKY-UHFFFAOYSA-N -1 3 363.830 3.621 20 0 FHADHM O=C(NCc1cccc(-c2nnn[n-]2)c1)c1cccc(Nc2ccccc2)c1 ZINC000738115446 599304431 /nfs/dbraw/zinc/30/44/31/599304431.db2.gz ARXLAFTUMWYUSB-UHFFFAOYSA-N -1 3 370.416 3.540 20 0 FHADHM O=C(NCc1cccc(-c2nn[n-]n2)c1)c1cccc(Nc2ccccc2)c1 ZINC000738115446 599304433 /nfs/dbraw/zinc/30/44/33/599304433.db2.gz ARXLAFTUMWYUSB-UHFFFAOYSA-N -1 3 370.416 3.540 20 0 FHADHM CN(C(=O)c1ccc(-c2ccccc2)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736749149 599308197 /nfs/dbraw/zinc/30/81/97/599308197.db2.gz MKMZLWBKLSUGQD-UHFFFAOYSA-N -1 3 355.401 3.810 20 0 FHADHM CN(C(=O)c1ccc(-c2ccccc2)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736749149 599308200 /nfs/dbraw/zinc/30/82/00/599308200.db2.gz MKMZLWBKLSUGQD-UHFFFAOYSA-N -1 3 355.401 3.810 20 0 FHADHM CCN(C(=O)CSc1cc(C)ccc1C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736505909 599309128 /nfs/dbraw/zinc/30/91/28/599309128.db2.gz ULJBHIMEADCRKI-UHFFFAOYSA-N -1 3 367.478 3.629 20 0 FHADHM CCN(C(=O)CSc1cc(C)ccc1C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736505909 599309131 /nfs/dbraw/zinc/30/91/31/599309131.db2.gz ULJBHIMEADCRKI-UHFFFAOYSA-N -1 3 367.478 3.629 20 0 FHADHM CCN(C(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736501298 599311016 /nfs/dbraw/zinc/31/10/16/599311016.db2.gz CIDYTXCACBKMGU-CHWSQXEVSA-N -1 3 367.375 3.588 20 0 FHADHM CCN(C(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736501298 599311019 /nfs/dbraw/zinc/31/10/19/599311019.db2.gz CIDYTXCACBKMGU-CHWSQXEVSA-N -1 3 367.375 3.588 20 0 FHADHM CCN(C(=O)c1ccc(Cl)c(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736507132 599312659 /nfs/dbraw/zinc/31/26/59/599312659.db2.gz AOEZCHOCQPKVSM-UHFFFAOYSA-N -1 3 362.220 3.840 20 0 FHADHM CCN(C(=O)c1ccc(Cl)c(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736507132 599312662 /nfs/dbraw/zinc/31/26/62/599312662.db2.gz AOEZCHOCQPKVSM-UHFFFAOYSA-N -1 3 362.220 3.840 20 0 FHADHM C[C@H](S[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)C(=O)N(C)c1ccccc1 ZINC000736189692 599325595 /nfs/dbraw/zinc/32/55/95/599325595.db2.gz QKOCAUALMLLTPX-KBPBESRZSA-N -1 3 367.478 3.712 20 0 FHADHM C[C@H](S[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)C(=O)N(C)c1ccccc1 ZINC000736189692 599325598 /nfs/dbraw/zinc/32/55/98/599325598.db2.gz QKOCAUALMLLTPX-KBPBESRZSA-N -1 3 367.478 3.712 20 0 FHADHM C[C@H](SCc1cccc(C(=O)N(C)C)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736193762 599325794 /nfs/dbraw/zinc/32/57/94/599325794.db2.gz SLOAKDZGKHCWEZ-ZDUSSCGKSA-N -1 3 367.478 3.563 20 0 FHADHM C[C@H](SCc1cccc(C(=O)N(C)C)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736193762 599325795 /nfs/dbraw/zinc/32/57/95/599325795.db2.gz SLOAKDZGKHCWEZ-ZDUSSCGKSA-N -1 3 367.478 3.563 20 0 FHADHM COc1ccccc1OCCS[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000737155056 599326375 /nfs/dbraw/zinc/32/63/75/599326375.db2.gz CQYNXBRTOGGDSI-CYBMUJFWSA-N -1 3 356.451 3.749 20 0 FHADHM COc1ccccc1OCCS[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000737155056 599326377 /nfs/dbraw/zinc/32/63/77/599326377.db2.gz CQYNXBRTOGGDSI-CYBMUJFWSA-N -1 3 356.451 3.749 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NCc1ccc(SC(F)F)cc1 ZINC000737061539 599328455 /nfs/dbraw/zinc/32/84/55/599328455.db2.gz AMUKERDSVCVNCZ-UHFFFAOYSA-N -1 3 363.393 3.802 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NCc1ccc(SC(F)F)cc1 ZINC000737061539 599328457 /nfs/dbraw/zinc/32/84/57/599328457.db2.gz AMUKERDSVCVNCZ-UHFFFAOYSA-N -1 3 363.393 3.802 20 0 FHADHM CCOc1ccc(C(C)=O)cc1CSc1ccccc1-c1nnn[n-]1 ZINC000821417391 599344518 /nfs/dbraw/zinc/34/45/18/599344518.db2.gz MUEWIOJOPPQNFZ-UHFFFAOYSA-N -1 3 354.435 3.760 20 0 FHADHM CCOc1ccc(C(C)=O)cc1CSc1ccccc1-c1nn[n-]n1 ZINC000821417391 599344520 /nfs/dbraw/zinc/34/45/20/599344520.db2.gz MUEWIOJOPPQNFZ-UHFFFAOYSA-N -1 3 354.435 3.760 20 0 FHADHM Cc1ccccc1[C@H](C)NC(=O)[C@H](C)Sc1ccccc1-c1nnn[n-]1 ZINC000822345927 599348275 /nfs/dbraw/zinc/34/82/75/599348275.db2.gz WWDJMTVQYHBCEV-KBPBESRZSA-N -1 3 367.478 3.533 20 0 FHADHM Cc1ccccc1[C@H](C)NC(=O)[C@H](C)Sc1ccccc1-c1nn[n-]n1 ZINC000822345927 599348279 /nfs/dbraw/zinc/34/82/79/599348279.db2.gz WWDJMTVQYHBCEV-KBPBESRZSA-N -1 3 367.478 3.533 20 0 FHADHM CN(Cc1ccc(-c2ccccc2-c2nnn[n-]2)cc1)c1cccc(O)c1 ZINC000736814078 599353677 /nfs/dbraw/zinc/35/36/77/599353677.db2.gz OMHZGNAZFRHGJV-UHFFFAOYSA-N -1 3 357.417 3.876 20 0 FHADHM CN(Cc1ccc(-c2ccccc2-c2nn[n-]n2)cc1)c1cccc(O)c1 ZINC000736814078 599353679 /nfs/dbraw/zinc/35/36/79/599353679.db2.gz OMHZGNAZFRHGJV-UHFFFAOYSA-N -1 3 357.417 3.876 20 0 FHADHM CC(C)C(=O)Nc1ccc(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000820011425 599362303 /nfs/dbraw/zinc/36/23/03/599362303.db2.gz MKEVKSVOFNFRKW-CYBMUJFWSA-N -1 3 350.426 3.634 20 0 FHADHM CC(C)C(=O)Nc1ccc(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000820011425 599362306 /nfs/dbraw/zinc/36/23/06/599362306.db2.gz MKEVKSVOFNFRKW-CYBMUJFWSA-N -1 3 350.426 3.634 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1CNc1ccc(CC(F)(F)F)cc1 ZINC000821736086 607371376 /nfs/dbraw/zinc/37/13/76/607371376.db2.gz ANHQLSVZBWFZQR-UHFFFAOYSA-N -1 3 363.343 3.592 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CNc1ccc(CC(F)(F)F)cc1 ZINC000821736086 607371377 /nfs/dbraw/zinc/37/13/77/607371377.db2.gz ANHQLSVZBWFZQR-UHFFFAOYSA-N -1 3 363.343 3.592 20 0 FHADHM C[C@H](Nc1cccc(OCC(F)(F)F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820461422 599367145 /nfs/dbraw/zinc/36/71/45/599367145.db2.gz JSBOOCRAGBGTMZ-NSHDSACASA-N -1 3 363.343 3.981 20 0 FHADHM C[C@H](Nc1cccc(OCC(F)(F)F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820461422 599367148 /nfs/dbraw/zinc/36/71/48/599367148.db2.gz JSBOOCRAGBGTMZ-NSHDSACASA-N -1 3 363.343 3.981 20 0 FHADHM O=C(Nc1sc2c(c1-c1nnn[n-]1)CCCC2)c1cc2occc2s1 ZINC000738212761 599370599 /nfs/dbraw/zinc/37/05/99/599370599.db2.gz ZASXJQUZGDQRLD-UHFFFAOYSA-N -1 3 371.447 3.867 20 0 FHADHM O=C(Nc1sc2c(c1-c1nn[n-]n1)CCCC2)c1cc2occc2s1 ZINC000738212761 599370602 /nfs/dbraw/zinc/37/06/02/599370602.db2.gz ZASXJQUZGDQRLD-UHFFFAOYSA-N -1 3 371.447 3.867 20 0 FHADHM Cc1ccnc(-c2cccc(N[C@H](C)c3ccc(-c4nnn[n-]4)cc3)c2)n1 ZINC000822374350 599378950 /nfs/dbraw/zinc/37/89/50/599378950.db2.gz RXEGFQHDWBRIMR-CQSZACIVSA-N -1 3 357.421 3.805 20 0 FHADHM Cc1ccnc(-c2cccc(N[C@H](C)c3ccc(-c4nn[n-]n4)cc3)c2)n1 ZINC000822374350 599378953 /nfs/dbraw/zinc/37/89/53/599378953.db2.gz RXEGFQHDWBRIMR-CQSZACIVSA-N -1 3 357.421 3.805 20 0 FHADHM CCc1nnc([C@H](C)Oc2ccc(-c3ccc(-c4nnn[n-]4)cc3)cc2)o1 ZINC000821518556 599381263 /nfs/dbraw/zinc/38/12/63/599381263.db2.gz ZMBJNOQTTUBQCI-LBPRGKRZSA-N -1 3 362.393 3.619 20 0 FHADHM CCc1nnc([C@H](C)Oc2ccc(-c3ccc(-c4nn[n-]n4)cc3)cc2)o1 ZINC000821518556 599381265 /nfs/dbraw/zinc/38/12/65/599381265.db2.gz ZMBJNOQTTUBQCI-LBPRGKRZSA-N -1 3 362.393 3.619 20 0 FHADHM CC(C)c1ccc(OCc2nnc(-c3ccc(-c4nnn[n-]4)cc3)o2)cc1 ZINC000820191950 599381730 /nfs/dbraw/zinc/38/17/30/599381730.db2.gz BTTHOFICELEHMC-UHFFFAOYSA-N -1 3 362.393 3.619 20 0 FHADHM CC(C)c1ccc(OCc2nnc(-c3ccc(-c4nn[n-]n4)cc3)o2)cc1 ZINC000820191950 599381732 /nfs/dbraw/zinc/38/17/32/599381732.db2.gz BTTHOFICELEHMC-UHFFFAOYSA-N -1 3 362.393 3.619 20 0 FHADHM COc1ccc([C@@H]2CCCN2c2cc(Cl)ccc2-c2nnn[n-]2)cc1 ZINC000737077182 599397970 /nfs/dbraw/zinc/39/79/70/599397970.db2.gz SKAJAPSHLBKOCY-INIZCTEOSA-N -1 3 355.829 3.870 20 0 FHADHM COc1ccc([C@@H]2CCCN2c2cc(Cl)ccc2-c2nn[n-]n2)cc1 ZINC000737077182 599397973 /nfs/dbraw/zinc/39/79/73/599397973.db2.gz SKAJAPSHLBKOCY-INIZCTEOSA-N -1 3 355.829 3.870 20 0 FHADHM Fc1ccc2c(CCNc3cc(-c4nnn[n-]4)c4ccccc4n3)c[nH]c2c1 ZINC000737655714 599423040 /nfs/dbraw/zinc/42/30/40/599423040.db2.gz FAGREOULVTWBFU-UHFFFAOYSA-N -1 3 373.395 3.690 20 0 FHADHM Fc1ccc2c(CCNc3cc(-c4nn[n-]n4)c4ccccc4n3)c[nH]c2c1 ZINC000737655714 599423043 /nfs/dbraw/zinc/42/30/43/599423043.db2.gz FAGREOULVTWBFU-UHFFFAOYSA-N -1 3 373.395 3.690 20 0 FHADHM Cc1ccc([C@@H](C)NC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1C ZINC000822228901 599426374 /nfs/dbraw/zinc/42/63/74/599426374.db2.gz ILBSAERXMHVNGB-HUUCEWRRSA-N -1 3 364.453 3.605 20 0 FHADHM Cc1ccc([C@@H](C)NC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1C ZINC000822228901 599426376 /nfs/dbraw/zinc/42/63/76/599426376.db2.gz ILBSAERXMHVNGB-HUUCEWRRSA-N -1 3 364.453 3.605 20 0 FHADHM c1ccc(C[C@H]2CCCN(c3cc(-c4nnn[n-]4)c4ccccc4n3)C2)cc1 ZINC000738426669 599432961 /nfs/dbraw/zinc/43/29/61/599432961.db2.gz FZEBDLXFESTZAX-QGZVFWFLSA-N -1 3 370.460 3.874 20 0 FHADHM c1ccc(C[C@H]2CCCN(c3cc(-c4nn[n-]n4)c4ccccc4n3)C2)cc1 ZINC000738426669 599432965 /nfs/dbraw/zinc/43/29/65/599432965.db2.gz FZEBDLXFESTZAX-QGZVFWFLSA-N -1 3 370.460 3.874 20 0 FHADHM CCS[C@H]1CCCCN(c2cc(-c3nnn[n-]3)c3ccccc3n2)C1 ZINC000736664429 599436382 /nfs/dbraw/zinc/43/63/82/599436382.db2.gz KYPILUFZOBSPHN-ZDUSSCGKSA-N -1 3 354.483 3.527 20 0 FHADHM CCS[C@H]1CCCCN(c2cc(-c3nn[n-]n3)c3ccccc3n2)C1 ZINC000736664429 599436386 /nfs/dbraw/zinc/43/63/86/599436386.db2.gz KYPILUFZOBSPHN-ZDUSSCGKSA-N -1 3 354.483 3.527 20 0 FHADHM C[C@H]1C[C@H](c2ccccc2)CN1c1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000736235031 599438234 /nfs/dbraw/zinc/43/82/34/599438234.db2.gz LNONLOIXTUQAKS-HOCLYGCPSA-N -1 3 356.433 3.797 20 0 FHADHM C[C@H]1C[C@H](c2ccccc2)CN1c1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000736235031 599438237 /nfs/dbraw/zinc/43/82/37/599438237.db2.gz LNONLOIXTUQAKS-HOCLYGCPSA-N -1 3 356.433 3.797 20 0 FHADHM Cc1cc(C)cc([C@H](C)NC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000822196551 599440581 /nfs/dbraw/zinc/44/05/81/599440581.db2.gz NFNJXBBKMPLPDO-CABCVRRESA-N -1 3 364.453 3.605 20 0 FHADHM Cc1cc(C)cc([C@H](C)NC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000822196551 599440584 /nfs/dbraw/zinc/44/05/84/599440584.db2.gz NFNJXBBKMPLPDO-CABCVRRESA-N -1 3 364.453 3.605 20 0 FHADHM CCc1noc([C@@H](C)Oc2ccc(-c3ccc(-c4nnn[n-]4)cc3)cc2)n1 ZINC000736713829 599444193 /nfs/dbraw/zinc/44/41/93/599444193.db2.gz SQXCIHIVWITEJM-GFCCVEGCSA-N -1 3 362.393 3.619 20 0 FHADHM CCc1noc([C@@H](C)Oc2ccc(-c3ccc(-c4nn[n-]n4)cc3)cc2)n1 ZINC000736713829 599444194 /nfs/dbraw/zinc/44/41/94/599444194.db2.gz SQXCIHIVWITEJM-GFCCVEGCSA-N -1 3 362.393 3.619 20 0 FHADHM CCCCc1noc([C@@H](C)SCc2cc(-c3nnn[n-]3)ccc2F)n1 ZINC000736467130 599451651 /nfs/dbraw/zinc/45/16/51/599451651.db2.gz VMELQDBXGWHEQQ-SNVBAGLBSA-N -1 3 362.434 3.726 20 0 FHADHM CCCCc1noc([C@@H](C)SCc2cc(-c3nn[n-]n3)ccc2F)n1 ZINC000736467130 599451654 /nfs/dbraw/zinc/45/16/54/599451654.db2.gz VMELQDBXGWHEQQ-SNVBAGLBSA-N -1 3 362.434 3.726 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H](C)C[C@H](C)CC ZINC000821104426 599458795 /nfs/dbraw/zinc/45/87/95/599458795.db2.gz CQCZUTCLHFDVPZ-CABCVRRESA-N -1 3 358.490 3.613 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H](C)C[C@H](C)CC ZINC000821104426 599458796 /nfs/dbraw/zinc/45/87/96/599458796.db2.gz CQCZUTCLHFDVPZ-CABCVRRESA-N -1 3 358.490 3.613 20 0 FHADHM CCOc1ccc([C@H](C)Nc2ccc(F)cc2-c2nnn[n-]2)cc1OCC ZINC000821418042 599465012 /nfs/dbraw/zinc/46/50/12/599465012.db2.gz VFTVDDBOBSWAON-LBPRGKRZSA-N -1 3 371.416 3.976 20 0 FHADHM CCOc1ccc([C@H](C)Nc2ccc(F)cc2-c2nn[n-]n2)cc1OCC ZINC000821418042 599465014 /nfs/dbraw/zinc/46/50/14/599465014.db2.gz VFTVDDBOBSWAON-LBPRGKRZSA-N -1 3 371.416 3.976 20 0 FHADHM C[C@@H](NC(=O)N(C)CCC1CCCCC1)c1cccc(-c2nnn[n-]2)c1 ZINC000820339493 599470418 /nfs/dbraw/zinc/47/04/18/599470418.db2.gz CYRZLAHMUVMOEV-CQSZACIVSA-N -1 3 356.474 3.540 20 0 FHADHM C[C@@H](NC(=O)N(C)CCC1CCCCC1)c1cccc(-c2nn[n-]n2)c1 ZINC000820339493 599470419 /nfs/dbraw/zinc/47/04/19/599470419.db2.gz CYRZLAHMUVMOEV-CQSZACIVSA-N -1 3 356.474 3.540 20 0 FHADHM CCC[C@@H](NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)C1CCCCC1 ZINC000821020958 599484427 /nfs/dbraw/zinc/48/44/27/599484427.db2.gz KENNKKZRDWLKDF-RDTXWAMCSA-N -1 3 370.501 3.976 20 0 FHADHM CCC[C@@H](NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)C1CCCCC1 ZINC000821020958 599484428 /nfs/dbraw/zinc/48/44/28/599484428.db2.gz KENNKKZRDWLKDF-RDTXWAMCSA-N -1 3 370.501 3.976 20 0 FHADHM C[C@@H](Cc1ccc(Cl)cc1)N(C)C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000736055784 599492740 /nfs/dbraw/zinc/49/27/40/599492740.db2.gz IZZWMYFOTZOEIE-LBPRGKRZSA-N -1 3 370.844 3.615 20 0 FHADHM C[C@@H](Cc1ccc(Cl)cc1)N(C)C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000736055784 599492743 /nfs/dbraw/zinc/49/27/43/599492743.db2.gz IZZWMYFOTZOEIE-LBPRGKRZSA-N -1 3 370.844 3.615 20 0 FHADHM Fc1ccc(N2CCC(c3cc4ccccc4[nH]3)CC2)c(-c2nnn[n-]2)c1 ZINC000822778123 599501640 /nfs/dbraw/zinc/50/16/40/599501640.db2.gz DHUPAUBUKLAQSR-UHFFFAOYSA-N -1 3 362.412 3.871 20 0 FHADHM Fc1ccc(N2CCC(c3cc4ccccc4[nH]3)CC2)c(-c2nn[n-]n2)c1 ZINC000822778123 599501643 /nfs/dbraw/zinc/50/16/43/599501643.db2.gz DHUPAUBUKLAQSR-UHFFFAOYSA-N -1 3 362.412 3.871 20 0 FHADHM C[C@H](NC(=O)CCCCCc1cccs1)c1cccc(-c2nnn[n-]2)c1 ZINC000820322678 599506245 /nfs/dbraw/zinc/50/62/45/599506245.db2.gz UCJJNIIZFLHXBN-AWEZNQCLSA-N -1 3 369.494 3.909 20 0 FHADHM C[C@H](NC(=O)CCCCCc1cccs1)c1cccc(-c2nn[n-]n2)c1 ZINC000820322678 599506248 /nfs/dbraw/zinc/50/62/48/599506248.db2.gz UCJJNIIZFLHXBN-AWEZNQCLSA-N -1 3 369.494 3.909 20 0 FHADHM C[C@@H](NC(=O)c1csc2c1CC[C@@H](C)C2)c1cccc(-c2nnn[n-]2)c1 ZINC000820727094 599507162 /nfs/dbraw/zinc/50/71/62/599507162.db2.gz GMVMIZAXLOWDJE-VXGBXAGGSA-N -1 3 367.478 3.544 20 0 FHADHM C[C@@H](NC(=O)c1csc2c1CC[C@@H](C)C2)c1cccc(-c2nn[n-]n2)c1 ZINC000820727094 599507164 /nfs/dbraw/zinc/50/71/64/599507164.db2.gz GMVMIZAXLOWDJE-VXGBXAGGSA-N -1 3 367.478 3.544 20 0 FHADHM CN(C[C@@H]1CCCO[C@@H]1c1ccccc1)c1ccc(F)cc1-c1nnn[n-]1 ZINC000821596806 599508020 /nfs/dbraw/zinc/50/80/20/599508020.db2.gz VRKVLYHBIOAXPY-HNAYVOBHSA-N -1 3 367.428 3.610 20 0 FHADHM CN(C[C@@H]1CCCO[C@@H]1c1ccccc1)c1ccc(F)cc1-c1nn[n-]n1 ZINC000821596806 599508022 /nfs/dbraw/zinc/50/80/22/599508022.db2.gz VRKVLYHBIOAXPY-HNAYVOBHSA-N -1 3 367.428 3.610 20 0 FHADHM C[C@H](NC(=O)C(C)(C)c1ccc(Cl)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000820314392 599510781 /nfs/dbraw/zinc/51/07/81/599510781.db2.gz IDTMZAUDOWTARY-LBPRGKRZSA-N -1 3 369.856 3.675 20 0 FHADHM C[C@H](NC(=O)C(C)(C)c1ccc(Cl)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000820314392 599510782 /nfs/dbraw/zinc/51/07/82/599510782.db2.gz IDTMZAUDOWTARY-LBPRGKRZSA-N -1 3 369.856 3.675 20 0 FHADHM CCC1(C)CCN(c2c(-c3nnn[n-]3)cnc3c(F)ccc(F)c32)CC1 ZINC000820951036 599513835 /nfs/dbraw/zinc/51/38/35/599513835.db2.gz VHPFNAWMLOQGRZ-UHFFFAOYSA-N -1 3 358.396 3.710 20 0 FHADHM CCC1(C)CCN(c2c(-c3nn[n-]n3)cnc3c(F)ccc(F)c32)CC1 ZINC000820951036 599513837 /nfs/dbraw/zinc/51/38/37/599513837.db2.gz VHPFNAWMLOQGRZ-UHFFFAOYSA-N -1 3 358.396 3.710 20 0 FHADHM C[C@H](Nc1c(-c2nnn[n-]2)cnc2c(F)cc(F)cc21)c1cccc(O)c1 ZINC000820451974 599515405 /nfs/dbraw/zinc/51/54/05/599515405.db2.gz YXDYFJYSMNQODL-VIFPVBQESA-N -1 3 368.347 3.572 20 0 FHADHM C[C@H](Nc1c(-c2nn[n-]n2)cnc2c(F)cc(F)cc21)c1cccc(O)c1 ZINC000820451974 599515406 /nfs/dbraw/zinc/51/54/06/599515406.db2.gz YXDYFJYSMNQODL-VIFPVBQESA-N -1 3 368.347 3.572 20 0 FHADHM C[C@@H](NC(=O)C1(c2ccccc2)CCCC1)c1cccc(-c2nnn[n-]2)c1 ZINC000820322059 599516044 /nfs/dbraw/zinc/51/60/44/599516044.db2.gz QGPZQONDYNRPOV-OAHLLOKOSA-N -1 3 361.449 3.556 20 0 FHADHM C[C@@H](NC(=O)C1(c2ccccc2)CCCC1)c1cccc(-c2nn[n-]n2)c1 ZINC000820322059 599516046 /nfs/dbraw/zinc/51/60/46/599516046.db2.gz QGPZQONDYNRPOV-OAHLLOKOSA-N -1 3 361.449 3.556 20 0 FHADHM CCc1ccc([C@H](C)CC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000821475846 599522523 /nfs/dbraw/zinc/52/25/23/599522523.db2.gz BAFJPDGCNBOZHH-CABCVRRESA-N -1 3 363.465 3.800 20 0 FHADHM CCc1ccc([C@H](C)CC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000821475846 599522525 /nfs/dbraw/zinc/52/25/25/599522525.db2.gz BAFJPDGCNBOZHH-CABCVRRESA-N -1 3 363.465 3.800 20 0 FHADHM C[C@@H](S[C@H](C)c1cccs1)C(=O)Nc1ccccc1-c1nnn[n-]1 ZINC000736188206 599523986 /nfs/dbraw/zinc/52/39/86/599523986.db2.gz JBQGLTZBYRMFRD-GHMZBOCLSA-N -1 3 359.480 3.750 20 0 FHADHM C[C@@H](S[C@H](C)c1cccs1)C(=O)Nc1ccccc1-c1nn[n-]n1 ZINC000736188206 599523987 /nfs/dbraw/zinc/52/39/87/599523987.db2.gz JBQGLTZBYRMFRD-GHMZBOCLSA-N -1 3 359.480 3.750 20 0 FHADHM Cc1ccc(CN(C)c2c(-c3nnn[n-]3)cnc3c(F)ccc(F)c32)s1 ZINC000822237078 599524106 /nfs/dbraw/zinc/52/41/06/599524106.db2.gz DFIWGVXGVVRJDA-UHFFFAOYSA-N -1 3 372.404 3.699 20 0 FHADHM Cc1ccc(CN(C)c2c(-c3nn[n-]n3)cnc3c(F)ccc(F)c32)s1 ZINC000822237078 599524109 /nfs/dbraw/zinc/52/41/09/599524109.db2.gz DFIWGVXGVVRJDA-UHFFFAOYSA-N -1 3 372.404 3.699 20 0 FHADHM CC[C@H](C)[C@H](C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000820860857 599532136 /nfs/dbraw/zinc/53/21/36/599532136.db2.gz KVQSAUYFIIDDMR-KHYOSLBOSA-N -1 3 363.465 3.874 20 0 FHADHM CC[C@H](C)[C@H](C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000820860857 599532139 /nfs/dbraw/zinc/53/21/39/599532139.db2.gz KVQSAUYFIIDDMR-KHYOSLBOSA-N -1 3 363.465 3.874 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)ccc1OC(=O)CC/C=C\c1ccccc1 ZINC000736625568 599539404 /nfs/dbraw/zinc/53/94/04/599539404.db2.gz CDSBWHYZYJHZHH-POHAHGRESA-N -1 3 364.405 3.664 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)ccc1OC(=O)CC/C=C\c1ccccc1 ZINC000736625568 599539406 /nfs/dbraw/zinc/53/94/06/599539406.db2.gz CDSBWHYZYJHZHH-POHAHGRESA-N -1 3 364.405 3.664 20 0 FHADHM Cc1sc(NC(=O)CC/C=C\c2ccccc2)c(-c2nnn[n-]2)c1C ZINC000737563728 599540073 /nfs/dbraw/zinc/54/00/73/599540073.db2.gz SPBXFYWGMWXDEQ-POHAHGRESA-N -1 3 353.451 3.977 20 0 FHADHM Cc1sc(NC(=O)CC/C=C\c2ccccc2)c(-c2nn[n-]n2)c1C ZINC000737563728 599540075 /nfs/dbraw/zinc/54/00/75/599540075.db2.gz SPBXFYWGMWXDEQ-POHAHGRESA-N -1 3 353.451 3.977 20 0 FHADHM CCc1ccc([C@@H](C)CC(=O)N(C)Cc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000736685116 599542420 /nfs/dbraw/zinc/54/24/20/599542420.db2.gz FREMEBFIRSDAFX-HNNXBMFYSA-N -1 3 363.465 3.581 20 0 FHADHM CCc1ccc([C@@H](C)CC(=O)N(C)Cc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000736685116 599542421 /nfs/dbraw/zinc/54/24/21/599542421.db2.gz FREMEBFIRSDAFX-HNNXBMFYSA-N -1 3 363.465 3.581 20 0 FHADHM O=C(CC/C=C\c1ccccc1)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000737827628 599543177 /nfs/dbraw/zinc/54/31/77/599543177.db2.gz ZZOMGQJEHVOXAN-YWEYNIOJSA-N -1 3 373.460 3.851 20 0 FHADHM O=C(CC/C=C\c1ccccc1)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000737827628 599543178 /nfs/dbraw/zinc/54/31/78/599543178.db2.gz ZZOMGQJEHVOXAN-YWEYNIOJSA-N -1 3 373.460 3.851 20 0 FHADHM CC[C@@H](CC(=O)Nc1cc(-c2nnn[n-]2)ccc1OC)c1ccc(C)cc1 ZINC000736334097 599544441 /nfs/dbraw/zinc/54/44/41/599544441.db2.gz SMSJGGQSPQYVMK-AWEZNQCLSA-N -1 3 365.437 3.706 20 0 FHADHM CC[C@@H](CC(=O)Nc1cc(-c2nn[n-]n2)ccc1OC)c1ccc(C)cc1 ZINC000736334097 599544444 /nfs/dbraw/zinc/54/44/44/599544444.db2.gz SMSJGGQSPQYVMK-AWEZNQCLSA-N -1 3 365.437 3.706 20 0 FHADHM Cc1cc(NC(=O)Nc2cccc(-c3nnn[n-]3)c2)ccc1OC(C)C ZINC000822208349 599551539 /nfs/dbraw/zinc/55/15/39/599551539.db2.gz OBRHLAAYFCEZSQ-UHFFFAOYSA-N -1 3 352.398 3.606 20 0 FHADHM Cc1cc(NC(=O)Nc2cccc(-c3nn[n-]n3)c2)ccc1OC(C)C ZINC000822208349 599551540 /nfs/dbraw/zinc/55/15/40/599551540.db2.gz OBRHLAAYFCEZSQ-UHFFFAOYSA-N -1 3 352.398 3.606 20 0 FHADHM CCC(C)(C)N(C)C(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736315951 599568944 /nfs/dbraw/zinc/56/89/44/599568944.db2.gz WAYUSZFITHSXPI-UHFFFAOYSA-N -1 3 364.453 3.871 20 0 FHADHM Clc1ccccc1N1CCC[C@@H](Nc2ccc(-c3nn[n-]n3)cc2)C1 ZINC000822585812 599579842 /nfs/dbraw/zinc/57/98/42/599579842.db2.gz NSQTXTSEYYXWKE-OAHLLOKOSA-N -1 3 354.845 3.601 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(NCc2coc(-c3ccccc3)n2)c1 ZINC000822568469 599585601 /nfs/dbraw/zinc/58/56/01/599585601.db2.gz RRQAZXUSFVIURX-UHFFFAOYSA-N -1 3 352.785 3.787 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(NCc2coc(-c3ccccc3)n2)c1 ZINC000822568469 599585603 /nfs/dbraw/zinc/58/56/03/599585603.db2.gz RRQAZXUSFVIURX-UHFFFAOYSA-N -1 3 352.785 3.787 20 0 FHADHM CC[C@H](C)[C@@H]1CCCCN1C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736333243 599608753 /nfs/dbraw/zinc/60/87/53/599608753.db2.gz URPAMKSQLPTWSK-NHYWBVRUSA-N -1 3 362.865 3.953 20 0 FHADHM CC[C@H](C)[C@@H]1CCCCN1C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736333243 599608755 /nfs/dbraw/zinc/60/87/55/599608755.db2.gz URPAMKSQLPTWSK-NHYWBVRUSA-N -1 3 362.865 3.953 20 0 FHADHM C[C@H](OC(=O)[C@@H](C)c1cccc(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820481322 599621211 /nfs/dbraw/zinc/62/12/11/599621211.db2.gz URTMIFSWAZGGFM-RYUDHWBXSA-N -1 3 356.813 3.928 20 0 FHADHM C[C@H](OC(=O)[C@@H](C)c1cccc(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820481322 599621212 /nfs/dbraw/zinc/62/12/12/599621212.db2.gz URTMIFSWAZGGFM-RYUDHWBXSA-N -1 3 356.813 3.928 20 0 FHADHM Cc1nc(C2CCCC2)sc1C(=O)OCc1ccccc1-c1nnn[n-]1 ZINC000822431620 599621583 /nfs/dbraw/zinc/62/15/83/599621583.db2.gz CIOBYCLEJOUJRB-UHFFFAOYSA-N -1 3 369.450 3.646 20 0 FHADHM Cc1nc(C2CCCC2)sc1C(=O)OCc1ccccc1-c1nn[n-]n1 ZINC000822431620 599621584 /nfs/dbraw/zinc/62/15/84/599621584.db2.gz CIOBYCLEJOUJRB-UHFFFAOYSA-N -1 3 369.450 3.646 20 0 FHADHM CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)C=CC3CC3)c2-c2nn[n-]n2)C1 ZINC000819908202 599629348 /nfs/dbraw/zinc/62/93/48/599629348.db2.gz XUOXVASGUNLFEU-OJIASSBASA-N -1 3 371.510 3.984 20 0 FHADHM CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)/C=C\C3CC3)c2-c2nn[n-]n2)C1 ZINC000819908202 599629349 /nfs/dbraw/zinc/62/93/49/599629349.db2.gz XUOXVASGUNLFEU-OJIASSBASA-N -1 3 371.510 3.984 20 0 FHADHM CCC(CC)(C(=O)Oc1ccc(-c2nnn[n-]2)cc1OC)c1ccccc1 ZINC000820882403 599629380 /nfs/dbraw/zinc/62/93/80/599629380.db2.gz QTJXLJSQKMXAOK-UHFFFAOYSA-N -1 3 366.421 3.539 20 0 FHADHM CCC(CC)(C(=O)Oc1ccc(-c2nn[n-]n2)cc1OC)c1ccccc1 ZINC000820882403 599629381 /nfs/dbraw/zinc/62/93/81/599629381.db2.gz QTJXLJSQKMXAOK-UHFFFAOYSA-N -1 3 366.421 3.539 20 0 FHADHM CC(C)[C@H](C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1)c1ccccc1 ZINC000820015147 599629482 /nfs/dbraw/zinc/62/94/82/599629482.db2.gz ATMMMTKMAFMDDZ-INIZCTEOSA-N -1 3 355.829 3.898 20 0 FHADHM CC(C)[C@H](C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1)c1ccccc1 ZINC000820015147 599629483 /nfs/dbraw/zinc/62/94/83/599629483.db2.gz ATMMMTKMAFMDDZ-INIZCTEOSA-N -1 3 355.829 3.898 20 0 FHADHM O=C(CCC(F)(F)F)Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1 ZINC000822950582 599630878 /nfs/dbraw/zinc/63/08/78/599630878.db2.gz UAGWOTBLMKBOFV-UHFFFAOYSA-N -1 3 367.356 3.876 20 0 FHADHM O=C(CCC(F)(F)F)Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1 ZINC000822950582 599630879 /nfs/dbraw/zinc/63/08/79/599630879.db2.gz UAGWOTBLMKBOFV-UHFFFAOYSA-N -1 3 367.356 3.876 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)c1ccsc1 ZINC000819865813 599633460 /nfs/dbraw/zinc/63/34/60/599633460.db2.gz IAYVVENLSCJBKU-MRVPVSSYSA-N -1 3 367.356 3.689 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)c1ccsc1 ZINC000819865813 599633461 /nfs/dbraw/zinc/63/34/61/599633461.db2.gz IAYVVENLSCJBKU-MRVPVSSYSA-N -1 3 367.356 3.689 20 0 FHADHM CCCn1ccc2ccc(NC(=O)C=Cc3ccccc3-c3nnn[n-]3)cc21 ZINC000821148956 599651821 /nfs/dbraw/zinc/65/18/21/599651821.db2.gz QSZJMZLKQMHYEZ-NTMALXAHSA-N -1 3 372.432 3.883 20 0 FHADHM CCCn1ccc2ccc(NC(=O)C=Cc3ccccc3-c3nn[n-]n3)cc21 ZINC000821148956 599651822 /nfs/dbraw/zinc/65/18/22/599651822.db2.gz QSZJMZLKQMHYEZ-NTMALXAHSA-N -1 3 372.432 3.883 20 0 FHADHM Cc1cncc(C(=O)OCc2ccc(-c3ccccc3-c3nnn[n-]3)cc2)c1 ZINC000822399951 599668616 /nfs/dbraw/zinc/66/86/16/599668616.db2.gz QMPYDFHNRBSTSH-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM Cc1cncc(C(=O)OCc2ccc(-c3ccccc3-c3nn[n-]n3)cc2)c1 ZINC000822399951 599668617 /nfs/dbraw/zinc/66/86/17/599668617.db2.gz QMPYDFHNRBSTSH-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM CC(C)C[C@@H]1CCCCCN1C(=O)NCc1cc(-c2nnn[n-]2)ccc1F ZINC000820062481 599678384 /nfs/dbraw/zinc/67/83/84/599678384.db2.gz MRKDRVPNSPGNON-INIZCTEOSA-N -1 3 374.464 3.506 20 0 FHADHM CC(C)C[C@@H]1CCCCCN1C(=O)NCc1cc(-c2nn[n-]n2)ccc1F ZINC000820062481 599678385 /nfs/dbraw/zinc/67/83/85/599678385.db2.gz MRKDRVPNSPGNON-INIZCTEOSA-N -1 3 374.464 3.506 20 0 FHADHM O=C(Nc1sccc1-c1nnn[n-]1)c1ccc2c(c1)-c1ccccc1C2 ZINC000823387146 599696259 /nfs/dbraw/zinc/69/62/59/599696259.db2.gz DHAKAFYYLYYPTC-UHFFFAOYSA-N -1 3 359.414 3.752 20 0 FHADHM O=C(Nc1sccc1-c1nn[n-]n1)c1ccc2c(c1)-c1ccccc1C2 ZINC000823387146 599696260 /nfs/dbraw/zinc/69/62/60/599696260.db2.gz DHAKAFYYLYYPTC-UHFFFAOYSA-N -1 3 359.414 3.752 20 0 FHADHM O=C([O-])Nc1ccc(C(=O)N[C@H](CN2CCCCC2)c2ccccc2)cc1 ZINC000738661988 599742296 /nfs/dbraw/zinc/74/22/96/599742296.db2.gz OHCXGYFHDBXMPQ-LJQANCHMSA-N -1 3 367.449 3.734 20 0 FHADHM CCc1cccc(C)c1NC(=O)NC1(c2cccc(-c3nnn[n-]3)c2)CC1 ZINC000825717459 607390610 /nfs/dbraw/zinc/39/06/10/607390610.db2.gz LZIDJUFNMGQAHE-UHFFFAOYSA-N -1 3 362.437 3.548 20 0 FHADHM CCc1cccc(C)c1NC(=O)NC1(c2cccc(-c3nn[n-]n3)c2)CC1 ZINC000825717459 607390612 /nfs/dbraw/zinc/39/06/12/607390612.db2.gz LZIDJUFNMGQAHE-UHFFFAOYSA-N -1 3 362.437 3.548 20 0 FHADHM CCc1cc2oc(=O)cc(CN[C@@H](C(=O)[O-])c3ccccc3)c2cc1Cl ZINC000737251217 599758556 /nfs/dbraw/zinc/75/85/56/599758556.db2.gz ARYPSUAZXJXNSU-LJQANCHMSA-N -1 3 371.820 3.924 20 0 FHADHM CCN(C(=O)c1ccc(C(C)C)nc1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821161103 607392229 /nfs/dbraw/zinc/39/22/29/607392229.db2.gz UVMFRZJKUVOALP-AWEZNQCLSA-N -1 3 364.453 3.608 20 0 FHADHM CCN(C(=O)c1ccc(C(C)C)nc1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821161103 607392230 /nfs/dbraw/zinc/39/22/30/607392230.db2.gz UVMFRZJKUVOALP-AWEZNQCLSA-N -1 3 364.453 3.608 20 0 FHADHM Cc1cscc1NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C(C)C ZINC000826320932 607396606 /nfs/dbraw/zinc/39/66/06/607396606.db2.gz KZBDYORTFMDGAC-UHFFFAOYSA-N -1 3 356.455 3.679 20 0 FHADHM Cc1cscc1NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C(C)C ZINC000826320932 607396608 /nfs/dbraw/zinc/39/66/08/607396608.db2.gz KZBDYORTFMDGAC-UHFFFAOYSA-N -1 3 356.455 3.679 20 0 FHADHM CC(C)Oc1ccc(NC(=O)CCCc2cccs2)cc1-c1nnn[n-]1 ZINC000820160460 607396915 /nfs/dbraw/zinc/39/69/15/607396915.db2.gz KUJGQFNSAHFBAD-UHFFFAOYSA-N -1 3 371.466 3.677 20 0 FHADHM CC(C)Oc1ccc(NC(=O)CCCc2cccs2)cc1-c1nn[n-]n1 ZINC000820160460 607396916 /nfs/dbraw/zinc/39/69/16/607396916.db2.gz KUJGQFNSAHFBAD-UHFFFAOYSA-N -1 3 371.466 3.677 20 0 FHADHM Cc1cc(C(=O)Nc2ccc(OC(C)C)c(-c3nnn[n-]3)c2)sc1C ZINC000822176591 607397937 /nfs/dbraw/zinc/39/79/37/607397937.db2.gz LZCBQMKMMKCXAS-UHFFFAOYSA-N -1 3 357.439 3.585 20 0 FHADHM Cc1cc(C(=O)Nc2ccc(OC(C)C)c(-c3nn[n-]n3)c2)sc1C ZINC000822176591 607397939 /nfs/dbraw/zinc/39/79/39/607397939.db2.gz LZCBQMKMMKCXAS-UHFFFAOYSA-N -1 3 357.439 3.585 20 0 FHADHM Cc1ccc(Br)c(NCc2ccc(-c3nnn[n-]3)s2)c1 ZINC000826281357 608452171 /nfs/dbraw/zinc/45/21/71/608452171.db2.gz OCHFRDXKSUQTEB-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM CC(C)Oc1ccc(NC(=O)C(C)(C)c2cccs2)cc1-c1nnn[n-]1 ZINC000820159831 607399382 /nfs/dbraw/zinc/39/93/82/607399382.db2.gz AGNCVCVBNHIZGE-UHFFFAOYSA-N -1 3 371.466 3.632 20 0 FHADHM CC(C)Oc1ccc(NC(=O)C(C)(C)c2cccs2)cc1-c1nn[n-]n1 ZINC000820159831 607399384 /nfs/dbraw/zinc/39/93/84/607399384.db2.gz AGNCVCVBNHIZGE-UHFFFAOYSA-N -1 3 371.466 3.632 20 0 FHADHM Cc1ccsc1CCCC(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000826316673 607400604 /nfs/dbraw/zinc/40/06/04/607400604.db2.gz VCSPXEZHJMEUER-ZDUSSCGKSA-N -1 3 356.451 3.864 20 0 FHADHM Cc1ccsc1CCCC(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000826316673 607400605 /nfs/dbraw/zinc/40/06/05/607400605.db2.gz VCSPXEZHJMEUER-ZDUSSCGKSA-N -1 3 356.451 3.864 20 0 FHADHM COc1ccc([C@@H](NCc2cc(Cl)cc3cccnc32)C(=O)[O-])cc1 ZINC000737974307 599862359 /nfs/dbraw/zinc/86/23/59/599862359.db2.gz UPHLGCUNNMIRDY-GOSISDBHSA-N -1 3 356.809 3.812 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Oc1ccc(-c2cscn2)cc1 ZINC000826252483 607402702 /nfs/dbraw/zinc/40/27/02/607402702.db2.gz DVORYBBXPHJYLV-UHFFFAOYSA-N -1 3 363.402 3.518 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Oc1ccc(-c2cscn2)cc1 ZINC000826252483 607402704 /nfs/dbraw/zinc/40/27/04/607402704.db2.gz DVORYBBXPHJYLV-UHFFFAOYSA-N -1 3 363.402 3.518 20 0 FHADHM Cc1ccc2c(c1)[C@H]1CN(C)CC[C@@H]1N2C(=O)c1cccc(NC(=O)[O-])c1 ZINC000738669818 599899248 /nfs/dbraw/zinc/89/92/48/599899248.db2.gz IUDKDHLHCFDKGK-MJGOQNOKSA-N -1 3 365.433 3.533 20 0 FHADHM Cc1cc(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)ccc1C(=O)[O-] ZINC000738443204 600018418 /nfs/dbraw/zinc/01/84/18/600018418.db2.gz VETWMALMKIYAJP-IBGZPJMESA-N -1 3 367.449 3.652 20 0 FHADHM CCSc1ccc(CC(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1 ZINC000825674015 607783272 /nfs/dbraw/zinc/78/32/72/607783272.db2.gz DWFJTJHSMKOODM-UHFFFAOYSA-N -1 3 373.869 3.813 20 0 FHADHM CCSc1ccc(CC(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1 ZINC000825674015 607783273 /nfs/dbraw/zinc/78/32/73/607783273.db2.gz DWFJTJHSMKOODM-UHFFFAOYSA-N -1 3 373.869 3.813 20 0 FHADHM CC(=O)N1CCCCC[C@@H]1C1CCN([C@@H](C)c2ccc(C(=O)[O-])o2)CC1 ZINC000736136197 600077054 /nfs/dbraw/zinc/07/70/54/600077054.db2.gz VFWSDBYUOXGBQO-WMLDXEAASA-N -1 3 362.470 3.542 20 0 FHADHM CC[C@@](NCc1csc(Br)c1)(C(=O)[O-])c1ccccc1 ZINC000736920156 600132938 /nfs/dbraw/zinc/13/29/38/600132938.db2.gz IMAQLNQFHRZLRB-HNNXBMFYSA-N -1 3 354.269 3.990 20 0 FHADHM CCN(C(=O)Nc1ccc(OC(C)C)c(-c2nnn[n-]2)c1)[C@H](C)C(C)C ZINC000821154519 607424788 /nfs/dbraw/zinc/42/47/88/607424788.db2.gz OFEJSARPABNXRG-CYBMUJFWSA-N -1 3 360.462 3.552 20 0 FHADHM CCN(C(=O)Nc1ccc(OC(C)C)c(-c2nn[n-]n2)c1)[C@H](C)C(C)C ZINC000821154519 607424790 /nfs/dbraw/zinc/42/47/90/607424790.db2.gz OFEJSARPABNXRG-CYBMUJFWSA-N -1 3 360.462 3.552 20 0 FHADHM C[C@H]1CCCC[C@@]1(CNC(=O)OC(C)(C)C)NCc1occc1C(=O)[O-] ZINC000736779604 600147103 /nfs/dbraw/zinc/14/71/03/600147103.db2.gz JCFZIDGOBFGILY-DJJJIMSYSA-N -1 3 366.458 3.541 20 0 FHADHM Cc1ccsc1CCCC(=O)Nc1sc(C)c(C)c1-c1nnn[n-]1 ZINC000826316014 607429020 /nfs/dbraw/zinc/42/90/20/607429020.db2.gz AVXSXGIWAYKRKE-UHFFFAOYSA-N -1 3 361.496 3.876 20 0 FHADHM Cc1ccsc1CCCC(=O)Nc1sc(C)c(C)c1-c1nn[n-]n1 ZINC000826316014 607429022 /nfs/dbraw/zinc/42/90/22/607429022.db2.gz AVXSXGIWAYKRKE-UHFFFAOYSA-N -1 3 361.496 3.876 20 0 FHADHM CN(C(=O)CCc1ccc(-c2ccccc2)o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825818254 607435274 /nfs/dbraw/zinc/43/52/74/607435274.db2.gz YWGSSASKZZKXJF-UHFFFAOYSA-N -1 3 373.416 3.722 20 0 FHADHM CN(C(=O)CCc1ccc(-c2ccccc2)o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825818254 607435275 /nfs/dbraw/zinc/43/52/75/607435275.db2.gz YWGSSASKZZKXJF-UHFFFAOYSA-N -1 3 373.416 3.722 20 0 FHADHM CCC[C@](C)(NCc1csc(-c2ccc(OC)cc2OC)n1)C(=O)[O-] ZINC000736963359 600324058 /nfs/dbraw/zinc/32/40/58/600324058.db2.gz XYAUBFQIKLNFQP-SFHVURJKSA-N -1 3 364.467 3.560 20 0 FHADHM O=C([O-])[C@H](NCc1ccc(OCC(F)(F)F)nc1)c1cccc(Cl)c1 ZINC000739501319 600424076 /nfs/dbraw/zinc/42/40/76/600424076.db2.gz WQEUZSQTWAJSJJ-CQSZACIVSA-N -1 3 374.746 3.592 20 0 FHADHM Cc1ccsc1[C@H]1C[C@H]1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000826316788 607444845 /nfs/dbraw/zinc/44/48/45/607444845.db2.gz YPLOPNPLMZQIRF-WDEREUQCSA-N -1 3 359.842 3.632 20 0 FHADHM Cc1ccsc1[C@H]1C[C@H]1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000826316788 607444847 /nfs/dbraw/zinc/44/48/47/607444847.db2.gz YPLOPNPLMZQIRF-WDEREUQCSA-N -1 3 359.842 3.632 20 0 FHADHM Cc1cc(Cl)c(NC(=O)c2sccc2-c2nn[n-]n2)cc1Cl ZINC000826267337 607791653 /nfs/dbraw/zinc/79/16/53/607791653.db2.gz AKDBFNAILBIZKB-UHFFFAOYSA-N -1 3 354.222 3.796 20 0 FHADHM Clc1ccc(Cl)c(OCCOc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000822573730 607453145 /nfs/dbraw/zinc/45/31/45/607453145.db2.gz GNCPSSLGZVOFIE-UHFFFAOYSA-N -1 3 351.193 3.631 20 0 FHADHM Cc1ccc([C@@H](CNC(=O)c2ccccc2NC(=O)[O-])N2CCCC2)cc1 ZINC000738569461 600575096 /nfs/dbraw/zinc/57/50/96/600575096.db2.gz FYRITHKQIZDINZ-LJQANCHMSA-N -1 3 367.449 3.652 20 0 FHADHM Cc1[nH]c(C(=O)[C@H](C)N2C[C@@H](c3ccccc3)C[C@@H]2C)c(C)c1C(=O)[O-] ZINC000738228851 600630592 /nfs/dbraw/zinc/63/05/92/600630592.db2.gz CTAODOCTELGCBW-NUTKFTJISA-N -1 3 354.450 3.779 20 0 FHADHM Cc1ccc(OCc2nc(CNC3CCC(C(=O)[O-])CC3)cs2)cc1 ZINC000738648688 600652502 /nfs/dbraw/zinc/65/25/02/600652502.db2.gz JBWMMTYDYSRHRP-UHFFFAOYSA-N -1 3 360.479 3.764 20 0 FHADHM CCCC[C@H](CCC)NC(=O)NC1(c2cccc(-c3nnn[n-]3)c2)CC1 ZINC000825258810 607458749 /nfs/dbraw/zinc/45/87/49/607458749.db2.gz DTNGFCDHSBJRHN-INIZCTEOSA-N -1 3 356.474 3.514 20 0 FHADHM CCCC[C@H](CCC)NC(=O)NC1(c2cccc(-c3nn[n-]n3)c2)CC1 ZINC000825258810 607458751 /nfs/dbraw/zinc/45/87/51/607458751.db2.gz DTNGFCDHSBJRHN-INIZCTEOSA-N -1 3 356.474 3.514 20 0 FHADHM O=C([O-])CCN(Cn1c2cc(Cl)ccc2oc1=S)C1CCOCC1 ZINC000833235738 600719907 /nfs/dbraw/zinc/71/99/07/600719907.db2.gz ASMQSWWGLKZXAM-UHFFFAOYSA-N -1 3 370.858 3.530 20 0 FHADHM O=C([O-])[C@@H](NC[C@@H]1Cc2ccccc2O1)c1ccc(Cl)cc1Cl ZINC000833165319 600737326 /nfs/dbraw/zinc/73/73/26/600737326.db2.gz BIEUDKJNNBFQPK-LRDDRELGSA-N -1 3 352.217 3.712 20 0 FHADHM CC(C)[C@@H](N[C@@H]1CCN(c2sccc2C(=O)[O-])C1=O)c1ccccc1 ZINC000826715728 600819103 /nfs/dbraw/zinc/81/91/03/600819103.db2.gz FYFCOKDGAPDVSD-HZPDHXFCSA-N -1 3 358.463 3.539 20 0 FHADHM CC(C)[C@H](N[C@H]1CCN(c2sccc2C(=O)[O-])C1=O)c1ccccc1 ZINC000826715723 600819195 /nfs/dbraw/zinc/81/91/95/600819195.db2.gz FYFCOKDGAPDVSD-HOTGVXAUSA-N -1 3 358.463 3.539 20 0 FHADHM CCCO[C@@H]1CCCN(CCOc2ccc(C(=O)[O-])cc2Cl)CC1 ZINC000565103770 600829104 /nfs/dbraw/zinc/82/91/04/600829104.db2.gz LARPBRLFCBSRFY-OAHLLOKOSA-N -1 3 355.862 3.698 20 0 FHADHM Cc1cc(CN(CCc2ccc(C)cc2)C[C@@H]2CCCO2)oc1C(=O)[O-] ZINC000576046354 600849174 /nfs/dbraw/zinc/84/91/74/600849174.db2.gz JXKNVDJUWYKAEC-SFHVURJKSA-N -1 3 357.450 3.818 20 0 FHADHM CCc1ccc(-c2nc(CN(CCC(=O)[O-])C3CCOCC3)cs2)cc1 ZINC000578192178 600859110 /nfs/dbraw/zinc/85/91/10/600859110.db2.gz GLNJVXZOEHJTFH-UHFFFAOYSA-N -1 3 374.506 3.828 20 0 FHADHM O=C([O-])[C@H](c1ccc(Cl)cc1Cl)N1CCC[C@H](c2cc[nH]n2)C1 ZINC000833171065 600990499 /nfs/dbraw/zinc/99/04/99/600990499.db2.gz LQWXIONZAJFLTP-BONVTDFDSA-N -1 3 354.237 3.722 20 0 FHADHM CCC[C@@H](NCc1ccc(-c2nn[n-]n2)cc1F)c1ccc(F)cc1F ZINC000821020625 607487592 /nfs/dbraw/zinc/48/75/92/607487592.db2.gz GCKNVZRYCOYQGA-QGZVFWFLSA-N -1 3 361.371 3.915 20 0 FHADHM C[C@](NCc1csc(Cc2ccc(Cl)cc2)n1)(C(=O)[O-])C1CC1 ZINC000827741331 601175564 /nfs/dbraw/zinc/17/55/64/601175564.db2.gz LSDKGSPGBAWKOV-QGZVFWFLSA-N -1 3 350.871 3.730 20 0 FHADHM CCC(CC)[N@@H+](Cc1nc(=O)c2c(C)c(C(=O)[O-])sc2[n-]1)CC(C)C ZINC000828863059 601181203 /nfs/dbraw/zinc/18/12/03/601181203.db2.gz URETVZFOJJVACI-UHFFFAOYSA-N -1 3 365.499 3.638 20 0 FHADHM CCC(CC)[N@H+](Cc1nc(=O)c2c(C)c(C(=O)[O-])sc2[n-]1)CC(C)C ZINC000828863059 601181205 /nfs/dbraw/zinc/18/12/05/601181205.db2.gz URETVZFOJJVACI-UHFFFAOYSA-N -1 3 365.499 3.638 20 0 FHADHM Cc1c(Cl)cccc1NC(=O)CN[C@H](c1ccccc1)[C@H](C)C(=O)[O-] ZINC000832854277 601202208 /nfs/dbraw/zinc/20/22/08/601202208.db2.gz CPDYUIVGXMQORR-UGSOOPFHSA-N -1 3 360.841 3.639 20 0 FHADHM C[C@@H](C(=O)[O-])[C@@H](NCC(=O)Nc1cccc2ccccc21)c1ccccc1 ZINC000826054320 601204108 /nfs/dbraw/zinc/20/41/08/601204108.db2.gz LZZURIAYOXHJRK-QVKFZJNVSA-N -1 3 362.429 3.830 20 0 FHADHM CCc1oc(C(=O)[O-])cc1CN1CCC(C(=O)Nc2ccc(F)cc2)CC1 ZINC000830362512 601415539 /nfs/dbraw/zinc/41/55/39/601415539.db2.gz AXXAPYOWIISUMJ-UHFFFAOYSA-N -1 3 374.412 3.530 20 0 FHADHM C[C@@H]1CN([C@H](C(=O)c2c[nH]c3ccccc23)c2ccccc2)C[C@H]1C(=O)[O-] ZINC000828410593 601533697 /nfs/dbraw/zinc/53/36/97/601533697.db2.gz BLLKXJCSFPKVLR-DJKXOVBDSA-N -1 3 362.429 3.744 20 0 FHADHM CN(C)C(=O)Sc1ccc(CN2CCc3ccccc3[C@H]2C(=O)[O-])cc1 ZINC000830563079 601548609 /nfs/dbraw/zinc/54/86/09/601548609.db2.gz DIDZFFPZZWXWQR-SFHVURJKSA-N -1 3 370.474 3.644 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CN(C)[C@@H](C)c1ccccc1Cl ZINC000826182060 607517010 /nfs/dbraw/zinc/51/70/10/607517010.db2.gz YKYAGULQBFFEHF-LBPRGKRZSA-N -1 3 357.845 3.722 20 0 FHADHM Cc1cc(C)c(NC(=O)CN[C@@H](c2ccccc2)[C@@H](C)C(=O)[O-])c(C)c1 ZINC000832875121 601654782 /nfs/dbraw/zinc/65/47/82/601654782.db2.gz UYFIJQNWLBMFHF-OXQOHEQNSA-N -1 3 354.450 3.602 20 0 FHADHM Cc1cc(Cl)ccc1NC(=O)CN[C@H](c1ccccc1)[C@H](C)C(=O)[O-] ZINC000832886455 601657156 /nfs/dbraw/zinc/65/71/56/601657156.db2.gz NXVBBKKKHSQVED-UGSOOPFHSA-N -1 3 360.841 3.639 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(Oc2ccccc2)cc1)N1CC[C@](C)(C(=O)[O-])C1 ZINC000263570365 601937439 /nfs/dbraw/zinc/93/74/39/601937439.db2.gz ICZZQKQQLCNUMN-BTYIYWSLSA-N -1 3 368.433 3.603 20 0 FHADHM CC(=O)Nc1ccc(CN[C@H](C(=O)[O-])c2cc(Cl)cc(Cl)c2)cc1 ZINC000825898413 601970354 /nfs/dbraw/zinc/97/03/54/601970354.db2.gz WKWVYDOQNYAXJZ-INIZCTEOSA-N -1 3 367.232 3.867 20 0 FHADHM C[C@H](CCC(=O)OCc1cc(-c2nnn[n-]2)ccc1F)c1ccccc1 ZINC000824400273 607539882 /nfs/dbraw/zinc/53/98/82/607539882.db2.gz DJNOOQVUDBKGJG-CYBMUJFWSA-N -1 3 354.385 3.633 20 0 FHADHM C[C@H](CCC(=O)OCc1cc(-c2nn[n-]n2)ccc1F)c1ccccc1 ZINC000824400273 607539883 /nfs/dbraw/zinc/53/98/83/607539883.db2.gz DJNOOQVUDBKGJG-CYBMUJFWSA-N -1 3 354.385 3.633 20 0 FHADHM Cn1cc([C@@H]2CCCN([C@H](C(=O)[O-])c3cc(Cl)cc(Cl)c3)C2)cn1 ZINC000833043908 602039165 /nfs/dbraw/zinc/03/91/65/602039165.db2.gz ZLDKMILUVKLZRP-BZNIZROVSA-N -1 3 368.264 3.732 20 0 FHADHM COc1cc(OC)cc([C@H](N[C@H](C)c2cccc(OC(C)C)c2)C(=O)[O-])c1 ZINC000832051753 602166697 /nfs/dbraw/zinc/16/66/97/602166697.db2.gz XOGDIZURMKJJKX-VLIAUNLRSA-N -1 3 373.449 3.968 20 0 FHADHM COc1cc(OC)cc([C@H](N[C@@H]2CCc3cc(Cl)ccc32)C(=O)[O-])c1 ZINC000832051523 602168108 /nfs/dbraw/zinc/16/81/08/602168108.db2.gz WETZLYMYMQRGDG-MSOLQXFVSA-N -1 3 361.825 3.760 20 0 FHADHM COc1cc(OC)cc([C@@H](N[C@@H](C)c2ccc(F)c(Cl)c2)C(=O)[O-])c1 ZINC000832049385 602168257 /nfs/dbraw/zinc/16/82/57/602168257.db2.gz HHKQQCIOOTUTJR-DYZYQPBXSA-N -1 3 367.804 3.973 20 0 FHADHM COc1cc(OC)cc([C@H](N[C@@H]2CCc3c2cccc3Cl)C(=O)[O-])c1 ZINC000832051225 602168506 /nfs/dbraw/zinc/16/85/06/602168506.db2.gz VFNRISLXAJMENB-MSOLQXFVSA-N -1 3 361.825 3.760 20 0 FHADHM CC[C@](C)(CC(=O)[O-])NCc1csc(-c2cccc(OC)c2OC)n1 ZINC000828671919 602219366 /nfs/dbraw/zinc/21/93/66/602219366.db2.gz IMWOYHJDTQGTRI-GOSISDBHSA-N -1 3 364.467 3.560 20 0 FHADHM C[C@@H](c1nnc(-c2ccc(Cl)c(Cl)c2)o1)N1CC[C@](C)(C(=O)[O-])C1 ZINC000827966796 602222860 /nfs/dbraw/zinc/22/28/60/602222860.db2.gz VHRZGDKSXIFCIQ-FVMDXXJSSA-N -1 3 370.236 3.901 20 0 FHADHM Cc1c([C@@H](C)NCc2cccc(C(=O)[O-])c2)cnn1-c1ccc(F)cc1 ZINC000832854374 602232719 /nfs/dbraw/zinc/23/27/19/602232719.db2.gz WSYPDISEKVFIBV-CYBMUJFWSA-N -1 3 353.397 3.869 20 0 FHADHM C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2ccc(NC(=O)[O-])cc2)C1 ZINC000739056254 602604021 /nfs/dbraw/zinc/60/40/21/602604021.db2.gz CWARDSDQRZZRJV-KBXCAEBGSA-N -1 3 368.437 3.734 20 0 FHADHM O=C([O-])N[C@H](CNCc1ccc(Br)s1)c1ccccc1 ZINC000832142143 603176437 /nfs/dbraw/zinc/17/64/37/603176437.db2.gz ZLQDGXLWYYDBIG-GFCCVEGCSA-N -1 3 355.257 3.609 20 0 FHADHM C[C@@H]1CN(Cc2c(-c3ccccc3)nc3sccn23)CC[C@@H]1NC(=O)[O-] ZINC000739185908 603186041 /nfs/dbraw/zinc/18/60/41/603186041.db2.gz RCRPZOAUIZQIMA-HIFRSBDPSA-N -1 3 370.478 3.541 20 0 FHADHM C[C@H](NCc1ccc(NC(=O)[O-])nc1)c1ccc(Br)cc1 ZINC000825502857 603529543 /nfs/dbraw/zinc/52/95/43/603529543.db2.gz LSIJZCUYTQTSIB-JTQLQIEISA-N -1 3 350.216 3.785 20 0 FHADHM C[C@H](NCc1ccc(NC(=O)[O-])nc1)c1cccc(Br)c1 ZINC000825503870 603535050 /nfs/dbraw/zinc/53/50/50/603535050.db2.gz YXPQDVXRAQWHPX-JTQLQIEISA-N -1 3 350.216 3.785 20 0 FHADHM CCN(C(=O)c1ccc(-c2nnn[n-]2)cc1C)[C@@H](C)c1ccc(F)cc1 ZINC000825380790 607666019 /nfs/dbraw/zinc/66/60/19/607666019.db2.gz TYFJWPORGVAFBJ-ZDUSSCGKSA-N -1 3 353.401 3.538 20 0 FHADHM CCN(C(=O)c1ccc(-c2nn[n-]n2)cc1C)[C@@H](C)c1ccc(F)cc1 ZINC000825380790 607666021 /nfs/dbraw/zinc/66/60/21/607666021.db2.gz TYFJWPORGVAFBJ-ZDUSSCGKSA-N -1 3 353.401 3.538 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N(Cc1ccco1)c1ccccc1 ZINC000826244078 607683012 /nfs/dbraw/zinc/68/30/12/607683012.db2.gz GGFMNXGDJNEQRP-UHFFFAOYSA-N -1 3 359.389 3.615 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N(Cc1ccco1)c1ccccc1 ZINC000826244078 607683014 /nfs/dbraw/zinc/68/30/14/607683014.db2.gz GGFMNXGDJNEQRP-UHFFFAOYSA-N -1 3 359.389 3.615 20 0 FHADHM O=C([O-])c1sc2ccccc2c1CN1CCC([C@@H](O)C(F)(F)F)CC1 ZINC000833347987 604370397 /nfs/dbraw/zinc/37/03/97/604370397.db2.gz YQPSRWUVZYQADJ-OAHLLOKOSA-N -1 3 373.396 3.735 20 0 FHADHM CC[C@@H](NC(=O)c1ccc(-c2nnn[n-]2)cc1C)c1ccc(Cl)s1 ZINC000825133791 607688795 /nfs/dbraw/zinc/68/87/95/607688795.db2.gz PVTCDCNUPUZRDV-GFCCVEGCSA-N -1 3 361.858 3.771 20 0 FHADHM CC[C@@H](NC(=O)c1ccc(-c2nn[n-]n2)cc1C)c1ccc(Cl)s1 ZINC000825133791 607688796 /nfs/dbraw/zinc/68/87/96/607688796.db2.gz PVTCDCNUPUZRDV-GFCCVEGCSA-N -1 3 361.858 3.771 20 0 FHADHM CC[C@@](NCc1ccc(OCC(F)(F)F)nc1)(C(=O)[O-])c1ccccc1 ZINC000828989132 604471926 /nfs/dbraw/zinc/47/19/26/604471926.db2.gz QLUMNGLYYNRWFJ-KRWDZBQOSA-N -1 3 368.355 3.502 20 0 FHADHM C[C@@H](Oc1ccc(CN2CCC[C@H]2c2ccc3c(c2)OCO3)cc1)C(=O)[O-] ZINC000833538492 604630771 /nfs/dbraw/zinc/63/07/71/604630771.db2.gz CVACENGMLAAPIE-KDOFPFPSSA-N -1 3 369.417 3.604 20 0 FHADHM C[C@@H](Oc1ccc(CN2CCS[C@@H](c3ccccc3)C2)cc1)C(=O)[O-] ZINC000833539720 604652972 /nfs/dbraw/zinc/65/29/72/604652972.db2.gz IAJKORYQJVHXNL-DNVCBOLYSA-N -1 3 357.475 3.829 20 0 FHADHM C[C@H](C(=O)[O-])[C@H](NC[C@@H]1CC(c2ccc(Cl)cc2)=NO1)c1ccccc1 ZINC000833406108 604717057 /nfs/dbraw/zinc/71/70/57/604717057.db2.gz ATGJZWWPDSNRJL-IXDGSTSKSA-N -1 3 372.852 3.885 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)CCOc1ccccc1C(C)C ZINC000826277648 607711650 /nfs/dbraw/zinc/71/16/50/607711650.db2.gz BMQNRCRRLWQEDC-UHFFFAOYSA-N -1 3 365.437 3.706 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)CCOc1ccccc1C(C)C ZINC000826277648 607711652 /nfs/dbraw/zinc/71/16/52/607711652.db2.gz BMQNRCRRLWQEDC-UHFFFAOYSA-N -1 3 365.437 3.706 20 0 FHADHM COc1ccccc1[C@@H](CN[C@H](C)c1cnc2ccsc2c1)NC(=O)[O-] ZINC000829600292 604760904 /nfs/dbraw/zinc/76/09/04/604760904.db2.gz ZBKJINDAJNESBW-MLGOLLRUSA-N -1 3 371.462 3.964 20 0 FHADHM C[C@H](c1ccccc1)N1CC[C@H](Nc2nc(Cl)c(C(=O)[O-])s2)C1 ZINC000833548501 604826071 /nfs/dbraw/zinc/82/60/71/604826071.db2.gz LDDLQNZJBVFFHH-PWSUYJOCSA-N -1 3 351.859 3.742 20 0 FHADHM CC(C)(C(=O)[O-])[C@@H]1CCCN(Cc2nc(-c3cccc(Cl)c3)no2)C1 ZINC000326876371 604934337 /nfs/dbraw/zinc/93/43/37/604934337.db2.gz YVWBPOSCIGTJLG-CYBMUJFWSA-N -1 3 363.845 3.713 20 0 FHADHM Cc1cccc(-c2nnc([C@H](C)N3CCC[C@H](C(C)(C)C(=O)[O-])C3)o2)c1 ZINC000833752261 604946402 /nfs/dbraw/zinc/94/64/02/604946402.db2.gz ORJOYXWUHCAZKR-HOCLYGCPSA-N -1 3 357.454 3.929 20 0 FHADHM O=C([O-])[C@H](NCc1ccc(OCc2cccc(F)c2)cc1)c1cccnc1 ZINC000833170560 604992527 /nfs/dbraw/zinc/99/25/27/604992527.db2.gz YIGUGAACWUKYBB-HXUWFJFHSA-N -1 3 366.392 3.715 20 0 FHADHM C[C@H](N[C@H](C(=O)[O-])c1cccnc1)c1cccc(OCc2ccccn2)c1 ZINC000827716818 604994605 /nfs/dbraw/zinc/99/46/05/604994605.db2.gz BCXJAXGURPPVMA-YWZLYKJASA-N -1 3 363.417 3.532 20 0 FHADHM CCc1oc(C(=O)[O-])cc1CN[C@@H](c1ccc2c(c1)OCCO2)C(C)C ZINC000833681125 605063646 /nfs/dbraw/zinc/06/36/46/605063646.db2.gz UBCFNVVAECHHAT-LJQANCHMSA-N -1 3 359.422 3.798 20 0 FHADHM CCc1oc(C(=O)[O-])cc1CN[C@@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000833680203 605079119 /nfs/dbraw/zinc/07/91/19/605079119.db2.gz DXEZWNUROVHVAI-LJQANCHMSA-N -1 3 357.406 3.552 20 0 FHADHM CC(C)N(Cc1ccc(C(=O)[O-])[nH]1)Cc1cccc(Br)c1 ZINC000833498290 605103576 /nfs/dbraw/zinc/10/35/76/605103576.db2.gz LTYDRTSNGMOJIC-UHFFFAOYSA-N -1 3 351.244 3.886 20 0 FHADHM C[C@H](NCc1ccc([C@H](C)NC(=O)[O-])cc1)c1ccc([S@@](C)=O)cc1 ZINC000825502877 605118719 /nfs/dbraw/zinc/11/87/19/605118719.db2.gz LZHVCDQXPKXBHO-KXTXEXGHSA-N -1 3 360.479 3.603 20 0 FHADHM CCc1cnccc1[C@@H](C)N[C@@H](C(=O)[O-])c1cccc(Br)c1 ZINC000833675452 605270782 /nfs/dbraw/zinc/27/07/82/605270782.db2.gz YRRBDXFLXBLWNW-BDJLRTHQSA-N -1 3 363.255 3.883 20 0 FHADHM CCc1cnccc1[C@@H](C)N[C@H](C(=O)[O-])c1cccc(Br)c1 ZINC000833675455 605271132 /nfs/dbraw/zinc/27/11/32/605271132.db2.gz YRRBDXFLXBLWNW-BZNIZROVSA-N -1 3 363.255 3.883 20 0 FHADHM Cc1oc(-c2ccsc2)nc1CN1C[C@@H]2CCC[C@@H](NC(=O)[O-])[C@@H]2C1 ZINC000833934610 605450187 /nfs/dbraw/zinc/45/01/87/605450187.db2.gz MLDPVTPIGSWWIC-NWANDNLSSA-N -1 3 361.467 3.580 20 0 FHADHM O=C([O-])N1CCC[C@@H]1[C@H]1CCCN(Cc2cnc(-c3ccccn3)s2)C1 ZINC000834104687 605472752 /nfs/dbraw/zinc/47/27/52/605472752.db2.gz FCJZDLQLLFSYML-WMLDXEAASA-N -1 3 372.494 3.560 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N[C@H]1CC[C@@H](C)c2ccccc21 ZINC000826277770 607762940 /nfs/dbraw/zinc/76/29/40/607762940.db2.gz GIRQOWVTECSPOX-PXAZEXFGSA-N -1 3 362.437 3.935 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N[C@H]1CC[C@@H](C)c2ccccc21 ZINC000826277770 607762941 /nfs/dbraw/zinc/76/29/41/607762941.db2.gz GIRQOWVTECSPOX-PXAZEXFGSA-N -1 3 362.437 3.935 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N[C@@H]1CC[C@@H](C)c2ccccc21 ZINC000826277772 607762996 /nfs/dbraw/zinc/76/29/96/607762996.db2.gz GIRQOWVTECSPOX-SJKOYZFVSA-N -1 3 362.437 3.935 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N[C@@H]1CC[C@@H](C)c2ccccc21 ZINC000826277772 607762997 /nfs/dbraw/zinc/76/29/97/607762997.db2.gz GIRQOWVTECSPOX-SJKOYZFVSA-N -1 3 362.437 3.935 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N[C@@H]1CC[C@H](C)c2ccccc21 ZINC000826277773 607763026 /nfs/dbraw/zinc/76/30/26/607763026.db2.gz GIRQOWVTECSPOX-YVEFUNNKSA-N -1 3 362.437 3.935 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N[C@@H]1CC[C@H](C)c2ccccc21 ZINC000826277773 607763027 /nfs/dbraw/zinc/76/30/27/607763027.db2.gz GIRQOWVTECSPOX-YVEFUNNKSA-N -1 3 362.437 3.935 20 0 FHADHM O=C([O-])N1CCC[C@H](CN[C@H](c2cc3ccccc3o2)c2cccnc2)C1 ZINC000834100005 605673089 /nfs/dbraw/zinc/67/30/89/605673089.db2.gz RAZNFQDCOKLTOC-QRWLVFNGSA-N -1 3 365.433 3.897 20 0 FHADHM O=C(C=Cc1ccccc1)Nc1nc(-c2cccc(-c3nnn[n-]3)c2)cs1 ZINC000826400719 607769985 /nfs/dbraw/zinc/76/99/85/607769985.db2.gz GJIAWEPFQDUTDF-MDZDMXLPSA-N -1 3 374.429 3.642 20 0 FHADHM O=C(C=Cc1ccccc1)Nc1nc(-c2cccc(-c3nn[n-]n3)c2)cs1 ZINC000826400719 607769986 /nfs/dbraw/zinc/76/99/86/607769986.db2.gz GJIAWEPFQDUTDF-MDZDMXLPSA-N -1 3 374.429 3.642 20 0 FHADHM C[C@@H]1CC[C@@H](NC(=O)C=Cc2ccccc2-c2nnn[n-]2)c2ccccc21 ZINC000824919519 607771892 /nfs/dbraw/zinc/77/18/92/607771892.db2.gz VZUBZYWCKWZDQM-QLZVHELBSA-N -1 3 359.433 3.635 20 0 FHADHM C[C@@H]1CC[C@@H](NC(=O)C=Cc2ccccc2-c2nn[n-]n2)c2ccccc21 ZINC000824919519 607771893 /nfs/dbraw/zinc/77/18/93/607771893.db2.gz VZUBZYWCKWZDQM-QLZVHELBSA-N -1 3 359.433 3.635 20 0 FHADHM C[C@@H]1CC[C@H](NC(=O)C=Cc2ccccc2-c2nnn[n-]2)c2ccccc21 ZINC000824919520 607772014 /nfs/dbraw/zinc/77/20/14/607772014.db2.gz VZUBZYWCKWZDQM-RNKZCZGJSA-N -1 3 359.433 3.635 20 0 FHADHM C[C@@H]1CC[C@H](NC(=O)C=Cc2ccccc2-c2nn[n-]n2)c2ccccc21 ZINC000824919520 607772015 /nfs/dbraw/zinc/77/20/15/607772015.db2.gz VZUBZYWCKWZDQM-RNKZCZGJSA-N -1 3 359.433 3.635 20 0 FHADHM O=C([O-])N[C@H]1C[C@H](NCc2ccc(-n3ccnc3)c(F)c2)c2ccccc21 ZINC000834159857 605795974 /nfs/dbraw/zinc/79/59/74/605795974.db2.gz YYOUVQWVCUUYRN-ROUUACIJSA-N -1 3 366.396 3.555 20 0 FHADHM O=C([O-])N1CCC([C@@H](NCc2cccc(O)c2)c2ccc(F)cc2)CC1 ZINC000834074240 605983174 /nfs/dbraw/zinc/98/31/74/605983174.db2.gz LHIVLOUPQRYFKZ-IBGZPJMESA-N -1 3 358.413 3.752 20 0 FHADHM O=C([O-])N1CCC[C@@H]1[C@@H]1CCC[C@@H]1NCc1coc(-c2cccs2)n1 ZINC000834107588 605989398 /nfs/dbraw/zinc/98/93/98/605989398.db2.gz MZROFIQBZSGTQL-QLFBSQMISA-N -1 3 361.467 3.804 20 0 FHADHM O=C([O-])N1CCC[C@@H]1[C@@H]1CCC[C@@H]1NCc1nc(C(F)(F)F)cs1 ZINC000834103366 605989883 /nfs/dbraw/zinc/98/98/83/605989883.db2.gz AOJVXBBYQAGZEK-OUAUKWLOSA-N -1 3 363.405 3.563 20 0 FHADHM CC[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)cc2)CC[C@@H]1c1ccccc1 ZINC000820989298 606030112 /nfs/dbraw/zinc/03/01/12/606030112.db2.gz QCMZNAHMQBALSL-BEFAXECRSA-N -1 3 361.449 3.523 20 0 FHADHM CC[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)cc2)CC[C@@H]1c1ccccc1 ZINC000820989298 606030119 /nfs/dbraw/zinc/03/01/19/606030119.db2.gz QCMZNAHMQBALSL-BEFAXECRSA-N -1 3 361.449 3.523 20 0 FHADHM C[C@@H](CCNc1ccc(-c2nnn[n-]2)cn1)c1cccc(C(F)(F)F)c1 ZINC000820242734 606038275 /nfs/dbraw/zinc/03/82/75/606038275.db2.gz QFORLLLPXFUBFP-NSHDSACASA-N -1 3 362.359 3.886 20 0 FHADHM C[C@@H](CCNc1ccc(-c2nn[n-]n2)cn1)c1cccc(C(F)(F)F)c1 ZINC000820242734 606038278 /nfs/dbraw/zinc/03/82/78/606038278.db2.gz QFORLLLPXFUBFP-NSHDSACASA-N -1 3 362.359 3.886 20 0 FHADHM COc1ccc(-c2ccc(CNc3ccc(-c4nnn[n-]4)nc3)s2)cc1 ZINC000821728560 606099826 /nfs/dbraw/zinc/09/98/26/606099826.db2.gz WOVBXGWLUYVKPS-UHFFFAOYSA-N -1 3 364.434 3.611 20 0 FHADHM COc1ccc(-c2ccc(CNc3ccc(-c4nn[n-]n4)nc3)s2)cc1 ZINC000821728560 606099828 /nfs/dbraw/zinc/09/98/28/606099828.db2.gz WOVBXGWLUYVKPS-UHFFFAOYSA-N -1 3 364.434 3.611 20 0 FHADHM C[C@@H](NC(=O)[C@H](C)c1ccc(Cl)s1)c1cccc(-c2nnn[n-]2)c1 ZINC000820314447 606117054 /nfs/dbraw/zinc/11/70/54/606117054.db2.gz IZYFNWSMWCFLEU-NXEZZACHSA-N -1 3 361.858 3.563 20 0 FHADHM C[C@@H](NC(=O)[C@H](C)c1ccc(Cl)s1)c1cccc(-c2nn[n-]n2)c1 ZINC000820314447 606117055 /nfs/dbraw/zinc/11/70/55/606117055.db2.gz IZYFNWSMWCFLEU-NXEZZACHSA-N -1 3 361.858 3.563 20 0 FHADHM CC[C@@H](Oc1ccccc1C)C(=O)Nc1sc(C)c(C)c1-c1nnn[n-]1 ZINC000820939520 606121681 /nfs/dbraw/zinc/12/16/81/606121681.db2.gz VWYSFASYLORPSF-CYBMUJFWSA-N -1 3 371.466 3.650 20 0 FHADHM CC[C@@H](Oc1ccccc1C)C(=O)Nc1sc(C)c(C)c1-c1nn[n-]n1 ZINC000820939520 606121682 /nfs/dbraw/zinc/12/16/82/606121682.db2.gz VWYSFASYLORPSF-CYBMUJFWSA-N -1 3 371.466 3.650 20 0 FHADHM CSc1ccc(NC(=O)CCc2ccc(-c3nnn[n-]3)cc2)cc1Cl ZINC000821984834 606150790 /nfs/dbraw/zinc/15/07/90/606150790.db2.gz UTLXIPDIPRBGCM-UHFFFAOYSA-N -1 3 373.869 3.813 20 0 FHADHM CSc1ccc(NC(=O)CCc2ccc(-c3nn[n-]n3)cc2)cc1Cl ZINC000821984834 606150791 /nfs/dbraw/zinc/15/07/91/606150791.db2.gz UTLXIPDIPRBGCM-UHFFFAOYSA-N -1 3 373.869 3.813 20 0 FHADHM C[C@H](NC(=O)c1c(Cl)cccc1Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000820384347 606153309 /nfs/dbraw/zinc/15/33/09/606153309.db2.gz CBFZMDQOQDZYHA-VIFPVBQESA-N -1 3 362.220 3.665 20 0 FHADHM C[C@H](NC(=O)c1c(Cl)cccc1Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000820384347 606153310 /nfs/dbraw/zinc/15/33/10/606153310.db2.gz CBFZMDQOQDZYHA-VIFPVBQESA-N -1 3 362.220 3.665 20 0 FHADHM O=C(C/C=C/c1ccc(F)cc1)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000822945356 606156287 /nfs/dbraw/zinc/15/62/87/606156287.db2.gz BUDZVAAMHFKWQH-OWOJBTEDSA-N -1 3 357.776 3.701 20 0 FHADHM O=C(C/C=C/c1ccc(F)cc1)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000822945356 606156288 /nfs/dbraw/zinc/15/62/88/606156288.db2.gz BUDZVAAMHFKWQH-OWOJBTEDSA-N -1 3 357.776 3.701 20 0 FHADHM O=C(c1ccc(-c2nnn[n-]2)cc1)N1CCCSc2ccc(Cl)cc21 ZINC000823477819 606193376 /nfs/dbraw/zinc/19/33/76/606193376.db2.gz CLRSNZIXJDZKTB-UHFFFAOYSA-N -1 3 371.853 3.663 20 0 FHADHM O=C(c1ccc(-c2nn[n-]n2)cc1)N1CCCSc2ccc(Cl)cc21 ZINC000823477819 606193377 /nfs/dbraw/zinc/19/33/77/606193377.db2.gz CLRSNZIXJDZKTB-UHFFFAOYSA-N -1 3 371.853 3.663 20 0 FHADHM CC(C)c1ccc(NC(=O)c2cc(-c3nnn[n-]3)cn2C)c(C(C)C)c1 ZINC000820192344 606224830 /nfs/dbraw/zinc/22/48/30/606224830.db2.gz KNOXKQROOHUTIG-UHFFFAOYSA-N -1 3 352.442 3.704 20 0 FHADHM CC(C)c1ccc(NC(=O)c2cc(-c3nn[n-]n3)cn2C)c(C(C)C)c1 ZINC000820192344 606224831 /nfs/dbraw/zinc/22/48/31/606224831.db2.gz KNOXKQROOHUTIG-UHFFFAOYSA-N -1 3 352.442 3.704 20 0 FHADHM c1cc2c(ncnc2Oc2ccc(Oc3ccc(-c4nnn[n-]4)cc3)cc2)[nH]1 ZINC000823821307 606242594 /nfs/dbraw/zinc/24/25/94/606242594.db2.gz SFJCCWOSHPDWBY-UHFFFAOYSA-N -1 3 371.360 3.723 20 0 FHADHM c1cc2c(ncnc2Oc2ccc(Oc3ccc(-c4nn[n-]n4)cc3)cc2)[nH]1 ZINC000823821307 606242596 /nfs/dbraw/zinc/24/25/96/606242596.db2.gz SFJCCWOSHPDWBY-UHFFFAOYSA-N -1 3 371.360 3.723 20 0 FHADHM O=C(Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)[C@H]1C[C@@H]1C1CC1 ZINC000823368302 606247969 /nfs/dbraw/zinc/24/79/69/606247969.db2.gz UBJYFTPLHMLQRS-MSOLQXFVSA-N -1 3 361.405 3.644 20 0 FHADHM O=C(Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)[C@H]1C[C@@H]1C1CC1 ZINC000823368302 606247970 /nfs/dbraw/zinc/24/79/70/606247970.db2.gz UBJYFTPLHMLQRS-MSOLQXFVSA-N -1 3 361.405 3.644 20 0 FHADHM CC(=CC(=O)Nc1ccc(F)cc1-c1nnn[n-]1)c1cccc(Cl)c1 ZINC000819765718 606262789 /nfs/dbraw/zinc/26/27/89/606262789.db2.gz QOVMVGAAWPOYLP-JXMROGBWSA-N -1 3 357.776 3.701 20 0 FHADHM CC(=CC(=O)Nc1ccc(F)cc1-c1nn[n-]n1)c1cccc(Cl)c1 ZINC000819765718 606262791 /nfs/dbraw/zinc/26/27/91/606262791.db2.gz QOVMVGAAWPOYLP-JXMROGBWSA-N -1 3 357.776 3.701 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@H]2C(=O)Nc2ccc(F)cc2-c2nnn[n-]2)cc1 ZINC000820192785 606266440 /nfs/dbraw/zinc/26/64/40/606266440.db2.gz ZIJVRGKEKBHWFR-HZPDHXFCSA-N -1 3 365.412 3.871 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@H]2C(=O)Nc2ccc(F)cc2-c2nn[n-]n2)cc1 ZINC000820192785 606266441 /nfs/dbraw/zinc/26/64/41/606266441.db2.gz ZIJVRGKEKBHWFR-HZPDHXFCSA-N -1 3 365.412 3.871 20 0 FHADHM CCc1cnc(COc2ccc(Oc3ccc(-c4nnn[n-]4)cc3)cc2)o1 ZINC000821499462 606306748 /nfs/dbraw/zinc/30/67/48/606306748.db2.gz KXBFFTSZBQBTDR-UHFFFAOYSA-N -1 3 363.377 3.788 20 0 FHADHM CCc1cnc(COc2ccc(Oc3ccc(-c4nn[n-]n4)cc3)cc2)o1 ZINC000821499462 606306750 /nfs/dbraw/zinc/30/67/50/606306750.db2.gz KXBFFTSZBQBTDR-UHFFFAOYSA-N -1 3 363.377 3.788 20 0 FHADHM C[C@H](Sc1cccc(-c2nnn[n-]2)c1)c1nc(-c2ccccc2)no1 ZINC000820557278 606325571 /nfs/dbraw/zinc/32/55/71/606325571.db2.gz XTXGDVVVYGBRIY-NSHDSACASA-N -1 3 350.407 3.770 20 0 FHADHM C[C@H](Sc1cccc(-c2nn[n-]n2)c1)c1nc(-c2ccccc2)no1 ZINC000820557278 606325573 /nfs/dbraw/zinc/32/55/73/606325573.db2.gz XTXGDVVVYGBRIY-NSHDSACASA-N -1 3 350.407 3.770 20 0 FHADHM CC[C@H](C)CN(CC)C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820870206 606327115 /nfs/dbraw/zinc/32/71/15/606327115.db2.gz OZQSVHQQBPPWBB-JTQLQIEISA-N -1 3 352.895 3.585 20 0 FHADHM CC[C@H](C)CN(CC)C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820870206 606327116 /nfs/dbraw/zinc/32/71/16/606327116.db2.gz OZQSVHQQBPPWBB-JTQLQIEISA-N -1 3 352.895 3.585 20 0 FHADHM Fc1ccc(-c2nc(CSc3cccc(-c4nnn[n-]4)c3)co2)cc1 ZINC000822753974 606328263 /nfs/dbraw/zinc/32/82/63/606328263.db2.gz UUVCBOIPAGNORL-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM Fc1ccc(-c2nc(CSc3cccc(-c4nn[n-]n4)c3)co2)cc1 ZINC000822753974 606328265 /nfs/dbraw/zinc/32/82/65/606328265.db2.gz UUVCBOIPAGNORL-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM O=C(Cc1coc2cc(F)ccc12)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000823118830 606336934 /nfs/dbraw/zinc/33/69/34/606336934.db2.gz RYZAQANGVXOYRT-UHFFFAOYSA-N -1 3 371.759 3.587 20 0 FHADHM O=C(Cc1coc2cc(F)ccc12)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000823118830 606336935 /nfs/dbraw/zinc/33/69/35/606336935.db2.gz RYZAQANGVXOYRT-UHFFFAOYSA-N -1 3 371.759 3.587 20 0 FHADHM Cc1ccccc1[C@H]1CCCN1C(=O)Nc1ccc(F)cc1-c1nnn[n-]1 ZINC000822352425 606347941 /nfs/dbraw/zinc/34/79/41/606347941.db2.gz ZGCPLXUFEUZZIV-QGZVFWFLSA-N -1 3 366.400 3.683 20 0 FHADHM Cc1ccccc1[C@H]1CCCN1C(=O)Nc1ccc(F)cc1-c1nn[n-]n1 ZINC000822352425 606347942 /nfs/dbraw/zinc/34/79/42/606347942.db2.gz ZGCPLXUFEUZZIV-QGZVFWFLSA-N -1 3 366.400 3.683 20 0 FHADHM Cc1ccc(OCCCC(=O)O[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000822262975 606350437 /nfs/dbraw/zinc/35/04/37/606350437.db2.gz HDNQMFWEPUYHMJ-OAHLLOKOSA-N -1 3 366.421 3.639 20 0 FHADHM Cc1ccc(OCCCC(=O)O[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000822262975 606350438 /nfs/dbraw/zinc/35/04/38/606350438.db2.gz HDNQMFWEPUYHMJ-OAHLLOKOSA-N -1 3 366.421 3.639 20 0 FHADHM Cc1ccc(OCCC(=O)O[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1C ZINC000822262884 606353446 /nfs/dbraw/zinc/35/34/46/606353446.db2.gz GAZNHSIMNMNZQR-HNNXBMFYSA-N -1 3 366.421 3.557 20 0 FHADHM Cc1ccc(OCCC(=O)O[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1C ZINC000822262884 606353448 /nfs/dbraw/zinc/35/34/48/606353448.db2.gz GAZNHSIMNMNZQR-HNNXBMFYSA-N -1 3 366.421 3.557 20 0 FHADHM C[C@H](OC(=O)c1cnc(C(C)(C)C)s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820519472 606356641 /nfs/dbraw/zinc/35/66/41/606356641.db2.gz VAZMNQPKEGCEQR-JTQLQIEISA-N -1 3 357.439 3.539 20 0 FHADHM C[C@H](OC(=O)c1cnc(C(C)(C)C)s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820519472 606356642 /nfs/dbraw/zinc/35/66/42/606356642.db2.gz VAZMNQPKEGCEQR-JTQLQIEISA-N -1 3 357.439 3.539 20 0 FHADHM Cc1nc(C(C)C)sc1C(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000822427638 606358611 /nfs/dbraw/zinc/35/86/11/606358611.db2.gz SFVHGPNJISRRQS-LLVKDONJSA-N -1 3 357.439 3.673 20 0 FHADHM Cc1nc(C(C)C)sc1C(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000822427638 606358612 /nfs/dbraw/zinc/35/86/12/606358612.db2.gz SFVHGPNJISRRQS-LLVKDONJSA-N -1 3 357.439 3.673 20 0 FHADHM CCN(C(=O)c1cc(C)c(F)cc1F)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821161003 606362915 /nfs/dbraw/zinc/36/29/15/606362915.db2.gz SUHGMFNSYIIHFD-GFCCVEGCSA-N -1 3 371.391 3.677 20 0 FHADHM CCN(C(=O)c1cc(C)c(F)cc1F)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821161003 606362916 /nfs/dbraw/zinc/36/29/16/606362916.db2.gz SUHGMFNSYIIHFD-GFCCVEGCSA-N -1 3 371.391 3.677 20 0 FHADHM CCCC[C@H](CCC)NC(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000821043658 606366160 /nfs/dbraw/zinc/36/61/60/606366160.db2.gz RPLUBTUINKFVBD-INIZCTEOSA-N -1 3 361.515 3.575 20 0 FHADHM CCCC[C@H](CCC)NC(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000821043658 606366163 /nfs/dbraw/zinc/36/61/63/606366163.db2.gz RPLUBTUINKFVBD-INIZCTEOSA-N -1 3 361.515 3.575 20 0 FHADHM CC(C)C[C@H](C)N(C)C(=O)CS[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820057354 606371209 /nfs/dbraw/zinc/37/12/09/606371209.db2.gz YXCUBIXFFYYJQL-KBPBESRZSA-N -1 3 361.515 3.554 20 0 FHADHM CC(C)C[C@H](C)N(C)C(=O)CS[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820057354 606371210 /nfs/dbraw/zinc/37/12/10/606371210.db2.gz YXCUBIXFFYYJQL-KBPBESRZSA-N -1 3 361.515 3.554 20 0 FHADHM CC[C@H]1CCc2ccccc2N1C(=O)CCc1ccc(-c2nnn[n-]2)cc1 ZINC000820989075 606373707 /nfs/dbraw/zinc/37/37/07/606373707.db2.gz LOMWRTKQSZKSNP-SFHVURJKSA-N -1 3 361.449 3.557 20 0 FHADHM CC[C@H]1CCc2ccccc2N1C(=O)CCc1ccc(-c2nn[n-]n2)cc1 ZINC000820989075 606373708 /nfs/dbraw/zinc/37/37/08/606373708.db2.gz LOMWRTKQSZKSNP-SFHVURJKSA-N -1 3 361.449 3.557 20 0 FHADHM CN(C(=O)[C@H]1CCCc2ccccc21)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821569640 606411850 /nfs/dbraw/zinc/41/18/50/606411850.db2.gz QMNDSUJOVCXGAI-HNNXBMFYSA-N -1 3 367.840 3.603 20 0 FHADHM CN(C(=O)[C@H]1CCCc2ccccc21)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821569640 606411851 /nfs/dbraw/zinc/41/18/51/606411851.db2.gz QMNDSUJOVCXGAI-HNNXBMFYSA-N -1 3 367.840 3.603 20 0 FHADHM CN(C(=O)CCCc1ccccc1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821569524 606413885 /nfs/dbraw/zinc/41/38/85/606413885.db2.gz NBVYFYNKRXACPX-UHFFFAOYSA-N -1 3 355.829 3.506 20 0 FHADHM CN(C(=O)CCCc1ccccc1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821569524 606413888 /nfs/dbraw/zinc/41/38/88/606413888.db2.gz NBVYFYNKRXACPX-UHFFFAOYSA-N -1 3 355.829 3.506 20 0 FHADHM C[C@@H](Nc1ncc(-c2nnn[n-]2)cc1Cl)c1c(F)cccc1Cl ZINC000820461365 606422235 /nfs/dbraw/zinc/42/22/35/606422235.db2.gz IOAPBJVZVDQCAS-SSDOTTSWSA-N -1 3 353.188 3.881 20 0 FHADHM C[C@@H](Nc1ncc(-c2nn[n-]n2)cc1Cl)c1c(F)cccc1Cl ZINC000820461365 606422237 /nfs/dbraw/zinc/42/22/37/606422237.db2.gz IOAPBJVZVDQCAS-SSDOTTSWSA-N -1 3 353.188 3.881 20 0 FHADHM Fc1cc(F)c(F)c(CNc2c(Cl)cccc2-c2nnn[n-]2)c1F ZINC000822753970 606431577 /nfs/dbraw/zinc/43/15/77/606431577.db2.gz UQZMJSOSFIDDNM-UHFFFAOYSA-N -1 3 357.698 3.689 20 0 FHADHM Fc1cc(F)c(F)c(CNc2c(Cl)cccc2-c2nn[n-]n2)c1F ZINC000822753970 606431579 /nfs/dbraw/zinc/43/15/79/606431579.db2.gz UQZMJSOSFIDDNM-UHFFFAOYSA-N -1 3 357.698 3.689 20 0 FHADHM c1ccc2c(c1)cccc2-c1nnc(Sc2ncccc2-c2nnn[n-]2)o1 ZINC000823809781 606433723 /nfs/dbraw/zinc/43/37/23/606433723.db2.gz QIIGBGXFWNHIBR-UHFFFAOYSA-N -1 3 373.401 3.616 20 0 FHADHM c1ccc2c(c1)cccc2-c1nnc(Sc2ncccc2-c2nn[n-]n2)o1 ZINC000823809781 606433725 /nfs/dbraw/zinc/43/37/25/606433725.db2.gz QIIGBGXFWNHIBR-UHFFFAOYSA-N -1 3 373.401 3.616 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)cc1CNc1ccccc1N1CCCCCC1 ZINC000822761409 606445070 /nfs/dbraw/zinc/44/50/70/606445070.db2.gz LRMMSVVFNMYAQT-UHFFFAOYSA-N -1 3 366.444 3.998 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CNc1ccccc1N1CCCCCC1 ZINC000822761409 606445071 /nfs/dbraw/zinc/44/50/71/606445071.db2.gz LRMMSVVFNMYAQT-UHFFFAOYSA-N -1 3 366.444 3.998 20 0 FHADHM c1ccc(OCCNc2ccccc2Oc2ncccc2-c2nnn[n-]2)cc1 ZINC000823792245 606447823 /nfs/dbraw/zinc/44/78/23/606447823.db2.gz QKWQROMQJYWSMR-UHFFFAOYSA-N -1 3 374.404 3.545 20 0 FHADHM Fc1ccc(NCc2cc(-c3nnn[n-]3)ccc2F)c(OCC2CC2)c1 ZINC000822783118 606463226 /nfs/dbraw/zinc/46/32/26/606463226.db2.gz VUBKEKHCGOKTIL-UHFFFAOYSA-N -1 3 357.364 3.546 20 0 FHADHM Fc1ccc(NCc2cc(-c3nn[n-]n3)ccc2F)c(OCC2CC2)c1 ZINC000822783118 606463227 /nfs/dbraw/zinc/46/32/27/606463227.db2.gz VUBKEKHCGOKTIL-UHFFFAOYSA-N -1 3 357.364 3.546 20 0 FHADHM C[C@@H](NC(=O)c1cc(-c2nnn[n-]2)cs1)c1ccc(Cl)cc1Cl ZINC000820391377 606479062 /nfs/dbraw/zinc/47/90/62/606479062.db2.gz OMOZVWKMDHLNCM-SSDOTTSWSA-N -1 3 368.249 3.726 20 0 FHADHM C[C@@H](NC(=O)c1cc(-c2nn[n-]n2)cs1)c1ccc(Cl)cc1Cl ZINC000820391377 606479064 /nfs/dbraw/zinc/47/90/64/606479064.db2.gz OMOZVWKMDHLNCM-SSDOTTSWSA-N -1 3 368.249 3.726 20 0 FHADHM CN(Cc1ccc(Cl)cc1Cl)C(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000821609979 606480113 /nfs/dbraw/zinc/48/01/13/606480113.db2.gz UOULCKOAGGCPGN-UHFFFAOYSA-N -1 3 368.249 3.507 20 0 FHADHM CN(Cc1ccc(Cl)cc1Cl)C(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000821609979 606480115 /nfs/dbraw/zinc/48/01/15/606480115.db2.gz UOULCKOAGGCPGN-UHFFFAOYSA-N -1 3 368.249 3.507 20 0 FHADHM O=C(Cc1cccc(-c2nnn[n-]2)c1)Nc1ccc(Oc2ccccc2)cc1 ZINC000823104160 606487846 /nfs/dbraw/zinc/48/78/46/606487846.db2.gz SQGPQNULCIGBFA-UHFFFAOYSA-N -1 3 371.400 3.840 20 0 FHADHM O=C(Cc1cccc(-c2nn[n-]n2)c1)Nc1ccc(Oc2ccccc2)cc1 ZINC000823104160 606487848 /nfs/dbraw/zinc/48/78/48/606487848.db2.gz SQGPQNULCIGBFA-UHFFFAOYSA-N -1 3 371.400 3.840 20 0 FHADHM CCCCN(C(=O)c1cc(-c2nnn[n-]2)cs1)[C@@H](C)c1ccccc1 ZINC000821061103 606492044 /nfs/dbraw/zinc/49/20/44/606492044.db2.gz MYJIFISGWHVEOK-ZDUSSCGKSA-N -1 3 355.467 3.932 20 0 FHADHM CCCCN(C(=O)c1cc(-c2nn[n-]n2)cs1)[C@@H](C)c1ccccc1 ZINC000821061103 606492045 /nfs/dbraw/zinc/49/20/45/606492045.db2.gz MYJIFISGWHVEOK-ZDUSSCGKSA-N -1 3 355.467 3.932 20 0 FHADHM CCC(CC)[C@@H](NC(=O)Cc1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000820892654 606509846 /nfs/dbraw/zinc/50/98/46/606509846.db2.gz DTTSUVMABCDEIU-HXUWFJFHSA-N -1 3 363.465 3.703 20 0 FHADHM CCC(CC)[C@@H](NC(=O)Cc1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000820892654 606509847 /nfs/dbraw/zinc/50/98/47/606509847.db2.gz DTTSUVMABCDEIU-HXUWFJFHSA-N -1 3 363.465 3.703 20 0 FHADHM Cc1ccc([C@@H]2CCC[C@@H]2N(C)C(=O)c2cc(-c3nnn[n-]3)cs2)cc1 ZINC000822232943 606520094 /nfs/dbraw/zinc/52/00/94/606520094.db2.gz FDQNKUKHWREQDW-HOTGVXAUSA-N -1 3 367.478 3.645 20 0 FHADHM Cc1ccc([C@@H]2CCC[C@@H]2N(C)C(=O)c2cc(-c3nn[n-]n3)cs2)cc1 ZINC000822232943 606520096 /nfs/dbraw/zinc/52/00/96/606520096.db2.gz FDQNKUKHWREQDW-HOTGVXAUSA-N -1 3 367.478 3.645 20 0 FHADHM CC[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000820938705 606538310 /nfs/dbraw/zinc/53/83/10/606538310.db2.gz MEPYFHPMBQOXIA-HOTGVXAUSA-N -1 3 367.478 3.727 20 0 FHADHM CC[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000820938705 606538313 /nfs/dbraw/zinc/53/83/13/606538313.db2.gz MEPYFHPMBQOXIA-HOTGVXAUSA-N -1 3 367.478 3.727 20 0 FHADHM CCCOc1ccc(Cl)cc1C(=O)Nc1cc(-c2nnn[n-]2)ccc1C ZINC000821134066 606539367 /nfs/dbraw/zinc/53/93/67/606539367.db2.gz MRPZOCMJUNIECS-UHFFFAOYSA-N -1 3 371.828 3.870 20 0 FHADHM CCCOc1ccc(Cl)cc1C(=O)Nc1cc(-c2nn[n-]n2)ccc1C ZINC000821134066 606539369 /nfs/dbraw/zinc/53/93/69/606539369.db2.gz MRPZOCMJUNIECS-UHFFFAOYSA-N -1 3 371.828 3.870 20 0 FHADHM C[C@H](NC(=O)Cc1cccc(-c2nnn[n-]2)c1)c1csc2ccccc21 ZINC000820335589 606553003 /nfs/dbraw/zinc/55/30/03/606553003.db2.gz ZZLRKZRVAHBACM-LBPRGKRZSA-N -1 3 363.446 3.501 20 0 FHADHM C[C@H](NC(=O)Cc1cccc(-c2nn[n-]n2)c1)c1csc2ccccc21 ZINC000820335589 606553005 /nfs/dbraw/zinc/55/30/05/606553005.db2.gz ZZLRKZRVAHBACM-LBPRGKRZSA-N -1 3 363.446 3.501 20 0 FHADHM C[C@H](N(C)C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)C1(C)CC1 ZINC000820308838 606577003 /nfs/dbraw/zinc/57/70/03/606577003.db2.gz ZGAAYZCCMZDNPY-VIFPVBQESA-N -1 3 368.363 3.538 20 0 FHADHM C[C@H](N(C)C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)C1(C)CC1 ZINC000820308838 606577005 /nfs/dbraw/zinc/57/70/05/606577005.db2.gz ZGAAYZCCMZDNPY-VIFPVBQESA-N -1 3 368.363 3.538 20 0 FHADHM CCC1(C(=O)Nc2ccc(Oc3ccccc3-c3nnn[n-]3)c(F)c2)CC1 ZINC000820944893 606579172 /nfs/dbraw/zinc/57/91/72/606579172.db2.gz PTMAOFKYWHJAPI-UHFFFAOYSA-N -1 3 367.384 3.927 20 0 FHADHM CCC1(C(=O)Nc2ccc(Oc3ccccc3-c3nn[n-]n3)c(F)c2)CC1 ZINC000820944893 606579173 /nfs/dbraw/zinc/57/91/73/606579173.db2.gz PTMAOFKYWHJAPI-UHFFFAOYSA-N -1 3 367.384 3.927 20 0 FHADHM Cc1cc(C)c(-c2nnn[n-]2)c(NC[C@@H]2CCC[C@@H](C(F)(F)F)C2)n1 ZINC000822192835 606594876 /nfs/dbraw/zinc/59/48/76/606594876.db2.gz CIYBQZUZTLLDLZ-VXGBXAGGSA-N -1 3 354.380 3.659 20 0 FHADHM Cc1cc(C)c(-c2nn[n-]n2)c(NC[C@@H]2CCC[C@@H](C(F)(F)F)C2)n1 ZINC000822192835 606594878 /nfs/dbraw/zinc/59/48/78/606594878.db2.gz CIYBQZUZTLLDLZ-VXGBXAGGSA-N -1 3 354.380 3.659 20 0 FHADHM C[C@H](C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccc2ccccc2c1 ZINC000819865376 606602087 /nfs/dbraw/zinc/60/20/87/606602087.db2.gz DLKXTLMUCNSTFZ-LBPRGKRZSA-N -1 3 361.380 3.901 20 0 FHADHM C[C@H](C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccc2ccccc2c1 ZINC000819865376 606602089 /nfs/dbraw/zinc/60/20/89/606602089.db2.gz DLKXTLMUCNSTFZ-LBPRGKRZSA-N -1 3 361.380 3.901 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)C/C=C\c2ccc(C)cc2)s1 ZINC000821465175 606622622 /nfs/dbraw/zinc/62/26/22/606622622.db2.gz CYUPLHOAEXVVSR-PLNGDYQASA-N -1 3 353.451 3.841 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)C/C=C\c2ccc(C)cc2)s1 ZINC000821465175 606622624 /nfs/dbraw/zinc/62/26/24/606622624.db2.gz CYUPLHOAEXVVSR-PLNGDYQASA-N -1 3 353.451 3.841 20 0 FHADHM Cc1cccnc1C(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)cc1 ZINC000822369106 606628425 /nfs/dbraw/zinc/62/84/25/606628425.db2.gz AZNVRCNZBVCXCU-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1cccnc1C(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)cc1 ZINC000822369106 606628428 /nfs/dbraw/zinc/62/84/28/606628428.db2.gz AZNVRCNZBVCXCU-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccccc1NC(=O)[C@@H](C)Sc1ccc(Cl)cc1-c1nnn[n-]1 ZINC000822361462 606628786 /nfs/dbraw/zinc/62/87/86/606628786.db2.gz BQMQOSFCDHPBJM-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM Cc1ccccc1NC(=O)[C@@H](C)Sc1ccc(Cl)cc1-c1nn[n-]n1 ZINC000822361462 606628787 /nfs/dbraw/zinc/62/87/87/606628787.db2.gz BQMQOSFCDHPBJM-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NCc1csc(C2CCCC2)n1 ZINC000821413153 606656359 /nfs/dbraw/zinc/65/63/59/606656359.db2.gz WRWYBRQEEGDECK-UHFFFAOYSA-N -1 3 370.482 3.992 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NCc1csc(C2CCCC2)n1 ZINC000821413153 606656360 /nfs/dbraw/zinc/65/63/60/606656360.db2.gz WRWYBRQEEGDECK-UHFFFAOYSA-N -1 3 370.482 3.992 20 0 FHADHM CC(C)c1ccc(CN(C)C(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)cc1 ZINC000820192767 606661915 /nfs/dbraw/zinc/66/19/15/606661915.db2.gz YREMPINDQHCSOY-UHFFFAOYSA-N -1 3 371.391 3.541 20 0 FHADHM CC(C)c1ccc(CN(C)C(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)cc1 ZINC000820192767 606661916 /nfs/dbraw/zinc/66/19/16/606661916.db2.gz YREMPINDQHCSOY-UHFFFAOYSA-N -1 3 371.391 3.541 20 0 FHADHM O=C(Nc1cccc2ccccc21)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000823368474 606663437 /nfs/dbraw/zinc/66/34/37/606663437.db2.gz XWJDAQIRZFAOMG-UHFFFAOYSA-N -1 3 351.316 3.550 20 0 FHADHM O=C(Nc1cccc2ccccc21)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000823368474 606663438 /nfs/dbraw/zinc/66/34/38/606663438.db2.gz XWJDAQIRZFAOMG-UHFFFAOYSA-N -1 3 351.316 3.550 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H]2C[C@@H]2Cc2ccccc2)c1-c1nnn[n-]1 ZINC000821465752 606676894 /nfs/dbraw/zinc/67/68/94/606676894.db2.gz NTFQBURRYHYBEZ-ZFWWWQNUSA-N -1 3 367.478 3.616 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H]2C[C@@H]2Cc2ccccc2)c1-c1nn[n-]n1 ZINC000821465752 606676895 /nfs/dbraw/zinc/67/68/95/606676895.db2.gz NTFQBURRYHYBEZ-ZFWWWQNUSA-N -1 3 367.478 3.616 20 0 FHADHM CC1(C)C[C@H](Nc2ncc(-c3nnn[n-]3)cc2Cl)c2ccccc2O1 ZINC000820590761 606725331 /nfs/dbraw/zinc/72/53/31/606725331.db2.gz ZIURZDZMJTYFKN-ZDUSSCGKSA-N -1 3 356.817 3.629 20 0 FHADHM CC1(C)C[C@H](Nc2ncc(-c3nn[n-]n3)cc2Cl)c2ccccc2O1 ZINC000820590761 606725332 /nfs/dbraw/zinc/72/53/32/606725332.db2.gz ZIURZDZMJTYFKN-ZDUSSCGKSA-N -1 3 356.817 3.629 20 0 FHADHM Cc1c(NC(=O)C=Cc2ccccc2-c2nnn[n-]2)cccc1C(F)(F)F ZINC000822068051 606739600 /nfs/dbraw/zinc/73/96/00/606739600.db2.gz PHAXMZXPSIOXPT-MDZDMXLPSA-N -1 3 373.338 3.846 20 0 FHADHM Cc1c(NC(=O)C=Cc2ccccc2-c2nn[n-]n2)cccc1C(F)(F)F ZINC000822068051 606739603 /nfs/dbraw/zinc/73/96/03/606739603.db2.gz PHAXMZXPSIOXPT-MDZDMXLPSA-N -1 3 373.338 3.846 20 0 FHADHM C[C@@H](OC(=O)c1c(F)cc(-c2nnn[n-]2)cc1F)c1cccc(Cl)c1 ZINC000820500680 606747666 /nfs/dbraw/zinc/74/76/66/606747666.db2.gz FYLQKWQCRSSDKE-MRVPVSSYSA-N -1 3 364.739 3.716 20 0 FHADHM C[C@@H](OC(=O)c1c(F)cc(-c2nn[n-]n2)cc1F)c1cccc(Cl)c1 ZINC000820500680 606747668 /nfs/dbraw/zinc/74/76/68/606747668.db2.gz FYLQKWQCRSSDKE-MRVPVSSYSA-N -1 3 364.739 3.716 20 0 FHADHM CCN(C(=O)c1ccc(Oc2ccc(-c3nnn[n-]3)cc2C)cc1)C1CC1 ZINC000821161107 606776051 /nfs/dbraw/zinc/77/60/51/606776051.db2.gz UYMVXGRBYVGNKN-UHFFFAOYSA-N -1 3 363.421 3.592 20 0 FHADHM CCN(C(=O)c1ccc(Oc2ccc(-c3nn[n-]n3)cc2C)cc1)C1CC1 ZINC000821161107 606776053 /nfs/dbraw/zinc/77/60/53/606776053.db2.gz UYMVXGRBYVGNKN-UHFFFAOYSA-N -1 3 363.421 3.592 20 0 FHADHM Cc1ccncc1COC(=O)c1ccccc1-c1ccccc1-c1nnn[n-]1 ZINC000822378905 606801775 /nfs/dbraw/zinc/80/17/75/606801775.db2.gz HFKOPGJNSNPPHE-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM Cc1ccncc1COC(=O)c1ccccc1-c1ccccc1-c1nn[n-]n1 ZINC000822378905 606801778 /nfs/dbraw/zinc/80/17/78/606801778.db2.gz HFKOPGJNSNPPHE-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM CC[C@@H]1CCC[C@H]1NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)CC(C)C ZINC000820972558 606811300 /nfs/dbraw/zinc/81/13/00/606811300.db2.gz PGATYSJYYIJFRP-SJLPKXTDSA-N -1 3 370.501 3.613 20 0 FHADHM CC[C@@H]1CCC[C@H]1NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)CC(C)C ZINC000820972558 606811302 /nfs/dbraw/zinc/81/13/02/606811302.db2.gz PGATYSJYYIJFRP-SJLPKXTDSA-N -1 3 370.501 3.613 20 0 FHADHM C[C@@H](SCc1ccccc1-c1nnn[n-]1)c1nc(-c2ccccc2)no1 ZINC000820548513 606827675 /nfs/dbraw/zinc/82/76/75/606827675.db2.gz BBHVAPSHCAXHSN-GFCCVEGCSA-N -1 3 364.434 3.911 20 0 FHADHM C[C@@H](SCc1ccccc1-c1nn[n-]n1)c1nc(-c2ccccc2)no1 ZINC000820548513 606827676 /nfs/dbraw/zinc/82/76/76/606827676.db2.gz BBHVAPSHCAXHSN-GFCCVEGCSA-N -1 3 364.434 3.911 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)C(F)=C1CCCC1 ZINC000820087034 606833828 /nfs/dbraw/zinc/83/38/28/606833828.db2.gz JUHVIQMCOSTMQP-UHFFFAOYSA-N -1 3 357.433 3.649 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)C(F)=C1CCCC1 ZINC000820087034 606833830 /nfs/dbraw/zinc/83/38/30/606833830.db2.gz JUHVIQMCOSTMQP-UHFFFAOYSA-N -1 3 357.433 3.649 20 0 FHADHM CCC(C)(C)NC(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000820847601 606834301 /nfs/dbraw/zinc/83/43/01/606834301.db2.gz HMPBUJDEINLHFI-UHFFFAOYSA-N -1 3 370.482 3.583 20 0 FHADHM COC(=O)c1ccc([C@@H](C)Sc2ccc(-c3nnn[n-]3)cc2Cl)o1 ZINC000821668643 606853704 /nfs/dbraw/zinc/85/37/04/606853704.db2.gz BVYWJLNMJSJHEW-MRVPVSSYSA-N -1 3 364.814 3.753 20 0 FHADHM COC(=O)c1ccc([C@@H](C)Sc2ccc(-c3nn[n-]n3)cc2Cl)o1 ZINC000821668643 606853705 /nfs/dbraw/zinc/85/37/05/606853705.db2.gz BVYWJLNMJSJHEW-MRVPVSSYSA-N -1 3 364.814 3.753 20 0 FHADHM C[C@@H]1c2cc(Cl)cc(Cl)c2CCN1c1ncccc1-c1nnn[n-]1 ZINC000820819740 606858026 /nfs/dbraw/zinc/85/80/26/606858026.db2.gz KGYVLFYIXSJDFX-SECBINFHSA-N -1 3 361.236 3.692 20 0 FHADHM C[C@@H]1c2cc(Cl)cc(Cl)c2CCN1c1ncccc1-c1nn[n-]n1 ZINC000820819740 606858027 /nfs/dbraw/zinc/85/80/27/606858027.db2.gz KGYVLFYIXSJDFX-SECBINFHSA-N -1 3 361.236 3.692 20 0 FHADHM CN(C[C@H](O)c1ccc(-c2nnn[n-]2)cc1)c1ccc(-c2ccccc2)cc1 ZINC000821594899 606905588 /nfs/dbraw/zinc/90/55/88/606905588.db2.gz GBAFMPYUUDFHIY-NRFANRHFSA-N -1 3 371.444 3.704 20 0 FHADHM CN(C[C@H](O)c1ccc(-c2nn[n-]n2)cc1)c1ccc(-c2ccccc2)cc1 ZINC000821594899 606905589 /nfs/dbraw/zinc/90/55/89/606905589.db2.gz GBAFMPYUUDFHIY-NRFANRHFSA-N -1 3 371.444 3.704 20 0 FHADHM Fc1ccc(CNc2ccccc2N2CCCCC2)cc1-c1nnn[n-]1 ZINC000822771643 606926385 /nfs/dbraw/zinc/92/63/85/606926385.db2.gz ISJYDPWKUFUADV-UHFFFAOYSA-N -1 3 352.417 3.608 20 0 FHADHM Fc1ccc(CNc2ccccc2N2CCCCC2)cc1-c1nn[n-]n1 ZINC000822771643 606926387 /nfs/dbraw/zinc/92/63/87/606926387.db2.gz ISJYDPWKUFUADV-UHFFFAOYSA-N -1 3 352.417 3.608 20 0 FHADHM c1cc(Sc2ncnc3sc4c(c32)CCC4)cc(-c2nnn[n-]2)c1 ZINC000823767190 606945647 /nfs/dbraw/zinc/94/56/47/606945647.db2.gz PDZVOHJIMNFHKY-UHFFFAOYSA-N -1 3 352.448 3.511 20 0 FHADHM c1cc(Sc2ncnc3sc4c(c32)CCC4)cc(-c2nn[n-]n2)c1 ZINC000823767190 606945648 /nfs/dbraw/zinc/94/56/48/606945648.db2.gz PDZVOHJIMNFHKY-UHFFFAOYSA-N -1 3 352.448 3.511 20 0 FHADHM Cc1cc(Cl)cc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCC3)c1 ZINC000822201923 606955230 /nfs/dbraw/zinc/95/52/30/606955230.db2.gz BSXXFOKLJBPAQZ-UHFFFAOYSA-N -1 3 359.842 3.631 20 0 FHADHM Cc1cc(Cl)cc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCC3)c1 ZINC000822201923 606955233 /nfs/dbraw/zinc/95/52/33/606955233.db2.gz BSXXFOKLJBPAQZ-UHFFFAOYSA-N -1 3 359.842 3.631 20 0 FHADHM CN(C(=O)c1cc2cc(F)ccc2o1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821573463 606963034 /nfs/dbraw/zinc/96/30/34/606963034.db2.gz QXELVSQAUYGBHM-UHFFFAOYSA-N -1 3 371.759 3.682 20 0 FHADHM CN(C(=O)c1cc2cc(F)ccc2o1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821573463 606963036 /nfs/dbraw/zinc/96/30/36/606963036.db2.gz QXELVSQAUYGBHM-UHFFFAOYSA-N -1 3 371.759 3.682 20 0 FHADHM CCc1ccc([C@H](C)C(=O)N(C)c2cc(Cl)ccc2-c2nnn[n-]2)cc1 ZINC000821476935 606963980 /nfs/dbraw/zinc/96/39/80/606963980.db2.gz VIAIUGXSGKWEID-LBPRGKRZSA-N -1 3 369.856 3.849 20 0 FHADHM CCc1ccc([C@H](C)C(=O)N(C)c2cc(Cl)ccc2-c2nn[n-]n2)cc1 ZINC000821476935 606963983 /nfs/dbraw/zinc/96/39/83/606963983.db2.gz VIAIUGXSGKWEID-LBPRGKRZSA-N -1 3 369.856 3.849 20 0 FHADHM CN(C(=O)Cc1ccc(-c2ccccc2)cc1)c1ccccc1-c1nnn[n-]1 ZINC000821570806 606971161 /nfs/dbraw/zinc/97/11/61/606971161.db2.gz MABOODFEERPQJM-UHFFFAOYSA-N -1 3 369.428 3.739 20 0 FHADHM CN(C(=O)Cc1ccc(-c2ccccc2)cc1)c1ccccc1-c1nn[n-]n1 ZINC000821570806 606971163 /nfs/dbraw/zinc/97/11/63/606971163.db2.gz MABOODFEERPQJM-UHFFFAOYSA-N -1 3 369.428 3.739 20 0 FHADHM O=C(OCc1ccc(F)c(-c2nnn[n-]2)c1)[C@H]1C[C@H]1c1cccc(Cl)c1 ZINC000823422397 606997943 /nfs/dbraw/zinc/99/79/43/606997943.db2.gz UAIFBXCJZCSOGR-KBPBESRZSA-N -1 3 372.787 3.506 20 0 FHADHM O=C(OCc1ccc(F)c(-c2nn[n-]n2)c1)[C@H]1C[C@H]1c1cccc(Cl)c1 ZINC000823422397 606997944 /nfs/dbraw/zinc/99/79/44/606997944.db2.gz UAIFBXCJZCSOGR-KBPBESRZSA-N -1 3 372.787 3.506 20 0 FHADHM Cc1nc2ccccc2c(SCc2ccc(F)c(-c3nnn[n-]3)c2)n1 ZINC000822453197 607005758 /nfs/dbraw/zinc/00/57/58/607005758.db2.gz DZYBRXGFMNFIKZ-UHFFFAOYSA-N -1 3 352.398 3.550 20 0 FHADHM Cc1nc2ccccc2c(SCc2ccc(F)c(-c3nn[n-]n3)c2)n1 ZINC000822453197 607005760 /nfs/dbraw/zinc/00/57/60/607005760.db2.gz DZYBRXGFMNFIKZ-UHFFFAOYSA-N -1 3 352.398 3.550 20 0 FHADHM CSc1ccccc1NC(=O)[C@@H](C)Sc1cccc(-c2nnn[n-]2)c1 ZINC000821983047 607016797 /nfs/dbraw/zinc/01/67/97/607016797.db2.gz CXKBBXYUMZRDTG-LLVKDONJSA-N -1 3 371.491 3.708 20 0 FHADHM CSc1ccccc1NC(=O)[C@@H](C)Sc1cccc(-c2nn[n-]n2)c1 ZINC000821983047 607016799 /nfs/dbraw/zinc/01/67/99/607016799.db2.gz CXKBBXYUMZRDTG-LLVKDONJSA-N -1 3 371.491 3.708 20 0 FHADHM CC(=O)c1ccccc1OCCSCc1cc(F)ccc1-c1nnn[n-]1 ZINC000819845233 607032392 /nfs/dbraw/zinc/03/23/92/607032392.db2.gz RWIGUCZUBKZQOT-UHFFFAOYSA-N -1 3 372.425 3.521 20 0 FHADHM CC(=O)c1ccccc1OCCSCc1cc(F)ccc1-c1nn[n-]n1 ZINC000819845233 607032393 /nfs/dbraw/zinc/03/23/93/607032393.db2.gz RWIGUCZUBKZQOT-UHFFFAOYSA-N -1 3 372.425 3.521 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)c(CSc2nccn2Cc2ccccc2)c1 ZINC000822758743 607038628 /nfs/dbraw/zinc/03/86/28/607038628.db2.gz XKWZLOAJASRYFM-UHFFFAOYSA-N -1 3 366.425 3.543 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)c(CSc2nccn2Cc2ccccc2)c1 ZINC000822758743 607038630 /nfs/dbraw/zinc/03/86/30/607038630.db2.gz XKWZLOAJASRYFM-UHFFFAOYSA-N -1 3 366.425 3.543 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NC(=O)CC/C=C/c1ccccc1 ZINC000821294015 607100658 /nfs/dbraw/zinc/10/06/58/607100658.db2.gz PJCNBQVEAPBSHJ-UXBLZVDNSA-N -1 3 362.437 3.731 20 0 FHADHM CC(C)c1nn(-c2ccccc2)cc1CNc1ccc(-c2nn[n-]n2)cc1 ZINC000820206554 607117219 /nfs/dbraw/zinc/11/72/19/607117219.db2.gz PZFAOXGYXAFNBP-UHFFFAOYSA-N -1 3 359.437 3.788 20 0 FHADHM COc1cccc2c1CC[C@@H]2Nc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000821877733 607119349 /nfs/dbraw/zinc/11/93/49/607119349.db2.gz SCFNEBFRVHQPQP-KRWDZBQOSA-N -1 3 358.405 3.523 20 0 FHADHM COc1cccc2c1CC[C@@H]2Nc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000821877733 607119350 /nfs/dbraw/zinc/11/93/50/607119350.db2.gz SCFNEBFRVHQPQP-KRWDZBQOSA-N -1 3 358.405 3.523 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NCc1cnc(-c2ccccc2)s1 ZINC000821765964 607125633 /nfs/dbraw/zinc/12/56/33/607125633.db2.gz OMJFRRMZZUTCJY-UHFFFAOYSA-N -1 3 364.434 3.611 20 0 FHADHM FC(F)(F)c1cc(-c2nn[n-]n2)ccc1N[C@@H]1CCOC2(CCCC2)C1 ZINC000822719011 607129915 /nfs/dbraw/zinc/12/99/15/607129915.db2.gz XPMXJVYKLDIQDF-GFCCVEGCSA-N -1 3 367.375 3.789 20 0 FHADHM Cc1ccc(CSc2nc(C)cc(C(F)(F)F)c2-c2nnn[n-]2)cn1 ZINC000822239956 607142477 /nfs/dbraw/zinc/14/24/77/607142477.db2.gz MJDKKIYTQLFXOH-UHFFFAOYSA-N -1 3 366.372 3.585 20 0 FHADHM CC(C)CC[C@H]1CCCN1C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820072267 607152903 /nfs/dbraw/zinc/15/29/03/607152903.db2.gz DDXKOSLTOIPXDV-RHSMWYFYSA-N -1 3 356.474 3.538 20 0 FHADHM CC(C)CC[C@H]1CCCN1C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820072267 607152904 /nfs/dbraw/zinc/15/29/04/607152904.db2.gz DDXKOSLTOIPXDV-RHSMWYFYSA-N -1 3 356.474 3.538 20 0 FHADHM Cc1cc(NC(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)sn1 ZINC000822209414 607158546 /nfs/dbraw/zinc/15/85/46/607158546.db2.gz HWKFWJJLAMEFGL-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1cc(NC(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)sn1 ZINC000822209414 607158548 /nfs/dbraw/zinc/15/85/48/607158548.db2.gz HWKFWJJLAMEFGL-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM CCCCC[C@@H]1CCCN1C(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000821050612 607165050 /nfs/dbraw/zinc/16/50/50/607165050.db2.gz SJPNMLLSNMNBKS-OAHLLOKOSA-N -1 3 359.499 3.530 20 0 FHADHM CCCCC[C@@H]1CCCN1C(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000821050612 607165052 /nfs/dbraw/zinc/16/50/52/607165052.db2.gz SJPNMLLSNMNBKS-OAHLLOKOSA-N -1 3 359.499 3.530 20 0 FHADHM CC(=O)c1c(C)cc(C)c(COc2ccc(-c3nnn[n-]3)cc2F)c1C ZINC000819835326 607170169 /nfs/dbraw/zinc/17/01/69/607170169.db2.gz VWWWWXBBHGBYCW-UHFFFAOYSA-N -1 3 354.385 3.713 20 0 FHADHM CC(=O)c1c(C)cc(C)c(COc2ccc(-c3nn[n-]n3)cc2F)c1C ZINC000819835326 607170170 /nfs/dbraw/zinc/17/01/70/607170170.db2.gz VWWWWXBBHGBYCW-UHFFFAOYSA-N -1 3 354.385 3.713 20 0 FHADHM CC(C)c1ccc(OCC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000820192516 607188816 /nfs/dbraw/zinc/18/88/16/607188816.db2.gz RCXCLWRKUMDBRL-UHFFFAOYSA-N -1 3 371.828 3.661 20 0 FHADHM CC(C)c1ccc(OCC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000820192516 607188817 /nfs/dbraw/zinc/18/88/17/607188817.db2.gz RCXCLWRKUMDBRL-UHFFFAOYSA-N -1 3 371.828 3.661 20 0 FHADHM CC(C)C[C@H]1CCCN(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)C1 ZINC000820068592 607195488 /nfs/dbraw/zinc/19/54/88/607195488.db2.gz SUCYSIGXNRNWQN-GFCCVEGCSA-N -1 3 362.865 3.810 20 0 FHADHM CC(C)C[C@H]1CCCN(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)C1 ZINC000820068592 607195489 /nfs/dbraw/zinc/19/54/89/607195489.db2.gz SUCYSIGXNRNWQN-GFCCVEGCSA-N -1 3 362.865 3.810 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N1CCC[C@H]1c1ccccc1 ZINC000823313781 607200397 /nfs/dbraw/zinc/20/03/97/607200397.db2.gz IRYWSQNIIMUZPM-INIZCTEOSA-N -1 3 368.828 3.889 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N1CCC[C@H]1c1ccccc1 ZINC000823313781 607200398 /nfs/dbraw/zinc/20/03/98/607200398.db2.gz IRYWSQNIIMUZPM-INIZCTEOSA-N -1 3 368.828 3.889 20 0 FHADHM C[C@H]1c2ccccc2CCN1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820827890 607200922 /nfs/dbraw/zinc/20/09/22/607200922.db2.gz YNRCNFJRLUGZKJ-NSHDSACASA-N -1 3 368.828 3.671 20 0 FHADHM C[C@H]1c2ccccc2CCN1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820827890 607200923 /nfs/dbraw/zinc/20/09/23/607200923.db2.gz YNRCNFJRLUGZKJ-NSHDSACASA-N -1 3 368.828 3.671 20 0 FHADHM Cc1ccc([C@H](C)CNC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000822228872 607200925 /nfs/dbraw/zinc/20/09/25/607200925.db2.gz HPHKKCYAGXPRDI-GFCCVEGCSA-N -1 3 370.844 3.754 20 0 FHADHM Cc1ccc([C@H](C)CNC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000822228872 607200926 /nfs/dbraw/zinc/20/09/26/607200926.db2.gz HPHKKCYAGXPRDI-GFCCVEGCSA-N -1 3 370.844 3.754 20 0 FHADHM CC(C)(NC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccccc1 ZINC000819987590 607203047 /nfs/dbraw/zinc/20/30/47/607203047.db2.gz ASEBFGQARWXRSX-UHFFFAOYSA-N -1 3 356.817 3.577 20 0 FHADHM CC(C)(NC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccccc1 ZINC000819987590 607203048 /nfs/dbraw/zinc/20/30/48/607203048.db2.gz ASEBFGQARWXRSX-UHFFFAOYSA-N -1 3 356.817 3.577 20 0 FHADHM CCN(C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)[C@@H](C)c1cccnc1 ZINC000821155318 607204228 /nfs/dbraw/zinc/20/42/28/607204228.db2.gz YBKSRUKWQBGBNB-NSHDSACASA-N -1 3 371.832 3.530 20 0 FHADHM CCN(C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)[C@@H](C)c1cccnc1 ZINC000821155318 607204229 /nfs/dbraw/zinc/20/42/29/607204229.db2.gz YBKSRUKWQBGBNB-NSHDSACASA-N -1 3 371.832 3.530 20 0 FHADHM CCCCc1ccc(NC(=O)c2ncc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000821077606 607231170 /nfs/dbraw/zinc/23/11/70/607231170.db2.gz NEBABCUAVAOCSI-UHFFFAOYSA-N -1 3 356.817 3.510 20 0 FHADHM CCCCc1ccc(NC(=O)c2ncc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000821077606 607231171 /nfs/dbraw/zinc/23/11/71/607231171.db2.gz NEBABCUAVAOCSI-UHFFFAOYSA-N -1 3 356.817 3.510 20 0 FHADHM CC(C)c1cccc(OCC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)c1 ZINC000820198490 607240456 /nfs/dbraw/zinc/24/04/56/607240456.db2.gz XZKAUTGUFLKBHI-UHFFFAOYSA-N -1 3 371.828 3.661 20 0 FHADHM CC(C)c1cccc(OCC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)c1 ZINC000820198490 607240457 /nfs/dbraw/zinc/24/04/57/607240457.db2.gz XZKAUTGUFLKBHI-UHFFFAOYSA-N -1 3 371.828 3.661 20 0 FHADHM Cc1cccc(C)c1OCCC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822299423 607243075 /nfs/dbraw/zinc/24/30/75/607243075.db2.gz IOJHUWDTGDXVGU-UHFFFAOYSA-N -1 3 371.828 3.545 20 0 FHADHM Cc1cccc(C)c1OCCC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822299423 607243076 /nfs/dbraw/zinc/24/30/76/607243076.db2.gz IOJHUWDTGDXVGU-UHFFFAOYSA-N -1 3 371.828 3.545 20 0 FHADHM Cc1c2cccc(F)c2oc1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822021216 607243665 /nfs/dbraw/zinc/24/36/65/607243665.db2.gz XHUDWMHCFQLCHS-UHFFFAOYSA-N -1 3 371.759 3.966 20 0 FHADHM Cc1c2cccc(F)c2oc1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822021216 607243666 /nfs/dbraw/zinc/24/36/66/607243666.db2.gz XHUDWMHCFQLCHS-UHFFFAOYSA-N -1 3 371.759 3.966 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccc2sccc2c1 ZINC000823318787 607244206 /nfs/dbraw/zinc/24/42/06/607244206.db2.gz KLKNGXPJABYLCO-UHFFFAOYSA-N -1 3 355.810 3.987 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccc2sccc2c1 ZINC000823318787 607244207 /nfs/dbraw/zinc/24/42/07/607244207.db2.gz KLKNGXPJABYLCO-UHFFFAOYSA-N -1 3 355.810 3.987 20 0 FHADHM O=C(Oc1ccc(-c2nnn[n-]2)cc1F)c1cc(F)c(Cl)cc1Cl ZINC000823451784 607246685 /nfs/dbraw/zinc/24/66/85/607246685.db2.gz ZRPXWWRBNIKBNM-UHFFFAOYSA-N -1 3 371.130 3.671 20 0 FHADHM O=C(Oc1ccc(-c2nn[n-]n2)cc1F)c1cc(F)c(Cl)cc1Cl ZINC000823451784 607246686 /nfs/dbraw/zinc/24/66/86/607246686.db2.gz ZRPXWWRBNIKBNM-UHFFFAOYSA-N -1 3 371.130 3.671 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@@H](C)c2cccc(C)c2)cc1-c1nnn[n-]1 ZINC000825553812 607784071 /nfs/dbraw/zinc/78/40/71/607784071.db2.gz XOIXBIMTPWYWCI-ZDUSSCGKSA-N -1 3 366.425 3.917 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@@H](C)c2cccc(C)c2)cc1-c1nn[n-]n1 ZINC000825553812 607784072 /nfs/dbraw/zinc/78/40/72/607784072.db2.gz XOIXBIMTPWYWCI-ZDUSSCGKSA-N -1 3 366.425 3.917 20 0 FHADHM CCc1ccc(-c2ccc(C(=O)N(C)c3ccccc3-c3nnn[n-]3)o2)cc1 ZINC000825700366 607787320 /nfs/dbraw/zinc/78/73/20/607787320.db2.gz CPRZZMZQUBFWEZ-UHFFFAOYSA-N -1 3 373.416 3.966 20 0 FHADHM CCc1ccc(-c2ccc(C(=O)N(C)c3ccccc3-c3nn[n-]n3)o2)cc1 ZINC000825700366 607787321 /nfs/dbraw/zinc/78/73/21/607787321.db2.gz CPRZZMZQUBFWEZ-UHFFFAOYSA-N -1 3 373.416 3.966 20 0 FHADHM CN(C(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1)c1ccccc1-c1nnn[n-]1 ZINC000825812849 607788945 /nfs/dbraw/zinc/78/89/45/607788945.db2.gz VXFUEHUYCZVRIQ-RTBURBONSA-N -1 3 369.428 3.786 20 0 FHADHM CN(C(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1)c1ccccc1-c1nn[n-]n1 ZINC000825812849 607788946 /nfs/dbraw/zinc/78/89/46/607788946.db2.gz VXFUEHUYCZVRIQ-RTBURBONSA-N -1 3 369.428 3.786 20 0 FHADHM Cc1c2cc(F)ccc2sc1C(=O)N(C)c1ccccc1-c1nnn[n-]1 ZINC000826234384 607789240 /nfs/dbraw/zinc/78/92/40/607789240.db2.gz TWBZBSXFGNMJJW-UHFFFAOYSA-N -1 3 367.409 3.806 20 0 FHADHM Cc1c2cc(F)ccc2sc1C(=O)N(C)c1ccccc1-c1nn[n-]n1 ZINC000826234384 607789241 /nfs/dbraw/zinc/78/92/41/607789241.db2.gz TWBZBSXFGNMJJW-UHFFFAOYSA-N -1 3 367.409 3.806 20 0 FHADHM CN(C(=O)CCc1ccc(-c2ccccc2)o1)c1ccccc1-c1nnn[n-]1 ZINC000825818004 607789792 /nfs/dbraw/zinc/78/97/92/607789792.db2.gz SBQZHCPJGCDBMS-UHFFFAOYSA-N -1 3 373.416 3.722 20 0 FHADHM CN(C(=O)CCc1ccc(-c2ccccc2)o1)c1ccccc1-c1nn[n-]n1 ZINC000825818004 607789793 /nfs/dbraw/zinc/78/97/93/607789793.db2.gz SBQZHCPJGCDBMS-UHFFFAOYSA-N -1 3 373.416 3.722 20 0 FHADHM Cc1cc(Cl)c(NC(=O)c2sccc2-c2nnn[n-]2)cc1Cl ZINC000826267337 607791652 /nfs/dbraw/zinc/79/16/52/607791652.db2.gz AKDBFNAILBIZKB-UHFFFAOYSA-N -1 3 354.222 3.796 20 0 FHADHM O=C(Cc1cc2c(ccc3ccccc23)o1)Nc1cccc(-c2nnn[n-]2)c1 ZINC000123076705 607792751 /nfs/dbraw/zinc/79/27/51/607792751.db2.gz OVBARZQKIAPUSE-UHFFFAOYSA-N -1 3 369.384 3.947 20 0 FHADHM O=C(Cc1cc2c(ccc3ccccc23)o1)Nc1cccc(-c2nn[n-]n2)c1 ZINC000123076705 607792752 /nfs/dbraw/zinc/79/27/52/607792752.db2.gz OVBARZQKIAPUSE-UHFFFAOYSA-N -1 3 369.384 3.947 20 0 FHADHM CCN(C(=O)CCSc1ccc(C)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825372351 607797535 /nfs/dbraw/zinc/79/75/35/607797535.db2.gz WCTJZUDNUVBXCY-UHFFFAOYSA-N -1 3 367.478 3.710 20 0 FHADHM CCN(C(=O)CCSc1ccc(C)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825372351 607797536 /nfs/dbraw/zinc/79/75/36/607797536.db2.gz WCTJZUDNUVBXCY-UHFFFAOYSA-N -1 3 367.478 3.710 20 0 FHADHM CCN(C(=O)c1ccc(-c2ccccc2)n1C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825380580 607797585 /nfs/dbraw/zinc/79/75/85/607797585.db2.gz RWGXNMSEILNQAU-UHFFFAOYSA-N -1 3 372.432 3.539 20 0 FHADHM CCN(C(=O)c1ccc(-c2ccccc2)n1C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825380580 607797586 /nfs/dbraw/zinc/79/75/86/607797586.db2.gz RWGXNMSEILNQAU-UHFFFAOYSA-N -1 3 372.432 3.539 20 0 FHADHM CC[C@H](O[C@H]1CCC[C@H](C)C1)C(=O)N(CC)c1ccc(-c2nnn[n-]2)cc1 ZINC000825153606 607797758 /nfs/dbraw/zinc/79/77/58/607797758.db2.gz ISULDHJLSBWHQY-WBAXXEDZSA-N -1 3 371.485 3.594 20 0 FHADHM CC[C@H](O[C@H]1CCC[C@H](C)C1)C(=O)N(CC)c1ccc(-c2nn[n-]n2)cc1 ZINC000825153606 607797759 /nfs/dbraw/zinc/79/77/59/607797759.db2.gz ISULDHJLSBWHQY-WBAXXEDZSA-N -1 3 371.485 3.594 20 0 FHADHM CCN(C(=O)c1cc(SC)ccc1C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825379787 607799236 /nfs/dbraw/zinc/79/92/36/607799236.db2.gz KXKURTAJESUCGS-UHFFFAOYSA-N -1 3 353.451 3.564 20 0 FHADHM CCN(C(=O)c1cc(SC)ccc1C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825379787 607799237 /nfs/dbraw/zinc/79/92/37/607799237.db2.gz KXKURTAJESUCGS-UHFFFAOYSA-N -1 3 353.451 3.564 20 0 FHADHM CCN(C(=O)CCc1cccc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825370968 607799773 /nfs/dbraw/zinc/79/97/73/607799773.db2.gz ADTMXTHCMSJTIJ-UHFFFAOYSA-N -1 3 355.829 3.506 20 0 FHADHM CCN(C(=O)CCc1cccc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825370968 607799774 /nfs/dbraw/zinc/79/97/74/607799774.db2.gz ADTMXTHCMSJTIJ-UHFFFAOYSA-N -1 3 355.829 3.506 20 0 FHADHM Fc1cc(NCc2ccc(-c3nnn[n-]3)cc2)c(F)cc1Br ZINC000826372547 607808061 /nfs/dbraw/zinc/80/80/61/607808061.db2.gz BEYXOTFOSWEQCQ-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1cc(NCc2ccc(-c3nn[n-]n3)cc2)c(F)cc1Br ZINC000826372547 607808062 /nfs/dbraw/zinc/80/80/62/607808062.db2.gz BEYXOTFOSWEQCQ-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM C[C@@H](NC(=O)CCC(C)(C)c1ccccc1)c1cccc(-c2nnn[n-]2)c1 ZINC000824478492 607819289 /nfs/dbraw/zinc/81/92/89/607819289.db2.gz HJLIYUWZBPGMKY-OAHLLOKOSA-N -1 3 363.465 3.802 20 0 FHADHM C[C@@H](NC(=O)CCC(C)(C)c1ccccc1)c1cccc(-c2nn[n-]n2)c1 ZINC000824478492 607819290 /nfs/dbraw/zinc/81/92/90/607819290.db2.gz HJLIYUWZBPGMKY-OAHLLOKOSA-N -1 3 363.465 3.802 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)cc1N1CCC[C@@H](C(F)(F)F)C1 ZINC000826368352 607839063 /nfs/dbraw/zinc/83/90/63/607839063.db2.gz MGEDLAYWWSIMJL-SECBINFHSA-N -1 3 365.281 3.664 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)cc1N1CCC[C@@H](C(F)(F)F)C1 ZINC000826368352 607839064 /nfs/dbraw/zinc/83/90/64/607839064.db2.gz MGEDLAYWWSIMJL-SECBINFHSA-N -1 3 365.281 3.664 20 0 FHADHM COc1cccc([C@H]2CCCN2c2ccc3cc(-c4nnn[n-]4)ccc3n2)c1 ZINC000826215360 607839654 /nfs/dbraw/zinc/83/96/54/607839654.db2.gz MYRMRCLECYDDJO-LJQANCHMSA-N -1 3 372.432 3.765 20 0 FHADHM COc1cccc([C@H]2CCCN2c2ccc3cc(-c4nn[n-]n4)ccc3n2)c1 ZINC000826215360 607839655 /nfs/dbraw/zinc/83/96/55/607839655.db2.gz MYRMRCLECYDDJO-LJQANCHMSA-N -1 3 372.432 3.765 20 0 FHADHM Cc1cccc(NC(=O)CSc2ccc(-c3nnn[n-]3)cc2Cl)c1 ZINC000826298840 607843857 /nfs/dbraw/zinc/84/38/57/607843857.db2.gz IPMCRVUJZITRGU-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1cccc(NC(=O)CSc2ccc(-c3nn[n-]n3)cc2Cl)c1 ZINC000826298840 607843858 /nfs/dbraw/zinc/84/38/58/607843858.db2.gz IPMCRVUJZITRGU-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1cccc(NC(=O)CSc2ccc(-c3nnn[n-]3)cc2Cl)c1C ZINC000826299271 607844738 /nfs/dbraw/zinc/84/47/38/607844738.db2.gz XUTHDWSOYMXFOB-UHFFFAOYSA-N -1 3 373.869 3.868 20 0 FHADHM Cc1cccc(NC(=O)CSc2ccc(-c3nn[n-]n3)cc2Cl)c1C ZINC000826299271 607844739 /nfs/dbraw/zinc/84/47/39/607844739.db2.gz XUTHDWSOYMXFOB-UHFFFAOYSA-N -1 3 373.869 3.868 20 0 FHADHM CCN(C(=O)c1ccc(SC)cc1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825385624 607878275 /nfs/dbraw/zinc/87/82/75/607878275.db2.gz OHGCNPPVQMHWPZ-UHFFFAOYSA-N -1 3 373.869 3.909 20 0 FHADHM CCN(C(=O)c1ccc(SC)cc1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825385624 607878276 /nfs/dbraw/zinc/87/82/76/607878276.db2.gz OHGCNPPVQMHWPZ-UHFFFAOYSA-N -1 3 373.869 3.909 20 0 FHADHM CC(C)[C@@H](C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccc(F)cc1 ZINC000824473018 607880991 /nfs/dbraw/zinc/88/09/91/607880991.db2.gz YPETWAAJZOPYAM-FZKQIMNGSA-N -1 3 367.428 3.623 20 0 FHADHM CC(C)[C@@H](C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccc(F)cc1 ZINC000824473018 607880992 /nfs/dbraw/zinc/88/09/92/607880992.db2.gz YPETWAAJZOPYAM-FZKQIMNGSA-N -1 3 367.428 3.623 20 0 FHADHM C[C@@H](NC(=O)[C@@H](C)Cc1cccc(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824459072 607905993 /nfs/dbraw/zinc/90/59/93/607905993.db2.gz ZJSCPWBJDLNSHA-QWHCGFSZSA-N -1 3 369.856 3.576 20 0 FHADHM C[C@@H](NC(=O)[C@@H](C)Cc1cccc(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824459072 607905994 /nfs/dbraw/zinc/90/59/94/607905994.db2.gz ZJSCPWBJDLNSHA-QWHCGFSZSA-N -1 3 369.856 3.576 20 0 FHADHM FC(F)(F)c1ccc(N2CC=C(C(F)(F)F)CC2)c(-c2nnn[n-]2)c1 ZINC000826366948 607935755 /nfs/dbraw/zinc/93/57/55/607935755.db2.gz FCJRPHLYVPGGLP-UHFFFAOYSA-N -1 3 363.265 3.584 20 0 FHADHM FC(F)(F)c1ccc(N2CC=C(C(F)(F)F)CC2)c(-c2nn[n-]n2)c1 ZINC000826366948 607935756 /nfs/dbraw/zinc/93/57/56/607935756.db2.gz FCJRPHLYVPGGLP-UHFFFAOYSA-N -1 3 363.265 3.584 20 0 FHADHM CC(C)(C)OC(=O)Nc1ccc(Sc2ncccc2-c2nnn[n-]2)cc1 ZINC000824114663 607936366 /nfs/dbraw/zinc/93/63/66/607936366.db2.gz ZSVJDZXOWXAIIX-UHFFFAOYSA-N -1 3 370.438 3.760 20 0 FHADHM CC(C)(C)OC(=O)Nc1ccc(Sc2ncccc2-c2nn[n-]n2)cc1 ZINC000824114663 607936367 /nfs/dbraw/zinc/93/63/67/607936367.db2.gz ZSVJDZXOWXAIIX-UHFFFAOYSA-N -1 3 370.438 3.760 20 0 FHADHM CS[C@H](C)CC(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000826225150 607939135 /nfs/dbraw/zinc/93/91/35/607939135.db2.gz VAPCTQZTKJQNHL-GFCCVEGCSA-N -1 3 369.450 3.739 20 0 FHADHM CS[C@H](C)CC(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000826225150 607939136 /nfs/dbraw/zinc/93/91/36/607939136.db2.gz VAPCTQZTKJQNHL-GFCCVEGCSA-N -1 3 369.450 3.739 20 0 FHADHM CS[C@H](C)CC(=O)Oc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000826224603 607945539 /nfs/dbraw/zinc/94/55/39/607945539.db2.gz INVVZLBZORQCAT-GFCCVEGCSA-N -1 3 370.434 3.706 20 0 FHADHM CS[C@H](C)CC(=O)Oc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000826224603 607945540 /nfs/dbraw/zinc/94/55/40/607945540.db2.gz INVVZLBZORQCAT-GFCCVEGCSA-N -1 3 370.434 3.706 20 0 FHADHM O=C(C1CCC(c2ccccc2)CC1)N1CCc2ccc(-c3nnn[n-]3)cc21 ZINC000826399117 607948888 /nfs/dbraw/zinc/94/88/88/607948888.db2.gz NAULMCWOKWMPBX-UHFFFAOYSA-N -1 3 373.460 3.730 20 0 FHADHM O=C(C1CCC(c2ccccc2)CC1)N1CCc2ccc(-c3nn[n-]n3)cc21 ZINC000826399117 607948889 /nfs/dbraw/zinc/94/88/89/607948889.db2.gz NAULMCWOKWMPBX-UHFFFAOYSA-N -1 3 373.460 3.730 20 0 FHADHM CS[C@H](C)CC(=O)Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1 ZINC000826224533 607962363 /nfs/dbraw/zinc/96/23/63/607962363.db2.gz HBQDGGOIPQYFDV-SNVBAGLBSA-N -1 3 359.480 3.675 20 0 FHADHM CS[C@H](C)CC(=O)Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1 ZINC000826224533 607962364 /nfs/dbraw/zinc/96/23/64/607962364.db2.gz HBQDGGOIPQYFDV-SNVBAGLBSA-N -1 3 359.480 3.675 20 0 FHADHM CS[C@H](C)CC(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCCCC2 ZINC000826224947 607962520 /nfs/dbraw/zinc/96/25/20/607962520.db2.gz PQNUFMZSGNYVIJ-SNVBAGLBSA-N -1 3 365.528 3.667 20 0 FHADHM CS[C@H](C)CC(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCCCC2 ZINC000826224947 607962521 /nfs/dbraw/zinc/96/25/21/607962521.db2.gz PQNUFMZSGNYVIJ-SNVBAGLBSA-N -1 3 365.528 3.667 20 0 FHADHM CCc1nc2sccc2c(Sc2ccc(-c3nnn[n-]3)cc2F)n1 ZINC000825750837 607965340 /nfs/dbraw/zinc/96/53/40/607965340.db2.gz YKMFXSHRSLIRAL-UHFFFAOYSA-N -1 3 358.427 3.724 20 0 FHADHM CCc1nc2sccc2c(Sc2ccc(-c3nn[n-]n3)cc2F)n1 ZINC000825750837 607965341 /nfs/dbraw/zinc/96/53/41/607965341.db2.gz YKMFXSHRSLIRAL-UHFFFAOYSA-N -1 3 358.427 3.724 20 0 FHADHM Cc1nnc(SCc2ccc(-c3nnn[n-]3)cc2)n1[C@@H]1CCC[C@H](C)C1 ZINC000826337426 607966217 /nfs/dbraw/zinc/96/62/17/607966217.db2.gz NVUWJHGTSNKFTI-BLLLJJGKSA-N -1 3 369.498 3.810 20 0 FHADHM Cc1nnc(SCc2ccc(-c3nn[n-]n3)cc2)n1[C@@H]1CCC[C@H](C)C1 ZINC000826337426 607966218 /nfs/dbraw/zinc/96/62/18/607966218.db2.gz NVUWJHGTSNKFTI-BLLLJJGKSA-N -1 3 369.498 3.810 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000823943912 607970407 /nfs/dbraw/zinc/97/04/07/607970407.db2.gz VAFVUTADKACFIQ-ACCUITESSA-N -1 3 367.840 3.582 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000823943912 607970408 /nfs/dbraw/zinc/97/04/08/607970408.db2.gz VAFVUTADKACFIQ-ACCUITESSA-N -1 3 367.840 3.582 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000823944022 607985918 /nfs/dbraw/zinc/98/59/18/607985918.db2.gz WXIQPJSOPRZNJS-XSNHNAGMSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000823944022 607985919 /nfs/dbraw/zinc/98/59/19/607985919.db2.gz WXIQPJSOPRZNJS-XSNHNAGMSA-N -1 3 367.840 3.801 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)C1(c2ccc(F)cc2F)CCCC1 ZINC000133653284 608023809 /nfs/dbraw/zinc/02/38/09/608023809.db2.gz XBVVYSOADIOCQA-UHFFFAOYSA-N -1 3 369.375 3.595 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)C1(c2ccc(F)cc2F)CCCC1 ZINC000133653284 608023810 /nfs/dbraw/zinc/02/38/10/608023810.db2.gz XBVVYSOADIOCQA-UHFFFAOYSA-N -1 3 369.375 3.595 20 0 FHADHM CC(C)[C@@H]1CCc2ccccc2N1C(=O)c1sccc1-c1nnn[n-]1 ZINC000824226268 608029494 /nfs/dbraw/zinc/02/94/94/608029494.db2.gz WZAYTCPZIAPKAA-AWEZNQCLSA-N -1 3 353.451 3.546 20 0 FHADHM CC(C)[C@@H]1CCc2ccccc2N1C(=O)c1sccc1-c1nn[n-]n1 ZINC000824226268 608029495 /nfs/dbraw/zinc/02/94/95/608029495.db2.gz WZAYTCPZIAPKAA-AWEZNQCLSA-N -1 3 353.451 3.546 20 0 FHADHM Fc1ccc(F)c(CNc2ccc(-c3nn[n-]n3)cc2Br)c1 ZINC000826375052 608049333 /nfs/dbraw/zinc/04/93/33/608049333.db2.gz XMJCQSLWFZLIMP-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM CCC(CC)[C@H](C)C(=O)Oc1c(Cl)cc(-c2nnn[n-]2)cc1OC ZINC000825096994 608059778 /nfs/dbraw/zinc/05/97/78/608059778.db2.gz RUJFXVCZORYOQJ-VIFPVBQESA-N -1 3 352.822 3.506 20 0 FHADHM CCC(CC)[C@H](C)C(=O)Oc1c(Cl)cc(-c2nn[n-]n2)cc1OC ZINC000825096994 608059779 /nfs/dbraw/zinc/05/97/79/608059779.db2.gz RUJFXVCZORYOQJ-VIFPVBQESA-N -1 3 352.822 3.506 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N(C)Cc1ccc(Cl)c(F)c1 ZINC000826277749 608105860 /nfs/dbraw/zinc/10/58/60/608105860.db2.gz FTIBIVAHFYAQDP-UHFFFAOYSA-N -1 3 374.807 3.632 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N(C)Cc1ccc(Cl)c(F)c1 ZINC000826277749 608105861 /nfs/dbraw/zinc/10/58/61/608105861.db2.gz FTIBIVAHFYAQDP-UHFFFAOYSA-N -1 3 374.807 3.632 20 0 FHADHM Cc1cnc(NCc2cccc(-c3ccc(-c4nnn[n-]4)s3)c2)nc1C ZINC000826319059 608123099 /nfs/dbraw/zinc/12/30/99/608123099.db2.gz MRUOYBWRRSFRFV-UHFFFAOYSA-N -1 3 363.450 3.614 20 0 FHADHM Cc1cc([C@H]2CN(c3c(Cl)cccc3-c3nnn[n-]3)CCO2)ccc1F ZINC000826266713 608151607 /nfs/dbraw/zinc/15/16/07/608151607.db2.gz YQGRBZRPJQABHK-MRXNPFEDSA-N -1 3 373.819 3.546 20 0 FHADHM Cc1cc([C@H]2CN(c3c(Cl)cccc3-c3nn[n-]n3)CCO2)ccc1F ZINC000826266713 608151608 /nfs/dbraw/zinc/15/16/08/608151608.db2.gz YQGRBZRPJQABHK-MRXNPFEDSA-N -1 3 373.819 3.546 20 0 FHADHM C[C@H](C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1c(F)cccc1F ZINC000824046561 608159096 /nfs/dbraw/zinc/15/90/96/608159096.db2.gz TXIDUPNPQIIHGX-QMMMGPOBSA-N -1 3 363.755 3.541 20 0 FHADHM C[C@H](C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1c(F)cccc1F ZINC000824046561 608159097 /nfs/dbraw/zinc/15/90/97/608159097.db2.gz TXIDUPNPQIIHGX-QMMMGPOBSA-N -1 3 363.755 3.541 20 0 FHADHM Cc1ccc(NC(=O)CSc2cccc(Cl)c2-c2nnn[n-]2)cc1C ZINC000826290904 608206265 /nfs/dbraw/zinc/20/62/65/608206265.db2.gz GLGYMJGKXZQNPS-UHFFFAOYSA-N -1 3 373.869 3.868 20 0 FHADHM Cc1ccc(NC(=O)CSc2cccc(Cl)c2-c2nn[n-]n2)cc1C ZINC000826290904 608206267 /nfs/dbraw/zinc/20/62/67/608206267.db2.gz GLGYMJGKXZQNPS-UHFFFAOYSA-N -1 3 373.869 3.868 20 0 FHADHM Fc1ccc(CNc2ccc3cc(-c4nnn[n-]4)ccc3n2)cc1Cl ZINC000826374628 608225220 /nfs/dbraw/zinc/22/52/20/608225220.db2.gz GNOGFYINJCHDLO-UHFFFAOYSA-N -1 3 354.776 3.820 20 0 FHADHM Fc1ccc(CNc2ccc3cc(-c4nn[n-]n4)ccc3n2)cc1Cl ZINC000826374628 608225221 /nfs/dbraw/zinc/22/52/21/608225221.db2.gz GNOGFYINJCHDLO-UHFFFAOYSA-N -1 3 354.776 3.820 20 0 FHADHM Fc1cccc(Cl)c1CNc1ccc2cc(-c3nnn[n-]3)ccc2n1 ZINC000826377624 608225595 /nfs/dbraw/zinc/22/55/95/608225595.db2.gz ZIEQJQFXKGINEA-UHFFFAOYSA-N -1 3 354.776 3.820 20 0 FHADHM Fc1cccc(Cl)c1CNc1ccc2cc(-c3nn[n-]n3)ccc2n1 ZINC000826377624 608225596 /nfs/dbraw/zinc/22/55/96/608225596.db2.gz ZIEQJQFXKGINEA-UHFFFAOYSA-N -1 3 354.776 3.820 20 0 FHADHM CC(C)[C@@H](CNc1ccc2cc(-c3nnn[n-]3)ccc2n1)c1cccnc1 ZINC000824191452 608231525 /nfs/dbraw/zinc/23/15/25/608231525.db2.gz DZCHVVHMCZKIRP-QGZVFWFLSA-N -1 3 359.437 3.662 20 0 FHADHM CC(C)[C@@H](CNc1ccc2cc(-c3nn[n-]n3)ccc2n1)c1cccnc1 ZINC000824191452 608231527 /nfs/dbraw/zinc/23/15/27/608231527.db2.gz DZCHVVHMCZKIRP-QGZVFWFLSA-N -1 3 359.437 3.662 20 0 FHADHM Cc1cnc(CSCc2ccc(-c3nnn[n-]3)cc2OC(F)F)s1 ZINC000826318470 608237745 /nfs/dbraw/zinc/23/77/45/608237745.db2.gz KUKGPLYVKDQUQH-UHFFFAOYSA-N -1 3 369.422 3.666 20 0 FHADHM Cc1cnc(CSCc2ccc(-c3nn[n-]n3)cc2OC(F)F)s1 ZINC000826318470 608237746 /nfs/dbraw/zinc/23/77/46/608237746.db2.gz KUKGPLYVKDQUQH-UHFFFAOYSA-N -1 3 369.422 3.666 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccc2[nH]ccc2c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824712823 608246476 /nfs/dbraw/zinc/24/64/76/608246476.db2.gz DEFXHKAIKRJUAA-STMXVASLSA-N -1 3 359.389 3.666 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccc2[nH]ccc2c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824712823 608246478 /nfs/dbraw/zinc/24/64/78/608246478.db2.gz DEFXHKAIKRJUAA-STMXVASLSA-N -1 3 359.389 3.666 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1ccc(F)cc1OC(C)(C)C ZINC000826250189 608251717 /nfs/dbraw/zinc/25/17/17/608251717.db2.gz OPQDBUCTPYRNPY-UHFFFAOYSA-N -1 3 369.400 3.744 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1ccc(F)cc1OC(C)(C)C ZINC000826250189 608251719 /nfs/dbraw/zinc/25/17/19/608251719.db2.gz OPQDBUCTPYRNPY-UHFFFAOYSA-N -1 3 369.400 3.744 20 0 FHADHM C[C@@H](CC(=O)Nc1ccccc1-c1nnn[n-]1)Cc1ccc(Cl)cc1 ZINC000824385220 608258489 /nfs/dbraw/zinc/25/84/89/608258489.db2.gz OHYBYGAAYXEGQG-GFCCVEGCSA-N -1 3 355.829 3.728 20 0 FHADHM C[C@@H](CC(=O)Nc1ccccc1-c1nn[n-]n1)Cc1ccc(Cl)cc1 ZINC000824385220 608258491 /nfs/dbraw/zinc/25/84/91/608258491.db2.gz OHYBYGAAYXEGQG-GFCCVEGCSA-N -1 3 355.829 3.728 20 0 FHADHM C[C@@H]1CCC[C@@H](OCCCCCC(=O)Nc2ccc(-c3nnn[n-]3)cc2)C1 ZINC000162236522 608262176 /nfs/dbraw/zinc/26/21/76/608262176.db2.gz OVXUIMXTLYDIRZ-CRAIPNDOSA-N -1 3 371.485 3.961 20 0 FHADHM C[C@@H]1CCC[C@@H](OCCCCCC(=O)Nc2ccc(-c3nn[n-]n3)cc2)C1 ZINC000162236522 608262179 /nfs/dbraw/zinc/26/21/79/608262179.db2.gz OVXUIMXTLYDIRZ-CRAIPNDOSA-N -1 3 371.485 3.961 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)c2ccc(F)c(SC)c2)s1 ZINC000825694553 608275223 /nfs/dbraw/zinc/27/52/23/608275223.db2.gz UCJLZWGUCGJQHG-UHFFFAOYSA-N -1 3 363.443 3.604 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)c2ccc(F)c(SC)c2)s1 ZINC000825694553 608275224 /nfs/dbraw/zinc/27/52/24/608275224.db2.gz UCJLZWGUCGJQHG-UHFFFAOYSA-N -1 3 363.443 3.604 20 0 FHADHM CCCOc1ccc([C@@H](C)Nc2nc(C)ccc2-c2nnn[n-]2)cc1OC ZINC000825339215 608275533 /nfs/dbraw/zinc/27/55/33/608275533.db2.gz RUDUWOHVDIEOQU-CYBMUJFWSA-N -1 3 368.441 3.541 20 0 FHADHM CCCOc1ccc([C@@H](C)Nc2nc(C)ccc2-c2nn[n-]n2)cc1OC ZINC000825339215 608275534 /nfs/dbraw/zinc/27/55/34/608275534.db2.gz RUDUWOHVDIEOQU-CYBMUJFWSA-N -1 3 368.441 3.541 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)c(N[C@H]2CCCc3cc(OC(F)F)ccc32)n1 ZINC000826275554 608279891 /nfs/dbraw/zinc/27/98/91/608279891.db2.gz CVXCKYAYONRGDK-HNNXBMFYSA-N -1 3 372.379 3.661 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)c(N[C@H]2CCCc3cc(OC(F)F)ccc32)n1 ZINC000826275554 608279892 /nfs/dbraw/zinc/27/98/92/608279892.db2.gz CVXCKYAYONRGDK-HNNXBMFYSA-N -1 3 372.379 3.661 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)c(N[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)n1 ZINC000826275177 608281825 /nfs/dbraw/zinc/28/18/25/608281825.db2.gz RBUXLDOYQBWXDB-GXTWGEPZSA-N -1 3 360.343 3.557 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)c(N[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)n1 ZINC000826275177 608281827 /nfs/dbraw/zinc/28/18/27/608281827.db2.gz RBUXLDOYQBWXDB-GXTWGEPZSA-N -1 3 360.343 3.557 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H](c2ccccc2)C2CC2)c1-c1nnn[n-]1 ZINC000825688028 608304836 /nfs/dbraw/zinc/30/48/36/608304836.db2.gz QGQNFLQZXGXWLJ-HNNXBMFYSA-N -1 3 367.478 3.931 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H](c2ccccc2)C2CC2)c1-c1nn[n-]n1 ZINC000825688028 608304838 /nfs/dbraw/zinc/30/48/38/608304838.db2.gz QGQNFLQZXGXWLJ-HNNXBMFYSA-N -1 3 367.478 3.931 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1csc(C)c1C ZINC000825333112 608308193 /nfs/dbraw/zinc/30/81/93/608308193.db2.gz RKFGSZXTTOHRAF-UHFFFAOYSA-N -1 3 356.455 3.619 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CNc1ccc2c3c(cccc31)CC2 ZINC000826170622 608319433 /nfs/dbraw/zinc/31/94/33/608319433.db2.gz IPYVDOCEFAWETQ-UHFFFAOYSA-N -1 3 357.417 3.739 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CNc1ccc2c3c(cccc31)CC2 ZINC000826170622 608319435 /nfs/dbraw/zinc/31/94/35/608319435.db2.gz IPYVDOCEFAWETQ-UHFFFAOYSA-N -1 3 357.417 3.739 20 0 FHADHM CS[C@H](C)CCC(=O)N(Cc1ccco1)c1ccccc1-c1nnn[n-]1 ZINC000826226099 608340992 /nfs/dbraw/zinc/34/09/92/608340992.db2.gz RYVHIVSOFHKDFP-CYBMUJFWSA-N -1 3 371.466 3.525 20 0 FHADHM CS[C@H](C)CCC(=O)N(Cc1ccco1)c1ccccc1-c1nn[n-]n1 ZINC000826226099 608340994 /nfs/dbraw/zinc/34/09/94/608340994.db2.gz RYVHIVSOFHKDFP-CYBMUJFWSA-N -1 3 371.466 3.525 20 0 FHADHM CCN(C(=O)c1cc2c(s1)CCC2)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825379269 608345395 /nfs/dbraw/zinc/34/53/95/608345395.db2.gz FLQXGLPDKWXMGW-UHFFFAOYSA-N -1 3 373.869 3.737 20 0 FHADHM CCN(C(=O)c1cc2c(s1)CCC2)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825379269 608345397 /nfs/dbraw/zinc/34/53/97/608345397.db2.gz FLQXGLPDKWXMGW-UHFFFAOYSA-N -1 3 373.869 3.737 20 0 FHADHM CCN(C(=O)c1ccc2c(c1)CCC2)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825385591 608345477 /nfs/dbraw/zinc/34/54/77/608345477.db2.gz MQBGCPMQRLTIBQ-UHFFFAOYSA-N -1 3 367.840 3.676 20 0 FHADHM CCN(C(=O)c1ccc2c(c1)CCC2)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825385591 608345479 /nfs/dbraw/zinc/34/54/79/608345479.db2.gz MQBGCPMQRLTIBQ-UHFFFAOYSA-N -1 3 367.840 3.676 20 0 FHADHM CCN(C(=O)[C@@H](C)c1cccc(F)c1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825361547 608346906 /nfs/dbraw/zinc/34/69/06/608346906.db2.gz DXXXRLHXTDPGOA-NSHDSACASA-N -1 3 373.819 3.816 20 0 FHADHM CCN(C(=O)[C@@H](C)c1cccc(F)c1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825361547 608346909 /nfs/dbraw/zinc/34/69/09/608346909.db2.gz DXXXRLHXTDPGOA-NSHDSACASA-N -1 3 373.819 3.816 20 0 FHADHM C[C@H](O)c1ccc(CNc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)cc1 ZINC000824708530 608373262 /nfs/dbraw/zinc/37/32/62/608373262.db2.gz YIPQWOCAWHZBBM-JTQLQIEISA-N -1 3 363.343 3.551 20 0 FHADHM CCCCC[C@H](C)NC(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000825267954 608389329 /nfs/dbraw/zinc/38/93/29/608389329.db2.gz OHTDJGNMEQBPIF-HNNXBMFYSA-N -1 3 368.485 3.634 20 0 FHADHM CCCCC[C@H](C)NC(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000825267954 608389332 /nfs/dbraw/zinc/38/93/32/608389332.db2.gz OHTDJGNMEQBPIF-HNNXBMFYSA-N -1 3 368.485 3.634 20 0 FHADHM Fc1c(CSCc2nc(-c3cccs3)no2)cccc1-c1nnn[n-]1 ZINC000826370928 608404585 /nfs/dbraw/zinc/40/45/85/608404585.db2.gz LVIVBKVFNHZZMS-UHFFFAOYSA-N -1 3 374.426 3.551 20 0 FHADHM Fc1c(CSCc2nc(-c3cccs3)no2)cccc1-c1nn[n-]n1 ZINC000826370928 608404587 /nfs/dbraw/zinc/40/45/87/608404587.db2.gz LVIVBKVFNHZZMS-UHFFFAOYSA-N -1 3 374.426 3.551 20 0 FHADHM Fc1c(CSCc2cc(-c3ccco3)on2)cccc1-c1nnn[n-]1 ZINC000826370786 608404925 /nfs/dbraw/zinc/40/49/25/608404925.db2.gz HGDUHQJXCPGBDJ-UHFFFAOYSA-N -1 3 357.370 3.687 20 0 FHADHM Fc1c(CSCc2cc(-c3ccco3)on2)cccc1-c1nn[n-]n1 ZINC000826370786 608404926 /nfs/dbraw/zinc/40/49/26/608404926.db2.gz HGDUHQJXCPGBDJ-UHFFFAOYSA-N -1 3 357.370 3.687 20 0 FHADHM Fc1c(CSC[C@H]2OCCc3ccccc32)cccc1-c1nnn[n-]1 ZINC000826370716 608404938 /nfs/dbraw/zinc/40/49/38/608404938.db2.gz FIBGAYLUMDMRDD-MRXNPFEDSA-N -1 3 356.426 3.553 20 0 FHADHM Fc1c(CSC[C@H]2OCCc3ccccc32)cccc1-c1nn[n-]n1 ZINC000826370716 608404941 /nfs/dbraw/zinc/40/49/41/608404941.db2.gz FIBGAYLUMDMRDD-MRXNPFEDSA-N -1 3 356.426 3.553 20 0 FHADHM C[C@H](NC(=O)N[C@@H](C)c1ccccc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000824505235 608405665 /nfs/dbraw/zinc/40/56/65/608405665.db2.gz ADAOXKODDWNMNX-RYUDHWBXSA-N -1 3 370.844 3.642 20 0 FHADHM C[C@H](NC(=O)N[C@@H](C)c1ccccc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000824505235 608405666 /nfs/dbraw/zinc/40/56/66/608405666.db2.gz ADAOXKODDWNMNX-RYUDHWBXSA-N -1 3 370.844 3.642 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1Sc1ncncc1-c1ccccc1 ZINC000826372332 608406851 /nfs/dbraw/zinc/40/68/51/608406851.db2.gz RUFKEGWNSLSECL-UHFFFAOYSA-N -1 3 350.382 3.614 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1Sc1ncncc1-c1ccccc1 ZINC000826372332 608406852 /nfs/dbraw/zinc/40/68/52/608406852.db2.gz RUFKEGWNSLSECL-UHFFFAOYSA-N -1 3 350.382 3.614 20 0 FHADHM c1ccc2sc(N3CC=C(c4ccc(-c5nnn[n-]5)cc4)CC3)nc2c1 ZINC000823867736 608443148 /nfs/dbraw/zinc/44/31/48/608443148.db2.gz FZGVRTPHWBGBPF-UHFFFAOYSA-N -1 3 360.446 3.770 20 0 FHADHM c1ccc2sc(N3CC=C(c4ccc(-c5nn[n-]n5)cc4)CC3)nc2c1 ZINC000823867736 608443150 /nfs/dbraw/zinc/44/31/50/608443150.db2.gz FZGVRTPHWBGBPF-UHFFFAOYSA-N -1 3 360.446 3.770 20 0 FHADHM O=C(Cc1csc2ccccc12)OCc1cccc(-c2nnn[n-]2)c1F ZINC000826424113 608443510 /nfs/dbraw/zinc/44/35/10/608443510.db2.gz WIWNQJYMTPIVHR-UHFFFAOYSA-N -1 3 368.393 3.506 20 0 FHADHM O=C(Cc1csc2ccccc12)OCc1cccc(-c2nn[n-]n2)c1F ZINC000826424113 608443512 /nfs/dbraw/zinc/44/35/12/608443512.db2.gz WIWNQJYMTPIVHR-UHFFFAOYSA-N -1 3 368.393 3.506 20 0 FHADHM Cc1ccc(Br)c(NCc2cc(-c3nnn[n-]3)cs2)c1 ZINC000826281449 608451879 /nfs/dbraw/zinc/45/18/79/608451879.db2.gz SJKWAHQUAAPKGU-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM Cc1ccc(Br)c(NCc2cc(-c3nn[n-]n3)cs2)c1 ZINC000826281449 608451881 /nfs/dbraw/zinc/45/18/81/608451881.db2.gz SJKWAHQUAAPKGU-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM O=C(CC1CCCCCC1)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000826404176 608482096 /nfs/dbraw/zinc/48/20/96/608482096.db2.gz QYKHAMBUSNUTRJ-UHFFFAOYSA-N -1 3 365.481 3.843 20 0 FHADHM O=C(CC1CCCCCC1)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000826404176 608482097 /nfs/dbraw/zinc/48/20/97/608482097.db2.gz QYKHAMBUSNUTRJ-UHFFFAOYSA-N -1 3 365.481 3.843 20 0 FHADHM CCCc1ccc(C(=O)N2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)cc1 ZINC000825348393 608485959 /nfs/dbraw/zinc/48/59/59/608485959.db2.gz IOHOEGRYVSZQLI-UHFFFAOYSA-N -1 3 373.460 3.749 20 0 FHADHM CCCc1ccc(C(=O)N2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)cc1 ZINC000825348393 608485961 /nfs/dbraw/zinc/48/59/61/608485961.db2.gz IOHOEGRYVSZQLI-UHFFFAOYSA-N -1 3 373.460 3.749 20 0 FHADHM O=C(Nc1ccccc1-c1nnn[n-]1)c1ccc(C(F)(F)F)cc1Cl ZINC000826457264 608540226 /nfs/dbraw/zinc/54/02/26/608540226.db2.gz UJVRZQAERDFDJH-UHFFFAOYSA-N -1 3 367.718 3.791 20 0 FHADHM O=C(Nc1ccccc1-c1nn[n-]n1)c1ccc(C(F)(F)F)cc1Cl ZINC000826457264 608540228 /nfs/dbraw/zinc/54/02/28/608540228.db2.gz UJVRZQAERDFDJH-UHFFFAOYSA-N -1 3 367.718 3.791 20 0 FHADHM C[C@@H](NC(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1)c1ccc(Cl)cc1 ZINC000824520994 608572950 /nfs/dbraw/zinc/57/29/50/608572950.db2.gz HGIXIJGFNBMVKC-SECBINFHSA-N -1 3 362.220 3.665 20 0 FHADHM C[C@@H](NC(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1)c1ccc(Cl)cc1 ZINC000824520994 608572951 /nfs/dbraw/zinc/57/29/51/608572951.db2.gz HGIXIJGFNBMVKC-SECBINFHSA-N -1 3 362.220 3.665 20 0 FHADHM CCN(C(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1)c1cc(C)ccc1C ZINC000825380809 608575398 /nfs/dbraw/zinc/57/53/98/608575398.db2.gz UMPRSSDDRTWMAR-UHFFFAOYSA-N -1 3 355.829 3.804 20 0 FHADHM CCN(C(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1)c1cc(C)ccc1C ZINC000825380809 608575399 /nfs/dbraw/zinc/57/53/99/608575399.db2.gz UMPRSSDDRTWMAR-UHFFFAOYSA-N -1 3 355.829 3.804 20 0 FHADHM FC(F)(F)[C@@H](CCc1ccccc1)NCc1cccc(-c2nnn[n-]2)c1 ZINC000826367227 608580239 /nfs/dbraw/zinc/58/02/39/608580239.db2.gz QFEMKYZYFQWGLQ-MRXNPFEDSA-N -1 3 361.371 3.520 20 0 FHADHM FC(F)(F)[C@@H](CCc1ccccc1)NCc1cccc(-c2nn[n-]n2)c1 ZINC000826367227 608580240 /nfs/dbraw/zinc/58/02/40/608580240.db2.gz QFEMKYZYFQWGLQ-MRXNPFEDSA-N -1 3 361.371 3.520 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1N1CC=C(c2cccc3ccccc32)C1 ZINC000826351160 608585659 /nfs/dbraw/zinc/58/56/59/608585659.db2.gz ZQQVIHHKFAYNHQ-UHFFFAOYSA-N -1 3 374.835 3.972 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1N1CC=C(c2cccc3ccccc32)C1 ZINC000826351160 608585660 /nfs/dbraw/zinc/58/56/60/608585660.db2.gz ZQQVIHHKFAYNHQ-UHFFFAOYSA-N -1 3 374.835 3.972 20 0 FHADHM O=C(c1sccc1-c1nnn[n-]1)N1CC=C(c2ccccc2Cl)CC1 ZINC000826475585 608602121 /nfs/dbraw/zinc/60/21/21/608602121.db2.gz KKIZNIGAYDPAJD-UHFFFAOYSA-N -1 3 371.853 3.511 20 0 FHADHM O=C(c1sccc1-c1nn[n-]n1)N1CC=C(c2ccccc2Cl)CC1 ZINC000826475585 608602125 /nfs/dbraw/zinc/60/21/25/608602125.db2.gz KKIZNIGAYDPAJD-UHFFFAOYSA-N -1 3 371.853 3.511 20 0 FHADHM C[C@H](c1cc2ccccc2o1)N(C)Cc1cccc(-c2nnn[n-]2)c1F ZINC000824764747 608640975 /nfs/dbraw/zinc/64/09/75/608640975.db2.gz YEEQRPIEYWPDCE-GFCCVEGCSA-N -1 3 351.385 3.945 20 0 FHADHM Cc1ccsc1-c1nnc(SCc2cccc(-c3nnn[n-]3)c2F)o1 ZINC000826315417 608672328 /nfs/dbraw/zinc/67/23/28/608672328.db2.gz JDKLJBSXNXHCMW-UHFFFAOYSA-N -1 3 374.426 3.718 20 0 FHADHM Cc1ccsc1-c1nnc(SCc2cccc(-c3nn[n-]n3)c2F)o1 ZINC000826315417 608672329 /nfs/dbraw/zinc/67/23/29/608672329.db2.gz JDKLJBSXNXHCMW-UHFFFAOYSA-N -1 3 374.426 3.718 20 0 FHADHM CCc1ccc(NC(=O)CSCc2ccc(-c3nnn[n-]3)cc2)cc1C ZINC000825711917 608764494 /nfs/dbraw/zinc/76/44/94/608764494.db2.gz IWTQGOXYQAYNHT-UHFFFAOYSA-N -1 3 367.478 3.609 20 0 FHADHM CCc1ccc(NC(=O)CSCc2ccc(-c3nn[n-]n3)cc2)cc1C ZINC000825711917 608764495 /nfs/dbraw/zinc/76/44/95/608764495.db2.gz IWTQGOXYQAYNHT-UHFFFAOYSA-N -1 3 367.478 3.609 20 0 FHADHM Fc1ccc(COc2cccc(Oc3cccnc3)c2)c(-c2nnn[n-]2)c1 ZINC000826374597 608800208 /nfs/dbraw/zinc/80/02/08/608800208.db2.gz FIDOLCWLQLYRFJ-UHFFFAOYSA-N -1 3 363.352 3.772 20 0 FHADHM Fc1ccc(COc2cccc(Oc3cccnc3)c2)c(-c2nn[n-]n2)c1 ZINC000826374597 608800211 /nfs/dbraw/zinc/80/02/11/608800211.db2.gz FIDOLCWLQLYRFJ-UHFFFAOYSA-N -1 3 363.352 3.772 20 0 FHADHM CC(C)CCc1ccccc1NCc1cnc2ccc(-c3nnn[n-]3)cn12 ZINC000824249962 608859394 /nfs/dbraw/zinc/85/93/94/608859394.db2.gz ZXZZHGFAEUKBBO-UHFFFAOYSA-N -1 3 361.453 3.715 20 0 FHADHM CC(C)CCc1ccccc1NCc1cnc2ccc(-c3nn[n-]n3)cn12 ZINC000824249962 608859398 /nfs/dbraw/zinc/85/93/98/608859398.db2.gz ZXZZHGFAEUKBBO-UHFFFAOYSA-N -1 3 361.453 3.715 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)N1CCC[C@@H]1/C=C/c1ccccc1 ZINC000826402069 609138192 /nfs/dbraw/zinc/13/81/92/609138192.db2.gz MKMMEYHKTIXCBR-YNIAAOTNSA-N -1 3 371.444 3.584 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)N1CCC[C@@H]1/C=C/c1ccccc1 ZINC000826402069 609138194 /nfs/dbraw/zinc/13/81/94/609138194.db2.gz MKMMEYHKTIXCBR-YNIAAOTNSA-N -1 3 371.444 3.584 20 0 FHADHM Fc1cccc(F)c1[C@H](NCc1ccccc1-c1nnn[n-]1)C(F)(F)F ZINC000826377222 609152579 /nfs/dbraw/zinc/15/25/79/609152579.db2.gz JPIJNCOILGUFSZ-AWEZNQCLSA-N -1 3 369.297 3.538 20 0 FHADHM Fc1cccc(F)c1[C@H](NCc1ccccc1-c1nn[n-]n1)C(F)(F)F ZINC000826377222 609152580 /nfs/dbraw/zinc/15/25/80/609152580.db2.gz JPIJNCOILGUFSZ-AWEZNQCLSA-N -1 3 369.297 3.538 20 0 FHADHM Cc1ccc2c(c1)[C@H](NC(=O)Nc1cc(-c3nnn[n-]3)ccc1C)[C@H](C)C2 ZINC000826294631 609157647 /nfs/dbraw/zinc/15/76/47/609157647.db2.gz XSWVJCLLDJDCET-FZKQIMNGSA-N -1 3 362.437 3.539 20 0 FHADHM Cc1ccc2c(c1)[C@H](NC(=O)Nc1cc(-c3nn[n-]n3)ccc1C)[C@H](C)C2 ZINC000826294631 609157648 /nfs/dbraw/zinc/15/76/48/609157648.db2.gz XSWVJCLLDJDCET-FZKQIMNGSA-N -1 3 362.437 3.539 20 0 FHADHM C[C@H]1CCN(c2ccc3cc(-c4nnn[n-]4)ccc3n2)[C@H](c2ccco2)C1 ZINC000824963032 609164350 /nfs/dbraw/zinc/16/43/50/609164350.db2.gz YUAIWWSZLXLSKX-GUYCJALGSA-N -1 3 360.421 3.986 20 0 FHADHM C[C@H]1CCN(c2ccc3cc(-c4nn[n-]n4)ccc3n2)[C@H](c2ccco2)C1 ZINC000824963032 609164352 /nfs/dbraw/zinc/16/43/52/609164352.db2.gz YUAIWWSZLXLSKX-GUYCJALGSA-N -1 3 360.421 3.986 20 0 FHADHM Cc1c(C)n(-c2ccccc2)c(NC(=O)c2cccs2)c1-c1nnn[n-]1 ZINC000826234330 609165150 /nfs/dbraw/zinc/16/51/50/609165150.db2.gz QVMNOZALTKJAIW-UHFFFAOYSA-N -1 3 364.434 3.588 20 0 FHADHM Cc1c(C)n(-c2ccccc2)c(NC(=O)c2cccs2)c1-c1nn[n-]n1 ZINC000826234330 609165152 /nfs/dbraw/zinc/16/51/52/609165152.db2.gz QVMNOZALTKJAIW-UHFFFAOYSA-N -1 3 364.434 3.588 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NCc1ccccc1Br ZINC000825481429 609178249 /nfs/dbraw/zinc/17/82/49/609178249.db2.gz YSZAWLYTPIXHIL-UHFFFAOYSA-N -1 3 373.258 3.673 20 0 FHADHM Cc1occc1S[C@@H](C)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000826342669 609178870 /nfs/dbraw/zinc/17/88/70/609178870.db2.gz VKPMFYOYENBRBE-VIFPVBQESA-N -1 3 363.830 3.541 20 0 FHADHM Cc1occc1S[C@@H](C)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000826342669 609178871 /nfs/dbraw/zinc/17/88/71/609178871.db2.gz VKPMFYOYENBRBE-VIFPVBQESA-N -1 3 363.830 3.541 20 0 FHADHM Cn1cc(CNc2ccc(Cl)c(-c3nnn[n-]3)c2)c(-c2ccccc2)n1 ZINC000826361581 609200002 /nfs/dbraw/zinc/20/00/02/609200002.db2.gz DEVKASCSYFDLLN-UHFFFAOYSA-N -1 3 365.828 3.533 20 0 FHADHM Cn1cc(CNc2ccc(Cl)c(-c3nn[n-]n3)c2)c(-c2ccccc2)n1 ZINC000826361581 609200003 /nfs/dbraw/zinc/20/00/03/609200003.db2.gz DEVKASCSYFDLLN-UHFFFAOYSA-N -1 3 365.828 3.533 20 0 FHADHM CCCCN(C(=O)c1c[nH]c(-c2nnn[n-]2)c1)[C@H](CC)c1ccccc1 ZINC000825281572 609213239 /nfs/dbraw/zinc/21/32/39/609213239.db2.gz GFQALAUILCSILH-QGZVFWFLSA-N -1 3 352.442 3.588 20 0 FHADHM CCCCN(C(=O)c1c[nH]c(-c2nn[n-]n2)c1)[C@H](CC)c1ccccc1 ZINC000825281572 609213240 /nfs/dbraw/zinc/21/32/40/609213240.db2.gz GFQALAUILCSILH-QGZVFWFLSA-N -1 3 352.442 3.588 20 0 FHADHM C[C@@H](Cc1nnc(NCc2cc(-c3nnn[n-]3)cs2)o1)CC(C)(C)C ZINC000824464438 609265519 /nfs/dbraw/zinc/26/55/19/609265519.db2.gz GMMDHPZSEQCBOG-JTQLQIEISA-N -1 3 361.475 3.538 20 0 FHADHM C[C@@H](Cc1nnc(NCc2cc(-c3nn[n-]n3)cs2)o1)CC(C)(C)C ZINC000824464438 609265521 /nfs/dbraw/zinc/26/55/21/609265521.db2.gz GMMDHPZSEQCBOG-JTQLQIEISA-N -1 3 361.475 3.538 20 0 FHADHM C[C@H](Cc1nnc(NCc2cc(-c3nnn[n-]3)cs2)o1)CC(C)(C)C ZINC000824464439 609265934 /nfs/dbraw/zinc/26/59/34/609265934.db2.gz GMMDHPZSEQCBOG-SNVBAGLBSA-N -1 3 361.475 3.538 20 0 FHADHM C[C@H](Cc1nnc(NCc2cc(-c3nn[n-]n3)cs2)o1)CC(C)(C)C ZINC000824464439 609265936 /nfs/dbraw/zinc/26/59/36/609265936.db2.gz GMMDHPZSEQCBOG-SNVBAGLBSA-N -1 3 361.475 3.538 20 0 FHADHM Cc1c2nc(NCc3ccc(-c4nnn[n-]4)cc3F)sc2ccc1F ZINC000826241122 609266101 /nfs/dbraw/zinc/26/61/01/609266101.db2.gz RYXHIFQKOZRHGG-UHFFFAOYSA-N -1 3 358.377 3.675 20 0 FHADHM Cc1c2nc(NCc3ccc(-c4nn[n-]n4)cc3F)sc2ccc1F ZINC000826241122 609266102 /nfs/dbraw/zinc/26/61/02/609266102.db2.gz RYXHIFQKOZRHGG-UHFFFAOYSA-N -1 3 358.377 3.675 20 0 FHADHM CCOc1ccc(N[C@@H]2CCCc3cc(-c4nnn[n-]4)ccc32)cc1OC ZINC000825642782 609270715 /nfs/dbraw/zinc/27/07/15/609270715.db2.gz BMJHUWBWKNREIQ-QGZVFWFLSA-N -1 3 365.437 3.764 20 0 FHADHM CCOc1ccc(N[C@@H]2CCCc3cc(-c4nn[n-]n4)ccc32)cc1OC ZINC000825642782 609270717 /nfs/dbraw/zinc/27/07/17/609270717.db2.gz BMJHUWBWKNREIQ-QGZVFWFLSA-N -1 3 365.437 3.764 20 0 FHADHM c1cn(-c2ccccc2)nc1N[C@H]1CCCc2cc(-c3nnn[n-]3)ccc21 ZINC000826520002 609271618 /nfs/dbraw/zinc/27/16/18/609271618.db2.gz XBOMAYKYWZPCAZ-SFHVURJKSA-N -1 3 357.421 3.542 20 0 FHADHM c1cn(-c2ccccc2)nc1N[C@H]1CCCc2cc(-c3nn[n-]n3)ccc21 ZINC000826520002 609271620 /nfs/dbraw/zinc/27/16/20/609271620.db2.gz XBOMAYKYWZPCAZ-SFHVURJKSA-N -1 3 357.421 3.542 20 0 FHADHM c1cnn(-c2cccc(N[C@H]3CCCc4cc(-c5nnn[n-]5)ccc43)c2)c1 ZINC000826517048 609274660 /nfs/dbraw/zinc/27/46/60/609274660.db2.gz NPBGYXJKYHJBPU-IBGZPJMESA-N -1 3 357.421 3.542 20 0 FHADHM c1cnn(-c2cccc(N[C@H]3CCCc4cc(-c5nn[n-]n5)ccc43)c2)c1 ZINC000826517048 609274662 /nfs/dbraw/zinc/27/46/62/609274662.db2.gz NPBGYXJKYHJBPU-IBGZPJMESA-N -1 3 357.421 3.542 20 0 FHADHM C[C@H](Nc1ccc2c(c1)CCCN2C)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824654897 609276350 /nfs/dbraw/zinc/27/63/50/609276350.db2.gz AEVKDSFTCNEIAJ-LBPRGKRZSA-N -1 3 352.417 3.561 20 0 FHADHM C[C@H](Nc1ccc2c(c1)CCCN2C)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824654897 609276352 /nfs/dbraw/zinc/27/63/52/609276352.db2.gz AEVKDSFTCNEIAJ-LBPRGKRZSA-N -1 3 352.417 3.561 20 0 FHADHM COCCCOc1ccccc1N[C@@H](C)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000826157397 609276751 /nfs/dbraw/zinc/27/67/51/609276751.db2.gz UBGUZMPLICZXFX-ZDUSSCGKSA-N -1 3 371.416 3.594 20 0 FHADHM COCCCOc1ccccc1N[C@@H](C)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000826157397 609276752 /nfs/dbraw/zinc/27/67/52/609276752.db2.gz UBGUZMPLICZXFX-ZDUSSCGKSA-N -1 3 371.416 3.594 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1nc(C2CC2)cs1 ZINC000824712949 609283467 /nfs/dbraw/zinc/28/34/67/609283467.db2.gz FQNRUGZWOJSOCX-FBOQAHMBSA-N -1 3 367.434 3.518 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1nc(C2CC2)cs1 ZINC000824712949 609283468 /nfs/dbraw/zinc/28/34/68/609283468.db2.gz FQNRUGZWOJSOCX-FBOQAHMBSA-N -1 3 367.434 3.518 20 0 FHADHM O=C(NC/C=C/c1ccccc1)c1c(Cl)cc(-c2nnn[n-]2)cc1Cl ZINC000826435648 609284324 /nfs/dbraw/zinc/28/43/24/609284324.db2.gz UDIVSZNHVKGWBV-QPJJXVBHSA-N -1 3 374.231 3.617 20 0 FHADHM O=C(NC/C=C/c1ccccc1)c1c(Cl)cc(-c2nn[n-]n2)cc1Cl ZINC000826435648 609284326 /nfs/dbraw/zinc/28/43/26/609284326.db2.gz UDIVSZNHVKGWBV-QPJJXVBHSA-N -1 3 374.231 3.617 20 0 FHADHM Cc1nnc(SCCCc2ccc(Cl)cc2)c(-c2nnn[n-]2)c1C ZINC000826336889 609308480 /nfs/dbraw/zinc/30/84/80/609308480.db2.gz SREUSPMEBZAKHK-UHFFFAOYSA-N -1 3 360.874 3.652 20 0 FHADHM Cc1nnc(SCCCc2ccc(Cl)cc2)c(-c2nn[n-]n2)c1C ZINC000826336889 609308482 /nfs/dbraw/zinc/30/84/82/609308482.db2.gz SREUSPMEBZAKHK-UHFFFAOYSA-N -1 3 360.874 3.652 20 0 FHADHM O=C(NCCC1CCC1)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000826436065 609328373 /nfs/dbraw/zinc/32/83/73/609328373.db2.gz GOWXTCDGYOJSMS-UHFFFAOYSA-N -1 3 363.421 3.579 20 0 FHADHM O=C(NCCC1CCC1)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000826436065 609328375 /nfs/dbraw/zinc/32/83/75/609328375.db2.gz GOWXTCDGYOJSMS-UHFFFAOYSA-N -1 3 363.421 3.579 20 0 FHADHM CC(C)(C)OCCSCc1ccc(-c2nnn[n-]2)cc1Br ZINC000824119254 609328596 /nfs/dbraw/zinc/32/85/96/609328596.db2.gz DXNFVPXBSBTISO-UHFFFAOYSA-N -1 3 371.304 3.678 20 0 FHADHM CC(C)(C)OCCSCc1ccc(-c2nn[n-]n2)cc1Br ZINC000824119254 609328598 /nfs/dbraw/zinc/32/85/98/609328598.db2.gz DXNFVPXBSBTISO-UHFFFAOYSA-N -1 3 371.304 3.678 20 0 FHADHM C[C@H](N[C@H]1CCCOc2ccc(F)cc21)c1ccc(-c2nn[n-]n2)cc1F ZINC000824545957 609330155 /nfs/dbraw/zinc/33/01/55/609330155.db2.gz FOVUITPBPMLCLF-GTNSWQLSSA-N -1 3 371.391 3.709 20 0 FHADHM COc1cc(Cl)ccc1CN[C@H](C)c1ccc(-c2nnn[n-]2)cc1F ZINC000826180169 609334787 /nfs/dbraw/zinc/33/47/87/609334787.db2.gz VISHAQIKFMPYAH-SNVBAGLBSA-N -1 3 361.808 3.519 20 0 FHADHM COc1cc(Cl)ccc1CN[C@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000826180169 609334789 /nfs/dbraw/zinc/33/47/89/609334789.db2.gz VISHAQIKFMPYAH-SNVBAGLBSA-N -1 3 361.808 3.519 20 0 FHADHM C[C@@H](Nc1cc(F)ccc1OC(F)F)c1ccc(-c2nnn[n-]2)cc1F ZINC000824648452 609347260 /nfs/dbraw/zinc/34/72/60/609347260.db2.gz GQXVTOGQVZAOTF-MRVPVSSYSA-N -1 3 367.306 3.919 20 0 FHADHM C[C@@H](Nc1cc(F)ccc1OC(F)F)c1ccc(-c2nn[n-]n2)cc1F ZINC000824648452 609347262 /nfs/dbraw/zinc/34/72/62/609347262.db2.gz GQXVTOGQVZAOTF-MRVPVSSYSA-N -1 3 367.306 3.919 20 0 FHADHM C[C@H](N[C@@H]1CCCOc2c(F)cccc21)c1ccc(-c2nn[n-]n2)cc1F ZINC000824546918 609348713 /nfs/dbraw/zinc/34/87/13/609348713.db2.gz LUAUUUIZKJCVSH-APPDUMDISA-N -1 3 371.391 3.709 20 0 FHADHM C[C@@H](Nc1ccc2c(c1)CC(C)(C)O2)c1ccc(-c2nnn[n-]2)cc1F ZINC000824658015 609349201 /nfs/dbraw/zinc/34/92/01/609349201.db2.gz UEFCBIIHAYDIGN-LLVKDONJSA-N -1 3 353.401 3.892 20 0 FHADHM C[C@@H](Nc1ccc2c(c1)CC(C)(C)O2)c1ccc(-c2nn[n-]n2)cc1F ZINC000824658015 609349202 /nfs/dbraw/zinc/34/92/02/609349202.db2.gz UEFCBIIHAYDIGN-LLVKDONJSA-N -1 3 353.401 3.892 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NCc1c(Cl)ccc2cccnc21 ZINC000826186059 609366199 /nfs/dbraw/zinc/36/61/99/609366199.db2.gz CABSOLCVNUXCBQ-UHFFFAOYSA-N -1 3 366.812 3.689 20 0 FHADHM O=C(Nc1ccccc1O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000826457851 609378006 /nfs/dbraw/zinc/37/80/06/609378006.db2.gz SOCIGBIFHOSUIA-UHFFFAOYSA-N -1 3 373.372 3.617 20 0 FHADHM O=C(Nc1ccccc1O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000826457851 609378007 /nfs/dbraw/zinc/37/80/07/609378007.db2.gz SOCIGBIFHOSUIA-UHFFFAOYSA-N -1 3 373.372 3.617 20 0 FHADHM CC1(C)CC[C@H](C(=O)Nc2nc(-c3cccc(-c4nnn[n-]4)c3)cs2)C1 ZINC000824795691 609396032 /nfs/dbraw/zinc/39/60/32/609396032.db2.gz CAKUYGAHFHZPBV-ZDUSSCGKSA-N -1 3 368.466 3.755 20 0 FHADHM CC1(C)CC[C@H](C(=O)Nc2nc(-c3cccc(-c4nn[n-]n4)c3)cs2)C1 ZINC000824795691 609396036 /nfs/dbraw/zinc/39/60/36/609396036.db2.gz CAKUYGAHFHZPBV-ZDUSSCGKSA-N -1 3 368.466 3.755 20 0 FHADHM C[C@@H](CSc1cccc(-c2nnn[n-]2)c1)C(=O)c1ccc(F)c(F)c1 ZINC000824450151 609434203 /nfs/dbraw/zinc/43/42/03/609434203.db2.gz SOOQRPLEWCVXPV-JTQLQIEISA-N -1 3 360.389 3.756 20 0 FHADHM C[C@@H](CSc1cccc(-c2nn[n-]n2)c1)C(=O)c1ccc(F)c(F)c1 ZINC000824450151 609434205 /nfs/dbraw/zinc/43/42/05/609434205.db2.gz SOOQRPLEWCVXPV-JTQLQIEISA-N -1 3 360.389 3.756 20 0 FHADHM CC(C)(C)Oc1c(F)cc(NCc2ccccc2-c2nnn[n-]2)cc1F ZINC000824119945 609444944 /nfs/dbraw/zinc/44/49/44/609444944.db2.gz UYRRBLZZXFKVLH-UHFFFAOYSA-N -1 3 359.380 3.934 20 0 FHADHM CC(C)(C)Oc1c(F)cc(NCc2ccccc2-c2nn[n-]n2)cc1F ZINC000824119945 609444946 /nfs/dbraw/zinc/44/49/46/609444946.db2.gz UYRRBLZZXFKVLH-UHFFFAOYSA-N -1 3 359.380 3.934 20 0 FHADHM COc1cc(NCc2cccc(-c3nnn[n-]3)c2)cc(OC)c1C(C)C ZINC000826181176 609446124 /nfs/dbraw/zinc/44/61/24/609446124.db2.gz OBFDZWQLAYGRHZ-UHFFFAOYSA-N -1 3 353.426 3.619 20 0 FHADHM COc1cc(NCc2cccc(-c3nn[n-]n3)c2)cc(OC)c1C(C)C ZINC000826181176 609446127 /nfs/dbraw/zinc/44/61/27/609446127.db2.gz OBFDZWQLAYGRHZ-UHFFFAOYSA-N -1 3 353.426 3.619 20 0 FHADHM Cn1nc(C(F)(F)F)c(CSc2ccc(-c3nnn[n-]3)cc2)c1Cl ZINC000826366125 609449467 /nfs/dbraw/zinc/44/94/67/609449467.db2.gz TWLBFTDCKFUCMJ-UHFFFAOYSA-N -1 3 374.779 3.565 20 0 FHADHM Cn1nc(C(F)(F)F)c(CSc2ccc(-c3nn[n-]n3)cc2)c1Cl ZINC000826366125 609449469 /nfs/dbraw/zinc/44/94/69/609449469.db2.gz TWLBFTDCKFUCMJ-UHFFFAOYSA-N -1 3 374.779 3.565 20 0 FHADHM Clc1cc2ncc(NCc3ccc(-c4nnn[n-]4)cc3)nc2cc1Cl ZINC000826351468 609462344 /nfs/dbraw/zinc/46/23/44/609462344.db2.gz NRTXSKDHLFMPBR-UHFFFAOYSA-N -1 3 372.219 3.729 20 0 FHADHM Clc1cc2ncc(NCc3ccc(-c4nn[n-]n4)cc3)nc2cc1Cl ZINC000826351468 609462346 /nfs/dbraw/zinc/46/23/46/609462346.db2.gz NRTXSKDHLFMPBR-UHFFFAOYSA-N -1 3 372.219 3.729 20 0 FHADHM CCCCOc1ccc(OC)cc1NCc1cccc(-c2nnn[n-]2)c1F ZINC000825296303 609475384 /nfs/dbraw/zinc/47/53/84/609475384.db2.gz COASHVNCYXBUQA-UHFFFAOYSA-N -1 3 371.416 3.805 20 0 FHADHM CCCCOc1ccc(OC)cc1NCc1cccc(-c2nn[n-]n2)c1F ZINC000825296303 609475385 /nfs/dbraw/zinc/47/53/85/609475385.db2.gz COASHVNCYXBUQA-UHFFFAOYSA-N -1 3 371.416 3.805 20 0 FHADHM Fc1cc(NCc2cccc(-c3nnn[n-]3)c2F)ccc1Br ZINC000826372759 609478876 /nfs/dbraw/zinc/47/88/76/609478876.db2.gz KQWWRVWRHZBHOL-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1cc(NCc2cccc(-c3nn[n-]n3)c2F)ccc1Br ZINC000826372759 609478878 /nfs/dbraw/zinc/47/88/78/609478878.db2.gz KQWWRVWRHZBHOL-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1cccc(Br)c1NCc1cccc(-c2nnn[n-]2)c1F ZINC000826376908 609479216 /nfs/dbraw/zinc/47/92/16/609479216.db2.gz XUNCFRPXIMIJDV-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1cccc(Br)c1NCc1cccc(-c2nn[n-]n2)c1F ZINC000826376908 609479218 /nfs/dbraw/zinc/47/92/18/609479218.db2.gz XUNCFRPXIMIJDV-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM CCOc1ccc(CNc2cc(-c3nnn[n-]3)ccc2C)cc1OCC ZINC000825639125 609480593 /nfs/dbraw/zinc/48/05/93/609480593.db2.gz RDIFNIWCKFHXLO-UHFFFAOYSA-N -1 3 353.426 3.585 20 0 FHADHM CCOc1ccc(CNc2cc(-c3nn[n-]n3)ccc2C)cc1OCC ZINC000825639125 609480594 /nfs/dbraw/zinc/48/05/94/609480594.db2.gz RDIFNIWCKFHXLO-UHFFFAOYSA-N -1 3 353.426 3.585 20 0 FHADHM CC(C)Oc1ccc(NCc2cnc3ccccc3c2)cc1-c1nnn[n-]1 ZINC000824329049 609492020 /nfs/dbraw/zinc/49/20/20/609492020.db2.gz GJKJETYMRZPAQH-UHFFFAOYSA-N -1 3 360.421 3.814 20 0 FHADHM CC(C)Oc1ccc(NCc2cnc3ccccc3c2)cc1-c1nn[n-]n1 ZINC000824329049 609492021 /nfs/dbraw/zinc/49/20/21/609492021.db2.gz GJKJETYMRZPAQH-UHFFFAOYSA-N -1 3 360.421 3.814 20 0 FHADHM Cc1cc(C)cc([C@@H]2CCN(C(=O)Nc3ccc(-c4nnn[n-]4)cc3)C2)c1 ZINC000826264578 609498151 /nfs/dbraw/zinc/49/81/51/609498151.db2.gz SUEBELDFFYEXRJ-MRXNPFEDSA-N -1 3 362.437 3.505 20 0 FHADHM Cc1cc(C)cc([C@@H]2CCN(C(=O)Nc3ccc(-c4nn[n-]n4)cc3)C2)c1 ZINC000826264578 609498153 /nfs/dbraw/zinc/49/81/53/609498153.db2.gz SUEBELDFFYEXRJ-MRXNPFEDSA-N -1 3 362.437 3.505 20 0 FHADHM CC[C@@H](C)[C@H](C)C(=O)Nc1ncc(Cc2ccc(-c3nnn[n-]3)cc2)s1 ZINC000825052143 609516915 /nfs/dbraw/zinc/51/69/15/609516915.db2.gz VANAKBVDOHVJMJ-NEPJUHHUSA-N -1 3 370.482 3.535 20 0 FHADHM CC[C@@H](C)[C@H](C)C(=O)Nc1ncc(Cc2ccc(-c3nn[n-]n3)cc2)s1 ZINC000825052143 609516916 /nfs/dbraw/zinc/51/69/16/609516916.db2.gz VANAKBVDOHVJMJ-NEPJUHHUSA-N -1 3 370.482 3.535 20 0 FHADHM CSc1c(F)cc(NC(=O)C=Cc2ccccc2-c2nnn[n-]2)cc1F ZINC000826229344 609517278 /nfs/dbraw/zinc/51/72/78/609517278.db2.gz APVYOJWOSRLXMX-SREVYHEPSA-N -1 3 373.388 3.519 20 0 FHADHM CSc1c(F)cc(NC(=O)C=Cc2ccccc2-c2nn[n-]n2)cc1F ZINC000826229344 609517281 /nfs/dbraw/zinc/51/72/81/609517281.db2.gz APVYOJWOSRLXMX-SREVYHEPSA-N -1 3 373.388 3.519 20 0 FHADHM Cc1c(Cl)cnc(N2CCC[C@H]2c2ccc(F)cc2)c1-c1nnn[n-]1 ZINC000826238057 609528568 /nfs/dbraw/zinc/52/85/68/609528568.db2.gz VDHIYQQTRLEAPG-AWEZNQCLSA-N -1 3 358.808 3.704 20 0 FHADHM Cc1c(Cl)cnc(N2CCC[C@H]2c2ccc(F)cc2)c1-c1nn[n-]n1 ZINC000826238057 609528569 /nfs/dbraw/zinc/52/85/69/609528569.db2.gz VDHIYQQTRLEAPG-AWEZNQCLSA-N -1 3 358.808 3.704 20 0 FHADHM Cc1c(Cl)cnc(NCc2ccc(OC(C)C)cc2)c1-c1nnn[n-]1 ZINC000826240515 609531198 /nfs/dbraw/zinc/53/11/98/609531198.db2.gz XPJYUSRTSUOJAJ-UHFFFAOYSA-N -1 3 358.833 3.623 20 0 FHADHM Cc1c(Cl)cnc(NCc2ccc(OC(C)C)cc2)c1-c1nn[n-]n1 ZINC000826240515 609531199 /nfs/dbraw/zinc/53/11/99/609531199.db2.gz XPJYUSRTSUOJAJ-UHFFFAOYSA-N -1 3 358.833 3.623 20 0 FHADHM Cc1ccnc(N[C@H]2CCCc3cc(OC(F)F)ccc32)c1-c1nnn[n-]1 ZINC000826312453 609543082 /nfs/dbraw/zinc/54/30/82/609543082.db2.gz DZALPRYFVYVRQQ-AWEZNQCLSA-N -1 3 372.379 3.661 20 0 FHADHM Cc1ccnc(N[C@H]2CCCc3cc(OC(F)F)ccc32)c1-c1nn[n-]n1 ZINC000826312453 609543084 /nfs/dbraw/zinc/54/30/84/609543084.db2.gz DZALPRYFVYVRQQ-AWEZNQCLSA-N -1 3 372.379 3.661 20 0 FHADHM Cc1c(Cl)cnc(N[C@@H]2CCCOc3ccccc32)c1-c1nnn[n-]1 ZINC000826239168 609543796 /nfs/dbraw/zinc/54/37/96/609543796.db2.gz ZEJRUABDHPPQJB-CYBMUJFWSA-N -1 3 356.817 3.549 20 0 FHADHM Cc1c(Cl)cnc(N[C@@H]2CCCOc3ccccc32)c1-c1nn[n-]n1 ZINC000826239168 609543797 /nfs/dbraw/zinc/54/37/97/609543797.db2.gz ZEJRUABDHPPQJB-CYBMUJFWSA-N -1 3 356.817 3.549 20 0 FHADHM CC[C@@H](Nc1ncc(Cl)c(C)c1-c1nnn[n-]1)c1nc2ccccc2[nH]1 ZINC000825148579 609546055 /nfs/dbraw/zinc/54/60/55/609546055.db2.gz REKRSUXPLJUJOP-LLVKDONJSA-N -1 3 368.832 3.663 20 0 FHADHM CC[C@@H](Nc1ncc(Cl)c(C)c1-c1nn[n-]n1)c1nc2ccccc2[nH]1 ZINC000825148579 609546057 /nfs/dbraw/zinc/54/60/57/609546057.db2.gz REKRSUXPLJUJOP-LLVKDONJSA-N -1 3 368.832 3.663 20 0 FHADHM COCC[C@H](Nc1ccc(C(F)(F)F)cc1-c1nnn[n-]1)c1ccco1 ZINC000826155496 609571790 /nfs/dbraw/zinc/57/17/90/609571790.db2.gz RUMCWPFCXRHVGX-ZDUSSCGKSA-N -1 3 367.331 3.668 20 0 FHADHM COCC[C@H](Nc1ccc(C(F)(F)F)cc1-c1nn[n-]n1)c1ccco1 ZINC000826155496 609571793 /nfs/dbraw/zinc/57/17/93/609571793.db2.gz RUMCWPFCXRHVGX-ZDUSSCGKSA-N -1 3 367.331 3.668 20 0 FHADHM CO[C@@](C)(C(=O)Nc1ccc(Br)cc1[O-])c1ccccc1F ZINC000583121760 937143045 /nfs/dbraw/zinc/14/30/45/937143045.db2.gz FZLQBHOFGAYMDP-MRXNPFEDSA-N -1 3 368.202 3.794 20 0 FHADHM CCc1sc(C(=O)N=c2cc3ccc(Br)cn3[n-]2)cc1C ZINC000430148627 927349418 /nfs/dbraw/zinc/34/94/18/927349418.db2.gz LQFIICZXMZVNDI-UHFFFAOYSA-N -1 3 364.268 3.703 20 0 FHADHM O=S(=O)([N-][C@@H]1CCC(F)(F)C1)c1cccc(Cl)c1Br ZINC000683143945 927460437 /nfs/dbraw/zinc/46/04/37/927460437.db2.gz PHLPNNODAOUBOZ-SSDOTTSWSA-N -1 3 374.634 3.569 20 0 FHADHM COc1ccc([C@@H](CC(=O)[O-])NCc2ccc(Br)s2)cc1 ZINC000683171068 927733247 /nfs/dbraw/zinc/73/32/47/927733247.db2.gz GAJOLMXUUDNKOY-CYBMUJFWSA-N -1 3 370.268 3.825 20 0 FHADHM COc1ccc([C@@H](CC(=O)[O-])NCc2cccc(Br)c2)cc1 ZINC000683171605 927747686 /nfs/dbraw/zinc/74/76/86/927747686.db2.gz MZWHRYJOISFZMS-MRXNPFEDSA-N -1 3 364.239 3.763 20 0 FHADHM Cc1ccc(CCN(Cc2ccco2)C(=O)N=c2cc3ccccn3[n-]2)cc1 ZINC000583162676 937192406 /nfs/dbraw/zinc/19/24/06/937192406.db2.gz VMEDMGGYCYCXKD-UHFFFAOYSA-N -1 3 374.444 3.934 20 0 FHADHM Cn1cc(CN[C@H]2C[C@@H](C(=O)[O-])c3ccccc32)c(C2CCCCC2)n1 ZINC000579814683 927849129 /nfs/dbraw/zinc/84/91/29/927849129.db2.gz AKLUBIRNIUFEBP-MOPGFXCFSA-N -1 3 353.466 3.871 20 0 FHADHM Cc1nc(-c2ccc(F)cc2)sc1C(=O)Nc1nnc(C(F)(F)F)[n-]1 ZINC000029389152 927849240 /nfs/dbraw/zinc/84/92/40/927849240.db2.gz VXWDGRJZVGNESC-UHFFFAOYSA-N -1 3 371.319 3.647 20 0 FHADHM Cc1nc(-c2ccc(F)cc2)sc1C(=O)Nc1nc(C(F)(F)F)n[n-]1 ZINC000029389152 927849247 /nfs/dbraw/zinc/84/92/47/927849247.db2.gz VXWDGRJZVGNESC-UHFFFAOYSA-N -1 3 371.319 3.647 20 0 FHADHM CC(C)(C)OC(=O)Nc1ccc(NC([O-])=NO[C@H]2CCCCO2)cc1 ZINC000274753726 927902665 /nfs/dbraw/zinc/90/26/65/927902665.db2.gz BKSXFOVQVUNVFU-AWEZNQCLSA-N -1 3 351.403 3.613 20 0 FHADHM CC(C)(C)OC(=O)Nc1ccc(NC(=O)[N-]O[C@H]2CCCCO2)cc1 ZINC000274753726 927902675 /nfs/dbraw/zinc/90/26/75/927902675.db2.gz BKSXFOVQVUNVFU-AWEZNQCLSA-N -1 3 351.403 3.613 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)c1ccccc1Oc1ccccc1 ZINC000007717563 928079289 /nfs/dbraw/zinc/07/92/89/928079289.db2.gz SLINCAGXDBDUTR-UHFFFAOYSA-N -1 3 357.373 3.911 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)c1ccccc1Oc1ccccc1 ZINC000007717563 928079298 /nfs/dbraw/zinc/07/92/98/928079298.db2.gz SLINCAGXDBDUTR-UHFFFAOYSA-N -1 3 357.373 3.911 20 0 FHADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)[C@@H](C)c3c(F)cccc3F)cc2)n1 ZINC000154784911 937254731 /nfs/dbraw/zinc/25/47/31/937254731.db2.gz JBCLETWFSOPAGE-LBPRGKRZSA-N -1 3 369.371 3.766 20 0 FHADHM CCc1csc(CC2CCN(C(=O)c3ccc(OC)cc3[O-])CC2)n1 ZINC000655259935 928567404 /nfs/dbraw/zinc/56/74/04/928567404.db2.gz CGCZLZBIVIACLK-UHFFFAOYSA-N -1 3 360.479 3.515 20 0 FHADHM COc1cc(C(=O)NCCc2cccc3ccccc32)cc(OC)c1[O-] ZINC000179497711 928779710 /nfs/dbraw/zinc/77/97/10/928779710.db2.gz KFGXDHHJYQMUBT-UHFFFAOYSA-N -1 3 351.402 3.535 20 0 FHADHM CC(C)CCOc1ccc(NC(=O)c2cc(=O)[n-]c(C3CC3)n2)c(F)c1 ZINC000655360622 928788826 /nfs/dbraw/zinc/78/88/26/928788826.db2.gz LLMWECMTQUPLDG-UHFFFAOYSA-N -1 3 359.401 3.876 20 0 FHADHM O=C(NCc1ncccc1[O-])c1ccc(-c2ccc(C(F)(F)F)cc2)o1 ZINC000510126277 928797778 /nfs/dbraw/zinc/79/77/78/928797778.db2.gz AWGPOKUDMFVTCS-UHFFFAOYSA-N -1 3 362.307 3.996 20 0 FHADHM COC(=O)[C@H](C)S[C@@H](C)c1nc(=O)c2c(-c3ccco3)csc2[n-]1 ZINC000154446000 928838171 /nfs/dbraw/zinc/83/81/71/928838171.db2.gz SFUSYMOHYCULKG-IUCAKERBSA-N -1 3 364.448 3.600 20 0 FHADHM Cc1cccc(NC(=O)c2cc(S(=O)(=O)[N-]c3ccccc3F)c[nH]2)c1 ZINC000047268058 928847621 /nfs/dbraw/zinc/84/76/21/928847621.db2.gz RGTMYUMOVJKBGE-UHFFFAOYSA-N -1 3 373.409 3.515 20 0 FHADHM Cc1ccc(NC(=O)c2cc(S(=O)(=O)[N-]c3ccccc3F)c[nH]2)cc1 ZINC000047268098 928848319 /nfs/dbraw/zinc/84/83/19/928848319.db2.gz DHFVMADBSGCBDY-UHFFFAOYSA-N -1 3 373.409 3.515 20 0 FHADHM Cc1ccc(NC(=O)OC(C)(C)C)cc1NC([O-])=NO[C@H]1CCCCO1 ZINC000274876799 928952897 /nfs/dbraw/zinc/95/28/97/928952897.db2.gz YTHFOQCRIAQNMN-HNNXBMFYSA-N -1 3 365.430 3.922 20 0 FHADHM Cc1ccc(NC(=O)OC(C)(C)C)cc1NC(=O)[N-]O[C@H]1CCCCO1 ZINC000274876799 928952905 /nfs/dbraw/zinc/95/29/05/928952905.db2.gz YTHFOQCRIAQNMN-HNNXBMFYSA-N -1 3 365.430 3.922 20 0 FHADHM Cc1conc1[N-]C(=O)c1nc(-c2cccs2)n(-c2cccc(F)c2)n1 ZINC000123621383 929279440 /nfs/dbraw/zinc/27/94/40/929279440.db2.gz UBMWZHNXZILOAQ-UHFFFAOYSA-N -1 3 369.381 3.684 20 0 FHADHM O=S(=O)([N-]c1ccc(F)cc1Br)c1ccc(F)cc1F ZINC000037327357 929331811 /nfs/dbraw/zinc/33/18/11/929331811.db2.gz REUVZGNTGVJRMA-UHFFFAOYSA-N -1 3 366.158 3.667 20 0 FHADHM O=S(=O)([N-]CC1(C2CC2)CC1)c1c(Cl)cccc1Br ZINC000305952712 929576729 /nfs/dbraw/zinc/57/67/29/929576729.db2.gz AJLKDHJJCOSTGE-UHFFFAOYSA-N -1 3 364.692 3.571 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2cccc3c2CN(C(C)C)C3)c(C)c1 ZINC000180713722 929624041 /nfs/dbraw/zinc/62/40/41/929624041.db2.gz UPBBYRAALSTVCK-UHFFFAOYSA-N -1 3 360.479 3.528 20 0 FHADHM CCc1ccc([O-])c(C(=O)Nc2cccc(CN3CCCCC3=O)c2)c1 ZINC000109821221 929639180 /nfs/dbraw/zinc/63/91/80/929639180.db2.gz QDZXNINYJMENFH-UHFFFAOYSA-N -1 3 352.434 3.719 20 0 FHADHM C[C@H](c1ccc(Cl)cc1Cl)S(=O)(=O)c1nnc(C(C)(C)C)[n-]1 ZINC000683688228 929791875 /nfs/dbraw/zinc/79/18/75/929791875.db2.gz GAVLIBBQDVJQSV-MRVPVSSYSA-N -1 3 362.282 3.944 20 0 FHADHM O=C([N-][C@@H](c1ccccc1)c1ccc2nc[nH]c2c1)C(F)(F)C(F)F ZINC000175865524 930077090 /nfs/dbraw/zinc/07/70/90/930077090.db2.gz WUVWSHNQWOFVRZ-AWEZNQCLSA-N -1 3 351.303 3.669 20 0 FHADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CC[C@]2(O)CCCC[C@H]2C1 ZINC000092759376 937388674 /nfs/dbraw/zinc/38/86/74/937388674.db2.gz GEVOQMLGTBFYMO-WMZHIEFXSA-N -1 3 365.473 3.750 20 0 FHADHM CC(C)COC[C@H]([N-]S(=O)(=O)/C=C\c1ccc(F)cc1)c1ccco1 ZINC000255168313 930238839 /nfs/dbraw/zinc/23/88/39/930238839.db2.gz JAZKJBLOEBGARS-CCCPALQASA-N -1 3 367.442 3.723 20 0 FHADHM Cc1cc(C)n(-c2ccc(Cl)c(C(=O)[N-]c3nnc(C4CC4)s3)n2)n1 ZINC000124239011 930308095 /nfs/dbraw/zinc/30/80/95/930308095.db2.gz PRUIQRAGGRCBIK-UHFFFAOYSA-N -1 3 374.857 3.519 20 0 FHADHM [O-]c1cccc(Nc2cncc(F)c2I)c1Cl ZINC001210844847 930400002 /nfs/dbraw/zinc/40/00/02/930400002.db2.gz NIZSMGPMFAAPMD-UHFFFAOYSA-N -1 3 364.545 3.928 20 0 FHADHM O=C(Nc1n[n-]c(-c2ccco2)n1)c1cc(Br)ccc1Cl ZINC000128072870 930459704 /nfs/dbraw/zinc/45/97/04/930459704.db2.gz QLEVAXQKIJSHSZ-UHFFFAOYSA-N -1 3 367.590 3.733 20 0 FHADHM Cc1ccc(-c2nc(CC(=O)Nc3n[n-]c(-c4ccco4)n3)cs2)cc1 ZINC000128087923 930462724 /nfs/dbraw/zinc/46/27/24/930462724.db2.gz VYRGXFSBPPOURW-UHFFFAOYSA-N -1 3 365.418 3.678 20 0 FHADHM COc1cc(C(=O)Nc2ncccc2[O-])ccc1OCc1ccccc1 ZINC000022263322 930590526 /nfs/dbraw/zinc/59/05/26/930590526.db2.gz VULQZDMGCKVQHQ-UHFFFAOYSA-N -1 3 350.374 3.627 20 0 FHADHM Cc1noc(C)c1S(=O)(=O)[N-][C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000580391249 930617308 /nfs/dbraw/zinc/61/73/08/930617308.db2.gz BMJHFACENAZFFG-MQMHXKEQSA-N -1 3 374.384 3.535 20 0 FHADHM CCOc1cc2c(cc1OCC)CN(CCc1ccccc1C(=O)[O-])CC2 ZINC000580440738 930680188 /nfs/dbraw/zinc/68/01/88/930680188.db2.gz OHPPWFVHWGLTTI-UHFFFAOYSA-N -1 3 369.461 3.783 20 0 FHADHM CCc1nc(=N)n(-c2ccc(F)c([O-])c2)c(N)c1-c1ccc(Cl)cc1 ZINC001211214583 930868716 /nfs/dbraw/zinc/86/87/16/930868716.db2.gz DUWJWYSQTQOCED-UHFFFAOYSA-N -1 3 358.804 3.661 20 0 FHADHM CCc1cc(=O)[n-]c(CN2CCC[C@H]2c2ccc(Br)s2)n1 ZINC000580626454 930944592 /nfs/dbraw/zinc/94/45/92/930944592.db2.gz XHFLIFAIXVGFPW-NSHDSACASA-N -1 3 368.300 3.906 20 0 FHADHM O=S(=O)([N-][C@H]1CCC[C@H](F)C1)c1cccc(Cl)c1Br ZINC000580770863 931124635 /nfs/dbraw/zinc/12/46/35/931124635.db2.gz DQLBECOJSKYLOU-IUCAKERBSA-N -1 3 370.671 3.662 20 0 FHADHM CCCc1ccc2nccc(N3CCC([C@@H]4OCC[C@H]4C(=O)[O-])CC3)c2c1 ZINC000580777514 931142448 /nfs/dbraw/zinc/14/24/48/931142448.db2.gz XBALRXGWYLWABH-UTKZUKDTSA-N -1 3 368.477 3.893 20 0 FHADHM COCCOCc1cccc([N-]S(=O)(=O)c2c(C)cc(C)cc2C)c1 ZINC000055632697 931171121 /nfs/dbraw/zinc/17/11/21/931171121.db2.gz 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ZINC000656444419 931736532 /nfs/dbraw/zinc/73/65/32/931736532.db2.gz AGUOCPHYLXRERO-NOZJJQNGSA-N -1 3 353.768 3.596 20 0 FHADHM Cc1cc(C(=O)Nc2cc(I)ccc2[O-])ccc1F ZINC000610490676 931766734 /nfs/dbraw/zinc/76/67/34/931766734.db2.gz GQJWMOOAZKSXQV-UHFFFAOYSA-N -1 3 371.149 3.697 20 0 FHADHM Cc1ncc(NC(=O)c2c[n-]c3ccc(Oc4ccccc4)cc3c2=O)cn1 ZINC000430559507 931843870 /nfs/dbraw/zinc/84/38/70/931843870.db2.gz CXMQAEFYFCGURC-UHFFFAOYSA-N -1 3 372.384 3.671 20 0 FHADHM CCOc1cc(CN2C[C@@H](NC(C)=O)Cc3ccccc32)cc(Cl)c1[O-] ZINC000656533655 932022423 /nfs/dbraw/zinc/02/24/23/932022423.db2.gz SIZUDCRWDKDHNB-INIZCTEOSA-N -1 3 374.868 3.512 20 0 FHADHM CCn1cnnc1-c1ccccc1[N-]S(=O)(=O)/C=C\c1ccc(F)cc1 ZINC000255310745 932144243 /nfs/dbraw/zinc/14/42/43/932144243.db2.gz PBMAVRRBEQRWGM-QXMHVHEDSA-N -1 3 372.425 3.517 20 0 FHADHM C[C@@H]1CCC[C@@H](OCC(=O)Nc2n[n-]c(-c3cc4ccccc4o3)n2)C1 ZINC000581523832 932204344 /nfs/dbraw/zinc/20/43/44/932204344.db2.gz DPHGGUOKIIMPLE-TZMCWYRMSA-N -1 3 354.410 3.752 20 0 FHADHM CO[C@H](CS(=O)(=O)[N-]c1ccc2c(c1)C(=O)CCC2)C1CCCCC1 ZINC000656623906 932207200 /nfs/dbraw/zinc/20/72/00/932207200.db2.gz KKYWBXJKNGTEKA-LJQANCHMSA-N -1 3 365.495 3.543 20 0 FHADHM CCCCn1ncc([N-]S(=O)(=O)CCc2ccccc2Cl)c1C ZINC000656626845 932213574 /nfs/dbraw/zinc/21/35/74/932213574.db2.gz VYDBJXHJYJMCQI-UHFFFAOYSA-N -1 3 355.891 3.629 20 0 FHADHM Cc1c([N-]S(=O)(=O)CCc2ccccc2Cl)cnn1C1CCCC1 ZINC000656628010 932215075 /nfs/dbraw/zinc/21/50/75/932215075.db2.gz JINQRJFVLJWQHQ-UHFFFAOYSA-N -1 3 367.902 3.944 20 0 FHADHM CO[C@H](CS(=O)(=O)[N-]c1c(F)cc(Cl)c(C)c1F)C1CCCC1 ZINC000656626651 932216958 /nfs/dbraw/zinc/21/69/58/932216958.db2.gz NQZYOQRAYDNPDR-CYBMUJFWSA-N -1 3 367.845 3.874 20 0 FHADHM CC(=O)N(C)c1ccc(S(=O)(=O)[N-]c2ccc3c(c2)C=CCCC3)cc1 ZINC000656635646 932228417 /nfs/dbraw/zinc/22/84/17/932228417.db2.gz AYUAXRCAFABEOY-UHFFFAOYSA-N -1 3 370.474 3.820 20 0 FHADHM CC(=O)c1cccc(NC(=O)c2cc(C)n(-c3ccccc3Cl)n2)c1[O-] ZINC000581629520 932346774 /nfs/dbraw/zinc/34/67/74/932346774.db2.gz XOCGFBOZOJRKIX-UHFFFAOYSA-N -1 3 369.808 3.995 20 0 FHADHM Cc1cc(=O)cc(C)n1CCCC(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000581638094 932362289 /nfs/dbraw/zinc/36/22/89/932362289.db2.gz CLGQVJACKZIKME-UHFFFAOYSA-N -1 3 368.355 3.608 20 0 FHADHM COc1ccc([C@@H]2CCCN2CCOc2cccc(C(=O)[O-])c2)cc1F ZINC000656762191 932395704 /nfs/dbraw/zinc/39/57/04/932395704.db2.gz AJQSFPOJGWQDCW-SFHVURJKSA-N -1 3 359.397 3.748 20 0 FHADHM Cc1cccc(-c2noc(CN3CC[C@H](C(=O)[O-])[C@H]4CCCC[C@@H]43)n2)c1 ZINC000656764596 932397409 /nfs/dbraw/zinc/39/74/09/932397409.db2.gz KZUUSXUQJDCDBJ-IKGGRYGDSA-N -1 3 355.438 3.510 20 0 FHADHM O=C([O-])c1ccc(OCCN2CCC([C@H]3CCCCO3)CC2)c(Cl)c1 ZINC000656767966 932404759 /nfs/dbraw/zinc/40/47/59/932404759.db2.gz IMKSDWKOVQLLIJ-QGZVFWFLSA-N -1 3 367.873 3.698 20 0 FHADHM Cc1cc(-c2csc(NC(=O)c3cc(=O)[n-]c(C4CC4)n3)n2)c(C)o1 ZINC000581675133 932465249 /nfs/dbraw/zinc/46/52/49/932465249.db2.gz ITTICXSKUDAZSP-UHFFFAOYSA-N -1 3 356.407 3.645 20 0 FHADHM C[C@H](C(=O)Nc1ccccc1Sc1ccccc1)N(C)CCCC(=O)[O-] ZINC000430665176 932803026 /nfs/dbraw/zinc/80/30/26/932803026.db2.gz QHSNUYPKKVLIET-OAHLLOKOSA-N -1 3 372.490 3.961 20 0 FHADHM CCC(CC)c1cc(C[N-]S(=O)(=O)C[C@@H](OC)C2CCCCC2)on1 ZINC000656919824 932813209 /nfs/dbraw/zinc/81/32/09/932813209.db2.gz VNTSTTQYVHVNJZ-GOSISDBHSA-N -1 3 372.531 3.593 20 0 FHADHM CCC1(CNC(=O)c2cc(=O)c3cc(Br)ccc3[n-]2)CCC1 ZINC000084381853 932984804 /nfs/dbraw/zinc/98/48/04/932984804.db2.gz TVMWYASCGBJGBC-UHFFFAOYSA-N -1 3 363.255 3.601 20 0 FHADHM CCN(c1ccc([N-]S(=O)(=O)c2ccc(C(C)=O)cc2)cc1)C(C)C ZINC000326453596 933011153 /nfs/dbraw/zinc/01/11/53/933011153.db2.gz DWVIMQVIKLDCED-UHFFFAOYSA-N -1 3 360.479 3.925 20 0 FHADHM Cc1ccc(Cl)c(S(=O)(=O)[N-]C[C@@H](C)c2ccccn2)c1Cl ZINC000657038850 933014612 /nfs/dbraw/zinc/01/46/12/933014612.db2.gz FKROPHZMYMRVNU-LLVKDONJSA-N -1 3 359.278 3.779 20 0 FHADHM C[C@H](Cc1ccc(Cl)cc1Cl)NC(=O)NCc1ncccc1[O-] ZINC000471817594 933029260 /nfs/dbraw/zinc/02/92/60/933029260.db2.gz VHFPXHHMLMAVKG-SNVBAGLBSA-N -1 3 354.237 3.524 20 0 FHADHM Cc1ccccc1-c1nc(C(=O)[N-]c2nc3ccc(F)cn3n2)cs1 ZINC000085741595 933071362 /nfs/dbraw/zinc/07/13/62/933071362.db2.gz MSHSNTPQIAJWNV-UHFFFAOYSA-N -1 3 353.382 3.553 20 0 FHADHM [O-]c1cc(F)cc(CN2CCCC[C@H]2c2nnc(C3CCOCC3)o2)c1 ZINC000276776121 933327026 /nfs/dbraw/zinc/32/70/26/933327026.db2.gz CVIQPAYBNNQSEZ-KRWDZBQOSA-N -1 3 361.417 3.536 20 0 FHADHM O=C(NCc1ncccc1[O-])N[C@H]1CCc2c1ccc(Cl)c2Cl ZINC000471890902 933511104 /nfs/dbraw/zinc/51/11/04/933511104.db2.gz UBDPDODFBUJJTF-LBPRGKRZSA-N -1 3 352.221 3.581 20 0 FHADHM CCS[C@@H]1CC[C@H](N(C)C(=O)c2c[n-]c3cc(F)c(F)cc3c2=O)C1 ZINC000933801332 933549077 /nfs/dbraw/zinc/54/90/77/933549077.db2.gz LYOGUDBRBLJGDU-WDEREUQCSA-N -1 3 366.433 3.553 20 0 FHADHM Cc1ccsc1[C@@H](Cc1ccccc1)NC(=O)NCc1ncccc1[O-] ZINC000471914237 933699062 /nfs/dbraw/zinc/69/90/62/933699062.db2.gz GFECZVRSAYWZBX-MRXNPFEDSA-N -1 3 367.474 3.940 20 0 FHADHM Cc1ncc(S(=O)(=O)[N-][C@H](C)c2ccc(C(F)(F)F)cc2)s1 ZINC000431063834 933756491 /nfs/dbraw/zinc/75/64/91/933756491.db2.gz ATPLDQQMLIMXMH-MRVPVSSYSA-N -1 3 350.387 3.510 20 0 FHADHM COC(=O)c1cc(F)cc([N-]C(=O)c2nsc3ccc(C)cc32)c1F ZINC000510826273 933818088 /nfs/dbraw/zinc/81/80/88/933818088.db2.gz NNDDWKYWEAFYQF-UHFFFAOYSA-N -1 3 362.357 3.922 20 0 FHADHM C[C@@H](NC(=O)c1c([O-])cccc1O)c1ccc(OCC(F)(F)F)cc1 ZINC000092120003 933882780 /nfs/dbraw/zinc/88/27/80/933882780.db2.gz BJQOEPUCWMWBKH-SNVBAGLBSA-N -1 3 355.312 3.530 20 0 FHADHM Cc1nn(-c2ccccc2C)c(C)c1CN(C)Cc1nc(C)ccc1[O-] ZINC000092485988 934071873 /nfs/dbraw/zinc/07/18/73/934071873.db2.gz ILKYSAJXWNYLMI-UHFFFAOYSA-N -1 3 350.466 3.839 20 0 FHADHM Cc1ccc(Cl)c(S(=O)(=O)[N-]C2C[C@@H](C)O[C@H](C)C2)c1Cl ZINC000535764937 934349697 /nfs/dbraw/zinc/34/96/97/934349697.db2.gz GOVZBXQVHZLQMW-NXEZZACHSA-N -1 3 352.283 3.536 20 0 FHADHM CC(C)([N-]S(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)C(F)F ZINC000684599062 934391547 /nfs/dbraw/zinc/39/15/47/934391547.db2.gz GBZZJWGWKJQQNF-UHFFFAOYSA-N -1 3 351.724 3.681 20 0 FHADHM Cc1nc(-c2ccncc2)[n-]c(=O)c1CCC(=O)N[C@@H]1CCC[C@@H](C)CC1 ZINC000277010524 934452889 /nfs/dbraw/zinc/45/28/89/934452889.db2.gz AUCFATDDHKNEKE-RHSMWYFYSA-N -1 3 368.481 3.570 20 0 FHADHM CCOc1cc(CNCc2ccccc2CC(=O)[O-])cc(Cl)c1OC ZINC000277014919 934454756 /nfs/dbraw/zinc/45/47/56/934454756.db2.gz NNLZPRSGJGNVTO-UHFFFAOYSA-N -1 3 363.841 3.664 20 0 FHADHM COc1ccc(CN[C@@H](CC(=O)[O-])c2ccsc2)cc1OC(F)F ZINC000277026752 934458713 /nfs/dbraw/zinc/45/87/13/934458713.db2.gz OZZCOZZYSCMGIS-LBPRGKRZSA-N -1 3 357.378 3.664 20 0 FHADHM C[C@@]1(C[N-]S(=O)(=O)c2cc3cc(Cl)ccc3s2)CC1(F)F ZINC000657155415 934519196 /nfs/dbraw/zinc/51/91/96/934519196.db2.gz IQEXIIRTWOQRIW-LBPRGKRZSA-N -1 3 351.827 3.878 20 0 FHADHM COCCOc1ccccc1[N-]S(=O)(=O)/C=C\c1cccc(Cl)c1 ZINC000588482167 934666206 /nfs/dbraw/zinc/66/62/06/934666206.db2.gz KPEGJUKYNACGFI-XFXZXTDPSA-N -1 3 367.854 3.778 20 0 FHADHM CC(C)[C@@H](NC(=O)c1c[n-]c2ccccc2c1=O)c1nc2ccccc2[nH]1 ZINC000097106182 934669172 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/nfs/dbraw/zinc/48/16/17/942481617.db2.gz AEVGVCVUPMHDIB-KBXCAEBGSA-N -1 3 374.843 3.531 20 0 FHADHM COc1cc(Br)ccc1CNC(=O)c1cc([O-])ccc1Cl ZINC000501503006 942513465 /nfs/dbraw/zinc/51/34/65/942513465.db2.gz KMUYORONBMVRIG-UHFFFAOYSA-N -1 3 370.630 3.747 20 0 FHADHM CCCCc1nc(NC(=O)Cc2sc(C)cc2C)c(C(=O)OCC)[n-]1 ZINC001269123977 942523832 /nfs/dbraw/zinc/52/38/32/942523832.db2.gz PQNCTUWLPIMNAY-UHFFFAOYSA-N -1 3 363.483 3.789 20 0 FHADHM CC(=O)c1ccc(C(=O)N2CCC[C@@H]2Cc2cc(F)ccc2F)cc1[O-] ZINC000420111231 942525754 /nfs/dbraw/zinc/52/57/54/942525754.db2.gz GFVFBTCMPDZEHE-MRXNPFEDSA-N -1 3 359.372 3.720 20 0 FHADHM Cc1nc2cccc(C(=O)Nc3cc(C)cc(Br)c3[O-])c2[nH]1 ZINC000549414091 942541502 /nfs/dbraw/zinc/54/15/02/942541502.db2.gz AHHMZJTZRVCJGT-UHFFFAOYSA-N -1 3 360.211 3.900 20 0 FHADHM O=C(CC1(C(F)(F)F)CC1)NCc1ccc([O-])c(Br)c1 ZINC000501762824 942665093 /nfs/dbraw/zinc/66/50/93/942665093.db2.gz CSAJLXFDKTXHLC-UHFFFAOYSA-N -1 3 352.150 3.504 20 0 FHADHM O=C(NCc1nccn1CCCc1ccccc1)c1cc([O-])ccc1Cl ZINC000431863516 942686981 /nfs/dbraw/zinc/68/69/81/942686981.db2.gz RYMVWUMALMUFPG-UHFFFAOYSA-N -1 3 369.852 3.805 20 0 FHADHM O=C(Nc1ccc(Cl)cc1OC(F)F)c1cc(F)cc2n[n-]nc21 ZINC000502876287 942807779 /nfs/dbraw/zinc/80/77/79/942807779.db2.gz MSWXXKRVVXHFSD-UHFFFAOYSA-N -1 3 356.691 3.604 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)N[C@@H](C)Cc3cccs3)cc2)cc(=O)[n-]1 ZINC000502973215 942873383 /nfs/dbraw/zinc/87/33/83/942873383.db2.gz YEZYUJRWMHLPIK-LBPRGKRZSA-N -1 3 368.462 3.972 20 0 FHADHM CCOc1cc(CNCc2c(F)ccc([O-])c2F)ccc1OC(F)F ZINC000509990374 942885313 /nfs/dbraw/zinc/88/53/13/942885313.db2.gz BYMLZSGSRPJTAR-UHFFFAOYSA-N -1 3 359.319 3.960 20 0 FHADHM C[C@@H](NC(=O)c1cc(F)cc2n[n-]nc21)c1ccccc1C(F)(F)F ZINC000502990820 942887200 /nfs/dbraw/zinc/88/72/00/942887200.db2.gz PNNBCJKEFUBCJZ-MRVPVSSYSA-N -1 3 352.291 3.607 20 0 FHADHM O=C(N[C@@H](c1ccc(Cl)cc1)C(F)(F)F)c1cc(F)cc2n[n-]nc21 ZINC000502992336 942889625 /nfs/dbraw/zinc/88/96/25/942889625.db2.gz PJQJAAHKCHMPFA-ZDUSSCGKSA-N -1 3 372.709 3.784 20 0 FHADHM COc1cc(C(=O)N[C@H](CC(F)F)c2ccccc2)cc(OC)c1[O-] ZINC000422024294 942941600 /nfs/dbraw/zinc/94/16/00/942941600.db2.gz LLHZULJSZPQDNR-CYBMUJFWSA-N -1 3 351.349 3.536 20 0 FHADHM CC[C@@H](C[N-]S(=O)(=O)c1cc(OC)ccc1Cl)CC(F)(F)F ZINC000416591698 942994296 /nfs/dbraw/zinc/99/42/96/942994296.db2.gz HYLVIARKWXUVNM-SECBINFHSA-N -1 3 359.797 3.606 20 0 FHADHM CO[C@@H]1CCN(Cc2nc(=O)c3c(-c4ccco4)csc3[n-]2)[C@H](C)C1 ZINC000282233854 943066745 /nfs/dbraw/zinc/06/67/45/943066745.db2.gz FRGMOBDENHCMCY-VXGBXAGGSA-N -1 3 359.451 3.656 20 0 FHADHM COc1cc(Br)c(CN[C@H](CCC(C)(C)C)C(=O)[O-])cc1O ZINC000414645651 943074153 /nfs/dbraw/zinc/07/41/53/943074153.db2.gz ADYUAHDSZVIBTM-GFCCVEGCSA-N -1 3 374.275 3.532 20 0 FHADHM CC1C[C@H]2CC[C@@H](C1)N2C(=O)NCc1ccc([O-])c(Br)c1 ZINC000664471362 943168256 /nfs/dbraw/zinc/16/82/56/943168256.db2.gz PBKMSBJPMPOHBL-VGPLMAKISA-N -1 3 353.260 3.627 20 0 FHADHM CC(C)[C@@H]1C[C@H](CC(=O)NCc2ccc([O-])c(Br)c2)CCO1 ZINC000272848818 943232951 /nfs/dbraw/zinc/23/29/51/943232951.db2.gz QOAWXSQZPZVZKI-WBMJQRKESA-N -1 3 370.287 3.612 20 0 FHADHM O=C(Nc1ccc2nc(-c3ccccn3)oc2c1)c1cc(F)cc2n[n-]nc21 ZINC000503553945 943257386 /nfs/dbraw/zinc/25/73/86/943257386.db2.gz JHJRIRMJUXLOEQ-UHFFFAOYSA-N -1 3 374.335 3.553 20 0 FHADHM O=C([O-])CCCCCNCc1nc(-c2cccc(Br)c2)c[nH]1 ZINC000414688315 943273997 /nfs/dbraw/zinc/27/39/97/943273997.db2.gz YMCVSVRVBQDCIG-UHFFFAOYSA-N -1 3 366.259 3.574 20 0 FHADHM O=C([N-]c1ccccc1SC(F)F)c1cnc(C2OCCO2)s1 ZINC000283159348 943281885 /nfs/dbraw/zinc/28/18/85/943281885.db2.gz VONUACNQPJAVAB-UHFFFAOYSA-N -1 3 358.391 3.756 20 0 FHADHM CCCc1noc2nc(CC)cc(C(=O)NCc3ccc([O-])c(F)c3)c12 ZINC000503679663 943327662 /nfs/dbraw/zinc/32/76/62/943327662.db2.gz FXRKQADFWJKLMV-UHFFFAOYSA-N -1 3 357.385 3.512 20 0 FHADHM COc1cccc(C(=O)Nc2ccc(-c3cn4ccccc4n3)cc2)c1[O-] ZINC000514908299 943378607 /nfs/dbraw/zinc/37/86/07/943378607.db2.gz QOOPHAKMBRXCAR-UHFFFAOYSA-N -1 3 359.385 3.968 20 0 FHADHM Cc1ncc(CNC(=O)Nc2cccc(Oc3ccccc3)c2)c(=O)[n-]1 ZINC000514968345 943434851 /nfs/dbraw/zinc/43/48/51/943434851.db2.gz ABJPTLULCDKUAL-UHFFFAOYSA-N -1 3 350.378 3.605 20 0 FHADHM CC(=O)c1ccc(C(=O)N2CC[C@H](C(F)(F)F)C3(CCC3)C2)cc1[O-] ZINC000515000543 943443478 /nfs/dbraw/zinc/44/34/78/943443478.db2.gz FOOJBFPQBSVMDD-HNNXBMFYSA-N -1 3 355.356 3.790 20 0 FHADHM Cc1nc2ccc(CN[C@@]3(C(=O)[O-])CCc4c3cccc4F)cc2s1 ZINC000515004128 943445486 /nfs/dbraw/zinc/44/54/86/943445486.db2.gz LTBUZHSYTXEGSA-IBGZPJMESA-N -1 3 356.422 3.760 20 0 FHADHM CCN(C(=O)c1cc(F)cc2n[n-]nc21)c1cccc(Br)c1 ZINC000503977622 943448858 /nfs/dbraw/zinc/44/88/58/943448858.db2.gz SAMZTZTUUPRQAG-UHFFFAOYSA-N -1 3 363.190 3.526 20 0 FHADHM CCc1cccc(C(=O)N2CC3(CCOCC3)[C@H]2c2ccccc2)c1[O-] ZINC000515044600 943471162 /nfs/dbraw/zinc/47/11/62/943471162.db2.gz XQDLBCSUKYDKTL-HXUWFJFHSA-N -1 3 351.446 3.949 20 0 FHADHM COC[C@@H]([N-]S(=O)(=O)c1ccccc1SC)c1cccc(Cl)c1 ZINC000515086601 943493501 /nfs/dbraw/zinc/49/35/01/943493501.db2.gz BUQLQIHIYMPPSQ-CQSZACIVSA-N -1 3 371.911 3.728 20 0 FHADHM O=S(=O)([N-][C@H]1C[C@H](c2ccccc2F)C1)c1cc(F)ccc1Cl ZINC000435593357 943508466 /nfs/dbraw/zinc/50/84/66/943508466.db2.gz MLODCZTWBYJFRR-UMSPYCQHSA-N -1 3 357.809 3.843 20 0 FHADHM COc1cc(C)c([N-]S(=O)(=O)c2ccc(OCC(F)F)cc2)cc1C ZINC000435721493 943579647 /nfs/dbraw/zinc/57/96/47/943579647.db2.gz IKQKQRUTRVWYNO-UHFFFAOYSA-N -1 3 371.405 3.757 20 0 FHADHM COc1cc(C)c([N-]S(=O)(=O)c2ccc(Br)cc2)cc1C ZINC000435736492 943588993 /nfs/dbraw/zinc/58/89/93/943588993.db2.gz ARERBWABRZLMQD-UHFFFAOYSA-N -1 3 370.268 3.875 20 0 FHADHM CC(C)c1cnc(CNC[C@@H](Cc2ccc(Cl)cc2)C(=O)[O-])s1 ZINC000417550169 943697041 /nfs/dbraw/zinc/69/70/41/943697041.db2.gz UXQFRXIEXNIJCN-CYBMUJFWSA-N -1 3 352.887 3.953 20 0 FHADHM CC(C)c1cnc(CNC[C@H](Cc2ccc(Cl)cc2)C(=O)[O-])s1 ZINC000417550170 943697079 /nfs/dbraw/zinc/69/70/79/943697079.db2.gz UXQFRXIEXNIJCN-ZDUSSCGKSA-N -1 3 352.887 3.953 20 0 FHADHM CCc1nc(CN[C@H](Cc2cc(Cl)cc(Cl)c2)C(=O)[O-])cs1 ZINC000417557448 943705508 /nfs/dbraw/zinc/70/55/08/943705508.db2.gz BOHYNYMWIAYPLF-CYBMUJFWSA-N -1 3 359.278 3.798 20 0 FHADHM CC(C)[C@H]1C[C@@](NCc2cnc(C(C)(C)C)nc2)(C(=O)[O-])c2ccccc21 ZINC000417562652 943713193 /nfs/dbraw/zinc/71/31/93/943713193.db2.gz CHYZOUPJUIFCIF-VGSWGCGISA-N -1 3 367.493 3.987 20 0 FHADHM CC(C)[C@@H]1C[C@@](NCc2cnc(C(C)(C)C)nc2)(C(=O)[O-])c2ccccc21 ZINC000417562649 943713896 /nfs/dbraw/zinc/71/38/96/943713896.db2.gz CHYZOUPJUIFCIF-JTSKRJEESA-N -1 3 367.493 3.987 20 0 FHADHM C[C@@H](OC(C)(C)C)[C@H](NCc1ccc(-c2ccncc2)cc1F)C(=O)[O-] ZINC000417584358 943731632 /nfs/dbraw/zinc/73/16/32/943731632.db2.gz MTQUGMAYFOMWTN-ACJLOTCBSA-N -1 3 360.429 3.634 20 0 FHADHM C[C@@H](CNCc1csc(COc2ccc(Cl)cc2)n1)CC(=O)[O-] ZINC000417623711 943759231 /nfs/dbraw/zinc/75/92/31/943759231.db2.gz PMLXEUBOSRGNPG-LLVKDONJSA-N -1 3 354.859 3.576 20 0 FHADHM CCCc1csc(CNC[C@@H](Cc2cc(F)c(F)c(F)c2)C(=O)[O-])n1 ZINC000417631975 943769895 /nfs/dbraw/zinc/76/98/95/943769895.db2.gz FOONXZJGBNTYCJ-LLVKDONJSA-N -1 3 372.412 3.546 20 0 FHADHM Cc1c(F)cccc1S(=O)(=O)[N-]c1ccc(-n2ccnc2)c(Cl)c1 ZINC000437397832 943774044 /nfs/dbraw/zinc/77/40/44/943774044.db2.gz TZRQELLMIVKHBE-UHFFFAOYSA-N -1 3 365.817 3.774 20 0 FHADHM O=C([O-])C[C@@H](CNCc1ccc(Cl)cc1Br)C(F)F ZINC000417624849 943774763 /nfs/dbraw/zinc/77/47/63/943774763.db2.gz OSJDVIDZSGHBRM-QMMMGPOBSA-N -1 3 356.594 3.548 20 0 FHADHM Cc1cc(C)c2ncc(C(=O)[O-])c(N3CCC[C@H](c4ncc[nH]4)C3)c2c1 ZINC000516869771 943780512 /nfs/dbraw/zinc/78/05/12/943780512.db2.gz ODNABSUJUWNSME-AWEZNQCLSA-N -1 3 350.422 3.657 20 0 FHADHM O=C([N-]c1csc(-c2ccncc2)n1)c1ncsc1Br ZINC000515327229 943791046 /nfs/dbraw/zinc/79/10/46/943791046.db2.gz JYFBXIODEWYHMN-UHFFFAOYSA-N -1 3 367.253 3.676 20 0 FHADHM O=C([O-])C[C@H](CCNCc1cccc(F)c1Br)C(F)(F)F ZINC000417653297 943800956 /nfs/dbraw/zinc/80/09/56/943800956.db2.gz HAARTMJTCHLXNA-VIFPVBQESA-N -1 3 372.156 3.721 20 0 FHADHM CC(C)(C)Cc1nc2cc(-n3c([O-])c(CC(F)(F)F)[nH]c3=O)ccc2o1 ZINC000516906449 943804128 /nfs/dbraw/zinc/80/41/28/943804128.db2.gz ZJWVVQHTGZGYJL-LLVKDONJSA-N -1 3 369.343 3.794 20 0 FHADHM C[C@H](NC(=O)CN1CCCC[C@H]1CCC(=O)[O-])c1ccc2ccccc2c1 ZINC000424254922 943808155 /nfs/dbraw/zinc/80/81/55/943808155.db2.gz HIRPICCIHONLPS-JXFKEZNVSA-N -1 3 368.477 3.736 20 0 FHADHM CC[C@@H](NC(=O)CN1CCCC[C@@H]1CCC(=O)[O-])c1ccc(Cl)cc1 ZINC000424255904 943809266 /nfs/dbraw/zinc/80/92/66/943809266.db2.gz IKIRHWGKJCQRJZ-IAGOWNOFSA-N -1 3 366.889 3.627 20 0 FHADHM C[C@H](NC(=O)CN1CCCC[C@@H]1CCC(=O)[O-])c1cccc2ccccc21 ZINC000424268179 943815220 /nfs/dbraw/zinc/81/52/20/943815220.db2.gz ZLGGJLOVZFGQFO-FUHWJXTLSA-N -1 3 368.477 3.736 20 0 FHADHM C[C@H]1CCCN(Cc2cc(Cl)ccc2OCc2cccnc2)[C@H]1C(=O)[O-] ZINC000424270870 943828820 /nfs/dbraw/zinc/82/88/20/943828820.db2.gz OHQYIMJEKNBDLG-IFXJQAMLSA-N -1 3 374.868 3.999 20 0 FHADHM COc1ccc(Cl)cc1-c1cc(=NC(=O)C[C@H](C)n2cccc2)[nH][n-]1 ZINC000517096375 943996323 /nfs/dbraw/zinc/99/63/23/943996323.db2.gz AQWHTNFGXAZQRN-LBPRGKRZSA-N -1 3 358.829 3.552 20 0 FHADHM CCSCC[C@H](C)[N-]S(=O)(=O)c1ccc(F)cc1C(F)(F)F ZINC000437696643 944039853 /nfs/dbraw/zinc/03/98/53/944039853.db2.gz FQNZVOUWOXROKY-VIFPVBQESA-N -1 3 359.410 3.655 20 0 FHADHM CC(C)Oc1ccc([N-]S(=O)(=O)c2cncc(Cl)c2)c(Cl)c1 ZINC000436158675 944064134 /nfs/dbraw/zinc/06/41/34/944064134.db2.gz XGRRUSMLKQWJEC-UHFFFAOYSA-N -1 3 361.250 3.976 20 0 FHADHM C[C@@H]1Cc2cc(S(=O)(=O)[N-]c3cccc(C(C)(F)F)c3)ccc2O1 ZINC000436168960 944072878 /nfs/dbraw/zinc/07/28/78/944072878.db2.gz JVXXWPXCEOKEAO-LLVKDONJSA-N -1 3 353.390 3.923 20 0 FHADHM COc1cc(S(=O)(=O)[N-]c2ccc(N3CCCC3)c(C)c2)ccc1F ZINC000190985222 944108131 /nfs/dbraw/zinc/10/81/31/944108131.db2.gz KMVDGIILQYSSKR-UHFFFAOYSA-N -1 3 364.442 3.544 20 0 FHADHM Cc1ncc(CNC(=O)c2ccc(O[C@H](C)c3ccccc3)cc2)c(=O)[n-]1 ZINC000473041890 944117972 /nfs/dbraw/zinc/11/79/72/944117972.db2.gz AJZKWZSGMQHGTD-CQSZACIVSA-N -1 3 363.417 3.561 20 0 FHADHM Cc1cc(=O)[n-]c(-c2cccc(NC(=O)c3sccc3C3CC3)c2)n1 ZINC000109293643 944127563 /nfs/dbraw/zinc/12/75/63/944127563.db2.gz ZABJNHGFLNWVLX-UHFFFAOYSA-N -1 3 351.431 3.937 20 0 FHADHM Cc1noc(C)c1S(=O)(=O)[N-][C@H]1CCc2c1ccc(Cl)c2Cl ZINC000500157847 944180753 /nfs/dbraw/zinc/18/07/53/944180753.db2.gz PEWOXXFGECEDDG-LBPRGKRZSA-N -1 3 361.250 3.564 20 0 FHADHM COc1cccc(CC[N-]S(=O)(=O)c2c(Cl)ccc(C)c2Cl)c1 ZINC000515761572 944188676 /nfs/dbraw/zinc/18/86/76/944188676.db2.gz MKQUQXFPWBORDP-UHFFFAOYSA-N -1 3 374.289 3.831 20 0 FHADHM CC(C)[C@@H](NC(=O)c1cc(=O)c2ccccc2[n-]1)c1nc2ccccc2[nH]1 ZINC000506161459 944224073 /nfs/dbraw/zinc/22/40/73/944224073.db2.gz XMBWPSDVSHCAIE-LJQANCHMSA-N -1 3 360.417 3.532 20 0 FHADHM CC(=O)c1cccc(NC(=O)c2scc(C)c2Br)c1[O-] ZINC000515821976 944242544 /nfs/dbraw/zinc/24/25/44/944242544.db2.gz MYEPIGVMNHFBTH-UHFFFAOYSA-N -1 3 354.225 3.980 20 0 FHADHM Cc1cc2cc(CNC[C@H](Oc3ccc(F)cc3)C(=O)[O-])oc2cc1C ZINC000426663469 944252960 /nfs/dbraw/zinc/25/29/60/944252960.db2.gz LZWRPHMCIABVGP-IBGZPJMESA-N -1 3 357.381 3.811 20 0 FHADHM CC1(C)Cc2ccc(C(=O)Nc3nc(C(F)(F)F)cs3)c([O-])c2O1 ZINC000439066551 944315527 /nfs/dbraw/zinc/31/55/27/944315527.db2.gz MGMSGOHJGXGKEI-UHFFFAOYSA-N -1 3 358.341 3.833 20 0 FHADHM CC(C)c1ccccc1S(=O)(=O)[N-]c1ccc(-c2nc[nH]n2)cc1F ZINC000436480569 944345800 /nfs/dbraw/zinc/34/58/00/944345800.db2.gz YTMAYPBHBSPUAT-UHFFFAOYSA-N -1 3 360.414 3.535 20 0 FHADHM Cc1cc(=O)[n-]c(CNc2nc(C3CC3)nc3sc4c(c32)CCCC4)n1 ZINC000894375917 944375711 /nfs/dbraw/zinc/37/57/11/944375711.db2.gz BFODRKSKPDABFJ-UHFFFAOYSA-N -1 3 367.478 3.864 20 0 FHADHM CC[C@H]1C[C@@]1(NC(=O)c1cc(OC)c([O-])c(OC)c1)c1cccc(C)c1 ZINC000436514603 944384706 /nfs/dbraw/zinc/38/47/06/944384706.db2.gz SDOZTWWXRBJXKG-BTYIYWSLSA-N -1 3 355.434 3.773 20 0 FHADHM Cc1noc(C)c1C[C@H](C)NC(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436525437 944393388 /nfs/dbraw/zinc/39/33/88/944393388.db2.gz AHPQJYWXULNEOF-AWEZNQCLSA-N -1 3 364.445 3.949 20 0 FHADHM CCN(C(=O)c1cc(F)c([O-])c(F)c1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000436533857 944399964 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COCc1c(Br)cccc1NC(=O)c1ccc(C)cc1[O-] ZINC000436542039 944419998 /nfs/dbraw/zinc/41/99/98/944419998.db2.gz CBLJSZHKMQITCE-UHFFFAOYSA-N -1 3 350.212 3.862 20 0 FHADHM CC(=O)c1cnc(NC(=O)c2cc(OCc3ccccc3)ccc2[O-])s1 ZINC000436543118 944421091 /nfs/dbraw/zinc/42/10/91/944421091.db2.gz GIWSBDXTWHDOGO-UHFFFAOYSA-N -1 3 368.414 3.883 20 0 FHADHM CC(C)c1ccc(C(=O)N[C@H](c2nnc3ccccn32)C(C)C)c([O-])c1 ZINC000436544001 944421123 /nfs/dbraw/zinc/42/11/23/944421123.db2.gz NUXWGFKXCVRPCT-SFHVURJKSA-N -1 3 352.438 3.685 20 0 FHADHM CC(C)c1nnc(CNC(=O)c2cc(Cc3ccccc3)ccc2[O-])s1 ZINC000436577678 944425597 /nfs/dbraw/zinc/42/55/97/944425597.db2.gz UUWHBAIJPMLURK-UHFFFAOYSA-N -1 3 367.474 3.888 20 0 FHADHM COc1cc(F)c(NC(=O)c2ccc3c(c2[O-])OC(C)(C)C3)cc1OC ZINC000436559241 944427333 /nfs/dbraw/zinc/42/73/33/944427333.db2.gz ZOAKYUGYWRAYSM-UHFFFAOYSA-N -1 3 361.369 3.514 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N[C@@H](C)c2oc3ccccc3c2C)c1 ZINC000436561383 944427778 /nfs/dbraw/zinc/42/77/78/944427778.db2.gz 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3.862 20 0 FHADHM Cc1ccc(C(=O)NCCC(=O)N([C@@H](C)c2ccccc2)C2CC2)c([O-])c1 ZINC000436649151 944480998 /nfs/dbraw/zinc/48/09/98/944480998.db2.gz SXBQCIFCITUQFT-INIZCTEOSA-N -1 3 366.461 3.573 20 0 FHADHM COc1ccc(C(=O)N(Cc2ccc3c(c2)CCO3)C2CCCC2)c([O-])c1 ZINC000436645281 944493860 /nfs/dbraw/zinc/49/38/60/944493860.db2.gz AANVHMPISNAIGC-UHFFFAOYSA-N -1 3 367.445 3.921 20 0 FHADHM Cc1c(C(=O)Nc2ccc(Br)cc2[O-])cnn1C(C)(C)C ZINC000516097751 944496350 /nfs/dbraw/zinc/49/63/50/944496350.db2.gz RXSPDWCKBZHQLA-UHFFFAOYSA-N -1 3 352.232 3.667 20 0 FHADHM CC(=O)c1ccc(C(=O)Nc2ccc(Oc3cc(C)[nH]n3)cc2)cc1[O-] ZINC000436659441 944510940 /nfs/dbraw/zinc/51/09/40/944510940.db2.gz OXEPBZMEVXUTID-UHFFFAOYSA-N -1 3 351.362 3.671 20 0 FHADHM CC(C)c1ccc(C(=O)NCc2ccc(CN3CCCC3=O)cc2)c([O-])c1 ZINC000436681706 944520549 /nfs/dbraw/zinc/52/05/49/944520549.db2.gz NZSHAUZJOFHMGO-UHFFFAOYSA-N -1 3 366.461 3.568 20 0 FHADHM CC1(C)Cc2ccc(C(=O)Nc3nc(-c4ccc[nH]4)cs3)c([O-])c2O1 ZINC000436683945 944522163 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CN1CC[C@H](CNC(=O)c2ccccc2[O-])[C@@H]1c1ccc(Cl)c(F)c1 ZINC000436718643 944557602 /nfs/dbraw/zinc/55/76/02/944557602.db2.gz XMDJHLGECDYHDF-ACJLOTCBSA-N -1 3 362.832 3.608 20 0 FHADHM CC(=O)Nc1ccc2nc(NC(=O)c3cc([O-])ccc3Cl)sc2c1 ZINC000550253646 944570489 /nfs/dbraw/zinc/57/04/89/944570489.db2.gz SLLWBUIAZMHDDT-UHFFFAOYSA-N -1 3 361.810 3.866 20 0 FHADHM O=C(Nc1nc2c(cccc2Br)s1)c1c([O-])cccc1O ZINC000436729380 944576021 /nfs/dbraw/zinc/57/60/21/944576021.db2.gz BAEDRCAMORTLEL-UHFFFAOYSA-N -1 3 365.208 3.722 20 0 FHADHM CC(C)[C@@H](C)CNC(=O)C[C@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000183923911 944587791 /nfs/dbraw/zinc/58/77/91/944587791.db2.gz WTQNLIFPZZLIRM-JXFKEZNVSA-N -1 3 368.477 3.662 20 0 FHADHM CCOC(=O)C1CCN(C(=O)c2cc(Oc3ccccc3)ccc2[O-])CC1 ZINC000436751148 944589934 /nfs/dbraw/zinc/58/99/34/944589934.db2.gz JJAVDPWWYBHTPU-UHFFFAOYSA-N -1 3 369.417 3.600 20 0 FHADHM Cc1nc2sc3c(c2c(NCc2cnc(C)[n-]c2=O)n1)CC[C@@H](C)C3 ZINC000517778027 944601741 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CC(C)[C@@H](Oc1cccc(Cl)c1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000552125271 944637722 /nfs/dbraw/zinc/63/77/22/944637722.db2.gz RFOGVLRYEWCYBD-MRXNPFEDSA-N -1 3 371.828 3.562 20 0 FHADHM CC(C)[C@@H](Oc1cccc(Cl)c1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000552125271 944637732 /nfs/dbraw/zinc/63/77/32/944637732.db2.gz RFOGVLRYEWCYBD-MRXNPFEDSA-N -1 3 371.828 3.562 20 0 FHADHM C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2C(=O)CCCc2ccc([O-])c(F)c2)C1 ZINC000500369604 944656981 /nfs/dbraw/zinc/65/69/81/944656981.db2.gz HFTKYIZLPJOBSI-HYEGPXJVSA-N -1 3 363.473 3.642 20 0 FHADHM C[C@H](O)C[C@H]1CCCCN1C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436812922 944668589 /nfs/dbraw/zinc/66/85/89/944668589.db2.gz YMCVSZWOJSGMDP-JKSUJKDBSA-N -1 3 355.434 3.950 20 0 FHADHM COc1ccc(C(=O)N2CCn3c(cc4cc(Cl)ccc43)C2)c([O-])c1 ZINC000436812776 944669849 /nfs/dbraw/zinc/66/98/49/944669849.db2.gz CILYHDHPIQRDME-UHFFFAOYSA-N -1 3 356.809 3.665 20 0 FHADHM Cc1cc(C(=O)N=c2cc([C@H]3CCCO3)[n-][nH]2)c(C)n1C1CCCCC1 ZINC000473847517 944676617 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O=C([O-])[C@H](Cc1ccc(F)cc1)NCc1csc(-c2ccc(F)cc2)n1 ZINC000426731612 944741443 /nfs/dbraw/zinc/74/14/43/944741443.db2.gz PUYKMHBSDYTRQW-KRWDZBQOSA-N -1 3 374.412 3.874 20 0 FHADHM C[C@@H](Sc1ccccc1-c1nnn[n-]1)c1nnc(-c2cccs2)o1 ZINC000736190466 944757849 /nfs/dbraw/zinc/75/78/49/944757849.db2.gz FMEQNAIZYGIXSC-SECBINFHSA-N -1 3 356.436 3.832 20 0 FHADHM C[C@@H](Sc1ccccc1-c1nn[n-]n1)c1nnc(-c2cccs2)o1 ZINC000736190466 944757854 /nfs/dbraw/zinc/75/78/54/944757854.db2.gz FMEQNAIZYGIXSC-SECBINFHSA-N -1 3 356.436 3.832 20 0 FHADHM C[C@@H](C(=O)[O-])[C@H](NCc1ccc(OC(F)F)c(F)c1)c1ccccc1 ZINC000426749934 944768891 /nfs/dbraw/zinc/76/88/91/944768891.db2.gz JNUCUBAUAQKARP-BZNIZROVSA-N -1 3 353.340 3.979 20 0 FHADHM C[C@H]1CCc2onc(C(=O)Nc3cc(Br)ccc3[O-])c2C1 ZINC000436902516 944771214 /nfs/dbraw/zinc/77/12/14/944771214.db2.gz QFMVEPSCKHTEKL-QMMMGPOBSA-N -1 3 351.200 3.520 20 0 FHADHM O=C(Nc1n[n-]c(-c2cc3ccccc3o2)n1)c1ccncc1C(F)(F)F ZINC000506935458 944776614 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CCC(=CC(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccc(C)cc1 ZINC000736304630 944794223 /nfs/dbraw/zinc/79/42/23/944794223.db2.gz ONHRPXUFZXEXLB-NWCRWOLESA-N -1 3 361.449 3.846 20 0 FHADHM O=C([O-])[C@@H](NCc1ccc(OCc2ccncc2)cc1)c1ccc(F)cc1 ZINC000426777804 944795440 /nfs/dbraw/zinc/79/54/40/944795440.db2.gz QWFGIKFMVAPNKA-FQEVSTJZSA-N -1 3 366.392 3.715 20 0 FHADHM CCC[C@@H](C)N(C)C(=O)C[C@@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436914554 944796627 /nfs/dbraw/zinc/79/66/27/944796627.db2.gz ZOQOGYSXPKLFMX-OXQOHEQNSA-N -1 3 368.477 3.900 20 0 FHADHM O=C(N[C@H](CO)c1ccsc1)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436916692 944799724 /nfs/dbraw/zinc/79/97/24/944799724.db2.gz VKCCMGQCSASYGV-GOSISDBHSA-N -1 3 353.443 3.508 20 0 FHADHM CCOc1ccc(CN[C@@H](C(=O)[O-])c2ccc(Cl)c(C)c2)cc1OC ZINC000426784497 944801153 /nfs/dbraw/zinc/80/11/53/944801153.db2.gz MVQDGKVZZOXTDH-GOSISDBHSA-N -1 3 363.841 3.971 20 0 FHADHM Cc1cc([C@H](NCc2cc(-c3ccccc3)n[nH]2)C(=O)[O-])ccc1Cl ZINC000426785584 944802808 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COc1cccc([C@H](CC(=O)[O-])NCc2ccc(Br)cc2)c1 ZINC000426803159 944823558 /nfs/dbraw/zinc/82/35/58/944823558.db2.gz KWFFNDTWVXBGDU-INIZCTEOSA-N -1 3 364.239 3.763 20 0 FHADHM Cc1cc([C@H](NCc2cnc(-c3ccccc3)[nH]2)C(=O)[O-])ccc1Cl ZINC000426802203 944823715 /nfs/dbraw/zinc/82/37/15/944823715.db2.gz XPRBCMXFTUYPBL-KRWDZBQOSA-N -1 3 355.825 3.954 20 0 FHADHM O=C([O-])[C@@H](NCc1cc(F)cc(F)c1)c1ccc(Br)cc1 ZINC000426809802 944831145 /nfs/dbraw/zinc/83/11/45/944831145.db2.gz GNEYFBBSFKPJFT-AWEZNQCLSA-N -1 3 356.166 3.643 20 0 FHADHM Cc1ccc(C(=O)N[C@H](c2ccn(C)n2)c2ccc(Cl)cc2)c([O-])c1 ZINC000436960481 944838338 /nfs/dbraw/zinc/83/83/38/944838338.db2.gz QOTLKKFMHKYNQU-SFHVURJKSA-N -1 3 355.825 3.607 20 0 FHADHM COc1ccc([C@@H](NCc2cccc(OC(F)(F)F)c2)C(=O)[O-])cc1F ZINC000426822720 944845423 /nfs/dbraw/zinc/84/54/23/944845423.db2.gz FHQVZBJFLPBQMM-OAHLLOKOSA-N -1 3 373.302 3.648 20 0 FHADHM CCCOc1cc(CN[C@H](C(=O)[O-])c2ccc(CC)cc2)ccc1OC ZINC000426826106 944849163 /nfs/dbraw/zinc/84/91/63/944849163.db2.gz NRXATHQUFBCENP-FQEVSTJZSA-N -1 3 357.450 3.962 20 0 FHADHM COc1ccc(CN[C@H](C(=O)[O-])c2cccc(F)c2)cc1Br ZINC000426825778 944850269 /nfs/dbraw/zinc/85/02/69/944850269.db2.gz BSNWECUTNFZILM-HNNXBMFYSA-N -1 3 368.202 3.512 20 0 FHADHM COc1ccc2c(c1)C[C@@H](C)N(C(=O)c1cc(OC)c([O-])c(OC)c1)[C@@H]2C ZINC000436971032 944857403 /nfs/dbraw/zinc/85/74/03/944857403.db2.gz NDWZMKGPHYRDED-CHWSQXEVSA-N -1 3 371.433 3.566 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)[C@H]1CCC[C@H](C)C1 ZINC000736625487 944858930 /nfs/dbraw/zinc/85/89/30/944858930.db2.gz AFBXNABDSRQHJS-QWRGUYRKSA-N -1 3 364.833 3.651 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)[C@H]1CCC[C@H](C)C1 ZINC000736625487 944858940 /nfs/dbraw/zinc/85/89/40/944858940.db2.gz AFBXNABDSRQHJS-QWRGUYRKSA-N -1 3 364.833 3.651 20 0 FHADHM COc1cc(OC)c(OC)cc1NC(=O)c1ccc2c(c1[O-])CCCC2 ZINC000436974691 944863800 /nfs/dbraw/zinc/86/38/00/944863800.db2.gz ARYAXAMLQOGPTG-UHFFFAOYSA-N -1 3 357.406 3.549 20 0 FHADHM C[C@@]1(CCCO)CCCN1C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436975941 944864820 /nfs/dbraw/zinc/86/48/20/944864820.db2.gz ATPHWANGRAUKCM-QFIPXVFZSA-N -1 3 353.462 3.750 20 0 FHADHM Cc1ccc(C(=O)N(C)[C@H]2c3cc(Cl)cc(Cl)c3C[C@@H]2O)c([O-])c1 ZINC000436984140 944865936 /nfs/dbraw/zinc/86/59/36/944865936.db2.gz YQTDOHCHWWOVEN-IRXDYDNUSA-N -1 3 366.244 3.738 20 0 FHADHM COc1ccc([C@@H](NCc2cc3c(cc(C)cc3C)[nH]2)C(=O)[O-])cc1F ZINC000426831579 944869819 /nfs/dbraw/zinc/86/98/19/944869819.db2.gz FKDAVNMCOBTJBU-LJQANCHMSA-N -1 3 356.397 3.848 20 0 FHADHM CCCCOc1ccc(C(=O)NCc2nc(-c3cccs3)no2)c([O-])c1 ZINC000436969727 944877822 /nfs/dbraw/zinc/87/78/22/944877822.db2.gz ASBWQKVTAIZEPJ-UHFFFAOYSA-N -1 3 373.434 3.613 20 0 FHADHM CCCCOc1ccc(C(=O)N2CCO[C@H](Cc3ccccc3)C2)c([O-])c1 ZINC000436987331 944878539 /nfs/dbraw/zinc/87/85/39/944878539.db2.gz IYTMYVOUYJJGCE-LJQANCHMSA-N -1 3 369.461 3.655 20 0 FHADHM C[C@@H](CNC(=O)c1cc(Cc2ccccc2)ccc1[O-])c1nccs1 ZINC000436987222 944878598 /nfs/dbraw/zinc/87/85/98/944878598.db2.gz UHHTXZSQQKEMCT-AWEZNQCLSA-N -1 3 352.459 3.973 20 0 FHADHM O=S(=O)([N-]Cc1ccc(F)c(F)c1)c1csc(-c2ccccc2)n1 ZINC000500426776 944880156 /nfs/dbraw/zinc/88/01/56/944880156.db2.gz GPERCBITQRYMLM-UHFFFAOYSA-N -1 3 366.414 3.567 20 0 FHADHM CCCCOc1ccc(C(=O)N[C@H]2CCc3cnn(C(C)C)c3C2)c([O-])c1 ZINC000436990154 944883037 /nfs/dbraw/zinc/88/30/37/944883037.db2.gz PANFFEZFMFHVRU-INIZCTEOSA-N -1 3 371.481 3.636 20 0 FHADHM CO[C@]1(C)CCCN(C(=O)c2cc(CCc3ccccc3)ccc2[O-])C1 ZINC000436995778 944891979 /nfs/dbraw/zinc/89/19/79/944891979.db2.gz DUQXQWADXIPSFW-JOCHJYFZSA-N -1 3 353.462 3.819 20 0 FHADHM O=C(CCc1cc(Cl)cc(Cl)c1)N=c1cc([C@@H]2CCCO2)[n-][nH]1 ZINC000473850788 944893837 /nfs/dbraw/zinc/89/38/37/944893837.db2.gz PHCUWYYFSWWRSL-AWEZNQCLSA-N -1 3 354.237 3.561 20 0 FHADHM O=C(c1ccccc1[O-])N1CC[C@@H](Cc2ccc(Br)cc2)C1 ZINC000437001581 944898345 /nfs/dbraw/zinc/89/83/45/944898345.db2.gz OLOGSGJNIUSQPU-AWEZNQCLSA-N -1 3 360.251 3.860 20 0 FHADHM CC[C@@H](C)n1nc(C(=O)Nc2cc(Br)ccc2[O-])cc1C ZINC000437003495 944901576 /nfs/dbraw/zinc/90/15/76/944901576.db2.gz JQNSKXOZXDJLDN-SECBINFHSA-N -1 3 352.232 3.883 20 0 FHADHM CCN(C(=O)c1cc(=O)c2ccccc2[n-]1)[C@@H](C)c1cccc(OC)c1 ZINC000507073213 944917463 /nfs/dbraw/zinc/91/74/63/944917463.db2.gz YELMPBOJTZTLMJ-AWEZNQCLSA-N -1 3 350.418 3.760 20 0 FHADHM COc1cccc(-c2nc(-c3ccc(OC(C)C)c(OC)c3)no2)c1[O-] ZINC000437000801 944919209 /nfs/dbraw/zinc/91/92/09/944919209.db2.gz ODNKOWWPGCETGX-UHFFFAOYSA-N -1 3 356.378 3.914 20 0 FHADHM C[C@H](SCC(=O)Nc1[nH][n-]c2cc(=O)ccc1-2)c1nc2ccccc2[nH]1 ZINC000590558054 944997029 /nfs/dbraw/zinc/99/70/29/944997029.db2.gz MJJJTUCICASYKF-JTQLQIEISA-N -1 3 367.434 3.578 20 0 FHADHM CCC(=O)Nc1ccc([N-]S(=O)(=O)c2ccc3c(c2)CC(C)(C)O3)cc1 ZINC000440290005 945379532 /nfs/dbraw/zinc/37/95/32/945379532.db2.gz KJHQWSADOASGBC-UHFFFAOYSA-N -1 3 374.462 3.549 20 0 FHADHM C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)C)CC1)c1cccc(-c2nnn[n-]2)c1 ZINC000820353092 945427722 /nfs/dbraw/zinc/42/77/22/945427722.db2.gz YBGXKKCKXJSDPI-PBHICJAKSA-N -1 3 370.501 3.786 20 0 FHADHM C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)C)CC1)c1cccc(-c2nn[n-]n2)c1 ZINC000820353092 945427728 /nfs/dbraw/zinc/42/77/28/945427728.db2.gz YBGXKKCKXJSDPI-PBHICJAKSA-N -1 3 370.501 3.786 20 0 FHADHM Cc1cc(=O)[n-]c(C(C)(C)NCc2cccc(Br)c2Cl)n1 ZINC000660749747 945447589 /nfs/dbraw/zinc/44/75/89/945447589.db2.gz OQFXYOHCIQGJFW-UHFFFAOYSA-N -1 3 370.678 3.931 20 0 FHADHM COc1cccc(C(=O)Nc2nc(-c3sc(C)nc3C)cs2)c1[O-] ZINC000192560965 945456994 /nfs/dbraw/zinc/45/69/94/945456994.db2.gz PZGQHLVWZCMSJH-UHFFFAOYSA-N -1 3 361.448 3.850 20 0 FHADHM Cc1c([O-])ccc2c(CNc3cccc(Cn4cccn4)c3)cc(=O)oc12 ZINC000027013396 945460247 /nfs/dbraw/zinc/46/02/47/945460247.db2.gz FRAAPIRNYXFWBW-UHFFFAOYSA-N -1 3 361.401 3.664 20 0 FHADHM COc1ccc(N(CCC(C)C)C(=O)CCc2c(C)nc(C)[n-]c2=O)cc1 ZINC000281304773 945584058 /nfs/dbraw/zinc/58/40/58/945584058.db2.gz VHOCMNUFTAYLDG-UHFFFAOYSA-N -1 3 371.481 3.820 20 0 FHADHM O=C(CCCc1ccc2c(c1)-c1ccccc1C2)NCc1ncccc1[O-] ZINC000473633634 945634448 /nfs/dbraw/zinc/63/44/48/945634448.db2.gz JZSGYPONDIRORH-UHFFFAOYSA-N -1 3 358.441 3.998 20 0 FHADHM Cc1ccccc1C[C@H](CNCc1coc(-c2ccccc2)n1)C(=O)[O-] ZINC000426656661 945635620 /nfs/dbraw/zinc/63/56/20/945635620.db2.gz JKLBQNUACZQHSZ-GOSISDBHSA-N -1 3 350.418 3.683 20 0 FHADHM O=C(NCc1ncccc1[O-])c1ccc(Oc2ccc(F)c(F)c2)cc1 ZINC000473628516 945637966 /nfs/dbraw/zinc/63/79/66/945637966.db2.gz FEEABJROQKQQBV-UHFFFAOYSA-N -1 3 356.328 3.788 20 0 FHADHM Cc1ccc(Cl)c(S(=O)(=O)[N-]c2cc3c(cc2Cl)OCCO3)c1 ZINC000123892197 945655694 /nfs/dbraw/zinc/65/56/94/945655694.db2.gz KMSBTDBIZYMQMF-UHFFFAOYSA-N -1 3 374.245 3.874 20 0 FHADHM CC(C)c1ccc(C(=O)NCC2(c3ccccc3)CCOCC2)c([O-])c1 ZINC000110531347 945671150 /nfs/dbraw/zinc/67/11/50/945671150.db2.gz OTZXJHHHDRNEIT-UHFFFAOYSA-N -1 3 353.462 3.994 20 0 FHADHM CCOC(=O)c1ccc(-c2nnn[n-]2)c(S[C@H](C)c2cccc(C)c2)n1 ZINC000821343899 945674362 /nfs/dbraw/zinc/67/43/62/945674362.db2.gz YPOQEPDUPXGMMA-GFCCVEGCSA-N -1 3 369.450 3.600 20 0 FHADHM CCOC(=O)c1ccc(-c2nn[n-]n2)c(S[C@H](C)c2cccc(C)c2)n1 ZINC000821343899 945674366 /nfs/dbraw/zinc/67/43/66/945674366.db2.gz YPOQEPDUPXGMMA-GFCCVEGCSA-N -1 3 369.450 3.600 20 0 FHADHM CCc1ccc(C(=O)N2CCN(c3nccc4sccc43)CC2)c([O-])c1 ZINC000519733394 945695115 /nfs/dbraw/zinc/69/51/15/945695115.db2.gz NZDUBVKSESZSTJ-UHFFFAOYSA-N -1 3 367.474 3.527 20 0 FHADHM O=C(NCc1ncccc1[O-])C1(c2ccc(Cl)c(Cl)c2)CCC1 ZINC000473645442 945709548 /nfs/dbraw/zinc/70/95/48/945709548.db2.gz XCRALBTXMHLTBO-UHFFFAOYSA-N -1 3 351.233 3.832 20 0 FHADHM CC1(C)[C@H](C(F)(F)F)CCN1C(=O)c1c[n-]c2c(F)cc(F)cc2c1=O ZINC000408160478 945710356 /nfs/dbraw/zinc/71/03/56/945710356.db2.gz JGRMANJNEAHIHX-GFCCVEGCSA-N -1 3 374.309 3.609 20 0 FHADHM O=C(Nc1nnc(C(F)(F)F)[n-]1)[C@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000110657374 945717220 /nfs/dbraw/zinc/71/72/20/945717220.db2.gz FMBHVSKQOKMPFB-BDAKNGLRSA-N -1 3 364.249 3.585 20 0 FHADHM O=C(Nc1nc(C(F)(F)F)n[n-]1)[C@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000110657374 945717227 /nfs/dbraw/zinc/71/72/27/945717227.db2.gz FMBHVSKQOKMPFB-BDAKNGLRSA-N -1 3 364.249 3.585 20 0 FHADHM CCSc1ccc(Cl)cc1NC(=O)NCc1cnc(C)[n-]c1=O ZINC000519775576 945733483 /nfs/dbraw/zinc/73/34/83/945733483.db2.gz HAVOENHYGLYWKS-UHFFFAOYSA-N -1 3 352.847 3.578 20 0 FHADHM CC[C@H](CNC(=O)c1c[n-]c2ccccc2c1=O)Oc1cccc(Cl)c1 ZINC000440621385 945735848 /nfs/dbraw/zinc/73/58/48/945735848.db2.gz HNVQBNCALRUBMU-CQSZACIVSA-N -1 3 370.836 3.769 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)N3CCC[C@H]4CCC[C@H]43)cc2)cc(=O)[n-]1 ZINC000440699640 945814169 /nfs/dbraw/zinc/81/41/69/945814169.db2.gz CMZRUOGLXIBOFT-CRAIPNDOSA-N -1 3 352.438 3.954 20 0 FHADHM Cc1nc2ncnn2c(Sc2nnc([N-]c3ccccc3F)s2)c1C ZINC000301557462 945846292 /nfs/dbraw/zinc/84/62/92/945846292.db2.gz NVMPFYPDKQTHMD-UHFFFAOYSA-N -1 3 373.442 3.627 20 0 FHADHM O=C(Nc1nnc(C(F)(F)F)[n-]1)C1(c2c(Cl)cccc2Cl)CC1 ZINC000468942538 945850049 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Cc1c2cccc(C)c2oc1C(=O)Nc1ccc(F)cc1-c1nn[n-]n1 ZINC000822020383 945924229 /nfs/dbraw/zinc/92/42/29/945924229.db2.gz BJJADWCSXIKVAK-UHFFFAOYSA-N -1 3 351.341 3.621 20 0 FHADHM Cc1cc(C)c2ncc(-c3nnn[n-]3)c(N3CCC[C@H]3c3ccco3)c2c1 ZINC000822194967 945978108 /nfs/dbraw/zinc/97/81/08/945978108.db2.gz BQHSRMUQSSBRME-INIZCTEOSA-N -1 3 360.421 3.966 20 0 FHADHM Cc1cc(C)c2ncc(-c3nn[n-]n3)c(N3CCC[C@H]3c3ccco3)c2c1 ZINC000822194967 945978115 /nfs/dbraw/zinc/97/81/15/945978115.db2.gz BQHSRMUQSSBRME-INIZCTEOSA-N -1 3 360.421 3.966 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H](C)[C@@H]3COc4ccccc43)nc2)n1 ZINC000301842696 945999543 /nfs/dbraw/zinc/99/95/43/945999543.db2.gz JZVQPECDDPWMCG-DYVFJYSZSA-N -1 3 362.433 3.783 20 0 FHADHM Cc1ccc2c(c1Br)CN(C(=O)Cc1ccc([O-])c(F)c1)C2 ZINC001167777315 946004684 /nfs/dbraw/zinc/00/46/84/946004684.db2.gz ZCPVNRDULMZIIM-UHFFFAOYSA-N -1 3 364.214 3.687 20 0 FHADHM C[C@H](OC(=O)c1cc(Cl)c(Cl)[n-]1)C(=O)Nc1ccc(F)c(F)c1 ZINC000011810590 946037795 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C[C@@H]1CN(C(=O)c2c[n-]c3ccc(Br)cc3c2=O)C(C)(C)C1 ZINC000444293947 946194640 /nfs/dbraw/zinc/19/46/40/946194640.db2.gz UTUGAJYZEIKXRP-JTQLQIEISA-N -1 3 363.255 3.551 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)N(C)[C@@H](C)c3ccco3)cc2)cc(=O)[n-]1 ZINC000520158782 946205969 /nfs/dbraw/zinc/20/59/69/946205969.db2.gz NKMHVFPHOGEIHI-LBPRGKRZSA-N -1 3 352.394 3.976 20 0 FHADHM O=S(=O)([N-]C1CC2(CCC2)C1)c1c(Cl)cccc1Br ZINC000651919762 946267999 /nfs/dbraw/zinc/26/79/99/946267999.db2.gz IVRXPAMFHRVWJH-UHFFFAOYSA-N -1 3 364.692 3.714 20 0 FHADHM O=S(=O)([N-]c1cccc(F)c1F)c1ccc(F)cc1Br ZINC000040231540 946280930 /nfs/dbraw/zinc/28/09/30/946280930.db2.gz GRYANUIDPLHFNQ-UHFFFAOYSA-N -1 3 366.158 3.667 20 0 FHADHM CC[C@@H](c1ccccc1)N(CC)C(=O)Nc1ccc2c(c1)C(=O)[N-]C2=O ZINC000549549469 946291110 /nfs/dbraw/zinc/29/11/10/946291110.db2.gz SLIWMDMTQVWLHE-KRWDZBQOSA-N -1 3 351.406 3.575 20 0 FHADHM CCOC(=O)C(=Cc1ccccc1)c1nc(=O)c2c(C)c(C)sc2[n-]1 ZINC000007502846 946429979 /nfs/dbraw/zinc/42/99/79/946429979.db2.gz FXZDLGHEQFLQPY-UVTDQMKNSA-N -1 3 354.431 3.705 20 0 FHADHM [O-]c1ccc(CN[C@@H](CCO)c2ccccc2Br)cc1F ZINC000893490994 946447298 /nfs/dbraw/zinc/44/72/98/946447298.db2.gz QMKLHUKOLUKAFO-HNNXBMFYSA-N -1 3 354.219 3.507 20 0 FHADHM CCc1ccc(-c2nc(-c3ccc(F)c(COCCOC)c3)no2)c([O-])c1 ZINC000664967260 946494999 /nfs/dbraw/zinc/49/49/99/946494999.db2.gz WUKXOHORZORRCB-UHFFFAOYSA-N -1 3 372.396 3.974 20 0 FHADHM c1ccc2c(c1)cccc2C1=CCN(c2cnccc2-c2nnn[n-]2)CC1 ZINC000823867498 946495473 /nfs/dbraw/zinc/49/54/73/946495473.db2.gz AYWCKUIBZDFYPM-UHFFFAOYSA-N -1 3 354.417 3.709 20 0 FHADHM c1ccc2c(c1)cccc2C1=CCN(c2cnccc2-c2nn[n-]n2)CC1 ZINC000823867498 946495483 /nfs/dbraw/zinc/49/54/83/946495483.db2.gz AYWCKUIBZDFYPM-UHFFFAOYSA-N -1 3 354.417 3.709 20 0 FHADHM CSc1ccccc1S(=O)(=O)[N-]c1cc(NC(C)=O)ccc1Cl ZINC000188388905 946512603 /nfs/dbraw/zinc/51/26/03/946512603.db2.gz MZBHTDSEUIKPDK-UHFFFAOYSA-N -1 3 370.883 3.821 20 0 FHADHM CC(=O)c1ccc(-c2nnn[n-]2)c(N[C@@H]2CCC[C@@H](C(F)(F)F)C2)c1 ZINC000824014423 946547876 /nfs/dbraw/zinc/54/78/76/946547876.db2.gz INJLTKHZFCPNMO-VXGBXAGGSA-N -1 3 353.348 3.602 20 0 FHADHM CC(=O)c1ccc(-c2nn[n-]n2)c(N[C@@H]2CCC[C@@H](C(F)(F)F)C2)c1 ZINC000824014423 946547879 /nfs/dbraw/zinc/54/78/79/946547879.db2.gz INJLTKHZFCPNMO-VXGBXAGGSA-N -1 3 353.348 3.602 20 0 FHADHM CC(=O)c1ccc(-c2nnn[n-]2)c(NCc2coc(-c3ccc(C)cc3)n2)c1 ZINC000824014902 946551124 /nfs/dbraw/zinc/55/11/24/946551124.db2.gz NWGIGEMYGXPBLM-UHFFFAOYSA-N -1 3 374.404 3.645 20 0 FHADHM CC(=O)c1ccc(-c2nn[n-]n2)c(NCc2coc(-c3ccc(C)cc3)n2)c1 ZINC000824014902 946551134 /nfs/dbraw/zinc/55/11/34/946551134.db2.gz NWGIGEMYGXPBLM-UHFFFAOYSA-N -1 3 374.404 3.645 20 0 FHADHM CC(C)(CO)[C@@H](CNc1ccc(Cl)cc1-c1nnn[n-]1)c1ccccc1 ZINC000824162877 946603917 /nfs/dbraw/zinc/60/39/17/946603917.db2.gz SGIKZMXYDAUZNS-INIZCTEOSA-N -1 3 371.872 3.734 20 0 FHADHM CC(C)(CO)[C@@H](CNc1ccc(Cl)cc1-c1nn[n-]n1)c1ccccc1 ZINC000824162877 946603927 /nfs/dbraw/zinc/60/39/27/946603927.db2.gz SGIKZMXYDAUZNS-INIZCTEOSA-N -1 3 371.872 3.734 20 0 FHADHM Brc1ccc(-c2nn[n-]n2)c(N2CCCCCCCC2)c1 ZINC001573279449 946642051 /nfs/dbraw/zinc/64/20/51/946642051.db2.gz IJVMAUKTJOGJFU-UHFFFAOYSA-N -1 3 350.264 3.790 20 0 FHADHM Brc1ccc(-c2nnn[n-]2)c(N2CCCCCCCC2)c1 ZINC001573279449 946642045 /nfs/dbraw/zinc/64/20/45/946642045.db2.gz IJVMAUKTJOGJFU-UHFFFAOYSA-N -1 3 350.264 3.790 20 0 FHADHM CCc1ccc([C@H]2CCCCN2C(=O)c2cc(NC(C)=O)ccc2[O-])o1 ZINC000122761584 946661318 /nfs/dbraw/zinc/66/13/18/946661318.db2.gz AOTVHKSSTSOTKL-QGZVFWFLSA-N -1 3 356.422 3.873 20 0 FHADHM Brc1cc(Nc2ncccc2-c2nnn[n-]2)cc2ccccc12 ZINC001573280619 946665955 /nfs/dbraw/zinc/66/59/55/946665955.db2.gz UXZWCMDICXWYRK-UHFFFAOYSA-N -1 3 367.210 3.921 20 0 FHADHM Brc1cc(Nc2ncccc2-c2nn[n-]n2)cc2ccccc12 ZINC001573280619 946665962 /nfs/dbraw/zinc/66/59/62/946665962.db2.gz UXZWCMDICXWYRK-UHFFFAOYSA-N -1 3 367.210 3.921 20 0 FHADHM CC(C)c1noc([C@H](C)Sc2cccc(Cl)c2-c2nnn[n-]2)n1 ZINC000824371412 946673196 /nfs/dbraw/zinc/67/31/96/946673196.db2.gz DSOHBUIVPRGDMX-QMMMGPOBSA-N -1 3 350.835 3.880 20 0 FHADHM CC(C)c1noc([C@H](C)Sc2cccc(Cl)c2-c2nn[n-]n2)n1 ZINC000824371412 946673205 /nfs/dbraw/zinc/67/32/05/946673205.db2.gz DSOHBUIVPRGDMX-QMMMGPOBSA-N -1 3 350.835 3.880 20 0 FHADHM C[C@@H](NC(=O)[C@@H](C)CCCc1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824402145 946682526 /nfs/dbraw/zinc/68/25/26/946682526.db2.gz UWTNJESPAPYYRO-JKSUJKDBSA-N -1 3 363.465 3.703 20 0 FHADHM C[C@@H](NC(=O)[C@@H](C)CCCc1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824402145 946682533 /nfs/dbraw/zinc/68/25/33/946682533.db2.gz UWTNJESPAPYYRO-JKSUJKDBSA-N -1 3 363.465 3.703 20 0 FHADHM CN(C(=O)c1cc([O-])c2ccccc2c1)C1CCN(CC(F)(F)F)CC1 ZINC000456929230 946689362 /nfs/dbraw/zinc/68/93/62/946689362.db2.gz GCLITXONRGZZHJ-UHFFFAOYSA-N -1 3 366.383 3.644 20 0 FHADHM C[C@H](CN(C)c1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)c1nccs1 ZINC000824412924 946693664 /nfs/dbraw/zinc/69/36/64/946693664.db2.gz HICPCQMZGMVYFV-SECBINFHSA-N -1 3 368.388 3.582 20 0 FHADHM C[C@H](CN(C)c1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)c1nccs1 ZINC000824412924 946693669 /nfs/dbraw/zinc/69/36/69/946693669.db2.gz HICPCQMZGMVYFV-SECBINFHSA-N -1 3 368.388 3.582 20 0 FHADHM CCN(Cc1nc2c3ccccc3oc2c(=O)[n-]1)c1ccc(F)c(F)c1 ZINC000053747460 946782796 /nfs/dbraw/zinc/78/27/96/946782796.db2.gz SPHYEJSIFXHZNV-UHFFFAOYSA-N -1 3 355.344 3.974 20 0 FHADHM O=S(=O)(C[C@H]1CCCCO1)[N-]c1ccc(Cl)c(C(F)(F)F)c1 ZINC000110096356 946852132 /nfs/dbraw/zinc/85/21/32/946852132.db2.gz QTIXYJMQVDAQMU-SNVBAGLBSA-N -1 3 357.781 3.670 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2cccc(Br)c2)c(C)c1 ZINC000048652149 946862571 /nfs/dbraw/zinc/86/25/71/946862571.db2.gz VFVZVYYYURJPPC-UHFFFAOYSA-N -1 3 356.241 3.567 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2ccc(Br)cc2)c(C)c1 ZINC000048652128 946863043 /nfs/dbraw/zinc/86/30/43/946863043.db2.gz HTQRNBXJXXJWKC-UHFFFAOYSA-N -1 3 356.241 3.567 20 0 FHADHM Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000123699400 946877323 /nfs/dbraw/zinc/87/73/23/946877323.db2.gz 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C[C@H](OC(=O)[C@@H]1CCc2c1cccc2Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000824712958 946906697 /nfs/dbraw/zinc/90/66/97/946906697.db2.gz FRFSXLACGBLEAH-MEDUHNTESA-N -1 3 368.824 3.854 20 0 FHADHM Cc1oc(-c2ccccc2)c(C(=O)NCc2nc(C(F)(F)F)n[n-]2)c1C ZINC000444342268 946987653 /nfs/dbraw/zinc/98/76/53/946987653.db2.gz WYHLMOIIINHUQZ-UHFFFAOYSA-N -1 3 364.327 3.630 20 0 FHADHM CCC[C@]1(CO)CCCN1C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000444535255 946995763 /nfs/dbraw/zinc/99/57/63/946995763.db2.gz LOIAJAYLMSDQDR-OAQYLSRUSA-N -1 3 355.434 3.952 20 0 FHADHM C[C@H]1COC2(CCCC2)CN1Cc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000661983801 947013971 /nfs/dbraw/zinc/01/39/71/947013971.db2.gz YFMVHVXSJATOTA-ZDUSSCGKSA-N -1 3 353.422 3.615 20 0 FHADHM C[C@@H]1CN(C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)[C@@H]2CCCC[C@@H]21 ZINC000824978508 947020506 /nfs/dbraw/zinc/02/05/06/947020506.db2.gz WHMFMASVPWFQIW-IXPVHAAZSA-N -1 3 360.849 3.563 20 0 FHADHM C[C@@H]1CN(C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)[C@@H]2CCCC[C@@H]21 ZINC000824978508 947020519 /nfs/dbraw/zinc/02/05/19/947020519.db2.gz WHMFMASVPWFQIW-IXPVHAAZSA-N -1 3 360.849 3.563 20 0 FHADHM O=C([O-])C1(C(=O)NC[C@@H]2CCCCN2Cc2ccccc2)CCCCCC1 ZINC000663102159 947036556 /nfs/dbraw/zinc/03/65/56/947036556.db2.gz NOSCWWUQBOXMGU-IBGZPJMESA-N -1 3 372.509 3.583 20 0 FHADHM CC[C@@H](C(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(OC)cc1 ZINC000825039562 947055840 /nfs/dbraw/zinc/05/58/40/947055840.db2.gz UAXQESQEVPKFJT-FZKQIMNGSA-N -1 3 366.421 3.673 20 0 FHADHM CC[C@@H](C(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(OC)cc1 ZINC000825039562 947055844 /nfs/dbraw/zinc/05/58/44/947055844.db2.gz UAXQESQEVPKFJT-FZKQIMNGSA-N -1 3 366.421 3.673 20 0 FHADHM CCN(CC)[C@@H](CNC(=O)C1(C(=O)[O-])CCCCCC1)c1ccsc1 ZINC000663113109 947066340 /nfs/dbraw/zinc/06/63/40/947066340.db2.gz FYRTXPKXEYFABH-INIZCTEOSA-N -1 3 366.527 3.672 20 0 FHADHM [O-]c1cccc(CN2CCC3(CC2)C[C@@H](O)c2ccccc2O3)c1Cl ZINC000897265916 947073640 /nfs/dbraw/zinc/07/36/40/947073640.db2.gz UZYNOATVGLJDRU-QGZVFWFLSA-N -1 3 359.853 3.896 20 0 FHADHM CCC(CC)n1nc(C(=O)O[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1C ZINC000825113748 947079473 /nfs/dbraw/zinc/07/94/73/947079473.db2.gz FKZFRXICPQUYBP-CYBMUJFWSA-N -1 3 368.441 3.651 20 0 FHADHM CCC(CC)n1nc(C(=O)O[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1C ZINC000825113748 947079485 /nfs/dbraw/zinc/07/94/85/947079485.db2.gz FKZFRXICPQUYBP-CYBMUJFWSA-N -1 3 368.441 3.651 20 0 FHADHM CCc1nc2c(s1)[C@@H](N(C)CCOc1cccc(C(=O)[O-])c1)CCC2 ZINC000652431757 947100751 /nfs/dbraw/zinc/10/07/51/947100751.db2.gz LNYMSKGQXFJYRI-INIZCTEOSA-N -1 3 360.479 3.792 20 0 FHADHM CCC1(C(=O)N[C@@H](C)c2ccc(-c3cccc(-c4nnn[n-]4)c3)cc2)CC1 ZINC000825159606 947105069 /nfs/dbraw/zinc/10/50/69/947105069.db2.gz QRXAFMFEOJXTOB-AWEZNQCLSA-N -1 3 361.449 3.901 20 0 FHADHM CCC1(C(=O)N[C@@H](C)c2ccc(-c3cccc(-c4nn[n-]n4)c3)cc2)CC1 ZINC000825159606 947105073 /nfs/dbraw/zinc/10/50/73/947105073.db2.gz QRXAFMFEOJXTOB-AWEZNQCLSA-N -1 3 361.449 3.901 20 0 FHADHM C[C@@H]1C[C@@H](C(=O)N=c2cc(-c3cc(Cl)cc(Cl)c3)[n-][nH]2)CCC1=O ZINC000328932850 947115091 /nfs/dbraw/zinc/11/50/91/947115091.db2.gz DRFSTRIUVZUVET-ZJUUUORDSA-N -1 3 366.248 3.749 20 0 FHADHM Cc1oncc1C(=O)Nc1ccc([O-])c(C(=O)N(CC2CCC2)C(C)C)c1 ZINC000193015911 947142303 /nfs/dbraw/zinc/14/23/03/947142303.db2.gz AODLCCXYMLKBIN-UHFFFAOYSA-N -1 3 371.437 3.592 20 0 FHADHM CCCN(Cc1nc2c(s1)CCCC2)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000825322804 947154190 /nfs/dbraw/zinc/15/41/90/947154190.db2.gz JJDZDKILTHWAPR-UHFFFAOYSA-N -1 3 368.510 3.614 20 0 FHADHM CCCc1c(NCc2cccc(-c3nnn[n-]3)c2)cnn1-c1ccccc1 ZINC000825348335 947162256 /nfs/dbraw/zinc/16/22/56/947162256.db2.gz GDPUPMZMKRAUCE-UHFFFAOYSA-N -1 3 359.437 3.617 20 0 FHADHM CCCc1c(NCc2cccc(-c3nn[n-]n3)c2)cnn1-c1ccccc1 ZINC000825348335 947162264 /nfs/dbraw/zinc/16/22/64/947162264.db2.gz GDPUPMZMKRAUCE-UHFFFAOYSA-N -1 3 359.437 3.617 20 0 FHADHM CCOc1ccc(-c2nc(CN(CCC(=O)[O-])CC3CC3)cs2)cc1 ZINC000652467631 947186959 /nfs/dbraw/zinc/18/69/59/947186959.db2.gz GFSHYOUSPMEMAA-UHFFFAOYSA-N -1 3 360.479 3.896 20 0 FHADHM CCc1ccc(C(=O)NC2(c3ccc(OC)c(F)c3)CCOCC2)c([O-])c1 ZINC000444763593 947199210 /nfs/dbraw/zinc/19/92/10/947199210.db2.gz UUNAQUVOVZWOFE-UHFFFAOYSA-N -1 3 373.424 3.538 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@@H]3CCOc4ccccc43)nc2)n1 ZINC000301161127 947208902 /nfs/dbraw/zinc/20/89/02/947208902.db2.gz BZSHGTPPXKMNAK-AWEZNQCLSA-N -1 3 362.433 3.785 20 0 FHADHM O=S(=O)([N-]Cc1ccn(C2CCCC2)n1)c1cccc(Cl)c1Cl ZINC000125666944 947257074 /nfs/dbraw/zinc/25/70/74/947257074.db2.gz DWZNQBXFIZWMSL-UHFFFAOYSA-N -1 3 374.293 3.784 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)ccc1OCc1nc(Cl)ccc1Cl ZINC000825609969 947257476 /nfs/dbraw/zinc/25/74/76/947257476.db2.gz VKZSXCNHKXVDPM-UHFFFAOYSA-N -1 3 366.208 3.546 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)ccc1OCc1nc(Cl)ccc1Cl ZINC000825609969 947257486 /nfs/dbraw/zinc/25/74/86/947257486.db2.gz VKZSXCNHKXVDPM-UHFFFAOYSA-N -1 3 366.208 3.546 20 0 FHADHM CC(C)(C)C(F)(F)CNC(=O)NCc1ccc([O-])c(Br)c1 ZINC000662103836 947285116 /nfs/dbraw/zinc/28/51/16/947285116.db2.gz QCDYSJFZBDDOLM-UHFFFAOYSA-N -1 3 365.218 3.635 20 0 FHADHM CCc1cnc(CN[C@@H](C)c2ccc(-c3cccc(-c4nnn[n-]4)c3)cc2)o1 ZINC000825735697 947305045 /nfs/dbraw/zinc/30/50/45/947305045.db2.gz SOIPADQSPCVXLO-AWEZNQCLSA-N -1 3 374.448 3.935 20 0 FHADHM CCc1cnc(CN[C@@H](C)c2ccc(-c3cccc(-c4nn[n-]n4)c3)cc2)o1 ZINC000825735697 947305057 /nfs/dbraw/zinc/30/50/57/947305057.db2.gz SOIPADQSPCVXLO-AWEZNQCLSA-N -1 3 374.448 3.935 20 0 FHADHM CCc1ccc(C(=O)NCc2ccc(COC3CCOCC3)cc2)c([O-])c1 ZINC000188519329 947344756 /nfs/dbraw/zinc/34/47/56/947344756.db2.gz FKEBTDVQFFQEMV-UHFFFAOYSA-N -1 3 369.461 3.580 20 0 FHADHM CCO[C@H](C[N-]S(=O)(=O)c1cc(C)c(Cl)s1)c1ccccc1 ZINC000444973125 947381397 /nfs/dbraw/zinc/38/13/97/947381397.db2.gz HTYDFFXMDBRDLD-CYBMUJFWSA-N -1 3 359.900 3.766 20 0 FHADHM CC(C)(C)C(=O)NC1CCC(C(=O)Nc2ccc(Cl)cc2[O-])CC1 ZINC000331341546 947389767 /nfs/dbraw/zinc/38/97/67/947389767.db2.gz NRAIATOYCMAFSB-UHFFFAOYSA-N -1 3 352.862 3.705 20 0 FHADHM Cc1oc(-c2ccccc2)c(C(=O)Nc2nnc(C(F)(F)F)[n-]2)c1C ZINC000188679322 947483322 /nfs/dbraw/zinc/48/33/22/947483322.db2.gz WAITWFKNZCVVST-UHFFFAOYSA-N -1 3 350.300 3.953 20 0 FHADHM Cc1oc(-c2ccccc2)c(C(=O)Nc2nc(C(F)(F)F)n[n-]2)c1C ZINC000188679322 947483332 /nfs/dbraw/zinc/48/33/32/947483332.db2.gz WAITWFKNZCVVST-UHFFFAOYSA-N -1 3 350.300 3.953 20 0 FHADHM CC(C)Cc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)OCCCO3)cc1 ZINC000032085002 947521649 /nfs/dbraw/zinc/52/16/49/947521649.db2.gz BSGKMOGFFJEBAT-UHFFFAOYSA-N -1 3 361.463 3.847 20 0 FHADHM CC[C@@H](C(=O)Nc1ccc(Br)cc1[O-])c1c(C)noc1C ZINC000523731135 947551597 /nfs/dbraw/zinc/55/15/97/947551597.db2.gz YWAJGGGIZLMAQE-LLVKDONJSA-N -1 3 353.216 3.892 20 0 FHADHM CCc1ccc(C(=O)N2CCC(OCc3ccccc3OC)CC2)c([O-])c1 ZINC000188954941 947567944 /nfs/dbraw/zinc/56/79/44/947567944.db2.gz SJKFDZNETCHVHM-UHFFFAOYSA-N -1 3 369.461 3.785 20 0 FHADHM O=C([O-])CC[C@@H](CNCc1ccc(Br)c(F)c1)C(F)(F)F ZINC000663261218 947582425 /nfs/dbraw/zinc/58/24/25/947582425.db2.gz GYONQXJIYMQPOB-VIFPVBQESA-N -1 3 372.156 3.721 20 0 FHADHM O=S(=O)([N-]CCC[C@H]1CCCC[C@@H]1O)c1cccc(Cl)c1Cl ZINC000127881093 947591861 /nfs/dbraw/zinc/59/18/61/947591861.db2.gz IEEBUSOOHHDHGD-YPMHNXCESA-N -1 3 366.310 3.603 20 0 FHADHM Cc1[nH]ccc1C(=O)N[C@H](C)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000826233598 947685213 /nfs/dbraw/zinc/68/52/13/947685213.db2.gz NQNSIGGTYLJVTO-CYBMUJFWSA-N -1 3 372.432 3.661 20 0 FHADHM Cc1[nH]ccc1C(=O)N[C@H](C)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000826233598 947685220 /nfs/dbraw/zinc/68/52/20/947685220.db2.gz NQNSIGGTYLJVTO-CYBMUJFWSA-N -1 3 372.432 3.661 20 0 FHADHM CC(=Cc1ccc(C)cc1)C(=O)N(C)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC001573365715 947733009 /nfs/dbraw/zinc/73/30/09/947733009.db2.gz NBMPTBDIEWRZTB-JLHYYAGUSA-N -1 3 367.840 3.895 20 0 FHADHM CC(=Cc1ccc(C)cc1)C(=O)N(C)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC001573365715 947733013 /nfs/dbraw/zinc/73/30/13/947733013.db2.gz NBMPTBDIEWRZTB-JLHYYAGUSA-N -1 3 367.840 3.895 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)Nc1ccc(-c2nnn[n-]2)c(F)c1 ZINC001573365779 947735205 /nfs/dbraw/zinc/73/52/05/947735205.db2.gz NPWULJUYSQLRJG-CSKARUKUSA-N -1 3 357.776 3.701 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)Nc1ccc(-c2nn[n-]n2)c(F)c1 ZINC001573365779 947735216 /nfs/dbraw/zinc/73/52/16/947735216.db2.gz NPWULJUYSQLRJG-CSKARUKUSA-N -1 3 357.776 3.701 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC001573366367 947740553 /nfs/dbraw/zinc/74/05/53/947740553.db2.gz PMVFWLZLCOIFFC-FMIVXFBMSA-N -1 3 368.416 3.604 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC001573366367 947740564 /nfs/dbraw/zinc/74/05/64/947740564.db2.gz PMVFWLZLCOIFFC-FMIVXFBMSA-N -1 3 368.416 3.604 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)Oc1ccc(-c2nnn[n-]2)cc1F ZINC001573366537 947744961 /nfs/dbraw/zinc/74/49/61/947744961.db2.gz RXQZWEDRRCRHPR-JXMROGBWSA-N -1 3 358.760 3.668 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)Oc1ccc(-c2nn[n-]n2)cc1F ZINC001573366537 947744970 /nfs/dbraw/zinc/74/49/70/947744970.db2.gz RXQZWEDRRCRHPR-JXMROGBWSA-N -1 3 358.760 3.668 20 0 FHADHM C[C@H](C(=O)N1CCCc2c(-c3nnn[n-]3)cccc21)c1cc2ccccc2o1 ZINC001573638027 947830310 /nfs/dbraw/zinc/83/03/10/947830310.db2.gz AUEGRHCJNPGNFR-ZDUSSCGKSA-N -1 3 373.416 3.696 20 0 FHADHM C[C@H](C(=O)N1CCCc2c(-c3nn[n-]n3)cccc21)c1cc2ccccc2o1 ZINC001573638027 947830326 /nfs/dbraw/zinc/83/03/26/947830326.db2.gz AUEGRHCJNPGNFR-ZDUSSCGKSA-N -1 3 373.416 3.696 20 0 FHADHM Cc1cccc(F)c1NC(=O)CCCCOc1cccc(-c2nnn[n-]2)c1 ZINC000826298385 947862561 /nfs/dbraw/zinc/86/25/61/947862561.db2.gz QIESXEDAIBANBD-UHFFFAOYSA-N -1 3 369.400 3.502 20 0 FHADHM Cc1cccc(F)c1NC(=O)CCCCOc1cccc(-c2nn[n-]n2)c1 ZINC000826298385 947862570 /nfs/dbraw/zinc/86/25/70/947862570.db2.gz QIESXEDAIBANBD-UHFFFAOYSA-N -1 3 369.400 3.502 20 0 FHADHM Cc1cccc2nc(CS[C@H](C)c3ccc(-c4nnn[n-]4)cc3)cn21 ZINC000826305252 947875722 /nfs/dbraw/zinc/87/57/22/947875722.db2.gz PYGFPSALKMEZKQ-CYBMUJFWSA-N -1 3 350.451 3.817 20 0 FHADHM Cc1cccc2nc(CS[C@H](C)c3ccc(-c4nn[n-]n4)cc3)cn21 ZINC000826305252 947875732 /nfs/dbraw/zinc/87/57/32/947875732.db2.gz PYGFPSALKMEZKQ-CYBMUJFWSA-N -1 3 350.451 3.817 20 0 FHADHM Cc1ccccc1C(=O)NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000826305842 947878393 /nfs/dbraw/zinc/87/83/93/947878393.db2.gz JZRRSGMBRKTRHK-UHFFFAOYSA-N -1 3 369.428 3.772 20 0 FHADHM Cc1ccccc1C(=O)NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000826305842 947878400 /nfs/dbraw/zinc/87/84/00/947878400.db2.gz JZRRSGMBRKTRHK-UHFFFAOYSA-N -1 3 369.428 3.772 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NC3CCC(OC(C)C)CC3)nc2)n1 ZINC000130086872 947898860 /nfs/dbraw/zinc/89/88/60/947898860.db2.gz BDTDFWBOJKWZEF-UHFFFAOYSA-N -1 3 356.470 3.542 20 0 FHADHM C[C@H](C(=O)N1Cc2cccc(-c3nnn[n-]3)c2C1)c1ccc2ccccc2c1 ZINC001573651229 947919011 /nfs/dbraw/zinc/91/90/11/947919011.db2.gz KJMFKKCKJYTJAV-AWEZNQCLSA-N -1 3 369.428 3.666 20 0 FHADHM C[C@H](C(=O)N1Cc2cccc(-c3nn[n-]n3)c2C1)c1ccc2ccccc2c1 ZINC001573651229 947919017 /nfs/dbraw/zinc/91/90/17/947919017.db2.gz KJMFKKCKJYTJAV-AWEZNQCLSA-N -1 3 369.428 3.666 20 0 FHADHM Cc1ccncc1NC(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000826315401 947921889 /nfs/dbraw/zinc/92/18/89/947921889.db2.gz IPTQBPCETQGVEK-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccncc1NC(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000826315401 947921895 /nfs/dbraw/zinc/92/18/95/947921895.db2.gz IPTQBPCETQGVEK-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1nn(Cc2ccccc2)c(Cl)c1C(=O)Nc1cccc([O-])c1F ZINC000128736377 948056722 /nfs/dbraw/zinc/05/67/22/948056722.db2.gz FALIUWCEIKJVRH-UHFFFAOYSA-N -1 3 359.788 3.990 20 0 FHADHM c1coc(CN=c2[n-]nc(S[C@@H]3CCN(Cc4ccccc4)C3)s2)c1 ZINC000549619154 948095316 /nfs/dbraw/zinc/09/53/16/948095316.db2.gz WYYXBLSWTDMJBJ-MRXNPFEDSA-N -1 3 372.519 3.532 20 0 FHADHM CCc1ccc([C@H]2CN(C(=O)c3cc(SC)ccc3[O-])CCO2)cc1 ZINC000613925550 948109238 /nfs/dbraw/zinc/10/92/38/948109238.db2.gz PRTKMGXXEYOOQI-LJQANCHMSA-N -1 3 357.475 3.890 20 0 FHADHM O=S(=O)([N-]CC[C@@H]1CCCCO1)c1ccc(Cl)cc1C(F)(F)F ZINC000180773712 948129112 /nfs/dbraw/zinc/12/91/12/948129112.db2.gz 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372.856 3.797 20 0 FHADHM COc1ccc(Sc2ccc(NC(=O)c3cnn[n-]3)cc2Cl)cc1 ZINC000520610519 948390600 /nfs/dbraw/zinc/39/06/00/948390600.db2.gz CBMYFBPYSXAZES-UHFFFAOYSA-N -1 3 360.826 3.870 20 0 FHADHM COc1ccc(Sc2ccc(NC(=O)c3c[n-]nn3)cc2Cl)cc1 ZINC000520610519 948390607 /nfs/dbraw/zinc/39/06/07/948390607.db2.gz CBMYFBPYSXAZES-UHFFFAOYSA-N -1 3 360.826 3.870 20 0 FHADHM COc1ccc(Sc2ccc(NC(=O)c3cn[n-]n3)cc2Cl)cc1 ZINC000520610519 948390613 /nfs/dbraw/zinc/39/06/13/948390613.db2.gz CBMYFBPYSXAZES-UHFFFAOYSA-N -1 3 360.826 3.870 20 0 FHADHM c1csc(CNc2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)n1 ZINC000826517065 948443496 /nfs/dbraw/zinc/44/34/96/948443496.db2.gz OPKXECRTKSCHCG-UHFFFAOYSA-N -1 3 350.407 3.728 20 0 FHADHM Cc1nn(C(C)(C)C)cc1C(=O)Nc1cc(Br)ccc1[O-] ZINC000183781444 948477616 /nfs/dbraw/zinc/47/76/16/948477616.db2.gz VQIFKDNZSOLFLT-UHFFFAOYSA-N -1 3 352.232 3.667 20 0 FHADHM O=C(C[C@H]1C=CCCC1)Nc1cc(I)ccc1[O-] ZINC000614635215 948484763 /nfs/dbraw/zinc/48/47/63/948484763.db2.gz SXGDMZOECZKOCL-JTQLQIEISA-N -1 3 357.191 3.682 20 0 FHADHM CC(C)(C)c1ccc(CCC(=O)Nc2cc(-c3nnn[n-]3)ccc2F)cc1 ZINC001525059353 948536561 /nfs/dbraw/zinc/53/65/61/948536561.db2.gz DKYOUWXRXJBOFP-UHFFFAOYSA-N -1 3 367.428 3.875 20 0 FHADHM CC(C)(C)c1ccc(CCC(=O)Nc2cc(-c3nn[n-]n3)ccc2F)cc1 ZINC001525059353 948536566 /nfs/dbraw/zinc/53/65/66/948536566.db2.gz DKYOUWXRXJBOFP-UHFFFAOYSA-N -1 3 367.428 3.875 20 0 FHADHM O=C(Cc1coc2cc(Cl)ccc12)Nc1cc(-c2nnn[n-]2)ccc1F ZINC001528094348 948542785 /nfs/dbraw/zinc/54/27/85/948542785.db2.gz XTNXPQFHOCEWOS-UHFFFAOYSA-N -1 3 371.759 3.587 20 0 FHADHM O=C(Cc1coc2cc(Cl)ccc12)Nc1cc(-c2nn[n-]n2)ccc1F ZINC001528094348 948542787 /nfs/dbraw/zinc/54/27/87/948542787.db2.gz XTNXPQFHOCEWOS-UHFFFAOYSA-N -1 3 371.759 3.587 20 0 FHADHM CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1cc(Cl)ccc1[O-] ZINC000261387676 948546888 /nfs/dbraw/zinc/54/68/88/948546888.db2.gz COQPGJUNTSDYFC-ZDUSSCGKSA-N -1 3 356.850 3.924 20 0 FHADHM Cc1cnc(Cl)c([N-]S(=O)(=O)c2ccc(C(F)(F)F)cc2)c1 ZINC000318600826 948568822 /nfs/dbraw/zinc/56/88/22/948568822.db2.gz HEIXAFUVFRQGGW-UHFFFAOYSA-N -1 3 350.749 3.863 20 0 FHADHM Cc1cc(C)c(S(=O)(=O)[N-]c2cccc3c2OCC[C@@H]3N(C)C)c(C)c1 ZINC000432490373 948573438 /nfs/dbraw/zinc/57/34/38/948573438.db2.gz SNRPKPDTXBMWQJ-SFHVURJKSA-N -1 3 374.506 3.798 20 0 FHADHM O=C(C1CCN(Cc2cccc([O-])c2Cl)CC1)N1CCc2ccccc21 ZINC000507802732 948629955 /nfs/dbraw/zinc/62/99/55/948629955.db2.gz WMECXWLGXVGYNO-UHFFFAOYSA-N -1 3 370.880 3.847 20 0 FHADHM O=C1CCCc2cc(-c3nc4ccc(Br)cc4c(=O)[n-]3)cnc21 ZINC000432507034 948651970 /nfs/dbraw/zinc/65/19/70/948651970.db2.gz YBBABCBBFMETSM-UHFFFAOYSA-N -1 3 370.206 3.679 20 0 FHADHM COc1cccc(CN(Cc2c(F)ccc([O-])c2F)C[C@H]2CCCO2)c1 ZINC000507808404 948721091 /nfs/dbraw/zinc/72/10/91/948721091.db2.gz RJNHROSIMZAUNH-MRXNPFEDSA-N -1 3 363.404 3.860 20 0 FHADHM COc1cc(OC)cc(-c2noc([N-][C@@H](c3cnn(C)c3)C(C)(C)C)n2)c1 ZINC000663706277 948724631 /nfs/dbraw/zinc/72/46/31/948724631.db2.gz ONRIPZKAYLQXAY-INIZCTEOSA-N -1 3 371.441 3.687 20 0 FHADHM CC(C)c1ccc(C(=O)N2Cc3ccc(-c4nnn[n-]4)cc3C2)cc1Cl ZINC001574416334 948747598 /nfs/dbraw/zinc/74/75/98/948747598.db2.gz RDXCDSWSRAEHBQ-UHFFFAOYSA-N -1 3 367.840 3.800 20 0 FHADHM CC(C)c1ccc(C(=O)N2Cc3ccc(-c4nn[n-]n4)cc3C2)cc1Cl ZINC001574416334 948747608 /nfs/dbraw/zinc/74/76/08/948747608.db2.gz RDXCDSWSRAEHBQ-UHFFFAOYSA-N -1 3 367.840 3.800 20 0 FHADHM CC(C)c1ccc2c(c1)[C@H](NC(=O)c1sccc1-c1nnn[n-]1)CCC2 ZINC001574417505 948769261 /nfs/dbraw/zinc/76/92/61/948769261.db2.gz QCUYNURCDSZUSZ-MRXNPFEDSA-N -1 3 367.478 3.859 20 0 FHADHM CC(C)c1ccc2c(c1)[C@H](NC(=O)c1sccc1-c1nn[n-]n1)CCC2 ZINC001574417505 948769268 /nfs/dbraw/zinc/76/92/68/948769268.db2.gz QCUYNURCDSZUSZ-MRXNPFEDSA-N -1 3 367.478 3.859 20 0 FHADHM CC(C)(CC(=O)[O-])NCc1cc(C(F)(F)F)ccc1Br ZINC000579608973 948795473 /nfs/dbraw/zinc/79/54/73/948795473.db2.gz JROBKTFCAAXMAJ-UHFFFAOYSA-N -1 3 354.166 3.811 20 0 FHADHM COc1cc(C)c(S(=O)(=O)[N-]c2ccc(-c3cncnc3)cc2)c(C)c1 ZINC000524007613 948799281 /nfs/dbraw/zinc/79/92/81/948799281.db2.gz SKYKSALJRFQLDK-UHFFFAOYSA-N -1 3 369.446 3.570 20 0 FHADHM C[C@@H]1CCC[C@H]([N-]S(=O)(=O)c2ccc(Br)s2)[C@@H]1C ZINC000007377418 203819251 /nfs/dbraw/zinc/81/92/51/203819251.db2.gz LBMREPNETBDIGM-BBBLOLIVSA-N -1 3 352.319 3.614 20 0 FHADHM COc1ccc(CC[N-]S(=O)(=O)c2c(Cl)cccc2Cl)cc1 ZINC000007374889 204295366 /nfs/dbraw/zinc/29/53/66/204295366.db2.gz NQIAXYWVZYZWDL-UHFFFAOYSA-N -1 3 360.262 3.523 20 0 FHADHM COc1ccc(C(=O)N[C@H](C)Cc2ccc(Br)cc2)c([O-])c1 ZINC000107871057 206025641 /nfs/dbraw/zinc/02/56/41/206025641.db2.gz WRZBSLDTLLGXNA-LLVKDONJSA-N -1 3 364.239 3.524 20 0 FHADHM CC(C)c1ccc(C(=O)N2CCN(CCc3ccccc3)CC2)c([O-])c1 ZINC000108068777 206027330 /nfs/dbraw/zinc/02/73/30/206027330.db2.gz MCXBCZGLZLUCLB-UHFFFAOYSA-N -1 3 352.478 3.516 20 0 FHADHM CCCCCCNC(=O)[C@H]1CCCN(C(=O)c2cc(CC)ccc2[O-])C1 ZINC000109822541 206064803 /nfs/dbraw/zinc/06/48/03/206064803.db2.gz DNECHGSTEUDLLR-KRWDZBQOSA-N -1 3 360.498 3.503 20 0 FHADHM CC[C@@H](C)c1ccccc1OCC(=O)N=c1cc(OC(F)F)n(C)[n-]1 ZINC000490978123 515348432 /nfs/dbraw/zinc/34/84/32/515348432.db2.gz YJQGUZRONNGTAA-LLVKDONJSA-N -1 3 353.369 3.553 20 0 FHADHM Cn1[n-]c(=NC(=O)C2(Cc3cccc(F)c3)CCC2)cc1OC(F)F ZINC000490997624 515353318 /nfs/dbraw/zinc/35/33/18/515353318.db2.gz CAJXASURUXNTKN-UHFFFAOYSA-N -1 3 353.344 3.512 20 0 FHADHM CN(C(=O)N=c1[n-]nc(C(C)(C)C)s1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474731090 516174295 /nfs/dbraw/zinc/17/42/95/516174295.db2.gz UDFSOLNLWXBXNY-HNNXBMFYSA-N -1 3 373.526 3.574 20 0 FHADHM O=C(N=c1cc(-c2cc(F)cc(F)c2)[n-][nH]1)c1ccc2nccnc2c1 ZINC000532080148 516790475 /nfs/dbraw/zinc/79/04/75/516790475.db2.gz ACPQFRCDGOSJTB-UHFFFAOYSA-N -1 3 351.316 3.550 20 0 FHADHM O=C(N=c1cc([C@@H]2CCCO2)[n-][nH]1)[C@@H]1CCCN1Cc1ccc(Cl)cc1 ZINC000529522805 517197375 /nfs/dbraw/zinc/19/73/75/517197375.db2.gz VZGRYPYJNCFIBR-IRXDYDNUSA-N -1 3 374.872 3.518 20 0 FHADHM O=C(N=c1cc([C@H]2CCCO2)[n-][nH]1)c1ccc(Br)c(F)c1F ZINC000529522205 517197396 /nfs/dbraw/zinc/19/73/96/517197396.db2.gz UBJIGKMUDOIEBH-SNVBAGLBSA-N -1 3 372.169 3.554 20 0 FHADHM Cc1cc(C)c(-c2cc(=NC(=O)[C@@H](C)OC[C@@H]3CCCO3)[nH][n-]2)cc1C ZINC000520607448 517454068 /nfs/dbraw/zinc/45/40/68/517454068.db2.gz LOHQXJBWCVTNBO-CVEARBPZSA-N -1 3 357.454 3.525 20 0 FHADHM Cc1[n-][nH]c(=NC(=O)c2cn(-c3cccc(C)c3)nn2)c1-c1ccccc1 ZINC000522311331 518074845 /nfs/dbraw/zinc/07/48/45/518074845.db2.gz SLRPONBLIOGYAH-UHFFFAOYSA-N -1 3 358.405 3.527 20 0 FHADHM CCN(CC)[C@H](CNC(=O)c1csc(=NC2CC2)[n-]1)c1ccccc1 ZINC000607052939 521246718 /nfs/dbraw/zinc/24/67/18/521246718.db2.gz FAXPBIJXJCBIGC-QGZVFWFLSA-N -1 3 358.511 3.530 20 0 FHADHM O=C(N=c1cc([C@H]2CCCO2)[n-][nH]1)c1cccc(NCc2ccccn2)c1 ZINC000636143919 522768057 /nfs/dbraw/zinc/76/80/57/522768057.db2.gz NMJAYEWTPAWNBU-GOSISDBHSA-N -1 3 363.421 3.521 20 0 FHADHM CN(C)[C@@H](CNc1ncc(C(=O)[O-])s1)c1cccc(C(F)(F)F)c1 ZINC000630458947 522861293 /nfs/dbraw/zinc/86/12/93/522861293.db2.gz IGKFDQDYKAGTOI-NSHDSACASA-N -1 3 359.373 3.575 20 0 FHADHM C[C@H](NC(=O)c1cccs1)C(=O)N=c1cc(-c2cccc(Cl)c2)[n-][nH]1 ZINC000622892296 523534220 /nfs/dbraw/zinc/53/42/20/523534220.db2.gz KFOGUNXWKXBDIN-JTQLQIEISA-N -1 3 374.853 3.549 20 0 FHADHM O=C(c1ccc2c(c1[O-])CCCC2)N1CCO[C@@H](c2ccccc2F)C1 ZINC000185780386 567863379 /nfs/dbraw/zinc/86/33/79/567863379.db2.gz JHRSEDSSKLIAIW-LJQANCHMSA-N -1 3 355.409 3.624 20 0 FHADHM CC(C)(C)OC(=O)c1cccc([N-]C(=O)c2ocnc2C(F)(F)F)c1 ZINC000602171265 567947512 /nfs/dbraw/zinc/94/75/12/567947512.db2.gz IPDBHLSPBQGQEB-UHFFFAOYSA-N -1 3 356.300 3.901 20 0 FHADHM COc1ccc([O-])c(C(=O)N[C@@H](C)Cc2cccc(Br)c2)c1 ZINC000521414435 567951436 /nfs/dbraw/zinc/95/14/36/567951436.db2.gz LYJIRELOXCRANO-NSHDSACASA-N -1 3 364.239 3.524 20 0 FHADHM Cc1cccc([O-])c1C(=O)N1C[C@H](O)C[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000626251247 567975880 /nfs/dbraw/zinc/97/58/80/567975880.db2.gz VXGHIYFJRSFHPZ-HUUCEWRRSA-N -1 3 365.351 3.668 20 0 FHADHM Cc1csc(N(C)C(=O)c2ccc(C(=O)c3cccc([O-])c3)cc2)n1 ZINC000186800619 567984637 /nfs/dbraw/zinc/98/46/37/567984637.db2.gz FWQALJCDDWLEGZ-UHFFFAOYSA-N -1 3 352.415 3.665 20 0 FHADHM COc1ccc([C@@H]([N-]S(=O)(=O)c2ccccc2SC)C2CC2)cc1 ZINC000186898629 568005285 /nfs/dbraw/zinc/00/52/85/568005285.db2.gz ULRHAURCBMSPOL-SFHVURJKSA-N -1 3 363.504 3.847 20 0 FHADHM COc1ccc(F)cc1[C@H](C)[N-]S(=O)(=O)c1ccccc1SC ZINC000186988076 568038190 /nfs/dbraw/zinc/03/81/90/568038190.db2.gz DECBEURXPXDCRS-NSHDSACASA-N -1 3 355.456 3.596 20 0 FHADHM Cc1ccc(NC(=O)c2cccc(Br)c2[O-])c(CN(C)C)c1 ZINC000603737035 568152856 /nfs/dbraw/zinc/15/28/56/568152856.db2.gz WQJONLPQIPLMJW-UHFFFAOYSA-N -1 3 363.255 3.777 20 0 FHADHM CC(C)(C)c1ccc(C2(C(=O)[N-]c3nnc4[nH]cnn34)CCCCC2)cc1 ZINC000647737477 568205922 /nfs/dbraw/zinc/20/59/22/568205922.db2.gz LWNBPJPIRSLEAN-UHFFFAOYSA-N -1 3 366.469 3.591 20 0 FHADHM CCN(Cc1nc(=O)c2c(-c3ccco3)csc2[n-]1)C[C@@H]1CCOC1 ZINC000604053727 568206995 /nfs/dbraw/zinc/20/69/95/568206995.db2.gz SWMVRLRNBXJBDU-LBPRGKRZSA-N -1 3 359.451 3.515 20 0 FHADHM CCOC(=O)c1ncc(NC(=O)[C@H]2C[C@@H]2c2cc(Cl)cc(Cl)c2)[n-]1 ZINC000617877705 568208503 /nfs/dbraw/zinc/20/85/03/568208503.db2.gz VZTSQZCGXCBTQK-NEPJUHHUSA-N -1 3 368.220 3.635 20 0 FHADHM CCOC(=O)c1nc(NC(=O)[C@H]2C[C@@H]2c2cc(Cl)cc(Cl)c2)c[n-]1 ZINC000617877705 568208504 /nfs/dbraw/zinc/20/85/04/568208504.db2.gz VZTSQZCGXCBTQK-NEPJUHHUSA-N -1 3 368.220 3.635 20 0 FHADHM Cc1cc(C)cc(-c2nnc([N-]C(=O)c3cnn(C)c3C(F)F)s2)c1 ZINC000604264721 568237219 /nfs/dbraw/zinc/23/72/19/568237219.db2.gz XSIWNKONNNLESF-UHFFFAOYSA-N -1 3 363.393 3.745 20 0 FHADHM CC(C)[C@H](CC1CCCCC1)C(=O)NCc1ccc(-c2nnn[n-]2)cc1 ZINC000604329406 568250476 /nfs/dbraw/zinc/25/04/76/568250476.db2.gz ZHQYDQXOURFNJE-SFHVURJKSA-N -1 3 355.486 3.726 20 0 FHADHM CC(C)[C@H](CC1CCCCC1)C(=O)NCc1ccc(-c2nn[n-]n2)cc1 ZINC000604329406 568250477 /nfs/dbraw/zinc/25/04/77/568250477.db2.gz ZHQYDQXOURFNJE-SFHVURJKSA-N -1 3 355.486 3.726 20 0 FHADHM CC(=O)Nc1ccc(S(=O)(=O)[N-][C@H](CCC(C)C)C(C)(C)C)c(F)c1 ZINC000604410564 568271780 /nfs/dbraw/zinc/27/17/80/568271780.db2.gz DWWGBQLRUSFSRB-QGZVFWFLSA-N -1 3 372.506 3.913 20 0 FHADHM CC[C@@H]([N-]S(=O)(=O)c1ccc(F)c(F)c1F)c1cc(F)ccc1F ZINC000303859045 568282412 /nfs/dbraw/zinc/28/24/12/568282412.db2.gz PHQZTNSUBLLXTC-GFCCVEGCSA-N -1 3 365.323 3.812 20 0 FHADHM Cc1cc(=O)[n-]c(-c2cccc(NC(=O)c3cc4sccc4[nH]3)c2)n1 ZINC000365266393 568385219 /nfs/dbraw/zinc/38/52/19/568385219.db2.gz MZJJDBCTVMYJEN-UHFFFAOYSA-N -1 3 350.403 3.953 20 0 FHADHM Clc1cc(CSc2n[n-]c(-c3ccccn3)n2)cc2c1OCCCO2 ZINC000604932797 568395250 /nfs/dbraw/zinc/39/52/50/568395250.db2.gz OVBIBKDBHCTYPL-UHFFFAOYSA-N -1 3 374.853 3.974 20 0 FHADHM O=C(Nc1cccc(C2CCC2)c1)[C@H]1CCCN1C(=O)c1ccccc1[O-] ZINC000643293449 568628186 /nfs/dbraw/zinc/62/81/86/568628186.db2.gz YJMGDRQGWNHYBW-LJQANCHMSA-N -1 3 364.445 3.903 20 0 FHADHM CC(C)c1cc(C(=O)N2C[C@@H](C)O[C@]3(CCOC3)C2)c([O-])c(C(C)C)c1 ZINC000408329767 568693639 /nfs/dbraw/zinc/69/36/39/568693639.db2.gz ZTHRVCYEXZBTMP-QVKFZJNVSA-N -1 3 361.482 3.659 20 0 FHADHM Cc1nnc(-c2cccc(-c3nnn[n-]3)c2)n1Cc1cccc2ccccc21 ZINC000737523102 598826590 /nfs/dbraw/zinc/82/65/90/598826590.db2.gz GTGJNJBXCXBBPA-UHFFFAOYSA-N -1 3 367.416 3.635 20 0 FHADHM Cc1nnc(-c2cccc(-c3nn[n-]n3)c2)n1Cc1cccc2ccccc21 ZINC000737523102 598826591 /nfs/dbraw/zinc/82/65/91/598826591.db2.gz GTGJNJBXCXBBPA-UHFFFAOYSA-N -1 3 367.416 3.635 20 0 FHADHM CS[C@@H](C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1)c1ccccc1 ZINC000737171782 598829735 /nfs/dbraw/zinc/82/97/35/598829735.db2.gz PRVPTRWWGZIJML-CQSZACIVSA-N -1 3 359.842 3.563 20 0 FHADHM CS[C@@H](C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1)c1ccccc1 ZINC000737171782 598829737 /nfs/dbraw/zinc/82/97/37/598829737.db2.gz PRVPTRWWGZIJML-CQSZACIVSA-N -1 3 359.842 3.563 20 0 FHADHM CCCCSCCC(=O)N(CC)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736462204 598830759 /nfs/dbraw/zinc/83/07/59/598830759.db2.gz CCSFHDMOAVUZBI-AWEZNQCLSA-N -1 3 361.515 3.700 20 0 FHADHM CCCCSCCC(=O)N(CC)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736462204 598830760 /nfs/dbraw/zinc/83/07/60/598830760.db2.gz CCSFHDMOAVUZBI-AWEZNQCLSA-N -1 3 361.515 3.700 20 0 FHADHM O=C(NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1)c1ccccc1 ZINC000738110470 598835160 /nfs/dbraw/zinc/83/51/60/598835160.db2.gz CZCAJWIFKBWWCD-UHFFFAOYSA-N -1 3 361.430 3.525 20 0 FHADHM CCc1ccc([C@H]2CCCCCN2C(=O)c2ccc(-c3nnn[n-]3)cc2)o1 ZINC000736684978 598835661 /nfs/dbraw/zinc/83/56/61/598835661.db2.gz JAOLRFCJAGZXQE-QGZVFWFLSA-N -1 3 365.437 3.780 20 0 FHADHM CCc1ccc([C@H]2CCCCCN2C(=O)c2ccc(-c3nn[n-]n3)cc2)o1 ZINC000736684978 598835662 /nfs/dbraw/zinc/83/56/62/598835662.db2.gz JAOLRFCJAGZXQE-QGZVFWFLSA-N -1 3 365.437 3.780 20 0 FHADHM CCCOc1ccccc1NC(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736493950 598850049 /nfs/dbraw/zinc/85/00/49/598850049.db2.gz ZMWDFDBHGJFDJM-UHFFFAOYSA-N -1 3 372.816 3.953 20 0 FHADHM CCCOc1ccccc1NC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736493950 598850050 /nfs/dbraw/zinc/85/00/50/598850050.db2.gz ZMWDFDBHGJFDJM-UHFFFAOYSA-N -1 3 372.816 3.953 20 0 FHADHM Clc1ccccc1-c1noc(C=Cc2ccccc2-c2nnn[n-]2)n1 ZINC000737585029 598860089 /nfs/dbraw/zinc/86/00/89/598860089.db2.gz WVSXFALAKVGORJ-KTKRTIGZSA-N -1 3 350.769 3.741 20 0 FHADHM Clc1ccccc1-c1noc(C=Cc2ccccc2-c2nn[n-]n2)n1 ZINC000737585029 598860091 /nfs/dbraw/zinc/86/00/91/598860091.db2.gz WVSXFALAKVGORJ-KTKRTIGZSA-N -1 3 350.769 3.741 20 0 FHADHM FC(F)(F)CCSc1nc(-c2ccccc2)ccc1-c1nnn[n-]1 ZINC000737625987 598902485 /nfs/dbraw/zinc/90/24/85/598902485.db2.gz DVEFDWYDFQYYAI-UHFFFAOYSA-N -1 3 351.357 3.973 20 0 FHADHM FC(F)(F)CCSc1nc(-c2ccccc2)ccc1-c1nn[n-]n1 ZINC000737625987 598902487 /nfs/dbraw/zinc/90/24/87/598902487.db2.gz DVEFDWYDFQYYAI-UHFFFAOYSA-N -1 3 351.357 3.973 20 0 FHADHM CC[C@H](NC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1ccc(Cl)s1 ZINC000736353952 598907443 /nfs/dbraw/zinc/90/74/43/598907443.db2.gz CXGZTFFPWDYELD-SZNGSJQDSA-N -1 3 373.869 3.862 20 0 FHADHM CC[C@H](NC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1ccc(Cl)s1 ZINC000736353952 598907445 /nfs/dbraw/zinc/90/74/45/598907445.db2.gz CXGZTFFPWDYELD-SZNGSJQDSA-N -1 3 373.869 3.862 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1Nc1ccc(N2CCCCC2)cc1 ZINC000737556992 598934694 /nfs/dbraw/zinc/93/46/94/598934694.db2.gz ARMOVXFLVVIADT-UHFFFAOYSA-N -1 3 355.833 3.649 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1Nc1ccc(N2CCCCC2)cc1 ZINC000737556992 598934696 /nfs/dbraw/zinc/93/46/96/598934696.db2.gz ARMOVXFLVVIADT-UHFFFAOYSA-N -1 3 355.833 3.649 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1NCc1csc(-c2ccccc2)n1 ZINC000737558929 598936184 /nfs/dbraw/zinc/93/61/84/598936184.db2.gz SADJXXJXRDFLIE-UHFFFAOYSA-N -1 3 369.841 3.651 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1NCc1csc(-c2ccccc2)n1 ZINC000737558929 598936185 /nfs/dbraw/zinc/93/61/85/598936185.db2.gz SADJXXJXRDFLIE-UHFFFAOYSA-N -1 3 369.841 3.651 20 0 FHADHM CCn1c(C)cc2c1CCC[C@H]2Nc1ncc(-c2nnn[n-]2)cc1Cl ZINC000736720217 598939839 /nfs/dbraw/zinc/93/98/39/598939839.db2.gz MUKGYQLPAGCDGP-CQSZACIVSA-N -1 3 357.849 3.534 20 0 FHADHM CCn1c(C)cc2c1CCC[C@H]2Nc1ncc(-c2nn[n-]n2)cc1Cl ZINC000736720217 598939841 /nfs/dbraw/zinc/93/98/41/598939841.db2.gz MUKGYQLPAGCDGP-CQSZACIVSA-N -1 3 357.849 3.534 20 0 FHADHM CC(C)C[C@@H]1CCCCCN1C(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000735794678 598942004 /nfs/dbraw/zinc/94/20/04/598942004.db2.gz AEZGZJGDVOMLNY-INIZCTEOSA-N -1 3 373.526 3.776 20 0 FHADHM CC(C)C[C@@H]1CCCCCN1C(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000735794678 598942006 /nfs/dbraw/zinc/94/20/06/598942006.db2.gz AEZGZJGDVOMLNY-INIZCTEOSA-N -1 3 373.526 3.776 20 0 FHADHM Cc1ccc(Nc2ncc(-c3nnn[n-]3)cc2Cl)cc1OC(F)F ZINC000737360808 598944016 /nfs/dbraw/zinc/94/40/16/598944016.db2.gz CDSVVLRPNHNNNA-UHFFFAOYSA-N -1 3 352.732 3.569 20 0 FHADHM Cc1ccc(Nc2ncc(-c3nn[n-]n3)cc2Cl)cc1OC(F)F ZINC000737360808 598944019 /nfs/dbraw/zinc/94/40/19/598944019.db2.gz CDSVVLRPNHNNNA-UHFFFAOYSA-N -1 3 352.732 3.569 20 0 FHADHM C[C@@H]1C[C@@H](C)N(C(=O)c2cccc(Oc3ccc(-c4nnn[n-]4)cc3)c2)C1 ZINC000736228599 598951521 /nfs/dbraw/zinc/95/15/21/598951521.db2.gz OITBXSIGUYELLH-ZIAGYGMSSA-N -1 3 363.421 3.530 20 0 FHADHM C[C@@H]1C[C@@H](C)N(C(=O)c2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)C1 ZINC000736228599 598951522 /nfs/dbraw/zinc/95/15/22/598951522.db2.gz OITBXSIGUYELLH-ZIAGYGMSSA-N -1 3 363.421 3.530 20 0 FHADHM Cc1cccc(NC2CCN(c3cc(Cl)ccc3-c3nnn[n-]3)CC2)c1 ZINC000737398996 598975659 /nfs/dbraw/zinc/97/56/59/598975659.db2.gz HAEYJRGQXBPORD-UHFFFAOYSA-N -1 3 368.872 3.909 20 0 FHADHM Cc1cccc(NC2CCN(c3cc(Cl)ccc3-c3nn[n-]n3)CC2)c1 ZINC000737398996 598975660 /nfs/dbraw/zinc/97/56/60/598975660.db2.gz HAEYJRGQXBPORD-UHFFFAOYSA-N -1 3 368.872 3.909 20 0 FHADHM O=C(CCC1CC1)Nc1cccc(OCc2cccc(-c3nnn[n-]3)c2)c1 ZINC000737824880 598993357 /nfs/dbraw/zinc/99/33/57/598993357.db2.gz UPOWQIWEOYTKJI-UHFFFAOYSA-N -1 3 363.421 3.574 20 0 FHADHM O=C(CCC1CC1)Nc1cccc(OCc2cccc(-c3nn[n-]n3)c2)c1 ZINC000737824880 598993358 /nfs/dbraw/zinc/99/33/58/598993358.db2.gz UPOWQIWEOYTKJI-UHFFFAOYSA-N -1 3 363.421 3.574 20 0 FHADHM Fc1ccc(CSCCOC2CCCCCC2)c(-c2nnn[n-]2)c1 ZINC000737648391 599010193 /nfs/dbraw/zinc/01/01/93/599010193.db2.gz JVAMMONQWOEFEH-UHFFFAOYSA-N -1 3 350.463 3.978 20 0 FHADHM Fc1ccc(CSCCOC2CCCCCC2)c(-c2nn[n-]n2)c1 ZINC000737648391 599010195 /nfs/dbraw/zinc/01/01/95/599010195.db2.gz JVAMMONQWOEFEH-UHFFFAOYSA-N -1 3 350.463 3.978 20 0 FHADHM COC(=O)[C@@H](C)CSCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000736895581 599014538 /nfs/dbraw/zinc/01/45/38/599014538.db2.gz YNPUEHMXIUZHOU-ZDUSSCGKSA-N -1 3 368.462 3.576 20 0 FHADHM COC(=O)[C@@H](C)CSCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000736895581 599014540 /nfs/dbraw/zinc/01/45/40/599014540.db2.gz YNPUEHMXIUZHOU-ZDUSSCGKSA-N -1 3 368.462 3.576 20 0 FHADHM CC(C)(C)Oc1ccccc1NC(=O)C=Cc1ccccc1-c1nnn[n-]1 ZINC000735639621 599017948 /nfs/dbraw/zinc/01/79/48/599017948.db2.gz KDDVXQJNISFLOG-OUKQBFOZSA-N -1 3 363.421 3.696 20 0 FHADHM CC(C)(C)Oc1ccccc1NC(=O)C=Cc1ccccc1-c1nn[n-]n1 ZINC000735639621 599017950 /nfs/dbraw/zinc/01/79/50/599017950.db2.gz KDDVXQJNISFLOG-OUKQBFOZSA-N -1 3 363.421 3.696 20 0 FHADHM CC(C)C[C@@H](C(=O)OCc1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000735757612 599019005 /nfs/dbraw/zinc/01/90/05/599019005.db2.gz UZRZJTJVVWQJOG-GOSISDBHSA-N -1 3 350.422 3.740 20 0 FHADHM CC(C)C[C@@H](C(=O)OCc1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000735757612 599019007 /nfs/dbraw/zinc/01/90/07/599019007.db2.gz UZRZJTJVVWQJOG-GOSISDBHSA-N -1 3 350.422 3.740 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)NC1(c2cccc(Cl)c2)CC1 ZINC000737295436 599021472 /nfs/dbraw/zinc/02/14/72/599021472.db2.gz WOKLKSUHIGVMCN-UHFFFAOYSA-N -1 3 368.828 3.639 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)NC1(c2cccc(Cl)c2)CC1 ZINC000737295436 599021474 /nfs/dbraw/zinc/02/14/74/599021474.db2.gz WOKLKSUHIGVMCN-UHFFFAOYSA-N -1 3 368.828 3.639 20 0 FHADHM C[C@H]1CN(c2c(Cl)cccc2-c2nnn[n-]2)C[C@@H](c2ccc(F)cc2)O1 ZINC000820768348 599038615 /nfs/dbraw/zinc/03/86/15/599038615.db2.gz MWIHIFUVERPACQ-ZBEGNZNMSA-N -1 3 373.819 3.626 20 0 FHADHM C[C@H]1CN(c2c(Cl)cccc2-c2nn[n-]n2)C[C@@H](c2ccc(F)cc2)O1 ZINC000820768348 599038618 /nfs/dbraw/zinc/03/86/18/599038618.db2.gz MWIHIFUVERPACQ-ZBEGNZNMSA-N -1 3 373.819 3.626 20 0 FHADHM C[C@@H]1CN(c2c(Cl)cccc2-c2nnn[n-]2)C[C@H](c2ccc(F)cc2)O1 ZINC000820768343 599038950 /nfs/dbraw/zinc/03/89/50/599038950.db2.gz MWIHIFUVERPACQ-BDJLRTHQSA-N -1 3 373.819 3.626 20 0 FHADHM C[C@@H]1CN(c2c(Cl)cccc2-c2nn[n-]n2)C[C@H](c2ccc(F)cc2)O1 ZINC000820768343 599038951 /nfs/dbraw/zinc/03/89/51/599038951.db2.gz MWIHIFUVERPACQ-BDJLRTHQSA-N -1 3 373.819 3.626 20 0 FHADHM CC(C)(CNc1nc(C(F)(F)F)ccc1-c1nnn[n-]1)c1ccccc1 ZINC000735671161 599043131 /nfs/dbraw/zinc/04/31/31/599043131.db2.gz PVZDNVWQHLWDBH-UHFFFAOYSA-N -1 3 362.359 3.670 20 0 FHADHM CC(C)(CNc1nc(C(F)(F)F)ccc1-c1nn[n-]n1)c1ccccc1 ZINC000735671161 599043134 /nfs/dbraw/zinc/04/31/34/599043134.db2.gz PVZDNVWQHLWDBH-UHFFFAOYSA-N -1 3 362.359 3.670 20 0 FHADHM CO[C@H](CNc1c(F)cc(-c2nnn[n-]2)cc1F)c1ccc(Cl)cc1 ZINC000821677540 599044136 /nfs/dbraw/zinc/04/41/36/599044136.db2.gz ZLWGNJPEFZAESD-CQSZACIVSA-N -1 3 365.771 3.598 20 0 FHADHM CO[C@H](CNc1c(F)cc(-c2nn[n-]n2)cc1F)c1ccc(Cl)cc1 ZINC000821677540 599044139 /nfs/dbraw/zinc/04/41/39/599044139.db2.gz ZLWGNJPEFZAESD-CQSZACIVSA-N -1 3 365.771 3.598 20 0 FHADHM Fc1cccc2c1CC[C@@H]2Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000737663226 599049483 /nfs/dbraw/zinc/04/94/83/599049483.db2.gz HXKJLUBIULENPE-LBPRGKRZSA-N -1 3 364.306 3.519 20 0 FHADHM Fc1cccc2c1CC[C@@H]2Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000737663226 599049485 /nfs/dbraw/zinc/04/94/85/599049485.db2.gz HXKJLUBIULENPE-LBPRGKRZSA-N -1 3 364.306 3.519 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N(CC2CC2)C2CCCCC2)n1 ZINC000737631037 599053116 /nfs/dbraw/zinc/05/31/16/599053116.db2.gz BWJYVBRHLOORFY-UHFFFAOYSA-N -1 3 366.391 3.830 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N(CC2CC2)C2CCCCC2)n1 ZINC000737631037 599053119 /nfs/dbraw/zinc/05/31/19/599053119.db2.gz BWJYVBRHLOORFY-UHFFFAOYSA-N -1 3 366.391 3.830 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1N1CCC(OCC2CCCCC2)CC1 ZINC000822743682 599058658 /nfs/dbraw/zinc/05/86/58/599058658.db2.gz DANCPECLLHKDRQ-UHFFFAOYSA-N -1 3 359.449 3.572 20 0 FHADHM Clc1ccc(N[C@H]2CCCN(c3ccccc3)C2)c(-c2nnn[n-]2)c1 ZINC000737576177 599059608 /nfs/dbraw/zinc/05/96/08/599059608.db2.gz XJZLBVDYRZIWLW-AWEZNQCLSA-N -1 3 354.845 3.601 20 0 FHADHM Clc1ccc(N[C@H]2CCCN(c3ccccc3)C2)c(-c2nn[n-]n2)c1 ZINC000737576177 599059611 /nfs/dbraw/zinc/05/96/11/599059611.db2.gz XJZLBVDYRZIWLW-AWEZNQCLSA-N -1 3 354.845 3.601 20 0 FHADHM Clc1cc(N[C@H]2CCCN(c3ccccc3)C2)ccc1-c1nnn[n-]1 ZINC000737566646 599059927 /nfs/dbraw/zinc/05/99/27/599059927.db2.gz WHJNISWIHCEVJR-AWEZNQCLSA-N -1 3 354.845 3.601 20 0 FHADHM Clc1cc(N[C@H]2CCCN(c3ccccc3)C2)ccc1-c1nn[n-]n1 ZINC000737566646 599059930 /nfs/dbraw/zinc/05/99/30/599059930.db2.gz WHJNISWIHCEVJR-AWEZNQCLSA-N -1 3 354.845 3.601 20 0 FHADHM Cc1ccc(CC[C@@H](C)Nc2nc(C(F)(F)F)ccc2-c2nnn[n-]2)o1 ZINC000822236158 599064819 /nfs/dbraw/zinc/06/48/19/599064819.db2.gz MFNBLWVSMLHHIE-SECBINFHSA-N -1 3 366.347 3.615 20 0 FHADHM Cc1ccc(CC[C@@H](C)Nc2nc(C(F)(F)F)ccc2-c2nn[n-]n2)o1 ZINC000822236158 599064821 /nfs/dbraw/zinc/06/48/21/599064821.db2.gz MFNBLWVSMLHHIE-SECBINFHSA-N -1 3 366.347 3.615 20 0 FHADHM C[C@H](Sc1ccc(-c2nnn[n-]2)cc1F)c1nc2ccccc2c(=O)[nH]1 ZINC000736193932 599065223 /nfs/dbraw/zinc/06/52/23/599065223.db2.gz UYNXENMDDMTLHC-VIFPVBQESA-N -1 3 368.397 3.508 20 0 FHADHM C[C@H](Sc1ccc(-c2nn[n-]n2)cc1F)c1nc2ccccc2c(=O)[nH]1 ZINC000736193932 599065226 /nfs/dbraw/zinc/06/52/26/599065226.db2.gz UYNXENMDDMTLHC-VIFPVBQESA-N -1 3 368.397 3.508 20 0 FHADHM Cc1ccccc1O[C@H](C)CNc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000822366518 599065909 /nfs/dbraw/zinc/06/59/09/599065909.db2.gz LIDFJMRBFTXUCS-CQSZACIVSA-N -1 3 360.421 3.603 20 0 FHADHM Cc1ccccc1O[C@H](C)CNc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000822366518 599065912 /nfs/dbraw/zinc/06/59/12/599065912.db2.gz LIDFJMRBFTXUCS-CQSZACIVSA-N -1 3 360.421 3.603 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)[C@@H]1C[C@@H]1C1CCCCC1 ZINC000735654818 599070151 /nfs/dbraw/zinc/07/01/51/599070151.db2.gz JCBKDMBVLDNCEZ-HUUCEWRRSA-N -1 3 356.474 3.578 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)[C@@H]1C[C@@H]1C1CCCCC1 ZINC000735654818 599070156 /nfs/dbraw/zinc/07/01/56/599070156.db2.gz JCBKDMBVLDNCEZ-HUUCEWRRSA-N -1 3 356.474 3.578 20 0 FHADHM C[C@H](C(=O)N(Cc1ccccc1)c1ccccc1-c1nnn[n-]1)c1ccco1 ZINC000735515048 599070259 /nfs/dbraw/zinc/07/02/59/599070259.db2.gz YJDOOIXSLTWNOT-HNNXBMFYSA-N -1 3 373.416 3.797 20 0 FHADHM C[C@H](C(=O)N(Cc1ccccc1)c1ccccc1-c1nn[n-]n1)c1ccco1 ZINC000735515048 599070261 /nfs/dbraw/zinc/07/02/61/599070261.db2.gz YJDOOIXSLTWNOT-HNNXBMFYSA-N -1 3 373.416 3.797 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H]2C[C@@H]2C2CCCCC2)c1-c1nnn[n-]1 ZINC000736672072 599072396 /nfs/dbraw/zinc/07/23/96/599072396.db2.gz XOWXQOSOBWJQOC-KGLIPLIRSA-N -1 3 359.499 3.954 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H]2C[C@@H]2C2CCCCC2)c1-c1nn[n-]n1 ZINC000736672072 599072399 /nfs/dbraw/zinc/07/23/99/599072399.db2.gz XOWXQOSOBWJQOC-KGLIPLIRSA-N -1 3 359.499 3.954 20 0 FHADHM Cc1cccc2c(CCC(=O)Nc3cc(-c4nnn[n-]4)ccc3C)c[nH]c21 ZINC000737292583 599073702 /nfs/dbraw/zinc/07/37/02/599073702.db2.gz VTZFUFAROOJMEA-UHFFFAOYSA-N -1 3 360.421 3.536 20 0 FHADHM Cc1cccc2c(CCC(=O)Nc3cc(-c4nn[n-]n4)ccc3C)c[nH]c21 ZINC000737292583 599073705 /nfs/dbraw/zinc/07/37/05/599073705.db2.gz VTZFUFAROOJMEA-UHFFFAOYSA-N -1 3 360.421 3.536 20 0 FHADHM Fc1ccc(N2CC[C@H](CSc3ccccc3)C2)c(-c2nnn[n-]2)c1 ZINC000822778063 599088610 /nfs/dbraw/zinc/08/86/10/599088610.db2.gz BRWZFSQNJPENPT-ZDUSSCGKSA-N -1 3 355.442 3.624 20 0 FHADHM Fc1ccc(N2CC[C@H](CSc3ccccc3)C2)c(-c2nn[n-]n2)c1 ZINC000822778063 599088612 /nfs/dbraw/zinc/08/86/12/599088612.db2.gz BRWZFSQNJPENPT-ZDUSSCGKSA-N -1 3 355.442 3.624 20 0 FHADHM Fc1ccc(Cl)c2c1ncc(-c1nnn[n-]1)c2N1CCC2(CCCC2)C1 ZINC000822775295 599093346 /nfs/dbraw/zinc/09/33/46/599093346.db2.gz URMPEKSJHNZVSI-UHFFFAOYSA-N -1 3 372.835 3.978 20 0 FHADHM Fc1ccc(Cl)c2c1ncc(-c1nn[n-]n1)c2N1CCC2(CCCC2)C1 ZINC000822775295 599093349 /nfs/dbraw/zinc/09/33/49/599093349.db2.gz URMPEKSJHNZVSI-UHFFFAOYSA-N -1 3 372.835 3.978 20 0 FHADHM C[C@@H](CNc1c(F)cc(-c2nnn[n-]2)cc1F)c1ccc(F)cc1F ZINC000820275260 599096998 /nfs/dbraw/zinc/09/69/98/599096998.db2.gz OIDUONZSADJUEH-QMMMGPOBSA-N -1 3 351.307 3.639 20 0 FHADHM C[C@@H](CNc1c(F)cc(-c2nn[n-]n2)cc1F)c1ccc(F)cc1F ZINC000820275260 599097001 /nfs/dbraw/zinc/09/70/01/599097001.db2.gz OIDUONZSADJUEH-QMMMGPOBSA-N -1 3 351.307 3.639 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)cc1CSC[C@@H]1OCCc2ccccc21 ZINC000737649991 599100441 /nfs/dbraw/zinc/10/04/41/599100441.db2.gz MMVJDIHLMCFZNF-KRWDZBQOSA-N -1 3 356.426 3.553 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CSC[C@@H]1OCCc2ccccc21 ZINC000737649991 599100442 /nfs/dbraw/zinc/10/04/42/599100442.db2.gz MMVJDIHLMCFZNF-KRWDZBQOSA-N -1 3 356.426 3.553 20 0 FHADHM CCO[C@H]1C[C@@H](Nc2cc(-c3nnn[n-]3)c3ccccc3n2)C12CCCC2 ZINC000821359199 599101160 /nfs/dbraw/zinc/10/11/60/599101160.db2.gz MNCLRXGWULCFNY-SJORKVTESA-N -1 3 364.453 3.565 20 0 FHADHM CCO[C@H]1C[C@@H](Nc2cc(-c3nn[n-]n3)c3ccccc3n2)C12CCCC2 ZINC000821359199 599101161 /nfs/dbraw/zinc/10/11/61/599101161.db2.gz MNCLRXGWULCFNY-SJORKVTESA-N -1 3 364.453 3.565 20 0 FHADHM C[C@H](CCC1CCCCC1)NC(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000735986968 599103357 /nfs/dbraw/zinc/10/33/57/599103357.db2.gz UZAJUALQMALWTD-CABCVRRESA-N -1 3 370.501 3.976 20 0 FHADHM C[C@H](CCC1CCCCC1)NC(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000735986968 599103359 /nfs/dbraw/zinc/10/33/59/599103359.db2.gz UZAJUALQMALWTD-CABCVRRESA-N -1 3 370.501 3.976 20 0 FHADHM CC(C)CC[C@H](NC(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1)C(C)(C)C ZINC000735796704 599105939 /nfs/dbraw/zinc/10/59/39/599105939.db2.gz HBEZYZUONWRDPM-KRWDZBQOSA-N -1 3 372.517 3.859 20 0 FHADHM CC(C)CC[C@H](NC(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1)C(C)(C)C ZINC000735796704 599105943 /nfs/dbraw/zinc/10/59/43/599105943.db2.gz HBEZYZUONWRDPM-KRWDZBQOSA-N -1 3 372.517 3.859 20 0 FHADHM CC(C)CC[C@@H](NC(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1)C(C)(C)C ZINC000735798541 599106261 /nfs/dbraw/zinc/10/62/61/599106261.db2.gz XOIDHKNKJLWEGZ-QGZVFWFLSA-N -1 3 372.517 3.859 20 0 FHADHM CC(C)CC[C@@H](NC(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1)C(C)(C)C ZINC000735798541 599106264 /nfs/dbraw/zinc/10/62/64/599106264.db2.gz XOIDHKNKJLWEGZ-QGZVFWFLSA-N -1 3 372.517 3.859 20 0 FHADHM Cc1cccc(C)c1NC(=O)[C@H](C)Sc1ccccc1-c1nnn[n-]1 ZINC000737391271 599111477 /nfs/dbraw/zinc/11/14/77/599111477.db2.gz XCDJMSODALXFHJ-ZDUSSCGKSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1cccc(C)c1NC(=O)[C@H](C)Sc1ccccc1-c1nn[n-]n1 ZINC000737391271 599111480 /nfs/dbraw/zinc/11/14/80/599111480.db2.gz XCDJMSODALXFHJ-ZDUSSCGKSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1cc(C)c(-c2nnn[n-]2)c(NCc2ccc(-c3cccnc3)cc2)n1 ZINC000822192914 599111530 /nfs/dbraw/zinc/11/15/30/599111530.db2.gz FIOLTJBJETUADP-UHFFFAOYSA-N -1 3 357.421 3.553 20 0 FHADHM Cc1cc(C)c(-c2nn[n-]n2)c(NCc2ccc(-c3cccnc3)cc2)n1 ZINC000822192914 599111533 /nfs/dbraw/zinc/11/15/33/599111533.db2.gz FIOLTJBJETUADP-UHFFFAOYSA-N -1 3 357.421 3.553 20 0 FHADHM Cc1ccc(C)c(NC(=O)[C@H](C)Sc2ccccc2-c2nnn[n-]2)c1 ZINC000737324044 599111793 /nfs/dbraw/zinc/11/17/93/599111793.db2.gz ZCRYRINBDBGMQZ-ZDUSSCGKSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1ccc(C)c(NC(=O)[C@H](C)Sc2ccccc2-c2nn[n-]n2)c1 ZINC000737324044 599111796 /nfs/dbraw/zinc/11/17/96/599111796.db2.gz ZCRYRINBDBGMQZ-ZDUSSCGKSA-N -1 3 353.451 3.603 20 0 FHADHM COc1ccccc1[C@@H](C)SCCOc1ccccc1-c1nnn[n-]1 ZINC000821883193 599128479 /nfs/dbraw/zinc/12/84/79/599128479.db2.gz RZPXSHXFTRLFOJ-CYBMUJFWSA-N -1 3 356.451 3.749 20 0 FHADHM COc1ccccc1[C@@H](C)SCCOc1ccccc1-c1nn[n-]n1 ZINC000821883193 599128481 /nfs/dbraw/zinc/12/84/81/599128481.db2.gz RZPXSHXFTRLFOJ-CYBMUJFWSA-N -1 3 356.451 3.749 20 0 FHADHM CC(C)[C@H](C)SCCC(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2 ZINC000820020071 599128721 /nfs/dbraw/zinc/12/87/21/599128721.db2.gz APQDTEVRKFRRTI-JTQLQIEISA-N -1 3 365.528 3.523 20 0 FHADHM CC(C)[C@H](C)SCCC(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2 ZINC000820020071 599128723 /nfs/dbraw/zinc/12/87/23/599128723.db2.gz APQDTEVRKFRRTI-JTQLQIEISA-N -1 3 365.528 3.523 20 0 FHADHM CCOc1ccccc1OCCSc1ccc(-c2nnn[n-]2)cc1F ZINC000821437746 599127109 /nfs/dbraw/zinc/12/71/09/599127109.db2.gz RLWTUCHZPYORGP-UHFFFAOYSA-N -1 3 360.414 3.576 20 0 FHADHM CCOc1ccccc1OCCSc1ccc(-c2nn[n-]n2)cc1F ZINC000821437746 599127111 /nfs/dbraw/zinc/12/71/11/599127111.db2.gz RLWTUCHZPYORGP-UHFFFAOYSA-N -1 3 360.414 3.576 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)CCCC1CCCC1 ZINC000821099336 599140892 /nfs/dbraw/zinc/14/08/92/599140892.db2.gz DWOGRDIGNMNVMP-UHFFFAOYSA-N -1 3 355.486 3.966 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)CCCC1CCCC1 ZINC000821099336 599140893 /nfs/dbraw/zinc/14/08/93/599140893.db2.gz DWOGRDIGNMNVMP-UHFFFAOYSA-N -1 3 355.486 3.966 20 0 FHADHM Cc1cc(Oc2ccc(-c3nnn[n-]3)cc2)ccc1NC(=O)/C=C\C1CC1 ZINC000822211905 599144125 /nfs/dbraw/zinc/14/41/25/599144125.db2.gz SPGCHPUAVYSDNJ-WCIBSUBMSA-N -1 3 361.405 3.872 20 0 FHADHM Cc1cc(Oc2ccc(-c3nn[n-]n3)cc2)ccc1NC(=O)/C=C\C1CC1 ZINC000822211905 599144128 /nfs/dbraw/zinc/14/41/28/599144128.db2.gz SPGCHPUAVYSDNJ-WCIBSUBMSA-N -1 3 361.405 3.872 20 0 FHADHM CCN(C(=O)c1cc(C)cc(F)c1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821161187 599144731 /nfs/dbraw/zinc/14/47/31/599144731.db2.gz WAMSUINXIFJUPG-CYBMUJFWSA-N -1 3 353.401 3.538 20 0 FHADHM CCN(C(=O)c1cc(C)cc(F)c1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821161187 599144732 /nfs/dbraw/zinc/14/47/32/599144732.db2.gz WAMSUINXIFJUPG-CYBMUJFWSA-N -1 3 353.401 3.538 20 0 FHADHM C[C@@H](CC(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C)c1cccc(F)c1 ZINC000735975359 599159728 /nfs/dbraw/zinc/15/97/28/599159728.db2.gz LWAUZJGASREIES-LBPRGKRZSA-N -1 3 370.432 3.695 20 0 FHADHM C[C@@H](CC(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C)c1cccc(F)c1 ZINC000735975359 599159730 /nfs/dbraw/zinc/15/97/30/599159730.db2.gz LWAUZJGASREIES-LBPRGKRZSA-N -1 3 370.432 3.695 20 0 FHADHM Cc1ccc([C@H]2CSCCN2Cc2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000737329654 599174940 /nfs/dbraw/zinc/17/49/40/599174940.db2.gz HGYQWCDGLKIVIH-GOSISDBHSA-N -1 3 369.469 3.604 20 0 FHADHM Clc1ccc([C@@H]2CSCCN2Cc2ccccc2-c2nn[n-]n2)cc1 ZINC000737571074 599177420 /nfs/dbraw/zinc/17/74/20/599177420.db2.gz QMXWEBKIMCLNKA-KRWDZBQOSA-N -1 3 371.897 3.810 20 0 FHADHM CC[C@H](Cc1ccc(Cl)cc1)NC(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000736352378 599181378 /nfs/dbraw/zinc/18/13/78/599181378.db2.gz LCXCTXKKDRZVKP-OAHLLOKOSA-N -1 3 370.844 3.663 20 0 FHADHM CC[C@H](Cc1ccc(Cl)cc1)NC(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000736352378 599181380 /nfs/dbraw/zinc/18/13/80/599181380.db2.gz LCXCTXKKDRZVKP-OAHLLOKOSA-N -1 3 370.844 3.663 20 0 FHADHM CCN(CC)C(=O)c1cccc(Oc2cccc(Cl)c2-c2nnn[n-]2)c1 ZINC000736528756 599192830 /nfs/dbraw/zinc/19/28/30/599192830.db2.gz CPFPSIPGFCRUMS-UHFFFAOYSA-N -1 3 371.828 3.794 20 0 FHADHM O=C(c1cccc(Oc2ccc(Cl)cc2-c2nnn[n-]2)c1)N1CCCC1 ZINC000738279435 599198024 /nfs/dbraw/zinc/19/80/24/599198024.db2.gz RSEGGCUPQZMFIP-UHFFFAOYSA-N -1 3 369.812 3.548 20 0 FHADHM O=C(c1cccc(Oc2ccc(Cl)cc2-c2nn[n-]n2)c1)N1CCCC1 ZINC000738279435 599198027 /nfs/dbraw/zinc/19/80/27/599198027.db2.gz RSEGGCUPQZMFIP-UHFFFAOYSA-N -1 3 369.812 3.548 20 0 FHADHM CCOc1ccccc1OCCSCc1ccc(-c2nnn[n-]2)cc1 ZINC000821438348 599225677 /nfs/dbraw/zinc/22/56/77/599225677.db2.gz ZWCALKZQEPAREQ-UHFFFAOYSA-N -1 3 356.451 3.578 20 0 FHADHM CCOc1ccccc1OCCSCc1ccc(-c2nn[n-]n2)cc1 ZINC000821438348 599225679 /nfs/dbraw/zinc/22/56/79/599225679.db2.gz ZWCALKZQEPAREQ-UHFFFAOYSA-N -1 3 356.451 3.578 20 0 FHADHM C[C@@H](CCSc1ccccc1)OC(=O)Cc1cccc(-c2nnn[n-]2)c1 ZINC000820248483 607261994 /nfs/dbraw/zinc/26/19/94/607261994.db2.gz ILUDMAKXMFUVSR-AWEZNQCLSA-N -1 3 368.462 3.523 20 0 FHADHM C[C@@H](CCSc1ccccc1)OC(=O)Cc1cccc(-c2nn[n-]n2)c1 ZINC000820248483 607261995 /nfs/dbraw/zinc/26/19/95/607261995.db2.gz ILUDMAKXMFUVSR-AWEZNQCLSA-N -1 3 368.462 3.523 20 0 FHADHM CC[C@@H](Cc1ccc(C)cc1)N(CC)C(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000736355098 599233081 /nfs/dbraw/zinc/23/30/81/599233081.db2.gz XSGUHPBPIHOOBY-IBGZPJMESA-N -1 3 363.465 3.659 20 0 FHADHM CC[C@@H](Cc1ccc(C)cc1)N(CC)C(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC000736355098 599233084 /nfs/dbraw/zinc/23/30/84/599233084.db2.gz XSGUHPBPIHOOBY-IBGZPJMESA-N -1 3 363.465 3.659 20 0 FHADHM Fc1ccc(-n2ccc(CSCc3cccc(-c4nnn[n-]4)c3)n2)cc1 ZINC000822761528 599226931 /nfs/dbraw/zinc/22/69/31/599226931.db2.gz OHWOCDFPZCIUIW-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM Fc1ccc(-n2ccc(CSCc3cccc(-c4nn[n-]n4)c3)n2)cc1 ZINC000822761528 599226934 /nfs/dbraw/zinc/22/69/34/599226934.db2.gz OHWOCDFPZCIUIW-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM Cc1c(NC(=O)C=Cc2cnc(C(C)(C)C)s2)cccc1-c1nnn[n-]1 ZINC000822068947 607268671 /nfs/dbraw/zinc/26/86/71/607268671.db2.gz XALXFHZVRBFNCO-HJWRWDBZSA-N -1 3 368.466 3.581 20 0 FHADHM Cc1c(NC(=O)C=Cc2cnc(C(C)(C)C)s2)cccc1-c1nn[n-]n1 ZINC000822068947 607268672 /nfs/dbraw/zinc/26/86/72/607268672.db2.gz XALXFHZVRBFNCO-HJWRWDBZSA-N -1 3 368.466 3.581 20 0 FHADHM CS[C@@H]1CC[C@@H](n2c(C)csc2=Nc2ccccc2-c2nnn[n-]2)C1 ZINC000821951090 599236144 /nfs/dbraw/zinc/23/61/44/599236144.db2.gz UKNAQGWDEFICNA-CHWSQXEVSA-N -1 3 372.523 3.727 20 0 FHADHM CS[C@@H]1CC[C@@H](n2c(C)csc2=Nc2ccccc2-c2nn[n-]n2)C1 ZINC000821951090 599236146 /nfs/dbraw/zinc/23/61/46/599236146.db2.gz UKNAQGWDEFICNA-CHWSQXEVSA-N -1 3 372.523 3.727 20 0 FHADHM Cc1c(Cl)cccc1NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000822034756 599236172 /nfs/dbraw/zinc/23/61/72/599236172.db2.gz KQULXRFNUMJBTF-NSHDSACASA-N -1 3 356.817 3.711 20 0 FHADHM Cc1c(Cl)cccc1NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000822034756 599236173 /nfs/dbraw/zinc/23/61/73/599236173.db2.gz KQULXRFNUMJBTF-NSHDSACASA-N -1 3 356.817 3.711 20 0 FHADHM Cc1c(NC(=O)c2ccc(-c3ccco3)s2)cccc1-c1nnn[n-]1 ZINC000822110028 607266723 /nfs/dbraw/zinc/26/67/23/607266723.db2.gz UHHBOTODNNKNTL-UHFFFAOYSA-N -1 3 351.391 3.749 20 0 FHADHM Cc1c(NC(=O)c2ccc(-c3ccco3)s2)cccc1-c1nn[n-]n1 ZINC000822110028 607266724 /nfs/dbraw/zinc/26/67/24/607266724.db2.gz UHHBOTODNNKNTL-UHFFFAOYSA-N -1 3 351.391 3.749 20 0 FHADHM O=C(Nc1ccc(CC(F)(F)F)cc1)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000823323201 599242162 /nfs/dbraw/zinc/24/21/62/599242162.db2.gz GNVODVXZVLOUSK-UHFFFAOYSA-N -1 3 362.315 3.616 20 0 FHADHM O=C(Nc1ccc(CC(F)(F)F)cc1)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000823323201 599242164 /nfs/dbraw/zinc/24/21/64/599242164.db2.gz GNVODVXZVLOUSK-UHFFFAOYSA-N -1 3 362.315 3.616 20 0 FHADHM CCCCOc1ccc(C(=O)Nc2cccc(-c3nnn[n-]3)c2C)cc1 ZINC000821077402 607271291 /nfs/dbraw/zinc/27/12/91/607271291.db2.gz DSJGCOHIFIRBAZ-UHFFFAOYSA-N -1 3 351.410 3.606 20 0 FHADHM CCCCOc1ccc(C(=O)Nc2cccc(-c3nn[n-]n3)c2C)cc1 ZINC000821077402 607271292 /nfs/dbraw/zinc/27/12/92/607271292.db2.gz DSJGCOHIFIRBAZ-UHFFFAOYSA-N -1 3 351.410 3.606 20 0 FHADHM O=C(Nc1sc2c(c1-c1nnn[n-]1)CCC2)c1cc2cc(F)ccc2o1 ZINC000738210533 599247244 /nfs/dbraw/zinc/24/72/44/599247244.db2.gz QRRAMYPNXGRRBB-UHFFFAOYSA-N -1 3 369.381 3.555 20 0 FHADHM O=C(Nc1sc2c(c1-c1nn[n-]n1)CCC2)c1cc2cc(F)ccc2o1 ZINC000738210533 599247246 /nfs/dbraw/zinc/24/72/46/599247246.db2.gz QRRAMYPNXGRRBB-UHFFFAOYSA-N -1 3 369.381 3.555 20 0 FHADHM CCC[C@H]1[C@H](C)CCCN1C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000821034356 599249710 /nfs/dbraw/zinc/24/97/10/599249710.db2.gz KUMUUCZGPHUTLQ-ABAIWWIYSA-N -1 3 362.865 3.953 20 0 FHADHM CCC[C@H]1[C@H](C)CCCN1C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000821034356 599249712 /nfs/dbraw/zinc/24/97/12/599249712.db2.gz KUMUUCZGPHUTLQ-ABAIWWIYSA-N -1 3 362.865 3.953 20 0 FHADHM COc1cc([C@@H](C)NCc2ccc(C(=O)[O-])cc2)ccc1OC(F)F ZINC000818558008 597245367 /nfs/dbraw/zinc/24/53/67/597245367.db2.gz OGTVHWRLTJPNMX-LLVKDONJSA-N -1 3 351.349 3.846 20 0 FHADHM Cc1c(NC(=O)N[C@@H](C)c2ccc(F)cc2Cl)cccc1-c1nnn[n-]1 ZINC000822092712 607280648 /nfs/dbraw/zinc/28/06/48/607280648.db2.gz YQLSFQLAEXGEPK-JTQLQIEISA-N -1 3 374.807 3.850 20 0 FHADHM Cc1c(NC(=O)N[C@@H](C)c2ccc(F)cc2Cl)cccc1-c1nn[n-]n1 ZINC000822092712 607280649 /nfs/dbraw/zinc/28/06/49/607280649.db2.gz YQLSFQLAEXGEPK-JTQLQIEISA-N -1 3 374.807 3.850 20 0 FHADHM Cc1ccccc1[C@H]1CCCN1C(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000822352411 607287853 /nfs/dbraw/zinc/28/78/53/607287853.db2.gz ZBCICSASRJSBCG-GOSISDBHSA-N -1 3 362.437 3.853 20 0 FHADHM Cc1ccccc1[C@H]1CCCN1C(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000822352411 607287854 /nfs/dbraw/zinc/28/78/54/607287854.db2.gz ZBCICSASRJSBCG-GOSISDBHSA-N -1 3 362.437 3.853 20 0 FHADHM Cc1cc(F)cc2c1ncc(-c1nnn[n-]1)c2N(C)Cc1ccccc1F ZINC000737264595 599255974 /nfs/dbraw/zinc/25/59/74/599255974.db2.gz TWNMFNFSIHTTFT-UHFFFAOYSA-N -1 3 366.375 3.638 20 0 FHADHM Cc1cc(F)cc2c1ncc(-c1nn[n-]n1)c2N(C)Cc1ccccc1F ZINC000737264595 599255977 /nfs/dbraw/zinc/25/59/77/599255977.db2.gz TWNMFNFSIHTTFT-UHFFFAOYSA-N -1 3 366.375 3.638 20 0 FHADHM Cc1c(NC(=O)NCc2cccc3ccccc32)cccc1-c1nnn[n-]1 ZINC000822104849 607285212 /nfs/dbraw/zinc/28/52/12/607285212.db2.gz REFAGLZYUDIVBN-UHFFFAOYSA-N -1 3 358.405 3.650 20 0 FHADHM Cc1c(NC(=O)NCc2cccc3ccccc32)cccc1-c1nn[n-]n1 ZINC000822104849 607285213 /nfs/dbraw/zinc/28/52/13/607285213.db2.gz REFAGLZYUDIVBN-UHFFFAOYSA-N -1 3 358.405 3.650 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@H]2c2ccc(F)cc2)cccc1-c1nnn[n-]1 ZINC000822084326 607285601 /nfs/dbraw/zinc/28/56/01/607285601.db2.gz IYTVEQUVHCMNFR-KRWDZBQOSA-N -1 3 366.400 3.683 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@H]2c2ccc(F)cc2)cccc1-c1nn[n-]n1 ZINC000822084326 607285602 /nfs/dbraw/zinc/28/56/02/607285602.db2.gz IYTVEQUVHCMNFR-KRWDZBQOSA-N -1 3 366.400 3.683 20 0 FHADHM Cc1cccc2c1ncc(-c1nnn[n-]1)c2N1Cc2ccccc2[C@H](C)C1 ZINC000737407645 599257700 /nfs/dbraw/zinc/25/77/00/599257700.db2.gz DIDFOTIVQNHAOA-CQSZACIVSA-N -1 3 356.433 3.847 20 0 FHADHM Cc1cccc2c1ncc(-c1nn[n-]n1)c2N1Cc2ccccc2[C@H](C)C1 ZINC000737407645 599257702 /nfs/dbraw/zinc/25/77/02/599257702.db2.gz DIDFOTIVQNHAOA-CQSZACIVSA-N -1 3 356.433 3.847 20 0 FHADHM Cc1ccc([C@@H](C)NC(=O)Nc2cccc(-c3nnn[n-]3)c2C)cc1C ZINC000822229355 607286970 /nfs/dbraw/zinc/28/69/70/607286970.db2.gz SCUNKMZCANAFQM-CQSZACIVSA-N -1 3 350.426 3.675 20 0 FHADHM Cc1ccc([C@@H](C)NC(=O)Nc2cccc(-c3nn[n-]n3)c2C)cc1C ZINC000822229355 607286971 /nfs/dbraw/zinc/28/69/71/607286971.db2.gz SCUNKMZCANAFQM-CQSZACIVSA-N -1 3 350.426 3.675 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@H]2c2ccsc2)cccc1-c1nnn[n-]1 ZINC000822084489 607292341 /nfs/dbraw/zinc/29/23/41/607292341.db2.gz LBTYJBFIBFHCBQ-HNNXBMFYSA-N -1 3 354.439 3.606 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@H]2c2ccsc2)cccc1-c1nn[n-]n1 ZINC000822084489 607292342 /nfs/dbraw/zinc/29/23/42/607292342.db2.gz LBTYJBFIBFHCBQ-HNNXBMFYSA-N -1 3 354.439 3.606 20 0 FHADHM Cc1c(NC(=O)N(Cc2ccccc2F)C(C)C)cccc1-c1nnn[n-]1 ZINC000822084957 607292368 /nfs/dbraw/zinc/29/23/68/607292368.db2.gz UBQQYONNNANXFJ-UHFFFAOYSA-N -1 3 368.416 3.757 20 0 FHADHM Cc1c(NC(=O)N(Cc2ccccc2F)C(C)C)cccc1-c1nn[n-]n1 ZINC000822084957 607292369 /nfs/dbraw/zinc/29/23/69/607292369.db2.gz UBQQYONNNANXFJ-UHFFFAOYSA-N -1 3 368.416 3.757 20 0 FHADHM CC[C@@H](NC(=O)Nc1cccc(-c2nnn[n-]2)c1C)c1cc(F)ccc1F ZINC000820919941 607293075 /nfs/dbraw/zinc/29/30/75/607293075.db2.gz HWSHBJVMCXISFS-OAHLLOKOSA-N -1 3 372.379 3.726 20 0 FHADHM CC[C@@H](NC(=O)Nc1cccc(-c2nn[n-]n2)c1C)c1cc(F)ccc1F ZINC000820919941 607293076 /nfs/dbraw/zinc/29/30/76/607293076.db2.gz HWSHBJVMCXISFS-OAHLLOKOSA-N -1 3 372.379 3.726 20 0 FHADHM Cc1c(NC(=O)C2(c3cccc(Cl)c3)CCC2)cccc1-c1nnn[n-]1 ZINC000822061503 607295831 /nfs/dbraw/zinc/29/58/31/607295831.db2.gz OKTZYYVCPXOFNO-UHFFFAOYSA-N -1 3 367.840 3.889 20 0 FHADHM Cc1c(NC(=O)C2(c3cccc(Cl)c3)CCC2)cccc1-c1nn[n-]n1 ZINC000822061503 607295832 /nfs/dbraw/zinc/29/58/32/607295832.db2.gz OKTZYYVCPXOFNO-UHFFFAOYSA-N -1 3 367.840 3.889 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CCCC(C)(C)CC1 ZINC000820151621 599261053 /nfs/dbraw/zinc/26/10/53/599261053.db2.gz JYCRUCPEDXVBPA-UHFFFAOYSA-N -1 3 372.473 3.698 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CCCC(C)(C)CC1 ZINC000820151621 599261055 /nfs/dbraw/zinc/26/10/55/599261055.db2.gz JYCRUCPEDXVBPA-UHFFFAOYSA-N -1 3 372.473 3.698 20 0 FHADHM CCCC(=O)Nc1cccc(NCc2ccc(-c3nnn[n-]3)s2)c1C ZINC000821009659 607310448 /nfs/dbraw/zinc/31/04/48/607310448.db2.gz XVRYIIYMQUTMSF-UHFFFAOYSA-N -1 3 356.455 3.587 20 0 FHADHM CCCC(=O)Nc1cccc(NCc2cc(-c3nnn[n-]3)cs2)c1C ZINC000821009628 607310565 /nfs/dbraw/zinc/31/05/65/607310565.db2.gz XDRCOCDMRUGAMH-UHFFFAOYSA-N -1 3 356.455 3.587 20 0 FHADHM CCCC(=O)Nc1cccc(NCc2cc(-c3nn[n-]n3)cs2)c1C ZINC000821009628 607310566 /nfs/dbraw/zinc/31/05/66/607310566.db2.gz XDRCOCDMRUGAMH-UHFFFAOYSA-N -1 3 356.455 3.587 20 0 FHADHM CC1CCN(c2ccc(NCc3ccc(-c4nnn[n-]4)s3)cc2)CC1 ZINC000820727265 607310693 /nfs/dbraw/zinc/31/06/93/607310693.db2.gz JRZFLGCNMUGGAU-UHFFFAOYSA-N -1 3 354.483 3.777 20 0 FHADHM CC1CCN(c2ccc(NCc3ccc(-c4nn[n-]n4)s3)cc2)CC1 ZINC000820727265 607310694 /nfs/dbraw/zinc/31/06/94/607310694.db2.gz JRZFLGCNMUGGAU-UHFFFAOYSA-N -1 3 354.483 3.777 20 0 FHADHM COc1ccc(CNc2cccc(Br)c2C)cc1-c1nnn[n-]1 ZINC000821821601 607311592 /nfs/dbraw/zinc/31/15/92/607311592.db2.gz MTMJHOOIQCBQEP-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM COc1ccc(CNc2cccc(Br)c2C)cc1-c1nn[n-]n1 ZINC000821821601 607311593 /nfs/dbraw/zinc/31/15/93/607311593.db2.gz MTMJHOOIQCBQEP-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM c1nc(COc2cccc(NCc3cc(-c4nnn[n-]4)cs3)c2)cs1 ZINC000823757295 607316439 /nfs/dbraw/zinc/31/64/39/607316439.db2.gz NYQYUXDEVOEQHU-UHFFFAOYSA-N -1 3 370.463 3.576 20 0 FHADHM c1nc(COc2cccc(NCc3cc(-c4nn[n-]n4)cs3)c2)cs1 ZINC000823757295 607316440 /nfs/dbraw/zinc/31/64/40/607316440.db2.gz NYQYUXDEVOEQHU-UHFFFAOYSA-N -1 3 370.463 3.576 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccnn2C(CC)CC)c1-c1nnn[n-]1 ZINC000821465996 607314131 /nfs/dbraw/zinc/31/41/31/607314131.db2.gz TYKXANSDOACUNS-UHFFFAOYSA-N -1 3 373.486 3.609 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccnn2C(CC)CC)c1-c1nn[n-]n1 ZINC000821465996 607314132 /nfs/dbraw/zinc/31/41/32/607314132.db2.gz TYKXANSDOACUNS-UHFFFAOYSA-N -1 3 373.486 3.609 20 0 FHADHM CSc1ccc(NCc2cnc3ccc(-c4nnn[n-]4)cn23)cc1Cl ZINC000821984840 607316129 /nfs/dbraw/zinc/31/61/29/607316129.db2.gz VCWQGLBEWVGLNP-UHFFFAOYSA-N -1 3 371.857 3.502 20 0 FHADHM CSc1ccc(NCc2cnc3ccc(-c4nn[n-]n4)cn23)cc1Cl ZINC000821984840 607316130 /nfs/dbraw/zinc/31/61/30/607316130.db2.gz VCWQGLBEWVGLNP-UHFFFAOYSA-N -1 3 371.857 3.502 20 0 FHADHM CC(C)(C)[S@@](=O)Cc1cccc(NCc2cccc(-c3nnn[n-]3)c2)c1 ZINC000819950814 607316552 /nfs/dbraw/zinc/31/65/52/607316552.db2.gz NBZFWBVHWNJGBQ-SANMLTNESA-N -1 3 369.494 3.526 20 0 FHADHM CC(C)(C)[S@@](=O)Cc1cccc(NCc2cccc(-c3nn[n-]n3)c2)c1 ZINC000819950814 607316553 /nfs/dbraw/zinc/31/65/53/607316553.db2.gz NBZFWBVHWNJGBQ-SANMLTNESA-N -1 3 369.494 3.526 20 0 FHADHM CCc1ccccc1C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000821492271 607316897 /nfs/dbraw/zinc/31/68/97/607316897.db2.gz JXDYZSPTSCGHOU-UHFFFAOYSA-N -1 3 361.327 3.700 20 0 FHADHM CCc1ccccc1C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000821492271 607316898 /nfs/dbraw/zinc/31/68/98/607316898.db2.gz JXDYZSPTSCGHOU-UHFFFAOYSA-N -1 3 361.327 3.700 20 0 FHADHM Cc1cc(NCc2cc(-c3nnn[n-]3)cs2)ccc1OCC(F)(F)F ZINC000822209638 607317823 /nfs/dbraw/zinc/31/78/23/607317823.db2.gz QLMHKAOPUFWXPO-UHFFFAOYSA-N -1 3 369.372 3.790 20 0 FHADHM Cc1cc(NCc2cc(-c3nn[n-]n3)cs2)ccc1OCC(F)(F)F ZINC000822209638 607317824 /nfs/dbraw/zinc/31/78/24/607317824.db2.gz QLMHKAOPUFWXPO-UHFFFAOYSA-N -1 3 369.372 3.790 20 0 FHADHM Cc1cc2cc(NC(=O)N[C@@H](C)c3cccc(-c4nnn[n-]4)c3)ccc2[nH]1 ZINC000822213155 599281804 /nfs/dbraw/zinc/28/18/04/599281804.db2.gz WUFGRKJFKONLMW-LBPRGKRZSA-N -1 3 361.409 3.539 20 0 FHADHM Cc1cc2cc(NC(=O)N[C@@H](C)c3cccc(-c4nn[n-]n4)c3)ccc2[nH]1 ZINC000822213155 599281807 /nfs/dbraw/zinc/28/18/07/599281807.db2.gz WUFGRKJFKONLMW-LBPRGKRZSA-N -1 3 361.409 3.539 20 0 FHADHM Cc1cc2cc(NC(=O)N[C@H](C)c3cccc(-c4nnn[n-]4)c3)ccc2[nH]1 ZINC000822213154 599282238 /nfs/dbraw/zinc/28/22/38/599282238.db2.gz WUFGRKJFKONLMW-GFCCVEGCSA-N -1 3 361.409 3.539 20 0 FHADHM Cc1cc2cc(NC(=O)N[C@H](C)c3cccc(-c4nn[n-]n4)c3)ccc2[nH]1 ZINC000822213154 599282243 /nfs/dbraw/zinc/28/22/43/599282243.db2.gz WUFGRKJFKONLMW-GFCCVEGCSA-N -1 3 361.409 3.539 20 0 FHADHM C[C@H](Cc1nc2ccccc2s1)Nc1ncc(-c2nnn[n-]2)cc1Cl ZINC000820306787 607329350 /nfs/dbraw/zinc/32/93/50/607329350.db2.gz FMXBIXCITXZVDH-SECBINFHSA-N -1 3 371.857 3.568 20 0 FHADHM C[C@H](Cc1nc2ccccc2s1)Nc1ncc(-c2nn[n-]n2)cc1Cl ZINC000820306787 607329351 /nfs/dbraw/zinc/32/93/51/607329351.db2.gz FMXBIXCITXZVDH-SECBINFHSA-N -1 3 371.857 3.568 20 0 FHADHM Cc1cc(O)ccc1NC(=O)c1ccccc1-c1ccccc1-c1nnn[n-]1 ZINC000826271725 607338917 /nfs/dbraw/zinc/33/89/17/607338917.db2.gz DXAIZSJMXXEICK-UHFFFAOYSA-N -1 3 371.400 3.800 20 0 FHADHM Cc1cc(O)ccc1NC(=O)c1ccccc1-c1ccccc1-c1nn[n-]n1 ZINC000826271725 607338918 /nfs/dbraw/zinc/33/89/18/607338918.db2.gz DXAIZSJMXXEICK-UHFFFAOYSA-N -1 3 371.400 3.800 20 0 FHADHM C/C(=C/C(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)C1CC1 ZINC000735448127 598231179 /nfs/dbraw/zinc/23/11/79/598231179.db2.gz PRBAJBQDVRNURL-QBFSEMIESA-N -1 3 361.405 3.954 20 0 FHADHM C/C(=C/C(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)C1CC1 ZINC000735448127 598231180 /nfs/dbraw/zinc/23/11/80/598231180.db2.gz PRBAJBQDVRNURL-QBFSEMIESA-N -1 3 361.405 3.954 20 0 FHADHM O=C(Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)c1cccs1 ZINC000738185931 598231388 /nfs/dbraw/zinc/23/13/88/598231388.db2.gz UQRZLDCDPCPWTO-UHFFFAOYSA-N -1 3 363.402 3.973 20 0 FHADHM O=C(Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)c1cccs1 ZINC000738185931 598231391 /nfs/dbraw/zinc/23/13/91/598231391.db2.gz UQRZLDCDPCPWTO-UHFFFAOYSA-N -1 3 363.402 3.973 20 0 FHADHM O=C(N[C@@H](c1ccc(Cl)cc1)C1CCC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000737999329 598235422 /nfs/dbraw/zinc/23/54/22/598235422.db2.gz STZORIZSYRCUAA-QGZVFWFLSA-N -1 3 367.840 3.791 20 0 FHADHM O=C(N[C@@H](c1ccc(Cl)cc1)C1CCC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000737999329 598235423 /nfs/dbraw/zinc/23/54/23/598235423.db2.gz STZORIZSYRCUAA-QGZVFWFLSA-N -1 3 367.840 3.791 20 0 FHADHM COc1cc(C)c([C@H](C)Nc2ccc(-c3nn[n-]n3)cc2F)cc1OC ZINC000737041922 598238207 /nfs/dbraw/zinc/23/82/07/598238207.db2.gz XFCVVVNEDLKZMC-NSHDSACASA-N -1 3 357.389 3.505 20 0 FHADHM CSc1cccc(NC(=O)Nc2cc(-c3nnn[n-]3)cn2C(C)(C)C)c1 ZINC000737193080 598277062 /nfs/dbraw/zinc/27/70/62/598277062.db2.gz WCGJUUHWZBSPOL-UHFFFAOYSA-N -1 3 371.470 3.789 20 0 FHADHM CSc1cccc(NC(=O)Nc2cc(-c3nn[n-]n3)cn2C(C)(C)C)c1 ZINC000737193080 598277064 /nfs/dbraw/zinc/27/70/64/598277064.db2.gz WCGJUUHWZBSPOL-UHFFFAOYSA-N -1 3 371.470 3.789 20 0 FHADHM Cc1noc([C@H](C)Nc2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)n1 ZINC000737540353 598285437 /nfs/dbraw/zinc/28/54/37/598285437.db2.gz UWRWDPZBUHKNEC-NSHDSACASA-N -1 3 363.381 3.524 20 0 FHADHM C[C@@H]1CCc2c(sc(NC(=O)C3CCCCCC3)c2-c2nnn[n-]2)C1 ZINC000736279734 598295499 /nfs/dbraw/zinc/29/54/99/598295499.db2.gz MBUXDZCUHSOCME-LLVKDONJSA-N -1 3 359.499 3.962 20 0 FHADHM C[C@@H]1CCc2c(sc(NC(=O)C3CCCCCC3)c2-c2nn[n-]n2)C1 ZINC000736279734 598295501 /nfs/dbraw/zinc/29/55/01/598295501.db2.gz MBUXDZCUHSOCME-LLVKDONJSA-N -1 3 359.499 3.962 20 0 FHADHM O=C(C1CCCCCC1)N(Cc1ccco1)c1ccccc1-c1nnn[n-]1 ZINC000737782012 598295883 /nfs/dbraw/zinc/29/58/83/598295883.db2.gz DRSDDMIYPRZGIP-UHFFFAOYSA-N -1 3 365.437 3.963 20 0 FHADHM O=C(C1CCCCCC1)N(Cc1ccco1)c1ccccc1-c1nn[n-]n1 ZINC000737782012 598295884 /nfs/dbraw/zinc/29/58/84/598295884.db2.gz DRSDDMIYPRZGIP-UHFFFAOYSA-N -1 3 365.437 3.963 20 0 FHADHM CC[C@@H](C)Oc1ccccc1C=CC(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000729846027 598296894 /nfs/dbraw/zinc/29/68/94/598296894.db2.gz ZIRPCACWCVCRCD-JWAFFJSPSA-N -1 3 363.421 3.696 20 0 FHADHM CC[C@@H](C)Oc1ccccc1C=CC(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000729846027 598296896 /nfs/dbraw/zinc/29/68/96/598296896.db2.gz ZIRPCACWCVCRCD-JWAFFJSPSA-N -1 3 363.421 3.696 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CNCc1ccccc1OC1CCCC1 ZINC000737638251 598314971 /nfs/dbraw/zinc/31/49/71/598314971.db2.gz FCSIDOWJXWHZCF-UHFFFAOYSA-N -1 3 367.428 3.617 20 0 FHADHM C[C@H](CNC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccccc1 ZINC000736026749 598316671 /nfs/dbraw/zinc/31/66/71/598316671.db2.gz XINQJWVLPKTTHX-LLVKDONJSA-N -1 3 372.885 3.610 20 0 FHADHM C[C@H](CNC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccccc1 ZINC000736026749 598316673 /nfs/dbraw/zinc/31/66/73/598316673.db2.gz XINQJWVLPKTTHX-LLVKDONJSA-N -1 3 372.885 3.610 20 0 FHADHM S=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)NC1CCCCCCC1 ZINC000738406170 598318435 /nfs/dbraw/zinc/31/84/35/598318435.db2.gz BGGKAWULVYUXNG-UHFFFAOYSA-N -1 3 364.906 3.919 20 0 FHADHM S=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)NC1CCCCCCC1 ZINC000738406170 598318437 /nfs/dbraw/zinc/31/84/37/598318437.db2.gz BGGKAWULVYUXNG-UHFFFAOYSA-N -1 3 364.906 3.919 20 0 FHADHM C[C@H](N(C)C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)C(C)(C)C ZINC000736095609 598318546 /nfs/dbraw/zinc/31/85/46/598318546.db2.gz HRNRYRBWFYOPMB-VIFPVBQESA-N -1 3 352.895 3.583 20 0 FHADHM C[C@H](N(C)C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)C(C)(C)C ZINC000736095609 598318548 /nfs/dbraw/zinc/31/85/48/598318548.db2.gz HRNRYRBWFYOPMB-VIFPVBQESA-N -1 3 352.895 3.583 20 0 FHADHM C[C@@H]1CCC[C@@H](CNC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)C1 ZINC000736248533 598321835 /nfs/dbraw/zinc/32/18/35/598321835.db2.gz JCFNOJBGZIZNPL-GHMZBOCLSA-N -1 3 364.906 3.633 20 0 FHADHM C[C@@H]1CCC[C@@H](CNC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)C1 ZINC000736248533 598321838 /nfs/dbraw/zinc/32/18/38/598321838.db2.gz JCFNOJBGZIZNPL-GHMZBOCLSA-N -1 3 364.906 3.633 20 0 FHADHM CCN(C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)[C@H](C)C(C)C ZINC000736509325 598324027 /nfs/dbraw/zinc/32/40/27/598324027.db2.gz UVFWHSKDMFWWHF-SNVBAGLBSA-N -1 3 352.895 3.583 20 0 FHADHM CCN(C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)[C@H](C)C(C)C ZINC000736509325 598324029 /nfs/dbraw/zinc/32/40/29/598324029.db2.gz UVFWHSKDMFWWHF-SNVBAGLBSA-N -1 3 352.895 3.583 20 0 FHADHM CN(C(=O)[C@@H]1CCCc2sccc21)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821569518 607352363 /nfs/dbraw/zinc/35/23/63/607352363.db2.gz MWNHNIBTQAXZSV-GFCCVEGCSA-N -1 3 373.869 3.665 20 0 FHADHM CN(C(=O)[C@@H]1CCCc2sccc21)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821569518 607352364 /nfs/dbraw/zinc/35/23/64/607352364.db2.gz MWNHNIBTQAXZSV-GFCCVEGCSA-N -1 3 373.869 3.665 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccccc2OC(C)C)c1-c1nnn[n-]1 ZINC000736676305 598359005 /nfs/dbraw/zinc/35/90/05/598359005.db2.gz RDVVLZFQIUXCGC-UHFFFAOYSA-N -1 3 371.466 3.839 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccccc2OC(C)C)c1-c1nn[n-]n1 ZINC000736676305 598359007 /nfs/dbraw/zinc/35/90/07/598359007.db2.gz RDVVLZFQIUXCGC-UHFFFAOYSA-N -1 3 371.466 3.839 20 0 FHADHM Cc1cccc(C2(C(=O)OCc3cccc(-c4nnn[n-]4)c3)CCCC2)c1 ZINC000737387694 598371603 /nfs/dbraw/zinc/37/16/03/598371603.db2.gz AHXMQPMENYCINB-UHFFFAOYSA-N -1 3 362.433 3.730 20 0 FHADHM Cc1cccc(C2(C(=O)OCc3cccc(-c4nn[n-]n4)c3)CCCC2)c1 ZINC000737387694 598371605 /nfs/dbraw/zinc/37/16/05/598371605.db2.gz AHXMQPMENYCINB-UHFFFAOYSA-N -1 3 362.433 3.730 20 0 FHADHM CC(C)[C@@H](Sc1ccccc1)C(=O)Oc1ccc(-c2nnn[n-]2)cc1 ZINC000735735247 598413963 /nfs/dbraw/zinc/41/39/63/598413963.db2.gz MVWPHLUEZLCQAC-MRXNPFEDSA-N -1 3 354.435 3.589 20 0 FHADHM CC(C)[C@@H](Sc1ccccc1)C(=O)Oc1ccc(-c2nn[n-]n2)cc1 ZINC000735735247 598413964 /nfs/dbraw/zinc/41/39/64/598413964.db2.gz MVWPHLUEZLCQAC-MRXNPFEDSA-N -1 3 354.435 3.589 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000500684806 598419233 /nfs/dbraw/zinc/41/92/33/598419233.db2.gz OUYSVDVPUUSTFN-UONOGXRCSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000500684806 598419235 /nfs/dbraw/zinc/41/92/35/598419235.db2.gz OUYSVDVPUUSTFN-UONOGXRCSA-N -1 3 374.231 3.916 20 0 FHADHM CC(C)(CNc1ccc(-c2nnn[n-]2)cn1)c1cccc(C(F)(F)F)c1 ZINC000735671576 598420456 /nfs/dbraw/zinc/42/04/56/598420456.db2.gz ZZNOUTQDIFCRBV-UHFFFAOYSA-N -1 3 362.359 3.670 20 0 FHADHM CC(C)(CNc1ccc(-c2nn[n-]n2)cn1)c1cccc(C(F)(F)F)c1 ZINC000735671576 598420457 /nfs/dbraw/zinc/42/04/57/598420457.db2.gz ZZNOUTQDIFCRBV-UHFFFAOYSA-N -1 3 362.359 3.670 20 0 FHADHM C[C@@H](NC(=O)Cc1ccc(-c2nnn[n-]2)cc1)c1cc2ccccc2s1 ZINC000736110695 598421665 /nfs/dbraw/zinc/42/16/65/598421665.db2.gz JVHZYMMZJYTYCH-GFCCVEGCSA-N -1 3 363.446 3.501 20 0 FHADHM C[C@@H](NC(=O)Cc1ccc(-c2nn[n-]n2)cc1)c1cc2ccccc2s1 ZINC000736110695 598421667 /nfs/dbraw/zinc/42/16/67/598421667.db2.gz JVHZYMMZJYTYCH-GFCCVEGCSA-N -1 3 363.446 3.501 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)NCCC1CCCCC1 ZINC000735875341 598428101 /nfs/dbraw/zinc/42/81/01/598428101.db2.gz UCULBRAXKGDKND-UHFFFAOYSA-N -1 3 370.501 3.757 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)NCCC1CCCCC1 ZINC000735875341 598428103 /nfs/dbraw/zinc/42/81/03/598428103.db2.gz UCULBRAXKGDKND-UHFFFAOYSA-N -1 3 370.501 3.757 20 0 FHADHM Cc1cc(C)cc([C@@H](C)NC(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)c1 ZINC000737253040 598431445 /nfs/dbraw/zinc/43/14/45/598431445.db2.gz OGKFTFWXMKLIFF-GFCCVEGCSA-N -1 3 354.389 3.505 20 0 FHADHM Cc1cc(C)cc([C@@H](C)NC(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)c1 ZINC000737253040 598431447 /nfs/dbraw/zinc/43/14/47/598431447.db2.gz OGKFTFWXMKLIFF-GFCCVEGCSA-N -1 3 354.389 3.505 20 0 FHADHM Cc1cc(Oc2ccc(-c3nnn[n-]3)cc2)ccc1NC(=O)NC1CCC1 ZINC000737281387 598431619 /nfs/dbraw/zinc/43/16/19/598431619.db2.gz XFKRAIKVUBVCKY-UHFFFAOYSA-N -1 3 364.409 3.641 20 0 FHADHM Cc1cc(Oc2ccc(-c3nn[n-]n3)cc2)ccc1NC(=O)NC1CCC1 ZINC000737281387 598431621 /nfs/dbraw/zinc/43/16/21/598431621.db2.gz XFKRAIKVUBVCKY-UHFFFAOYSA-N -1 3 364.409 3.641 20 0 FHADHM Cc1ccc(Oc2ccc(NC(=O)c3ccc(-c4nnn[n-]4)cn3)cc2)cc1 ZINC000737366509 598437258 /nfs/dbraw/zinc/43/72/58/598437258.db2.gz RUVOTEWWRLLFON-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccc(Oc2ccc(NC(=O)c3ccc(-c4nn[n-]n4)cn3)cc2)cc1 ZINC000737366509 598437259 /nfs/dbraw/zinc/43/72/59/598437259.db2.gz RUVOTEWWRLLFON-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM COc1ccc(CCCCCC(=O)Nc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000589446692 598440359 /nfs/dbraw/zinc/44/03/59/598440359.db2.gz MMNOLCUMWBWGBI-UHFFFAOYSA-N -1 3 365.437 3.617 20 0 FHADHM COc1ccc(CCCCCC(=O)Nc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000589446692 598440360 /nfs/dbraw/zinc/44/03/60/598440360.db2.gz MMNOLCUMWBWGBI-UHFFFAOYSA-N -1 3 365.437 3.617 20 0 FHADHM CC(=CC(=O)N(C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1Cl ZINC000735448913 598443440 /nfs/dbraw/zinc/44/34/40/598443440.db2.gz MTCZZQRVODIIRC-ZRDIBKRKSA-N -1 3 353.813 3.586 20 0 FHADHM CC(=CC(=O)N(C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1Cl ZINC000735448913 598443442 /nfs/dbraw/zinc/44/34/42/598443442.db2.gz MTCZZQRVODIIRC-ZRDIBKRKSA-N -1 3 353.813 3.586 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)C[C@@H]1C[C@H](C)CC(C)(C)C1 ZINC000737057806 598443936 /nfs/dbraw/zinc/44/39/36/598443936.db2.gz JQFJRVGOBACTNV-STQMWFEESA-N -1 3 357.458 3.666 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)C[C@@H]1C[C@H](C)CC(C)(C)C1 ZINC000737057806 598443939 /nfs/dbraw/zinc/44/39/39/598443939.db2.gz JQFJRVGOBACTNV-STQMWFEESA-N -1 3 357.458 3.666 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)c1cc(C)c(OC(F)F)c(C)c1 ZINC000737293642 598450416 /nfs/dbraw/zinc/45/04/16/598450416.db2.gz HFZJVYNWMBMJFZ-UHFFFAOYSA-N -1 3 373.363 3.646 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cc(C)c(OC(F)F)c(C)c1 ZINC000737293642 598450417 /nfs/dbraw/zinc/45/04/17/598450417.db2.gz HFZJVYNWMBMJFZ-UHFFFAOYSA-N -1 3 373.363 3.646 20 0 FHADHM Cc1cc(O)c(C(C)C)cc1NC(=O)C=Cc1ccccc1-c1nnn[n-]1 ZINC000826271354 607357897 /nfs/dbraw/zinc/35/78/97/607357897.db2.gz OAHQCMLHICCUSC-HJWRWDBZSA-N -1 3 363.421 3.656 20 0 FHADHM Cc1cc(O)c(C(C)C)cc1NC(=O)C=Cc1ccccc1-c1nn[n-]n1 ZINC000826271354 607357899 /nfs/dbraw/zinc/35/78/99/607357899.db2.gz OAHQCMLHICCUSC-HJWRWDBZSA-N -1 3 363.421 3.656 20 0 FHADHM CC(=CC(=O)OCc1ccccc1-c1nnn[n-]1)c1ccccc1Cl ZINC000735449467 598473943 /nfs/dbraw/zinc/47/39/43/598473943.db2.gz YYBFYIKXRADZBK-BENRWUELSA-N -1 3 354.797 3.667 20 0 FHADHM CC(=CC(=O)OCc1ccccc1-c1nn[n-]n1)c1ccccc1Cl ZINC000735449467 598473944 /nfs/dbraw/zinc/47/39/44/598473944.db2.gz YYBFYIKXRADZBK-BENRWUELSA-N -1 3 354.797 3.667 20 0 FHADHM O=C(OCc1cccc(-c2nnn[n-]2)c1)[C@@H]1C[C@@H]1c1cccc2ccccc21 ZINC000738232609 598475783 /nfs/dbraw/zinc/47/57/83/598475783.db2.gz MNMAQYOQWSWQRJ-WOJBJXKFSA-N -1 3 370.412 3.867 20 0 FHADHM O=C(OCc1cccc(-c2nn[n-]n2)c1)[C@@H]1C[C@@H]1c1cccc2ccccc21 ZINC000738232609 598475784 /nfs/dbraw/zinc/47/57/84/598475784.db2.gz MNMAQYOQWSWQRJ-WOJBJXKFSA-N -1 3 370.412 3.867 20 0 FHADHM Cc1cc(C(C)(C)C)cc(C)c1COC(=O)c1ccc(-c2nnn[n-]2)cn1 ZINC000737243835 598478359 /nfs/dbraw/zinc/47/83/59/598478359.db2.gz BLOFVGZFHCKHMZ-UHFFFAOYSA-N -1 3 365.437 3.533 20 0 FHADHM Cc1cc(C(C)(C)C)cc(C)c1COC(=O)c1ccc(-c2nn[n-]n2)cn1 ZINC000737243835 598478361 /nfs/dbraw/zinc/47/83/61/598478361.db2.gz BLOFVGZFHCKHMZ-UHFFFAOYSA-N -1 3 365.437 3.533 20 0 FHADHM COc1ccccc1C(C)=CC(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000737143290 598481828 /nfs/dbraw/zinc/48/18/28/598481828.db2.gz TYUDPUUTNVPUTL-YPDDLIOESA-N -1 3 364.405 3.583 20 0 FHADHM COc1ccccc1C(C)=CC(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000737143290 598481829 /nfs/dbraw/zinc/48/18/29/598481829.db2.gz TYUDPUUTNVPUTL-YPDDLIOESA-N -1 3 364.405 3.583 20 0 FHADHM Cc1ccc2c(CC(=O)O[C@@H](C)c3cccc(-c4nnn[n-]4)c3)c[nH]c2c1 ZINC000737371998 598483732 /nfs/dbraw/zinc/48/37/32/598483732.db2.gz STRLZAQMZVSNQF-ZDUSSCGKSA-N -1 3 361.405 3.503 20 0 FHADHM Cc1ccc2c(CC(=O)O[C@@H](C)c3cccc(-c4nn[n-]n4)c3)c[nH]c2c1 ZINC000737371998 598483734 /nfs/dbraw/zinc/48/37/34/598483734.db2.gz STRLZAQMZVSNQF-ZDUSSCGKSA-N -1 3 361.405 3.503 20 0 FHADHM COc1ccc(CCCC(=O)O[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000737089166 598484574 /nfs/dbraw/zinc/48/45/74/598484574.db2.gz QHCOSQXRZABWPX-CQSZACIVSA-N -1 3 366.421 3.502 20 0 FHADHM COc1ccc(CCCC(=O)O[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000737089166 598484575 /nfs/dbraw/zinc/48/45/75/598484575.db2.gz QHCOSQXRZABWPX-CQSZACIVSA-N -1 3 366.421 3.502 20 0 FHADHM C[C@@H](OC(=O)CCOc1cccc(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000736147108 598485573 /nfs/dbraw/zinc/48/55/73/598485573.db2.gz AVSPHPWWBBXLGL-GFCCVEGCSA-N -1 3 372.812 3.593 20 0 FHADHM C[C@@H](OC(=O)CCOc1cccc(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000736147108 598485574 /nfs/dbraw/zinc/48/55/74/598485574.db2.gz AVSPHPWWBBXLGL-GFCCVEGCSA-N -1 3 372.812 3.593 20 0 FHADHM C[C@@H](OC(=O)CCOc1ccccc1Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000736153725 598485690 /nfs/dbraw/zinc/48/56/90/598485690.db2.gz ZADIPLVIYTWJOK-GFCCVEGCSA-N -1 3 372.812 3.593 20 0 FHADHM C[C@@H](OC(=O)CCOc1ccccc1Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000736153725 598485691 /nfs/dbraw/zinc/48/56/91/598485691.db2.gz ZADIPLVIYTWJOK-GFCCVEGCSA-N -1 3 372.812 3.593 20 0 FHADHM CCOc1ccccc1CCC(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000736654217 598486714 /nfs/dbraw/zinc/48/67/14/598486714.db2.gz SLXRWFZWUZYSBN-AWEZNQCLSA-N -1 3 366.421 3.502 20 0 FHADHM CCOc1ccccc1CCC(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000736654217 598486717 /nfs/dbraw/zinc/48/67/17/598486717.db2.gz SLXRWFZWUZYSBN-AWEZNQCLSA-N -1 3 366.421 3.502 20 0 FHADHM CC[C@H](CC(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C)c1ccccc1 ZINC000736331826 598490978 /nfs/dbraw/zinc/49/09/78/598490978.db2.gz LTANPIIJFWWFGM-CQSZACIVSA-N -1 3 366.469 3.946 20 0 FHADHM CC[C@H](CC(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C)c1ccccc1 ZINC000736331826 598490979 /nfs/dbraw/zinc/49/09/79/598490979.db2.gz LTANPIIJFWWFGM-CQSZACIVSA-N -1 3 366.469 3.946 20 0 FHADHM Clc1cc(-c2nnn[n-]2)ccc1OCc1csc(-c2ccoc2)n1 ZINC000737566250 598492571 /nfs/dbraw/zinc/49/25/71/598492571.db2.gz YGTBOGBAWPICKE-UHFFFAOYSA-N -1 3 359.798 3.816 20 0 FHADHM Clc1cc(-c2nn[n-]n2)ccc1OCc1csc(-c2ccoc2)n1 ZINC000737566250 598492574 /nfs/dbraw/zinc/49/25/74/598492574.db2.gz YGTBOGBAWPICKE-UHFFFAOYSA-N -1 3 359.798 3.816 20 0 FHADHM Cc1ccc(N(C(=O)c2sccc2-c2nnn[n-]2)C2CCCCC2)nc1 ZINC000737347766 598495143 /nfs/dbraw/zinc/49/51/43/598495143.db2.gz QRTWMOVBCWYPAE-UHFFFAOYSA-N -1 3 368.466 3.611 20 0 FHADHM Cc1ccc(N(C(=O)c2sccc2-c2nn[n-]n2)C2CCCCC2)nc1 ZINC000737347766 598495144 /nfs/dbraw/zinc/49/51/44/598495144.db2.gz QRTWMOVBCWYPAE-UHFFFAOYSA-N -1 3 368.466 3.611 20 0 FHADHM O=C(NCC1CCC(c2ccccc2)CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000738043668 598495534 /nfs/dbraw/zinc/49/55/34/598495534.db2.gz DKUQIQIWWJMRDK-UHFFFAOYSA-N -1 3 361.449 3.571 20 0 FHADHM O=C(NCC1CCC(c2ccccc2)CC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000738043668 598495535 /nfs/dbraw/zinc/49/55/35/598495535.db2.gz DKUQIQIWWJMRDK-UHFFFAOYSA-N -1 3 361.449 3.571 20 0 FHADHM CC1CCC(OC2CCN(c3ccc(-c4nn[n-]n4)cc3F)CC2)CC1 ZINC000736243841 598501767 /nfs/dbraw/zinc/50/17/67/598501767.db2.gz AEQZLDXDGKRNMU-UHFFFAOYSA-N -1 3 359.449 3.570 20 0 FHADHM Clc1cc(NCc2cccnc2OC2CCCC2)ccc1-c1nnn[n-]1 ZINC000737567116 598508167 /nfs/dbraw/zinc/50/81/67/598508167.db2.gz XUCTYBUTOCTLTF-UHFFFAOYSA-N -1 3 370.844 3.849 20 0 FHADHM Clc1cc(NCc2cccnc2OC2CCCC2)ccc1-c1nn[n-]n1 ZINC000737567116 598508168 /nfs/dbraw/zinc/50/81/68/598508168.db2.gz XUCTYBUTOCTLTF-UHFFFAOYSA-N -1 3 370.844 3.849 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)[C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000521464919 598513511 /nfs/dbraw/zinc/51/35/11/598513511.db2.gz FSNVWUVHHIBMLG-CHWSQXEVSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)[C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000521464919 598513514 /nfs/dbraw/zinc/51/35/14/598513514.db2.gz FSNVWUVHHIBMLG-CHWSQXEVSA-N -1 3 374.231 3.916 20 0 FHADHM CCO[C@@H](C(=O)Nc1sc(C)c(CC)c1-c1nnn[n-]1)c1ccccc1 ZINC000736616751 598513952 /nfs/dbraw/zinc/51/39/52/598513952.db2.gz PNWJDMMHICTTFL-OAHLLOKOSA-N -1 3 371.466 3.515 20 0 FHADHM CCO[C@@H](C(=O)Nc1sc(C)c(CC)c1-c1nn[n-]n1)c1ccccc1 ZINC000736616751 598513954 /nfs/dbraw/zinc/51/39/54/598513954.db2.gz PNWJDMMHICTTFL-OAHLLOKOSA-N -1 3 371.466 3.515 20 0 FHADHM O=C(C[C@@H]1CCCc2ccccc21)OCc1cc(-c2nnn[n-]2)ccc1F ZINC000737823976 598514875 /nfs/dbraw/zinc/51/48/75/598514875.db2.gz SQFUESXENRGPRK-AWEZNQCLSA-N -1 3 366.396 3.559 20 0 FHADHM O=C(C[C@@H]1CCCc2ccccc21)OCc1cc(-c2nn[n-]n2)ccc1F ZINC000737823976 598514876 /nfs/dbraw/zinc/51/48/76/598514876.db2.gz SQFUESXENRGPRK-AWEZNQCLSA-N -1 3 366.396 3.559 20 0 FHADHM CCc1c(C)sc(NC(=O)C(F)(F)c2ccccc2)c1-c1nnn[n-]1 ZINC000736671203 598515787 /nfs/dbraw/zinc/51/57/87/598515787.db2.gz UGIBIUOISFKSQY-UHFFFAOYSA-N -1 3 363.393 3.530 20 0 FHADHM CCc1c(C)sc(NC(=O)C(F)(F)c2ccccc2)c1-c1nn[n-]n1 ZINC000736671203 598515789 /nfs/dbraw/zinc/51/57/89/598515789.db2.gz UGIBIUOISFKSQY-UHFFFAOYSA-N -1 3 363.393 3.530 20 0 FHADHM CCc1c(C)sc(NC(=O)CCc2ccc(C)cc2C)c1-c1nnn[n-]1 ZINC000736672129 598517105 /nfs/dbraw/zinc/51/71/05/598517105.db2.gz ZGPXCNKPGLAIKB-UHFFFAOYSA-N -1 3 369.494 3.987 20 0 FHADHM CCc1c(C)sc(NC(=O)CCc2ccc(C)cc2C)c1-c1nn[n-]n1 ZINC000736672129 598517106 /nfs/dbraw/zinc/51/71/06/598517106.db2.gz ZGPXCNKPGLAIKB-UHFFFAOYSA-N -1 3 369.494 3.987 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cc(Cl)ccc2F)c1-c1nnn[n-]1 ZINC000736676231 598517529 /nfs/dbraw/zinc/51/75/29/598517529.db2.gz PJWZSSCTXMXQPR-UHFFFAOYSA-N -1 3 365.821 3.844 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cc(Cl)ccc2F)c1-c1nn[n-]n1 ZINC000736676231 598517530 /nfs/dbraw/zinc/51/75/30/598517530.db2.gz PJWZSSCTXMXQPR-UHFFFAOYSA-N -1 3 365.821 3.844 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccc(SC)cc2)c1-c1nnn[n-]1 ZINC000736675816 598517534 /nfs/dbraw/zinc/51/75/34/598517534.db2.gz OURWQIARMGZJSZ-UHFFFAOYSA-N -1 3 359.480 3.773 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccc(SC)cc2)c1-c1nn[n-]n1 ZINC000736675816 598517535 /nfs/dbraw/zinc/51/75/35/598517535.db2.gz OURWQIARMGZJSZ-UHFFFAOYSA-N -1 3 359.480 3.773 20 0 FHADHM CCc1c(C)sc(NC(=O)C(C)(C)c2ccccc2)c1-c1nnn[n-]1 ZINC000736669787 598518481 /nfs/dbraw/zinc/51/84/81/598518481.db2.gz LAEUGICMAUTBAC-UHFFFAOYSA-N -1 3 355.467 3.715 20 0 FHADHM CCc1c(C)sc(NC(=O)C(C)(C)c2ccccc2)c1-c1nn[n-]n1 ZINC000736669787 598518482 /nfs/dbraw/zinc/51/84/82/598518482.db2.gz LAEUGICMAUTBAC-UHFFFAOYSA-N -1 3 355.467 3.715 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccc3c(c2)CCC3)c1-c1nnn[n-]1 ZINC000736677056 598519282 /nfs/dbraw/zinc/51/92/82/598519282.db2.gz YUIUSZMZYJAEQH-UHFFFAOYSA-N -1 3 353.451 3.540 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccc3c(c2)CCC3)c1-c1nn[n-]n1 ZINC000736677056 598519283 /nfs/dbraw/zinc/51/92/83/598519283.db2.gz YUIUSZMZYJAEQH-UHFFFAOYSA-N -1 3 353.451 3.540 20 0 FHADHM CCCC[C@H]1CCC[C@@H]1NC(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000736441744 598519809 /nfs/dbraw/zinc/51/98/09/598519809.db2.gz UEOUPACUCMLZLD-RDJZCZTQSA-N -1 3 373.526 3.575 20 0 FHADHM CCCC[C@H]1CCC[C@@H]1NC(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000736441744 598519810 /nfs/dbraw/zinc/51/98/10/598519810.db2.gz UEOUPACUCMLZLD-RDJZCZTQSA-N -1 3 373.526 3.575 20 0 FHADHM CC(C)CC[C@H]1CCC[C@@H]1NC(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000735796846 598528114 /nfs/dbraw/zinc/52/81/14/598528114.db2.gz IUVLXDNZKBUTTO-AEFFLSMTSA-N -1 3 370.501 3.613 20 0 FHADHM CC(C)CC[C@H]1CCC[C@@H]1NC(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000735796846 598528116 /nfs/dbraw/zinc/52/81/16/598528116.db2.gz IUVLXDNZKBUTTO-AEFFLSMTSA-N -1 3 370.501 3.613 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)[C@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000108769624 598532451 /nfs/dbraw/zinc/53/24/51/598532451.db2.gz PIKBQMYOZGOYDN-OALUTQOASA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)[C@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000108769624 598532453 /nfs/dbraw/zinc/53/24/53/598532453.db2.gz PIKBQMYOZGOYDN-OALUTQOASA-N -1 3 355.401 3.762 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)O[C@H]1CCc2ccc(Cl)cc21 ZINC000737799040 598538266 /nfs/dbraw/zinc/53/82/66/598538266.db2.gz ITKMTIMNVRRBRK-JEJOPICUSA-N -1 3 366.808 3.764 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)O[C@H]1CCc2ccc(Cl)cc21 ZINC000737799040 598538268 /nfs/dbraw/zinc/53/82/68/598538268.db2.gz ITKMTIMNVRRBRK-JEJOPICUSA-N -1 3 366.808 3.764 20 0 FHADHM CCC(C)(C)C(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736311952 598541728 /nfs/dbraw/zinc/54/17/28/598541728.db2.gz CWCZTXZTHUOMQR-UHFFFAOYSA-N -1 3 365.437 3.820 20 0 FHADHM CCC(C)(C)C(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736311952 598541729 /nfs/dbraw/zinc/54/17/29/598541729.db2.gz CWCZTXZTHUOMQR-UHFFFAOYSA-N -1 3 365.437 3.820 20 0 FHADHM FC(F)(F)c1ccccc1[C@@H]1CCCN1c1ncccc1-c1nnn[n-]1 ZINC000737634702 598551683 /nfs/dbraw/zinc/55/16/83/598551683.db2.gz AQDOHFZKKAVXLH-AWEZNQCLSA-N -1 3 360.343 3.622 20 0 FHADHM FC(F)(F)c1ccccc1[C@@H]1CCCN1c1ncccc1-c1nn[n-]n1 ZINC000737634702 598551686 /nfs/dbraw/zinc/55/16/86/598551686.db2.gz AQDOHFZKKAVXLH-AWEZNQCLSA-N -1 3 360.343 3.622 20 0 FHADHM CC(C)SCC(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000735921647 598552941 /nfs/dbraw/zinc/55/29/41/598552941.db2.gz YARFUSCWPLFAEG-UHFFFAOYSA-N -1 3 369.450 3.739 20 0 FHADHM CC(C)SCC(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000735921647 598552942 /nfs/dbraw/zinc/55/29/42/598552942.db2.gz YARFUSCWPLFAEG-UHFFFAOYSA-N -1 3 369.450 3.739 20 0 FHADHM C/C(=C\C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1)C1CC1 ZINC000735449178 598554135 /nfs/dbraw/zinc/55/41/35/598554135.db2.gz XBNBODTWFFGAFO-ACCUITESSA-N -1 3 361.405 3.954 20 0 FHADHM C/C(=C\C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1)C1CC1 ZINC000735449178 598554137 /nfs/dbraw/zinc/55/41/37/598554137.db2.gz XBNBODTWFFGAFO-ACCUITESSA-N -1 3 361.405 3.954 20 0 FHADHM O=C(C=Cc1ccco1)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000737806046 598555288 /nfs/dbraw/zinc/55/52/88/598555288.db2.gz KVODFNIPAJLGLZ-ZHACJKMWSA-N -1 3 373.372 3.904 20 0 FHADHM O=C(C=Cc1ccco1)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000737806046 598555290 /nfs/dbraw/zinc/55/52/90/598555290.db2.gz KVODFNIPAJLGLZ-ZHACJKMWSA-N -1 3 373.372 3.904 20 0 FHADHM C[C@H](NC(=O)Nc1cc(F)ccc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000736117549 598558648 /nfs/dbraw/zinc/55/86/48/598558648.db2.gz QDZQSLVAUAXHNZ-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM C[C@H](NC(=O)Nc1cc(F)ccc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000736117549 598558649 /nfs/dbraw/zinc/55/86/49/598558649.db2.gz QDZQSLVAUAXHNZ-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N[C@@H](C)C(C)(C)c1ccccc1 ZINC000737292623 598559072 /nfs/dbraw/zinc/55/90/72/598559072.db2.gz WRCQEVDGDQKAFY-AWEZNQCLSA-N -1 3 364.453 3.663 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N[C@@H](C)C(C)(C)c1ccccc1 ZINC000737292623 598559075 /nfs/dbraw/zinc/55/90/75/598559075.db2.gz WRCQEVDGDQKAFY-AWEZNQCLSA-N -1 3 364.453 3.663 20 0 FHADHM CC(C)[C@@H](Sc1ccccc1)C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000735736371 598583374 /nfs/dbraw/zinc/58/33/74/598583374.db2.gz SVYPLZRKTVWNJW-MRXNPFEDSA-N -1 3 371.441 3.761 20 0 FHADHM CC(C)[C@@H](Sc1ccccc1)C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000735736371 598583376 /nfs/dbraw/zinc/58/33/76/598583376.db2.gz SVYPLZRKTVWNJW-MRXNPFEDSA-N -1 3 371.441 3.761 20 0 FHADHM O=C(CCCCCc1cccs1)OCc1ccccc1-c1nnn[n-]1 ZINC000737827566 598584062 /nfs/dbraw/zinc/58/40/62/598584062.db2.gz ZLVFUFPVYOVYDX-UHFFFAOYSA-N -1 3 356.451 3.775 20 0 FHADHM O=C(CCCCCc1cccs1)OCc1ccccc1-c1nn[n-]n1 ZINC000737827566 598584064 /nfs/dbraw/zinc/58/40/64/598584064.db2.gz ZLVFUFPVYOVYDX-UHFFFAOYSA-N -1 3 356.451 3.775 20 0 FHADHM CC(C)c1cccc(O[C@H](C)C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)c1 ZINC000736183461 598584654 /nfs/dbraw/zinc/58/46/54/598584654.db2.gz RVJLNHZWLNYGGP-GFCCVEGCSA-N -1 3 369.400 3.535 20 0 FHADHM CC(C)c1cccc(O[C@H](C)C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)c1 ZINC000736183461 598584656 /nfs/dbraw/zinc/58/46/56/598584656.db2.gz RVJLNHZWLNYGGP-GFCCVEGCSA-N -1 3 369.400 3.535 20 0 FHADHM CSCc1cccc(NC(=S)Nc2ccccc2-c2nnn[n-]2)c1 ZINC000737187809 598587086 /nfs/dbraw/zinc/58/70/86/598587086.db2.gz VPUVNMHPXCGAHV-UHFFFAOYSA-N -1 3 356.480 3.539 20 0 FHADHM CSCc1cccc(NC(=S)Nc2ccccc2-c2nn[n-]n2)c1 ZINC000737187809 598587088 /nfs/dbraw/zinc/58/70/88/598587088.db2.gz VPUVNMHPXCGAHV-UHFFFAOYSA-N -1 3 356.480 3.539 20 0 FHADHM Cc1ccc(CCC(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)cc1Cl ZINC000737338186 598588273 /nfs/dbraw/zinc/58/82/73/598588273.db2.gz OUJMRNAXAWOTGR-UHFFFAOYSA-N -1 3 359.792 3.539 20 0 FHADHM Cc1ccc(CCC(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)cc1Cl ZINC000737338186 598588274 /nfs/dbraw/zinc/58/82/74/598588274.db2.gz OUJMRNAXAWOTGR-UHFFFAOYSA-N -1 3 359.792 3.539 20 0 FHADHM Cc1nc2ccccc2n1CCCNc1ccc(Cl)cc1-c1nnn[n-]1 ZINC000737489941 598592596 /nfs/dbraw/zinc/59/25/96/598592596.db2.gz NNMAZXPIPRPDON-UHFFFAOYSA-N -1 3 367.844 3.680 20 0 FHADHM Cc1nc2ccccc2n1CCCNc1ccc(Cl)cc1-c1nn[n-]n1 ZINC000737489941 598592598 /nfs/dbraw/zinc/59/25/98/598592598.db2.gz NNMAZXPIPRPDON-UHFFFAOYSA-N -1 3 367.844 3.680 20 0 FHADHM Cc1cc(C)c(-c2nnn[n-]2)c(NCC2(Sc3ccccc3)CC2)n1 ZINC000737239222 598594015 /nfs/dbraw/zinc/59/40/15/598594015.db2.gz BLFRIBAAAYMBLK-UHFFFAOYSA-N -1 3 352.467 3.615 20 0 FHADHM Cc1cc(C)c(-c2nn[n-]n2)c(NCC2(Sc3ccccc3)CC2)n1 ZINC000737239222 598594016 /nfs/dbraw/zinc/59/40/16/598594016.db2.gz BLFRIBAAAYMBLK-UHFFFAOYSA-N -1 3 352.467 3.615 20 0 FHADHM CCOCCOc1ccc(Cl)cc1NCc1ccccc1-c1nnn[n-]1 ZINC000736625079 598603306 /nfs/dbraw/zinc/60/33/06/598603306.db2.gz IQHZPXJWVIYJHT-UHFFFAOYSA-N -1 3 373.844 3.548 20 0 FHADHM CCOCCOc1ccc(Cl)cc1NCc1ccccc1-c1nn[n-]n1 ZINC000736625079 598603307 /nfs/dbraw/zinc/60/33/07/598603307.db2.gz IQHZPXJWVIYJHT-UHFFFAOYSA-N -1 3 373.844 3.548 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)N[C@H]1CCCCc2ccccc21 ZINC000738166445 598628502 /nfs/dbraw/zinc/62/85/02/598628502.db2.gz JQDFGUOBPFHVNY-KRWDZBQOSA-N -1 3 366.400 3.595 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)N[C@H]1CCCCc2ccccc21 ZINC000738166445 598628503 /nfs/dbraw/zinc/62/85/03/598628503.db2.gz JQDFGUOBPFHVNY-KRWDZBQOSA-N -1 3 366.400 3.595 20 0 FHADHM CC(C)(C)[C@@H](NC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccccc1 ZINC000735590097 598628822 /nfs/dbraw/zinc/62/88/22/598628822.db2.gz UJBQXLRSPIJZEE-INIZCTEOSA-N -1 3 368.416 3.915 20 0 FHADHM CC(C)(C)[C@@H](NC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccccc1 ZINC000735590097 598628824 /nfs/dbraw/zinc/62/88/24/598628824.db2.gz UJBQXLRSPIJZEE-INIZCTEOSA-N -1 3 368.416 3.915 20 0 FHADHM Cc1ccc([C@@H](C)N(C)C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)cc1 ZINC000737322346 598629403 /nfs/dbraw/zinc/62/94/03/598629403.db2.gz YPRZVFHVXKMOQW-GFCCVEGCSA-N -1 3 354.389 3.539 20 0 FHADHM Cc1ccc([C@@H](C)N(C)C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)cc1 ZINC000737322346 598629405 /nfs/dbraw/zinc/62/94/05/598629405.db2.gz YPRZVFHVXKMOQW-GFCCVEGCSA-N -1 3 354.389 3.539 20 0 FHADHM Cc1ccc([C@H](NC(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)C2CC2)cc1 ZINC000737320101 598632541 /nfs/dbraw/zinc/63/25/41/598632541.db2.gz NLVCDWRFAIENBO-KRWDZBQOSA-N -1 3 366.400 3.587 20 0 FHADHM Cc1ccc([C@H](NC(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)C2CC2)cc1 ZINC000737320101 598632543 /nfs/dbraw/zinc/63/25/43/598632543.db2.gz NLVCDWRFAIENBO-KRWDZBQOSA-N -1 3 366.400 3.587 20 0 FHADHM CCCN(Cc1ccc(C)cc1)C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000736480405 598634067 /nfs/dbraw/zinc/63/40/67/598634067.db2.gz PIQDBHCUTXYCRI-UHFFFAOYSA-N -1 3 368.416 3.758 20 0 FHADHM CCCN(Cc1ccc(C)cc1)C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000736480405 598634069 /nfs/dbraw/zinc/63/40/69/598634069.db2.gz PIQDBHCUTXYCRI-UHFFFAOYSA-N -1 3 368.416 3.758 20 0 FHADHM O=C(c1ccccc1)C1CCN(c2c(Cl)cccc2-c2nnn[n-]2)CC1 ZINC000738279432 598634066 /nfs/dbraw/zinc/63/40/66/598634066.db2.gz RJPYLAVCLZHJCE-UHFFFAOYSA-N -1 3 367.840 3.619 20 0 FHADHM O=C(c1ccccc1)C1CCN(c2c(Cl)cccc2-c2nn[n-]n2)CC1 ZINC000738279432 598634068 /nfs/dbraw/zinc/63/40/68/598634068.db2.gz RJPYLAVCLZHJCE-UHFFFAOYSA-N -1 3 367.840 3.619 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(NCc2ccccc2N2CCCC2)c1 ZINC000737570958 598634918 /nfs/dbraw/zinc/63/49/18/598634918.db2.gz NERMFXNKXZHDQQ-UHFFFAOYSA-N -1 3 354.845 3.732 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(NCc2ccccc2N2CCCC2)c1 ZINC000737570958 598634920 /nfs/dbraw/zinc/63/49/20/598634920.db2.gz NERMFXNKXZHDQQ-UHFFFAOYSA-N -1 3 354.845 3.732 20 0 FHADHM Cc1sc2ncnc(SCc3ccc(F)cc3-c3nnn[n-]3)c2c1C ZINC000737565762 598643474 /nfs/dbraw/zinc/64/34/74/598643474.db2.gz XIBPQJGVGMEKEP-UHFFFAOYSA-N -1 3 372.454 3.920 20 0 FHADHM Cc1sc2ncnc(SCc3ccc(F)cc3-c3nn[n-]n3)c2c1C ZINC000737565762 598643475 /nfs/dbraw/zinc/64/34/75/598643475.db2.gz XIBPQJGVGMEKEP-UHFFFAOYSA-N -1 3 372.454 3.920 20 0 FHADHM Cn1c2ccc(Cl)cc2nc1SCc1ccc(F)cc1-c1nnn[n-]1 ZINC000737591586 598644832 /nfs/dbraw/zinc/64/48/32/598644832.db2.gz HMDVTBLPGZSGGC-UHFFFAOYSA-N -1 3 374.832 3.838 20 0 FHADHM Cn1c2ccc(Cl)cc2nc1SCc1ccc(F)cc1-c1nn[n-]n1 ZINC000737591586 598644834 /nfs/dbraw/zinc/64/48/34/598644834.db2.gz HMDVTBLPGZSGGC-UHFFFAOYSA-N -1 3 374.832 3.838 20 0 FHADHM CC(C)N(C(=O)CCCCOc1cccc(-c2nnn[n-]2)c1)C1CCCC1 ZINC000735851304 598647782 /nfs/dbraw/zinc/64/77/82/598647782.db2.gz PJODJVOMFJNDIZ-UHFFFAOYSA-N -1 3 371.485 3.595 20 0 FHADHM CC(C)N(C(=O)CCCCOc1cccc(-c2nn[n-]n2)c1)C1CCCC1 ZINC000735851304 598647784 /nfs/dbraw/zinc/64/77/84/598647784.db2.gz PJODJVOMFJNDIZ-UHFFFAOYSA-N -1 3 371.485 3.595 20 0 FHADHM CC(C)[C@H]1CC[C@@H](C)C[C@H]1NC(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000736236750 598653189 /nfs/dbraw/zinc/65/31/89/598653189.db2.gz MQJLRLVFUUNNLF-KBRIMQKVSA-N -1 3 373.526 3.536 20 0 FHADHM CC(C)[C@H]1CC[C@@H](C)C[C@H]1NC(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000736236750 598653191 /nfs/dbraw/zinc/65/31/91/598653191.db2.gz MQJLRLVFUUNNLF-KBRIMQKVSA-N -1 3 373.526 3.536 20 0 FHADHM Clc1cc(NCc2ccc(N3CCCCC3)nc2)ccc1-c1nnn[n-]1 ZINC000737563829 598653237 /nfs/dbraw/zinc/65/32/37/598653237.db2.gz GTJSBBAESNVXGA-UHFFFAOYSA-N -1 3 369.860 3.518 20 0 FHADHM Clc1cc(NCc2ccc(N3CCCCC3)nc2)ccc1-c1nn[n-]n1 ZINC000737563829 598653239 /nfs/dbraw/zinc/65/32/39/598653239.db2.gz GTJSBBAESNVXGA-UHFFFAOYSA-N -1 3 369.860 3.518 20 0 FHADHM CC(C)[C@@H](CC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccccc1 ZINC000735708671 598659607 /nfs/dbraw/zinc/65/96/07/598659607.db2.gz NGYLQSBUHYDUKH-OAHLLOKOSA-N -1 3 353.401 3.774 20 0 FHADHM CC(C)[C@@H](CC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccccc1 ZINC000735708671 598659609 /nfs/dbraw/zinc/65/96/09/598659609.db2.gz NGYLQSBUHYDUKH-OAHLLOKOSA-N -1 3 353.401 3.774 20 0 FHADHM CC(C)CCCCCCNC(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000735796780 598664176 /nfs/dbraw/zinc/66/41/76/598664176.db2.gz IEZYOGAYJVMNEP-UHFFFAOYSA-N -1 3 361.515 3.682 20 0 FHADHM CC(C)CCCCCCNC(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000735796780 598664178 /nfs/dbraw/zinc/66/41/78/598664178.db2.gz IEZYOGAYJVMNEP-UHFFFAOYSA-N -1 3 361.515 3.682 20 0 FHADHM COc1ccc([C@H]2CCN(c3ccc(-c4nnn[n-]4)c(Cl)c3)C2)cc1 ZINC000737077971 598668771 /nfs/dbraw/zinc/66/87/71/598668771.db2.gz XAEGJVHJRAWYQL-ZDUSSCGKSA-N -1 3 355.829 3.523 20 0 FHADHM COc1ccc([C@H]2CCN(c3ccc(-c4nn[n-]n4)c(Cl)c3)C2)cc1 ZINC000737077971 598668772 /nfs/dbraw/zinc/66/87/72/598668772.db2.gz XAEGJVHJRAWYQL-ZDUSSCGKSA-N -1 3 355.829 3.523 20 0 FHADHM CCCCNc1nc2ccccc2n1Cc1ccc(F)cc1-c1nnn[n-]1 ZINC000736460653 598673720 /nfs/dbraw/zinc/67/37/20/598673720.db2.gz JIRLJDLDUMQEFD-UHFFFAOYSA-N -1 3 365.416 3.616 20 0 FHADHM CCCCNc1nc2ccccc2n1Cc1ccc(F)cc1-c1nn[n-]n1 ZINC000736460653 598673722 /nfs/dbraw/zinc/67/37/22/598673722.db2.gz JIRLJDLDUMQEFD-UHFFFAOYSA-N -1 3 365.416 3.616 20 0 FHADHM CC(C)C[C@@H](C)Oc1cc(CNc2ccc(-c3nn[n-]n3)cc2)ccn1 ZINC000735761879 598674979 /nfs/dbraw/zinc/67/49/79/598674979.db2.gz QTRYFHZGIARNAH-CQSZACIVSA-N -1 3 352.442 3.687 20 0 FHADHM COc1ccccc1[C@@H](C)CC(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000737143740 598727338 /nfs/dbraw/zinc/72/73/38/598727338.db2.gz YZSIJHCKWUBSOI-KBPBESRZSA-N -1 3 366.421 3.673 20 0 FHADHM COc1ccccc1[C@@H](C)CC(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000737143740 598727339 /nfs/dbraw/zinc/72/73/39/598727339.db2.gz YZSIJHCKWUBSOI-KBPBESRZSA-N -1 3 366.421 3.673 20 0 FHADHM CCN(C(=O)[C@@H](C)Cc1ccccc1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736503602 598741556 /nfs/dbraw/zinc/74/15/56/598741556.db2.gz YRERQYZSUDCKBY-HOTGVXAUSA-N -1 3 363.465 3.655 20 0 FHADHM CCN(C(=O)[C@@H](C)Cc1ccccc1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736503602 598741558 /nfs/dbraw/zinc/74/15/58/598741558.db2.gz YRERQYZSUDCKBY-HOTGVXAUSA-N -1 3 363.465 3.655 20 0 FHADHM CC(C)Sc1ccc([C@H](C)NC(=O)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000735921710 598743647 /nfs/dbraw/zinc/74/36/47/598743647.db2.gz ZGAVHSWXQQYJDO-ZDUSSCGKSA-N -1 3 367.478 3.858 20 0 FHADHM CC(C)Sc1ccc([C@H](C)NC(=O)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000735921710 598743649 /nfs/dbraw/zinc/74/36/49/598743649.db2.gz ZGAVHSWXQQYJDO-ZDUSSCGKSA-N -1 3 367.478 3.858 20 0 FHADHM Cc1[nH]c2c(cc(C)cc2CNc2ncc(-c3nnn[n-]3)cc2Cl)c1C ZINC000737264544 598746471 /nfs/dbraw/zinc/74/64/71/598746471.db2.gz NOOZOLDCCUWWML-UHFFFAOYSA-N -1 3 367.844 3.934 20 0 FHADHM Cc1[nH]c2c(cc(C)cc2CNc2ncc(-c3nn[n-]n3)cc2Cl)c1C ZINC000737264544 598746473 /nfs/dbraw/zinc/74/64/73/598746473.db2.gz NOOZOLDCCUWWML-UHFFFAOYSA-N -1 3 367.844 3.934 20 0 FHADHM C[C@@H](Sc1ccc(-c2nnn[n-]2)cn1)c1ccc(Br)cc1 ZINC000736190692 598761690 /nfs/dbraw/zinc/76/16/90/598761690.db2.gz GVKYPFKPKACJOS-SECBINFHSA-N -1 3 362.256 3.878 20 0 FHADHM C[C@@H](Sc1ccc(-c2nn[n-]n2)cn1)c1ccc(Br)cc1 ZINC000736190692 598761692 /nfs/dbraw/zinc/76/16/92/598761692.db2.gz GVKYPFKPKACJOS-SECBINFHSA-N -1 3 362.256 3.878 20 0 FHADHM Cc1ccccc1[C@@H](C(C)C)N(C)C(=O)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000737416145 598764584 /nfs/dbraw/zinc/76/45/84/598764584.db2.gz XIUOUNWUOGGHRX-HXUWFJFHSA-N -1 3 363.465 3.573 20 0 FHADHM Cc1ccccc1[C@@H](C(C)C)N(C)C(=O)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000737416145 598764585 /nfs/dbraw/zinc/76/45/85/598764585.db2.gz XIUOUNWUOGGHRX-HXUWFJFHSA-N -1 3 363.465 3.573 20 0 FHADHM Fc1cc(F)c2ncc(-c3nnn[n-]3)c(N[C@H]3CCc4ccccc43)c2c1 ZINC000737645247 598770850 /nfs/dbraw/zinc/77/08/50/598770850.db2.gz UITDNFFMWAIZKB-INIZCTEOSA-N -1 3 364.359 3.793 20 0 FHADHM Fc1cc(F)c2ncc(-c3nn[n-]n3)c(N[C@H]3CCc4ccccc43)c2c1 ZINC000737645247 598770851 /nfs/dbraw/zinc/77/08/51/598770851.db2.gz UITDNFFMWAIZKB-INIZCTEOSA-N -1 3 364.359 3.793 20 0 FHADHM CC(C)(C(=O)OCc1ccc(F)cc1-c1nnn[n-]1)c1ccccc1Cl ZINC000735583328 598778832 /nfs/dbraw/zinc/77/88/32/598778832.db2.gz VQQHGBDSPDFHKY-UHFFFAOYSA-N -1 3 374.803 3.680 20 0 FHADHM CC(C)(C(=O)OCc1ccc(F)cc1-c1nn[n-]n1)c1ccccc1Cl ZINC000735583328 598778835 /nfs/dbraw/zinc/77/88/35/598778835.db2.gz VQQHGBDSPDFHKY-UHFFFAOYSA-N -1 3 374.803 3.680 20 0 FHADHM CC[C@H](CC(=O)OCc1cc(-c2nnn[n-]2)ccc1F)c1ccccc1 ZINC000736334387 598780761 /nfs/dbraw/zinc/78/07/61/598780761.db2.gz HCGSDJJSXPSTEY-CYBMUJFWSA-N -1 3 354.385 3.633 20 0 FHADHM CC[C@H](CC(=O)OCc1cc(-c2nn[n-]n2)ccc1F)c1ccccc1 ZINC000736334387 598780762 /nfs/dbraw/zinc/78/07/62/598780762.db2.gz HCGSDJJSXPSTEY-CYBMUJFWSA-N -1 3 354.385 3.633 20 0 FHADHM CN(Cc1ccc(Br)o1)c1ccc(Cl)cc1-c1nnn[n-]1 ZINC000736817417 598792874 /nfs/dbraw/zinc/79/28/74/598792874.db2.gz YALLIWBVJAUARI-UHFFFAOYSA-N -1 3 368.622 3.512 20 0 FHADHM CN(Cc1ccc(Br)o1)c1ccc(Cl)cc1-c1nn[n-]n1 ZINC000736817417 598792875 /nfs/dbraw/zinc/79/28/75/598792875.db2.gz YALLIWBVJAUARI-UHFFFAOYSA-N -1 3 368.622 3.512 20 0 FHADHM CCn1c(CCNc2ccc(Cl)cc2-c2nnn[n-]2)nc2ccccc21 ZINC000736719343 598794372 /nfs/dbraw/zinc/79/43/72/598794372.db2.gz CLZNXTRUFUCIOG-UHFFFAOYSA-N -1 3 367.844 3.544 20 0 FHADHM CCn1c(CCNc2ccc(Cl)cc2-c2nn[n-]n2)nc2ccccc21 ZINC000736719343 598794374 /nfs/dbraw/zinc/79/43/74/598794374.db2.gz CLZNXTRUFUCIOG-UHFFFAOYSA-N -1 3 367.844 3.544 20 0 FHADHM Fc1ccc(N2CC[C@H](CNc3ccc(Cl)cc3-c3nnn[n-]3)C2)cc1 ZINC000737660272 598794690 /nfs/dbraw/zinc/79/46/90/598794690.db2.gz PMPUBGKNETYURN-GFCCVEGCSA-N -1 3 372.835 3.598 20 0 FHADHM Fc1ccc(N2CC[C@H](CNc3ccc(Cl)cc3-c3nn[n-]n3)C2)cc1 ZINC000737660272 598794691 /nfs/dbraw/zinc/79/46/91/598794691.db2.gz PMPUBGKNETYURN-GFCCVEGCSA-N -1 3 372.835 3.598 20 0 FHADHM Cc1ccc(N2CCCN(c3ccc(Cl)cc3-c3nnn[n-]3)CC2)cc1 ZINC000737350606 598794817 /nfs/dbraw/zinc/79/48/17/598794817.db2.gz GSWZARDVGQXCKH-UHFFFAOYSA-N -1 3 368.872 3.545 20 0 FHADHM Cc1ccc(N2CCCN(c3ccc(Cl)cc3-c3nn[n-]n3)CC2)cc1 ZINC000737350606 598794819 /nfs/dbraw/zinc/79/48/19/598794819.db2.gz GSWZARDVGQXCKH-UHFFFAOYSA-N -1 3 368.872 3.545 20 0 FHADHM CC(C)[C@H](C)C(=O)Nc1cccc(OCc2cccc(-c3nnn[n-]3)c2)c1 ZINC000735699640 598803578 /nfs/dbraw/zinc/80/35/78/598803578.db2.gz CFTVLNOUKZNXAJ-AWEZNQCLSA-N -1 3 365.437 3.676 20 0 FHADHM CC(C)[C@H](C)C(=O)Nc1cccc(OCc2cccc(-c3nn[n-]n3)c2)c1 ZINC000735699640 598803580 /nfs/dbraw/zinc/80/35/80/598803580.db2.gz CFTVLNOUKZNXAJ-AWEZNQCLSA-N -1 3 365.437 3.676 20 0 FHADHM CC(C)[C@H](C)C(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000735703790 598805008 /nfs/dbraw/zinc/80/50/08/598805008.db2.gz WBSUOTPXQCXYAO-ZDUSSCGKSA-N -1 3 351.410 3.890 20 0 FHADHM CC(C)[C@H](C)C(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735703790 598805009 /nfs/dbraw/zinc/80/50/09/598805009.db2.gz WBSUOTPXQCXYAO-ZDUSSCGKSA-N -1 3 351.410 3.890 20 0 FHADHM O=C(C1CCC1)N(Cc1ccccc1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000737781972 598807586 /nfs/dbraw/zinc/80/75/86/598807586.db2.gz DEMINWCHLFREEQ-UHFFFAOYSA-N -1 3 367.840 3.853 20 0 FHADHM O=C(C1CCC1)N(Cc1ccccc1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000737781972 598807588 /nfs/dbraw/zinc/80/75/88/598807588.db2.gz DEMINWCHLFREEQ-UHFFFAOYSA-N -1 3 367.840 3.853 20 0 FHADHM Fc1cccc(N(Cc2ccco2)Cc2cccs2)c1-c1nnn[n-]1 ZINC000737661290 598814819 /nfs/dbraw/zinc/81/48/19/598814819.db2.gz OGBNMZQMTRIYBM-UHFFFAOYSA-N -1 3 355.398 3.867 20 0 FHADHM Fc1cccc(N(Cc2ccco2)Cc2cccs2)c1-c1nn[n-]n1 ZINC000737661290 598814820 /nfs/dbraw/zinc/81/48/20/598814820.db2.gz OGBNMZQMTRIYBM-UHFFFAOYSA-N -1 3 355.398 3.867 20 0 FHADHM CCC[C@H](CC1CCCCC1)C(=O)NCc1ccc(-c2nnn[n-]2)cc1 ZINC000499835342 598821485 /nfs/dbraw/zinc/82/14/85/598821485.db2.gz CWETZLFBWMKOCR-GOSISDBHSA-N -1 3 355.486 3.870 20 0 FHADHM CCC[C@H](CC1CCCCC1)C(=O)NCc1ccc(-c2nn[n-]n2)cc1 ZINC000499835342 598821486 /nfs/dbraw/zinc/82/14/86/598821486.db2.gz CWETZLFBWMKOCR-GOSISDBHSA-N -1 3 355.486 3.870 20 0 FHADHM C[C@@H](SC[C@H]1OCCc2ccccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000736187425 599324870 /nfs/dbraw/zinc/32/48/70/599324870.db2.gz AIXDRRRFUXBIPB-FZKQIMNGSA-N -1 3 352.463 3.975 20 0 FHADHM C[C@@H](SC[C@H]1OCCc2ccccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000736187425 599324873 /nfs/dbraw/zinc/32/48/73/599324873.db2.gz AIXDRRRFUXBIPB-FZKQIMNGSA-N -1 3 352.463 3.975 20 0 FHADHM C[C@H](SCc1nc(-c2cccs2)no1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736193971 599326396 /nfs/dbraw/zinc/32/63/96/599326396.db2.gz VZKNPOLTJALFCV-JTQLQIEISA-N -1 3 370.463 3.973 20 0 FHADHM C[C@H](SCc1nc(-c2cccs2)no1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736193971 599326399 /nfs/dbraw/zinc/32/63/99/599326399.db2.gz VZKNPOLTJALFCV-JTQLQIEISA-N -1 3 370.463 3.973 20 0 FHADHM FC(F)Oc1ccccc1CNc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000737638637 599327194 /nfs/dbraw/zinc/32/71/94/599327194.db2.gz HUPXUYJMSBHWCU-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM FC(F)Oc1ccccc1CNc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000737638637 599327197 /nfs/dbraw/zinc/32/71/97/599327197.db2.gz HUPXUYJMSBHWCU-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM C[C@H](SCCC(=O)Nc1cccc(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736187468 599327832 /nfs/dbraw/zinc/32/78/32/599327832.db2.gz BBSVUJJBHDFJSA-LBPRGKRZSA-N -1 3 371.441 3.829 20 0 FHADHM C[C@H](SCCC(=O)Nc1cccc(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736187468 599327835 /nfs/dbraw/zinc/32/78/35/599327835.db2.gz BBSVUJJBHDFJSA-LBPRGKRZSA-N -1 3 371.441 3.829 20 0 FHADHM CCc1ccccc1NC(=O)CS[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736702662 599328620 /nfs/dbraw/zinc/32/86/20/599328620.db2.gz SYHMKUDQLJSGSG-CYBMUJFWSA-N -1 3 367.478 3.862 20 0 FHADHM CCc1ccccc1NC(=O)CS[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736702662 599328622 /nfs/dbraw/zinc/32/86/22/599328622.db2.gz SYHMKUDQLJSGSG-CYBMUJFWSA-N -1 3 367.478 3.862 20 0 FHADHM CCCCOc1ccccc1NCCOc1cccc(-c2nnn[n-]2)c1 ZINC000736462525 599330746 /nfs/dbraw/zinc/33/07/46/599330746.db2.gz DMIMWAPZXDYNQG-UHFFFAOYSA-N -1 3 353.426 3.537 20 0 FHADHM CCCCOc1ccccc1NCCOc1cccc(-c2nn[n-]n2)c1 ZINC000736462525 599330749 /nfs/dbraw/zinc/33/07/49/599330749.db2.gz DMIMWAPZXDYNQG-UHFFFAOYSA-N -1 3 353.426 3.537 20 0 FHADHM Cc1cccc(C)c1NC(=O)CS[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000737390096 599332325 /nfs/dbraw/zinc/33/23/25/599332325.db2.gz OUPAEVOCMVUEEM-CQSZACIVSA-N -1 3 367.478 3.916 20 0 FHADHM Cc1cccc(C)c1NC(=O)CS[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000737390096 599332330 /nfs/dbraw/zinc/33/23/30/599332330.db2.gz OUPAEVOCMVUEEM-CQSZACIVSA-N -1 3 367.478 3.916 20 0 FHADHM C[C@H](SCC(=O)N[C@@H]1CCC[C@H](C)[C@H]1C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736190494 599332915 /nfs/dbraw/zinc/33/29/15/599332915.db2.gz SMZGDWZAUXINKV-QDEZUTFSSA-N -1 3 373.526 3.602 20 0 FHADHM C[C@H](SCC(=O)N[C@@H]1CCC[C@H](C)[C@H]1C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736190494 599332918 /nfs/dbraw/zinc/33/29/18/599332918.db2.gz SMZGDWZAUXINKV-QDEZUTFSSA-N -1 3 373.526 3.602 20 0 FHADHM C[C@H](SCC(=O)N[C@@H]1CCC[C@H](C)[C@@H]1C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736190493 599333206 /nfs/dbraw/zinc/33/32/06/599333206.db2.gz SMZGDWZAUXINKV-AYMQEEERSA-N -1 3 373.526 3.602 20 0 FHADHM C[C@H](SCC(=O)N[C@@H]1CCC[C@H](C)[C@@H]1C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736190493 599333209 /nfs/dbraw/zinc/33/32/09/599333209.db2.gz SMZGDWZAUXINKV-AYMQEEERSA-N -1 3 373.526 3.602 20 0 FHADHM Fc1ccc(NCc2ccc(-c3nnn[n-]3)cc2F)cc1Br ZINC000737655573 599333805 /nfs/dbraw/zinc/33/38/05/599333805.db2.gz AAKMJGLPPBWHOI-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1ccc(NCc2ccc(-c3nn[n-]n3)cc2F)cc1Br ZINC000737655573 599333808 /nfs/dbraw/zinc/33/38/08/599333808.db2.gz AAKMJGLPPBWHOI-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Cc1ccc(NC(=O)[C@@H](C)Sc2ccccc2-c2nnn[n-]2)c(Cl)c1 ZINC000822242634 599350406 /nfs/dbraw/zinc/35/04/06/599350406.db2.gz RWXTZBCEXAJCTO-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM Cc1ccc(NC(=O)[C@@H](C)Sc2ccccc2-c2nn[n-]n2)c(Cl)c1 ZINC000822242634 599350407 /nfs/dbraw/zinc/35/04/07/599350407.db2.gz RWXTZBCEXAJCTO-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM CCOCCOCc1cccc(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000821384130 599369311 /nfs/dbraw/zinc/36/93/11/599369311.db2.gz QKOQOPSHGOUWSH-OAHLLOKOSA-N -1 3 367.453 3.593 20 0 FHADHM CCOCCOCc1cccc(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000821384130 599369312 /nfs/dbraw/zinc/36/93/12/599369312.db2.gz QKOQOPSHGOUWSH-OAHLLOKOSA-N -1 3 367.453 3.593 20 0 FHADHM CSCCCC(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)cc1 ZINC000737183671 599372492 /nfs/dbraw/zinc/37/24/92/599372492.db2.gz USKDVYIUIVFUPR-UHFFFAOYSA-N -1 3 369.450 3.741 20 0 FHADHM CSCCCC(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)cc1 ZINC000737183671 599372495 /nfs/dbraw/zinc/37/24/95/599372495.db2.gz USKDVYIUIVFUPR-UHFFFAOYSA-N -1 3 369.450 3.741 20 0 FHADHM C[C@@H](Nc1cccc(NC(=O)c2ccoc2)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820462534 599373667 /nfs/dbraw/zinc/37/36/67/599373667.db2.gz YLHWLEJHXOKKNQ-CYBMUJFWSA-N -1 3 374.404 3.885 20 0 FHADHM C[C@@H](Nc1cccc(NC(=O)c2ccoc2)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820462534 599373670 /nfs/dbraw/zinc/37/36/70/599373670.db2.gz YLHWLEJHXOKKNQ-CYBMUJFWSA-N -1 3 374.404 3.885 20 0 FHADHM Cc1ccnc(-c2cccc(N[C@@H](C)c3ccc(-c4nnn[n-]4)cc3)c2)n1 ZINC000822374349 599378521 /nfs/dbraw/zinc/37/85/21/599378521.db2.gz RXEGFQHDWBRIMR-AWEZNQCLSA-N -1 3 357.421 3.805 20 0 FHADHM Cc1ccnc(-c2cccc(N[C@@H](C)c3ccc(-c4nn[n-]n4)cc3)c2)n1 ZINC000822374349 599378525 /nfs/dbraw/zinc/37/85/25/599378525.db2.gz RXEGFQHDWBRIMR-AWEZNQCLSA-N -1 3 357.421 3.805 20 0 FHADHM CCOc1ccc([C@H](C)Nc2cc(-c3nnn[n-]3)c3ccccc3n2)cc1 ZINC000736638144 599399051 /nfs/dbraw/zinc/39/90/51/599399051.db2.gz VIDYRRYZMITRQP-ZDUSSCGKSA-N -1 3 360.421 3.987 20 0 FHADHM CCOc1ccc([C@H](C)Nc2cc(-c3nn[n-]n3)c3ccccc3n2)cc1 ZINC000736638144 599399054 /nfs/dbraw/zinc/39/90/54/599399054.db2.gz VIDYRRYZMITRQP-ZDUSSCGKSA-N -1 3 360.421 3.987 20 0 FHADHM CCn1c2ccccc2nc1SCc1cc(-c2nn[n-]n2)ccc1OC ZINC000821565374 607374452 /nfs/dbraw/zinc/37/44/52/607374452.db2.gz PYCPSAKGKWBZMS-UHFFFAOYSA-N -1 3 366.450 3.537 20 0 FHADHM CCCC(=O)Nc1cccc(CNc2cc(Cl)ccc2-c2nnn[n-]2)c1 ZINC000736414908 599411963 /nfs/dbraw/zinc/41/19/63/599411963.db2.gz AJZHFJCCGNHGEE-UHFFFAOYSA-N -1 3 370.844 3.871 20 0 FHADHM CCCC(=O)Nc1cccc(CNc2cc(Cl)ccc2-c2nn[n-]n2)c1 ZINC000736414908 599411965 /nfs/dbraw/zinc/41/19/65/599411965.db2.gz AJZHFJCCGNHGEE-UHFFFAOYSA-N -1 3 370.844 3.871 20 0 FHADHM COc1ccc2c(c1)CCC[C@H]2Nc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000737114252 599419950 /nfs/dbraw/zinc/41/99/50/599419950.db2.gz IYWSPGCDVYENLY-GOSISDBHSA-N -1 3 372.432 3.913 20 0 FHADHM COc1ccc2c(c1)CCC[C@H]2Nc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000737114252 599419952 /nfs/dbraw/zinc/41/99/52/599419952.db2.gz IYWSPGCDVYENLY-GOSISDBHSA-N -1 3 372.432 3.913 20 0 FHADHM CC(C)c1nc(CCNc2cc(-c3nnn[n-]3)c3ccccc3n2)cs1 ZINC000735941083 599423867 /nfs/dbraw/zinc/42/38/67/599423867.db2.gz WLYNGFRBXJVXGK-UHFFFAOYSA-N -1 3 365.466 3.649 20 0 FHADHM CC(C)c1nc(CCNc2cc(-c3nn[n-]n3)c3ccccc3n2)cs1 ZINC000735941083 599423868 /nfs/dbraw/zinc/42/38/68/599423868.db2.gz WLYNGFRBXJVXGK-UHFFFAOYSA-N -1 3 365.466 3.649 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@H]1NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820073847 599432243 /nfs/dbraw/zinc/43/22/43/599432243.db2.gz WJAGNYQMLZCYQB-RLFYNMQTSA-N -1 3 370.501 3.832 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@H]1NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820073847 599432244 /nfs/dbraw/zinc/43/22/44/599432244.db2.gz WJAGNYQMLZCYQB-RLFYNMQTSA-N -1 3 370.501 3.832 20 0 FHADHM CC(C)(C)OC(=O)c1ccc(CSc2cc(-c3nnn[n-]3)ccn2)cc1 ZINC000819946507 607377924 /nfs/dbraw/zinc/37/79/24/607377924.db2.gz MPOFZRDBPOQDKL-UHFFFAOYSA-N -1 3 369.450 3.509 20 0 FHADHM CC(C)(C)OC(=O)c1ccc(CSc2cc(-c3nn[n-]n3)ccn2)cc1 ZINC000819946507 607377925 /nfs/dbraw/zinc/37/79/25/607377925.db2.gz MPOFZRDBPOQDKL-UHFFFAOYSA-N -1 3 369.450 3.509 20 0 FHADHM CCC[C@@H]1CCCC[C@@H]1NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821039809 599434119 /nfs/dbraw/zinc/43/41/19/599434119.db2.gz HHRAHRCMYPRPPC-CPUCHLNUSA-N -1 3 356.474 3.586 20 0 FHADHM CCC[C@@H]1CCCC[C@@H]1NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821039809 599434122 /nfs/dbraw/zinc/43/41/22/599434122.db2.gz HHRAHRCMYPRPPC-CPUCHLNUSA-N -1 3 356.474 3.586 20 0 FHADHM c1[nH]c2ccccc2c1CCCNc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000738433793 599435833 /nfs/dbraw/zinc/43/58/33/599435833.db2.gz WYTNSXBVFUWXKC-UHFFFAOYSA-N -1 3 369.432 3.941 20 0 FHADHM c1[nH]c2ccccc2c1CCCNc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000738433793 599435835 /nfs/dbraw/zinc/43/58/35/599435835.db2.gz WYTNSXBVFUWXKC-UHFFFAOYSA-N -1 3 369.432 3.941 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@H](C)C1CCCCC1 ZINC000821104413 599445750 /nfs/dbraw/zinc/44/57/50/599445750.db2.gz CAQGSFPPBFHXEQ-OAHLLOKOSA-N -1 3 370.501 3.757 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@H](C)C1CCCCC1 ZINC000821104413 599445753 /nfs/dbraw/zinc/44/57/53/599445753.db2.gz CAQGSFPPBFHXEQ-OAHLLOKOSA-N -1 3 370.501 3.757 20 0 FHADHM C[C@H](NC(=O)Nc1cccc(-c2nnn[n-]2)c1)c1ccc(F)cc1Cl ZINC000736119313 599451572 /nfs/dbraw/zinc/45/15/72/599451572.db2.gz XJXVSKNEKZFHBY-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM C[C@H](NC(=O)Nc1cccc(-c2nn[n-]n2)c1)c1ccc(F)cc1Cl ZINC000736119313 599451576 /nfs/dbraw/zinc/45/15/76/599451576.db2.gz XJXVSKNEKZFHBY-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1COc1ccc2cc(C(C)=O)ccc2c1 ZINC000821749706 607379989 /nfs/dbraw/zinc/37/99/89/607379989.db2.gz VFAJFGBQENFSFN-UHFFFAOYSA-N -1 3 374.400 3.810 20 0 FHADHM COc1ccc([C@@H]2CCCN2c2c(Cl)cccc2-c2nnn[n-]2)cc1 ZINC000821786805 599465549 /nfs/dbraw/zinc/46/55/49/599465549.db2.gz JXWCHMYVORWATE-INIZCTEOSA-N -1 3 355.829 3.870 20 0 FHADHM COc1ccc([C@@H]2CCCN2c2c(Cl)cccc2-c2nn[n-]n2)cc1 ZINC000821786805 599465550 /nfs/dbraw/zinc/46/55/50/599465550.db2.gz JXWCHMYVORWATE-INIZCTEOSA-N -1 3 355.829 3.870 20 0 FHADHM C[C@@H](NC(=O)N1CCC[C@H]1c1ccsc1)c1cccc(-c2nnn[n-]2)c1 ZINC000820348180 599478057 /nfs/dbraw/zinc/47/80/57/599478057.db2.gz ASFSNKQBYXXOLP-WBMJQRKESA-N -1 3 368.466 3.536 20 0 FHADHM C[C@@H](NC(=O)N1CCC[C@H]1c1ccsc1)c1cccc(-c2nn[n-]n2)c1 ZINC000820348180 599478059 /nfs/dbraw/zinc/47/80/59/599478059.db2.gz ASFSNKQBYXXOLP-WBMJQRKESA-N -1 3 368.466 3.536 20 0 FHADHM CCO[C@H](C)c1nc(CSCc2ccccc2-c2nnn[n-]2)cs1 ZINC000736616782 599480508 /nfs/dbraw/zinc/48/05/08/599480508.db2.gz PWBLJEFTKBPFFA-LLVKDONJSA-N -1 3 361.496 3.854 20 0 FHADHM CCO[C@H](C)c1nc(CSCc2ccccc2-c2nn[n-]n2)cs1 ZINC000736616782 599480512 /nfs/dbraw/zinc/48/05/12/599480512.db2.gz PWBLJEFTKBPFFA-LLVKDONJSA-N -1 3 361.496 3.854 20 0 FHADHM CN(Cc1cccc(C(F)(F)F)c1)c1ccc(F)cc1-c1nnn[n-]1 ZINC000821613709 599482778 /nfs/dbraw/zinc/48/27/78/599482778.db2.gz ZVWCZKWFACIFCL-UHFFFAOYSA-N -1 3 351.307 3.661 20 0 FHADHM CN(Cc1cccc(C(F)(F)F)c1)c1ccc(F)cc1-c1nn[n-]n1 ZINC000821613709 599482780 /nfs/dbraw/zinc/48/27/80/599482780.db2.gz ZVWCZKWFACIFCL-UHFFFAOYSA-N -1 3 351.307 3.661 20 0 FHADHM C[C@H](NC(=O)N1CCC[C@H]1C1CCCCC1)c1cccc(-c2nnn[n-]2)c1 ZINC000820352295 599485528 /nfs/dbraw/zinc/48/55/28/599485528.db2.gz TUJYAOMQXKKCQE-KSSFIOAISA-N -1 3 368.485 3.682 20 0 FHADHM C[C@H](NC(=O)N1CCC[C@H]1C1CCCCC1)c1cccc(-c2nn[n-]n2)c1 ZINC000820352295 599485531 /nfs/dbraw/zinc/48/55/31/599485531.db2.gz TUJYAOMQXKKCQE-KSSFIOAISA-N -1 3 368.485 3.682 20 0 FHADHM Fc1ccc(NCc2ccccc2OCC(F)(F)F)c(-c2nnn[n-]2)c1 ZINC000822782928 599489226 /nfs/dbraw/zinc/48/92/26/599489226.db2.gz MEUUXMHHNHBCIZ-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM Fc1ccc(NCc2ccccc2OCC(F)(F)F)c(-c2nn[n-]n2)c1 ZINC000822782928 599489229 /nfs/dbraw/zinc/48/92/29/599489229.db2.gz MEUUXMHHNHBCIZ-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM CCC(CC)(C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000820882106 599493921 /nfs/dbraw/zinc/49/39/21/599493921.db2.gz JUVRNZUSSUUFHC-OAHLLOKOSA-N -1 3 363.465 3.802 20 0 FHADHM CCC(CC)(C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000820882106 599493922 /nfs/dbraw/zinc/49/39/22/599493922.db2.gz JUVRNZUSSUUFHC-OAHLLOKOSA-N -1 3 363.465 3.802 20 0 FHADHM C[C@H](NC(=O)c1csc2c1CC[C@H](C)C2)c1cccc(-c2nnn[n-]2)c1 ZINC000820727093 599506903 /nfs/dbraw/zinc/50/69/03/599506903.db2.gz GMVMIZAXLOWDJE-RYUDHWBXSA-N -1 3 367.478 3.544 20 0 FHADHM C[C@H](NC(=O)c1csc2c1CC[C@H](C)C2)c1cccc(-c2nn[n-]n2)c1 ZINC000820727093 599506904 /nfs/dbraw/zinc/50/69/04/599506904.db2.gz GMVMIZAXLOWDJE-RYUDHWBXSA-N -1 3 367.478 3.544 20 0 FHADHM C[C@@H](S[C@H](C)c1cccs1)C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000736188473 599521912 /nfs/dbraw/zinc/52/19/12/599521912.db2.gz KENWTXNKDSUCST-GHMZBOCLSA-N -1 3 359.480 3.750 20 0 FHADHM C[C@@H](S[C@H](C)c1cccs1)C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000736188473 599521915 /nfs/dbraw/zinc/52/19/15/599521915.db2.gz KENWTXNKDSUCST-GHMZBOCLSA-N -1 3 359.480 3.750 20 0 FHADHM COCCSc1ccc([C@H](C)Nc2ccc(F)cc2-c2nnn[n-]2)cc1 ZINC000821694419 599526221 /nfs/dbraw/zinc/52/62/21/599526221.db2.gz MKIDUOUPVIMDCO-LBPRGKRZSA-N -1 3 373.457 3.917 20 0 FHADHM COCCSc1ccc([C@H](C)Nc2ccc(F)cc2-c2nn[n-]n2)cc1 ZINC000821694419 599526223 /nfs/dbraw/zinc/52/62/23/599526223.db2.gz MKIDUOUPVIMDCO-LBPRGKRZSA-N -1 3 373.457 3.917 20 0 FHADHM CCS[C@H]1CCCCN(c2ccc(-c3nn[n-]n3)cc2C(F)(F)F)C1 ZINC000736668096 599526327 /nfs/dbraw/zinc/52/63/27/599526327.db2.gz XHJHDSKLWNZVBI-LBPRGKRZSA-N -1 3 371.432 3.998 20 0 FHADHM Cc1ccc([C@H](C)CNc2nc(C(F)(F)F)ccc2-c2nnn[n-]2)cc1 ZINC000737319889 599531143 /nfs/dbraw/zinc/53/11/43/599531143.db2.gz HCYQCDAFCISQLO-LLVKDONJSA-N -1 3 362.359 3.805 20 0 FHADHM Cc1ccc([C@H](C)CNc2nc(C(F)(F)F)ccc2-c2nn[n-]n2)cc1 ZINC000737319889 599531146 /nfs/dbraw/zinc/53/11/46/599531146.db2.gz HCYQCDAFCISQLO-LLVKDONJSA-N -1 3 362.359 3.805 20 0 FHADHM Cc1noc(C)c1C[C@H](C)Nc1ccc(-c2nn[n-]n2)cc1C(F)(F)F ZINC000737541167 599531178 /nfs/dbraw/zinc/53/11/78/599531178.db2.gz YTOSJDLDJQIMPC-QMMMGPOBSA-N -1 3 366.347 3.533 20 0 FHADHM CC[C@@H](CC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(C)cc1 ZINC000820882574 599537476 /nfs/dbraw/zinc/53/74/76/599537476.db2.gz UKRQNUPKYDSDGS-CVEARBPZSA-N -1 3 363.465 3.936 20 0 FHADHM CC[C@@H](CC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(C)cc1 ZINC000820882574 599537479 /nfs/dbraw/zinc/53/74/79/599537479.db2.gz UKRQNUPKYDSDGS-CVEARBPZSA-N -1 3 363.465 3.936 20 0 FHADHM CCCO[C@@H]1CCCN(c2c(-c3nnn[n-]3)cnc3c(C)cccc32)CC1 ZINC000821127301 599546781 /nfs/dbraw/zinc/54/67/81/599546781.db2.gz FWDXOKRSKZURRA-OAHLLOKOSA-N -1 3 366.469 3.509 20 0 FHADHM CCCO[C@@H]1CCCN(c2c(-c3nn[n-]n3)cnc3c(C)cccc32)CC1 ZINC000821127301 599546783 /nfs/dbraw/zinc/54/67/83/599546783.db2.gz FWDXOKRSKZURRA-OAHLLOKOSA-N -1 3 366.469 3.509 20 0 FHADHM Cc1ccc([C@H]2CCCCN2C(=O)Nc2ccc(-c3nnn[n-]3)cc2)o1 ZINC000822233219 599551644 /nfs/dbraw/zinc/55/16/44/599551644.db2.gz KSUPEGLEGBNWOI-OAHLLOKOSA-N -1 3 352.398 3.527 20 0 FHADHM Cc1ccc([C@H]2CCCCN2C(=O)Nc2ccc(-c3nn[n-]n3)cc2)o1 ZINC000822233219 599551645 /nfs/dbraw/zinc/55/16/45/599551645.db2.gz KSUPEGLEGBNWOI-OAHLLOKOSA-N -1 3 352.398 3.527 20 0 FHADHM CCc1ccc(N[C@@H](C)C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1 ZINC000736691134 599558641 /nfs/dbraw/zinc/55/86/41/599558641.db2.gz OQOOYDZRHYYBAB-NSHDSACASA-N -1 3 370.844 3.522 20 0 FHADHM CCc1ccc(N[C@@H](C)C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1 ZINC000736691134 599558644 /nfs/dbraw/zinc/55/86/44/599558644.db2.gz OQOOYDZRHYYBAB-NSHDSACASA-N -1 3 370.844 3.522 20 0 FHADHM Cc1ccc([C@H]2CCCCCN2C(=O)c2cccc(-c3nnn[n-]3)c2)o1 ZINC000737330006 599560982 /nfs/dbraw/zinc/56/09/82/599560982.db2.gz MAWILWKNGJGBSP-MRXNPFEDSA-N -1 3 351.410 3.526 20 0 FHADHM Cc1ccc([C@H]2CCCCCN2C(=O)c2cccc(-c3nn[n-]n3)c2)o1 ZINC000737330006 599560984 /nfs/dbraw/zinc/56/09/84/599560984.db2.gz MAWILWKNGJGBSP-MRXNPFEDSA-N -1 3 351.410 3.526 20 0 FHADHM CC[C@H](NC(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1)C(C)C ZINC000736365967 599564758 /nfs/dbraw/zinc/56/47/58/599564758.db2.gz ZZIGTASPXILHSK-SFHVURJKSA-N -1 3 364.453 3.775 20 0 FHADHM CCCN(C(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1)C1CC1 ZINC000736473060 599567202 /nfs/dbraw/zinc/56/72/02/599567202.db2.gz XWKOLTGOEMLAGP-UHFFFAOYSA-N -1 3 362.437 3.625 20 0 FHADHM CC1(NC(=O)c2cccc(Nc3ccc(-c4nn[n-]n4)cc3)c2)CCCC1 ZINC000736222647 599567343 /nfs/dbraw/zinc/56/73/43/599567343.db2.gz JCJABEAVUMSMHU-UHFFFAOYSA-N -1 3 362.437 3.673 20 0 FHADHM C[C@H]1CCC[C@H]1NC(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736264321 599568937 /nfs/dbraw/zinc/56/89/37/599568937.db2.gz VSACEOSCTPLTGG-SCLBCKFNSA-N -1 3 362.437 3.529 20 0 FHADHM Cc1ccc([C@@H]2CCCCCN2C(=O)Nc2ccc(-c3nnn[n-]3)cc2)o1 ZINC000737328143 599600875 /nfs/dbraw/zinc/60/08/75/599600875.db2.gz CTCFDYIPNGMBIR-INIZCTEOSA-N -1 3 366.425 3.917 20 0 FHADHM Cc1ccc([C@@H]2CCCCCN2C(=O)Nc2ccc(-c3nn[n-]n3)cc2)o1 ZINC000737328143 599600877 /nfs/dbraw/zinc/60/08/77/599600877.db2.gz CTCFDYIPNGMBIR-INIZCTEOSA-N -1 3 366.425 3.917 20 0 FHADHM CCc1ccc([C@H](C)CC(=O)OCc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000736686626 599605749 /nfs/dbraw/zinc/60/57/49/599605749.db2.gz KIRKMTPUBGRUSB-CQSZACIVSA-N -1 3 350.422 3.666 20 0 FHADHM CCc1ccc([C@H](C)CC(=O)OCc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000736686626 599605751 /nfs/dbraw/zinc/60/57/51/599605751.db2.gz KIRKMTPUBGRUSB-CQSZACIVSA-N -1 3 350.422 3.666 20 0 FHADHM CC[C@@H](C)[C@@H]1CCCCN1C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736333241 599608317 /nfs/dbraw/zinc/60/83/17/599608317.db2.gz URPAMKSQLPTWSK-ABAIWWIYSA-N -1 3 362.865 3.953 20 0 FHADHM CC[C@@H](C)[C@@H]1CCCCN1C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736333241 599608318 /nfs/dbraw/zinc/60/83/18/599608318.db2.gz URPAMKSQLPTWSK-ABAIWWIYSA-N -1 3 362.865 3.953 20 0 FHADHM CC[C@H](c1ccncc1)N(C)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736394806 599608900 /nfs/dbraw/zinc/60/89/00/599608900.db2.gz FKCWHLGJKSISMW-OAHLLOKOSA-N -1 3 371.832 3.530 20 0 FHADHM CC[C@H](c1ccncc1)N(C)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736394806 599608901 /nfs/dbraw/zinc/60/89/01/599608901.db2.gz FKCWHLGJKSISMW-OAHLLOKOSA-N -1 3 371.832 3.530 20 0 FHADHM C[C@@H](C(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1cccc(Cl)c1 ZINC000820481317 599621454 /nfs/dbraw/zinc/62/14/54/599621454.db2.gz URTMIFSWAZGGFM-NEPJUHHUSA-N -1 3 356.813 3.928 20 0 FHADHM C[C@@H](C(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1cccc(Cl)c1 ZINC000820481317 599621455 /nfs/dbraw/zinc/62/14/55/599621455.db2.gz URTMIFSWAZGGFM-NEPJUHHUSA-N -1 3 356.813 3.928 20 0 FHADHM C[C@H](OC(=O)[C@@H]1C[C@@H]1c1cc(F)ccc1F)c1cccc(-c2nnn[n-]2)c1 ZINC000820488767 599622160 /nfs/dbraw/zinc/62/21/60/599622160.db2.gz UBEZPHWBCIVJJG-DRZCJDIDSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@@H]1C[C@@H]1c1cc(F)ccc1F)c1cccc(-c2nn[n-]n2)c1 ZINC000820488767 599622161 /nfs/dbraw/zinc/62/21/61/599622161.db2.gz UBEZPHWBCIVJJG-DRZCJDIDSA-N -1 3 370.359 3.553 20 0 FHADHM CCOCCCCOC(=O)c1ccccc1-c1ccccc1-c1nnn[n-]1 ZINC000821378692 599625521 /nfs/dbraw/zinc/62/55/21/599625521.db2.gz SGCIFSYGLFXEEE-UHFFFAOYSA-N -1 3 366.421 3.507 20 0 FHADHM CCOCCCCOC(=O)c1ccccc1-c1ccccc1-c1nn[n-]n1 ZINC000821378692 599625522 /nfs/dbraw/zinc/62/55/22/599625522.db2.gz SGCIFSYGLFXEEE-UHFFFAOYSA-N -1 3 366.421 3.507 20 0 FHADHM Cc1sc(NC(=O)[C@@]2(C)CCc3ccccc3C2)c(-c2nnn[n-]2)c1C ZINC000822556345 599628770 /nfs/dbraw/zinc/62/87/70/599628770.db2.gz BMZSOODPJIQOIR-IBGZPJMESA-N -1 3 367.478 3.679 20 0 FHADHM Cc1sc(NC(=O)[C@@]2(C)CCc3ccccc3C2)c(-c2nn[n-]n2)c1C ZINC000822556345 599628771 /nfs/dbraw/zinc/62/87/71/599628771.db2.gz BMZSOODPJIQOIR-IBGZPJMESA-N -1 3 367.478 3.679 20 0 FHADHM Cc1ccc([C@H](C)C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCCC3)o1 ZINC000822227434 599628827 /nfs/dbraw/zinc/62/88/27/599628827.db2.gz ILOKVSRIRLQRRM-NSHDSACASA-N -1 3 371.466 3.841 20 0 FHADHM Cc1ccc([C@H](C)C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCCC3)o1 ZINC000822227434 599628828 /nfs/dbraw/zinc/62/88/28/599628828.db2.gz ILOKVSRIRLQRRM-NSHDSACASA-N -1 3 371.466 3.841 20 0 FHADHM CC(C)CCSCC(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000820081762 599633487 /nfs/dbraw/zinc/63/34/87/599633487.db2.gz UUXZUIYNYPODMT-UHFFFAOYSA-N -1 3 373.404 3.603 20 0 FHADHM CC(C)CCSCC(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000820081762 599633488 /nfs/dbraw/zinc/63/34/88/599633488.db2.gz UUXZUIYNYPODMT-UHFFFAOYSA-N -1 3 373.404 3.603 20 0 FHADHM CC(C)CCOc1ccc(NC(=O)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000820076160 599657160 /nfs/dbraw/zinc/65/71/60/599657160.db2.gz DIGJBWUVKSHWFB-UHFFFAOYSA-N -1 3 351.410 3.544 20 0 FHADHM CC(C)CCOc1ccc(NC(=O)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000820076160 599657161 /nfs/dbraw/zinc/65/71/61/599657161.db2.gz DIGJBWUVKSHWFB-UHFFFAOYSA-N -1 3 351.410 3.544 20 0 FHADHM CSCCCOC(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000821971030 599662428 /nfs/dbraw/zinc/66/24/28/599662428.db2.gz WDEPMYZUCFNETE-UHFFFAOYSA-N -1 3 369.450 3.520 20 0 FHADHM C[C@H](NC(=O)N[C@@H]1CCCC[C@H]1C(C)(C)C)c1cccc(-c2nnn[n-]2)c1 ZINC000820357333 599668043 /nfs/dbraw/zinc/66/80/43/599668043.db2.gz GKRLXARXAZBYRT-IAOVAPTHSA-N -1 3 370.501 3.832 20 0 FHADHM C[C@H](NC(=O)N[C@@H]1CCCC[C@H]1C(C)(C)C)c1cccc(-c2nn[n-]n2)c1 ZINC000820357333 599668044 /nfs/dbraw/zinc/66/80/44/599668044.db2.gz GKRLXARXAZBYRT-IAOVAPTHSA-N -1 3 370.501 3.832 20 0 FHADHM CC(C)C[C@@H]1CCCCCN1C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820062523 599680478 /nfs/dbraw/zinc/68/04/78/599680478.db2.gz NMECKGATCYSMOQ-QAPCUYQASA-N -1 3 370.501 3.928 20 0 FHADHM CC(C)C[C@@H]1CCCCCN1C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820062523 599680479 /nfs/dbraw/zinc/68/04/79/599680479.db2.gz NMECKGATCYSMOQ-QAPCUYQASA-N -1 3 370.501 3.928 20 0 FHADHM CCC1(CNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)CCOCC1 ZINC000820962674 599688920 /nfs/dbraw/zinc/68/89/20/599688920.db2.gz YCZOADAYDSATEU-UHFFFAOYSA-N -1 3 355.364 3.504 20 0 FHADHM CCC1(CNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)CCOCC1 ZINC000820962674 599688921 /nfs/dbraw/zinc/68/89/21/599688921.db2.gz YCZOADAYDSATEU-UHFFFAOYSA-N -1 3 355.364 3.504 20 0 FHADHM CCc1cc2oc(=O)cc(CN[C@H](C(=O)[O-])c3ccccc3)c2cc1Cl ZINC000737251215 599758817 /nfs/dbraw/zinc/75/88/17/599758817.db2.gz ARYPSUAZXJXNSU-IBGZPJMESA-N -1 3 371.820 3.924 20 0 FHADHM O=C([O-])c1coc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)c1 ZINC000566359430 599850342 /nfs/dbraw/zinc/85/03/42/599850342.db2.gz TVBRWALVSSCHIW-CYBMUJFWSA-N -1 3 371.368 3.547 20 0 FHADHM C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCCCN1Cc1cccc(C(=O)[O-])c1 ZINC000736649478 599850410 /nfs/dbraw/zinc/85/04/10/599850410.db2.gz GUQSPSYIHGVITN-RHSMWYFYSA-N -1 3 362.470 3.653 20 0 FHADHM COc1ccc([C@H](NCc2ccc(SC(F)F)cc2)C(=O)[O-])cc1 ZINC000737971705 599859724 /nfs/dbraw/zinc/85/97/24/599859724.db2.gz TZGMDGPLRACSBU-HNNXBMFYSA-N -1 3 353.390 3.925 20 0 FHADHM COc1ccc([C@@H](NCc2ccc(OCC(F)(F)F)cc2)C(=O)[O-])cc1 ZINC000737969299 599860276 /nfs/dbraw/zinc/86/02/76/599860276.db2.gz JWYWYIVXFINFHF-MRXNPFEDSA-N -1 3 369.339 3.552 20 0 FHADHM O=C([O-])CN(CCOc1ccccc1Cl)Cc1ccc(F)c(F)c1 ZINC000739793753 599866350 /nfs/dbraw/zinc/86/63/50/599866350.db2.gz PEOGTRXBDAESAH-UHFFFAOYSA-N -1 3 355.768 3.584 20 0 FHADHM Cc1ccc([C@@H](CNC(=O)c2cccc(NC(=O)[O-])c2)N2CCCC2)cc1 ZINC000738566225 599934822 /nfs/dbraw/zinc/93/48/22/599934822.db2.gz AWZQQTWGMOWUBO-LJQANCHMSA-N -1 3 367.449 3.652 20 0 FHADHM Cc1cccc(CN(CCN(C)C)C(=O)Nc2cccc(C(=O)[O-])c2C)c1 ZINC000738709095 600008383 /nfs/dbraw/zinc/00/83/83/600008383.db2.gz QHYVCHSBICUIFC-UHFFFAOYSA-N -1 3 369.465 3.597 20 0 FHADHM Cc1cccc(CN(CCN(C)C)C(=O)Nc2cccc(NC(=O)[O-])c2)c1 ZINC000738708265 600009244 /nfs/dbraw/zinc/00/92/44/600009244.db2.gz LYXLCSYDYANYBV-UHFFFAOYSA-N -1 3 370.453 3.681 20 0 FHADHM COC[C@@H](C)NCc1nc2ccccc2c(-c2ccccc2)c1C(=O)[O-] ZINC000737749164 600011767 /nfs/dbraw/zinc/01/17/67/600011767.db2.gz XDYKNDDDJAFVRL-CQSZACIVSA-N -1 3 350.418 3.725 20 0 FHADHM CC(=O)N1CCCCC[C@@H]1C1CCN([C@H](C)c2ccc(C(=O)[O-])o2)CC1 ZINC000736136195 600077254 /nfs/dbraw/zinc/07/72/54/600077254.db2.gz VFWSDBYUOXGBQO-RHSMWYFYSA-N -1 3 362.470 3.542 20 0 FHADHM CCc1ccc2c(CN[C@@](CC)(C(=O)[O-])c3ccccc3)cc(=O)oc2c1 ZINC000737268365 600129284 /nfs/dbraw/zinc/12/92/84/600129284.db2.gz YXNMPUYDAMFEEQ-JOCHJYFZSA-N -1 3 365.429 3.835 20 0 FHADHM O=C([O-])c1cc(Cl)cc(NC(=O)c2cccc(CN3CCCC3)c2)c1 ZINC000740071888 600202138 /nfs/dbraw/zinc/20/21/38/600202138.db2.gz FYHIAXSBTYDLTM-UHFFFAOYSA-N -1 3 358.825 3.886 20 0 FHADHM O=C([O-])c1ccc2c(cnn2CN(CCc2cccc(F)c2)C2CC2)c1 ZINC000740204151 600278904 /nfs/dbraw/zinc/27/89/04/600278904.db2.gz UELYKJXFXHBRBP-UHFFFAOYSA-N -1 3 353.397 3.538 20 0 FHADHM CCc1ccc([C@H](CNC(=O)Nc2ccc(C(=O)[O-])cc2F)N(C)C)cc1 ZINC000737259130 600397334 /nfs/dbraw/zinc/39/73/34/600397334.db2.gz NNDYQVXBKASOTE-SFHVURJKSA-N -1 3 373.428 3.511 20 0 FHADHM CN(C(=O)CCCCCc1cccs1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825817364 607442114 /nfs/dbraw/zinc/44/21/14/607442114.db2.gz IMEDRXNOURVZER-UHFFFAOYSA-N -1 3 355.467 3.694 20 0 FHADHM CN(C(=O)CCCCCc1cccs1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825817364 607442116 /nfs/dbraw/zinc/44/21/16/607442116.db2.gz IMEDRXNOURVZER-UHFFFAOYSA-N -1 3 355.467 3.694 20 0 FHADHM O=C([O-])[C@H](NCc1ccc(Oc2ccc(F)cc2)nc1)c1ccccc1 ZINC000738524642 600425921 /nfs/dbraw/zinc/42/59/21/600425921.db2.gz HSPWKJBPUPSPOV-LJQANCHMSA-N -1 3 352.365 3.929 20 0 FHADHM CCOc1ccc(CN[C@@H](C(=O)[O-])c2ccc(Br)cc2)cc1 ZINC000426810296 600428366 /nfs/dbraw/zinc/42/83/66/600428366.db2.gz YOSUVYGWWWOMST-MRXNPFEDSA-N -1 3 364.239 3.763 20 0 FHADHM O=C([O-])[C@H](c1ccc(F)cc1)N1CCC[C@@H](C(=O)c2ccc(F)cc2)C1 ZINC000580456707 600440932 /nfs/dbraw/zinc/44/09/32/600440932.db2.gz NQQDEECYYWMWSE-QAPCUYQASA-N -1 3 359.372 3.685 20 0 FHADHM CCCCN(CC(=O)N1CCC(C(=O)[O-])CC1)[C@@H](CC)c1ccccc1 ZINC000736992427 600507964 /nfs/dbraw/zinc/50/79/64/600507964.db2.gz HXMNVLJTPHTCMP-IBGZPJMESA-N -1 3 360.498 3.563 20 0 FHADHM Cc1cc(C)cc([C@@H](C)N[C@@H]2CCN(c3sccc3C(=O)[O-])C2=O)c1 ZINC000832875236 600694194 /nfs/dbraw/zinc/69/41/94/600694194.db2.gz QGVCBCFOWZXXAN-CZUORRHYSA-N -1 3 358.463 3.519 20 0 FHADHM O=C([O-])[C@H](NCCOc1cccc(C(F)(F)F)c1)c1ccccc1F ZINC000833167098 600740109 /nfs/dbraw/zinc/74/01/09/600740109.db2.gz XOMGGWQAGQCNPJ-OAHLLOKOSA-N -1 3 357.303 3.639 20 0 FHADHM C[C@@H]1CCN(C(=O)Nc2ccccc2C(=O)[O-])CCN1Cc1ccccc1 ZINC000382622520 600813341 /nfs/dbraw/zinc/81/33/41/600813341.db2.gz FZKPMAPPVFWHGT-MRXNPFEDSA-N -1 3 367.449 3.513 20 0 FHADHM COc1ccc(CN2CCC(CC(=O)[O-])CC2)cc1SC(F)(F)F ZINC000832314751 600820044 /nfs/dbraw/zinc/82/00/44/600820044.db2.gz OKVAGGBCHNQWPT-UHFFFAOYSA-N -1 3 363.401 3.994 20 0 FHADHM O=C([O-])[C@H](c1ccccc1F)N1CCC(Oc2ccc(F)cc2F)CC1 ZINC000582852219 600987839 /nfs/dbraw/zinc/98/78/39/600987839.db2.gz YJFNLXIHNSKPTD-SFHVURJKSA-N -1 3 365.351 3.773 20 0 FHADHM COc1ccc(OC2CCN([C@H](C(=O)[O-])c3ccccc3F)CC2)cc1 ZINC000832439169 600988787 /nfs/dbraw/zinc/98/87/87/600988787.db2.gz ONDNOGOTFXIPTK-IBGZPJMESA-N -1 3 359.397 3.503 20 0 FHADHM Cn1nccc1[C@@H]1CCCN([C@H](C(=O)[O-])c2ccc(Cl)cc2Cl)C1 ZINC000833061256 600990297 /nfs/dbraw/zinc/99/02/97/600990297.db2.gz RAYLMQKCDBOORI-BZNIZROVSA-N -1 3 368.264 3.732 20 0 FHADHM C[C@H](NC(=O)CN[C@H](c1ccccc1)[C@H](C)C(=O)[O-])c1ccc(Cl)cc1 ZINC000827637899 601201673 /nfs/dbraw/zinc/20/16/73/601201673.db2.gz XKTDHIRNUXJTFQ-NJSLBKSFSA-N -1 3 374.868 3.569 20 0 FHADHM Cc1ccc2c(CN[C@@H](c3ccccc3)[C@@H](C)C(=O)[O-])cc(=O)oc2c1C ZINC000832962624 601205712 /nfs/dbraw/zinc/20/57/12/601205712.db2.gz ZIJUUJKZDOFKNE-FOIQADDNSA-N -1 3 365.429 3.961 20 0 FHADHM CC[C@](NCc1cccc(SC(=O)N(C)C)c1)(C(=O)[O-])c1ccccc1 ZINC000828989369 601531993 /nfs/dbraw/zinc/53/19/93/601531993.db2.gz YKBJICYIBBZUEL-HXUWFJFHSA-N -1 3 372.490 3.940 20 0 FHADHM O=C([O-])[C@H]1CCCCN1Cc1cc(Cl)ccc1OCc1cccnc1 ZINC000158384746 601577577 /nfs/dbraw/zinc/57/75/77/601577577.db2.gz HMZBBMVPZNABCU-QGZVFWFLSA-N -1 3 360.841 3.753 20 0 FHADHM O=C([O-])c1ccc(-c2nc(CN3CCC[C@H]4COCC[C@@H]43)cs2)cc1 ZINC000574165394 601662111 /nfs/dbraw/zinc/66/21/11/601662111.db2.gz YTROWPPFSYTGLE-RDJZCZTQSA-N -1 3 358.463 3.509 20 0 FHADHM O=C([O-])NC1CCN(CCOC(c2ccccc2)c2ccccc2)CC1 ZINC000740596583 601923922 /nfs/dbraw/zinc/92/39/22/601923922.db2.gz NMDHPJKABWOZNZ-UHFFFAOYSA-N -1 3 354.450 3.525 20 0 FHADHM O=C([O-])N1CCC[C@@H](CNCc2csc(-c3ccc(Cl)cc3)n2)C1 ZINC000740511646 602002660 /nfs/dbraw/zinc/00/26/60/602002660.db2.gz FXPSHWGDPMSTCK-LBPRGKRZSA-N -1 3 365.886 3.943 20 0 FHADHM O=C([O-])[C@@H](c1cc(Cl)cc(Cl)c1)N1CCC[C@@H](c2ncc[nH]2)C1 ZINC000833169399 602044221 /nfs/dbraw/zinc/04/42/21/602044221.db2.gz BBBIXHSUHYACGJ-QMTHXVAHSA-N -1 3 354.237 3.722 20 0 FHADHM O=C([O-])[C@@H](c1cc(Cl)cc(Cl)c1)N1CCC(c2ncc[nH]2)CC1 ZINC000833169458 602044595 /nfs/dbraw/zinc/04/45/95/602044595.db2.gz BOBRXEGPOGQOGP-CQSZACIVSA-N -1 3 354.237 3.722 20 0 FHADHM CC[C@](C)(CC(=O)[O-])NCc1csc(-c2ccc(OC)c(OC)c2)n1 ZINC000828665706 602215607 /nfs/dbraw/zinc/21/56/07/602215607.db2.gz WYPPGDYCXSPCLX-GOSISDBHSA-N -1 3 364.467 3.560 20 0 FHADHM C[C@H](CCC(=O)OCc1ccc(F)c(-c2nnn[n-]2)c1)c1ccccc1 ZINC000824402132 607553007 /nfs/dbraw/zinc/55/30/07/607553007.db2.gz UPDCORSABXMEQO-CYBMUJFWSA-N -1 3 354.385 3.633 20 0 FHADHM C[C@H](CCC(=O)OCc1ccc(F)c(-c2nn[n-]n2)c1)c1ccccc1 ZINC000824402132 607553009 /nfs/dbraw/zinc/55/30/09/607553009.db2.gz UPDCORSABXMEQO-CYBMUJFWSA-N -1 3 354.385 3.633 20 0 FHADHM CCC(=CC(=O)Nc1cc(-c2nnn[n-]2)ccc1C)c1ccc(OC)cc1 ZINC000825029031 607577386 /nfs/dbraw/zinc/57/73/86/607577386.db2.gz LVWGIVMQMHNKTN-WYMLVPIESA-N -1 3 363.421 3.616 20 0 FHADHM CCC(=CC(=O)Nc1cc(-c2nn[n-]n2)ccc1C)c1ccc(OC)cc1 ZINC000825029031 607577388 /nfs/dbraw/zinc/57/73/88/607577388.db2.gz LVWGIVMQMHNKTN-WYMLVPIESA-N -1 3 363.421 3.616 20 0 FHADHM CCn1nc(C)c(CNC[C@@H](NC(=O)[O-])c2ccc(C(C)C)cc2)c1C ZINC000739571624 602647353 /nfs/dbraw/zinc/64/73/53/602647353.db2.gz WAJPLOLGCSLNEL-LJQANCHMSA-N -1 3 358.486 3.742 20 0 FHADHM C[C@H](NCC[C@H]1CCCN(C(=O)[O-])C1)c1nc2ccccc2n1C(F)F ZINC000739037693 602649933 /nfs/dbraw/zinc/64/99/33/602649933.db2.gz YBIVOYOBSZUKIF-QWHCGFSZSA-N -1 3 366.412 3.862 20 0 FHADHM COc1cc(CN2CCC[C@H]([C@H]3CCCN3C(=O)[O-])C2)ccc1SC ZINC000739856473 602735411 /nfs/dbraw/zinc/73/54/11/602735411.db2.gz BEJUZMYEBPFYLW-JKSUJKDBSA-N -1 3 364.511 3.772 20 0 FHADHM CN(C(=O)[O-])c1ccc(OC(=O)C2CCN(Cc3ccccc3)CC2)cc1 ZINC000827900917 603051510 /nfs/dbraw/zinc/05/15/10/603051510.db2.gz SAJXIAHLGFQLRG-UHFFFAOYSA-N -1 3 368.433 3.618 20 0 FHADHM C[C@@H](NC(=O)[O-])c1ccc(NC(=O)Nc2cccc(CN(C)C)c2)cc1 ZINC000825442345 603270102 /nfs/dbraw/zinc/27/01/02/603270102.db2.gz DPAGMSCOSFQYTN-CYBMUJFWSA-N -1 3 356.426 3.721 20 0 FHADHM C[C@H](NC(=O)[O-])c1ccc(NC(=O)Nc2cccc(CN(C)C)c2)cc1 ZINC000825442346 603270425 /nfs/dbraw/zinc/27/04/25/603270425.db2.gz DPAGMSCOSFQYTN-ZDUSSCGKSA-N -1 3 356.426 3.721 20 0 FHADHM Cc1ccc(C(=O)N(CCN(C)C)CC2CCCCC2)cc1NC(=O)[O-] ZINC000830186444 603392844 /nfs/dbraw/zinc/39/28/44/603392844.db2.gz HZTRRSSCXJVYGI-UHFFFAOYSA-N -1 3 361.486 3.669 20 0 FHADHM Cc1cc(Br)ccc1CNCc1ccc(NC(=O)[O-])nc1 ZINC000829903715 603552574 /nfs/dbraw/zinc/55/25/74/603552574.db2.gz ABBVJICHBFALMN-UHFFFAOYSA-N -1 3 350.216 3.532 20 0 FHADHM CC[C@H](NC[C@H]1CCCN(C(=O)[O-])C1)c1nc(C(F)(F)F)cs1 ZINC000826620669 603604035 /nfs/dbraw/zinc/60/40/35/603604035.db2.gz SNFKJUVFCDFVSZ-ZJUUUORDSA-N -1 3 351.394 3.593 20 0 FHADHM Cc1ccc(-c2nc(-c3ccc(CN(C)C)cc3)no2)cc1NC(=O)[O-] ZINC000830153802 603637426 /nfs/dbraw/zinc/63/74/26/603637426.db2.gz ABYSOZSHWIQZLT-UHFFFAOYSA-N -1 3 352.394 3.864 20 0 FHADHM Fc1ccc(OCc2nc(-c3cccc(-c4nnn[n-]4)c3)cs2)cc1 ZINC000826376201 607644831 /nfs/dbraw/zinc/64/48/31/607644831.db2.gz SNQSLGJPBBGORF-UHFFFAOYSA-N -1 3 353.382 3.708 20 0 FHADHM Fc1ccc(OCc2nc(-c3cccc(-c4nn[n-]n4)c3)cs2)cc1 ZINC000826376201 607644833 /nfs/dbraw/zinc/64/48/33/607644833.db2.gz SNQSLGJPBBGORF-UHFFFAOYSA-N -1 3 353.382 3.708 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)NC(c1ccccc1)c1ccccc1 ZINC000826247070 607651560 /nfs/dbraw/zinc/65/15/60/607651560.db2.gz SIBLQCNGSRAYPQ-UHFFFAOYSA-N -1 3 369.428 3.695 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)NC(c1ccccc1)c1ccccc1 ZINC000826247070 607651561 /nfs/dbraw/zinc/65/15/61/607651561.db2.gz SIBLQCNGSRAYPQ-UHFFFAOYSA-N -1 3 369.428 3.695 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N(C)[C@@H](C)c1ccccc1Cl ZINC000826243552 607660213 /nfs/dbraw/zinc/66/02/13/607660213.db2.gz MGHACJWTPRUYEE-LBPRGKRZSA-N -1 3 355.829 3.662 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N(C)[C@@H](C)c1ccccc1Cl ZINC000826243552 607660214 /nfs/dbraw/zinc/66/02/14/607660214.db2.gz MGHACJWTPRUYEE-LBPRGKRZSA-N -1 3 355.829 3.662 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N(C)Cc1cccc2ccccc21 ZINC000826243511 607660334 /nfs/dbraw/zinc/66/03/34/607660334.db2.gz KVAVJUBYUVHNTG-UHFFFAOYSA-N -1 3 357.417 3.601 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N(C)Cc1cccc2ccccc21 ZINC000826243511 607660336 /nfs/dbraw/zinc/66/03/36/607660336.db2.gz KVAVJUBYUVHNTG-UHFFFAOYSA-N -1 3 357.417 3.601 20 0 FHADHM Cc1cc([C@H](C)N2CCC(C(=O)Nc3cccc(F)c3)CC2)oc1C(=O)[O-] ZINC000832872167 604385116 /nfs/dbraw/zinc/38/51/16/604385116.db2.gz ZGEYHWBSKOBSDX-ZDUSSCGKSA-N -1 3 374.412 3.837 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N(Cc1ccoc1)C1CCCCC1 ZINC000826244377 607694658 /nfs/dbraw/zinc/69/46/58/607694658.db2.gz PTJGDNMSDMEWNA-UHFFFAOYSA-N -1 3 365.437 3.743 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N(Cc1ccoc1)C1CCCCC1 ZINC000826244377 607694659 /nfs/dbraw/zinc/69/46/59/607694659.db2.gz PTJGDNMSDMEWNA-UHFFFAOYSA-N -1 3 365.437 3.743 20 0 FHADHM C[C@@H](C(=O)[O-])[C@H](NCc1ccc(OCC(F)(F)F)nc1)c1ccccc1 ZINC000826055014 604484691 /nfs/dbraw/zinc/48/46/91/604484691.db2.gz UPJOMULFOXIIKE-WBMJQRKESA-N -1 3 368.355 3.574 20 0 FHADHM CC[C@H](Cc1ccc(C)cc1)N(C)C(=O)c1ccc(-c2nnn[n-]2)cc1C ZINC000825128477 607695294 /nfs/dbraw/zinc/69/52/94/607695294.db2.gz VOFGOVQJKOFVMC-GOSISDBHSA-N -1 3 363.465 3.577 20 0 FHADHM CC[C@H](Cc1ccc(C)cc1)N(C)C(=O)c1ccc(-c2nn[n-]n2)cc1C ZINC000825128477 607695295 /nfs/dbraw/zinc/69/52/95/607695295.db2.gz VOFGOVQJKOFVMC-GOSISDBHSA-N -1 3 363.465 3.577 20 0 FHADHM O=C([O-])[C@H](c1ccc(Cl)cc1Cl)N1CC[C@]2(O)CCCC[C@H]2C1 ZINC000833170965 604499489 /nfs/dbraw/zinc/49/94/89/604499489.db2.gz KWMSQKKLODLDAH-XNJJOIOASA-N -1 3 358.265 3.746 20 0 FHADHM Cc1cc([C@H](C)OC(=O)[C@@H]2CCCN(Cc3ccccc3)C2)oc1C(=O)[O-] ZINC000832873210 604585711 /nfs/dbraw/zinc/58/57/11/604585711.db2.gz FRRLVDGOZWJCIL-DOTOQJQBSA-N -1 3 371.433 3.803 20 0 FHADHM C[C@@H](Oc1ccc(CN(Cc2ccccc2)C[C@H]2CCCO2)cc1)C(=O)[O-] ZINC000833538202 604607667 /nfs/dbraw/zinc/60/76/67/604607667.db2.gz RRJJRXCSOVFHII-DYESRHJHSA-N -1 3 369.461 3.720 20 0 FHADHM CC(C)(C)[C@H](NCc1coc(-c2ccc(C(F)(F)F)cc2)n1)C(=O)[O-] ZINC000833423396 604617704 /nfs/dbraw/zinc/61/77/04/604617704.db2.gz ATTMFWMOQHUNTI-CYBMUJFWSA-N -1 3 356.344 3.949 20 0 FHADHM Cc1ccc(-c2ncc(CN(CCC(=O)[O-])C[C@H]3CCCO3)s2)cc1 ZINC000833746863 604656702 /nfs/dbraw/zinc/65/67/02/604656702.db2.gz SHTZADQEXQDQNK-MRXNPFEDSA-N -1 3 360.479 3.574 20 0 FHADHM CC[C@H](CC(=O)OCc1ccc(-c2nnn[n-]2)cc1)c1ccc(OC)cc1 ZINC000825081848 607715909 /nfs/dbraw/zinc/71/59/09/607715909.db2.gz NMBSVBQCSQDOIA-OAHLLOKOSA-N -1 3 366.421 3.502 20 0 FHADHM CC[C@H](CC(=O)OCc1ccc(-c2nn[n-]n2)cc1)c1ccc(OC)cc1 ZINC000825081848 607715911 /nfs/dbraw/zinc/71/59/11/607715911.db2.gz NMBSVBQCSQDOIA-OAHLLOKOSA-N -1 3 366.421 3.502 20 0 FHADHM CC(C)c1ccccc1OCCC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000824352570 607722934 /nfs/dbraw/zinc/72/29/34/607722934.db2.gz JBAPSPRFMZYXEU-UHFFFAOYSA-N -1 3 369.400 3.537 20 0 FHADHM CC(C)c1ccccc1OCCC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000824352570 607722936 /nfs/dbraw/zinc/72/29/36/607722936.db2.gz JBAPSPRFMZYXEU-UHFFFAOYSA-N -1 3 369.400 3.537 20 0 FHADHM CC(C)(C(=O)[O-])[C@@H]1CCCN(Cc2nnc(-c3ccccc3Cl)o2)C1 ZINC000326966080 604928458 /nfs/dbraw/zinc/92/84/58/604928458.db2.gz KFYUHDHPUSQECJ-GFCCVEGCSA-N -1 3 363.845 3.713 20 0 FHADHM CC(C)(C)c1ccc(NC(=O)CN2CCC[C@H](C(C)(C)C(=O)[O-])C2)cc1 ZINC000833448838 604932940 /nfs/dbraw/zinc/93/29/40/604932940.db2.gz ILEDKWDYLPJTGI-INIZCTEOSA-N -1 3 360.498 3.745 20 0 FHADHM CC(C)(C(=O)[O-])[C@H]1CCCN(Cc2cc(F)cc(Br)c2)C1 ZINC000135024100 604941655 /nfs/dbraw/zinc/94/16/55/604941655.db2.gz IZXZBPBRSVUNOF-LBPRGKRZSA-N -1 3 358.251 3.911 20 0 FHADHM Cc1cccc(-c2nnc([C@H](C)N3CCC[C@@H](C(C)(C)C(=O)[O-])C3)o2)c1 ZINC000833752260 604946455 /nfs/dbraw/zinc/94/64/55/604946455.db2.gz ORJOYXWUHCAZKR-GOEBONIOSA-N -1 3 357.454 3.929 20 0 FHADHM O=C([O-])[C@H](NCc1ccc(CN2CCc3ccccc32)cc1)c1cccnc1 ZINC000833166010 604991710 /nfs/dbraw/zinc/99/17/10/604991710.db2.gz NGJWYHNNYCHNAV-JOCHJYFZSA-N -1 3 373.456 3.560 20 0 FHADHM Cc1cccc(COc2ccc(CN[C@@H](C(=O)[O-])c3cccnc3)cc2)c1 ZINC000832967246 604991833 /nfs/dbraw/zinc/99/18/33/604991833.db2.gz WJOWYNNISPWUNM-OAQYLSRUSA-N -1 3 362.429 3.885 20 0 FHADHM O=C([O-])[C@H](NCc1ccc(-c2ccc3c(c2)CCO3)cc1)c1cccnc1 ZINC000833165225 604998032 /nfs/dbraw/zinc/99/80/32/604998032.db2.gz GVJZGDWHKVHFPY-OAQYLSRUSA-N -1 3 360.413 3.599 20 0 FHADHM CC(C)N(C(=O)CN[C@@H](c1ccccc1)C(C)(C)C(=O)[O-])c1ccccc1 ZINC000833495791 605178791 /nfs/dbraw/zinc/17/87/91/605178791.db2.gz WAUPKXWCGDNWAH-FQEVSTJZSA-N -1 3 368.477 3.870 20 0 FHADHM C[C@@]1(CCCO)CCCN1Cc1csc(-c2cccc(C(=O)[O-])c2)n1 ZINC000833563941 605193167 /nfs/dbraw/zinc/19/31/67/605193167.db2.gz PZLFTIRDIRTSJD-IBGZPJMESA-N -1 3 360.479 3.635 20 0 FHADHM CC(C)Sc1c(Cl)cccc1NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC000824338385 607741817 /nfs/dbraw/zinc/74/18/17/607741817.db2.gz YRNQOHGSGWLMHH-UHFFFAOYSA-N -1 3 362.846 3.601 20 0 FHADHM CC(C)Sc1c(Cl)cccc1NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC000824338385 607741818 /nfs/dbraw/zinc/74/18/18/607741818.db2.gz YRNQOHGSGWLMHH-UHFFFAOYSA-N -1 3 362.846 3.601 20 0 FHADHM Cc1cc(CN2CCSCC2)ccc1NCc1ccc(NC(=O)[O-])nc1 ZINC000830036666 605251596 /nfs/dbraw/zinc/25/15/96/605251596.db2.gz XKGPRIQOXLHOOH-UHFFFAOYSA-N -1 3 372.494 3.641 20 0 FHADHM CCc1oc(C(=O)[O-])cc1CN[C@@H](CN1CCCCC1)c1ccccc1 ZINC000833680405 605271478 /nfs/dbraw/zinc/27/14/78/605271478.db2.gz INGOSHUXGLQZNG-SFHVURJKSA-N -1 3 356.466 3.857 20 0 FHADHM CCc1oc(C(=O)[O-])cc1CN[C@H](CN1CCCCC1)c1ccccc1 ZINC000833680404 605271591 /nfs/dbraw/zinc/27/15/91/605271591.db2.gz INGOSHUXGLQZNG-GOSISDBHSA-N -1 3 356.466 3.857 20 0 FHADHM CC[C@@H](CSc1ccccc1)NC(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000825128429 607757535 /nfs/dbraw/zinc/75/75/35/607757535.db2.gz UEIIQAMOABUEPH-AWEZNQCLSA-N -1 3 368.466 3.559 20 0 FHADHM CC[C@@H](CSc1ccccc1)NC(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000825128429 607757536 /nfs/dbraw/zinc/75/75/36/607757536.db2.gz UEIIQAMOABUEPH-AWEZNQCLSA-N -1 3 368.466 3.559 20 0 FHADHM C[C@H](NC(=O)Nc1cccc2ccsc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000824505834 607761815 /nfs/dbraw/zinc/76/18/15/607761815.db2.gz IDCBZIJMAGJTQG-NSHDSACASA-N -1 3 364.434 3.964 20 0 FHADHM C[C@H](NC(=O)Nc1cccc2ccsc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000824505834 607761816 /nfs/dbraw/zinc/76/18/16/607761816.db2.gz IDCBZIJMAGJTQG-NSHDSACASA-N -1 3 364.434 3.964 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)Nc1cccc2ccsc21 ZINC000826454369 607763682 /nfs/dbraw/zinc/76/36/82/607763682.db2.gz UAXNXBHWRWAOSC-UHFFFAOYSA-N -1 3 354.370 3.865 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)Nc1cccc2ccsc21 ZINC000826454369 607763683 /nfs/dbraw/zinc/76/36/83/607763683.db2.gz UAXNXBHWRWAOSC-UHFFFAOYSA-N -1 3 354.370 3.865 20 0 FHADHM O=C([O-])Nc1ccc2c(c1)CC[C@H]2NCc1cnn(Cc2ccccc2)c1 ZINC000834263344 605578770 /nfs/dbraw/zinc/57/87/70/605578770.db2.gz STFXIAKPAPSQDB-HXUWFJFHSA-N -1 3 362.433 3.798 20 0 FHADHM O=C([O-])NC[C@@H](NCc1ccc2[nH]cnc2c1)c1ccc2ccccc2c1 ZINC000834205217 605632694 /nfs/dbraw/zinc/63/26/94/605632694.db2.gz FCTJRAMITYKMTH-HXUWFJFHSA-N -1 3 360.417 3.815 20 0 FHADHM O=C([O-])NC[C@@H](NCc1ccc2nc[nH]c2c1)c1ccc2ccccc2c1 ZINC000834205217 605632696 /nfs/dbraw/zinc/63/26/96/605632696.db2.gz FCTJRAMITYKMTH-HXUWFJFHSA-N -1 3 360.417 3.815 20 0 FHADHM Cc1cccc(C(=O)Nc2nc(-c3cccc(-c4nnn[n-]4)c3)cs2)c1 ZINC000826296323 607769710 /nfs/dbraw/zinc/76/97/10/607769710.db2.gz RQCMCABWCXBLQD-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1cccc(C(=O)Nc2nc(-c3cccc(-c4nn[n-]n4)c3)cs2)c1 ZINC000826296323 607769711 /nfs/dbraw/zinc/76/97/11/607769711.db2.gz RQCMCABWCXBLQD-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM O=C(Nc1ccccc1F)c1c(Cl)cc(-c2nnn[n-]2)cc1Cl ZINC000826457477 607832672 /nfs/dbraw/zinc/83/26/72/607832672.db2.gz CTAKZBKVXBDEDI-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccccc1F)c1c(Cl)cc(-c2nn[n-]n2)cc1Cl ZINC000826457477 607832673 /nfs/dbraw/zinc/83/26/73/607832673.db2.gz CTAKZBKVXBDEDI-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM Cc1noc(C)c1CCN[C@@H](CNC(=O)[O-])c1ccc2ccccc2c1 ZINC000833931286 605973804 /nfs/dbraw/zinc/97/38/04/605973804.db2.gz OBIONUCZCAFWJR-IBGZPJMESA-N -1 3 353.422 3.586 20 0 FHADHM COc1cccc2c1CC[C@H]2N[C@@H](C)c1ccc(CNC(=O)[O-])nc1C ZINC000833891951 605989853 /nfs/dbraw/zinc/98/98/53/605989853.db2.gz WWIJLBRXCGNERK-SCLBCKFNSA-N -1 3 355.438 3.504 20 0 FHADHM O=C([O-])N1CCC[C@H](NCc2csc(CCc3ccccc3)n2)CC1 ZINC000834107068 606042790 /nfs/dbraw/zinc/04/27/90/606042790.db2.gz NJDBEYWQYUSZIX-INIZCTEOSA-N -1 3 359.495 3.550 20 0 FHADHM C[C@H](C(=O)Nc1sccc1-c1nnn[n-]1)c1ccc(Cl)c(Cl)c1 ZINC000819876999 606099473 /nfs/dbraw/zinc/09/94/73/606099473.db2.gz MMQZCCDNFQIXRZ-ZETCQYMHSA-N -1 3 368.249 3.977 20 0 FHADHM C[C@H](C(=O)Nc1sccc1-c1nn[n-]n1)c1ccc(Cl)c(Cl)c1 ZINC000819876999 606099476 /nfs/dbraw/zinc/09/94/76/606099476.db2.gz MMQZCCDNFQIXRZ-ZETCQYMHSA-N -1 3 368.249 3.977 20 0 FHADHM CC[C@H](C)[C@@H](C)N(C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000820860570 606114979 /nfs/dbraw/zinc/11/49/79/606114979.db2.gz KBRHQELETVAIGK-MELADBBJSA-N -1 3 356.474 3.536 20 0 FHADHM CC[C@H](C)[C@@H](C)N(C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000820860570 606114981 /nfs/dbraw/zinc/11/49/81/606114981.db2.gz KBRHQELETVAIGK-MELADBBJSA-N -1 3 356.474 3.536 20 0 FHADHM C[C@@H]1c2ccccc2CN1C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820826486 606115135 /nfs/dbraw/zinc/11/51/35/606115135.db2.gz MTSCUGNBIZIHOE-SNVBAGLBSA-N -1 3 354.801 3.629 20 0 FHADHM C[C@@H]1c2ccccc2CN1C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820826486 606115137 /nfs/dbraw/zinc/11/51/37/606115137.db2.gz MTSCUGNBIZIHOE-SNVBAGLBSA-N -1 3 354.801 3.629 20 0 FHADHM C[C@H](C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(Cl)s1 ZINC000820314448 606116844 /nfs/dbraw/zinc/11/68/44/606116844.db2.gz IZYFNWSMWCFLEU-UWVGGRQHSA-N -1 3 361.858 3.563 20 0 FHADHM C[C@H](C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(Cl)s1 ZINC000820314448 606116846 /nfs/dbraw/zinc/11/68/46/606116846.db2.gz IZYFNWSMWCFLEU-UWVGGRQHSA-N -1 3 361.858 3.563 20 0 FHADHM CC1(C(=O)Oc2ccc(Oc3ccc(-c4nnn[n-]4)cc3)cc2)CCC1 ZINC000820576953 606127364 /nfs/dbraw/zinc/12/73/64/606127364.db2.gz DIPSYNVJYROOBC-UHFFFAOYSA-N -1 3 350.378 3.755 20 0 FHADHM CC1(C(=O)Oc2ccc(Oc3ccc(-c4nn[n-]n4)cc3)cc2)CCC1 ZINC000820576953 606127366 /nfs/dbraw/zinc/12/73/66/606127366.db2.gz DIPSYNVJYROOBC-UHFFFAOYSA-N -1 3 350.378 3.755 20 0 FHADHM C[C@H]1CCc2c(sc(NC(=O)[C@@H]3CC34CCCC4)c2-c2nnn[n-]2)C1 ZINC000820727459 606145621 /nfs/dbraw/zinc/14/56/21/606145621.db2.gz MBVZUXKBDDKYFS-JQWIXIFHSA-N -1 3 357.483 3.572 20 0 FHADHM C[C@H]1CCc2c(sc(NC(=O)[C@@H]3CC34CCCC4)c2-c2nn[n-]n2)C1 ZINC000820727459 606145622 /nfs/dbraw/zinc/14/56/22/606145622.db2.gz MBVZUXKBDDKYFS-JQWIXIFHSA-N -1 3 357.483 3.572 20 0 FHADHM C[C@@H]1c2ccccc2CN1C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000820827555 606154382 /nfs/dbraw/zinc/15/43/82/606154382.db2.gz UAPGTHBMGLETJQ-GFCCVEGCSA-N -1 3 365.441 3.532 20 0 FHADHM C[C@@H]1c2ccccc2CN1C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000820827555 606154383 /nfs/dbraw/zinc/15/43/83/606154383.db2.gz UAPGTHBMGLETJQ-GFCCVEGCSA-N -1 3 365.441 3.532 20 0 FHADHM CCN(Cc1csc([C@@H](C)OC)n1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821230561 606158404 /nfs/dbraw/zinc/15/84/04/606158404.db2.gz NICVCNWCDASRAX-QWHCGFSZSA-N -1 3 372.498 3.614 20 0 FHADHM CCN(Cc1csc([C@@H](C)OC)n1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821230561 606158405 /nfs/dbraw/zinc/15/84/05/606158405.db2.gz NICVCNWCDASRAX-QWHCGFSZSA-N -1 3 372.498 3.614 20 0 FHADHM COCc1ccc(CNc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)cc1 ZINC000821695387 606174182 /nfs/dbraw/zinc/17/41/82/606174182.db2.gz WRFSOXSISVFOKM-UHFFFAOYSA-N -1 3 363.343 3.644 20 0 FHADHM COCc1ccc(CNc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)cc1 ZINC000821695387 606174184 /nfs/dbraw/zinc/17/41/84/606174184.db2.gz WRFSOXSISVFOKM-UHFFFAOYSA-N -1 3 363.343 3.644 20 0 FHADHM O=[S@](Cc1ccc(-c2nnn[n-]2)cc1)Cc1cc(Cl)ccc1Cl ZINC000823606823 606181455 /nfs/dbraw/zinc/18/14/55/606181455.db2.gz NTSXZBFFMGWFMZ-HSZRJFAPSA-N -1 3 367.261 3.622 20 0 FHADHM O=[S@](Cc1ccc(-c2nn[n-]n2)cc1)Cc1cc(Cl)ccc1Cl ZINC000823606823 606181456 /nfs/dbraw/zinc/18/14/56/606181456.db2.gz NTSXZBFFMGWFMZ-HSZRJFAPSA-N -1 3 367.261 3.622 20 0 FHADHM CN(C(=O)c1sccc1-c1nnn[n-]1)C1c2ccccc2-c2ccccc21 ZINC000821574381 606183613 /nfs/dbraw/zinc/18/36/13/606183613.db2.gz DPWIEXPOZVOIAV-UHFFFAOYSA-N -1 3 373.441 3.770 20 0 FHADHM CN(C(=O)c1sccc1-c1nn[n-]n1)C1c2ccccc2-c2ccccc21 ZINC000821574381 606183614 /nfs/dbraw/zinc/18/36/14/606183614.db2.gz DPWIEXPOZVOIAV-UHFFFAOYSA-N -1 3 373.441 3.770 20 0 FHADHM C[C@@H](NC(=O)c1ccc(OC(C)(C)C)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000820395990 606185628 /nfs/dbraw/zinc/18/56/28/606185628.db2.gz BBASMPLFOGXTLW-CYBMUJFWSA-N -1 3 365.437 3.535 20 0 FHADHM C[C@@H](NC(=O)c1ccc(OC(C)(C)C)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000820395990 606185629 /nfs/dbraw/zinc/18/56/29/606185629.db2.gz BBASMPLFOGXTLW-CYBMUJFWSA-N -1 3 365.437 3.535 20 0 FHADHM Oc1ccc(C2CCN(c3ccc(-c4nnn[n-]4)c(Cl)c3)CC2)cc1 ZINC000823726896 606214061 /nfs/dbraw/zinc/21/40/61/606214061.db2.gz HYSHGAZACDZYDD-UHFFFAOYSA-N -1 3 355.829 3.610 20 0 FHADHM Oc1ccc(C2CCN(c3ccc(-c4nn[n-]n4)c(Cl)c3)CC2)cc1 ZINC000823726896 606214063 /nfs/dbraw/zinc/21/40/63/606214063.db2.gz HYSHGAZACDZYDD-UHFFFAOYSA-N -1 3 355.829 3.610 20 0 FHADHM Fc1ccc(OC2CCN(c3ccc(-c4nnn[n-]4)c(Cl)c3)CC2)cc1 ZINC000822783066 606220436 /nfs/dbraw/zinc/22/04/36/606220436.db2.gz SZLUMZSFPDDHKU-UHFFFAOYSA-N -1 3 373.819 3.707 20 0 FHADHM Fc1ccc(OC2CCN(c3ccc(-c4nn[n-]n4)c(Cl)c3)CC2)cc1 ZINC000822783066 606220438 /nfs/dbraw/zinc/22/04/38/606220438.db2.gz SZLUMZSFPDDHKU-UHFFFAOYSA-N -1 3 373.819 3.707 20 0 FHADHM O=C(Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1)[C@@H]1C[C@H]1C1CC1 ZINC000823383804 606231496 /nfs/dbraw/zinc/23/14/96/606231496.db2.gz ZZHJIGXTTTWXRA-QWHCGFSZSA-N -1 3 351.435 3.580 20 0 FHADHM O=C(Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1)[C@@H]1C[C@H]1C1CC1 ZINC000823383804 606231498 /nfs/dbraw/zinc/23/14/98/606231498.db2.gz ZZHJIGXTTTWXRA-QWHCGFSZSA-N -1 3 351.435 3.580 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)C=C(C)c2cccc(OC)c2)s1 ZINC000821465747 606233916 /nfs/dbraw/zinc/23/39/16/606233916.db2.gz NSBLRDHVKCGHSM-FLIBITNWSA-N -1 3 369.450 3.541 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)C=C(C)c2cccc(OC)c2)s1 ZINC000821465747 606233918 /nfs/dbraw/zinc/23/39/18/606233918.db2.gz NSBLRDHVKCGHSM-FLIBITNWSA-N -1 3 369.450 3.541 20 0 FHADHM O=C(Nc1ccc(Oc2ccccc2-c2nnn[n-]2)cc1)[C@@H]1C[C@@H]1C1CC1 ZINC000823357656 606236634 /nfs/dbraw/zinc/23/66/34/606236634.db2.gz XDWHQLHNVUIIMA-IAGOWNOFSA-N -1 3 361.405 3.644 20 0 FHADHM O=C(Nc1ccc(Oc2ccccc2-c2nn[n-]n2)cc1)[C@@H]1C[C@@H]1C1CC1 ZINC000823357656 606236635 /nfs/dbraw/zinc/23/66/35/606236635.db2.gz XDWHQLHNVUIIMA-IAGOWNOFSA-N -1 3 361.405 3.644 20 0 FHADHM CCc1ccc([C@H](C)CC(=O)Nc2ccc(F)cc2-c2nnn[n-]2)cc1 ZINC000821476119 606263161 /nfs/dbraw/zinc/26/31/61/606263161.db2.gz ILQCJUMSACNONK-GFCCVEGCSA-N -1 3 353.401 3.701 20 0 FHADHM CCc1ccc([C@H](C)CC(=O)Nc2ccc(F)cc2-c2nn[n-]n2)cc1 ZINC000821476119 606263163 /nfs/dbraw/zinc/26/31/63/606263163.db2.gz ILQCJUMSACNONK-GFCCVEGCSA-N -1 3 353.401 3.701 20 0 FHADHM Cc1ccc(CCC(=O)Nc2ccc(F)cc2-c2nnn[n-]2)cc1Cl ZINC000822234578 606272703 /nfs/dbraw/zinc/27/27/03/606272703.db2.gz AIVMQWFJAANEBV-UHFFFAOYSA-N -1 3 359.792 3.539 20 0 FHADHM Cc1ccc(CCC(=O)Nc2ccc(F)cc2-c2nn[n-]n2)cc1Cl ZINC000822234578 606272704 /nfs/dbraw/zinc/27/27/04/606272704.db2.gz AIVMQWFJAANEBV-UHFFFAOYSA-N -1 3 359.792 3.539 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@H](C)Cc1ccccc1 ZINC000821118554 606282715 /nfs/dbraw/zinc/28/27/15/606282715.db2.gz OWONSPCLXQFYGT-CQSZACIVSA-N -1 3 364.453 3.506 20 0 FHADHM C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC000820555304 606287419 /nfs/dbraw/zinc/28/74/19/606287419.db2.gz IRMJSZINTBAJBV-CQSZACIVSA-N -1 3 372.432 3.695 20 0 FHADHM C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC000820555304 606287420 /nfs/dbraw/zinc/28/74/20/606287420.db2.gz IRMJSZINTBAJBV-CQSZACIVSA-N -1 3 372.432 3.695 20 0 FHADHM CCCCc1ccc(N[C@@H](C(=O)OC)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000821077684 606299622 /nfs/dbraw/zinc/29/96/22/606299622.db2.gz QAGISKSHEBDQOQ-GOSISDBHSA-N -1 3 365.437 3.536 20 0 FHADHM CCCCc1ccc(N[C@@H](C(=O)OC)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000821077684 606299623 /nfs/dbraw/zinc/29/96/23/606299623.db2.gz QAGISKSHEBDQOQ-GOSISDBHSA-N -1 3 365.437 3.536 20 0 FHADHM Cc1ccc(NC(=O)[C@@H](C)Sc2cccc(-c3nnn[n-]3)c2)c(C)c1 ZINC000822242801 606324723 /nfs/dbraw/zinc/32/47/23/606324723.db2.gz YCRVONBBGWINED-CYBMUJFWSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1ccc(NC(=O)[C@@H](C)Sc2cccc(-c3nn[n-]n3)c2)c(C)c1 ZINC000822242801 606324724 /nfs/dbraw/zinc/32/47/24/606324724.db2.gz YCRVONBBGWINED-CYBMUJFWSA-N -1 3 353.451 3.603 20 0 FHADHM C[C@H](Sc1cccc(-c2nnn[n-]2)c1)c1nc(-c2cccs2)no1 ZINC000820554918 606325000 /nfs/dbraw/zinc/32/50/00/606325000.db2.gz BMXXNLBIZABKJY-VIFPVBQESA-N -1 3 356.436 3.832 20 0 FHADHM C[C@H](Sc1cccc(-c2nn[n-]n2)c1)c1nc(-c2cccs2)no1 ZINC000820554918 606325002 /nfs/dbraw/zinc/32/50/02/606325002.db2.gz BMXXNLBIZABKJY-VIFPVBQESA-N -1 3 356.436 3.832 20 0 FHADHM C[C@@H](Sc1cccc(-c2nnn[n-]2)c1)C(=O)Nc1ccccc1Cl ZINC000820554900 606326716 /nfs/dbraw/zinc/32/67/16/606326716.db2.gz AYQAVONQVQWZII-SNVBAGLBSA-N -1 3 359.842 3.639 20 0 FHADHM C[C@@H](Sc1cccc(-c2nn[n-]n2)c1)C(=O)Nc1ccccc1Cl ZINC000820554900 606326719 /nfs/dbraw/zinc/32/67/19/606326719.db2.gz AYQAVONQVQWZII-SNVBAGLBSA-N -1 3 359.842 3.639 20 0 FHADHM CCc1cccc(CC)c1NC(=O)CSc1cccc(-c2nnn[n-]2)c1 ZINC000821492698 606327465 /nfs/dbraw/zinc/32/74/65/606327465.db2.gz TWBRPWXLJGNSNF-UHFFFAOYSA-N -1 3 367.478 3.722 20 0 FHADHM CCc1cccc(CC)c1NC(=O)CSc1cccc(-c2nn[n-]n2)c1 ZINC000821492698 606327467 /nfs/dbraw/zinc/32/74/67/606327467.db2.gz TWBRPWXLJGNSNF-UHFFFAOYSA-N -1 3 367.478 3.722 20 0 FHADHM Cc1sc(NC(=O)Cc2coc3cc(F)ccc23)c(-c2nnn[n-]2)c1C ZINC000822563682 606336306 /nfs/dbraw/zinc/33/63/06/606336306.db2.gz LXAWWUMEKNGEIT-UHFFFAOYSA-N -1 3 371.397 3.612 20 0 FHADHM Cc1sc(NC(=O)Cc2coc3cc(F)ccc23)c(-c2nn[n-]n2)c1C ZINC000822563682 606336308 /nfs/dbraw/zinc/33/63/08/606336308.db2.gz LXAWWUMEKNGEIT-UHFFFAOYSA-N -1 3 371.397 3.612 20 0 FHADHM C[C@H](OC(=O)C(C)(C)c1ccc(F)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820479710 606339670 /nfs/dbraw/zinc/33/96/70/606339670.db2.gz BDXAZJYMXMEZBY-LBPRGKRZSA-N -1 3 354.385 3.588 20 0 FHADHM C[C@H](OC(=O)C(C)(C)c1ccc(F)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820479710 606339672 /nfs/dbraw/zinc/33/96/72/606339672.db2.gz BDXAZJYMXMEZBY-LBPRGKRZSA-N -1 3 354.385 3.588 20 0 FHADHM C[C@H](OC(=O)[C@@H]1SCCc2sccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488840 606340210 /nfs/dbraw/zinc/34/02/10/606340210.db2.gz VIKGGWXHABYOOF-ZUZCIYMTSA-N -1 3 372.475 3.563 20 0 FHADHM C[C@H](OC(=O)[C@@H]1SCCc2sccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488840 606340211 /nfs/dbraw/zinc/34/02/11/606340211.db2.gz VIKGGWXHABYOOF-ZUZCIYMTSA-N -1 3 372.475 3.563 20 0 FHADHM C[C@H](OC(=O)Cc1c(F)cccc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000820497706 606340225 /nfs/dbraw/zinc/34/02/25/606340225.db2.gz UTKWIWLUDDDBHS-JTQLQIEISA-N -1 3 360.776 3.506 20 0 FHADHM C[C@H](OC(=O)Cc1c(F)cccc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000820497706 606340226 /nfs/dbraw/zinc/34/02/26/606340226.db2.gz UTKWIWLUDDDBHS-JTQLQIEISA-N -1 3 360.776 3.506 20 0 FHADHM CC(C)Oc1cccc(CC(=O)O[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000820177837 606341667 /nfs/dbraw/zinc/34/16/67/606341667.db2.gz BHWOWMFDAUNYMX-CQSZACIVSA-N -1 3 366.421 3.501 20 0 FHADHM CC(C)Oc1cccc(CC(=O)O[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000820177837 606341669 /nfs/dbraw/zinc/34/16/69/606341669.db2.gz BHWOWMFDAUNYMX-CQSZACIVSA-N -1 3 366.421 3.501 20 0 FHADHM Cc1ccccc1[C@@H](NC(=O)Nc1ccc(F)cc1-c1nnn[n-]1)C1CC1 ZINC000822350332 606347911 /nfs/dbraw/zinc/34/79/11/606347911.db2.gz CDDTUMQXRYZSQF-KRWDZBQOSA-N -1 3 366.400 3.587 20 0 FHADHM Cc1ccccc1[C@@H](NC(=O)Nc1ccc(F)cc1-c1nn[n-]n1)C1CC1 ZINC000822350332 606347912 /nfs/dbraw/zinc/34/79/12/606347912.db2.gz CDDTUMQXRYZSQF-KRWDZBQOSA-N -1 3 366.400 3.587 20 0 FHADHM Cc1c(Cl)cccc1OCC(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000822035493 606348308 /nfs/dbraw/zinc/34/83/08/606348308.db2.gz VTAUMKAOCGWMLR-GFCCVEGCSA-N -1 3 372.812 3.512 20 0 FHADHM Cc1c(Cl)cccc1OCC(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000822035493 606348310 /nfs/dbraw/zinc/34/83/10/606348310.db2.gz VTAUMKAOCGWMLR-GFCCVEGCSA-N -1 3 372.812 3.512 20 0 FHADHM Cc1cccc(OCCCC(=O)O[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000822327216 606358639 /nfs/dbraw/zinc/35/86/39/606358639.db2.gz CZNZKJGCQIKOIZ-OAHLLOKOSA-N -1 3 366.421 3.639 20 0 FHADHM Cc1cccc(OCCCC(=O)O[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000822327216 606358641 /nfs/dbraw/zinc/35/86/41/606358641.db2.gz CZNZKJGCQIKOIZ-OAHLLOKOSA-N -1 3 366.421 3.639 20 0 FHADHM Cc1c(C(=O)Nc2ccc(Cl)c(-c3nnn[n-]3)c2)cnc2ccccc12 ZINC000822021372 606361316 /nfs/dbraw/zinc/36/13/16/606361316.db2.gz YQYRVBYMXFQWHE-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1c(C(=O)Nc2ccc(Cl)c(-c3nn[n-]n3)c2)cnc2ccccc12 ZINC000822021372 606361318 /nfs/dbraw/zinc/36/13/18/606361318.db2.gz YQYRVBYMXFQWHE-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM CC[C@@H](Oc1ccccc1Cl)C(=O)Nc1cc(-c2nnn[n-]2)ccc1C ZINC000820938457 606362594 /nfs/dbraw/zinc/36/25/94/606362594.db2.gz JBWPHVALTXIATI-OAHLLOKOSA-N -1 3 371.828 3.625 20 0 FHADHM CC[C@@H](Oc1ccccc1Cl)C(=O)Nc1cc(-c2nn[n-]n2)ccc1C ZINC000820938457 606362596 /nfs/dbraw/zinc/36/25/96/606362596.db2.gz JBWPHVALTXIATI-OAHLLOKOSA-N -1 3 371.828 3.625 20 0 FHADHM CC[C@H](C)CN(CC)C(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(C)C ZINC000820870418 606382271 /nfs/dbraw/zinc/38/22/71/606382271.db2.gz SEZOTGKZKOYFCG-ZDUSSCGKSA-N -1 3 360.462 3.554 20 0 FHADHM CC[C@H](C)CN(CC)C(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(C)C ZINC000820870418 606382272 /nfs/dbraw/zinc/38/22/72/606382272.db2.gz SEZOTGKZKOYFCG-ZDUSSCGKSA-N -1 3 360.462 3.554 20 0 FHADHM C[C@@H](OC(=O)CCn1ccc2ccccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000820496110 606397657 /nfs/dbraw/zinc/39/76/57/606397657.db2.gz LPFINBYHJOUWRE-CQSZACIVSA-N -1 3 361.405 3.516 20 0 FHADHM C[C@@H](OC(=O)CCn1ccc2ccccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000820496110 606397659 /nfs/dbraw/zinc/39/76/59/606397659.db2.gz LPFINBYHJOUWRE-CQSZACIVSA-N -1 3 361.405 3.516 20 0 FHADHM CC(C)COC(=O)Nc1cccc(NCc2ccc(-c3nnn[n-]3)s2)c1 ZINC000820098392 606412036 /nfs/dbraw/zinc/41/20/36/606412036.db2.gz XUNKCGYJIKKHQM-UHFFFAOYSA-N -1 3 372.454 3.745 20 0 FHADHM CN(C(=O)CCSc1ccccc1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821569770 606414092 /nfs/dbraw/zinc/41/40/92/606414092.db2.gz VHCYIXJFSMHKRO-UHFFFAOYSA-N -1 3 373.869 3.665 20 0 FHADHM CN(C(=O)CCSc1ccccc1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821569770 606414096 /nfs/dbraw/zinc/41/40/96/606414096.db2.gz VHCYIXJFSMHKRO-UHFFFAOYSA-N -1 3 373.869 3.665 20 0 FHADHM Fc1ccc([C@H]2CCCN2c2cc(-c3nnn[n-]3)c3ccccc3n2)cc1 ZINC000822766980 606447276 /nfs/dbraw/zinc/44/72/76/606447276.db2.gz RIPYCJGNBPIGEO-GOSISDBHSA-N -1 3 360.396 3.896 20 0 FHADHM Fc1ccc([C@H]2CCCN2c2cc(-c3nn[n-]n3)c3ccccc3n2)cc1 ZINC000822766980 606447277 /nfs/dbraw/zinc/44/72/77/606447277.db2.gz RIPYCJGNBPIGEO-GOSISDBHSA-N -1 3 360.396 3.896 20 0 FHADHM C[C@@H](Nc1c(F)cc(-c2nnn[n-]2)cc1F)c1ccc(OC(F)F)cc1 ZINC000820449689 606448014 /nfs/dbraw/zinc/44/80/14/606448014.db2.gz APPPNBKZGPVJOH-MRVPVSSYSA-N -1 3 367.306 3.919 20 0 FHADHM C[C@@H](Nc1c(F)cc(-c2nn[n-]n2)cc1F)c1ccc(OC(F)F)cc1 ZINC000820449689 606448016 /nfs/dbraw/zinc/44/80/16/606448016.db2.gz APPPNBKZGPVJOH-MRVPVSSYSA-N -1 3 367.306 3.919 20 0 FHADHM Cc1ccc(NC(=O)C(C)C)cc1NCc1cc(-c2nnn[n-]2)ccc1F ZINC000822242314 606448935 /nfs/dbraw/zinc/44/89/35/606448935.db2.gz HVWALXRFTIMTQA-UHFFFAOYSA-N -1 3 368.416 3.521 20 0 FHADHM Cc1ccc(NC(=O)C(C)C)cc1NCc1cc(-c2nn[n-]n2)ccc1F ZINC000822242314 606448937 /nfs/dbraw/zinc/44/89/37/606448937.db2.gz HVWALXRFTIMTQA-UHFFFAOYSA-N -1 3 368.416 3.521 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1N1CCC[C@H](c2nc3ccccc3o2)C1 ZINC000822743956 606452824 /nfs/dbraw/zinc/45/28/24/606452824.db2.gz IWCZTRWGBSCUHM-ZDUSSCGKSA-N -1 3 364.384 3.531 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)cc1CNc1cc(C(F)(F)F)ccc1F ZINC000822761341 606457520 /nfs/dbraw/zinc/45/75/20/606457520.db2.gz JETUMKUBKMUSJV-UHFFFAOYSA-N -1 3 355.270 3.776 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CNc1cc(C(F)(F)F)ccc1F ZINC000822761341 606457521 /nfs/dbraw/zinc/45/75/21/606457521.db2.gz JETUMKUBKMUSJV-UHFFFAOYSA-N -1 3 355.270 3.776 20 0 FHADHM CC[C@H](OC(=O)c1cc(-c2nnn[n-]2)cs1)c1ccc(F)cc1F ZINC000820938451 606466889 /nfs/dbraw/zinc/46/68/89/606466889.db2.gz JAADJAYKYCJRHO-LBPRGKRZSA-N -1 3 350.350 3.515 20 0 FHADHM CC[C@H](OC(=O)c1cc(-c2nn[n-]n2)cs1)c1ccc(F)cc1F ZINC000820938451 606466890 /nfs/dbraw/zinc/46/68/90/606466890.db2.gz JAADJAYKYCJRHO-LBPRGKRZSA-N -1 3 350.350 3.515 20 0 FHADHM CCOc1cccc([C@@H](CC)OC(=O)c2cc(-c3nnn[n-]3)cs2)c1 ZINC000821427257 606470265 /nfs/dbraw/zinc/47/02/65/606470265.db2.gz PWAYHVKZGREDBO-CQSZACIVSA-N -1 3 358.423 3.635 20 0 FHADHM CCOc1cccc([C@@H](CC)OC(=O)c2cc(-c3nn[n-]n3)cs2)c1 ZINC000821427257 606470266 /nfs/dbraw/zinc/47/02/66/606470266.db2.gz PWAYHVKZGREDBO-CQSZACIVSA-N -1 3 358.423 3.635 20 0 FHADHM O=C(Nc1ccccc1Cc1ccccc1)c1cc(-c2nnn[n-]2)cs1 ZINC000823373181 606477579 /nfs/dbraw/zinc/47/75/79/606477579.db2.gz SJOIBCDTBKEZAZ-UHFFFAOYSA-N -1 3 361.430 3.771 20 0 FHADHM O=C(Nc1ccccc1Cc1ccccc1)c1cc(-c2nn[n-]n2)cs1 ZINC000823373181 606477581 /nfs/dbraw/zinc/47/75/81/606477581.db2.gz SJOIBCDTBKEZAZ-UHFFFAOYSA-N -1 3 361.430 3.771 20 0 FHADHM O=C(Nc1cccc(Oc2ccccc2)c1)c1cc(-c2nnn[n-]2)cs1 ZINC000823368333 606477637 /nfs/dbraw/zinc/47/76/37/606477637.db2.gz UVAFQHHRHWFGTI-UHFFFAOYSA-N -1 3 363.402 3.973 20 0 FHADHM O=C(Nc1cccc(Oc2ccccc2)c1)c1cc(-c2nn[n-]n2)cs1 ZINC000823368333 606477639 /nfs/dbraw/zinc/47/76/39/606477639.db2.gz UVAFQHHRHWFGTI-UHFFFAOYSA-N -1 3 363.402 3.973 20 0 FHADHM CCc1ccc(Cl)c(CC)c1NC(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000821486705 606478081 /nfs/dbraw/zinc/47/80/81/606478081.db2.gz KHUWSPYRUQCYCS-UHFFFAOYSA-N -1 3 361.858 3.959 20 0 FHADHM CCc1ccc(Cl)c(CC)c1NC(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000821486705 606478083 /nfs/dbraw/zinc/47/80/83/606478083.db2.gz KHUWSPYRUQCYCS-UHFFFAOYSA-N -1 3 361.858 3.959 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)N(C1CC1)C1CCCCC1 ZINC000819976167 606485269 /nfs/dbraw/zinc/48/52/69/606485269.db2.gz PBOXXRCWKSFGGJ-UHFFFAOYSA-N -1 3 371.489 3.752 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)N(C1CC1)C1CCCCC1 ZINC000819976167 606485271 /nfs/dbraw/zinc/48/52/71/606485271.db2.gz PBOXXRCWKSFGGJ-UHFFFAOYSA-N -1 3 371.489 3.752 20 0 FHADHM CC(C)[C@@H](NC(=O)Cc1cccc(-c2nnn[n-]2)c1)c1ccc(Cl)cc1 ZINC000820027033 606499466 /nfs/dbraw/zinc/49/94/66/606499466.db2.gz PSBJJWCZLNSVFZ-GOSISDBHSA-N -1 3 369.856 3.576 20 0 FHADHM CC(C)[C@@H](NC(=O)Cc1cccc(-c2nn[n-]n2)c1)c1ccc(Cl)cc1 ZINC000820027033 606499467 /nfs/dbraw/zinc/49/94/67/606499467.db2.gz PSBJJWCZLNSVFZ-GOSISDBHSA-N -1 3 369.856 3.576 20 0 FHADHM Cc1ccc([C@@H]2CCCN2C(=O)c2cc(-c3nnn[n-]3)cs2)cc1C ZINC000822233024 606499655 /nfs/dbraw/zinc/49/96/55/606499655.db2.gz GLMLEHYUFXXGEF-HNNXBMFYSA-N -1 3 353.451 3.522 20 0 FHADHM Cc1ccc([C@@H]2CCCN2C(=O)c2cc(-c3nn[n-]n3)cs2)cc1C ZINC000822233024 606499657 /nfs/dbraw/zinc/49/96/57/606499657.db2.gz GLMLEHYUFXXGEF-HNNXBMFYSA-N -1 3 353.451 3.522 20 0 FHADHM O=C(c1cc(-c2nnn[n-]2)cs1)N(Cc1ccsc1)c1ccccc1 ZINC000823467258 606503369 /nfs/dbraw/zinc/50/33/69/606503369.db2.gz STBJWFMQYYZTNE-UHFFFAOYSA-N -1 3 367.459 3.837 20 0 FHADHM O=C(c1cc(-c2nn[n-]n2)cs1)N(Cc1ccsc1)c1ccccc1 ZINC000823467258 606503371 /nfs/dbraw/zinc/50/33/71/606503371.db2.gz STBJWFMQYYZTNE-UHFFFAOYSA-N -1 3 367.459 3.837 20 0 FHADHM CCCCN(C(=O)Cc1cccc(-c2nnn[n-]2)c1)[C@H](C)c1ccc(C)o1 ZINC000821061507 606506646 /nfs/dbraw/zinc/50/66/46/606506646.db2.gz ORRXUBZERMDBKD-OAHLLOKOSA-N -1 3 367.453 3.701 20 0 FHADHM CCCCN(C(=O)Cc1cccc(-c2nn[n-]n2)c1)[C@H](C)c1ccc(C)o1 ZINC000821061507 606506647 /nfs/dbraw/zinc/50/66/47/606506647.db2.gz ORRXUBZERMDBKD-OAHLLOKOSA-N -1 3 367.453 3.701 20 0 FHADHM O=C(Nc1ccc(Cl)cc1-n1cccc1)c1cc(-c2nnn[n-]2)cs1 ZINC000823332922 606508449 /nfs/dbraw/zinc/50/84/49/606508449.db2.gz TWARAHJLFOWWGO-UHFFFAOYSA-N -1 3 370.825 3.625 20 0 FHADHM O=C(Nc1ccc(Cl)cc1-n1cccc1)c1cc(-c2nn[n-]n2)cs1 ZINC000823332922 606508451 /nfs/dbraw/zinc/50/84/51/606508451.db2.gz TWARAHJLFOWWGO-UHFFFAOYSA-N -1 3 370.825 3.625 20 0 FHADHM CC(C)[C@H](NC(=O)c1cc(-c2nnn[n-]2)cs1)c1ccccc1Cl ZINC000820027877 606512068 /nfs/dbraw/zinc/51/20/68/606512068.db2.gz VCSHGMCTFQZCIO-AWEZNQCLSA-N -1 3 361.858 3.709 20 0 FHADHM CC(C)[C@H](NC(=O)c1cc(-c2nn[n-]n2)cs1)c1ccccc1Cl ZINC000820027877 606512069 /nfs/dbraw/zinc/51/20/69/606512069.db2.gz VCSHGMCTFQZCIO-AWEZNQCLSA-N -1 3 361.858 3.709 20 0 FHADHM Cc1ccc([C@H]2CCC[C@@H]2N(C)C(=O)c2cc(-c3nnn[n-]3)cs2)cc1 ZINC000822232942 606519597 /nfs/dbraw/zinc/51/95/97/606519597.db2.gz FDQNKUKHWREQDW-CVEARBPZSA-N -1 3 367.478 3.645 20 0 FHADHM Cc1ccc([C@H]2CCC[C@@H]2N(C)C(=O)c2cc(-c3nn[n-]n3)cs2)cc1 ZINC000822232942 606519599 /nfs/dbraw/zinc/51/95/99/606519599.db2.gz FDQNKUKHWREQDW-CVEARBPZSA-N -1 3 367.478 3.645 20 0 FHADHM O=C(CCc1ccc(-c2nnn[n-]2)cc1)N(CC1CCC1)c1ccccc1 ZINC000822974299 606549826 /nfs/dbraw/zinc/54/98/26/606549826.db2.gz GHKCANKICVFTSO-UHFFFAOYSA-N -1 3 361.449 3.633 20 0 FHADHM O=C(CCc1ccc(-c2nn[n-]n2)cc1)N(CC1CCC1)c1ccccc1 ZINC000822974299 606549827 /nfs/dbraw/zinc/54/98/27/606549827.db2.gz GHKCANKICVFTSO-UHFFFAOYSA-N -1 3 361.449 3.633 20 0 FHADHM COc1ccc(SCc2ccc(-c3nnn[n-]3)cc2OC(F)F)cc1 ZINC000821846584 606589366 /nfs/dbraw/zinc/58/93/66/606589366.db2.gz UYRZUULNYJZCLA-UHFFFAOYSA-N -1 3 364.377 3.769 20 0 FHADHM COc1ccc(SCc2ccc(-c3nn[n-]n3)cc2OC(F)F)cc1 ZINC000821846584 606589368 /nfs/dbraw/zinc/58/93/68/606589368.db2.gz UYRZUULNYJZCLA-UHFFFAOYSA-N -1 3 364.377 3.769 20 0 FHADHM Fc1ccc(Cl)cc1NCc1ccc(-c2nnn[n-]2)cc1OC(F)F ZINC000822774293 606597857 /nfs/dbraw/zinc/59/78/57/606597857.db2.gz JDSIMLMFEKQUHU-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM Fc1ccc(Cl)cc1NCc1ccc(-c2nn[n-]n2)cc1OC(F)F ZINC000822774293 606597859 /nfs/dbraw/zinc/59/78/59/606597859.db2.gz JDSIMLMFEKQUHU-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)ccc1OCc1ccc(C(F)(F)F)cc1 ZINC000821394077 606600180 /nfs/dbraw/zinc/60/01/80/606600180.db2.gz FUOLDYPXLOWFHS-UHFFFAOYSA-N -1 3 364.327 3.863 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)ccc1OCc1ccc(C(F)(F)F)cc1 ZINC000821394077 606600181 /nfs/dbraw/zinc/60/01/81/606600181.db2.gz FUOLDYPXLOWFHS-UHFFFAOYSA-N -1 3 364.327 3.863 20 0 FHADHM C[C@H](C(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1)c1ccc2ccccc2c1 ZINC000819856307 606601781 /nfs/dbraw/zinc/60/17/81/606601781.db2.gz HPAKQDNTOWTRRH-HNNXBMFYSA-N -1 3 371.444 3.782 20 0 FHADHM C[C@H](C(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1)c1ccc2ccccc2c1 ZINC000819856307 606601782 /nfs/dbraw/zinc/60/17/82/606601782.db2.gz HPAKQDNTOWTRRH-HNNXBMFYSA-N -1 3 371.444 3.782 20 0 FHADHM Cc1cc(CCCC(=O)N(C)Cc2ccc(-c3nnn[n-]3)cc2)c(C)s1 ZINC000822199794 606602531 /nfs/dbraw/zinc/60/25/31/606602531.db2.gz IDAIBWJQUFIIIP-UHFFFAOYSA-N -1 3 369.494 3.526 20 0 FHADHM Cc1cc(CCCC(=O)N(C)Cc2ccc(-c3nn[n-]n3)cc2)c(C)s1 ZINC000822199794 606602532 /nfs/dbraw/zinc/60/25/32/606602532.db2.gz IDAIBWJQUFIIIP-UHFFFAOYSA-N -1 3 369.494 3.526 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1COc1ccc(Oc2nccs2)cc1 ZINC000822744383 606616990 /nfs/dbraw/zinc/61/69/90/606616990.db2.gz RFTJXFNFNGZMCD-UHFFFAOYSA-N -1 3 369.381 3.834 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1COc1ccc(Oc2nccs2)cc1 ZINC000822744383 606616991 /nfs/dbraw/zinc/61/69/91/606616991.db2.gz RFTJXFNFNGZMCD-UHFFFAOYSA-N -1 3 369.381 3.834 20 0 FHADHM Cc1ccc(/C=C/CC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)cc1 ZINC000822233904 606619440 /nfs/dbraw/zinc/61/94/40/606619440.db2.gz XMZBCBIUPHCRHZ-NSCUHMNNSA-N -1 3 373.460 3.770 20 0 FHADHM Cc1ccc(/C=C/CC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)cc1 ZINC000822233904 606619441 /nfs/dbraw/zinc/61/94/41/606619441.db2.gz XMZBCBIUPHCRHZ-NSCUHMNNSA-N -1 3 373.460 3.770 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1)C1CC(F)(F)C1 ZINC000823350495 606621168 /nfs/dbraw/zinc/62/11/68/606621168.db2.gz PIFVGZOUDWYMLL-UHFFFAOYSA-N -1 3 371.347 3.643 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1)C1CC(F)(F)C1 ZINC000823350495 606621169 /nfs/dbraw/zinc/62/11/69/606621169.db2.gz PIFVGZOUDWYMLL-UHFFFAOYSA-N -1 3 371.347 3.643 20 0 FHADHM CC(=CC(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1)c1cccc(Cl)c1 ZINC000819766129 606626165 /nfs/dbraw/zinc/62/61/65/606626165.db2.gz VNFPCTWWXYNFGZ-LCYFTJDESA-N -1 3 367.840 3.582 20 0 FHADHM CC(=CC(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1)c1cccc(Cl)c1 ZINC000819766129 606626168 /nfs/dbraw/zinc/62/61/68/606626168.db2.gz VNFPCTWWXYNFGZ-LCYFTJDESA-N -1 3 367.840 3.582 20 0 FHADHM CCc1ccc(C(C)(C)C(=O)N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000821475810 606626572 /nfs/dbraw/zinc/62/65/72/606626572.db2.gz ABIHFAXUAFVXBB-CQSZACIVSA-N -1 3 363.465 3.584 20 0 FHADHM CCc1ccc(C(C)(C)C(=O)N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000821475810 606626574 /nfs/dbraw/zinc/62/65/74/606626574.db2.gz ABIHFAXUAFVXBB-CQSZACIVSA-N -1 3 363.465 3.584 20 0 FHADHM O=C(Nc1cccc(NC2CCCC2)c1)Nc1cccc(-c2nnn[n-]2)c1 ZINC000823367996 606632272 /nfs/dbraw/zinc/63/22/72/606632272.db2.gz QLGRVNNAEGVUMS-UHFFFAOYSA-N -1 3 363.425 3.865 20 0 FHADHM O=C(Nc1cccc(NC2CCCC2)c1)Nc1cccc(-c2nn[n-]n2)c1 ZINC000823367996 606632274 /nfs/dbraw/zinc/63/22/74/606632274.db2.gz QLGRVNNAEGVUMS-UHFFFAOYSA-N -1 3 363.425 3.865 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N(CCC(C)C)C1CCCC1 ZINC000822217529 606657252 /nfs/dbraw/zinc/65/72/52/606657252.db2.gz HBSADBPILGPUHF-UHFFFAOYSA-N -1 3 356.474 3.998 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N(CCC(C)C)C1CCCC1 ZINC000822217529 606657253 /nfs/dbraw/zinc/65/72/53/606657253.db2.gz HBSADBPILGPUHF-UHFFFAOYSA-N -1 3 356.474 3.998 20 0 FHADHM COCC[C@@H](C)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)cc1C ZINC000821685365 606661401 /nfs/dbraw/zinc/66/14/01/606661401.db2.gz AVMCMXUAFWDIST-OAHLLOKOSA-N -1 3 367.453 3.591 20 0 FHADHM COCC[C@@H](C)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)cc1C ZINC000821685365 606661402 /nfs/dbraw/zinc/66/14/02/606661402.db2.gz AVMCMXUAFWDIST-OAHLLOKOSA-N -1 3 367.453 3.591 20 0 FHADHM CC(C)C[C@H](NC(=O)c1c(F)cc(-c2nnn[n-]2)cc1F)c1ccccc1 ZINC000820054575 606666087 /nfs/dbraw/zinc/66/60/87/606666087.db2.gz BUHPYCOEEFDIEY-INIZCTEOSA-N -1 3 371.391 3.662 20 0 FHADHM CC(C)C[C@H](NC(=O)c1c(F)cc(-c2nn[n-]n2)cc1F)c1ccccc1 ZINC000820054575 606666088 /nfs/dbraw/zinc/66/60/88/606666088.db2.gz BUHPYCOEEFDIEY-INIZCTEOSA-N -1 3 371.391 3.662 20 0 FHADHM CC[C@@H](C)Oc1cccc(NC(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)c1 ZINC000820875524 606673291 /nfs/dbraw/zinc/67/32/91/606673291.db2.gz BUXBKWNBKGNMAE-SNVBAGLBSA-N -1 3 373.363 3.575 20 0 FHADHM CC[C@@H](C)Oc1cccc(NC(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)c1 ZINC000820875524 606673292 /nfs/dbraw/zinc/67/32/92/606673292.db2.gz BUXBKWNBKGNMAE-SNVBAGLBSA-N -1 3 373.363 3.575 20 0 FHADHM CC[C@H](C)Oc1cccc(NC(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)c1 ZINC000820875522 606673329 /nfs/dbraw/zinc/67/33/29/606673329.db2.gz BUXBKWNBKGNMAE-JTQLQIEISA-N -1 3 373.363 3.575 20 0 FHADHM CC[C@H](C)Oc1cccc(NC(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)c1 ZINC000820875522 606673330 /nfs/dbraw/zinc/67/33/30/606673330.db2.gz BUXBKWNBKGNMAE-JTQLQIEISA-N -1 3 373.363 3.575 20 0 FHADHM O=C(c1c(F)cc(-c2nnn[n-]2)cc1F)N(c1ccccc1)C1CCCC1 ZINC000823455026 606678801 /nfs/dbraw/zinc/67/88/01/606678801.db2.gz VQRMKOVFMBGEDT-UHFFFAOYSA-N -1 3 369.375 3.734 20 0 FHADHM O=C(c1c(F)cc(-c2nn[n-]n2)cc1F)N(c1ccccc1)C1CCCC1 ZINC000823455026 606678802 /nfs/dbraw/zinc/67/88/02/606678802.db2.gz VQRMKOVFMBGEDT-UHFFFAOYSA-N -1 3 369.375 3.734 20 0 FHADHM Cc1csc(CSCc2ccc(-c3nnn[n-]3)cc2OC(F)F)n1 ZINC000822414460 606695075 /nfs/dbraw/zinc/69/50/75/606695075.db2.gz GVJIMQLGVKTQIZ-UHFFFAOYSA-N -1 3 369.422 3.666 20 0 FHADHM Cc1csc(CSCc2ccc(-c3nn[n-]n3)cc2OC(F)F)n1 ZINC000822414460 606695076 /nfs/dbraw/zinc/69/50/76/606695076.db2.gz GVJIMQLGVKTQIZ-UHFFFAOYSA-N -1 3 369.422 3.666 20 0 FHADHM Cc1ccc([C@H](C)Nc2nc(C(F)(F)F)ccc2-c2nnn[n-]2)cc1F ZINC000822229136 606733326 /nfs/dbraw/zinc/73/33/26/606733326.db2.gz NSHSJCGRAOLKHI-VIFPVBQESA-N -1 3 366.322 3.901 20 0 FHADHM Cc1ccc([C@H](C)Nc2nc(C(F)(F)F)ccc2-c2nn[n-]n2)cc1F ZINC000822229136 606733328 /nfs/dbraw/zinc/73/33/28/606733328.db2.gz NSHSJCGRAOLKHI-VIFPVBQESA-N -1 3 366.322 3.901 20 0 FHADHM CC(C)Sc1ccccc1NC(=O)Cc1cccc(-c2nnn[n-]2)c1 ZINC000820183619 606744827 /nfs/dbraw/zinc/74/48/27/606744827.db2.gz HHUZHUJVPQOEPB-UHFFFAOYSA-N -1 3 353.451 3.548 20 0 FHADHM CC(C)Sc1ccccc1NC(=O)Cc1cccc(-c2nn[n-]n2)c1 ZINC000820183619 606744829 /nfs/dbraw/zinc/74/48/29/606744829.db2.gz HHUZHUJVPQOEPB-UHFFFAOYSA-N -1 3 353.451 3.548 20 0 FHADHM Cc1cc(C)c([C@@H](C)OC(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)c(C)c1 ZINC000822194175 606757540 /nfs/dbraw/zinc/75/75/40/606757540.db2.gz LRYRFLZEQWHRAR-GFCCVEGCSA-N -1 3 372.375 3.988 20 0 FHADHM Cc1cc(C)c([C@@H](C)OC(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)c(C)c1 ZINC000822194175 606757542 /nfs/dbraw/zinc/75/75/42/606757542.db2.gz LRYRFLZEQWHRAR-GFCCVEGCSA-N -1 3 372.375 3.988 20 0 FHADHM CC(C)N(C)C(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)cc1 ZINC000820112558 606769818 /nfs/dbraw/zinc/76/98/18/606769818.db2.gz YHRHMJXOHYQQLA-UHFFFAOYSA-N -1 3 352.398 3.531 20 0 FHADHM CC(C)N(C)C(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)cc1 ZINC000820112558 606769819 /nfs/dbraw/zinc/76/98/19/606769819.db2.gz YHRHMJXOHYQQLA-UHFFFAOYSA-N -1 3 352.398 3.531 20 0 FHADHM CCCCN(C)C(=O)c1ccc(Oc2ccc(-c3nnn[n-]3)cc2C)cc1 ZINC000821060336 606775984 /nfs/dbraw/zinc/77/59/84/606775984.db2.gz AVDRQRMEJJORQO-UHFFFAOYSA-N -1 3 365.437 3.840 20 0 FHADHM CCCCN(C)C(=O)c1ccc(Oc2ccc(-c3nn[n-]n3)cc2C)cc1 ZINC000821060336 606775985 /nfs/dbraw/zinc/77/59/85/606775985.db2.gz AVDRQRMEJJORQO-UHFFFAOYSA-N -1 3 365.437 3.840 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1Oc1ccc(C(=O)NC2CCCC2)cc1 ZINC000822136971 606776119 /nfs/dbraw/zinc/77/61/19/606776119.db2.gz RULFUJKRYRYUBE-UHFFFAOYSA-N -1 3 363.421 3.640 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1Oc1ccc(C(=O)NC2CCCC2)cc1 ZINC000822136971 606776120 /nfs/dbraw/zinc/77/61/20/606776120.db2.gz RULFUJKRYRYUBE-UHFFFAOYSA-N -1 3 363.421 3.640 20 0 FHADHM CCN(C(=O)c1ccc(Oc2ccc(-c3nnn[n-]3)cc2C)cc1)C(C)C ZINC000821161089 606787346 /nfs/dbraw/zinc/78/73/46/606787346.db2.gz UOUGAEWPVPFDKZ-UHFFFAOYSA-N -1 3 365.437 3.838 20 0 FHADHM CCN(C(=O)c1ccc(Oc2ccc(-c3nn[n-]n3)cc2C)cc1)C(C)C ZINC000821161089 606787347 /nfs/dbraw/zinc/78/73/47/606787347.db2.gz UOUGAEWPVPFDKZ-UHFFFAOYSA-N -1 3 365.437 3.838 20 0 FHADHM Cc1sc2ncnc(Oc3cc(Cl)ccc3-c3nnn[n-]3)c2c1C ZINC000822563712 606789756 /nfs/dbraw/zinc/78/97/56/606789756.db2.gz MDZSKBRULWOSRL-UHFFFAOYSA-N -1 3 358.814 3.934 20 0 FHADHM Cc1sc2ncnc(Oc3cc(Cl)ccc3-c3nn[n-]n3)c2c1C ZINC000822563712 606789757 /nfs/dbraw/zinc/78/97/57/606789757.db2.gz MDZSKBRULWOSRL-UHFFFAOYSA-N -1 3 358.814 3.934 20 0 FHADHM CCCC[C@@H](NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)C1CCC1 ZINC000821043688 606795006 /nfs/dbraw/zinc/79/50/06/606795006.db2.gz SPIWEMWHEQWDHB-SUMWQHHRSA-N -1 3 356.474 3.586 20 0 FHADHM CCCC[C@@H](NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)C1CCC1 ZINC000821043688 606795008 /nfs/dbraw/zinc/79/50/08/606795008.db2.gz SPIWEMWHEQWDHB-SUMWQHHRSA-N -1 3 356.474 3.586 20 0 FHADHM CC(C)CN(CC(C)(C)C)C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820081327 606805408 /nfs/dbraw/zinc/80/54/08/606805408.db2.gz BWNGRVJKDUYZEB-AWEZNQCLSA-N -1 3 358.490 3.641 20 0 FHADHM CC(C)CN(CC(C)(C)C)C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820081327 606805410 /nfs/dbraw/zinc/80/54/10/606805410.db2.gz BWNGRVJKDUYZEB-AWEZNQCLSA-N -1 3 358.490 3.641 20 0 FHADHM Cc1ccc(Cl)c(NC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000822240063 606807662 /nfs/dbraw/zinc/80/76/62/606807662.db2.gz QULFGLOVZQPERI-LLVKDONJSA-N -1 3 356.817 3.711 20 0 FHADHM Cc1ccc(Cl)c(NC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000822240063 606807663 /nfs/dbraw/zinc/80/76/63/606807663.db2.gz QULFGLOVZQPERI-LLVKDONJSA-N -1 3 356.817 3.711 20 0 FHADHM Cc1ccc(Cl)c(NC(=O)N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000822239901 606807790 /nfs/dbraw/zinc/80/77/90/606807790.db2.gz JSQINFOXCUYDLZ-NSHDSACASA-N -1 3 356.817 3.711 20 0 FHADHM Cc1ccc(Cl)c(NC(=O)N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000822239901 606807792 /nfs/dbraw/zinc/80/77/92/606807792.db2.gz JSQINFOXCUYDLZ-NSHDSACASA-N -1 3 356.817 3.711 20 0 FHADHM CC(C)CN(C(=O)c1cc(-c2nnn[n-]2)cs1)c1ccc(Cl)cc1 ZINC000820081721 606811718 /nfs/dbraw/zinc/81/17/18/606811718.db2.gz SGUPFCMAGHTDOK-UHFFFAOYSA-N -1 3 361.858 3.884 20 0 FHADHM CC(C)CN(C(=O)c1cc(-c2nn[n-]n2)cs1)c1ccc(Cl)cc1 ZINC000820081721 606811720 /nfs/dbraw/zinc/81/17/20/606811720.db2.gz SGUPFCMAGHTDOK-UHFFFAOYSA-N -1 3 361.858 3.884 20 0 FHADHM CC(=O)c1cc(Cl)ccc1OCCCOc1cccc(-c2nnn[n-]2)c1 ZINC000819832889 606837157 /nfs/dbraw/zinc/83/71/57/606837157.db2.gz CFUVBAPUSVIRKR-UHFFFAOYSA-N -1 3 372.812 3.571 20 0 FHADHM CC(=O)c1cc(Cl)ccc1OCCCOc1cccc(-c2nn[n-]n2)c1 ZINC000819832889 606837159 /nfs/dbraw/zinc/83/71/59/606837159.db2.gz CFUVBAPUSVIRKR-UHFFFAOYSA-N -1 3 372.812 3.571 20 0 FHADHM CC(C)(C)OCCCSCCCOc1cccc(-c2nnn[n-]2)c1 ZINC000819951636 606840768 /nfs/dbraw/zinc/84/07/68/606840768.db2.gz VFAKHVVLBNCSTR-UHFFFAOYSA-N -1 3 350.488 3.574 20 0 FHADHM CC(C)(C)OCCCSCCCOc1cccc(-c2nn[n-]n2)c1 ZINC000819951636 606840769 /nfs/dbraw/zinc/84/07/69/606840769.db2.gz VFAKHVVLBNCSTR-UHFFFAOYSA-N -1 3 350.488 3.574 20 0 FHADHM Clc1cccc(CSCCCOc2cccc(-c3nnn[n-]3)c2)n1 ZINC000822585758 606843018 /nfs/dbraw/zinc/84/30/18/606843018.db2.gz MSZHXJJSEQIGEC-UHFFFAOYSA-N -1 3 361.858 3.617 20 0 FHADHM Clc1cccc(CSCCCOc2cccc(-c3nn[n-]n3)c2)n1 ZINC000822585758 606843019 /nfs/dbraw/zinc/84/30/19/606843019.db2.gz MSZHXJJSEQIGEC-UHFFFAOYSA-N -1 3 361.858 3.617 20 0 FHADHM COC(=O)c1ccc(CS[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1F ZINC000821669331 606848431 /nfs/dbraw/zinc/84/84/31/606848431.db2.gz GVYGHQPXGKQTLV-LLVKDONJSA-N -1 3 372.425 3.787 20 0 FHADHM COC(=O)c1ccc(CS[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1F ZINC000821669331 606848433 /nfs/dbraw/zinc/84/84/33/606848433.db2.gz GVYGHQPXGKQTLV-LLVKDONJSA-N -1 3 372.425 3.787 20 0 FHADHM Clc1cc(-c2nnn[n-]2)ccc1SCc1nnc(-c2ccccc2)o1 ZINC000822563659 606852044 /nfs/dbraw/zinc/85/20/44/606852044.db2.gz LRVZWAYYYHQYPM-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1cc(-c2nn[n-]n2)ccc1SCc1nnc(-c2ccccc2)o1 ZINC000822563659 606852046 /nfs/dbraw/zinc/85/20/46/606852046.db2.gz LRVZWAYYYHQYPM-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Cc1cc(Cl)cc(C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)c1 ZINC000822201266 606865384 /nfs/dbraw/zinc/86/53/84/606865384.db2.gz XXCCDSIVOOJBON-UHFFFAOYSA-N -1 3 367.840 3.633 20 0 FHADHM Cc1cc(Cl)cc(C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)c1 ZINC000822201266 606865386 /nfs/dbraw/zinc/86/53/86/606865386.db2.gz XXCCDSIVOOJBON-UHFFFAOYSA-N -1 3 367.840 3.633 20 0 FHADHM CCN(C(=O)c1cccc(Cl)c1F)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821161020 606871831 /nfs/dbraw/zinc/87/18/31/606871831.db2.gz TURWQKPVUIECMY-NSHDSACASA-N -1 3 373.819 3.883 20 0 FHADHM CCN(C(=O)c1cccc(Cl)c1F)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821161020 606871832 /nfs/dbraw/zinc/87/18/32/606871832.db2.gz TURWQKPVUIECMY-NSHDSACASA-N -1 3 373.819 3.883 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H]1CCCCC1(C)C ZINC000820120638 606873706 /nfs/dbraw/zinc/87/37/06/606873706.db2.gz HDOAOAITRNLVQU-QGZVFWFLSA-N -1 3 370.501 3.756 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H]1CCCCC1(C)C ZINC000820120638 606873708 /nfs/dbraw/zinc/87/37/08/606873708.db2.gz HDOAOAITRNLVQU-QGZVFWFLSA-N -1 3 370.501 3.756 20 0 FHADHM C[C@H](NC(=O)c1ccc(C(C)(C)C)s1)c1cccc(-c2nnn[n-]2)c1 ZINC000820396962 606915126 /nfs/dbraw/zinc/91/51/26/606915126.db2.gz KCTNXPWUXKWAPL-NSHDSACASA-N -1 3 355.467 3.717 20 0 FHADHM C[C@H](NC(=O)c1ccc(C(C)(C)C)s1)c1cccc(-c2nn[n-]n2)c1 ZINC000820396962 606915128 /nfs/dbraw/zinc/91/51/28/606915128.db2.gz KCTNXPWUXKWAPL-NSHDSACASA-N -1 3 355.467 3.717 20 0 FHADHM Cc1ccc(NCc2ccc(F)c(-c3nnn[n-]3)c2)c(Br)c1 ZINC000822258786 606926185 /nfs/dbraw/zinc/92/61/85/606926185.db2.gz CMSURUQVBRJFFQ-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Cc1ccc(NCc2ccc(F)c(-c3nn[n-]n3)c2)c(Br)c1 ZINC000822258786 606926186 /nfs/dbraw/zinc/92/61/86/606926186.db2.gz CMSURUQVBRJFFQ-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Cc1noc(C)c1C[C@@H](C)Nc1ccc(C(F)(F)F)cc1-c1nnn[n-]1 ZINC000822524189 606937575 /nfs/dbraw/zinc/93/75/75/606937575.db2.gz ZGOSEUGTWBBQMZ-MRVPVSSYSA-N -1 3 366.347 3.533 20 0 FHADHM Cc1noc(C)c1C[C@@H](C)Nc1ccc(C(F)(F)F)cc1-c1nn[n-]n1 ZINC000822524189 606937578 /nfs/dbraw/zinc/93/75/78/606937578.db2.gz ZGOSEUGTWBBQMZ-MRVPVSSYSA-N -1 3 366.347 3.533 20 0 FHADHM CN(C(=O)c1ccc(C(C)(C)C)s1)c1ccc(-c2nnn[n-]2)cc1F ZINC000821573647 606957310 /nfs/dbraw/zinc/95/73/10/606957310.db2.gz YSJYGRDKEJWEBL-UHFFFAOYSA-N -1 3 359.430 3.641 20 0 FHADHM CN(C(=O)c1ccc(C(C)(C)C)s1)c1ccc(-c2nn[n-]n2)cc1F ZINC000821573647 606957312 /nfs/dbraw/zinc/95/73/12/606957312.db2.gz YSJYGRDKEJWEBL-UHFFFAOYSA-N -1 3 359.430 3.641 20 0 FHADHM CN(C(=O)C/C=C\c1ccc(F)cc1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821569690 606960757 /nfs/dbraw/zinc/96/07/57/606960757.db2.gz SBHQOGADYBSFCT-IHWYPQMZSA-N -1 3 371.803 3.726 20 0 FHADHM CN(C(=O)C/C=C\c1ccc(F)cc1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821569690 606960758 /nfs/dbraw/zinc/96/07/58/606960758.db2.gz SBHQOGADYBSFCT-IHWYPQMZSA-N -1 3 371.803 3.726 20 0 FHADHM CN(C(=O)c1cccc2ccccc21)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821574448 606961267 /nfs/dbraw/zinc/96/12/67/606961267.db2.gz HLVGYNYRRUQDFW-UHFFFAOYSA-N -1 3 363.808 3.950 20 0 FHADHM CN(C(=O)c1cccc2ccccc21)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821574448 606961269 /nfs/dbraw/zinc/96/12/69/606961269.db2.gz HLVGYNYRRUQDFW-UHFFFAOYSA-N -1 3 363.808 3.950 20 0 FHADHM CC(C)(Oc1ccc(-c2nnn[n-]2)cc1)C(=O)Oc1ccc2ccccc2c1 ZINC000820005665 606985325 /nfs/dbraw/zinc/98/53/25/606985325.db2.gz VOTWDKCYSHZYKU-UHFFFAOYSA-N -1 3 374.400 3.783 20 0 FHADHM CC(C)(Oc1ccc(-c2nn[n-]n2)cc1)C(=O)Oc1ccc2ccccc2c1 ZINC000820005665 606985326 /nfs/dbraw/zinc/98/53/26/606985326.db2.gz VOTWDKCYSHZYKU-UHFFFAOYSA-N -1 3 374.400 3.783 20 0 FHADHM Cc1nc(SCc2ccc(F)c(-c3nnn[n-]3)c2)n(CC(C)C)c1C ZINC000822454000 607006558 /nfs/dbraw/zinc/00/65/58/607006558.db2.gz QUDYIPUGTSOBPF-UHFFFAOYSA-N -1 3 360.462 3.767 20 0 FHADHM Cc1nc(SCc2ccc(F)c(-c3nn[n-]n3)c2)n(CC(C)C)c1C ZINC000822454000 607006560 /nfs/dbraw/zinc/00/65/60/607006560.db2.gz QUDYIPUGTSOBPF-UHFFFAOYSA-N -1 3 360.462 3.767 20 0 FHADHM COC(=O)c1oc2ccccc2c1CSc1cccc(-c2nnn[n-]2)c1 ZINC000821670982 607010460 /nfs/dbraw/zinc/01/04/60/607010460.db2.gz AUJJIQVLXGBISX-UHFFFAOYSA-N -1 3 366.402 3.692 20 0 FHADHM COC(=O)c1oc2ccccc2c1CSc1cccc(-c2nn[n-]n2)c1 ZINC000821670982 607010462 /nfs/dbraw/zinc/01/04/62/607010462.db2.gz AUJJIQVLXGBISX-UHFFFAOYSA-N -1 3 366.402 3.692 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)c(CSc2ccc(C(F)(F)F)cn2)c1 ZINC000822758636 607038685 /nfs/dbraw/zinc/03/86/85/607038685.db2.gz UQWPJGCZFCWJHJ-UHFFFAOYSA-N -1 3 355.320 3.712 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)c(CSc2ccc(C(F)(F)F)cn2)c1 ZINC000822758636 607038686 /nfs/dbraw/zinc/03/86/86/607038686.db2.gz UQWPJGCZFCWJHJ-UHFFFAOYSA-N -1 3 355.320 3.712 20 0 FHADHM Cc1ccsc1-c1nnc(SCc2cc(F)ccc2-c2nnn[n-]2)o1 ZINC000822379680 607040019 /nfs/dbraw/zinc/04/00/19/607040019.db2.gz SARYLZYSLDRZQW-UHFFFAOYSA-N -1 3 374.426 3.718 20 0 FHADHM Cc1ccsc1-c1nnc(SCc2cc(F)ccc2-c2nn[n-]n2)o1 ZINC000822379680 607040021 /nfs/dbraw/zinc/04/00/21/607040021.db2.gz SARYLZYSLDRZQW-UHFFFAOYSA-N -1 3 374.426 3.718 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)O[C@@H]1CCc2sc(Cl)cc21 ZINC000822935216 607094188 /nfs/dbraw/zinc/09/41/88/607094188.db2.gz HFZQDNYUCMCTSZ-DMTLFAOVSA-N -1 3 372.837 3.826 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)O[C@@H]1CCc2sc(Cl)cc21 ZINC000822935216 607094190 /nfs/dbraw/zinc/09/41/90/607094190.db2.gz HFZQDNYUCMCTSZ-DMTLFAOVSA-N -1 3 372.837 3.826 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)O[C@H]1CCc2sc(Cl)cc21 ZINC000822935219 607094497 /nfs/dbraw/zinc/09/44/97/607094497.db2.gz HFZQDNYUCMCTSZ-UJZCVKTISA-N -1 3 372.837 3.826 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)O[C@H]1CCc2sc(Cl)cc21 ZINC000822935219 607094498 /nfs/dbraw/zinc/09/44/98/607094498.db2.gz HFZQDNYUCMCTSZ-UJZCVKTISA-N -1 3 372.837 3.826 20 0 FHADHM C[C@H](Nc1ccn([C@@H](C)c2ccccc2)n1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820461794 607112459 /nfs/dbraw/zinc/11/24/59/607112459.db2.gz QXWVRPIRYVVTPF-GJZGRUSLSA-N -1 3 359.437 3.846 20 0 FHADHM C[C@H](Nc1ccn([C@@H](C)c2ccccc2)n1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820461794 607112461 /nfs/dbraw/zinc/11/24/61/607112461.db2.gz QXWVRPIRYVVTPF-GJZGRUSLSA-N -1 3 359.437 3.846 20 0 FHADHM C[C@H](Nc1c(F)cc(-c2nnn[n-]2)cc1F)c1ccccc1-n1cccn1 ZINC000820452083 607118947 /nfs/dbraw/zinc/11/89/47/607118947.db2.gz ZHXNAKCLGCDBRG-NSHDSACASA-N -1 3 367.363 3.504 20 0 FHADHM C[C@H](Nc1c(F)cc(-c2nn[n-]n2)cc1F)c1ccccc1-n1cccn1 ZINC000820452083 607118949 /nfs/dbraw/zinc/11/89/49/607118949.db2.gz ZHXNAKCLGCDBRG-NSHDSACASA-N -1 3 367.363 3.504 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1Oc1ncnc2sc3c(c21)CCCC3 ZINC000822748108 607128760 /nfs/dbraw/zinc/12/87/60/607128760.db2.gz IGXKIPQOXVHHPP-UHFFFAOYSA-N -1 3 368.397 3.682 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1Oc1ncnc2sc3c(c21)CCCC3 ZINC000822748108 607128761 /nfs/dbraw/zinc/12/87/61/607128761.db2.gz IGXKIPQOXVHHPP-UHFFFAOYSA-N -1 3 368.397 3.682 20 0 FHADHM c1ccc2c(c1)nc(N[C@H]1CCOC3(CCCCC3)C1)cc2-c1nnn[n-]1 ZINC000823791557 607131834 /nfs/dbraw/zinc/13/18/34/607131834.db2.gz FBJYTOOQXLYAIM-AWEZNQCLSA-N -1 3 364.453 3.709 20 0 FHADHM c1ccc2c(c1)nc(N[C@H]1CCOC3(CCCCC3)C1)cc2-c1nn[n-]n1 ZINC000823791557 607131836 /nfs/dbraw/zinc/13/18/36/607131836.db2.gz FBJYTOOQXLYAIM-AWEZNQCLSA-N -1 3 364.453 3.709 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1OCc1ccccc1OCC(F)(F)F ZINC000822748068 607135596 /nfs/dbraw/zinc/13/55/96/607135596.db2.gz FYUJCAKYTYPRNG-UHFFFAOYSA-N -1 3 368.290 3.526 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1OCc1ccccc1OCC(F)(F)F ZINC000822748068 607135597 /nfs/dbraw/zinc/13/55/97/607135597.db2.gz FYUJCAKYTYPRNG-UHFFFAOYSA-N -1 3 368.290 3.526 20 0 FHADHM C[C@H](Oc1ccc(-c2nnn[n-]2)cc1F)c1ncc(-c2ccccc2)o1 ZINC000820536189 607135853 /nfs/dbraw/zinc/13/58/53/607135853.db2.gz SUJYAEPREDWWRM-NSHDSACASA-N -1 3 351.341 3.801 20 0 FHADHM C[C@H](Oc1ccc(-c2nn[n-]n2)cc1F)c1ncc(-c2ccccc2)o1 ZINC000820536189 607135855 /nfs/dbraw/zinc/13/58/55/607135855.db2.gz SUJYAEPREDWWRM-NSHDSACASA-N -1 3 351.341 3.801 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CCC(CCC(C)C)CC1 ZINC000822217677 607136823 /nfs/dbraw/zinc/13/68/23/607136823.db2.gz LACKEYOIAIPTTO-UHFFFAOYSA-N -1 3 356.474 3.855 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CCC(CCC(C)C)CC1 ZINC000822217677 607136825 /nfs/dbraw/zinc/13/68/25/607136825.db2.gz LACKEYOIAIPTTO-UHFFFAOYSA-N -1 3 356.474 3.855 20 0 FHADHM CC[C@@H](OC1CCCCC1)C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000820938675 607152258 /nfs/dbraw/zinc/15/22/58/607152258.db2.gz LOMODSVTLRYBBV-OAHLLOKOSA-N -1 3 363.849 3.587 20 0 FHADHM CC[C@@H](OC1CCCCC1)C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000820938675 607152261 /nfs/dbraw/zinc/15/22/61/607152261.db2.gz LOMODSVTLRYBBV-OAHLLOKOSA-N -1 3 363.849 3.587 20 0 FHADHM Clc1ncc(CSc2nc3c(cc2-c2nnn[n-]2)CCCC3)s1 ZINC000822590729 607161290 /nfs/dbraw/zinc/16/12/90/607161290.db2.gz OAMMWOAAWAGODG-UHFFFAOYSA-N -1 3 364.887 3.543 20 0 FHADHM Clc1ncc(CSc2nc3c(cc2-c2nn[n-]n2)CCCC3)s1 ZINC000822590729 607161291 /nfs/dbraw/zinc/16/12/91/607161291.db2.gz OAMMWOAAWAGODG-UHFFFAOYSA-N -1 3 364.887 3.543 20 0 FHADHM O=C(c1cc(-c2nnn[n-]2)cs1)N1CCC[C@@H]1CCC1CCCCC1 ZINC000823472704 607163681 /nfs/dbraw/zinc/16/36/81/607163681.db2.gz WAXDLFYYAPDKRY-OAHLLOKOSA-N -1 3 359.499 3.893 20 0 FHADHM O=C(c1cc(-c2nn[n-]n2)cs1)N1CCC[C@@H]1CCC1CCCCC1 ZINC000823472704 607163682 /nfs/dbraw/zinc/16/36/82/607163682.db2.gz WAXDLFYYAPDKRY-OAHLLOKOSA-N -1 3 359.499 3.893 20 0 FHADHM CCCCC[C@H]1CCCN1C(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000821050606 607165160 /nfs/dbraw/zinc/16/51/60/607165160.db2.gz SJPNMLLSNMNBKS-HNNXBMFYSA-N -1 3 359.499 3.530 20 0 FHADHM CCCCC[C@H]1CCCN1C(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000821050606 607165161 /nfs/dbraw/zinc/16/51/61/607165161.db2.gz SJPNMLLSNMNBKS-HNNXBMFYSA-N -1 3 359.499 3.530 20 0 FHADHM Cc1csc([C@H](C)Nc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)n1 ZINC000822409695 607173123 /nfs/dbraw/zinc/17/31/23/607173123.db2.gz UPCGMLNOGXTMFC-QMMMGPOBSA-N -1 3 354.361 3.824 20 0 FHADHM Cc1csc([C@H](C)Nc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)n1 ZINC000822409695 607173124 /nfs/dbraw/zinc/17/31/24/607173124.db2.gz UPCGMLNOGXTMFC-QMMMGPOBSA-N -1 3 354.361 3.824 20 0 FHADHM CC1(C)[C@H](Nc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)[C@H]2CCCO[C@H]21 ZINC000820586502 607173485 /nfs/dbraw/zinc/17/34/85/607173485.db2.gz WQVBBLVJSMOONR-LERXQTSPSA-N -1 3 367.375 3.501 20 0 FHADHM CC1(C)[C@H](Nc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)[C@H]2CCCO[C@H]21 ZINC000820586502 607173486 /nfs/dbraw/zinc/17/34/86/607173486.db2.gz WQVBBLVJSMOONR-LERXQTSPSA-N -1 3 367.375 3.501 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)c1cc2ccccc2s1 ZINC000823319727 607191301 /nfs/dbraw/zinc/19/13/01/607191301.db2.gz XZPDGTIVVKMTMW-UHFFFAOYSA-N -1 3 355.810 3.987 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)c1cc2ccccc2s1 ZINC000823319727 607191302 /nfs/dbraw/zinc/19/13/02/607191302.db2.gz XZPDGTIVVKMTMW-UHFFFAOYSA-N -1 3 355.810 3.987 20 0 FHADHM CC(C)CN(C(=O)c1ccc(F)c(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820081572 607192019 /nfs/dbraw/zinc/19/20/19/607192019.db2.gz LPUGMHIIOQFRBT-UHFFFAOYSA-N -1 3 373.819 3.962 20 0 FHADHM CC(C)CN(C(=O)c1ccc(F)c(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820081572 607192020 /nfs/dbraw/zinc/19/20/20/607192020.db2.gz LPUGMHIIOQFRBT-UHFFFAOYSA-N -1 3 373.819 3.962 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)c1cc(Cl)ccc1F ZINC000823318735 607192291 /nfs/dbraw/zinc/19/22/91/607192291.db2.gz JASHRCQDKHUOPR-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)c1cc(Cl)ccc1F ZINC000823318735 607192292 /nfs/dbraw/zinc/19/22/92/607192292.db2.gz JASHRCQDKHUOPR-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1ccc(F)c(Cl)c1 ZINC000820122035 607192368 /nfs/dbraw/zinc/19/23/68/607192368.db2.gz XTHKENXOTXKLIK-UHFFFAOYSA-N -1 3 373.819 3.710 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1ccc(F)c(Cl)c1 ZINC000820122035 607192369 /nfs/dbraw/zinc/19/23/69/607192369.db2.gz XTHKENXOTXKLIK-UHFFFAOYSA-N -1 3 373.819 3.710 20 0 FHADHM C[C@@H](c1cccs1)N(C)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820570930 607197027 /nfs/dbraw/zinc/19/70/27/607197027.db2.gz UCSRBULBVYJNPJ-VIFPVBQESA-N -1 3 362.846 3.807 20 0 FHADHM C[C@@H](c1cccs1)N(C)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820570930 607197028 /nfs/dbraw/zinc/19/70/28/607197028.db2.gz UCSRBULBVYJNPJ-VIFPVBQESA-N -1 3 362.846 3.807 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N1CC[C@H](c2ccccc2)C1 ZINC000823313526 607198428 /nfs/dbraw/zinc/19/84/28/607198428.db2.gz DNVFLSYCJOYMCH-AWEZNQCLSA-N -1 3 368.828 3.542 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N1CC[C@H](c2ccccc2)C1 ZINC000823313526 607198429 /nfs/dbraw/zinc/19/84/29/607198429.db2.gz DNVFLSYCJOYMCH-AWEZNQCLSA-N -1 3 368.828 3.542 20 0 FHADHM CC[C@@H](C)[C@H]1CCCCN1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820864167 607201475 /nfs/dbraw/zinc/20/14/75/607201475.db2.gz XBLQPLJHHWVPLR-IAQYHMDHSA-N -1 3 362.865 3.953 20 0 FHADHM CC[C@@H](C)[C@H]1CCCCN1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820864167 607201476 /nfs/dbraw/zinc/20/14/76/607201476.db2.gz XBLQPLJHHWVPLR-IAQYHMDHSA-N -1 3 362.865 3.953 20 0 FHADHM CC(C)CN(CC(C)C)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820087722 607202193 /nfs/dbraw/zinc/20/21/93/607202193.db2.gz YGKVPWOWMBWWDY-UHFFFAOYSA-N -1 3 350.854 3.666 20 0 FHADHM CC(C)CN(CC(C)C)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820087722 607202194 /nfs/dbraw/zinc/20/21/94/607202194.db2.gz YGKVPWOWMBWWDY-UHFFFAOYSA-N -1 3 350.854 3.666 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N1CCC[C@@H]1C1CCCC1 ZINC000823314188 607203006 /nfs/dbraw/zinc/20/30/06/607203006.db2.gz ODHTWVGSXKKEMZ-OAHLLOKOSA-N -1 3 360.849 3.707 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N1CCC[C@@H]1C1CCCC1 ZINC000823314188 607203007 /nfs/dbraw/zinc/20/30/07/607203007.db2.gz ODHTWVGSXKKEMZ-OAHLLOKOSA-N -1 3 360.849 3.707 20 0 FHADHM Cc1cccnc1NCc1cccc(OCc2ccccc2-c2nn[n-]n2)c1 ZINC000822369940 607229327 /nfs/dbraw/zinc/22/93/27/607229327.db2.gz PQZKCDZJOQNFKO-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM C[C@H](OC(=O)Cc1ccc(F)cc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000820496051 607239016 /nfs/dbraw/zinc/23/90/16/607239016.db2.gz LEFVSGDJYITBIS-JTQLQIEISA-N -1 3 360.776 3.506 20 0 FHADHM C[C@H](OC(=O)Cc1ccc(F)cc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000820496051 607239017 /nfs/dbraw/zinc/23/90/17/607239017.db2.gz LEFVSGDJYITBIS-JTQLQIEISA-N -1 3 360.776 3.506 20 0 FHADHM CC(C)Oc1ccccc1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820178674 607241080 /nfs/dbraw/zinc/24/10/80/607241080.db2.gz XCMLRZKPWGWKNK-UHFFFAOYSA-N -1 3 357.801 3.560 20 0 FHADHM CC(C)Oc1ccccc1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820178674 607241081 /nfs/dbraw/zinc/24/10/81/607241081.db2.gz XCMLRZKPWGWKNK-UHFFFAOYSA-N -1 3 357.801 3.560 20 0 FHADHM O=C(Cc1csc2ccccc12)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000823118959 607241663 /nfs/dbraw/zinc/24/16/63/607241663.db2.gz XFACXEPEZDHHGG-UHFFFAOYSA-N -1 3 369.837 3.916 20 0 FHADHM O=C(Cc1csc2ccccc12)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000823118959 607241664 /nfs/dbraw/zinc/24/16/64/607241664.db2.gz XFACXEPEZDHHGG-UHFFFAOYSA-N -1 3 369.837 3.916 20 0 FHADHM CS[C@H](C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccccc1 ZINC000821943210 607243629 /nfs/dbraw/zinc/24/36/29/607243629.db2.gz UORLBQZZTIAHAC-AWEZNQCLSA-N -1 3 359.842 3.563 20 0 FHADHM CS[C@H](C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccccc1 ZINC000821943210 607243630 /nfs/dbraw/zinc/24/36/30/607243630.db2.gz UORLBQZZTIAHAC-AWEZNQCLSA-N -1 3 359.842 3.563 20 0 FHADHM COc1cccc(OCCS[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000826217731 607785019 /nfs/dbraw/zinc/78/50/19/607785019.db2.gz ZTXADKAXDZBWIA-ZDUSSCGKSA-N -1 3 356.451 3.749 20 0 FHADHM COc1cccc(OCCS[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000826217731 607785020 /nfs/dbraw/zinc/78/50/20/607785020.db2.gz ZTXADKAXDZBWIA-ZDUSSCGKSA-N -1 3 356.451 3.749 20 0 FHADHM CN(C(=O)c1cccc(Oc2ccccc2)c1)c1ccccc1-c1nnn[n-]1 ZINC000825829276 607788391 /nfs/dbraw/zinc/78/83/91/607788391.db2.gz AUTBPPAKWAGOLK-UHFFFAOYSA-N -1 3 371.400 3.936 20 0 FHADHM CN(C(=O)c1cccc(Oc2ccccc2)c1)c1ccccc1-c1nn[n-]n1 ZINC000825829276 607788392 /nfs/dbraw/zinc/78/83/92/607788392.db2.gz AUTBPPAKWAGOLK-UHFFFAOYSA-N -1 3 371.400 3.936 20 0 FHADHM CN(C(=O)[C@H]1C[C@H]1c1cccc2ccccc21)c1ccccc1-c1nnn[n-]1 ZINC000825811734 607789762 /nfs/dbraw/zinc/78/97/62/607789762.db2.gz AHEGTEFFBAFXJM-OALUTQOASA-N -1 3 369.428 3.786 20 0 FHADHM CN(C(=O)[C@H]1C[C@H]1c1cccc2ccccc21)c1ccccc1-c1nn[n-]n1 ZINC000825811734 607789763 /nfs/dbraw/zinc/78/97/63/607789763.db2.gz AHEGTEFFBAFXJM-OALUTQOASA-N -1 3 369.428 3.786 20 0 FHADHM CCN(C(=O)[C@H](C)c1ccc(Cl)s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825361658 607800707 /nfs/dbraw/zinc/80/07/07/607800707.db2.gz HBNLQXRTITWMKT-SNVBAGLBSA-N -1 3 361.858 3.738 20 0 FHADHM CCN(C(=O)[C@H](C)c1ccc(Cl)s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825361658 607800708 /nfs/dbraw/zinc/80/07/08/607800708.db2.gz HBNLQXRTITWMKT-SNVBAGLBSA-N -1 3 361.858 3.738 20 0 FHADHM FC(F)(F)c1ccc(N2CCC(c3ccccn3)CC2)c(-c2nnn[n-]2)c1 ZINC000826368138 607820410 /nfs/dbraw/zinc/82/04/10/607820410.db2.gz CWINYXAZNHBFQU-UHFFFAOYSA-N -1 3 374.370 3.665 20 0 FHADHM FC(F)(F)c1ccc(N2CCC(c3ccccn3)CC2)c(-c2nn[n-]n2)c1 ZINC000826368138 607820411 /nfs/dbraw/zinc/82/04/11/607820411.db2.gz CWINYXAZNHBFQU-UHFFFAOYSA-N -1 3 374.370 3.665 20 0 FHADHM Cc1c(NC(=O)[C@H](OC(C)(C)C)c2ccccc2)cccc1-c1nnn[n-]1 ZINC000826241104 607822777 /nfs/dbraw/zinc/82/27/77/607822777.db2.gz RDRVLONREOZTRQ-QGZVFWFLSA-N -1 3 365.437 3.670 20 0 FHADHM Cc1c(NC(=O)[C@H](OC(C)(C)C)c2ccccc2)cccc1-c1nn[n-]n1 ZINC000826241104 607822778 /nfs/dbraw/zinc/82/27/78/607822778.db2.gz RDRVLONREOZTRQ-QGZVFWFLSA-N -1 3 365.437 3.670 20 0 FHADHM CCN(C(=O)[C@@H](C)Cc1ccccc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000825363346 607829793 /nfs/dbraw/zinc/82/97/93/607829793.db2.gz YRSPYKXRBJEZIG-ZDUSSCGKSA-N -1 3 369.856 3.752 20 0 FHADHM CCN(C(=O)[C@@H](C)Cc1ccccc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000825363346 607829794 /nfs/dbraw/zinc/82/97/94/607829794.db2.gz YRSPYKXRBJEZIG-ZDUSSCGKSA-N -1 3 369.856 3.752 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1C[C@@H](C)CSc2ccccc21 ZINC000826244519 607831944 /nfs/dbraw/zinc/83/19/44/607831944.db2.gz VQARLWDPVLASGE-GFCCVEGCSA-N -1 3 365.462 3.564 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1C[C@@H](C)CSc2ccccc21 ZINC000826244519 607831945 /nfs/dbraw/zinc/83/19/45/607831945.db2.gz VQARLWDPVLASGE-GFCCVEGCSA-N -1 3 365.462 3.564 20 0 FHADHM FC(F)(F)c1ccc(N2CCC[C@@H](C(F)(F)F)C2)cc1-c1nnn[n-]1 ZINC000826368534 607839016 /nfs/dbraw/zinc/83/90/16/607839016.db2.gz TUDUSEIHNNEEQQ-MRVPVSSYSA-N -1 3 365.281 3.664 20 0 FHADHM FC(F)(F)c1ccc(N2CCC[C@@H](C(F)(F)F)C2)cc1-c1nn[n-]n1 ZINC000826368534 607839017 /nfs/dbraw/zinc/83/90/17/607839017.db2.gz TUDUSEIHNNEEQQ-MRVPVSSYSA-N -1 3 365.281 3.664 20 0 FHADHM c1cc2nc(NCCCOC3CCCCC3)ccc2cc1-c1nnn[n-]1 ZINC000826518204 607839368 /nfs/dbraw/zinc/83/93/68/607839368.db2.gz FKLNXOYSCBCQHI-UHFFFAOYSA-N -1 3 352.442 3.566 20 0 FHADHM c1cc2nc(NCCCOC3CCCCC3)ccc2cc1-c1nn[n-]n1 ZINC000826518204 607839369 /nfs/dbraw/zinc/83/93/69/607839369.db2.gz FKLNXOYSCBCQHI-UHFFFAOYSA-N -1 3 352.442 3.566 20 0 FHADHM CC(C)[C@H](Sc1ccc(-c2nnn[n-]2)cc1Cl)C(=O)NC(C)(C)C ZINC000824206927 607844313 /nfs/dbraw/zinc/84/43/13/607844313.db2.gz LZRJJAKTYXEJNB-ZDUSSCGKSA-N -1 3 367.906 3.552 20 0 FHADHM CC(C)[C@H](Sc1ccc(-c2nn[n-]n2)cc1Cl)C(=O)NC(C)(C)C ZINC000824206927 607844314 /nfs/dbraw/zinc/84/43/14/607844314.db2.gz LZRJJAKTYXEJNB-ZDUSSCGKSA-N -1 3 367.906 3.552 20 0 FHADHM Cc1c(C(=O)OCc2ccc(-c3nnn[n-]3)cc2)cccc1-c1ccccn1 ZINC000826234593 607857253 /nfs/dbraw/zinc/85/72/53/607857253.db2.gz DWYSTLITEUQWQX-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM Cc1c(C(=O)OCc2ccc(-c3nn[n-]n3)cc2)cccc1-c1ccccn1 ZINC000826234593 607857254 /nfs/dbraw/zinc/85/72/54/607857254.db2.gz DWYSTLITEUQWQX-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM O[C@H](COc1ccc(Oc2ccccc2)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000826505197 607869965 /nfs/dbraw/zinc/86/99/65/607869965.db2.gz PFFNGSGPOHIJNR-HXUWFJFHSA-N -1 3 374.400 3.771 20 0 FHADHM O[C@H](COc1ccc(Oc2ccccc2)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000826505197 607869966 /nfs/dbraw/zinc/86/99/66/607869966.db2.gz PFFNGSGPOHIJNR-HXUWFJFHSA-N -1 3 374.400 3.771 20 0 FHADHM CCN(C(=O)c1ccc(C)c(F)c1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825379662 607877862 /nfs/dbraw/zinc/87/78/62/607877862.db2.gz JMEQUHDEILGNFT-UHFFFAOYSA-N -1 3 359.792 3.634 20 0 FHADHM CCN(C(=O)c1ccc(C)c(F)c1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825379662 607877863 /nfs/dbraw/zinc/87/78/63/607877863.db2.gz JMEQUHDEILGNFT-UHFFFAOYSA-N -1 3 359.792 3.634 20 0 FHADHM CCN(C(=O)CCc1ccc(C)cc1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825372439 607878685 /nfs/dbraw/zinc/87/86/85/607878685.db2.gz YRMZBWTXXIZQBN-UHFFFAOYSA-N -1 3 369.856 3.814 20 0 FHADHM CCN(C(=O)CCc1ccc(C)cc1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825372439 607878686 /nfs/dbraw/zinc/87/86/86/607878686.db2.gz YRMZBWTXXIZQBN-UHFFFAOYSA-N -1 3 369.856 3.814 20 0 FHADHM CCN(C(=O)CCc1ccc(F)cc1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825371191 607878796 /nfs/dbraw/zinc/87/87/96/607878796.db2.gz DFGJKUDJEYHKEU-UHFFFAOYSA-N -1 3 373.819 3.645 20 0 FHADHM CCN(C(=O)CCc1ccc(F)cc1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825371191 607878797 /nfs/dbraw/zinc/87/87/97/607878797.db2.gz DFGJKUDJEYHKEU-UHFFFAOYSA-N -1 3 373.819 3.645 20 0 FHADHM CCN(C(=O)c1cc(C)sc1C)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825379912 607878941 /nfs/dbraw/zinc/87/89/41/607878941.db2.gz MBPBOVBLHNQOHV-UHFFFAOYSA-N -1 3 361.858 3.865 20 0 FHADHM CCN(C(=O)c1cc(C)sc1C)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825379912 607878942 /nfs/dbraw/zinc/87/89/42/607878942.db2.gz MBPBOVBLHNQOHV-UHFFFAOYSA-N -1 3 361.858 3.865 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@H](c1ccc(F)cc1)C(C)C ZINC000826277465 607889551 /nfs/dbraw/zinc/88/95/51/607889551.db2.gz VPROUPLRDYYSHD-KRWDZBQOSA-N -1 3 353.401 3.693 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@H](c1ccc(F)cc1)C(C)C ZINC000826277465 607889552 /nfs/dbraw/zinc/88/95/52/607889552.db2.gz VPROUPLRDYYSHD-KRWDZBQOSA-N -1 3 353.401 3.693 20 0 FHADHM CCN(C(=O)[C@H](C)Cc1cccc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825363340 607927166 /nfs/dbraw/zinc/92/71/66/607927166.db2.gz YKUWJWLUXLRKSQ-CYBMUJFWSA-N -1 3 369.856 3.752 20 0 FHADHM CCN(C(=O)[C@H](C)Cc1cccc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825363340 607927167 /nfs/dbraw/zinc/92/71/67/607927167.db2.gz YKUWJWLUXLRKSQ-CYBMUJFWSA-N -1 3 369.856 3.752 20 0 FHADHM FC(F)(F)C1=CCN(c2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)CC1 ZINC000826367355 607936054 /nfs/dbraw/zinc/93/60/54/607936054.db2.gz WEVVCXQXTJMUDS-UHFFFAOYSA-N -1 3 363.265 3.584 20 0 FHADHM FC(F)(F)C1=CCN(c2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)CC1 ZINC000826367355 607936055 /nfs/dbraw/zinc/93/60/55/607936055.db2.gz WEVVCXQXTJMUDS-UHFFFAOYSA-N -1 3 363.265 3.584 20 0 FHADHM CC(C)c1ccc2cc(C(=O)N3CCc4ccc(-c5nnn[n-]5)cc43)[nH]c2c1 ZINC000824347875 607946884 /nfs/dbraw/zinc/94/68/84/607946884.db2.gz QLRWRDBTSCOZQV-UHFFFAOYSA-N -1 3 372.432 3.674 20 0 FHADHM CC(C)c1ccc2cc(C(=O)N3CCc4ccc(-c5nn[n-]n5)cc43)[nH]c2c1 ZINC000824347875 607946885 /nfs/dbraw/zinc/94/68/85/607946885.db2.gz QLRWRDBTSCOZQV-UHFFFAOYSA-N -1 3 372.432 3.674 20 0 FHADHM CC[C@H](C)[C@@H](C(=O)N1CCc2ccc(-c3nnn[n-]3)cc21)c1ccccc1 ZINC000825052491 607948679 /nfs/dbraw/zinc/94/86/79/607948679.db2.gz XOBNEZSNXUIAJQ-IFXJQAMLSA-N -1 3 361.449 3.586 20 0 FHADHM CC[C@H](C)[C@@H](C(=O)N1CCc2ccc(-c3nn[n-]n3)cc21)c1ccccc1 ZINC000825052491 607948680 /nfs/dbraw/zinc/94/86/80/607948680.db2.gz XOBNEZSNXUIAJQ-IFXJQAMLSA-N -1 3 361.449 3.586 20 0 FHADHM O=C(c1ccc(-c2ccccc2)cc1)N1CCc2ccc(-c3nnn[n-]3)cc21 ZINC000826471203 607950504 /nfs/dbraw/zinc/95/05/04/607950504.db2.gz QPBBYLPGUAJFIG-UHFFFAOYSA-N -1 3 367.412 3.737 20 0 FHADHM O=C(c1ccc(-c2ccccc2)cc1)N1CCc2ccc(-c3nn[n-]n3)cc21 ZINC000826471203 607950505 /nfs/dbraw/zinc/95/05/05/607950505.db2.gz QPBBYLPGUAJFIG-UHFFFAOYSA-N -1 3 367.412 3.737 20 0 FHADHM CCCn1c2ccc(-c3nnn[n-]3)cc2nc1-c1cnc(C(C)C)s1 ZINC000825353641 607975114 /nfs/dbraw/zinc/97/51/14/607975114.db2.gz ZWMAECDREDXZDR-UHFFFAOYSA-N -1 3 353.455 3.873 20 0 FHADHM CCCn1c2ccc(-c3nn[n-]n3)cc2nc1-c1cnc(C(C)C)s1 ZINC000825353641 607975115 /nfs/dbraw/zinc/97/51/15/607975115.db2.gz ZWMAECDREDXZDR-UHFFFAOYSA-N -1 3 353.455 3.873 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)C(C)=Cc1cccc(Cl)c1 ZINC000826185457 607980335 /nfs/dbraw/zinc/98/03/35/607980335.db2.gz KPUWCUQXPMGBNI-FLIBITNWSA-N -1 3 369.812 3.571 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)C(C)=Cc1cccc(Cl)c1 ZINC000826185457 607980336 /nfs/dbraw/zinc/98/03/36/607980336.db2.gz KPUWCUQXPMGBNI-FLIBITNWSA-N -1 3 369.812 3.571 20 0 FHADHM c1sc(C2CC2)nc1CSCCOc1cccc(-c2nnn[n-]2)c1 ZINC000826517457 607983891 /nfs/dbraw/zinc/98/38/91/607983891.db2.gz CTFMPUMRNGFIDL-UHFFFAOYSA-N -1 3 359.480 3.513 20 0 FHADHM c1sc(C2CC2)nc1CSCCOc1cccc(-c2nn[n-]n2)c1 ZINC000826517457 607983892 /nfs/dbraw/zinc/98/38/92/607983892.db2.gz CTFMPUMRNGFIDL-UHFFFAOYSA-N -1 3 359.480 3.513 20 0 FHADHM CS[C@H](C)CC(=O)OCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000826225300 608003272 /nfs/dbraw/zinc/00/32/72/608003272.db2.gz YLZGOAFZAOSDBQ-CYBMUJFWSA-N -1 3 368.462 3.719 20 0 FHADHM CS[C@H](C)CC(=O)OCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000826225300 608003273 /nfs/dbraw/zinc/00/32/73/608003273.db2.gz YLZGOAFZAOSDBQ-CYBMUJFWSA-N -1 3 368.462 3.719 20 0 FHADHM c1ccc2c(c1)nc(NCc1ccc(-c3nn[n-]n3)cc1)n2C1CCCC1 ZINC000826524513 608047111 /nfs/dbraw/zinc/04/71/11/608047111.db2.gz XYAPVQMPIWQEQB-UHFFFAOYSA-N -1 3 359.437 3.944 20 0 FHADHM c1ccc(C[C@@H]2c3ccccc3CCN2c2ncccc2-c2nnn[n-]2)cc1 ZINC000826520094 608053609 /nfs/dbraw/zinc/05/36/09/608053609.db2.gz AJWHVMQPWUDIMQ-HXUWFJFHSA-N -1 3 368.444 3.608 20 0 FHADHM c1ccc(C[C@@H]2c3ccccc3CCN2c2ncccc2-c2nn[n-]n2)cc1 ZINC000826520094 608053610 /nfs/dbraw/zinc/05/36/10/608053610.db2.gz AJWHVMQPWUDIMQ-HXUWFJFHSA-N -1 3 368.444 3.608 20 0 FHADHM Cc1cc2c(ncnc2SCc2cc(F)ccc2-c2nnn[n-]2)s1 ZINC000826272854 608056778 /nfs/dbraw/zinc/05/67/78/608056778.db2.gz DVMSRQJLXFSIBR-UHFFFAOYSA-N -1 3 358.427 3.611 20 0 FHADHM Cc1cc2c(ncnc2SCc2cc(F)ccc2-c2nn[n-]n2)s1 ZINC000826272854 608056779 /nfs/dbraw/zinc/05/67/79/608056779.db2.gz DVMSRQJLXFSIBR-UHFFFAOYSA-N -1 3 358.427 3.611 20 0 FHADHM CC(C)(C)OC(=O)Nc1cccc(CNc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000824114280 608057225 /nfs/dbraw/zinc/05/72/25/608057225.db2.gz MUUAVEMXBMEJCJ-UHFFFAOYSA-N -1 3 366.425 3.826 20 0 FHADHM CC(C)Cc1ccc([C@H](C)C(=O)Nc2sccc2-c2nnn[n-]2)cc1 ZINC000824280415 608058880 /nfs/dbraw/zinc/05/88/80/608058880.db2.gz MOTIXRLXKLBHHP-LBPRGKRZSA-N -1 3 355.467 3.869 20 0 FHADHM CC(C)Cc1ccc([C@H](C)C(=O)Nc2sccc2-c2nn[n-]n2)cc1 ZINC000824280415 608058881 /nfs/dbraw/zinc/05/88/81/608058881.db2.gz MOTIXRLXKLBHHP-LBPRGKRZSA-N -1 3 355.467 3.869 20 0 FHADHM CC[C@@H](C)n1ncc(NC(=O)Nc2ccc(-c3nnn[n-]3)cc2)c1C1CC1 ZINC000825081637 608100558 /nfs/dbraw/zinc/10/05/58/608100558.db2.gz LALKNIFGKLSVSB-LLVKDONJSA-N -1 3 366.429 3.556 20 0 FHADHM CC[C@@H](C)n1ncc(NC(=O)Nc2ccc(-c3nn[n-]n3)cc2)c1C1CC1 ZINC000825081637 608100559 /nfs/dbraw/zinc/10/05/59/608100559.db2.gz LALKNIFGKLSVSB-LLVKDONJSA-N -1 3 366.429 3.556 20 0 FHADHM Cc1cc(C)cc([C@H]2CCN(C(=O)C=Cc3ccccc3-c3nnn[n-]3)C2)c1 ZINC000826264428 608131977 /nfs/dbraw/zinc/13/19/77/608131977.db2.gz NZEXDIPUGDZQSM-ZEVQVBBLSA-N -1 3 373.460 3.513 20 0 FHADHM Cc1cc(C)cc([C@H]2CCN(C(=O)C=Cc3ccccc3-c3nn[n-]n3)C2)c1 ZINC000826264428 608131978 /nfs/dbraw/zinc/13/19/78/608131978.db2.gz NZEXDIPUGDZQSM-ZEVQVBBLSA-N -1 3 373.460 3.513 20 0 FHADHM CC(C)CN(C(=O)CCCC(F)(F)F)c1ccc(-c2nnn[n-]2)cc1 ZINC000824248728 608149854 /nfs/dbraw/zinc/14/98/54/608149854.db2.gz AHCMAJMMUYMTNS-UHFFFAOYSA-N -1 3 355.364 3.588 20 0 FHADHM CC(C)CN(C(=O)CCCC(F)(F)F)c1ccc(-c2nn[n-]n2)cc1 ZINC000824248728 608149856 /nfs/dbraw/zinc/14/98/56/608149856.db2.gz AHCMAJMMUYMTNS-UHFFFAOYSA-N -1 3 355.364 3.588 20 0 FHADHM C[C@H](OC(=O)[C@@H](C)c1c(F)cccc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000824707104 608158766 /nfs/dbraw/zinc/15/87/66/608158766.db2.gz NMFYVQRXQZNSIN-QWRGUYRKSA-N -1 3 358.348 3.553 20 0 FHADHM C[C@H](OC(=O)[C@@H](C)c1c(F)cccc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000824707104 608158769 /nfs/dbraw/zinc/15/87/69/608158769.db2.gz NMFYVQRXQZNSIN-QWRGUYRKSA-N -1 3 358.348 3.553 20 0 FHADHM C[C@@H](OC(=O)c1cc(F)c(Cl)cc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000824723534 608159099 /nfs/dbraw/zinc/15/90/99/608159099.db2.gz RWGKDULXWIOHOI-MRVPVSSYSA-N -1 3 364.739 3.716 20 0 FHADHM C[C@@H](OC(=O)c1cc(F)c(Cl)cc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000824723534 608159100 /nfs/dbraw/zinc/15/91/00/608159100.db2.gz RWGKDULXWIOHOI-MRVPVSSYSA-N -1 3 364.739 3.716 20 0 FHADHM C[C@@H](C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1c(F)cccc1F ZINC000824707103 608159158 /nfs/dbraw/zinc/15/91/58/608159158.db2.gz NMFYVQRXQZNSIN-MNOVXSKESA-N -1 3 358.348 3.553 20 0 FHADHM C[C@@H](C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1c(F)cccc1F ZINC000824707103 608159159 /nfs/dbraw/zinc/15/91/59/608159159.db2.gz NMFYVQRXQZNSIN-MNOVXSKESA-N -1 3 358.348 3.553 20 0 FHADHM C[C@H](OC(=O)c1ccccc1Br)c1cccc(-c2nnn[n-]2)c1 ZINC000824721925 608181848 /nfs/dbraw/zinc/18/18/48/608181848.db2.gz FOIFBRIKEGYGPE-JTQLQIEISA-N -1 3 373.210 3.547 20 0 FHADHM C[C@H](OC(=O)c1ccccc1Br)c1cccc(-c2nn[n-]n2)c1 ZINC000824721925 608181850 /nfs/dbraw/zinc/18/18/50/608181850.db2.gz FOIFBRIKEGYGPE-JTQLQIEISA-N -1 3 373.210 3.547 20 0 FHADHM Cc1cccc(C2=CCN(C(=O)Nc3cccc(-c4nnn[n-]4)c3C)CC2)c1 ZINC000826297348 608209821 /nfs/dbraw/zinc/20/98/21/608209821.db2.gz DKIUWHLFAFNTER-UHFFFAOYSA-N -1 3 374.448 3.805 20 0 FHADHM Cc1cccc(C2=CCN(C(=O)Nc3cccc(-c4nn[n-]n4)c3C)CC2)c1 ZINC000826297348 608209824 /nfs/dbraw/zinc/20/98/24/608209824.db2.gz DKIUWHLFAFNTER-UHFFFAOYSA-N -1 3 374.448 3.805 20 0 FHADHM c1cnc2c(c1)cccc2CCNc1ccc2cc(-c3nnn[n-]3)ccc2n1 ZINC000826525227 608222144 /nfs/dbraw/zinc/22/21/44/608222144.db2.gz BDCVPKIJRUKCAJ-UHFFFAOYSA-N -1 3 367.416 3.618 20 0 FHADHM c1cnc2c(c1)cccc2CCNc1ccc2cc(-c3nn[n-]n3)ccc2n1 ZINC000826525227 608222145 /nfs/dbraw/zinc/22/21/45/608222145.db2.gz BDCVPKIJRUKCAJ-UHFFFAOYSA-N -1 3 367.416 3.618 20 0 FHADHM Cc1ccccc1[C@@H]1CCN(c2ccc3cc(-c4nnn[n-]4)ccc3n2)C1 ZINC000826306685 608225237 /nfs/dbraw/zinc/22/52/37/608225237.db2.gz HYFOIWRYCLPDAF-QGZVFWFLSA-N -1 3 356.433 3.717 20 0 FHADHM Cc1ccccc1[C@@H]1CCN(c2ccc3cc(-c4nn[n-]n4)ccc3n2)C1 ZINC000826306685 608225239 /nfs/dbraw/zinc/22/52/39/608225239.db2.gz HYFOIWRYCLPDAF-QGZVFWFLSA-N -1 3 356.433 3.717 20 0 FHADHM c1ccc(Oc2ccc(CSc3ccccc3-c3nnn[n-]3)nn2)cc1 ZINC000826523019 608231252 /nfs/dbraw/zinc/23/12/52/608231252.db2.gz XJIUOJSGXYWOJV-UHFFFAOYSA-N -1 3 362.418 3.741 20 0 FHADHM c1ccc(Oc2ccc(CSc3ccccc3-c3nn[n-]n3)nn2)cc1 ZINC000826523019 608231254 /nfs/dbraw/zinc/23/12/54/608231254.db2.gz XJIUOJSGXYWOJV-UHFFFAOYSA-N -1 3 362.418 3.741 20 0 FHADHM c1cc2nc(N[C@H]3CCOC4(CCCCC4)C3)ccc2cc1-c1nnn[n-]1 ZINC000826518336 608234001 /nfs/dbraw/zinc/23/40/01/608234001.db2.gz JVGAWTSHGFLKSW-INIZCTEOSA-N -1 3 364.453 3.709 20 0 FHADHM c1cc2nc(N[C@H]3CCOC4(CCCCC4)C3)ccc2cc1-c1nn[n-]n1 ZINC000826518336 608234003 /nfs/dbraw/zinc/23/40/03/608234003.db2.gz JVGAWTSHGFLKSW-INIZCTEOSA-N -1 3 364.453 3.709 20 0 FHADHM Fc1cccc([C@@H](Nc2ccc(F)cc2-c2nnn[n-]2)c2ccccn2)c1 ZINC000826376902 608234642 /nfs/dbraw/zinc/23/46/42/608234642.db2.gz XROAHOXUIAQNHK-GOSISDBHSA-N -1 3 364.359 3.741 20 0 FHADHM Fc1cccc([C@@H](Nc2ccc(F)cc2-c2nn[n-]n2)c2ccccn2)c1 ZINC000826376902 608234644 /nfs/dbraw/zinc/23/46/44/608234644.db2.gz XROAHOXUIAQNHK-GOSISDBHSA-N -1 3 364.359 3.741 20 0 FHADHM Cc1nc(-c2ccc(CNc3nc(C)ccc3-c3nnn[n-]3)s2)cs1 ZINC000826276348 608270846 /nfs/dbraw/zinc/27/08/46/608270846.db2.gz BMQSMHOFHCGLDV-UHFFFAOYSA-N -1 3 369.479 3.676 20 0 FHADHM Cc1nc(-c2ccc(CNc3nc(C)ccc3-c3nn[n-]n3)s2)cs1 ZINC000826276348 608270848 /nfs/dbraw/zinc/27/08/48/608270848.db2.gz BMQSMHOFHCGLDV-UHFFFAOYSA-N -1 3 369.479 3.676 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)c(NCc2ccc(OCc3ccccc3)cc2)n1 ZINC000826276458 608275737 /nfs/dbraw/zinc/27/57/37/608275737.db2.gz HUPRKJKYNXHDEK-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)c(NCc2ccc(OCc3ccccc3)cc2)n1 ZINC000826276458 608275739 /nfs/dbraw/zinc/27/57/39/608275739.db2.gz HUPRKJKYNXHDEK-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM Cc1cnc(NCc2ccc(-c3ccccc3-c3nnn[n-]3)cc2)nc1C ZINC000826318959 608294537 /nfs/dbraw/zinc/29/45/37/608294537.db2.gz ICXIXITUAGIMLR-UHFFFAOYSA-N -1 3 357.421 3.553 20 0 FHADHM Cc1cnc(NCc2ccc(-c3ccccc3-c3nn[n-]n3)cc2)nc1C ZINC000826318959 608294538 /nfs/dbraw/zinc/29/45/38/608294538.db2.gz ICXIXITUAGIMLR-UHFFFAOYSA-N -1 3 357.421 3.553 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)c(N2CC=C(c3ccc(Cl)cc3)CC2)n1 ZINC000826274485 608295376 /nfs/dbraw/zinc/29/53/76/608295376.db2.gz SLIUOQZUGWRVSN-UHFFFAOYSA-N -1 3 352.829 3.517 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)c(N2CC=C(c3ccc(Cl)cc3)CC2)n1 ZINC000826274485 608295378 /nfs/dbraw/zinc/29/53/78/608295378.db2.gz SLIUOQZUGWRVSN-UHFFFAOYSA-N -1 3 352.829 3.517 20 0 FHADHM COC[C@@H](Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccc(F)c(F)c1 ZINC000826152103 608299229 /nfs/dbraw/zinc/29/92/29/608299229.db2.gz QXLNFVFAMDPDSI-OAHLLOKOSA-N -1 3 365.771 3.598 20 0 FHADHM COC[C@@H](Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccc(F)c(F)c1 ZINC000826152103 608299230 /nfs/dbraw/zinc/29/92/30/608299230.db2.gz QXLNFVFAMDPDSI-OAHLLOKOSA-N -1 3 365.771 3.598 20 0 FHADHM Cc1scc(C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)c1C ZINC000826350092 608301652 /nfs/dbraw/zinc/30/16/52/608301652.db2.gz IARKXYBPUJXOEG-UHFFFAOYSA-N -1 3 355.467 3.596 20 0 FHADHM Cc1scc(C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)c1C ZINC000826350092 608301653 /nfs/dbraw/zinc/30/16/53/608301653.db2.gz IARKXYBPUJXOEG-UHFFFAOYSA-N -1 3 355.467 3.596 20 0 FHADHM Cc1cc(C(=O)NCc2ccc(-c3ccccc3-c3nnn[n-]3)cc2)c(C)o1 ZINC000826260026 608305725 /nfs/dbraw/zinc/30/57/25/608305725.db2.gz ROCYUQVVZWVKKT-UHFFFAOYSA-N -1 3 373.416 3.674 20 0 FHADHM Cc1cc(C(=O)NCc2ccc(-c3ccccc3-c3nn[n-]n3)cc2)c(C)o1 ZINC000826260026 608305727 /nfs/dbraw/zinc/30/57/27/608305727.db2.gz ROCYUQVVZWVKKT-UHFFFAOYSA-N -1 3 373.416 3.674 20 0 FHADHM C[C@@H]1CCN(C(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)C[C@@H]1C ZINC000824955453 608312949 /nfs/dbraw/zinc/31/29/49/608312949.db2.gz OVVAZJHOLQCZEP-CABCVRRESA-N -1 3 361.449 3.652 20 0 FHADHM C[C@@H]1CCN(C(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)C[C@@H]1C ZINC000824955453 608312951 /nfs/dbraw/zinc/31/29/51/608312951.db2.gz OVVAZJHOLQCZEP-CABCVRRESA-N -1 3 361.449 3.652 20 0 FHADHM C[C@H]1CN(C(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)CC[C@@H]1C ZINC000824955455 608313327 /nfs/dbraw/zinc/31/33/27/608313327.db2.gz OVVAZJHOLQCZEP-GJZGRUSLSA-N -1 3 361.449 3.652 20 0 FHADHM C[C@H]1CN(C(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)CC[C@@H]1C ZINC000824955455 608313329 /nfs/dbraw/zinc/31/33/29/608313329.db2.gz OVVAZJHOLQCZEP-GJZGRUSLSA-N -1 3 361.449 3.652 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)Cc2c(C)cc(C)cc2C)s1 ZINC000825693916 608341077 /nfs/dbraw/zinc/34/10/77/608341077.db2.gz HRYIAFYDXQZFEF-UHFFFAOYSA-N -1 3 355.467 3.597 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)Cc2c(C)cc(C)cc2C)s1 ZINC000825693916 608341078 /nfs/dbraw/zinc/34/10/78/608341078.db2.gz HRYIAFYDXQZFEF-UHFFFAOYSA-N -1 3 355.467 3.597 20 0 FHADHM CCOc1ccc(C(=O)N(CC)c2ccc(-c3nnn[n-]3)c(Cl)c2)cc1 ZINC000825632286 608346318 /nfs/dbraw/zinc/34/63/18/608346318.db2.gz OASRLXSTZSETSL-UHFFFAOYSA-N -1 3 371.828 3.586 20 0 FHADHM CCOc1ccc(C(=O)N(CC)c2ccc(-c3nn[n-]n3)c(Cl)c2)cc1 ZINC000825632286 608346320 /nfs/dbraw/zinc/34/63/20/608346320.db2.gz OASRLXSTZSETSL-UHFFFAOYSA-N -1 3 371.828 3.586 20 0 FHADHM CCN(C(=O)c1cccc2c1CCC2)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825385570 608347040 /nfs/dbraw/zinc/34/70/40/608347040.db2.gz LGFJAMVPZYQQKX-UHFFFAOYSA-N -1 3 367.840 3.676 20 0 FHADHM CCN(C(=O)c1cccc2c1CCC2)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825385570 608347041 /nfs/dbraw/zinc/34/70/41/608347041.db2.gz LGFJAMVPZYQQKX-UHFFFAOYSA-N -1 3 367.840 3.676 20 0 FHADHM Fc1c(CSc2nccn2Cc2ccccc2)cccc1-c1nnn[n-]1 ZINC000826371310 608394793 /nfs/dbraw/zinc/39/47/93/608394793.db2.gz BIFVZSIDNMXXEL-UHFFFAOYSA-N -1 3 366.425 3.543 20 0 FHADHM Fc1c(CSc2nccn2Cc2ccccc2)cccc1-c1nn[n-]n1 ZINC000826371310 608394795 /nfs/dbraw/zinc/39/47/95/608394795.db2.gz BIFVZSIDNMXXEL-UHFFFAOYSA-N -1 3 366.425 3.543 20 0 FHADHM COc1cc(C(C)=O)ccc1SCc1cccc(-c2nnn[n-]2)c1F ZINC000826177690 608399916 /nfs/dbraw/zinc/39/99/16/608399916.db2.gz QZKSBNGJMIQORL-UHFFFAOYSA-N -1 3 358.398 3.509 20 0 FHADHM COc1cc(C(C)=O)ccc1SCc1cccc(-c2nn[n-]n2)c1F ZINC000826177690 608399918 /nfs/dbraw/zinc/39/99/18/608399918.db2.gz QZKSBNGJMIQORL-UHFFFAOYSA-N -1 3 358.398 3.509 20 0 FHADHM Cc1oc(-c2ccsc2)nc1CN[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000826340580 608460297 /nfs/dbraw/zinc/46/02/97/608460297.db2.gz DDIDNDGUYWBIQS-NSHDSACASA-N -1 3 366.450 3.742 20 0 FHADHM C[C@H](CC1CCCC1)C(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000824392447 608477983 /nfs/dbraw/zinc/47/79/83/608477983.db2.gz OCFOAPDXTGJPGT-OAHLLOKOSA-N -1 3 365.481 3.699 20 0 FHADHM C[C@H](CC1CCCC1)C(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000824392447 608477986 /nfs/dbraw/zinc/47/79/86/608477986.db2.gz OCFOAPDXTGJPGT-OAHLLOKOSA-N -1 3 365.481 3.699 20 0 FHADHM CC(C)(C(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1)C1CCCC1 ZINC000824058861 608479567 /nfs/dbraw/zinc/47/95/67/608479567.db2.gz GBVVVFIFEUFCPW-UHFFFAOYSA-N -1 3 365.481 3.699 20 0 FHADHM CC(C)(C(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1)C1CCCC1 ZINC000824058861 608479570 /nfs/dbraw/zinc/47/95/70/608479570.db2.gz GBVVVFIFEUFCPW-UHFFFAOYSA-N -1 3 365.481 3.699 20 0 FHADHM CC(C)C[C@@H](C)CC(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000824228775 608481628 /nfs/dbraw/zinc/48/16/28/608481628.db2.gz KTKHIMABCXKZGN-OAHLLOKOSA-N -1 3 353.470 3.555 20 0 FHADHM CC(C)C[C@@H](C)CC(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000824228775 608481630 /nfs/dbraw/zinc/48/16/30/608481630.db2.gz KTKHIMABCXKZGN-OAHLLOKOSA-N -1 3 353.470 3.555 20 0 FHADHM C[C@H](NCc1ncc(-c2ccccc2F)o1)c1cccc(-c2nn[n-]n2)c1 ZINC000824633385 608484735 /nfs/dbraw/zinc/48/47/35/608484735.db2.gz MBQYBMUKSBFXGT-LBPRGKRZSA-N -1 3 364.384 3.512 20 0 FHADHM c1oc(-c2ccccc2)nc1CN[C@@H]1CCCc2cc(-c3nn[n-]n3)ccc21 ZINC000826519108 608515035 /nfs/dbraw/zinc/51/50/35/608515035.db2.gz KKHHXYZKNNKHQY-LJQANCHMSA-N -1 3 372.432 3.689 20 0 FHADHM C[C@@H]1C[C@@H]1c1ccc(CN(Cc2ccc(-c3nnn[n-]3)s2)C2CC2)o1 ZINC000824899616 608518601 /nfs/dbraw/zinc/51/86/01/608518601.db2.gz LSYWAFYOQMILFR-ABAIWWIYSA-N -1 3 355.467 3.809 20 0 FHADHM C[C@@H]1C[C@@H]1c1ccc(CN(Cc2ccc(-c3nn[n-]n3)s2)C2CC2)o1 ZINC000824899616 608518602 /nfs/dbraw/zinc/51/86/02/608518602.db2.gz LSYWAFYOQMILFR-ABAIWWIYSA-N -1 3 355.467 3.809 20 0 FHADHM C[C@H](NC(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1)c1cccc(Cl)c1 ZINC000824522109 608572995 /nfs/dbraw/zinc/57/29/95/608572995.db2.gz QFQRQVGLJVJEJJ-VIFPVBQESA-N -1 3 362.220 3.665 20 0 FHADHM C[C@H](NC(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1)c1cccc(Cl)c1 ZINC000824522109 608572997 /nfs/dbraw/zinc/57/29/97/608572997.db2.gz QFQRQVGLJVJEJJ-VIFPVBQESA-N -1 3 362.220 3.665 20 0 FHADHM Fc1c(CN(Cc2ccco2)Cc2ccccc2)cccc1-c1nnn[n-]1 ZINC000826370108 608645738 /nfs/dbraw/zinc/64/57/38/608645738.db2.gz DUNRBMQZKJLFKL-UHFFFAOYSA-N -1 3 363.396 3.801 20 0 FHADHM Fc1c(CN(Cc2ccco2)Cc2ccccc2)cccc1-c1nn[n-]n1 ZINC000826370108 608645741 /nfs/dbraw/zinc/64/57/41/608645741.db2.gz DUNRBMQZKJLFKL-UHFFFAOYSA-N -1 3 363.396 3.801 20 0 FHADHM Cc1sc2ncnc(SCc3cccc(-c4nnn[n-]4)c3F)c2c1C ZINC000826350144 608669488 /nfs/dbraw/zinc/66/94/88/608669488.db2.gz JWBVWGXLCILPGB-UHFFFAOYSA-N -1 3 372.454 3.920 20 0 FHADHM Cc1sc2ncnc(SCc3cccc(-c4nn[n-]n4)c3F)c2c1C ZINC000826350144 608669489 /nfs/dbraw/zinc/66/94/89/608669489.db2.gz JWBVWGXLCILPGB-UHFFFAOYSA-N -1 3 372.454 3.920 20 0 FHADHM CN(Cc1cc(-c2nnn[n-]2)cs1)[C@H](c1ccccc1)C(F)(F)F ZINC000825953969 608677757 /nfs/dbraw/zinc/67/77/57/608677757.db2.gz UHKIYHIYMWBAOB-CYBMUJFWSA-N -1 3 353.373 3.664 20 0 FHADHM CN(Cc1cc(-c2nn[n-]n2)cs1)[C@H](c1ccccc1)C(F)(F)F ZINC000825953969 608677761 /nfs/dbraw/zinc/67/77/61/608677761.db2.gz UHKIYHIYMWBAOB-CYBMUJFWSA-N -1 3 353.373 3.664 20 0 FHADHM CCc1ccc(NC(=O)N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1C ZINC000825712395 608819894 /nfs/dbraw/zinc/81/98/94/608819894.db2.gz QHJOEZMYGDLUOZ-ZDUSSCGKSA-N -1 3 350.426 3.620 20 0 FHADHM CCc1ccc(NC(=O)N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1C ZINC000825712395 608819897 /nfs/dbraw/zinc/81/98/97/608819897.db2.gz QHJOEZMYGDLUOZ-ZDUSSCGKSA-N -1 3 350.426 3.620 20 0 FHADHM Fc1ccc([C@H]2CCCCN2Cc2cc(-c3nnn[n-]3)cs2)c(F)c1 ZINC000826374380 608848527 /nfs/dbraw/zinc/84/85/27/608848527.db2.gz XBJQZKUVIUWZCI-MRXNPFEDSA-N -1 3 361.421 3.934 20 0 FHADHM Fc1ccc([C@H]2CCCCN2Cc2cc(-c3nn[n-]n3)cs2)c(F)c1 ZINC000826374380 608848528 /nfs/dbraw/zinc/84/85/28/608848528.db2.gz XBJQZKUVIUWZCI-MRXNPFEDSA-N -1 3 361.421 3.934 20 0 FHADHM COc1ccc(CNc2cccc(-c3nnn[n-]3)c2)cc1OCC(C)C ZINC000826204135 608872195 /nfs/dbraw/zinc/87/21/95/608872195.db2.gz ZFALYYJZMJOFLS-UHFFFAOYSA-N -1 3 353.426 3.522 20 0 FHADHM COc1ccc(CNc2cccc(-c3nn[n-]n3)c2)cc1OCC(C)C ZINC000826204135 608872197 /nfs/dbraw/zinc/87/21/97/608872197.db2.gz ZFALYYJZMJOFLS-UHFFFAOYSA-N -1 3 353.426 3.522 20 0 FHADHM Fc1cccc(F)c1[C@@H](NCc1ccccc1-c1nnn[n-]1)C(F)(F)F ZINC000826377223 609152826 /nfs/dbraw/zinc/15/28/26/609152826.db2.gz JPIJNCOILGUFSZ-CQSZACIVSA-N -1 3 369.297 3.538 20 0 FHADHM Fc1cccc(F)c1[C@@H](NCc1ccccc1-c1nn[n-]n1)C(F)(F)F ZINC000826377223 609152827 /nfs/dbraw/zinc/15/28/27/609152827.db2.gz JPIJNCOILGUFSZ-CQSZACIVSA-N -1 3 369.297 3.538 20 0 FHADHM CCC(=O)Nc1ccc(C)c(N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000825034572 609157778 /nfs/dbraw/zinc/15/77/78/609157778.db2.gz LXNIDOJCHMPODL-CYBMUJFWSA-N -1 3 350.426 3.697 20 0 FHADHM CCC(=O)Nc1ccc(C)c(N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000825034572 609157779 /nfs/dbraw/zinc/15/77/79/609157779.db2.gz LXNIDOJCHMPODL-CYBMUJFWSA-N -1 3 350.426 3.697 20 0 FHADHM CC(=O)Nc1ccc(N[C@@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)cc1Cl ZINC000823999843 609163860 /nfs/dbraw/zinc/16/38/60/609163860.db2.gz JFGNGBLQRVFGAD-VIFPVBQESA-N -1 3 374.807 3.791 20 0 FHADHM CC(=O)Nc1ccc(N[C@@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)cc1Cl ZINC000823999843 609163863 /nfs/dbraw/zinc/16/38/63/609163863.db2.gz JFGNGBLQRVFGAD-VIFPVBQESA-N -1 3 374.807 3.791 20 0 FHADHM C[C@H]1CCN(c2ccc3cc(-c4nnn[n-]4)ccc3n2)[C@@H](c2ccco2)C1 ZINC000824963033 609164632 /nfs/dbraw/zinc/16/46/32/609164632.db2.gz YUAIWWSZLXLSKX-SUMWQHHRSA-N -1 3 360.421 3.986 20 0 FHADHM C[C@H]1CCN(c2ccc3cc(-c4nn[n-]n4)ccc3n2)[C@@H](c2ccco2)C1 ZINC000824963033 609164633 /nfs/dbraw/zinc/16/46/33/609164633.db2.gz YUAIWWSZLXLSKX-SUMWQHHRSA-N -1 3 360.421 3.986 20 0 FHADHM CC(C)C[C@@H]1C[C@H](Nc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)CCO1 ZINC000824245420 609171743 /nfs/dbraw/zinc/17/17/43/609171743.db2.gz ZMVCKDGTLCYNQX-CHWSQXEVSA-N -1 3 369.391 3.891 20 0 FHADHM CC(C)C[C@@H]1C[C@H](Nc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)CCO1 ZINC000824245420 609171745 /nfs/dbraw/zinc/17/17/45/609171745.db2.gz ZMVCKDGTLCYNQX-CHWSQXEVSA-N -1 3 369.391 3.891 20 0 FHADHM Cc1cc(C)c(-c2nnn[n-]2)c(SCc2ncc(Cl)cc2Cl)n1 ZINC000826263364 609175031 /nfs/dbraw/zinc/17/50/31/609175031.db2.gz XKONCGHFFXMTKA-UHFFFAOYSA-N -1 3 367.265 3.873 20 0 FHADHM Cc1cc(C)c(-c2nn[n-]n2)c(SCc2ncc(Cl)cc2Cl)n1 ZINC000826263364 609175032 /nfs/dbraw/zinc/17/50/32/609175032.db2.gz XKONCGHFFXMTKA-UHFFFAOYSA-N -1 3 367.265 3.873 20 0 FHADHM C[C@@H](Nc1cc(F)c(N2CCCC2)c(F)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824648949 609179906 /nfs/dbraw/zinc/17/99/06/609179906.db2.gz JWVBAJKJFSCFGW-GFCCVEGCSA-N -1 3 370.407 3.918 20 0 FHADHM C[C@@H](Nc1cc(F)c(N2CCCC2)c(F)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824648949 609179908 /nfs/dbraw/zinc/17/99/08/609179908.db2.gz JWVBAJKJFSCFGW-GFCCVEGCSA-N -1 3 370.407 3.918 20 0 FHADHM CC(=O)Nc1c(C)ccc(N[C@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)c1C ZINC000823994660 609180028 /nfs/dbraw/zinc/18/00/28/609180028.db2.gz MCOYUHPBONCPGE-GFCCVEGCSA-N -1 3 368.416 3.754 20 0 FHADHM CC(=O)Nc1c(C)ccc(N[C@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)c1C ZINC000823994660 609180030 /nfs/dbraw/zinc/18/00/30/609180030.db2.gz MCOYUHPBONCPGE-GFCCVEGCSA-N -1 3 368.416 3.754 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)C1(c2ccc(F)cc2F)CCC1 ZINC000826277120 609180934 /nfs/dbraw/zinc/18/09/34/609180934.db2.gz JXKGICOBJZRBER-UHFFFAOYSA-N -1 3 369.375 3.514 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)C1(c2ccc(F)cc2F)CCC1 ZINC000826277120 609180937 /nfs/dbraw/zinc/18/09/37/609180937.db2.gz JXKGICOBJZRBER-UHFFFAOYSA-N -1 3 369.375 3.514 20 0 FHADHM Cc1cc(NCc2cc(-c3nnn[n-]3)cs2)nn1-c1cc(C)cc(C)c1 ZINC000826264151 609188061 /nfs/dbraw/zinc/18/80/61/609188061.db2.gz DOPHDSVKVJZOMK-UHFFFAOYSA-N -1 3 365.466 3.651 20 0 FHADHM Cc1cc(NCc2cc(-c3nn[n-]n3)cs2)nn1-c1cc(C)cc(C)c1 ZINC000826264151 609188063 /nfs/dbraw/zinc/18/80/63/609188063.db2.gz DOPHDSVKVJZOMK-UHFFFAOYSA-N -1 3 365.466 3.651 20 0 FHADHM Clc1ccc(NCc2cnc(-c3ccncc3)s2)cc1-c1nnn[n-]1 ZINC000826352895 609199994 /nfs/dbraw/zinc/19/99/94/609199994.db2.gz RTUKCVAFMFMWFJ-UHFFFAOYSA-N -1 3 369.841 3.651 20 0 FHADHM Clc1ccc(NCc2cnc(-c3ccncc3)s2)cc1-c1nn[n-]n1 ZINC000826352895 609199995 /nfs/dbraw/zinc/19/99/95/609199995.db2.gz RTUKCVAFMFMWFJ-UHFFFAOYSA-N -1 3 369.841 3.651 20 0 FHADHM C[C@H](Nc1ccc(OC[C@@H]2CCCO2)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000824655561 609236575 /nfs/dbraw/zinc/23/65/75/609236575.db2.gz DQKQDPWKSSCGIR-LIRRHRJNSA-N -1 3 365.437 3.598 20 0 FHADHM C[C@H](Nc1ccc(OC[C@@H]2CCCO2)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000824655561 609236577 /nfs/dbraw/zinc/23/65/77/609236577.db2.gz DQKQDPWKSSCGIR-LIRRHRJNSA-N -1 3 365.437 3.598 20 0 FHADHM C[C@@H](Nc1cccc(OC[C@H]2CCCO2)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824662829 609236870 /nfs/dbraw/zinc/23/68/70/609236870.db2.gz SBBMLQVGZZTTCM-AUUYWEPGSA-N -1 3 365.437 3.598 20 0 FHADHM C[C@@H](Nc1cccc(OC[C@H]2CCCO2)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824662829 609236871 /nfs/dbraw/zinc/23/68/71/609236871.db2.gz SBBMLQVGZZTTCM-AUUYWEPGSA-N -1 3 365.437 3.598 20 0 FHADHM CCOc1ccc2nc(NCc3ccc(-c4nnn[n-]4)cc3F)sc2c1 ZINC000825648844 609264068 /nfs/dbraw/zinc/26/40/68/609264068.db2.gz DSFXBDLKMDDWJY-UHFFFAOYSA-N -1 3 370.413 3.626 20 0 FHADHM CCOc1ccc2nc(NCc3ccc(-c4nn[n-]n4)cc3F)sc2c1 ZINC000825648844 609264070 /nfs/dbraw/zinc/26/40/70/609264070.db2.gz DSFXBDLKMDDWJY-UHFFFAOYSA-N -1 3 370.413 3.626 20 0 FHADHM c1cc(-c2nnn[n-]2)sc1CNc1ccc(OCc2ccccc2)nc1 ZINC000826522067 609266529 /nfs/dbraw/zinc/26/65/29/609266529.db2.gz LAUBQMMKPKTBHB-UHFFFAOYSA-N -1 3 364.434 3.514 20 0 FHADHM CC1(C)Oc2ccc(N[C@@H]3CCCc4cc(-c5nnn[n-]5)ccc43)cc2O1 ZINC000824818715 609274947 /nfs/dbraw/zinc/27/49/47/609274947.db2.gz VIWOXZVTOJABNF-MRXNPFEDSA-N -1 3 363.421 3.864 20 0 FHADHM CC1(C)Oc2ccc(N[C@@H]3CCCc4cc(-c5nn[n-]n5)ccc43)cc2O1 ZINC000824818715 609274949 /nfs/dbraw/zinc/27/49/49/609274949.db2.gz VIWOXZVTOJABNF-MRXNPFEDSA-N -1 3 363.421 3.864 20 0 FHADHM Cc1cc(Cl)c(C(=O)N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1C ZINC000826267549 609278697 /nfs/dbraw/zinc/27/86/97/609278697.db2.gz KLGBMHWOZYMZRW-LBPRGKRZSA-N -1 3 355.829 3.628 20 0 FHADHM Cc1cc(Cl)c(C(=O)N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1C ZINC000826267549 609278699 /nfs/dbraw/zinc/27/86/99/609278699.db2.gz KLGBMHWOZYMZRW-LBPRGKRZSA-N -1 3 355.829 3.628 20 0 FHADHM Cc1cc(Cl)c(C(=O)Nc2cc(-c3nnn[n-]3)cn2C(C)(C)C)cc1C ZINC000826267738 609280967 /nfs/dbraw/zinc/28/09/67/609280967.db2.gz TWOQLCNAHFBQHS-UHFFFAOYSA-N -1 3 372.860 3.946 20 0 FHADHM Cc1cc(Cl)c(C(=O)Nc2cc(-c3nn[n-]n3)cn2C(C)(C)C)cc1C ZINC000826267738 609280969 /nfs/dbraw/zinc/28/09/69/609280969.db2.gz TWOQLCNAHFBQHS-UHFFFAOYSA-N -1 3 372.860 3.946 20 0 FHADHM Cc1cc(C)c2c(c1)N(C(=O)c1ccc(Cl)c(-c3nnn[n-]3)c1)CCC2 ZINC000826263676 609299046 /nfs/dbraw/zinc/29/90/46/609299046.db2.gz LYLYFTAROKAHMM-UHFFFAOYSA-N -1 3 367.840 3.730 20 0 FHADHM Cc1cc(C)c2c(c1)N(C(=O)c1ccc(Cl)c(-c3nn[n-]n3)c1)CCC2 ZINC000826263676 609299047 /nfs/dbraw/zinc/29/90/47/609299047.db2.gz LYLYFTAROKAHMM-UHFFFAOYSA-N -1 3 367.840 3.730 20 0 FHADHM CCCCN(CC)C(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000825281338 609311120 /nfs/dbraw/zinc/31/11/20/609311120.db2.gz ABMPUDWYWHYLNJ-UHFFFAOYSA-N -1 3 365.437 3.921 20 0 FHADHM CCCCN(CC)C(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000825281338 609311121 /nfs/dbraw/zinc/31/11/21/609311121.db2.gz ABMPUDWYWHYLNJ-UHFFFAOYSA-N -1 3 365.437 3.921 20 0 FHADHM Oc1ccccc1SCc1ccc(-c2nnn[n-]2)cc1Br ZINC000826511639 609311966 /nfs/dbraw/zinc/31/19/66/609311966.db2.gz YJQCVPAEYIBOOK-UHFFFAOYSA-N -1 3 363.240 3.627 20 0 FHADHM Oc1ccccc1SCc1ccc(-c2nn[n-]n2)cc1Br ZINC000826511639 609311967 /nfs/dbraw/zinc/31/19/67/609311967.db2.gz YJQCVPAEYIBOOK-UHFFFAOYSA-N -1 3 363.240 3.627 20 0 FHADHM CCC[C@H](C)N(C)C(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000825231817 609314634 /nfs/dbraw/zinc/31/46/34/609314634.db2.gz ALGDRTMQUIJMKV-AWEZNQCLSA-N -1 3 365.437 3.920 20 0 FHADHM CCC[C@H](C)N(C)C(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000825231817 609314636 /nfs/dbraw/zinc/31/46/36/609314636.db2.gz ALGDRTMQUIJMKV-AWEZNQCLSA-N -1 3 365.437 3.920 20 0 FHADHM Cc1nn(-c2ccccc2)cc1CNc1c(Cl)cccc1-c1nnn[n-]1 ZINC000826333108 609317046 /nfs/dbraw/zinc/31/70/46/609317046.db2.gz UMGWVCDXVUXFKE-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM Cc1nn(-c2ccccc2)cc1CNc1c(Cl)cccc1-c1nn[n-]n1 ZINC000826333108 609317047 /nfs/dbraw/zinc/31/70/47/609317047.db2.gz UMGWVCDXVUXFKE-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM CCC(CC)[C@H]1C[C@H](Nc2ccc3cc(-c4nnn[n-]4)ccc3n2)CCO1 ZINC000825108339 609322112 /nfs/dbraw/zinc/32/21/12/609322112.db2.gz VYMBRFKHRDXHSQ-SJLPKXTDSA-N -1 3 366.469 3.811 20 0 FHADHM CCC(CC)[C@H]1C[C@H](Nc2ccc3cc(-c4nn[n-]n4)ccc3n2)CCO1 ZINC000825108339 609322114 /nfs/dbraw/zinc/32/21/14/609322114.db2.gz VYMBRFKHRDXHSQ-SJLPKXTDSA-N -1 3 366.469 3.811 20 0 FHADHM COc1ccc(F)cc1[C@@H](C)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1F ZINC000826209156 609328006 /nfs/dbraw/zinc/32/80/06/609328006.db2.gz PBVFSHAKWQUWCB-WDEREUQCSA-N -1 3 359.380 3.565 20 0 FHADHM COc1ccc(F)cc1[C@@H](C)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000826209156 609328007 /nfs/dbraw/zinc/32/80/07/609328007.db2.gz PBVFSHAKWQUWCB-WDEREUQCSA-N -1 3 359.380 3.565 20 0 FHADHM C[C@@H](N[C@H](c1ccccc1)c1ccncc1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824540169 609330348 /nfs/dbraw/zinc/33/03/48/609330348.db2.gz SJDOXSVDEZDBQQ-JLTOFOAXSA-N -1 3 374.423 3.841 20 0 FHADHM C[C@@H](N[C@H](c1ccccc1)c1ccncc1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824540169 609330349 /nfs/dbraw/zinc/33/03/49/609330349.db2.gz SJDOXSVDEZDBQQ-JLTOFOAXSA-N -1 3 374.423 3.841 20 0 FHADHM CC(C)COC[C@H](N[C@H](C)c1ccc(-c2nnn[n-]2)cc1F)c1ccco1 ZINC000824266788 609331529 /nfs/dbraw/zinc/33/15/29/609331529.db2.gz QIJNBZPKWLNGLX-DYVFJYSZSA-N -1 3 373.432 3.663 20 0 FHADHM CC(C)COC[C@H](N[C@H](C)c1ccc(-c2nn[n-]n2)cc1F)c1ccco1 ZINC000824266788 609331531 /nfs/dbraw/zinc/33/15/31/609331531.db2.gz QIJNBZPKWLNGLX-DYVFJYSZSA-N -1 3 373.432 3.663 20 0 FHADHM CSc1ccc(F)cc1CN[C@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000826230886 609338945 /nfs/dbraw/zinc/33/89/45/609338945.db2.gz NVKHDXFXYAKGLO-SNVBAGLBSA-N -1 3 361.421 3.718 20 0 FHADHM C[C@H](NCc1csc(-c2ccco2)n1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824626132 609339935 /nfs/dbraw/zinc/33/99/35/609339935.db2.gz MJEBBRZYBZORBK-JTQLQIEISA-N -1 3 370.413 3.573 20 0 FHADHM C[C@H](NCc1csc(-c2ccco2)n1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824626132 609339936 /nfs/dbraw/zinc/33/99/36/609339936.db2.gz MJEBBRZYBZORBK-JTQLQIEISA-N -1 3 370.413 3.573 20 0 FHADHM CC(=O)Nc1c(C)ccc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2F)c1C ZINC000823993887 609345744 /nfs/dbraw/zinc/34/57/44/609345744.db2.gz BJKRKBWUWSAQKW-LBPRGKRZSA-N -1 3 368.416 3.754 20 0 FHADHM CC(=O)Nc1c(C)ccc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2F)c1C ZINC000823993887 609345747 /nfs/dbraw/zinc/34/57/47/609345747.db2.gz BJKRKBWUWSAQKW-LBPRGKRZSA-N -1 3 368.416 3.754 20 0 FHADHM C[C@@H](Nc1ccc(-c2csnn2)cc1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824651454 609348437 /nfs/dbraw/zinc/34/84/37/609348437.db2.gz ZTOPUZVIFLKLLM-SNVBAGLBSA-N -1 3 367.413 3.697 20 0 FHADHM C[C@@H](Nc1ccc(-c2csnn2)cc1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824651454 609348438 /nfs/dbraw/zinc/34/84/38/609348438.db2.gz ZTOPUZVIFLKLLM-SNVBAGLBSA-N -1 3 367.413 3.697 20 0 FHADHM C[C@H](Nc1ccc(F)cc1OC(F)F)c1ccc(-c2nnn[n-]2)cc1F ZINC000824654925 609348705 /nfs/dbraw/zinc/34/87/05/609348705.db2.gz AIZGBRIAWHUQDB-QMMMGPOBSA-N -1 3 367.306 3.919 20 0 FHADHM C[C@H](Nc1ccc(F)cc1OC(F)F)c1ccc(-c2nn[n-]n2)cc1F ZINC000824654925 609348707 /nfs/dbraw/zinc/34/87/07/609348707.db2.gz AIZGBRIAWHUQDB-QMMMGPOBSA-N -1 3 367.306 3.919 20 0 FHADHM C[C@H](Nc1ccc2c(c1)CCCN2C)c1ccc(-c2nnn[n-]2)cc1F ZINC000824657540 609349252 /nfs/dbraw/zinc/34/92/52/609349252.db2.gz QVWSINMAKCUTLL-LBPRGKRZSA-N -1 3 352.417 3.561 20 0 FHADHM C[C@H](Nc1ccc2c(c1)CCCN2C)c1ccc(-c2nn[n-]n2)cc1F ZINC000824657540 609349254 /nfs/dbraw/zinc/34/92/54/609349254.db2.gz QVWSINMAKCUTLL-LBPRGKRZSA-N -1 3 352.417 3.561 20 0 FHADHM CCOc1ccc(OC)cc1N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1F ZINC000825643291 609349871 /nfs/dbraw/zinc/34/98/71/609349871.db2.gz KZTQLJUDKALFDR-NSHDSACASA-N -1 3 357.389 3.586 20 0 FHADHM CCOc1ccc(OC)cc1N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000825643291 609349873 /nfs/dbraw/zinc/34/98/73/609349873.db2.gz KZTQLJUDKALFDR-NSHDSACASA-N -1 3 357.389 3.586 20 0 FHADHM CC(C)S[C@H]1CCCC[C@@H]1OC(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000824337549 609365028 /nfs/dbraw/zinc/36/50/28/609365028.db2.gz AFTHHQCSUHKTTK-RYUDHWBXSA-N -1 3 352.485 3.538 20 0 FHADHM CC(C)S[C@H]1CCCC[C@@H]1OC(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000824337549 609365031 /nfs/dbraw/zinc/36/50/31/609365031.db2.gz AFTHHQCSUHKTTK-RYUDHWBXSA-N -1 3 352.485 3.538 20 0 FHADHM CCc1cc(NC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)ccc1C ZINC000825700829 609383562 /nfs/dbraw/zinc/38/35/62/609383562.db2.gz UZQLSKGPLNCEDW-ZDUSSCGKSA-N -1 3 350.426 3.620 20 0 FHADHM CCc1cc(NC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)ccc1C ZINC000825700829 609383564 /nfs/dbraw/zinc/38/35/64/609383564.db2.gz UZQLSKGPLNCEDW-ZDUSSCGKSA-N -1 3 350.426 3.620 20 0 FHADHM c1[nH]c2ncccc2c1-c1csc(Nc2ccc(-c3nn[n-]n3)cc2)n1 ZINC000826525664 609407438 /nfs/dbraw/zinc/40/74/38/609407438.db2.gz UGOMHURDVLLAME-UHFFFAOYSA-N -1 3 360.406 3.610 20 0 FHADHM COc1cc(NCc2ccc(-c3nnn[n-]3)cc2F)cc(OC)c1C(C)C ZINC000826180457 609446082 /nfs/dbraw/zinc/44/60/82/609446082.db2.gz IMFJKIHLHOOTBQ-UHFFFAOYSA-N -1 3 371.416 3.759 20 0 FHADHM COc1cc(NCc2ccc(-c3nn[n-]n3)cc2F)cc(OC)c1C(C)C ZINC000826180457 609446084 /nfs/dbraw/zinc/44/60/84/609446084.db2.gz IMFJKIHLHOOTBQ-UHFFFAOYSA-N -1 3 371.416 3.759 20 0 FHADHM O=C(CSc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)C1CCCC1 ZINC000826420348 609451208 /nfs/dbraw/zinc/45/12/08/609451208.db2.gz JBUXRNPUWSUQML-UHFFFAOYSA-N -1 3 356.373 3.737 20 0 FHADHM O=C(CSc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)C1CCCC1 ZINC000826420348 609451210 /nfs/dbraw/zinc/45/12/10/609451210.db2.gz JBUXRNPUWSUQML-UHFFFAOYSA-N -1 3 356.373 3.737 20 0 FHADHM COc1cccc(CSc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)n1 ZINC000826216925 609452971 /nfs/dbraw/zinc/45/29/71/609452971.db2.gz RYVWBTXIDQOHPU-UHFFFAOYSA-N -1 3 367.356 3.581 20 0 FHADHM COc1cccc(CSc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)n1 ZINC000826216925 609452973 /nfs/dbraw/zinc/45/29/73/609452973.db2.gz RYVWBTXIDQOHPU-UHFFFAOYSA-N -1 3 367.356 3.581 20 0 FHADHM Cc1nn(-c2ccc(Cl)cc2)cc1CNc1cccc(-c2nnn[n-]2)c1 ZINC000826331671 609475070 /nfs/dbraw/zinc/47/50/70/609475070.db2.gz SRYKRCKPMZLGPO-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM Cc1nn(-c2ccc(Cl)cc2)cc1CNc1cccc(-c2nn[n-]n2)c1 ZINC000826331671 609475072 /nfs/dbraw/zinc/47/50/72/609475072.db2.gz SRYKRCKPMZLGPO-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM Fc1c(CNc2ccc(OCC(F)(F)F)cc2)cccc1-c1nnn[n-]1 ZINC000826370631 609476297 /nfs/dbraw/zinc/47/62/97/609476297.db2.gz BGJHIHBSTVSVSL-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM Fc1c(CNc2ccc(OCC(F)(F)F)cc2)cccc1-c1nn[n-]n1 ZINC000826370631 609476298 /nfs/dbraw/zinc/47/62/98/609476298.db2.gz BGJHIHBSTVSVSL-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NCc1cnc(C(C)(C)C)s1 ZINC000825631611 609476382 /nfs/dbraw/zinc/47/63/82/609476382.db2.gz DNJXGPXYLUCFJT-UHFFFAOYSA-N -1 3 358.471 3.632 20 0 FHADHM Fc1c(CNc2ccc(Oc3ccccn3)cc2)cccc1-c1nnn[n-]1 ZINC000826371055 609478857 /nfs/dbraw/zinc/47/88/57/609478857.db2.gz QJMDNMCLBQIDEP-UHFFFAOYSA-N -1 3 362.368 3.805 20 0 FHADHM Fc1c(CNc2ccc(Oc3ccccn3)cc2)cccc1-c1nn[n-]n1 ZINC000826371055 609478860 /nfs/dbraw/zinc/47/88/60/609478860.db2.gz QJMDNMCLBQIDEP-UHFFFAOYSA-N -1 3 362.368 3.805 20 0 FHADHM COc1ccc(CNc2cc(-c3nnn[n-]3)ccc2C)cc1Br ZINC000826203459 609479707 /nfs/dbraw/zinc/47/97/07/609479707.db2.gz PBHIIJCERMHGDN-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM COc1ccc(CNc2cc(-c3nn[n-]n3)ccc2C)cc1Br ZINC000826203459 609479708 /nfs/dbraw/zinc/47/97/08/609479708.db2.gz PBHIIJCERMHGDN-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM CC(C)Oc1c(F)cc(NCc2ccc(F)c(-c3nnn[n-]3)c2)cc1F ZINC000824315764 609480433 /nfs/dbraw/zinc/48/04/33/609480433.db2.gz XUWCTUYTGDTGOM-UHFFFAOYSA-N -1 3 363.343 3.683 20 0 FHADHM CC(C)Oc1c(F)cc(NCc2ccc(F)c(-c3nn[n-]n3)c2)cc1F ZINC000824315764 609480434 /nfs/dbraw/zinc/48/04/34/609480434.db2.gz XUWCTUYTGDTGOM-UHFFFAOYSA-N -1 3 363.343 3.683 20 0 FHADHM CC(C)Oc1ccc(NCc2cc(F)c(F)c(F)c2)cc1-c1nnn[n-]1 ZINC000824329982 609489690 /nfs/dbraw/zinc/48/96/90/609489690.db2.gz ZTUMFZNFJCPUEA-UHFFFAOYSA-N -1 3 363.343 3.683 20 0 FHADHM CC(C)Oc1ccc(NCc2cc(F)c(F)c(F)c2)cc1-c1nn[n-]n1 ZINC000824329982 609489692 /nfs/dbraw/zinc/48/96/92/609489692.db2.gz ZTUMFZNFJCPUEA-UHFFFAOYSA-N -1 3 363.343 3.683 20 0 FHADHM CC(C)Oc1c(F)cc(NC(=O)Nc2cccc(-c3nnn[n-]3)c2)cc1F ZINC000824315675 609491369 /nfs/dbraw/zinc/49/13/69/609491369.db2.gz SZOVJXXTTZMDDL-UHFFFAOYSA-N -1 3 374.351 3.576 20 0 FHADHM CC(C)Oc1c(F)cc(NC(=O)Nc2cccc(-c3nn[n-]n3)c2)cc1F ZINC000824315675 609491372 /nfs/dbraw/zinc/49/13/72/609491372.db2.gz SZOVJXXTTZMDDL-UHFFFAOYSA-N -1 3 374.351 3.576 20 0 FHADHM Cc1cc(NCc2ccc(-c3nn[n-]n3)cc2)cnc1N1CCCC[C@H]1C ZINC000826271574 609512529 /nfs/dbraw/zinc/51/25/29/609512529.db2.gz XLQBOCDTIWIUPP-OAHLLOKOSA-N -1 3 363.469 3.561 20 0 FHADHM Cc1c(Cl)cnc(N[C@H](C)c2ccc(F)c(F)c2)c1-c1nnn[n-]1 ZINC000826239143 609520138 /nfs/dbraw/zinc/52/01/38/609520138.db2.gz YVVTZIHDBDELOK-MRVPVSSYSA-N -1 3 350.760 3.675 20 0 FHADHM Cc1c(Cl)cnc(N[C@H](C)c2ccc(F)c(F)c2)c1-c1nn[n-]n1 ZINC000826239143 609520139 /nfs/dbraw/zinc/52/01/39/609520139.db2.gz YVVTZIHDBDELOK-MRVPVSSYSA-N -1 3 350.760 3.675 20 0 FHADHM COc1ccc(C)cc1[C@@H](C)Nc1ncc(Cl)c(C)c1-c1nnn[n-]1 ZINC000826189797 609523848 /nfs/dbraw/zinc/52/38/48/609523848.db2.gz FKYHHJNMGBMGKF-LLVKDONJSA-N -1 3 358.833 3.714 20 0 FHADHM COc1ccc(C)cc1[C@@H](C)Nc1ncc(Cl)c(C)c1-c1nn[n-]n1 ZINC000826189797 609523849 /nfs/dbraw/zinc/52/38/49/609523849.db2.gz FKYHHJNMGBMGKF-LLVKDONJSA-N -1 3 358.833 3.714 20 0 FHADHM Cc1c(Cl)cnc(N[C@@H]2CCC[C@@H](C(F)(F)F)C2)c1-c1nnn[n-]1 ZINC000826239191 609526620 /nfs/dbraw/zinc/52/66/20/609526620.db2.gz ZQRXTUUPBHKDJK-RKDXNWHRSA-N -1 3 360.771 3.757 20 0 FHADHM Cc1c(Cl)cnc(N[C@@H]2CCC[C@@H](C(F)(F)F)C2)c1-c1nn[n-]n1 ZINC000826239191 609526621 /nfs/dbraw/zinc/52/66/21/609526621.db2.gz ZQRXTUUPBHKDJK-RKDXNWHRSA-N -1 3 360.771 3.757 20 0 FHADHM Cc1ccnc(NCc2ccccc2OC2CCCC2)c1-c1nnn[n-]1 ZINC000826314031 609538443 /nfs/dbraw/zinc/53/84/43/609538443.db2.gz CKPFOFOWWFWWDW-UHFFFAOYSA-N -1 3 350.426 3.504 20 0 FHADHM Cc1ccnc(NCc2ccccc2OC2CCCC2)c1-c1nn[n-]n1 ZINC000826314031 609538444 /nfs/dbraw/zinc/53/84/44/609538444.db2.gz CKPFOFOWWFWWDW-UHFFFAOYSA-N -1 3 350.426 3.504 20 0 FHADHM CCc1ccc([C@H]2CCCN2c2ncc(Cl)c(C)c2-c2nnn[n-]2)o1 ZINC000825705211 609554995 /nfs/dbraw/zinc/55/49/95/609554995.db2.gz YVXLLCDCBDQWSQ-CYBMUJFWSA-N -1 3 358.833 3.720 20 0 FHADHM CCc1ccc([C@H]2CCCN2c2ncc(Cl)c(C)c2-c2nn[n-]n2)o1 ZINC000825705211 609554996 /nfs/dbraw/zinc/55/49/96/609554996.db2.gz YVXLLCDCBDQWSQ-CYBMUJFWSA-N -1 3 358.833 3.720 20 0 FHADHM C[C@H]1CC[C@H](C(F)(F)F)CN1c1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000824907238 609575977 /nfs/dbraw/zinc/57/59/77/609575977.db2.gz HEDVZPQFINGLQW-QWRGUYRKSA-N -1 3 362.359 3.582 20 0 FHADHM C[C@H]1CC[C@H](C(F)(F)F)CN1c1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000824907238 609575979 /nfs/dbraw/zinc/57/59/79/609575979.db2.gz HEDVZPQFINGLQW-QWRGUYRKSA-N -1 3 362.359 3.582 20 0 FHADHM Cc1ccnc(N[C@@H]2CC3(CCCC3)Oc3ccccc32)c1-c1nnn[n-]1 ZINC000826312345 609578919 /nfs/dbraw/zinc/57/89/19/609578919.db2.gz BSYFBOQPWOWTGG-OAHLLOKOSA-N -1 3 362.437 3.819 20 0 FHADHM Cc1ccnc(N[C@@H]2CC3(CCCC3)Oc3ccccc32)c1-c1nn[n-]n1 ZINC000826312345 609578920 /nfs/dbraw/zinc/57/89/20/609578920.db2.gz BSYFBOQPWOWTGG-OAHLLOKOSA-N -1 3 362.437 3.819 20 0 FHADHM COc1cccc([C@H]2C[C@@H](C)CN2c2ncc(-c3nnn[n-]3)cc2Cl)c1 ZINC000826215205 609592827 /nfs/dbraw/zinc/59/28/27/609592827.db2.gz JHKKQFZJZYGZHJ-BDJLRTHQSA-N -1 3 370.844 3.511 20 0 FHADHM COc1cccc([C@H]2C[C@@H](C)CN2c2ncc(-c3nn[n-]n3)cc2Cl)c1 ZINC000826215205 609592831 /nfs/dbraw/zinc/59/28/31/609592831.db2.gz JHKKQFZJZYGZHJ-BDJLRTHQSA-N -1 3 370.844 3.511 20 0 FHADHM C[C@H]1CC(C(=O)N2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)C[C@H](C)C1 ZINC000824874507 609604460 /nfs/dbraw/zinc/60/44/60/609604460.db2.gz DFKUIMXYOZDBTH-HUUCEWRRSA-N -1 3 365.481 3.555 20 0 FHADHM C[C@H]1CC(C(=O)N2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)C[C@H](C)C1 ZINC000824874507 609604463 /nfs/dbraw/zinc/60/44/63/609604463.db2.gz DFKUIMXYOZDBTH-HUUCEWRRSA-N -1 3 365.481 3.555 20 0 FHADHM C[C@H]1C[C@H](C(=O)N2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)C[C@@H](C)C1 ZINC000824874508 609604604 /nfs/dbraw/zinc/60/46/04/609604604.db2.gz DFKUIMXYOZDBTH-QWHZDKJVSA-N -1 3 365.481 3.555 20 0 FHADHM C[C@H]1C[C@H](C(=O)N2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)C[C@@H](C)C1 ZINC000824874508 609604606 /nfs/dbraw/zinc/60/46/06/609604606.db2.gz DFKUIMXYOZDBTH-QWHZDKJVSA-N -1 3 365.481 3.555 20 0 FHADHM O=C(OCc1ccc(Cl)cc1-c1nnn[n-]1)[C@H]1CCCc2sccc21 ZINC000826465526 609616551 /nfs/dbraw/zinc/61/65/51/609616551.db2.gz QLWHGNQTJDXWJI-ZDUSSCGKSA-N -1 3 374.853 3.745 20 0 FHADHM O=C(OCc1ccc(Cl)cc1-c1nn[n-]n1)[C@H]1CCCc2sccc21 ZINC000826465526 609616552 /nfs/dbraw/zinc/61/65/52/609616552.db2.gz QLWHGNQTJDXWJI-ZDUSSCGKSA-N -1 3 374.853 3.745 20 0 FHADHM Cn1ncc(C(=O)N=c2cc(-c3cccc(F)c3)o[n-]2)c1-c1ccccc1 ZINC000448541141 936337090 /nfs/dbraw/zinc/33/70/90/936337090.db2.gz DSNJJBKSTBMCTR-UHFFFAOYSA-N -1 3 362.364 3.555 20 0 FHADHM O=C(Nc1ccc(Cl)cc1[O-])C1CCC(OC[C@H]2CCCO2)CC1 ZINC000582980032 936340526 /nfs/dbraw/zinc/34/05/26/936340526.db2.gz SYKBGIVEOUQNSE-PESDSKBTSA-N -1 3 353.846 3.739 20 0 FHADHM CO[C@@H](CS(=O)(=O)[N-]c1ccc(C(F)(F)F)cc1Cl)C(C)C ZINC000647270921 936382295 /nfs/dbraw/zinc/38/22/95/936382295.db2.gz UNNVXIBUDMQRCU-LBPRGKRZSA-N -1 3 359.797 3.772 20 0 FHADHM C[C@@H]1CCN(C(=O)NCc2ccc([O-])c(Br)c2)C[C@@H](C)C1 ZINC000506374586 945065586 /nfs/dbraw/zinc/06/55/86/945065586.db2.gz DRGXMUADBUFJAG-NEPJUHHUSA-N -1 3 355.276 3.732 20 0 FHADHM Cc1ccc2c(CC[N-]S(=O)(=O)c3ccc(Cl)cc3F)c[nH]c2c1 ZINC001211567203 937145762 /nfs/dbraw/zinc/14/57/62/937145762.db2.gz RWAZDPOKOPZGRW-UHFFFAOYSA-N -1 3 366.845 3.790 20 0 FHADHM CCS(=O)(=O)[N-]c1ccc(NC(=O)C[C@H]2CCC[C@H](C)C2)cc1OC ZINC000153911052 937147365 /nfs/dbraw/zinc/14/73/65/937147365.db2.gz IXTFBEFPQUQMGY-KBPBESRZSA-N -1 3 368.499 3.612 20 0 FHADHM O=C(c1cccc(NCc2ccc([O-])c(F)c2)c1)N1CCCC[C@H]1CCO ZINC000892327085 937152200 /nfs/dbraw/zinc/15/22/00/937152200.db2.gz ICPPCPTWXHXZRW-SFHVURJKSA-N -1 3 372.440 3.521 20 0 FHADHM Cc1cc(CN=c2[n-]ncn2Cc2ccccc2)c(OC(F)F)cc1C ZINC000547637187 927547125 /nfs/dbraw/zinc/54/71/25/927547125.db2.gz IGZJKHRCUXYYAJ-UHFFFAOYSA-N -1 3 358.392 3.579 20 0 FHADHM COc1ccc([C@@H](CC(=O)[O-])NCc2cc3cc(OC)ccc3o2)cc1 ZINC000683171831 927740338 /nfs/dbraw/zinc/74/03/38/927740338.db2.gz QJOCRXLTKRZVHK-GOSISDBHSA-N -1 3 355.390 3.756 20 0 FHADHM O=C([O-])[C@H](CNCc1c(Cl)cccc1OC(F)F)Cc1ccccc1 ZINC000683172643 927757162 /nfs/dbraw/zinc/75/71/62/927757162.db2.gz XZMFKOJNSVHDST-ZDUSSCGKSA-N -1 3 369.795 3.975 20 0 FHADHM CCc1cc(C(=O)N2CCc3c(=O)[n-]cnc3C2)sc1-c1ccccc1 ZINC000654995418 927804528 /nfs/dbraw/zinc/80/45/28/927804528.db2.gz QILVKIGCUWRFQO-UHFFFAOYSA-N -1 3 365.458 3.672 20 0 FHADHM O=C(CCCOc1cccc2ccccc21)Nc1nnc(C(F)(F)F)[n-]1 ZINC000047078138 928028235 /nfs/dbraw/zinc/02/82/35/928028235.db2.gz QLHASZDGWHCCTH-UHFFFAOYSA-N -1 3 364.327 3.774 20 0 FHADHM O=C(CCCOc1cccc2ccccc21)Nc1nc(C(F)(F)F)n[n-]1 ZINC000047078138 928028254 /nfs/dbraw/zinc/02/82/54/928028254.db2.gz QLHASZDGWHCCTH-UHFFFAOYSA-N -1 3 364.327 3.774 20 0 FHADHM O=C(Nc1cc2c(cc1F)NC(=O)CC2)c1ccc2c(c1[O-])CCCC2 ZINC000187356665 928282592 /nfs/dbraw/zinc/28/25/92/928282592.db2.gz YIWVVEZRVLMBDO-UHFFFAOYSA-N -1 3 354.381 3.547 20 0 FHADHM O=c1cc(CN2CCOC3(C2)CCCCCC3)nc(-c2ccccc2)[n-]1 ZINC001167659693 937236053 /nfs/dbraw/zinc/23/60/53/937236053.db2.gz UGMYMXYDTSNCLN-UHFFFAOYSA-N -1 3 353.466 3.774 20 0 FHADHM CC(=O)Nc1ccc(Cl)cc1[N-]S(=O)(=O)/C=C\c1ccc(F)cc1 ZINC000254974169 928608778 /nfs/dbraw/zinc/60/87/78/928608778.db2.gz HQFWMUMFOVUORH-HJWRWDBZSA-N -1 3 368.817 3.850 20 0 FHADHM O=C(Cc1c[nH]c2ccc(F)cc12)Nc1cc(Br)ccc1[O-] ZINC000126435099 937270651 /nfs/dbraw/zinc/27/06/51/937270651.db2.gz SVRKUBAEBCPEMA-UHFFFAOYSA-N -1 3 363.186 3.956 20 0 FHADHM COc1cc(C(=O)N2CCC[C@H]2CCc2ccccc2)cc(OC)c1[O-] ZINC000179552241 928823510 /nfs/dbraw/zinc/82/35/10/928823510.db2.gz ZPNYKBPAUSQZIC-KRWDZBQOSA-N -1 3 355.434 3.647 20 0 FHADHM CCCc1c(C(=O)NCc2ccc([O-])c(F)c2)cnn1-c1ccc(C)cc1 ZINC000430295721 929366642 /nfs/dbraw/zinc/36/66/42/929366642.db2.gz HZYNHFHZPUOMPG-UHFFFAOYSA-N -1 3 367.424 3.908 20 0 FHADHM CC[C@@H]([N-]S(=O)(=O)c1c(Cl)cccc1Br)C1CC1 ZINC000324347404 929431156 /nfs/dbraw/zinc/43/11/56/929431156.db2.gz UAESMMAFGOWRML-LLVKDONJSA-N -1 3 352.681 3.569 20 0 FHADHM NC(=O)c1cccc(CSc2nnc([N-]c3ccccc3F)s2)c1 ZINC000047438616 929515822 /nfs/dbraw/zinc/51/58/22/929515822.db2.gz FKUPBRUCOOUOLF-UHFFFAOYSA-N -1 3 360.439 3.812 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)NCCSCC(C)C)cc2)cc(=O)[n-]1 ZINC000533716622 929693252 /nfs/dbraw/zinc/69/32/52/929693252.db2.gz MKYUNWKQYORLLY-UHFFFAOYSA-N -1 3 360.483 3.668 20 0 FHADHM COc1cc(C(=O)Nc2cccc(C(C)=O)c2[O-])ccc1OCC(C)C ZINC000583337967 937361429 /nfs/dbraw/zinc/36/14/29/937361429.db2.gz SREOEPJCJWEXGZ-UHFFFAOYSA-N -1 3 357.406 3.891 20 0 FHADHM CCOc1cc(C[NH2+][C@H](C)[C@@H]2C[C@H](C(=O)[O-])C2(C)C)cc(Cl)c1[O-] ZINC000656100344 930159487 /nfs/dbraw/zinc/15/94/87/930159487.db2.gz JTLKORGBWBCHPR-KGYLQXTDSA-N -1 3 355.862 3.669 20 0 FHADHM CCOc1c(OC)cc(C=Cc2nc(C(F)(F)F)cc(=O)[n-]2)cc1OC 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FHADHM O=S(=O)([N-]C1CCC2(CC2(F)F)CC1)c1ccc(Cl)cc1F ZINC000657197588 934746233 /nfs/dbraw/zinc/74/62/33/934746233.db2.gz MMZHLSDRRUEADG-UHFFFAOYSA-N -1 3 353.793 3.725 20 0 FHADHM Cc1ccc([N-]S(=O)(=O)c2ccc3c4c(cccc42)C(=O)N3)c(F)c1 ZINC000247813351 934777467 /nfs/dbraw/zinc/77/74/67/934777467.db2.gz ARWCRWGMEOTSJN-UHFFFAOYSA-N -1 3 356.378 3.654 20 0 FHADHM O=S(=O)(Cc1ccccc1C(F)(F)F)[N-]c1nc2ccccc2[nH]1 ZINC000187744969 934804303 /nfs/dbraw/zinc/80/43/03/934804303.db2.gz NQLSZVLWPNPUNM-UHFFFAOYSA-N -1 3 355.341 3.524 20 0 FHADHM COC(=O)c1cc(OC)ccc1NC(=O)c1cc([O-])c2ccccc2c1 ZINC000472032331 934861652 /nfs/dbraw/zinc/86/16/52/934861652.db2.gz DQEPQEMJIIYCTQ-UHFFFAOYSA-N -1 3 351.358 3.593 20 0 FHADHM O=C(Nc1ccnn1C1CCCCC1)c1c[n-]c2cc(F)c(F)cc2c1=O ZINC000892051957 934894657 /nfs/dbraw/zinc/89/46/57/934894657.db2.gz CUYIKNLMXJZYGD-UHFFFAOYSA-N -1 3 372.375 3.760 20 0 FHADHM Cc1ccc(CNC(=O)NCc2ncccc2[O-])c(O[C@H](C)CC(C)C)c1 ZINC000472050503 934902431 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CCc1cccc(C(=O)N(C)Cc2ccc(OC(F)F)c(OC)c2)c1[O-] ZINC000081706158 938797576 /nfs/dbraw/zinc/79/75/76/938797576.db2.gz WUAYIIYPYNZCTE-UHFFFAOYSA-N -1 3 365.376 3.837 20 0 FHADHM Cc1ccc(Oc2ccccc2)c(NC(=O)Cc2c(C)nc(C)[n-]c2=O)c1 ZINC000084786806 938832181 /nfs/dbraw/zinc/83/21/81/938832181.db2.gz WTISBANCXVQCDK-UHFFFAOYSA-N -1 3 363.417 3.669 20 0 FHADHM Cn1cc(Br)cc1C(=O)Nc1ccc(Br)cc1[O-] ZINC000525705361 938949814 /nfs/dbraw/zinc/94/98/14/938949814.db2.gz LSBRWSQOOWLXJH-UHFFFAOYSA-N -1 3 374.032 3.508 20 0 FHADHM CC(=O)Nc1cc(F)c(S(=O)(=O)[N-]C(C)(C)C(C)(C)C)cc1Cl ZINC000431580127 938983314 /nfs/dbraw/zinc/98/33/14/938983314.db2.gz UMEOHQFRFYPGMN-UHFFFAOYSA-N -1 3 364.870 3.541 20 0 FHADHM Cc1ccc([N-]S(=O)(=O)c2ccc3c(c2)CCO3)cc1C(F)(F)F ZINC000685447350 938987651 /nfs/dbraw/zinc/98/76/51/938987651.db2.gz NHFAQOIZOVWQEN-UHFFFAOYSA-N -1 3 357.353 3.750 20 0 FHADHM CN(Cc1nc2ccccc2o1)Cc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000431593745 938991848 /nfs/dbraw/zinc/99/18/48/938991848.db2.gz 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ZINC000425941069 944291936 /nfs/dbraw/zinc/29/19/36/944291936.db2.gz CPNVGANGUOSXGT-LBPRGKRZSA-N -1 3 373.507 3.643 20 0 FHADHM Cn1ccnc1-c1cccc(NC(=O)CCCc2ccc([O-])c(F)c2)c1 ZINC000468754616 944301604 /nfs/dbraw/zinc/30/16/04/944301604.db2.gz ADVYWBBSAAWDHC-UHFFFAOYSA-N -1 3 353.397 3.893 20 0 FHADHM C[C@@H]1C[C@@H](C)[C@H](C)N(C(=O)NCc2ccc([O-])c(Br)c2)C1 ZINC000473737547 944333136 /nfs/dbraw/zinc/33/31/36/944333136.db2.gz YLDPSZMVYINSHE-UTUOFQBUSA-N -1 3 355.276 3.731 20 0 FHADHM O=C([O-])c1ccc(CN2CC[C@H](C(F)(F)F)C3(CCOCC3)C2)s1 ZINC000518397900 944337216 /nfs/dbraw/zinc/33/72/16/944337216.db2.gz MJLWQHHZCZHHAS-ZDUSSCGKSA-N -1 3 363.401 3.627 20 0 FHADHM C=Cc1ccc(S(=O)(=O)[N-]c2ccc(Oc3cc(C)[nH]n3)cc2)cc1 ZINC000436476627 944357083 /nfs/dbraw/zinc/35/70/83/944357083.db2.gz JPMMMOUEZDPPBA-UHFFFAOYSA-N -1 3 355.419 3.954 20 0 FHADHM CC(C)(C)c1ccccc1S(=O)(=O)[N-]c1cc(-c2nc[nH]n2)ccc1F ZINC000436478817 944358605 /nfs/dbraw/zinc/35/86/05/944358605.db2.gz RLMDYYNLLJDGRO-UHFFFAOYSA-N -1 3 374.441 3.709 20 0 FHADHM Cc1ccccc1-c1cc(=NC(=O)[C@H]2C[C@@H]2c2cccc(F)c2F)[nH][n-]1 ZINC000439148593 944379001 /nfs/dbraw/zinc/37/90/01/944379001.db2.gz ZHYDRVGYLHVWCX-CABCVRRESA-N -1 3 353.372 3.827 20 0 FHADHM O=c1nc(CN2CCSC[C@@H]2C2CC2)[n-]c2scc(-c3ccco3)c21 ZINC000664680750 944386777 /nfs/dbraw/zinc/38/67/77/944386777.db2.gz LXSSQDHMHHBHIR-CYBMUJFWSA-N -1 3 373.503 3.984 20 0 FHADHM COc1ccccc1[C@H](CNC(=O)c1ccc2ccccc2c1[O-])N(C)C ZINC000436521806 944390224 /nfs/dbraw/zinc/39/02/24/944390224.db2.gz HTRLHWDVQVPVBZ-IBGZPJMESA-N -1 3 364.445 3.587 20 0 FHADHM COc1ccc(CN(CC2CC2)C(=O)c2ccc(C)cc2[O-])c(OC)c1 ZINC000436521358 944390379 /nfs/dbraw/zinc/39/03/79/944390379.db2.gz MDVFFRARECTFRG-UHFFFAOYSA-N -1 3 355.434 3.770 20 0 FHADHM COC(=O)[C@@H](C)CN(C(=O)c1cc(Oc2ccccc2)ccc1[O-])C1CC1 ZINC000436535766 944402540 /nfs/dbraw/zinc/40/25/40/944402540.db2.gz OHJIDQJBNGUAKX-AWEZNQCLSA-N -1 3 369.417 3.598 20 0 FHADHM CC(=O)Nc1cc(F)c(F)cc1NC(=O)c1cc2c(cc1[O-])CCCC2 ZINC000436546858 944405862 /nfs/dbraw/zinc/40/58/62/944405862.db2.gz WGCOTKIGNZQCJA-UHFFFAOYSA-N -1 3 360.360 3.760 20 0 FHADHM COc1ccc(C(=O)N2CCSC[C@@H]2c2ccc(Cl)cc2)c([O-])c1 ZINC000436547192 944407477 /nfs/dbraw/zinc/40/74/77/944407477.db2.gz RKILIQMPEPEYEX-MRXNPFEDSA-N -1 3 363.866 3.985 20 0 FHADHM Cc1nc(-c2cccc(NC(=O)c3ccc4c(c3[O-])OC(C)(C)C4)c2)no1 ZINC000436549969 944408450 /nfs/dbraw/zinc/40/84/50/944408450.db2.gz HHDIQMYJNXMMKH-UHFFFAOYSA-N -1 3 365.389 3.716 20 0 FHADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CCO[C@@H]2CCC[C@@H]21 ZINC000436551800 944410855 /nfs/dbraw/zinc/41/08/55/944410855.db2.gz SJDNTCXDTGZXIJ-PZJWPPBQSA-N -1 3 351.446 3.571 20 0 FHADHM Cc1ccc(C(=O)Nc2ccccc2CN2C[C@@H](C)O[C@H](C)C2)c([O-])c1C ZINC000436555932 944412772 /nfs/dbraw/zinc/41/27/72/944412772.db2.gz JVYIALQXMRYAFP-HZPDHXFCSA-N -1 3 368.477 3.871 20 0 FHADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1CCC[C@H](n2cccn2)C1 ZINC000436540341 944418480 /nfs/dbraw/zinc/41/84/80/944418480.db2.gz YKKGEUAPANHWAK-INIZCTEOSA-N -1 3 363.417 3.858 20 0 FHADHM CC[C@@H](NC(=O)c1ccc(OC)cc1[O-])c1nc(-c2ccccc2)c[nH]1 ZINC000436543608 944420904 /nfs/dbraw/zinc/42/09/04/944420904.db2.gz FZGBWPLSNHTGBM-MRXNPFEDSA-N -1 3 351.406 3.672 20 0 FHADHM Cc1nccn1C[C@H](C)CNC(=O)c1cc(Cl)c2ccccc2c1[O-] ZINC000436544917 944422041 /nfs/dbraw/zinc/42/20/41/944422041.db2.gz AMPCKOWJFATDLO-GFCCVEGCSA-N -1 3 357.841 3.770 20 0 FHADHM CC(=O)c1ccc(C(=O)Nc2cc(NC(=O)C(C)C)ccc2C)cc1[O-] ZINC000436568924 944432999 /nfs/dbraw/zinc/43/29/99/944432999.db2.gz XQEIAQKLOMPJII-UHFFFAOYSA-N -1 3 354.406 3.750 20 0 FHADHM Cc1ccc(NC(=O)c2cc(Cc3ccccc3)ccc2[O-])cc1C(N)=O ZINC000436569332 944433820 /nfs/dbraw/zinc/43/38/20/944433820.db2.gz CSSIKBLZPNWFCU-UHFFFAOYSA-N -1 3 360.413 3.643 20 0 FHADHM O=C(c1ccccc1[O-])N(Cc1nnc(-c2ccc(Cl)cc2)o1)C1CC1 ZINC000436569566 944433923 /nfs/dbraw/zinc/43/39/23/944433923.db2.gz GELDIJVWIJOGHC-UHFFFAOYSA-N -1 3 369.808 3.900 20 0 FHADHM CC(C)c1ccc(C(=O)NCc2ccc(N3CCCCC3)nc2)c([O-])c1 ZINC000436570296 944434468 /nfs/dbraw/zinc/43/44/68/944434468.db2.gz OOANRPOLWKIGNI-UHFFFAOYSA-N -1 3 353.466 3.831 20 0 FHADHM Cc1ccc(CCN(C[C@H]2CCCO2)C(=O)c2ccc(C)cc2[O-])cc1 ZINC000436572375 944436277 /nfs/dbraw/zinc/43/62/77/944436277.db2.gz FPCWEUPGCXVBMG-LJQANCHMSA-N -1 3 353.462 3.873 20 0 FHADHM CSC1(CNC(=O)c2cc(Oc3ccccc3)ccc2[O-])CCOCC1 ZINC000436592600 944438198 /nfs/dbraw/zinc/43/81/98/944438198.db2.gz WSYJGOJAFQLTCE-UHFFFAOYSA-N -1 3 373.474 3.827 20 0 FHADHM O=C(N[C@@H]1CCOC2(CCC2)C1)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436593282 944438912 /nfs/dbraw/zinc/43/89/12/944438912.db2.gz DAZTXDSYYTWKMR-GOSISDBHSA-N -1 3 351.446 3.815 20 0 FHADHM COC(=O)c1ccc(CCC(=O)Nc2ccc([O-])c(C(F)(F)F)c2)cc1 ZINC000473600583 944443519 /nfs/dbraw/zinc/44/35/19/944443519.db2.gz RPMMZNVKDARKAK-UHFFFAOYSA-N -1 3 367.323 3.769 20 0 FHADHM CCOc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)C(=O)CCC3)c(C)c1 ZINC000425970699 944455152 /nfs/dbraw/zinc/45/51/52/944455152.db2.gz IHLZBEHWDDUZCT-UHFFFAOYSA-N -1 3 359.447 3.714 20 0 FHADHM CCCNC(=O)c1cccc(CNC(=O)c2ccc(C(C)C)cc2[O-])c1 ZINC000436613640 944461980 /nfs/dbraw/zinc/46/19/80/944461980.db2.gz WQEOOKSADRSNNX-UHFFFAOYSA-N -1 3 354.450 3.585 20 0 FHADHM Cn1nc(-c2nc(-c3ccc([O-])c4ccccc34)no2)c(=O)c2ccccc21 ZINC000436613528 944462549 /nfs/dbraw/zinc/46/25/49/944462549.db2.gz QVZPUKNQPSUJEV-UHFFFAOYSA-N -1 3 370.368 3.509 20 0 FHADHM Cc1ccc(C(=O)N(CCO)Cc2ccc(Cl)c(Cl)c2)c([O-])c1 ZINC000436614969 944462935 /nfs/dbraw/zinc/46/29/35/944462935.db2.gz BOPWBNFMWCZYNM-UHFFFAOYSA-N -1 3 354.233 3.642 20 0 FHADHM COc1cccc(C(=O)Nc2cc(NC(=O)C(C)(C)C)ccc2C)c1[O-] ZINC000112021701 944469967 /nfs/dbraw/zinc/46/99/67/944469967.db2.gz WZICHRZQVAHQSF-UHFFFAOYSA-N -1 3 356.422 3.946 20 0 FHADHM CC1CCN([C@H](CNC(=O)c2cc(F)c([O-])c(F)c2)c2ccccc2)CC1 ZINC000436634875 944474845 /nfs/dbraw/zinc/47/48/45/944474845.db2.gz NDBCYKQOPSSSEY-LJQANCHMSA-N -1 3 374.431 3.873 20 0 FHADHM CC(C)[C@@H]1CCN1C(=O)C[C@@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436635878 944474896 /nfs/dbraw/zinc/47/48/96/944474896.db2.gz OXPMIXZELSEQPE-UXHICEINSA-N -1 3 366.461 3.510 20 0 FHADHM O=C(Nc1ccc2c(c1)OCC(=O)N2)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436620729 944478218 /nfs/dbraw/zinc/47/82/18/944478218.db2.gz WKZXDSDAHZXGCC-UHFFFAOYSA-N -1 3 374.396 3.566 20 0 FHADHM CC(=O)c1ccc(C(=O)N2CC[C@@H](CSc3ccccc3)C2)cc1[O-] ZINC000436653056 944482484 /nfs/dbraw/zinc/48/24/84/944482484.db2.gz CHQJWGHIVCBAQV-OAHLLOKOSA-N -1 3 355.459 3.849 20 0 FHADHM COc1ccc(-c2csc(CNC(=O)c3c([O-])cccc3O)c2)cc1 ZINC000436647076 944495561 /nfs/dbraw/zinc/49/55/61/944495561.db2.gz JXXQJFDKUMZNGA-UHFFFAOYSA-N -1 3 355.415 3.765 20 0 FHADHM O=C(c1c([O-])cccc1O)N1CCC[C@H](c2nc(C(F)(F)F)cs2)C1 ZINC000436648048 944495571 /nfs/dbraw/zinc/49/55/71/944495571.db2.gz PANJONRVLXWDCW-VIFPVBQESA-N -1 3 372.368 3.593 20 0 FHADHM O=C(c1ccc([O-])cc1)N1CCN(Cc2ccc(C3CCC3)cc2)CC1 ZINC000436672592 944506228 /nfs/dbraw/zinc/50/62/28/944506228.db2.gz MKZYEYZCTIQBBG-UHFFFAOYSA-N -1 3 350.462 3.618 20 0 FHADHM CN(CCCc1cc(-c2cccc(F)c2)n[nH]1)C(=O)c1ccccc1[O-] ZINC000436680952 944518452 /nfs/dbraw/zinc/51/84/52/944518452.db2.gz MAHUISYSXDPIHO-UHFFFAOYSA-N -1 3 353.397 3.626 20 0 FHADHM CC(C)c1ccc([C@H](C)CC(=O)NCCNC(=O)c2ccc([O-])cc2)cc1 ZINC000436680602 944519552 /nfs/dbraw/zinc/51/95/52/944519552.db2.gz KONKNPUSCRGAHR-MRXNPFEDSA-N -1 3 368.477 3.555 20 0 FHADHM CC1(C)Cc2ccc(C(=O)Nc3ccc(NC(=O)C4CC4)cc3)c([O-])c2O1 ZINC000436681737 944520282 /nfs/dbraw/zinc/52/02/82/944520282.db2.gz OFHIDLOIUPQTBL-UHFFFAOYSA-N -1 3 366.417 3.707 20 0 FHADHM COc1cc(NC(=O)c2cc(C)ccc2[O-])cc(OC)c1Br ZINC000436683867 944523399 /nfs/dbraw/zinc/52/33/99/944523399.db2.gz WUBRBLOAPQMLKL-UHFFFAOYSA-N -1 3 366.211 3.733 20 0 FHADHM COc1cc(-c2nc(-c3ccc(NC(C)(C)C)cn3)no2)cc(OC)c1[O-] ZINC000436686887 944525017 /nfs/dbraw/zinc/52/50/17/944525017.db2.gz GSRCSBDKFLMDRB-UHFFFAOYSA-N -1 3 370.409 3.732 20 0 FHADHM Cc1ccc(C(=O)NCCc2nc([C@H](C)c3ccccc3C)no2)c([O-])c1 ZINC000436686779 944525878 /nfs/dbraw/zinc/52/58/78/944525878.db2.gz GAIKSIJXKLJSNG-OAHLLOKOSA-N -1 3 365.433 3.516 20 0 FHADHM COC(=O)c1cc(NC(=O)CCCc2ccc([O-])c(F)c2)cc2[nH]ccc21 ZINC000425988017 944538807 /nfs/dbraw/zinc/53/88/07/944538807.db2.gz MATJPCGZELZHKF-UHFFFAOYSA-N -1 3 370.380 3.761 20 0 FHADHM O=C(NCc1ccc(Cn2cnc3ccccc32)cc1)c1ccccc1[O-] ZINC000436720132 944558318 /nfs/dbraw/zinc/55/83/18/944558318.db2.gz RVGKMKKBENILBL-UHFFFAOYSA-N -1 3 357.413 3.720 20 0 FHADHM CCc1ccc(C(=O)Nc2ccc(N(C(C)=O)[C@@H]3C[C@@H]3C)cc2)c([O-])c1 ZINC000436735836 944565327 /nfs/dbraw/zinc/56/53/27/944565327.db2.gz DOIWKUOKNXLDCZ-ORAYPTAESA-N -1 3 352.434 3.968 20 0 FHADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CCC[C@]12CCOC2 ZINC000436738848 944568261 /nfs/dbraw/zinc/56/82/61/944568261.db2.gz UZUPNPVXLUCPSP-JOCHJYFZSA-N -1 3 351.446 3.573 20 0 FHADHM COc1ccc(C(=O)NCCOc2cccc(Cl)c2Cl)c([O-])c1 ZINC000516189565 944578917 /nfs/dbraw/zinc/57/89/17/944578917.db2.gz ZOJGDIRAVDMQTI-UHFFFAOYSA-N -1 3 356.205 3.516 20 0 FHADHM CNC(=O)c1ccc(C)c(NC(=O)c2cc(Cc3ccccc3)ccc2[O-])c1 ZINC000436758154 944580176 /nfs/dbraw/zinc/58/01/76/944580176.db2.gz LTFSIAVXBMTCAJ-UHFFFAOYSA-N -1 3 374.440 3.903 20 0 FHADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CCOC[C@H](C2CCC2)C1 ZINC000436784941 944630566 /nfs/dbraw/zinc/63/05/66/944630566.db2.gz MUTUTAQPTRRPAC-HXUWFJFHSA-N -1 3 365.473 3.872 20 0 FHADHM COCCOc1cc(C(=O)Nc2cc(Cl)ccc2[O-])nc2ccccc21 ZINC000436787533 944636335 /nfs/dbraw/zinc/63/63/35/944636335.db2.gz WSZCLMMHTDDLTA-UHFFFAOYSA-N -1 3 372.808 3.871 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)c1ccc(OC2CCCCC2)cc1 ZINC000524233914 944636598 /nfs/dbraw/zinc/63/65/98/944636598.db2.gz HSEVVNICUFRNSL-UHFFFAOYSA-N -1 3 363.421 3.831 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)c1ccc(OC2CCCCC2)cc1 ZINC000524233914 944636608 /nfs/dbraw/zinc/63/66/08/944636608.db2.gz HSEVVNICUFRNSL-UHFFFAOYSA-N -1 3 363.421 3.831 20 0 FHADHM CN(C(=O)c1cc(F)cc(Cl)c1[O-])[C@H]1CCN(Cc2ccccc2)C1 ZINC000436795987 944647360 /nfs/dbraw/zinc/64/73/60/944647360.db2.gz HNPWPQYEKNELOU-HNNXBMFYSA-N -1 3 362.832 3.531 20 0 FHADHM O=C(N[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1)c1c([O-])cccc1O ZINC000438467154 944651884 /nfs/dbraw/zinc/65/18/84/944651884.db2.gz PJCRWYZCTGDLBE-AULYBMBSSA-N -1 3 351.324 3.793 20 0 FHADHM CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)Nc1cc(F)ccc1[O-] ZINC000436804275 944658904 /nfs/dbraw/zinc/65/89/04/944658904.db2.gz BLNBGMOVSMIAHH-UHFFFAOYSA-N -1 3 354.385 3.987 20 0 FHADHM C[C@@H](O)C[C@H]1CCCCN1C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436807329 944663524 /nfs/dbraw/zinc/66/35/24/944663524.db2.gz XNQADXWIJHJKDP-VQIMIIECSA-N -1 3 353.462 3.749 20 0 FHADHM CCc1ccc(C(=O)NCc2ccc(NC(=O)c3ccco3)cc2)c([O-])c1 ZINC000436811261 944665871 /nfs/dbraw/zinc/66/58/71/944665871.db2.gz IQVMLNSMBHHWIY-UHFFFAOYSA-N -1 3 364.401 3.730 20 0 FHADHM O=C(N=c1cc([C@@H]2CCCO2)[n-][nH]1)c1cc(-c2ccccn2)ccc1Cl ZINC000473848100 944672468 /nfs/dbraw/zinc/67/24/68/944672468.db2.gz GLDYLZJEFPZTJS-KRWDZBQOSA-N -1 3 368.824 3.651 20 0 FHADHM Cc1cccc(C(=O)Nc2cccc3c2CN(c2nccs2)C3)c1[O-] ZINC000436827313 944673567 /nfs/dbraw/zinc/67/35/67/944673567.db2.gz NIDJAJUOWCNHFE-UHFFFAOYSA-N -1 3 351.431 3.930 20 0 FHADHM CCC1(CC)CCCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2[O-])CC1 ZINC000436830284 944675830 /nfs/dbraw/zinc/67/58/30/944675830.db2.gz UYYHJAVIJHLUCL-GOSISDBHSA-N -1 3 372.509 3.816 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)NC[C@@H](Cc2ccccc2)C(C)C)c1 ZINC000436831726 944678632 /nfs/dbraw/zinc/67/86/32/944678632.db2.gz GDQFJOLHTNFGJA-QGZVFWFLSA-N -1 3 354.450 3.595 20 0 FHADHM O=S(=O)([N-]Cc1ccc(F)c(F)c1)c1cccc(Cl)c1Cl ZINC000518731411 944680407 /nfs/dbraw/zinc/68/04/07/944680407.db2.gz VBUJOTNIANEVCB-UHFFFAOYSA-N -1 3 352.189 3.750 20 0 FHADHM CCNC(=O)Nc1ccc(C)c(NC(=O)c2cc3c(cc2[O-])CCCC3)c1 ZINC000436820652 944689584 /nfs/dbraw/zinc/68/95/84/944689584.db2.gz IDRUDUAQQQKBAY-UHFFFAOYSA-N -1 3 367.449 3.973 20 0 FHADHM CCc1ccc(C(=O)N(Cc2ccccc2OC)C[C@H]2CCCO2)c([O-])c1 ZINC000436824411 944694585 /nfs/dbraw/zinc/69/45/85/944694585.db2.gz ZPBLOLHNHBIEHW-GOSISDBHSA-N -1 3 369.461 3.785 20 0 FHADHM COc1cc(C[NH2+][C@H](C)CCC[C@@H](C)C(=O)[O-])cc(Br)c1[O-] ZINC000426694332 944695162 /nfs/dbraw/zinc/69/51/62/944695162.db2.gz IJTVELJUASFBJS-GHMZBOCLSA-N -1 3 374.275 3.532 20 0 FHADHM COc1cc(C[NH2+][C@@H](C)CCC[C@@H](C)C(=O)[O-])cc(Br)c1[O-] ZINC000426694333 944695259 /nfs/dbraw/zinc/69/52/59/944695259.db2.gz IJTVELJUASFBJS-MNOVXSKESA-N -1 3 374.275 3.532 20 0 FHADHM CCc1ccc(C(=O)NC[C@H](C)c2nc(-c3ccccc3)no2)c([O-])c1 ZINC000436826860 944697794 /nfs/dbraw/zinc/69/77/94/944697794.db2.gz BSOUARJCRVROFF-ZDUSSCGKSA-N -1 3 351.406 3.538 20 0 FHADHM CCOc1c(Cl)cc(CN[C@H](C(=O)[O-])c2ccc(C)cc2)cc1OC ZINC000426702157 944701892 /nfs/dbraw/zinc/70/18/92/944701892.db2.gz FDAYKBONXOPKKZ-KRWDZBQOSA-N -1 3 363.841 3.971 20 0 FHADHM CCc1ccc([C@H]2CCN(C(=O)c3cc(OC)c([O-])c(OC)c3)C2)cc1 ZINC000436856451 944705976 /nfs/dbraw/zinc/70/59/76/944705976.db2.gz YDSMUDJDLCNIDW-INIZCTEOSA-N -1 3 355.434 3.602 20 0 FHADHM CCCC[C@@H](CC)CC(=O)NC1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436840796 944706301 /nfs/dbraw/zinc/70/63/01/944706301.db2.gz ROEMLMGHGYGYJG-MRXNPFEDSA-N -1 3 360.498 3.720 20 0 FHADHM O=C([O-])C[C@H](NCc1cccc2cc[nH]c21)c1cnn(-c2ccccc2)c1 ZINC000426727156 944723322 /nfs/dbraw/zinc/72/33/22/944723322.db2.gz NBCMEMIKHLMOIM-IBGZPJMESA-N -1 3 360.417 3.659 20 0 FHADHM O=C([O-])[C@H](Cc1ccc(F)cc1)NCc1csc(-c2ccsc2)n1 ZINC000426726065 944727930 /nfs/dbraw/zinc/72/79/30/944727930.db2.gz GVUNIKAQSOFLDV-HNNXBMFYSA-N -1 3 362.451 3.796 20 0 FHADHM CC(C)n1ccc(C(=O)Oc2ccc(-c3ccc(-c4nnn[n-]4)cc3)cc2)n1 ZINC000735961965 944728629 /nfs/dbraw/zinc/72/86/29/944728629.db2.gz YISGGDGLOFTDKR-UHFFFAOYSA-N -1 3 374.404 3.530 20 0 FHADHM CC(C)n1ccc(C(=O)Oc2ccc(-c3ccc(-c4nn[n-]n4)cc3)cc2)n1 ZINC000735961965 944728634 /nfs/dbraw/zinc/72/86/34/944728634.db2.gz YISGGDGLOFTDKR-UHFFFAOYSA-N -1 3 374.404 3.530 20 0 FHADHM O=C([O-])[C@H](CNCc1ccn(-c2ccccc2)n1)Cc1ccc(Cl)cc1 ZINC000426707722 944730006 /nfs/dbraw/zinc/73/00/06/944730006.db2.gz CHLMPPBCPPTNGW-INIZCTEOSA-N -1 3 369.852 3.559 20 0 FHADHM C[C@@H]([C@H](C)NC(=O)[C@@H]1CCCN1C(=O)c1ccccc1[O-])C1CCCCC1 ZINC000436868659 944734623 /nfs/dbraw/zinc/73/46/23/944734623.db2.gz HUONPICKSULINZ-BXWFABGCSA-N -1 3 372.509 3.718 20 0 FHADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)CCCc3ccsc3)cc2)n1 ZINC000783446435 944737958 /nfs/dbraw/zinc/73/79/58/944737958.db2.gz XTPYOHGKIBCLRO-UHFFFAOYSA-N -1 3 353.447 3.768 20 0 FHADHM COc1ccc([C@H](CCC(=O)[O-])NCc2cc(F)c(F)c(F)c2)cc1 ZINC000426731568 944741179 /nfs/dbraw/zinc/74/11/79/944741179.db2.gz FQMHNSMUFVWRQF-INIZCTEOSA-N -1 3 353.340 3.808 20 0 FHADHM C[C@H](CN(C)C(=O)c1c([O-])cccc1O)Oc1ccc(Cl)c(Cl)c1 ZINC000436857817 944745606 /nfs/dbraw/zinc/74/56/06/944745606.db2.gz YHLVREIDXUEXHQ-SNVBAGLBSA-N -1 3 370.232 3.944 20 0 FHADHM COc1cc(CN[C@H](C(=O)[O-])c2cccc(Cl)c2)ccc1SC ZINC000426736313 944748575 /nfs/dbraw/zinc/74/85/75/944748575.db2.gz XDNAORMVAQTBOD-INIZCTEOSA-N -1 3 351.855 3.986 20 0 FHADHM CCc1ccc(-c2nc(CC(=O)N[C@H](CC)c3ccccc3)no2)c([O-])c1 ZINC000436882211 944754324 /nfs/dbraw/zinc/75/43/24/944754324.db2.gz YCCLQAKPONZOES-QGZVFWFLSA-N -1 3 365.433 3.815 20 0 FHADHM Cc1ccc(OCc2nc(CN[C@H]3CCC[C@]3(C)C(=O)[O-])cs2)cc1 ZINC000426744439 944758882 /nfs/dbraw/zinc/75/88/82/944758882.db2.gz QXMGGYHTCDUEQS-LPHOPBHVSA-N -1 3 360.479 3.764 20 0 FHADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1C[C@H](CO)c2ccccc21 ZINC000436884397 944759482 /nfs/dbraw/zinc/75/94/82/944759482.db2.gz BVHSBSXFQFOWAS-GOSISDBHSA-N -1 3 359.425 3.719 20 0 FHADHM O=S(=O)([N-]CCc1cc(F)cc(F)c1)c1c(Cl)cccc1Cl ZINC000500397789 944762416 /nfs/dbraw/zinc/76/24/16/944762416.db2.gz MTGCREVZXNXZNP-UHFFFAOYSA-N -1 3 366.216 3.793 20 0 FHADHM COc1cccc([C@H](CC(=O)[O-])NCc2ccc(OC(F)(F)F)cc2)c1 ZINC000426765196 944763508 /nfs/dbraw/zinc/76/35/08/944763508.db2.gz CTHKWIAZOBVEST-INIZCTEOSA-N -1 3 369.339 3.899 20 0 FHADHM CSc1cc2c(cc1CN[C@@H](C(=O)[O-])c1cc(C)cc(C)c1)OCCO2 ZINC000426764251 944763676 /nfs/dbraw/zinc/76/36/76/944763676.db2.gz WIXHRMYJKHVLQL-LJQANCHMSA-N -1 3 373.474 3.712 20 0 FHADHM Cc1ccc(-c2nc(-c3cccc(NC(=O)NC(C)C)c3)no2)c([O-])c1 ZINC000436902946 944769823 /nfs/dbraw/zinc/76/98/23/944769823.db2.gz RXNROXOXIOXROY-UHFFFAOYSA-N -1 3 352.394 3.948 20 0 FHADHM CN(C[C@H]1CCCC[C@@H]1O)C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436904162 944771506 /nfs/dbraw/zinc/77/15/06/944771506.db2.gz KLJISEYRQWVFSA-CTNGQTDRSA-N -1 3 367.489 3.801 20 0 FHADHM COc1ccc([C@H](CCC(=O)[O-])NCc2cnn(-c3ccccc3)c2)cc1 ZINC000426753039 944772985 /nfs/dbraw/zinc/77/29/85/944772985.db2.gz CCADERGYGKIEJK-FQEVSTJZSA-N -1 3 365.433 3.577 20 0 FHADHM COc1cccc(-c2nc(-c3cccc(NC(=O)C4CCC4)c3)no2)c1[O-] ZINC000436907770 944776330 /nfs/dbraw/zinc/77/63/30/944776330.db2.gz YRAPWNRWQCWBEG-UHFFFAOYSA-N -1 3 365.389 3.856 20 0 FHADHM O=C([O-])C[C@@H](NC/C=C/c1ccc(F)cc1)c1cnn(-c2ccccc2)c1 ZINC000426758480 944780555 /nfs/dbraw/zinc/78/05/55/944780555.db2.gz IGFPXBBGLHSHLA-DPZZJQGRSA-N -1 3 365.408 3.830 20 0 FHADHM COc1cccc([C@@H](CNC(=O)c2ccc(Cl)cc2[O-])N2CCCC2)c1 ZINC000436911879 944780797 /nfs/dbraw/zinc/78/07/97/944780797.db2.gz RVKKWFBNJRFPLP-GOSISDBHSA-N -1 3 374.868 3.621 20 0 FHADHM C[C@@H](C(=O)[O-])[C@H](NCc1cnc(-c2ccccn2)s1)c1ccccc1 ZINC000426759742 944782569 /nfs/dbraw/zinc/78/25/69/944782569.db2.gz OIPMBGVSTQOLNO-DYVFJYSZSA-N -1 3 353.447 3.757 20 0 FHADHM COc1cccc(-c2nc(Cc3coc(-c4cccs4)n3)no2)c1[O-] ZINC000436895370 944784692 /nfs/dbraw/zinc/78/46/92/944784692.db2.gz IPRBKIPGSGXBCM-UHFFFAOYSA-N -1 3 355.375 3.758 20 0 FHADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CCc2ccccc2[C@H]1CO ZINC000436900490 944790911 /nfs/dbraw/zinc/79/09/11/944790911.db2.gz NOIJZFDOLBOYSE-JOCHJYFZSA-N -1 3 373.452 3.715 20 0 FHADHM CC[C@@H]1CCCN1C(=O)C[C@@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436932329 944794412 /nfs/dbraw/zinc/79/44/12/944794412.db2.gz NGKIDYAZBBBKNI-UYAOXDASSA-N -1 3 366.461 3.654 20 0 FHADHM O=C(c1cc(F)c([O-])c(Cl)c1)N1CCN(CC2CCCCC2)CC1 ZINC000436931871 944795912 /nfs/dbraw/zinc/79/59/12/944795912.db2.gz MWQIODRELGZGRI-UHFFFAOYSA-N -1 3 354.853 3.523 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(NC[C@H]3CCCO3)c(F)c2)c([O-])c1C ZINC000436917893 944800740 /nfs/dbraw/zinc/80/07/40/944800740.db2.gz CLDCNFIZXSTYIK-OAHLLOKOSA-N -1 3 358.413 3.991 20 0 FHADHM CCOc1c(Cl)cc(CN[C@H](C(=O)[O-])c2cccc(F)c2)cc1OC ZINC000426806795 944807737 /nfs/dbraw/zinc/80/77/37/944807737.db2.gz LADOJORVSCICBM-INIZCTEOSA-N -1 3 367.804 3.802 20 0 FHADHM COc1cccc([C@@H](CC(=O)[O-])NC/C=C\c2ccc(F)cc2)c1OC ZINC000426805459 944807926 /nfs/dbraw/zinc/80/79/26/944807926.db2.gz BQEDNAPFMKYUQK-VGOKWCNXSA-N -1 3 359.397 3.662 20 0 FHADHM Cc1c([C@@H](C)NC(=O)c2cc(Oc3ccccc3)ccc2[O-])cnn1C ZINC000436923685 944809287 /nfs/dbraw/zinc/80/92/87/944809287.db2.gz DIPJGXQIPBOMSE-CYBMUJFWSA-N -1 3 351.406 3.717 20 0 FHADHM COc1cccc([C@@H](CC(=O)[O-])NCc2cccc(Br)c2)c1 ZINC000426788552 944812319 /nfs/dbraw/zinc/81/23/19/944812319.db2.gz NNGSXAPELVNFOC-MRXNPFEDSA-N -1 3 364.239 3.763 20 0 FHADHM CCOc1cc(CN[C@@H](C(=O)[O-])c2ccsc2)ccc1OC(F)F ZINC000426793745 944816638 /nfs/dbraw/zinc/81/66/38/944816638.db2.gz RMTYNBZPFIMCDZ-CQSZACIVSA-N -1 3 357.378 3.664 20 0 FHADHM COc1ccc([C@H](CC(=O)[O-])NCc2coc3ccccc23)cc1OC ZINC000426797894 944820086 /nfs/dbraw/zinc/82/00/86/944820086.db2.gz HKPUOCVXBCZLQJ-INIZCTEOSA-N -1 3 355.390 3.756 20 0 FHADHM Cc1cc(CNC(=O)c2ccc3ccccc3c2[O-])cc(N2CCCC2)n1 ZINC000436934698 944822521 /nfs/dbraw/zinc/82/25/21/944822521.db2.gz YUTVHSLANRBHDV-UHFFFAOYSA-N -1 3 361.445 3.779 20 0 FHADHM CCOc1ccc(S(=O)(=O)[N-]c2ccc(NC(=O)C3CC3)cc2)cc1C ZINC000032589633 944825469 /nfs/dbraw/zinc/82/54/69/944825469.db2.gz JPCRAPVSKPZVBI-UHFFFAOYSA-N -1 3 374.462 3.543 20 0 FHADHM CCOc1cc2c(cc1OCC)CN(C(=O)c1cc(CC)ccc1[O-])CC2 ZINC000436943059 944829829 /nfs/dbraw/zinc/82/98/29/944829829.db2.gz XUFHEIUXYYMGQG-UHFFFAOYSA-N -1 3 369.461 3.951 20 0 FHADHM CCOc1c(Cl)cc(NC(=O)c2ccc(C(=O)OC)[n-]2)cc1Cl ZINC000500413582 944832034 /nfs/dbraw/zinc/83/20/34/944832034.db2.gz XCQJGLLHFWBDKW-UHFFFAOYSA-N -1 3 357.193 3.759 20 0 FHADHM Cc1cc(Br)ccc1CN[C@@H](C(=O)[O-])c1cccc(F)c1 ZINC000426812210 944833051 /nfs/dbraw/zinc/83/30/51/944833051.db2.gz QBLQEBZYGYMYNN-OAHLLOKOSA-N -1 3 352.203 3.812 20 0 FHADHM O=C(Nc1ccccc1C(=O)N1CCCC1)c1ccc2c(c1[O-])CCCC2 ZINC000436946838 944834625 /nfs/dbraw/zinc/83/46/25/944834625.db2.gz KOVRTILCMOHOOP-UHFFFAOYSA-N -1 3 364.445 3.759 20 0 FHADHM Cc1ccc(-c2nc(-c3cccc(OCC(F)(F)F)n3)no2)c([O-])c1 ZINC000436948280 944836012 /nfs/dbraw/zinc/83/60/12/944836012.db2.gz UBCQWGJHSGOSED-UHFFFAOYSA-N -1 3 351.284 3.754 20 0 FHADHM Cc1cc(CN[C@@H](C(=O)[O-])c2cccc(F)c2)ccc1Br ZINC000426820209 944841729 /nfs/dbraw/zinc/84/17/29/944841729.db2.gz KGFFIBIKJKTKFD-OAHLLOKOSA-N -1 3 352.203 3.812 20 0 FHADHM COc1ccc([C@H](NCc2cccc(-c3ccccn3)c2)C(=O)[O-])cc1F ZINC000426822034 944844004 /nfs/dbraw/zinc/84/40/04/944844004.db2.gz ZFCIPQUWWQBGAH-FQEVSTJZSA-N -1 3 366.392 3.812 20 0 FHADHM COC(=O)c1ccc(-c2nc(Cc3c[nH]c4cc(Cl)ccc34)no2)[n-]1 ZINC000426449531 944844860 /nfs/dbraw/zinc/84/48/60/944844860.db2.gz JLZLSGILENDCCB-UHFFFAOYSA-N -1 3 356.769 3.577 20 0 FHADHM COc1ccc([C@@H](NCc2ccc(OC(F)(F)F)cc2)C(=O)[O-])cc1F ZINC000426823767 944847737 /nfs/dbraw/zinc/84/77/37/944847737.db2.gz JYLYVAQJNRTINI-OAHLLOKOSA-N -1 3 373.302 3.648 20 0 FHADHM CC1(C)Cc2ccc(C(=O)Nc3nc(-c4ccccn4)cs3)c([O-])c2O1 ZINC000436951743 944848625 /nfs/dbraw/zinc/84/86/25/944848625.db2.gz SVXDFLFQFFQBJR-UHFFFAOYSA-N -1 3 367.430 3.877 20 0 FHADHM CCCN(C(=O)c1cc(OC)c([O-])c(OC)c1)[C@H]1CCCc2cccnc21 ZINC000436954417 944849454 /nfs/dbraw/zinc/84/94/54/944849454.db2.gz GOHLQXKQOYVYRO-INIZCTEOSA-N -1 3 370.449 3.734 20 0 FHADHM Cc1nnc([C@@H](C)NC(=O)c2cc(Cc3ccccc3)ccc2[O-])s1 ZINC000436956556 944853003 /nfs/dbraw/zinc/85/30/03/944853003.db2.gz SFTSGSLHYFSSLM-GFCCVEGCSA-N -1 3 353.447 3.634 20 0 FHADHM CCc1ccc(NC(=O)[C@@H](C)Sc2ccccc2-c2nnn[n-]2)cc1 ZINC000736688059 944868268 /nfs/dbraw/zinc/86/82/68/944868268.db2.gz AIGQMRJPUXSYFQ-GFCCVEGCSA-N -1 3 353.451 3.548 20 0 FHADHM CCc1ccc(NC(=O)[C@@H](C)Sc2ccccc2-c2nn[n-]n2)cc1 ZINC000736688059 944868277 /nfs/dbraw/zinc/86/82/77/944868277.db2.gz AIGQMRJPUXSYFQ-GFCCVEGCSA-N -1 3 353.451 3.548 20 0 FHADHM Cc1ccc(NC(=O)c2ccc3c(c2[O-])CCCC3)cc1C(=O)N(C)C ZINC000436979637 944870694 /nfs/dbraw/zinc/87/06/94/944870694.db2.gz ZTKLNXFTJWHZLH-UHFFFAOYSA-N -1 3 352.434 3.534 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N[C@H](C)c2cc3cccc(F)c3o2)c1 ZINC000436982173 944872626 /nfs/dbraw/zinc/87/26/26/944872626.db2.gz GHZDVDDGTQYYIW-SNVBAGLBSA-N -1 3 356.353 3.727 20 0 FHADHM Cc1ccc(C(=O)Nc2cccc(CN3C[C@@H](C)O[C@H](C)C3)c2)c([O-])c1C ZINC000436983111 944874216 /nfs/dbraw/zinc/87/42/16/944874216.db2.gz VOKVUOQUVFTPOH-HZPDHXFCSA-N -1 3 368.477 3.871 20 0 FHADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CCc2ncsc2C1 ZINC000438684516 944908628 /nfs/dbraw/zinc/90/86/28/944908628.db2.gz WEWFSZZMZSMXAQ-UHFFFAOYSA-N -1 3 350.443 3.638 20 0 FHADHM O=C(Nc1ncccc1[O-])C1(Cc2ccc(OC(F)(F)F)cc2)CC1 ZINC000439761070 944943655 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ZINC000824506104 946751727 /nfs/dbraw/zinc/75/17/27/946751727.db2.gz LGEQAMRHJACDIL-NSHDSACASA-N -1 3 364.434 3.964 20 0 FHADHM C[C@H](NC(=O)Nc1csc2ccccc12)c1ccc(-c2nn[n-]n2)cc1 ZINC000824506104 946751734 /nfs/dbraw/zinc/75/17/34/946751734.db2.gz LGEQAMRHJACDIL-NSHDSACASA-N -1 3 364.434 3.964 20 0 FHADHM C[C@@H](N[C@H](CCc1ccccc1)C(F)F)c1cccc(-c2nnn[n-]2)c1 ZINC000824529995 946765283 /nfs/dbraw/zinc/76/52/83/946765283.db2.gz ISIJYPOLTSJSGU-CXAGYDPISA-N -1 3 357.408 3.784 20 0 FHADHM C[C@@H](N[C@H](CCc1ccccc1)C(F)F)c1cccc(-c2nn[n-]n2)c1 ZINC000824529995 946765290 /nfs/dbraw/zinc/76/52/90/946765290.db2.gz ISIJYPOLTSJSGU-CXAGYDPISA-N -1 3 357.408 3.784 20 0 FHADHM C[C@@H](N[C@@H](c1ccccc1)c1ccccn1)c1cccc(-c2nn[n-]n2)c1 ZINC000824538442 946775234 /nfs/dbraw/zinc/77/52/34/946775234.db2.gz JDELFGHXTPLTLQ-QRWLVFNGSA-N -1 3 356.433 3.702 20 0 FHADHM Cc1cc(S(=O)(=O)[N-]CCc2cc3ccccc3[nH]2)sc1Cl ZINC000473938068 946798234 /nfs/dbraw/zinc/79/82/34/946798234.db2.gz OQJLYCXRPBHWIG-UHFFFAOYSA-N -1 3 354.884 3.712 20 0 FHADHM COc1cccc(SCC(=O)Nc2ccc(Br)cc2[O-])c1 ZINC000112868213 946805332 /nfs/dbraw/zinc/80/53/32/946805332.db2.gz FMQBZCDYVRNCEG-UHFFFAOYSA-N -1 3 368.252 3.894 20 0 FHADHM CCOc1cc(C(=O)Nc2ccc(-c3nc(C)cc(=O)[n-]3)cc2)ccc1C ZINC000113037428 946851990 /nfs/dbraw/zinc/85/19/90/946851990.db2.gz BNHUYWVSGCWCAV-UHFFFAOYSA-N -1 3 363.417 3.705 20 0 FHADHM Cc1cc(S(=O)(=O)[N-][C@H](C)CC(=O)c2ccccc2)sc1Cl ZINC000473945134 946853424 /nfs/dbraw/zinc/85/34/24/946853424.db2.gz MPAVVBUKBWEQDQ-LLVKDONJSA-N -1 3 357.884 3.650 20 0 FHADHM COc1ccc(C(=O)N2C[C@H](c3ccccc3Cl)OC[C@H]2C)c([O-])c1 ZINC000110515935 946871154 /nfs/dbraw/zinc/87/11/54/946871154.db2.gz XSOBGTZHBRMNQU-KZULUSFZSA-N -1 3 361.825 3.656 20 0 FHADHM Cc1cc(S(=O)(=O)[N-][C@@H]2CCO[C@H](CC(C)C)C2)sc1Cl ZINC000473948834 946871493 /nfs/dbraw/zinc/87/14/93/946871493.db2.gz IFPOZTILLCALKG-VXGBXAGGSA-N -1 3 351.921 3.582 20 0 FHADHM CNC(=O)c1cccc([N-]S(=O)(=O)c2c(C)c(C)c(C)c(C)c2C)c1C ZINC000032631970 946895934 /nfs/dbraw/zinc/89/59/34/946895934.db2.gz RGWVRVJGYUGPHR-UHFFFAOYSA-N -1 3 374.506 3.698 20 0 FHADHM Cc1cc(Br)cc(CNCc2ncccc2[O-])c1OC(F)F ZINC000475337092 946904893 /nfs/dbraw/zinc/90/48/93/946904893.db2.gz PAXGJLVXWSGYIF-UHFFFAOYSA-N -1 3 373.197 3.749 20 0 FHADHM COc1ccc(Cl)c(S(=O)(=O)[N-][C@H]2CCC[C@H](C(F)(F)F)C2)c1 ZINC000112361195 946914073 /nfs/dbraw/zinc/91/40/73/946914073.db2.gz KUMSEDDAOVFMQK-UWVGGRQHSA-N -1 3 371.808 3.748 20 0 FHADHM CCc1ccc([O-])c(C(=O)N2CCOC[C@H]2c2nc3ccccc3s2)c1 ZINC000328643133 946962193 /nfs/dbraw/zinc/96/21/93/946962193.db2.gz FFVDWHNYKOLYPM-INIZCTEOSA-N -1 3 368.458 3.778 20 0 FHADHM CCC[C@@]1(CO)CCCN1C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000444535254 946996107 /nfs/dbraw/zinc/99/61/07/946996107.db2.gz LOIAJAYLMSDQDR-NRFANRHFSA-N -1 3 355.434 3.952 20 0 FHADHM O=S(=O)([N-][C@@H]1CCCC12CCOCC2)c1c(Cl)cccc1Cl ZINC000328851130 947065337 /nfs/dbraw/zinc/06/53/37/947065337.db2.gz WPHLUDPRDGSKOL-CYBMUJFWSA-N -1 3 364.294 3.621 20 0 FHADHM [O-]c1ccc(F)c(CN2CCC3(CC2)C[C@H](O)c2ccccc2O3)c1F ZINC000897265367 947071594 /nfs/dbraw/zinc/07/15/94/947071594.db2.gz DNAUTBLCRKEXLC-KRWDZBQOSA-N -1 3 361.388 3.521 20 0 FHADHM CCC(CC)n1nc(C(=O)O[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1C ZINC000825113749 947080464 /nfs/dbraw/zinc/08/04/64/947080464.db2.gz FKZFRXICPQUYBP-ZDUSSCGKSA-N -1 3 368.441 3.651 20 0 FHADHM CCC(CC)n1nc(C(=O)O[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1C ZINC000825113749 947080476 /nfs/dbraw/zinc/08/04/76/947080476.db2.gz FKZFRXICPQUYBP-ZDUSSCGKSA-N -1 3 368.441 3.651 20 0 FHADHM CCC(CC)c1cc(CNc2ncc(Cl)c(C)c2-c2nnn[n-]2)on1 ZINC000825115296 947085429 /nfs/dbraw/zinc/08/54/29/947085429.db2.gz WDDWIBBYVLXDMJ-UHFFFAOYSA-N -1 3 361.837 3.727 20 0 FHADHM CCC(CC)c1cc(CNc2ncc(Cl)c(C)c2-c2nn[n-]n2)on1 ZINC000825115296 947085440 /nfs/dbraw/zinc/08/54/40/947085440.db2.gz WDDWIBBYVLXDMJ-UHFFFAOYSA-N -1 3 361.837 3.727 20 0 FHADHM O=c1[n-]c(CN2CC[C@H](CC(F)(F)F)C2)nc2c3ccccc3oc21 ZINC000444691843 947116294 /nfs/dbraw/zinc/11/62/94/947116294.db2.gz DLFWNFBUDXURMT-SNVBAGLBSA-N -1 3 351.328 3.856 20 0 FHADHM CCN(C(=O)[C@@H]1CCc2c1cccc2Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000825367129 947166546 /nfs/dbraw/zinc/16/65/46/947166546.db2.gz JHMKFJIVOMCSDR-MRXNPFEDSA-N -1 3 367.840 3.603 20 0 FHADHM CCN(C(=O)[C@@H]1CCc2c1cccc2Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000825367129 947166554 /nfs/dbraw/zinc/16/65/54/947166554.db2.gz JHMKFJIVOMCSDR-MRXNPFEDSA-N -1 3 367.840 3.603 20 0 FHADHM CCCc1nnc([N-]C(=O)c2cnc(Cc3ccccc3F)s2)s1 ZINC000475613023 947190533 /nfs/dbraw/zinc/19/05/33/947190533.db2.gz QEFLGXJYNYCTHZ-UHFFFAOYSA-N -1 3 362.455 3.929 20 0 FHADHM O=C(NCc1ccc([O-])c(F)c1)[C@H]1C[C@@H]1c1ccccc1C(F)(F)F ZINC000523424953 947235771 /nfs/dbraw/zinc/23/57/71/947235771.db2.gz XPVWYAGIBWQWIQ-OLZOCXBDSA-N -1 3 353.315 3.970 20 0 FHADHM CCOc1ccc(NCc2ccc(-c3nnn[n-]3)cc2OC)cc1Cl ZINC000825643302 947266627 /nfs/dbraw/zinc/26/66/27/947266627.db2.gz LHTBLDAKFIKLSI-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM CCOc1ccc(NCc2ccc(-c3nn[n-]n3)cc2OC)cc1Cl ZINC000825643302 947266637 /nfs/dbraw/zinc/26/66/37/947266637.db2.gz LHTBLDAKFIKLSI-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NCCOC3CCCCCC3)nc2)n1 ZINC000301288069 947268853 /nfs/dbraw/zinc/26/88/53/947268853.db2.gz NQAWVYBKOQCBKT-UHFFFAOYSA-N -1 3 356.470 3.958 20 0 FHADHM Cc1cn2cc([N-]S(=O)(=O)c3ccc(C)c(C(F)(F)F)c3)ccc2n1 ZINC000523458467 947280937 /nfs/dbraw/zinc/28/09/37/947280937.db2.gz GRFQPGYTGHUCIQ-UHFFFAOYSA-N -1 3 369.368 3.771 20 0 FHADHM O=C(NCCSc1ccc(Cl)cc1)NCc1ccc([O-])c(F)c1 ZINC000523470759 947291263 /nfs/dbraw/zinc/29/12/63/947291263.db2.gz NVSVJSWRYBQZBS-UHFFFAOYSA-N -1 3 354.834 3.776 20 0 FHADHM O=C(NCC1(c2ccc(C(F)(F)F)cc2)CC1)c1c([O-])cccc1O ZINC000444850327 947296846 /nfs/dbraw/zinc/29/68/46/947296846.db2.gz ONJVDJZMPWHURB-UHFFFAOYSA-N -1 3 351.324 3.578 20 0 FHADHM CCc1cnc(CN[C@H](C)c2ccc(-c3cccc(-c4nnn[n-]4)c3)cc2)o1 ZINC000825735699 947305570 /nfs/dbraw/zinc/30/55/70/947305570.db2.gz SOIPADQSPCVXLO-CQSZACIVSA-N -1 3 374.448 3.935 20 0 FHADHM CCc1cnc(CN[C@H](C)c2ccc(-c3cccc(-c4nn[n-]n4)c3)cc2)o1 ZINC000825735699 947305585 /nfs/dbraw/zinc/30/55/85/947305585.db2.gz SOIPADQSPCVXLO-CQSZACIVSA-N -1 3 374.448 3.935 20 0 FHADHM CC(C)(C(=O)N1CCC(C(=O)Nc2cc(Cl)ccc2[O-])CC1)C(F)F ZINC000331009930 947333009 /nfs/dbraw/zinc/33/30/09/947333009.db2.gz RQDXGAHEOWITIP-UHFFFAOYSA-N -1 3 374.815 3.514 20 0 FHADHM CC(C)c1ccc(C(=O)N2CCC[C@@H](CNC(=O)C(C)(C)C)C2)c([O-])c1 ZINC000331227134 947364388 /nfs/dbraw/zinc/36/43/88/947364388.db2.gz DCWOZNMULCDHCV-HNNXBMFYSA-N -1 3 360.498 3.530 20 0 FHADHM COCCOc1ccc(S(=O)(=O)[N-]c2cccc(C(C)(F)F)c2)cc1 ZINC000188560017 947441084 /nfs/dbraw/zinc/44/10/84/947441084.db2.gz YWNMRJAROUQOKS-UHFFFAOYSA-N -1 3 371.405 3.624 20 0 FHADHM O=c1[n-]c(SC[C@@H]2C[C@H]3C[C@H]3C2)nc2c1cnn2Cc1ccccc1 ZINC000663248661 947531991 /nfs/dbraw/zinc/53/19/91/947531991.db2.gz QKGSFJXGILKODG-QDMKHBRRSA-N -1 3 352.463 3.718 20 0 FHADHM CCCN(C(=O)c1cc2c(cc1[O-])OCO2)[C@H]1CCc2ccccc2C1 ZINC000436536742 947601239 /nfs/dbraw/zinc/60/12/39/947601239.db2.gz CFZBIMUZPASSDI-INIZCTEOSA-N -1 3 353.418 3.531 20 0 FHADHM CCN(Cc1ccccc1NC(=O)c1ccc2c(c1[O-])CCCC2)C(C)=O ZINC000185051238 947646889 /nfs/dbraw/zinc/64/68/89/947646889.db2.gz CTESHTHGTSKSLV-UHFFFAOYSA-N -1 3 366.461 3.892 20 0 FHADHM CSc1ccc(C)c(NC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000826230299 947674717 /nfs/dbraw/zinc/67/47/17/947674717.db2.gz MWLGTXUVENDQSG-GFCCVEGCSA-N -1 3 368.466 3.780 20 0 FHADHM CSc1ccc(C)c(NC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000826230299 947674726 /nfs/dbraw/zinc/67/47/26/947674726.db2.gz MWLGTXUVENDQSG-GFCCVEGCSA-N -1 3 368.466 3.780 20 0 FHADHM Cc1c(Cl)cnc(N2CCS[C@H](c3ccccc3)C2)c1-c1nnn[n-]1 ZINC000826238399 947703464 /nfs/dbraw/zinc/70/34/64/947703464.db2.gz FQZJIUNVTVTWPZ-AWEZNQCLSA-N -1 3 372.885 3.518 20 0 FHADHM Cc1c(Cl)cnc(N2CCS[C@H](c3ccccc3)C2)c1-c1nn[n-]n1 ZINC000826238399 947703471 /nfs/dbraw/zinc/70/34/71/947703471.db2.gz FQZJIUNVTVTWPZ-AWEZNQCLSA-N -1 3 372.885 3.518 20 0 FHADHM O=C(Nc1cccc(Oc2ccccn2)c1)c1cc2c(cc1[O-])OCO2 ZINC000436573866 947709837 /nfs/dbraw/zinc/70/98/37/947709837.db2.gz IYIUJZPKCGOPRL-UHFFFAOYSA-N -1 3 350.330 3.561 20 0 FHADHM Cc1c(NC(=O)Nc2ccc(F)cc2OC(C)C)cccc1-c1nnn[n-]1 ZINC000826241477 947716271 /nfs/dbraw/zinc/71/62/71/947716271.db2.gz FJKNQGMODDHLLT-UHFFFAOYSA-N -1 3 370.388 3.745 20 0 FHADHM Cc1c(NC(=O)Nc2ccc(F)cc2OC(C)C)cccc1-c1nn[n-]n1 ZINC000826241477 947716278 /nfs/dbraw/zinc/71/62/78/947716278.db2.gz FJKNQGMODDHLLT-UHFFFAOYSA-N -1 3 370.388 3.745 20 0 FHADHM Cc1cc(CNc2ccn(-c3ccc(Cl)cc3-c3nnn[n-]3)n2)c(C)o1 ZINC000826267134 947771320 /nfs/dbraw/zinc/77/13/20/947771320.db2.gz SOJXWPANVYJXHX-UHFFFAOYSA-N -1 3 369.816 3.528 20 0 FHADHM Cc1cc(CNc2ccn(-c3ccc(Cl)cc3-c3nn[n-]n3)n2)c(C)o1 ZINC000826267134 947771329 /nfs/dbraw/zinc/77/13/29/947771329.db2.gz SOJXWPANVYJXHX-UHFFFAOYSA-N -1 3 369.816 3.528 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)Nc1ccc(F)cc1OC(C)C ZINC000826277664 947799802 /nfs/dbraw/zinc/79/98/02/947799802.db2.gz CHAVXVMDDACCSQ-UHFFFAOYSA-N -1 3 370.388 3.745 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)Nc1ccc(F)cc1OC(C)C ZINC000826277664 947799813 /nfs/dbraw/zinc/79/98/13/947799813.db2.gz CHAVXVMDDACCSQ-UHFFFAOYSA-N -1 3 370.388 3.745 20 0 FHADHM Cc1cccc2nc(CS[C@@H](C)c3ccc(-c4nnn[n-]4)cc3)cn21 ZINC000826305253 947876630 /nfs/dbraw/zinc/87/66/30/947876630.db2.gz PYGFPSALKMEZKQ-ZDUSSCGKSA-N -1 3 350.451 3.817 20 0 FHADHM Cc1cccc2nc(CS[C@@H](C)c3ccc(-c4nn[n-]n4)cc3)cn21 ZINC000826305253 947876638 /nfs/dbraw/zinc/87/66/38/947876638.db2.gz PYGFPSALKMEZKQ-ZDUSSCGKSA-N -1 3 350.451 3.817 20 0 FHADHM CCCCOc1ccc(C(=O)N2CCO[C@@H](c3ccccc3)C2)c([O-])c1 ZINC000190059329 947903782 /nfs/dbraw/zinc/90/37/82/947903782.db2.gz UJUYMASPHXLDPN-HXUWFJFHSA-N -1 3 355.434 3.785 20 0 FHADHM Cc1ccoc1C(=O)N[C@@H](C)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000826315609 947921356 /nfs/dbraw/zinc/92/13/56/947921356.db2.gz NPZXVIQKZPPWJS-AWEZNQCLSA-N -1 3 373.416 3.926 20 0 FHADHM Cc1ccoc1C(=O)N[C@@H](C)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000826315609 947921363 /nfs/dbraw/zinc/92/13/63/947921363.db2.gz NPZXVIQKZPPWJS-AWEZNQCLSA-N -1 3 373.416 3.926 20 0 FHADHM Cc1nc(C(C)C)sc1[C@H](C)OC(=O)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000826323363 947945343 /nfs/dbraw/zinc/94/53/43/947945343.db2.gz AYMAJPFLSZRRKJ-LBPRGKRZSA-N -1 3 371.466 3.602 20 0 FHADHM Cc1nc(C(C)C)sc1[C@H](C)OC(=O)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000826323363 947945354 /nfs/dbraw/zinc/94/53/54/947945354.db2.gz AYMAJPFLSZRRKJ-LBPRGKRZSA-N -1 3 371.466 3.602 20 0 FHADHM O=S(=O)([N-][C@H]1CCCc2occc21)c1csc(-c2ccccc2)n1 ZINC000500443506 947968971 /nfs/dbraw/zinc/96/89/71/947968971.db2.gz YUQWPCJPJRTCIV-AWEZNQCLSA-N -1 3 360.460 3.759 20 0 FHADHM Clc1cccc(N2CCCC2)c1CNc1cccc(-c2nnn[n-]2)c1 ZINC000826353437 948104358 /nfs/dbraw/zinc/10/43/58/948104358.db2.gz PERLNOBAKBCEPO-UHFFFAOYSA-N -1 3 354.845 3.732 20 0 FHADHM Clc1cccc(N2CCCC2)c1CNc1cccc(-c2nn[n-]n2)c1 ZINC000826353437 948104364 /nfs/dbraw/zinc/10/43/64/948104364.db2.gz PERLNOBAKBCEPO-UHFFFAOYSA-N -1 3 354.845 3.732 20 0 FHADHM FC(F)(F)[C@H](NCc1ccc(Cl)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000826367357 948146363 /nfs/dbraw/zinc/14/63/63/948146363.db2.gz WFMAPSQTKFJYIN-CQSZACIVSA-N -1 3 367.762 3.913 20 0 FHADHM FC(F)(F)[C@H](NCc1ccc(Cl)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000826367357 948146370 /nfs/dbraw/zinc/14/63/70/948146370.db2.gz WFMAPSQTKFJYIN-CQSZACIVSA-N -1 3 367.762 3.913 20 0 FHADHM O=C(c1cc2c(cc1[O-])OCO2)N1CCC(=Cc2cccc(F)c2)CC1 ZINC000054030344 948231979 /nfs/dbraw/zinc/23/19/79/948231979.db2.gz RMXAJSSKWLVZLN-UHFFFAOYSA-N -1 3 355.365 3.580 20 0 FHADHM O=C(CCCc1ccsc1)Nc1sc2c(c1-c1nnn[n-]1)CCCC2 ZINC000826406528 948234918 /nfs/dbraw/zinc/23/49/18/948234918.db2.gz AZIKMTVPQBFXEI-UHFFFAOYSA-N -1 3 373.507 3.830 20 0 FHADHM O=C(CCCc1ccsc1)Nc1sc2c(c1-c1nn[n-]n1)CCCC2 ZINC000826406528 948234929 /nfs/dbraw/zinc/23/49/29/948234929.db2.gz AZIKMTVPQBFXEI-UHFFFAOYSA-N -1 3 373.507 3.830 20 0 FHADHM CCOc1ccc(CN[C@@H](CCC(=O)[O-])c2ccc(OC)cc2)cc1F ZINC000417577517 948281472 /nfs/dbraw/zinc/28/14/72/948281472.db2.gz LVPQQPGJBXGGOT-SFHVURJKSA-N -1 3 361.413 3.929 20 0 FHADHM [O-]c1ccc(F)c(CNCc2ccnc(OCc3ccccc3)c2)c1F ZINC000512045135 948300307 /nfs/dbraw/zinc/30/03/07/948300307.db2.gz KTJISLWNWRTUFU-UHFFFAOYSA-N -1 3 356.372 3.934 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)[C@H]1CCc2c1cccc2Cl ZINC000826452736 948322409 /nfs/dbraw/zinc/32/24/09/948322409.db2.gz GCRBIZQGFGREJR-LBPRGKRZSA-N -1 3 374.231 3.842 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)[C@H]1CCc2c1cccc2Cl ZINC000826452736 948322417 /nfs/dbraw/zinc/32/24/17/948322417.db2.gz GCRBIZQGFGREJR-LBPRGKRZSA-N -1 3 374.231 3.842 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)[C@@H]1CCc2c1cccc2Cl ZINC000826452735 948322492 /nfs/dbraw/zinc/32/24/92/948322492.db2.gz GCRBIZQGFGREJR-GFCCVEGCSA-N -1 3 374.231 3.842 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)[C@@H]1CCc2c1cccc2Cl ZINC000826452735 948322501 /nfs/dbraw/zinc/32/25/01/948322501.db2.gz GCRBIZQGFGREJR-GFCCVEGCSA-N -1 3 374.231 3.842 20 0 FHADHM Cc1ccc([C@@H]2[C@H](C)CCCN2C(=O)c2cnc3c(cnn3C)c2[O-])cc1 ZINC000512063829 948336513 /nfs/dbraw/zinc/33/65/13/948336513.db2.gz JZSMWNCINIDVTN-KDOFPFPSSA-N -1 3 364.449 3.596 20 0 FHADHM COc1cc(CN[C@H]2C[C@@H](C(=O)[O-])c3ccccc32)cc(Cl)c1OC ZINC000417611119 948345221 /nfs/dbraw/zinc/34/52/21/948345221.db2.gz AKWLSYOHTJZQDD-ZBFHGGJFSA-N -1 3 361.825 3.760 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@@H]3CCC[C@H](OC)C3)c2)n1 ZINC000432407571 948346635 /nfs/dbraw/zinc/34/66/35/948346635.db2.gz NFQZAMNSFDUDKO-PBHICJAKSA-N -1 3 355.438 3.555 20 0 FHADHM CCCCOCCC[N-]S(=O)(=O)c1c(Cl)ccc(C)c1Cl ZINC000614602399 948349134 /nfs/dbraw/zinc/34/91/34/948349134.db2.gz RFZPBSBUBFJPAV-UHFFFAOYSA-N -1 3 354.299 3.787 20 0 FHADHM Cc1ccc([C@@H]2OCCC[C@H]2[N-]S(=O)(=O)c2ccc(Cl)s2)cc1 ZINC000467800793 948473011 /nfs/dbraw/zinc/47/30/11/948473011.db2.gz OPRZYKJULNURNT-CJNGLKHVSA-N -1 3 371.911 3.909 20 0 FHADHM CCC1(C(=O)Nc2ccc([N-]S(=O)(=O)CC)c(OC)c2)CCCCC1 ZINC000184098282 948525327 /nfs/dbraw/zinc/52/53/27/948525327.db2.gz FVLSKXCCRGYTLN-UHFFFAOYSA-N -1 3 368.499 3.756 20 0 FHADHM CC(C)(Cc1ccc(Cl)cc1)C(=O)Nc1cc(-c2nnn[n-]2)ccc1F ZINC001460784575 948526236 /nfs/dbraw/zinc/52/62/36/948526236.db2.gz JTSFCBYULPYPIN-UHFFFAOYSA-N -1 3 373.819 3.867 20 0 FHADHM CC(C)(Cc1ccc(Cl)cc1)C(=O)Nc1cc(-c2nn[n-]n2)ccc1F ZINC001460784575 948526240 /nfs/dbraw/zinc/52/62/40/948526240.db2.gz JTSFCBYULPYPIN-UHFFFAOYSA-N -1 3 373.819 3.867 20 0 FHADHM CC(C)c1ccc(OCCC(=O)Nc2cc(-c3nnn[n-]3)ccc2F)cc1 ZINC001460783103 948526645 /nfs/dbraw/zinc/52/66/45/948526645.db2.gz BAVFRYDLOOKMSD-UHFFFAOYSA-N -1 3 369.400 3.537 20 0 FHADHM CC(C)c1ccc(OCCC(=O)Nc2cc(-c3nn[n-]n3)ccc2F)cc1 ZINC001460783103 948526656 /nfs/dbraw/zinc/52/66/56/948526656.db2.gz BAVFRYDLOOKMSD-UHFFFAOYSA-N -1 3 369.400 3.537 20 0 FHADHM O=C(CCN1C(=O)CSc2ccccc21)Nc1cc(Cl)ccc1[O-] ZINC000520974734 948620434 /nfs/dbraw/zinc/62/04/34/948620434.db2.gz GCLVSCKTGXRNIG-UHFFFAOYSA-N -1 3 362.838 3.513 20 0 FHADHM O=C(Cc1noc(-c2ccccc2[O-])n1)Nc1c(Cl)cccc1Cl ZINC000445385945 948735567 /nfs/dbraw/zinc/73/55/67/948735567.db2.gz QWFUIOFIQNHZHH-UHFFFAOYSA-N -1 3 364.188 3.930 20 0 FHADHM O=C(Cc1noc(-c2ccccc2[O-])n1)Nc1cc(Cl)cc(Cl)c1 ZINC000445372102 948740209 /nfs/dbraw/zinc/74/02/09/948740209.db2.gz CUQPSBUDVFAFAY-UHFFFAOYSA-N -1 3 364.188 3.930 20 0 FHADHM COc1ccc(C(=O)N[C@@H](C)Cc2ccc(Br)cc2)c([O-])c1 ZINC000107871054 209281799 /nfs/dbraw/zinc/28/17/99/209281799.db2.gz WRZBSLDTLLGXNA-NSHDSACASA-N -1 3 364.239 3.524 20 0 FHADHM Cc1ccc(C(=O)NCc2ccc(NC(=O)c3ccco3)cc2)c([O-])c1C ZINC000097472842 209181586 /nfs/dbraw/zinc/18/15/86/209181586.db2.gz BZBZUOONAFZPKJ-UHFFFAOYSA-N -1 3 364.401 3.784 20 0 FHADHM Cn1[n-]c(=NC(=O)[C@H]2C[C@H]2c2c(F)cccc2Cl)cc1OC(F)F ZINC000490993194 515352608 /nfs/dbraw/zinc/35/26/08/515352608.db2.gz XICCABMUWVGRPB-SFYZADRCSA-N -1 3 359.735 3.556 20 0 FHADHM C[C@@H](CC(F)(F)F)NC(=O)N=c1cc2ccc(Br)cn2[n-]1 ZINC000482248904 515624384 /nfs/dbraw/zinc/62/43/84/515624384.db2.gz ZZKVAPFIYNFDRJ-ZETCQYMHSA-N -1 3 365.153 3.559 20 0 FHADHM CCN(C(=O)N=c1[n-]nc(C)s1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000473687111 515715724 /nfs/dbraw/zinc/71/57/24/515715724.db2.gz PKOUMHIDPHNMBR-CZUORRHYSA-N -1 3 359.499 3.536 20 0 FHADHM Cc1ccc(CC(=O)N=c2cc([C@@H]3CCCO3)[n-][nH]2)cc1Br ZINC000473852435 515775270 /nfs/dbraw/zinc/77/52/70/515775270.db2.gz FMQLAAHVYMTSKA-AWEZNQCLSA-N -1 3 364.243 3.513 20 0 FHADHM COc1cc(C(=O)N=c2cc([C@@H]3CCCO3)[n-][nH]2)ccc1OCC(C)C ZINC000473854479 515777117 /nfs/dbraw/zinc/77/71/17/515777117.db2.gz YPIJTUWFTYAEEB-HNNXBMFYSA-N -1 3 359.426 3.557 20 0 FHADHM O=C(N=c1cc(-c2ccccc2)[n-][nH]1)c1cn(-c2ccc(Cl)cc2)nn1 ZINC000523305169 516428894 /nfs/dbraw/zinc/42/88/94/516428894.db2.gz HCAZEFXIVVYEEO-UHFFFAOYSA-N -1 3 364.796 3.563 20 0 FHADHM O=C(N=c1cc(-c2ccncc2)[n-][nH]1)c1cnn(-c2ccccc2Cl)c1 ZINC000523503558 516489928 /nfs/dbraw/zinc/48/99/28/516489928.db2.gz NOPOPROKHIQJBB-UHFFFAOYSA-N -1 3 364.796 3.563 20 0 FHADHM CCCc1ccc(-c2cc(=NC(=O)[C@@H](C)NC(=O)C(C)(C)C)[nH][n-]2)cc1 ZINC000523821651 516587669 /nfs/dbraw/zinc/58/76/69/516587669.db2.gz OOBPRURPZNWNPY-CYBMUJFWSA-N -1 3 356.470 3.519 20 0 FHADHM CCc1[n-][nH]c(=NC(=O)c2cn(CC)c3ccc(Cl)cc3c2=O)c1C ZINC000544624783 516844035 /nfs/dbraw/zinc/84/40/35/516844035.db2.gz KBSZBCARHGDJCI-UHFFFAOYSA-N -1 3 358.829 3.521 20 0 FHADHM Cc1[nH]c(-c2cccc(C)c2)nc1C(=O)N=c1cc([C@@H]2CCCO2)[n-][nH]1 ZINC000527208566 517562439 /nfs/dbraw/zinc/56/24/39/517562439.db2.gz QDQCUZUMWKVTAB-HNNXBMFYSA-N -1 3 351.410 3.520 20 0 FHADHM CCc1c(C(=O)N=c2cc([C@@H]3CCCO3)[n-][nH]2)cnn1-c1ccc(C)cc1 ZINC000527208456 517562943 /nfs/dbraw/zinc/56/29/43/517562943.db2.gz KNGQCKXAHDCZTA-SFHVURJKSA-N -1 3 365.437 3.570 20 0 FHADHM O=C(N=c1cc(-c2cccnc2)[n-][nH]1)c1ccc2[nH]c(C(F)F)nc2c1 ZINC000533674703 517568291 /nfs/dbraw/zinc/56/82/91/517568291.db2.gz DBDMDVXHUSQTAH-UHFFFAOYSA-N -1 3 354.320 3.538 20 0 FHADHM CCOC(=O)c1cnc(C)c(C(=O)N=c2cc(-c3ccccc3C)[n-][nH]2)c1 ZINC000539320477 517991546 /nfs/dbraw/zinc/99/15/46/517991546.db2.gz KUPJNEMIXJPRBJ-UHFFFAOYSA-N -1 3 364.405 3.518 20 0 FHADHM CC[C@H]1CCCCN1CCNC(=O)N=c1[n-]nc(Cc2ccccc2)s1 ZINC000603559916 520305304 /nfs/dbraw/zinc/30/53/04/520305304.db2.gz KYVWERDWIUPYLH-INIZCTEOSA-N -1 3 373.526 3.515 20 0 FHADHM COc1cc(C)cc(C(=O)N2CCc3c2cccc3C(F)(F)F)c1[O-] ZINC000185041844 567819984 /nfs/dbraw/zinc/81/99/84/567819984.db2.gz VZDCJUKOMJOSID-UHFFFAOYSA-N -1 3 351.324 3.931 20 0 FHADHM Cc1nn(C)c(C)c1[C@@H]1CCCN1C(=O)c1ccc2c(c1[O-])CCCC2 ZINC000186047114 567881659 /nfs/dbraw/zinc/88/16/59/567881659.db2.gz NHFBONQKUWZJLK-SFHVURJKSA-N -1 3 353.466 3.599 20 0 FHADHM CCC(CC)(CCO)CNC(=O)c1c[n-]nc1-c1ccc(Cl)s1 ZINC000186548281 567945891 /nfs/dbraw/zinc/94/58/91/567945891.db2.gz GZBAXTJWQCQUGI-UHFFFAOYSA-N -1 3 355.891 3.710 20 0 FHADHM Cc1nocc1C(=O)[N-]c1ccc(F)c(C(=O)OC(C)(C)C)c1Cl ZINC000602400097 567975687 /nfs/dbraw/zinc/97/56/87/567975687.db2.gz GTMWBYMKYVGYGV-UHFFFAOYSA-N -1 3 354.765 3.983 20 0 FHADHM Cc1cc(NC(=O)c2cn[n-]c2-c2ccsc2)ccc1C(=O)NC(C)C ZINC000186791952 567983828 /nfs/dbraw/zinc/98/38/28/567983828.db2.gz UCUBOGFNFWJYHK-UHFFFAOYSA-N -1 3 368.462 3.837 20 0 FHADHM Cc1cc(NC(=O)c2c[n-]nc2-c2ccsc2)ccc1C(=O)NC(C)C ZINC000186791952 567983829 /nfs/dbraw/zinc/98/38/29/567983829.db2.gz UCUBOGFNFWJYHK-UHFFFAOYSA-N -1 3 368.462 3.837 20 0 FHADHM COc1ccc([C@H](C)[N-]S(=O)(=O)c2ccccc2SC)cc1F ZINC000186888218 567997665 /nfs/dbraw/zinc/99/76/65/567997665.db2.gz QRVOJYTZWAFJCD-NSHDSACASA-N -1 3 355.456 3.596 20 0 FHADHM CC(=O)Nc1ccc(NC(=O)c2ccc(C(=O)c3cccc([O-])c3)cc2)cc1 ZINC000186894555 568002649 /nfs/dbraw/zinc/00/26/49/568002649.db2.gz OOTGOTJQASHCDL-UHFFFAOYSA-N -1 3 374.396 3.834 20 0 FHADHM CC[C@@H](NC(=O)c1cc(=O)c2cc(Br)ccc2[n-]1)C(C)(C)C ZINC000602768088 568027402 /nfs/dbraw/zinc/02/74/02/568027402.db2.gz UALFVGSKZUYHCY-OAHLLOKOSA-N -1 3 365.271 3.845 20 0 FHADHM CCC[C@H](CC)NC(=O)c1cc(=O)c2cc(Br)ccc2[n-]1 ZINC000602753506 568030766 /nfs/dbraw/zinc/03/07/66/568030766.db2.gz UKFDXXZICAHXGK-NSHDSACASA-N -1 3 351.244 3.599 20 0 FHADHM C[S@@](=O)Cc1cc(NC(=O)Cc2ccc([O-])cc2Cl)ccc1Cl ZINC000151998835 568057831 /nfs/dbraw/zinc/05/78/31/568057831.db2.gz XELBFHJVKJCWKB-QHCPKHFHSA-N -1 3 372.273 3.759 20 0 FHADHM Cc1sc(Br)cc1S(=O)(=O)[N-]c1ccccc1F ZINC000094870603 568154453 /nfs/dbraw/zinc/15/44/53/568154453.db2.gz CLZZTFDPBRVHPU-UHFFFAOYSA-N -1 3 350.234 3.759 20 0 FHADHM Cc1cnc([C@@H]([N-]S(=O)(=O)c2ccc(Cl)c(C)c2)C2CC2)s1 ZINC000655526497 568157169 /nfs/dbraw/zinc/15/71/69/568157169.db2.gz REXOOMQJAWDWOR-AWEZNQCLSA-N -1 3 356.900 3.843 20 0 FHADHM Cc1cnc([C@H]([N-]S(=O)(=O)c2ccc(Cl)c(C)c2)C2CC2)s1 ZINC000655526498 568157295 /nfs/dbraw/zinc/15/72/95/568157295.db2.gz REXOOMQJAWDWOR-CQSZACIVSA-N -1 3 356.900 3.843 20 0 FHADHM Cc1cccc2c1CCCN2Cc1nc2c(cnn2-c2ccccc2)c(=O)[n-]1 ZINC000603943774 568185663 /nfs/dbraw/zinc/18/56/63/568185663.db2.gz PXCBHEZXJCWECF-UHFFFAOYSA-N -1 3 371.444 3.782 20 0 FHADHM CCOC(=O)c1ncc(NC(=O)[C@@H]2C[C@H]2c2cc(Cl)cc(Cl)c2)[n-]1 ZINC000617877706 568208486 /nfs/dbraw/zinc/20/84/86/568208486.db2.gz VZTSQZCGXCBTQK-NWDGAFQWSA-N -1 3 368.220 3.635 20 0 FHADHM CCOC(=O)c1nc(NC(=O)[C@@H]2C[C@H]2c2cc(Cl)cc(Cl)c2)c[n-]1 ZINC000617877706 568208487 /nfs/dbraw/zinc/20/84/87/568208487.db2.gz VZTSQZCGXCBTQK-NWDGAFQWSA-N -1 3 368.220 3.635 20 0 FHADHM CCc1ccc([O-])c(C(=O)NCCc2nc(-c3cccc(Cl)c3)no2)c1 ZINC000604087909 568209959 /nfs/dbraw/zinc/20/99/59/568209959.db2.gz HBJNCECRSNOAKO-UHFFFAOYSA-N -1 3 371.824 3.631 20 0 FHADHM O=C([N-]c1ccc(F)cc1-c1nc(C2CC2)no1)c1ocnc1C(F)F ZINC000636949909 568220750 /nfs/dbraw/zinc/22/07/50/568220750.db2.gz ZALCQMCUYPBQQG-UHFFFAOYSA-N -1 3 364.283 3.931 20 0 FHADHM COC(=O)c1sc2[n-]c(CSc3ccccc3F)nc(=O)c2c1C ZINC000007487628 568236091 /nfs/dbraw/zinc/23/60/91/568236091.db2.gz HYZDJGATBQMJTP-UHFFFAOYSA-N -1 3 364.423 3.511 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)C[C@@H](C)c3cccnc3)c2)n1 ZINC000604314019 568249029 /nfs/dbraw/zinc/24/90/29/568249029.db2.gz KNDBVESBFPCILR-CQSZACIVSA-N -1 3 362.433 3.939 20 0 FHADHM Cc1ccc(C[C@H]([N-]S(=O)(=O)c2ccccc2F)c2ccccn2)cc1 ZINC000604410900 568271992 /nfs/dbraw/zinc/27/19/92/568271992.db2.gz MIIRLIRRKLYJHX-IBGZPJMESA-N -1 3 370.449 3.791 20 0 FHADHM CC(C)c1cc(C(=O)N2CCO[C@@]3(CCO[C@H]3C)C2)c([O-])c(C(C)C)c1 ZINC000408276746 568287881 /nfs/dbraw/zinc/28/78/81/568287881.db2.gz LEOCZMXKFHDUNG-BTYIYWSLSA-N -1 3 361.482 3.659 20 0 FHADHM CSc1nnc(NC(=O)[C@@H](C)Oc2ccc(-c3ccccc3)cc2)[n-]1 ZINC000604526945 568310334 /nfs/dbraw/zinc/31/03/34/568310334.db2.gz DKRVAWBJEAWBJP-GFCCVEGCSA-N -1 3 354.435 3.600 20 0 FHADHM CSc1n[n-]c(NC(=O)[C@@H](C)Oc2ccc(-c3ccccc3)cc2)n1 ZINC000604526945 568310335 /nfs/dbraw/zinc/31/03/35/568310335.db2.gz DKRVAWBJEAWBJP-GFCCVEGCSA-N -1 3 354.435 3.600 20 0 FHADHM CSc1nc(NC(=O)[C@@H](C)Oc2ccc(-c3ccccc3)cc2)n[n-]1 ZINC000604526945 568310336 /nfs/dbraw/zinc/31/03/36/568310336.db2.gz DKRVAWBJEAWBJP-GFCCVEGCSA-N -1 3 354.435 3.600 20 0 FHADHM C[C@@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000365210002 568322275 /nfs/dbraw/zinc/32/22/75/568322275.db2.gz YLAAOGRUPJMIQC-HIFRSBDPSA-N -1 3 350.393 3.685 20 0 FHADHM C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000365210003 568322277 /nfs/dbraw/zinc/32/22/77/568322277.db2.gz YLAAOGRUPJMIQC-UKRRQHHQSA-N -1 3 350.393 3.685 20 0 FHADHM Cc1cc(C)cc(-c2cc(=NC(=O)c3ccccc3-n3cccn3)[nH][n-]2)c1 ZINC000604901433 568384804 /nfs/dbraw/zinc/38/48/04/568384804.db2.gz JQSQVIIJBMECCI-UHFFFAOYSA-N -1 3 357.417 3.553 20 0 FHADHM Cc1c(C(=O)Nc2cc(Cl)cc(C)c2[O-])nnn1-c1cccc(C)c1 ZINC000604901878 568384975 /nfs/dbraw/zinc/38/49/75/568384975.db2.gz AACLVVCMMZMCLW-UHFFFAOYSA-N -1 3 356.813 3.804 20 0 FHADHM O=C(CSc1n[n-]c(-c2ccccn2)n1)c1ccc2c(c1)CCCC2 ZINC000604932824 568395301 /nfs/dbraw/zinc/39/53/01/568395301.db2.gz RDDVHIGWTXOPBS-UHFFFAOYSA-N -1 3 350.447 3.721 20 0 FHADHM C[C@@H]1CCN(C(=O)c2cc(=O)c3ccccc3[n-]2)[C@H]1c1cccc(F)c1 ZINC000365370417 568574838 /nfs/dbraw/zinc/57/48/38/568574838.db2.gz VIRZSSNCDNJWLE-ZUOKHONESA-N -1 3 350.393 3.891 20 0 FHADHM CCc1cccc(CC)c1S(=O)(=O)[N-]c1ccc(-n2ccnc2)c(F)c1 ZINC000606145200 568670279 /nfs/dbraw/zinc/67/02/79/568670279.db2.gz KGLIQUBQBQVPON-UHFFFAOYSA-N -1 3 373.453 3.937 20 0 FHADHM O=C([O-])[C@@H]1CN(Cc2cc(Cl)cc3cccnc32)C[C@H]1C(F)(F)F ZINC000299740538 571338230 /nfs/dbraw/zinc/33/82/30/571338230.db2.gz BKVOKTXWVWPARK-CHWSQXEVSA-N -1 3 358.747 3.583 20 0 FHADHM Cc1ccc(Oc2ccc(NC(=O)c3cccc(-c4nnn[n-]4)c3)cc2)nc1 ZINC000737365202 598823156 /nfs/dbraw/zinc/82/31/56/598823156.db2.gz GQHPSMSSFFUDPD-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccc(Oc2ccc(NC(=O)c3cccc(-c4nn[n-]n4)c3)cc2)nc1 ZINC000737365202 598823157 /nfs/dbraw/zinc/82/31/57/598823157.db2.gz GQHPSMSSFFUDPD-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1sc(NC(=O)[C@H](Cc2ccccc2)C(C)C)c(-c2nnn[n-]2)c1C ZINC000737562174 598829847 /nfs/dbraw/zinc/82/98/47/598829847.db2.gz LDKZRDCKVJHOLW-OAHLLOKOSA-N -1 3 369.494 3.998 20 0 FHADHM Cc1sc(NC(=O)[C@H](Cc2ccccc2)C(C)C)c(-c2nn[n-]n2)c1C ZINC000737562174 598829848 /nfs/dbraw/zinc/82/98/48/598829848.db2.gz LDKZRDCKVJHOLW-OAHLLOKOSA-N -1 3 369.494 3.998 20 0 FHADHM CCC/C(C)=C/C(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000736418160 598833574 /nfs/dbraw/zinc/83/35/74/598833574.db2.gz ASHVUOLYTHPRTJ-JLHYYAGUSA-N -1 3 367.478 3.958 20 0 FHADHM C[C@@H](C(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1)C(C)(C)C ZINC000735547107 598833640 /nfs/dbraw/zinc/83/36/40/598833640.db2.gz KFHAWCPIPFOLNF-LBPRGKRZSA-N -1 3 369.494 3.894 20 0 FHADHM CCc1ccc([C@H]2CCCCCN2C(=O)c2cccc(-c3nnn[n-]3)c2)o1 ZINC000736683558 598835747 /nfs/dbraw/zinc/83/57/47/598835747.db2.gz DWPHCOWUQUZGEL-QGZVFWFLSA-N -1 3 365.437 3.780 20 0 FHADHM CCc1ccc([C@H]2CCCCCN2C(=O)c2cccc(-c3nn[n-]n3)c2)o1 ZINC000736683558 598835749 /nfs/dbraw/zinc/83/57/49/598835749.db2.gz DWPHCOWUQUZGEL-QGZVFWFLSA-N -1 3 365.437 3.780 20 0 FHADHM CC(C)[C@H](C)CNC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000735701712 598836926 /nfs/dbraw/zinc/83/69/26/598836926.db2.gz KLYUCKWWIIVMSY-CQSZACIVSA-N -1 3 365.437 3.681 20 0 FHADHM CC(C)[C@H](C)CNC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735701712 598836928 /nfs/dbraw/zinc/83/69/28/598836928.db2.gz KLYUCKWWIIVMSY-CQSZACIVSA-N -1 3 365.437 3.681 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H]1CC[C@@H](C)C[C@@H]1C ZINC000736478749 598840550 /nfs/dbraw/zinc/84/05/50/598840550.db2.gz BHNWHEFQBNELOU-RVKKMQEKSA-N -1 3 370.501 3.613 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H]1CC[C@@H](C)C[C@@H]1C ZINC000736478749 598840551 /nfs/dbraw/zinc/84/05/51/598840551.db2.gz BHNWHEFQBNELOU-RVKKMQEKSA-N -1 3 370.501 3.613 20 0 FHADHM COc1ccc([C@@H](C)OC(=O)c2sccc2-c2nnn[n-]2)cc1Cl ZINC000737076854 598843947 /nfs/dbraw/zinc/84/39/47/598843947.db2.gz RZUJFGFWOYJAIM-MRVPVSSYSA-N -1 3 364.814 3.508 20 0 FHADHM CC(C)[C@@H](C)CNC(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735700203 598848219 /nfs/dbraw/zinc/84/82/19/598848219.db2.gz FVSNUZCVXOUDFD-AWEZNQCLSA-N -1 3 364.453 3.632 20 0 FHADHM CCc1nc2ccccc2n1CCNc1ccc(Cl)cc1-c1nnn[n-]1 ZINC000736706048 598852966 /nfs/dbraw/zinc/85/29/66/598852966.db2.gz PTKIJWFTMGSFSB-UHFFFAOYSA-N -1 3 367.844 3.544 20 0 FHADHM CCc1nc2ccccc2n1CCNc1ccc(Cl)cc1-c1nn[n-]n1 ZINC000736706048 598852968 /nfs/dbraw/zinc/85/29/68/598852968.db2.gz PTKIJWFTMGSFSB-UHFFFAOYSA-N -1 3 367.844 3.544 20 0 FHADHM c1cn(Cc2ccc3ccccc3c2)nc1-c1ccc(-c2nnn[n-]2)cc1 ZINC000738442876 598859055 /nfs/dbraw/zinc/85/90/55/598859055.db2.gz RIMYOHOEXZVSEZ-UHFFFAOYSA-N -1 3 352.401 3.932 20 0 FHADHM c1cn(Cc2ccc3ccccc3c2)nc1-c1ccc(-c2nn[n-]n2)cc1 ZINC000738442876 598859057 /nfs/dbraw/zinc/85/90/57/598859057.db2.gz RIMYOHOEXZVSEZ-UHFFFAOYSA-N -1 3 352.401 3.932 20 0 FHADHM C[C@@H](Oc1ccc(-c2nn[n-]n2)cc1)c1nc(-c2ccccc2Cl)no1 ZINC000736170044 598859280 /nfs/dbraw/zinc/85/92/80/598859280.db2.gz QYEFOGPKULWFTR-SNVBAGLBSA-N -1 3 368.784 3.710 20 0 FHADHM CCc1ccc(-c2noc([C@H](C)Oc3ccccc3-c3nnn[n-]3)n2)cc1 ZINC000736677844 598859676 /nfs/dbraw/zinc/85/96/76/598859676.db2.gz PDDMARNVXIEVQD-LBPRGKRZSA-N -1 3 362.393 3.619 20 0 FHADHM CCc1ccc(-c2noc([C@H](C)Oc3ccccc3-c3nn[n-]n3)n2)cc1 ZINC000736677844 598859677 /nfs/dbraw/zinc/85/96/77/598859677.db2.gz PDDMARNVXIEVQD-LBPRGKRZSA-N -1 3 362.393 3.619 20 0 FHADHM Cc1noc(C)c1[C@@H](C)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000737538852 598870569 /nfs/dbraw/zinc/87/05/69/598870569.db2.gz QGFCORQCQGWFOJ-SSDOTTSWSA-N -1 3 352.320 3.663 20 0 FHADHM Cc1noc(C)c1[C@@H](C)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000737538852 598870570 /nfs/dbraw/zinc/87/05/70/598870570.db2.gz QGFCORQCQGWFOJ-SSDOTTSWSA-N -1 3 352.320 3.663 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)OCc1ccc2ccccc2c1 ZINC000737797952 598896975 /nfs/dbraw/zinc/89/69/75/598896975.db2.gz GAALNXMVAHOJQG-QXMHVHEDSA-N -1 3 356.385 3.777 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)OCc1ccc2ccccc2c1 ZINC000737797952 598896977 /nfs/dbraw/zinc/89/69/77/598896977.db2.gz GAALNXMVAHOJQG-QXMHVHEDSA-N -1 3 356.385 3.777 20 0 FHADHM C[C@@H](CC1CCCC1)C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCC2 ZINC000735986985 598902702 /nfs/dbraw/zinc/90/27/02/598902702.db2.gz VIYASTBBKCRBJK-NSHDSACASA-N -1 3 359.499 3.962 20 0 FHADHM C[C@@H](CC1CCCC1)C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCC2 ZINC000735986985 598902704 /nfs/dbraw/zinc/90/27/04/598902704.db2.gz VIYASTBBKCRBJK-NSHDSACASA-N -1 3 359.499 3.962 20 0 FHADHM CCO[C@H](C)c1nc(COc2ccc(-c3nnn[n-]3)cc2Cl)cs1 ZINC000736615692 598912919 /nfs/dbraw/zinc/91/29/19/598912919.db2.gz KWNPIJASBYXRRU-SECBINFHSA-N -1 3 365.846 3.653 20 0 FHADHM CCO[C@H](C)c1nc(COc2ccc(-c3nn[n-]n3)cc2Cl)cs1 ZINC000736615692 598912920 /nfs/dbraw/zinc/91/29/20/598912920.db2.gz KWNPIJASBYXRRU-SECBINFHSA-N -1 3 365.846 3.653 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NC(=O)C=C1CCC(C)CC1 ZINC000736237024 598927425 /nfs/dbraw/zinc/92/74/25/598927425.db2.gz NQBLYTRIMWRJDB-UHFFFAOYSA-N -1 3 355.442 3.729 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NC(=O)C=C1CCC(C)CC1 ZINC000736237024 598927427 /nfs/dbraw/zinc/92/74/27/598927427.db2.gz NQBLYTRIMWRJDB-UHFFFAOYSA-N -1 3 355.442 3.729 20 0 FHADHM Cc1cc(N2CCCC2)ccc1Nc1ncc(-c2nnn[n-]2)cc1Cl ZINC000737270143 598935030 /nfs/dbraw/zinc/93/50/30/598935030.db2.gz BGWREIQUKXTLNV-UHFFFAOYSA-N -1 3 355.833 3.567 20 0 FHADHM Cc1cc(N2CCCC2)ccc1Nc1ncc(-c2nn[n-]n2)cc1Cl ZINC000737270143 598935031 /nfs/dbraw/zinc/93/50/31/598935031.db2.gz BGWREIQUKXTLNV-UHFFFAOYSA-N -1 3 355.833 3.567 20 0 FHADHM CCOc1ccc([C@@H]2CCCN2c2ncc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000736635465 598935171 /nfs/dbraw/zinc/93/51/71/598935171.db2.gz CKQQJHMURQXFEC-INIZCTEOSA-N -1 3 370.844 3.655 20 0 FHADHM CCOc1ccc([C@@H]2CCCN2c2ncc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000736635465 598935172 /nfs/dbraw/zinc/93/51/72/598935172.db2.gz CKQQJHMURQXFEC-INIZCTEOSA-N -1 3 370.844 3.655 20 0 FHADHM C[C@H](Nc1ncc(-c2nnn[n-]2)cc1Cl)c1ccc(OC(F)F)cc1 ZINC000736135579 598937005 /nfs/dbraw/zinc/93/70/05/598937005.db2.gz BUIIUWPUOBDTFF-QMMMGPOBSA-N -1 3 366.759 3.690 20 0 FHADHM C[C@H](Nc1ncc(-c2nn[n-]n2)cc1Cl)c1ccc(OC(F)F)cc1 ZINC000736135579 598937006 /nfs/dbraw/zinc/93/70/06/598937006.db2.gz BUIIUWPUOBDTFF-QMMMGPOBSA-N -1 3 366.759 3.690 20 0 FHADHM CC(C)C[C@H](C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000735755583 598939173 /nfs/dbraw/zinc/93/91/73/598939173.db2.gz HEJDABDCHDJNJY-BEFAXECRSA-N -1 3 363.465 3.874 20 0 FHADHM CC(C)C[C@H](C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000735755583 598939175 /nfs/dbraw/zinc/93/91/75/598939175.db2.gz HEJDABDCHDJNJY-BEFAXECRSA-N -1 3 363.465 3.874 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1OC(=O)[C@@H](CC(C)C)c1ccccc1 ZINC000737027164 598939228 /nfs/dbraw/zinc/93/92/28/598939228.db2.gz ZJVUEXFAJNKFHA-INIZCTEOSA-N -1 3 366.421 3.611 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1OC(=O)[C@@H](CC(C)C)c1ccccc1 ZINC000737027164 598939230 /nfs/dbraw/zinc/93/92/30/598939230.db2.gz ZJVUEXFAJNKFHA-INIZCTEOSA-N -1 3 366.421 3.611 20 0 FHADHM FC(F)(F)COc1ccccc1Oc1ncc(-c2nnn[n-]2)cc1Cl ZINC000737627960 598941616 /nfs/dbraw/zinc/94/16/16/598941616.db2.gz SDCRWTDUKADYIX-UHFFFAOYSA-N -1 3 371.706 3.649 20 0 FHADHM FC(F)(F)COc1ccccc1Oc1ncc(-c2nn[n-]n2)cc1Cl ZINC000737627960 598941618 /nfs/dbraw/zinc/94/16/18/598941618.db2.gz SDCRWTDUKADYIX-UHFFFAOYSA-N -1 3 371.706 3.649 20 0 FHADHM CC(C)[C@@H](NC(=O)c1sccc1-c1nnn[n-]1)c1ccccc1Cl ZINC000735733270 599007068 /nfs/dbraw/zinc/00/70/68/599007068.db2.gz GXOMZUMSFGYHGV-CYBMUJFWSA-N -1 3 361.858 3.709 20 0 FHADHM CC(C)[C@@H](NC(=O)c1sccc1-c1nn[n-]n1)c1ccccc1Cl ZINC000735733270 599007069 /nfs/dbraw/zinc/00/70/69/599007069.db2.gz GXOMZUMSFGYHGV-CYBMUJFWSA-N -1 3 361.858 3.709 20 0 FHADHM C[C@H](CCC1CCCCC1)NC(=O)CCc1ccc(-c2nnn[n-]2)cc1 ZINC000735984877 599008282 /nfs/dbraw/zinc/00/82/82/599008282.db2.gz HLCLYXOSAXZFIK-OAHLLOKOSA-N -1 3 355.486 3.665 20 0 FHADHM C[C@H](CCC1CCCCC1)NC(=O)CCc1ccc(-c2nn[n-]n2)cc1 ZINC000735984877 599008283 /nfs/dbraw/zinc/00/82/83/599008283.db2.gz HLCLYXOSAXZFIK-OAHLLOKOSA-N -1 3 355.486 3.665 20 0 FHADHM O=C(CCc1ccc(-c2nnn[n-]2)cc1)OCCCc1ccc(Cl)cc1 ZINC000737853437 599015304 /nfs/dbraw/zinc/01/53/04/599015304.db2.gz LTHFEJOFIKTEJD-UHFFFAOYSA-N -1 3 370.840 3.629 20 0 FHADHM O=C(CCc1ccc(-c2nn[n-]n2)cc1)OCCCc1ccc(Cl)cc1 ZINC000737853437 599015305 /nfs/dbraw/zinc/01/53/05/599015305.db2.gz LTHFEJOFIKTEJD-UHFFFAOYSA-N -1 3 370.840 3.629 20 0 FHADHM CC[C@H](NC(=S)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1)c1cccs1 ZINC000736368346 599013973 /nfs/dbraw/zinc/01/39/73/599013973.db2.gz CJWOMNIVCXVXFP-RISCZKNCSA-N -1 3 372.523 3.605 20 0 FHADHM CC[C@H](NC(=S)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1)c1cccs1 ZINC000736368346 599013976 /nfs/dbraw/zinc/01/39/76/599013976.db2.gz CJWOMNIVCXVXFP-RISCZKNCSA-N -1 3 372.523 3.605 20 0 FHADHM CC(C)C[C@H]1CCCCCN1C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000735795517 599018917 /nfs/dbraw/zinc/01/89/17/599018917.db2.gz NODSXMGVLNCLBK-MAUKXSAKSA-N -1 3 370.501 3.928 20 0 FHADHM CC(C)C[C@H]1CCCCCN1C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000735795517 599018918 /nfs/dbraw/zinc/01/89/18/599018918.db2.gz NODSXMGVLNCLBK-MAUKXSAKSA-N -1 3 370.501 3.928 20 0 FHADHM CC(C)C[C@@H](C(=O)OCc1cc(-c2nnn[n-]2)ccc1F)c1ccccc1 ZINC000735755526 599019194 /nfs/dbraw/zinc/01/91/94/599019194.db2.gz GISXVYKWFJHAAO-QGZVFWFLSA-N -1 3 368.412 3.879 20 0 FHADHM CC(C)C[C@@H](C(=O)OCc1cc(-c2nn[n-]n2)ccc1F)c1ccccc1 ZINC000735755526 599019196 /nfs/dbraw/zinc/01/91/96/599019196.db2.gz GISXVYKWFJHAAO-QGZVFWFLSA-N -1 3 368.412 3.879 20 0 FHADHM Cc1c(NCc2cccc(SC(=O)N(C)C)c2)cccc1-c1nnn[n-]1 ZINC000822122979 607257522 /nfs/dbraw/zinc/25/75/22/607257522.db2.gz SFLOBXCHDFPSSO-UHFFFAOYSA-N -1 3 368.466 3.561 20 0 FHADHM Cc1c(NCc2cccc(SC(=O)N(C)C)c2)cccc1-c1nn[n-]n1 ZINC000822122979 607257523 /nfs/dbraw/zinc/25/75/23/607257523.db2.gz SFLOBXCHDFPSSO-UHFFFAOYSA-N -1 3 368.466 3.561 20 0 FHADHM Fc1cc(NCc2ccc(-c3nnn[n-]3)cc2F)ccc1Br ZINC000737653845 599330908 /nfs/dbraw/zinc/33/09/08/599330908.db2.gz SWPAIYXGAWNWPW-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1cc(NCc2ccc(-c3nn[n-]n3)cc2F)ccc1Br ZINC000737653845 599330911 /nfs/dbraw/zinc/33/09/11/599330911.db2.gz SWPAIYXGAWNWPW-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM CN(Cc1ccccc1Cl)c1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000736828915 599039438 /nfs/dbraw/zinc/03/94/38/599039438.db2.gz UHBBFHNFVNHMRC-UHFFFAOYSA-N -1 3 368.750 3.570 20 0 FHADHM CN(Cc1ccccc1Cl)c1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000736828915 599039440 /nfs/dbraw/zinc/03/94/40/599039440.db2.gz UHBBFHNFVNHMRC-UHFFFAOYSA-N -1 3 368.750 3.570 20 0 FHADHM CC(C)c1csc([C@H]2CCCN(c3ccc(-c4nn[n-]n4)cc3)C2)n1 ZINC000820197450 599043303 /nfs/dbraw/zinc/04/33/03/599043303.db2.gz JBSHDSLMUDHCJK-AWEZNQCLSA-N -1 3 354.483 3.831 20 0 FHADHM C[C@H](Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1)c1c(F)cccc1F ZINC000736135961 599045606 /nfs/dbraw/zinc/04/56/06/599045606.db2.gz CMXHVUADSDHELS-ZETCQYMHSA-N -1 3 370.285 3.732 20 0 FHADHM C[C@H](Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1)c1c(F)cccc1F ZINC000736135961 599045609 /nfs/dbraw/zinc/04/56/09/599045609.db2.gz CMXHVUADSDHELS-ZETCQYMHSA-N -1 3 370.285 3.732 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N2CCC[C@@H]2C2CCCCC2)n1 ZINC000737631488 599048132 /nfs/dbraw/zinc/04/81/32/599048132.db2.gz DVTGHOCSLAAJDQ-CYBMUJFWSA-N -1 3 366.391 3.830 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N2CCC[C@@H]2C2CCCCC2)n1 ZINC000737631488 599048135 /nfs/dbraw/zinc/04/81/35/599048135.db2.gz DVTGHOCSLAAJDQ-CYBMUJFWSA-N -1 3 366.391 3.830 20 0 FHADHM C[C@@H](CN(C)c1nc(C(F)(F)F)ccc1-c1nnn[n-]1)c1ccccc1 ZINC000736000221 599050686 /nfs/dbraw/zinc/05/06/86/599050686.db2.gz FUHSFCPDQRPWBP-NSHDSACASA-N -1 3 362.359 3.520 20 0 FHADHM C[C@@H](CN(C)c1nc(C(F)(F)F)ccc1-c1nn[n-]n1)c1ccccc1 ZINC000736000221 599050689 /nfs/dbraw/zinc/05/06/89/599050689.db2.gz FUHSFCPDQRPWBP-NSHDSACASA-N -1 3 362.359 3.520 20 0 FHADHM CCC[C@H](Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1)c1ccccn1 ZINC000736435504 599054093 /nfs/dbraw/zinc/05/40/93/599054093.db2.gz JJBYGMDQELUKMS-LBPRGKRZSA-N -1 3 363.347 3.629 20 0 FHADHM CCC[C@H](Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1)c1ccccn1 ZINC000736435504 599054096 /nfs/dbraw/zinc/05/40/96/599054096.db2.gz JJBYGMDQELUKMS-LBPRGKRZSA-N -1 3 363.347 3.629 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1SCc1ccc(OC(F)F)cc1 ZINC000737645280 599064597 /nfs/dbraw/zinc/06/45/97/599064597.db2.gz VPQBYGPCANJIMA-UHFFFAOYSA-N -1 3 352.341 3.900 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1SCc1ccc(OC(F)F)cc1 ZINC000737645280 599064598 /nfs/dbraw/zinc/06/45/98/599064598.db2.gz VPQBYGPCANJIMA-UHFFFAOYSA-N -1 3 352.341 3.900 20 0 FHADHM C[C@@H]1C[C@H](c2ccccc2)CN1c1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000736234794 599060320 /nfs/dbraw/zinc/06/03/20/599060320.db2.gz KPKFMTYKAZDZRB-YPMHNXCESA-N -1 3 374.370 3.663 20 0 FHADHM C[C@@H]1C[C@H](c2ccccc2)CN1c1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000736234794 599060323 /nfs/dbraw/zinc/06/03/23/599060323.db2.gz KPKFMTYKAZDZRB-YPMHNXCESA-N -1 3 374.370 3.663 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(N2CC[C@@H](COCc3ccccc3)C2)c1 ZINC000822568053 599062971 /nfs/dbraw/zinc/06/29/71/599062971.db2.gz LADWEFIPGKHHQT-OAHLLOKOSA-N -1 3 369.856 3.563 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(N2CC[C@@H](COCc3ccccc3)C2)c1 ZINC000822568053 599062973 /nfs/dbraw/zinc/06/29/73/599062973.db2.gz LADWEFIPGKHHQT-OAHLLOKOSA-N -1 3 369.856 3.563 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1SCc1cc2c(c(Cl)c1)OCO2 ZINC000737645480 599065990 /nfs/dbraw/zinc/06/59/90/599065990.db2.gz ZWAZJSSGFQKRPF-UHFFFAOYSA-N -1 3 364.789 3.680 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1SCc1cc2c(c(Cl)c1)OCO2 ZINC000737645480 599065993 /nfs/dbraw/zinc/06/59/93/599065993.db2.gz ZWAZJSSGFQKRPF-UHFFFAOYSA-N -1 3 364.789 3.680 20 0 FHADHM CCN(C(=O)[C@@H]1C[C@H]1C1CCCCC1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736503459 599070743 /nfs/dbraw/zinc/07/07/43/599070743.db2.gz XCASBCPPFYAFEG-ZOCIIQOWSA-N -1 3 367.497 3.993 20 0 FHADHM CCN(C(=O)[C@@H]1C[C@H]1C1CCCCC1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736503459 599070746 /nfs/dbraw/zinc/07/07/46/599070746.db2.gz XCASBCPPFYAFEG-ZOCIIQOWSA-N -1 3 367.497 3.993 20 0 FHADHM C[C@@H]1CCC[C@@H](C(=O)N(Cc2ccco2)c2ccccc2-c2nnn[n-]2)C1 ZINC000736244665 599070857 /nfs/dbraw/zinc/07/08/57/599070857.db2.gz LSRNBSMFJFBNBQ-HUUCEWRRSA-N -1 3 365.437 3.819 20 0 FHADHM C[C@@H]1CCC[C@@H](C(=O)N(Cc2ccco2)c2ccccc2-c2nn[n-]n2)C1 ZINC000736244665 599070860 /nfs/dbraw/zinc/07/08/60/599070860.db2.gz LSRNBSMFJFBNBQ-HUUCEWRRSA-N -1 3 365.437 3.819 20 0 FHADHM CCc1c(C)sc(NC(=O)Cc2ccc(CC)cc2)c1-c1nnn[n-]1 ZINC000736682709 599072770 /nfs/dbraw/zinc/07/27/70/599072770.db2.gz LBHDZSFSRCBZDL-UHFFFAOYSA-N -1 3 355.467 3.543 20 0 FHADHM CCc1c(C)sc(NC(=O)Cc2ccc(CC)cc2)c1-c1nn[n-]n1 ZINC000736682709 599072773 /nfs/dbraw/zinc/07/27/73/599072773.db2.gz LBHDZSFSRCBZDL-UHFFFAOYSA-N -1 3 355.467 3.543 20 0 FHADHM C[C@@H]1CCCN(C(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)[C@H]1C ZINC000736264316 599081689 /nfs/dbraw/zinc/08/16/89/599081689.db2.gz CVUWYTBSAYYNID-CABCVRRESA-N -1 3 361.449 3.794 20 0 FHADHM C[C@@H]1CCCN(C(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)[C@H]1C ZINC000736264316 599081692 /nfs/dbraw/zinc/08/16/92/599081692.db2.gz CVUWYTBSAYYNID-CABCVRRESA-N -1 3 361.449 3.794 20 0 FHADHM CC[C@]1(C)CCCN(c2c(-c3nnn[n-]3)cnc3c(F)ccc(F)c32)C1 ZINC000820950714 599089422 /nfs/dbraw/zinc/08/94/22/599089422.db2.gz RGJHRVTVZUZLMR-GOSISDBHSA-N -1 3 358.396 3.710 20 0 FHADHM CC[C@]1(C)CCCN(c2c(-c3nn[n-]n3)cnc3c(F)ccc(F)c32)C1 ZINC000820950714 599089425 /nfs/dbraw/zinc/08/94/25/599089425.db2.gz RGJHRVTVZUZLMR-GOSISDBHSA-N -1 3 358.396 3.710 20 0 FHADHM CC(C)[C@@H]1CN(c2c(-c3nnn[n-]3)cnc3ccc(Cl)cc32)CCS1 ZINC000820046609 599097348 /nfs/dbraw/zinc/09/73/48/599097348.db2.gz SSJJZTSSWIVEHD-HNNXBMFYSA-N -1 3 374.901 3.646 20 0 FHADHM CC(C)[C@@H]1CN(c2c(-c3nn[n-]n3)cnc3ccc(Cl)cc32)CCS1 ZINC000820046609 599097351 /nfs/dbraw/zinc/09/73/51/599097351.db2.gz SSJJZTSSWIVEHD-HNNXBMFYSA-N -1 3 374.901 3.646 20 0 FHADHM CCCCC[C@H](NC(=O)NCc1ccc(-c2nnn[n-]2)cc1)C(C)(C)C ZINC000736441600 599103976 /nfs/dbraw/zinc/10/39/76/599103976.db2.gz SSGGLFZWVUKKHM-INIZCTEOSA-N -1 3 358.490 3.661 20 0 FHADHM CCCCC[C@H](NC(=O)NCc1ccc(-c2nn[n-]n2)cc1)C(C)(C)C ZINC000736441600 599103978 /nfs/dbraw/zinc/10/39/78/599103978.db2.gz SSGGLFZWVUKKHM-INIZCTEOSA-N -1 3 358.490 3.661 20 0 FHADHM Cc1cccc([C@H](C)NC(=O)N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1C ZINC000737390258 599104944 /nfs/dbraw/zinc/10/49/44/599104944.db2.gz RXWCQOOVFPGGIO-GJZGRUSLSA-N -1 3 364.453 3.605 20 0 FHADHM Cc1cccc([C@H](C)NC(=O)N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1C ZINC000737390258 599104945 /nfs/dbraw/zinc/10/49/45/599104945.db2.gz RXWCQOOVFPGGIO-GJZGRUSLSA-N -1 3 364.453 3.605 20 0 FHADHM CCC[C@]1(C)CCCN(c2nc(C(F)(F)F)ccc2-c2nnn[n-]2)C1 ZINC000821028436 599110818 /nfs/dbraw/zinc/11/08/18/599110818.db2.gz VTRNWARNYSQEIG-OAHLLOKOSA-N -1 3 354.380 3.687 20 0 FHADHM CCC[C@]1(C)CCCN(c2nc(C(F)(F)F)ccc2-c2nn[n-]n2)C1 ZINC000821028436 599110821 /nfs/dbraw/zinc/11/08/21/599110821.db2.gz VTRNWARNYSQEIG-OAHLLOKOSA-N -1 3 354.380 3.687 20 0 FHADHM Clc1cc(CSc2ccccc2-c2nnn[n-]2)cc2c1OCCO2 ZINC000737562882 599111559 /nfs/dbraw/zinc/11/15/59/599111559.db2.gz AABFLLSIKXDVIL-UHFFFAOYSA-N -1 3 360.826 3.584 20 0 FHADHM Clc1cc(CSc2ccccc2-c2nn[n-]n2)cc2c1OCCO2 ZINC000737562882 599111561 /nfs/dbraw/zinc/11/15/61/599111561.db2.gz AABFLLSIKXDVIL-UHFFFAOYSA-N -1 3 360.826 3.584 20 0 FHADHM Cc1cc2cc(C(=O)N[C@H](C)c3ccc(-c4nnn[n-]4)cc3)oc2cc1C ZINC000822212985 599137732 /nfs/dbraw/zinc/13/77/32/599137732.db2.gz PMMPUORMSNRYBM-CYBMUJFWSA-N -1 3 361.405 3.721 20 0 FHADHM Cc1cc2cc(C(=O)N[C@H](C)c3ccc(-c4nn[n-]n4)cc3)oc2cc1C ZINC000822212985 599137735 /nfs/dbraw/zinc/13/77/35/599137735.db2.gz PMMPUORMSNRYBM-CYBMUJFWSA-N -1 3 361.405 3.721 20 0 FHADHM Cc1ccccc1CSCc1nnc(-c2cccc(-c3nnn[n-]3)c2)o1 ZINC000737428941 599158153 /nfs/dbraw/zinc/15/81/53/599158153.db2.gz YOHGGPWAWRJLDY-UHFFFAOYSA-N -1 3 364.434 3.659 20 0 FHADHM Cc1ccccc1CSCc1nnc(-c2cccc(-c3nn[n-]n3)c2)o1 ZINC000737428941 599158154 /nfs/dbraw/zinc/15/81/54/599158154.db2.gz YOHGGPWAWRJLDY-UHFFFAOYSA-N -1 3 364.434 3.659 20 0 FHADHM S=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)N1CCC[C@H]1c1ccco1 ZINC000738401695 599159594 /nfs/dbraw/zinc/15/95/94/599159594.db2.gz RQQNBOCUFMRAOL-ZDUSSCGKSA-N -1 3 374.857 3.647 20 0 FHADHM S=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)N1CCC[C@H]1c1ccco1 ZINC000738401695 599159596 /nfs/dbraw/zinc/15/95/96/599159596.db2.gz RQQNBOCUFMRAOL-ZDUSSCGKSA-N -1 3 374.857 3.647 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)C[C@@H](C)c1cccc(F)c1 ZINC000736637154 599160617 /nfs/dbraw/zinc/16/06/17/599160617.db2.gz PEWAENWYPPURHG-GFCCVEGCSA-N -1 3 369.400 3.537 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)C[C@@H](C)c1cccc(F)c1 ZINC000736637154 599160619 /nfs/dbraw/zinc/16/06/19/599160619.db2.gz PEWAENWYPPURHG-GFCCVEGCSA-N -1 3 369.400 3.537 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)ccc1OC(=O)C[C@@H](C)c1ccccc1C ZINC000736627822 599160719 /nfs/dbraw/zinc/16/07/19/599160719.db2.gz OFGIKAYKQJYXII-CQSZACIVSA-N -1 3 366.421 3.673 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)ccc1OC(=O)C[C@@H](C)c1ccccc1C ZINC000736627822 599160720 /nfs/dbraw/zinc/16/07/20/599160720.db2.gz OFGIKAYKQJYXII-CQSZACIVSA-N -1 3 366.421 3.673 20 0 FHADHM Cc1ccccc1[C@@H](C)CC(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000737424690 599161485 /nfs/dbraw/zinc/16/14/85/599161485.db2.gz WSDXZJOKYRWFPS-AWEZNQCLSA-N -1 3 366.469 3.864 20 0 FHADHM Cc1ccccc1[C@@H](C)CC(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000737424690 599161486 /nfs/dbraw/zinc/16/14/86/599161486.db2.gz WSDXZJOKYRWFPS-AWEZNQCLSA-N -1 3 366.469 3.864 20 0 FHADHM O=C(Nc1ccc(OC2CCCCC2)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000738173296 599163696 /nfs/dbraw/zinc/16/36/96/599163696.db2.gz MXGVXDDNZWSXNI-UHFFFAOYSA-N -1 3 363.421 3.831 20 0 FHADHM O=C(Nc1ccc(OC2CCCCC2)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000738173296 599163700 /nfs/dbraw/zinc/16/37/00/599163700.db2.gz MXGVXDDNZWSXNI-UHFFFAOYSA-N -1 3 363.421 3.831 20 0 FHADHM c1cc(-c2nnc(CSCC3CCCCC3)o2)ccc1-c1nnn[n-]1 ZINC000738406323 599165636 /nfs/dbraw/zinc/16/56/36/599165636.db2.gz TZQYMPGSYUTELQ-UHFFFAOYSA-N -1 3 356.455 3.730 20 0 FHADHM c1cc(-c2nnc(CSCC3CCCCC3)o2)ccc1-c1nn[n-]n1 ZINC000738406323 599165639 /nfs/dbraw/zinc/16/56/39/599165639.db2.gz TZQYMPGSYUTELQ-UHFFFAOYSA-N -1 3 356.455 3.730 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1SCc1csc(-c2ccccn2)n1 ZINC000737644656 599170202 /nfs/dbraw/zinc/17/02/02/599170202.db2.gz JIZZKJAUAVBCEP-UHFFFAOYSA-N -1 3 370.438 3.817 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1SCc1csc(-c2ccccn2)n1 ZINC000737644656 599170205 /nfs/dbraw/zinc/17/02/05/599170205.db2.gz JIZZKJAUAVBCEP-UHFFFAOYSA-N -1 3 370.438 3.817 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1SCCOc1ccccc1Cl ZINC000737645255 599172134 /nfs/dbraw/zinc/17/21/34/599172134.db2.gz UODGWYWJRPSACU-UHFFFAOYSA-N -1 3 350.806 3.830 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1SCCOc1ccccc1Cl ZINC000737645255 599172135 /nfs/dbraw/zinc/17/21/35/599172135.db2.gz UODGWYWJRPSACU-UHFFFAOYSA-N -1 3 350.806 3.830 20 0 FHADHM CC(C)(C(=O)Nc1ccc(-c2nnn[n-]2)cc1)c1ccc2ccccc2c1 ZINC000607818627 599177139 /nfs/dbraw/zinc/17/71/39/599177139.db2.gz DFPUUZDDGYXOFC-UHFFFAOYSA-N -1 3 357.417 3.936 20 0 FHADHM CC(C)(C(=O)Nc1ccc(-c2nn[n-]n2)cc1)c1ccc2ccccc2c1 ZINC000607818627 599177142 /nfs/dbraw/zinc/17/71/42/599177142.db2.gz DFPUUZDDGYXOFC-UHFFFAOYSA-N -1 3 357.417 3.936 20 0 FHADHM CC(C)(C(=O)Nc1cccc(-c2nnn[n-]2)c1)c1ccc2ccccc2c1 ZINC000607884845 599177444 /nfs/dbraw/zinc/17/74/44/599177444.db2.gz FVIKTCUTCLFTHP-UHFFFAOYSA-N -1 3 357.417 3.936 20 0 FHADHM CC(C)(C(=O)Nc1cccc(-c2nn[n-]n2)c1)c1ccc2ccccc2c1 ZINC000607884845 599177447 /nfs/dbraw/zinc/17/74/47/599177447.db2.gz FVIKTCUTCLFTHP-UHFFFAOYSA-N -1 3 357.417 3.936 20 0 FHADHM Cc1ccncc1C(=O)Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000737444488 599185587 /nfs/dbraw/zinc/18/55/87/599185587.db2.gz LZMWUFWQICXHHG-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccncc1C(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000737444488 599185589 /nfs/dbraw/zinc/18/55/89/599185589.db2.gz LZMWUFWQICXHHG-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM C[C@@H](CC(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1cccc(F)c1 ZINC000735974881 599190192 /nfs/dbraw/zinc/19/01/92/599190192.db2.gz CUXYZALYFRLHHZ-STQMWFEESA-N -1 3 354.385 3.804 20 0 FHADHM C[C@@H](CC(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1cccc(F)c1 ZINC000735974881 599190195 /nfs/dbraw/zinc/19/01/95/599190195.db2.gz CUXYZALYFRLHHZ-STQMWFEESA-N -1 3 354.385 3.804 20 0 FHADHM C[C@H](OC(=O)[C@H]1C[C@H]1c1c(F)cccc1F)c1cccc(-c2nnn[n-]2)c1 ZINC000736147957 599190503 /nfs/dbraw/zinc/19/05/03/599190503.db2.gz BINYDZLKTZYJDT-GDLCADMTSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@H]1C[C@H]1c1c(F)cccc1F)c1cccc(-c2nn[n-]n2)c1 ZINC000736147957 599190506 /nfs/dbraw/zinc/19/05/06/599190506.db2.gz BINYDZLKTZYJDT-GDLCADMTSA-N -1 3 370.359 3.553 20 0 FHADHM Cc1cccc([C@H]2CCCCN2C(=O)c2ccc(-c3nnn[n-]3)cc2)c1C ZINC000822299398 599202830 /nfs/dbraw/zinc/20/28/30/599202830.db2.gz HMBXSZVWEHRNFC-LJQANCHMSA-N -1 3 361.449 3.851 20 0 FHADHM Cc1cccc([C@H]2CCCCN2C(=O)c2ccc(-c3nn[n-]n3)cc2)c1C ZINC000822299398 599202833 /nfs/dbraw/zinc/20/28/33/599202833.db2.gz HMBXSZVWEHRNFC-LJQANCHMSA-N -1 3 361.449 3.851 20 0 FHADHM Cc1cccc([C@@H]2CCCCN2C(=O)c2ccc(-c3nnn[n-]3)cc2)c1C ZINC000822299397 599202898 /nfs/dbraw/zinc/20/28/98/599202898.db2.gz HMBXSZVWEHRNFC-IBGZPJMESA-N -1 3 361.449 3.851 20 0 FHADHM Cc1cccc([C@@H]2CCCCN2C(=O)c2ccc(-c3nn[n-]n3)cc2)c1C ZINC000822299397 599202901 /nfs/dbraw/zinc/20/29/01/599202901.db2.gz HMBXSZVWEHRNFC-IBGZPJMESA-N -1 3 361.449 3.851 20 0 FHADHM CCOc1ccccc1OCCSCc1ccc(-c2nnn[n-]2)cc1F ZINC000821438250 599225788 /nfs/dbraw/zinc/22/57/88/599225788.db2.gz WMSVJGZWJKUQLQ-UHFFFAOYSA-N -1 3 374.441 3.717 20 0 FHADHM CCOc1ccccc1OCCSCc1ccc(-c2nn[n-]n2)cc1F ZINC000821438250 599225791 /nfs/dbraw/zinc/22/57/91/599225791.db2.gz WMSVJGZWJKUQLQ-UHFFFAOYSA-N -1 3 374.441 3.717 20 0 FHADHM CC[C@H](Cc1ccc(C)cc1)N(CC)C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000736354634 599232797 /nfs/dbraw/zinc/23/27/97/599232797.db2.gz VJHGZTYJGLREHB-LJQANCHMSA-N -1 3 363.465 3.659 20 0 FHADHM CC[C@H](Cc1ccc(C)cc1)N(CC)C(=O)c1cccc(-c2nn[n-]n2)c1 ZINC000736354634 599232798 /nfs/dbraw/zinc/23/27/98/599232798.db2.gz VJHGZTYJGLREHB-LJQANCHMSA-N -1 3 363.465 3.659 20 0 FHADHM C[C@@H]1C[C@@H]1[C@@H](NC(=O)c1sccc1-c1nnn[n-]1)c1ccc(Cl)cc1 ZINC000736233677 599226545 /nfs/dbraw/zinc/22/65/45/599226545.db2.gz GJIRQBGKTVUXJE-IIMNLJJBSA-N -1 3 373.869 3.709 20 0 FHADHM C[C@@H]1C[C@@H]1[C@@H](NC(=O)c1sccc1-c1nn[n-]n1)c1ccc(Cl)cc1 ZINC000736233677 599226547 /nfs/dbraw/zinc/22/65/47/599226547.db2.gz GJIRQBGKTVUXJE-IIMNLJJBSA-N -1 3 373.869 3.709 20 0 FHADHM Cc1cccc([C@@H](C)SCC(=O)Nc2cccc(-c3nnn[n-]3)c2)c1 ZINC000822288613 599227003 /nfs/dbraw/zinc/22/70/03/599227003.db2.gz CZBUMZLNSQCXEC-CYBMUJFWSA-N -1 3 353.451 3.608 20 0 FHADHM Cc1cccc([C@@H](C)SCC(=O)Nc2cccc(-c3nn[n-]n3)c2)c1 ZINC000822288613 599227006 /nfs/dbraw/zinc/22/70/06/599227006.db2.gz CZBUMZLNSQCXEC-CYBMUJFWSA-N -1 3 353.451 3.608 20 0 FHADHM CS[C@@H]1CC[C@H](n2c(C)csc2=Nc2ccccc2-c2nnn[n-]2)C1 ZINC000821951092 599235894 /nfs/dbraw/zinc/23/58/94/599235894.db2.gz UKNAQGWDEFICNA-QWHCGFSZSA-N -1 3 372.523 3.727 20 0 FHADHM CS[C@@H]1CC[C@H](n2c(C)csc2=Nc2ccccc2-c2nn[n-]n2)C1 ZINC000821951092 599235897 /nfs/dbraw/zinc/23/58/97/599235897.db2.gz UKNAQGWDEFICNA-QWHCGFSZSA-N -1 3 372.523 3.727 20 0 FHADHM C[C@H](NC(=S)Nc1ccc(Cl)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000820403972 599237630 /nfs/dbraw/zinc/23/76/30/599237630.db2.gz OFUSEIWXERRWHO-JTQLQIEISA-N -1 3 358.858 3.568 20 0 FHADHM C[C@H](NC(=S)Nc1ccc(Cl)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000820403972 599237632 /nfs/dbraw/zinc/23/76/32/599237632.db2.gz OFUSEIWXERRWHO-JTQLQIEISA-N -1 3 358.858 3.568 20 0 FHADHM C[C@@H]1CCN(C(=S)Nc2ccccc2-c2nnn[n-]2)[C@H](c2ccco2)C1 ZINC000820715955 599238872 /nfs/dbraw/zinc/23/88/72/599238872.db2.gz GFDPUPJFNJFOID-DOMZBBRYSA-N -1 3 368.466 3.630 20 0 FHADHM C[C@@H]1CCN(C(=S)Nc2ccccc2-c2nn[n-]n2)[C@H](c2ccco2)C1 ZINC000820715955 599238874 /nfs/dbraw/zinc/23/88/74/599238874.db2.gz GFDPUPJFNJFOID-DOMZBBRYSA-N -1 3 368.466 3.630 20 0 FHADHM C[C@H]1CN(C(=O)Nc2ccc(-c3nnn[n-]3)cc2)CC[C@H]1c1ccccc1 ZINC000820742916 599240267 /nfs/dbraw/zinc/24/02/67/599240267.db2.gz NSTMVLFLSGJCAA-KBXCAEBGSA-N -1 3 362.437 3.524 20 0 FHADHM C[C@H]1CN(C(=O)Nc2ccc(-c3nn[n-]n3)cc2)CC[C@H]1c1ccccc1 ZINC000820742916 599240271 /nfs/dbraw/zinc/24/02/71/599240271.db2.gz NSTMVLFLSGJCAA-KBXCAEBGSA-N -1 3 362.437 3.524 20 0 FHADHM Cc1c(NC(=O)c2cc3c(cccc3F)s2)cccc1-c1nnn[n-]1 ZINC000822109318 607270020 /nfs/dbraw/zinc/27/00/20/607270020.db2.gz QETZLLYCSRTNBO-UHFFFAOYSA-N -1 3 353.382 3.781 20 0 FHADHM Cc1c(NC(=O)c2cc3c(cccc3F)s2)cccc1-c1nn[n-]n1 ZINC000822109318 607270021 /nfs/dbraw/zinc/27/00/21/607270021.db2.gz QETZLLYCSRTNBO-UHFFFAOYSA-N -1 3 353.382 3.781 20 0 FHADHM Cc1ccc(C(C)(C)CN(C)C(=O)Nc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000822227780 599241237 /nfs/dbraw/zinc/24/12/37/599241237.db2.gz VUDMTIUERJBIPM-UHFFFAOYSA-N -1 3 364.453 3.617 20 0 FHADHM Cc1ccc(C(C)(C)CN(C)C(=O)Nc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000822227780 599241239 /nfs/dbraw/zinc/24/12/39/599241239.db2.gz VUDMTIUERJBIPM-UHFFFAOYSA-N -1 3 364.453 3.617 20 0 FHADHM Cc1c(NC(=O)c2cc3cc(Cl)ccc3o2)cccc1-c1nnn[n-]1 ZINC000822109681 607270809 /nfs/dbraw/zinc/27/08/09/607270809.db2.gz UFZBJBUTOQHALW-UHFFFAOYSA-N -1 3 353.769 3.827 20 0 FHADHM Cc1c(NC(=O)c2cc3cc(Cl)ccc3o2)cccc1-c1nn[n-]n1 ZINC000822109681 607270810 /nfs/dbraw/zinc/27/08/10/607270810.db2.gz UFZBJBUTOQHALW-UHFFFAOYSA-N -1 3 353.769 3.827 20 0 FHADHM Cc1c(NC(=O)CCc2ccc3ccccc3c2)cccc1-c1nnn[n-]1 ZINC000822065989 607271531 /nfs/dbraw/zinc/27/15/31/607271531.db2.gz DCXARMHSNHTDFA-UHFFFAOYSA-N -1 3 357.417 3.900 20 0 FHADHM Cc1c(NC(=O)CCc2ccc3ccccc3c2)cccc1-c1nn[n-]n1 ZINC000822065989 607271532 /nfs/dbraw/zinc/27/15/32/607271532.db2.gz DCXARMHSNHTDFA-UHFFFAOYSA-N -1 3 357.417 3.900 20 0 FHADHM Cc1c(NC(=O)c2ccc(OC(C)(C)C)cc2)cccc1-c1nnn[n-]1 ZINC000822107722 607269032 /nfs/dbraw/zinc/26/90/32/607269032.db2.gz CFKLMJIDNFQXJU-UHFFFAOYSA-N -1 3 351.410 3.605 20 0 FHADHM Cc1c(NC(=O)c2ccc(OC(C)(C)C)cc2)cccc1-c1nn[n-]n1 ZINC000822107722 607269033 /nfs/dbraw/zinc/26/90/33/607269033.db2.gz CFKLMJIDNFQXJU-UHFFFAOYSA-N -1 3 351.410 3.605 20 0 FHADHM Cc1cccc([C@@H]2CCCN2C(=O)Nc2cccc(-c3nnn[n-]3)c2)c1C ZINC000822299689 599246028 /nfs/dbraw/zinc/24/60/28/599246028.db2.gz RGMAMYQSWTYBBA-SFHVURJKSA-N -1 3 362.437 3.853 20 0 FHADHM Cc1cccc([C@@H]2CCCN2C(=O)Nc2cccc(-c3nn[n-]n3)c2)c1C ZINC000822299689 599246031 /nfs/dbraw/zinc/24/60/31/599246031.db2.gz RGMAMYQSWTYBBA-SFHVURJKSA-N -1 3 362.437 3.853 20 0 FHADHM CCCc1ccc(NC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000821138822 599250052 /nfs/dbraw/zinc/25/00/52/599250052.db2.gz ICRIASMNYYCFHU-ZDUSSCGKSA-N -1 3 350.426 3.702 20 0 FHADHM CCCc1ccc(NC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000821138822 599250055 /nfs/dbraw/zinc/25/00/55/599250055.db2.gz ICRIASMNYYCFHU-ZDUSSCGKSA-N -1 3 350.426 3.702 20 0 FHADHM Cc1ccccc1[C@@H]1CCCN1C(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000822352412 607287995 /nfs/dbraw/zinc/28/79/95/607287995.db2.gz ZBCICSASRJSBCG-SFHVURJKSA-N -1 3 362.437 3.853 20 0 FHADHM Cc1ccccc1[C@@H]1CCCN1C(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000822352412 607287996 /nfs/dbraw/zinc/28/79/96/607287996.db2.gz ZBCICSASRJSBCG-SFHVURJKSA-N -1 3 362.437 3.853 20 0 FHADHM Cc1c(NC(=O)N[C@H](C)c2c(F)cccc2Cl)cccc1-c1nnn[n-]1 ZINC000822092715 607288586 /nfs/dbraw/zinc/28/85/86/607288586.db2.gz YRGIKTGGXZXXCM-SNVBAGLBSA-N -1 3 374.807 3.850 20 0 FHADHM Cc1c(NC(=O)N[C@H](C)c2c(F)cccc2Cl)cccc1-c1nn[n-]n1 ZINC000822092715 607288587 /nfs/dbraw/zinc/28/85/87/607288587.db2.gz YRGIKTGGXZXXCM-SNVBAGLBSA-N -1 3 374.807 3.850 20 0 FHADHM Cc1ccc([C@H](NC(=O)Nc2cccc(-c3nnn[n-]3)c2C)C2CC2)cc1 ZINC000822231025 607289350 /nfs/dbraw/zinc/28/93/50/607289350.db2.gz XXFWGHPILAZKNB-SFHVURJKSA-N -1 3 362.437 3.756 20 0 FHADHM Cc1ccc([C@H](NC(=O)Nc2cccc(-c3nn[n-]n3)c2C)C2CC2)cc1 ZINC000822231025 607289351 /nfs/dbraw/zinc/28/93/51/607289351.db2.gz XXFWGHPILAZKNB-SFHVURJKSA-N -1 3 362.437 3.756 20 0 FHADHM Cc1c(NC(=O)N(Cc2ccccc2)CC(C)C)cccc1-c1nnn[n-]1 ZINC000822084262 607289023 /nfs/dbraw/zinc/28/90/23/607289023.db2.gz IBFYDFGIVFKCTB-UHFFFAOYSA-N -1 3 364.453 3.865 20 0 FHADHM Cc1c(NC(=O)N(Cc2ccccc2)CC(C)C)cccc1-c1nn[n-]n1 ZINC000822084262 607289024 /nfs/dbraw/zinc/28/90/24/607289024.db2.gz IBFYDFGIVFKCTB-UHFFFAOYSA-N -1 3 364.453 3.865 20 0 FHADHM Cc1cccc2c1ncc(-c1nnn[n-]1)c2N1CCC[C@H](C(F)(F)F)C1 ZINC000737410130 599256584 /nfs/dbraw/zinc/25/65/84/599256584.db2.gz PJSXUSTYLPTMNS-NSHDSACASA-N -1 3 362.359 3.502 20 0 FHADHM Cc1cccc2c1ncc(-c1nn[n-]n1)c2N1CCC[C@H](C(F)(F)F)C1 ZINC000737410130 599256585 /nfs/dbraw/zinc/25/65/85/599256585.db2.gz PJSXUSTYLPTMNS-NSHDSACASA-N -1 3 362.359 3.502 20 0 FHADHM Cc1c(NC(=O)Nc2ccccc2OC(C)C)cccc1-c1nnn[n-]1 ZINC000822105891 607285020 /nfs/dbraw/zinc/28/50/20/607285020.db2.gz XWCOXPLXPYYWTF-UHFFFAOYSA-N -1 3 352.398 3.606 20 0 FHADHM Cc1c(NC(=O)Nc2ccccc2OC(C)C)cccc1-c1nn[n-]n1 ZINC000822105891 607285021 /nfs/dbraw/zinc/28/50/21/607285021.db2.gz XWCOXPLXPYYWTF-UHFFFAOYSA-N -1 3 352.398 3.606 20 0 FHADHM Cc1c(NC(=O)N(C)Cc2ccc3ccccc3c2)cccc1-c1nnn[n-]1 ZINC000822077432 607285393 /nfs/dbraw/zinc/28/53/93/607285393.db2.gz VDSAGXZZJFQJRZ-UHFFFAOYSA-N -1 3 372.432 3.992 20 0 FHADHM Cc1c(NC(=O)N(C)Cc2ccc3ccccc3c2)cccc1-c1nn[n-]n1 ZINC000822077432 607285394 /nfs/dbraw/zinc/28/53/94/607285394.db2.gz VDSAGXZZJFQJRZ-UHFFFAOYSA-N -1 3 372.432 3.992 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@H]2C2CCCCC2)cccc1-c1nnn[n-]1 ZINC000822084979 607287345 /nfs/dbraw/zinc/28/73/45/607287345.db2.gz UTLXSSRNMQNPAC-KRWDZBQOSA-N -1 3 354.458 3.752 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@H]2C2CCCCC2)cccc1-c1nn[n-]n1 ZINC000822084979 607287346 /nfs/dbraw/zinc/28/73/46/607287346.db2.gz UTLXSSRNMQNPAC-KRWDZBQOSA-N -1 3 354.458 3.752 20 0 FHADHM CCCN(Cc1ccccc1)C(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000821109826 607290377 /nfs/dbraw/zinc/29/03/77/607290377.db2.gz QICVJMHGFTZGNQ-UHFFFAOYSA-N -1 3 350.426 3.619 20 0 FHADHM CCCN(Cc1ccccc1)C(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000821109826 607290378 /nfs/dbraw/zinc/29/03/78/607290378.db2.gz QICVJMHGFTZGNQ-UHFFFAOYSA-N -1 3 350.426 3.619 20 0 FHADHM Cc1c(NC(=O)CCc2ccc(-c3ccccc3)[nH]2)cccc1-c1nnn[n-]1 ZINC000822066548 607294373 /nfs/dbraw/zinc/29/43/73/607294373.db2.gz GDIQWBIZBMWCJY-UHFFFAOYSA-N -1 3 372.432 3.742 20 0 FHADHM Cc1c(NC(=O)CCc2ccc(-c3ccccc3)[nH]2)cccc1-c1nn[n-]n1 ZINC000822066548 607294374 /nfs/dbraw/zinc/29/43/74/607294374.db2.gz GDIQWBIZBMWCJY-UHFFFAOYSA-N -1 3 372.432 3.742 20 0 FHADHM Cc1nc(C2CCCC2)sc1C(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000822431875 607296816 /nfs/dbraw/zinc/29/68/16/607296816.db2.gz NCPGQCUOIYOWGO-UHFFFAOYSA-N -1 3 368.466 3.850 20 0 FHADHM Cc1nc(C2CCCC2)sc1C(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000822431875 607296817 /nfs/dbraw/zinc/29/68/17/607296817.db2.gz NCPGQCUOIYOWGO-UHFFFAOYSA-N -1 3 368.466 3.850 20 0 FHADHM CC[C@@H](C)C[C@H](C)NC(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(C)C ZINC000820869454 599264491 /nfs/dbraw/zinc/26/44/91/599264491.db2.gz HAZRWBQTEKLUIS-OLZOCXBDSA-N -1 3 360.462 3.600 20 0 FHADHM CC[C@@H](C)C[C@H](C)NC(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(C)C ZINC000820869454 599264494 /nfs/dbraw/zinc/26/44/94/599264494.db2.gz HAZRWBQTEKLUIS-OLZOCXBDSA-N -1 3 360.462 3.600 20 0 FHADHM CC1CCN(c2ccc(NCc3cc(-c4nnn[n-]4)cs3)cc2)CC1 ZINC000820727220 607310604 /nfs/dbraw/zinc/31/06/04/607310604.db2.gz JDUQYALEBTZGDU-UHFFFAOYSA-N -1 3 354.483 3.777 20 0 FHADHM CC1CCN(c2ccc(NCc3cc(-c4nn[n-]n4)cs3)cc2)CC1 ZINC000820727220 607310605 /nfs/dbraw/zinc/31/06/05/607310605.db2.gz JDUQYALEBTZGDU-UHFFFAOYSA-N -1 3 354.483 3.777 20 0 FHADHM COc1ccc(CNc2ccccc2OCC(C)C)cc1-c1nnn[n-]1 ZINC000821825236 607312430 /nfs/dbraw/zinc/31/24/30/607312430.db2.gz VBDFAHORLUTEQK-UHFFFAOYSA-N -1 3 353.426 3.522 20 0 FHADHM COc1ccc(CNc2ccccc2OCC(C)C)cc1-c1nn[n-]n1 ZINC000821825236 607312431 /nfs/dbraw/zinc/31/24/31/607312431.db2.gz VBDFAHORLUTEQK-UHFFFAOYSA-N -1 3 353.426 3.522 20 0 FHADHM FC(F)(F)c1nc2cc(NCc3cccc(-c4nnn[n-]4)c3)ccc2o1 ZINC000822729050 607314712 /nfs/dbraw/zinc/31/47/12/607314712.db2.gz SJLYJRLOZGYEGC-UHFFFAOYSA-N -1 3 360.299 3.639 20 0 FHADHM FC(F)(F)c1nc2cc(NCc3cccc(-c4nn[n-]n4)c3)ccc2o1 ZINC000822729050 607314713 /nfs/dbraw/zinc/31/47/13/607314713.db2.gz SJLYJRLOZGYEGC-UHFFFAOYSA-N -1 3 360.299 3.639 20 0 FHADHM Cc1csc(-c2ccc(NCc3cc(-c4nnn[n-]4)cs3)cc2)n1 ZINC000822409320 607315277 /nfs/dbraw/zinc/31/52/77/607315277.db2.gz PVFOFYGBRUCYDZ-UHFFFAOYSA-N -1 3 354.464 3.972 20 0 FHADHM Cc1csc(-c2ccc(NCc3cc(-c4nn[n-]n4)cs3)cc2)n1 ZINC000822409320 607315278 /nfs/dbraw/zinc/31/52/78/607315278.db2.gz PVFOFYGBRUCYDZ-UHFFFAOYSA-N -1 3 354.464 3.972 20 0 FHADHM CCCOc1cccc(CC(=O)Nc2sc(C)c(C)c2-c2nnn[n-]2)c1 ZINC000821133623 607303744 /nfs/dbraw/zinc/30/37/44/607303744.db2.gz BZKUMOWXVLQQDW-UHFFFAOYSA-N -1 3 371.466 3.515 20 0 FHADHM CCCOc1cccc(CC(=O)Nc2sc(C)c(C)c2-c2nn[n-]n2)c1 ZINC000821133623 607303745 /nfs/dbraw/zinc/30/37/45/607303745.db2.gz BZKUMOWXVLQQDW-UHFFFAOYSA-N -1 3 371.466 3.515 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)CCc1ccc(C)cc1 ZINC000736488472 599277435 /nfs/dbraw/zinc/27/74/35/599277435.db2.gz RLYRUZXHCULIRZ-UHFFFAOYSA-N -1 3 364.453 3.568 20 0 FHADHM C[C@@H]1CCCC[C@@H]1NC(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000820704671 599286782 /nfs/dbraw/zinc/28/67/82/599286782.db2.gz PHJZKGPYXVTDBS-RNCFNFMXSA-N -1 3 368.363 3.586 20 0 FHADHM C[C@@H]1CCCC[C@@H]1NC(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000820704671 599286784 /nfs/dbraw/zinc/28/67/84/599286784.db2.gz PHJZKGPYXVTDBS-RNCFNFMXSA-N -1 3 368.363 3.586 20 0 FHADHM C[C@@H](Sc1nccc(C(F)(F)F)n1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736192431 599289621 /nfs/dbraw/zinc/28/96/21/599289621.db2.gz MTRDWRHCLHOBLF-MRVPVSSYSA-N -1 3 352.345 3.529 20 0 FHADHM C[C@@H](Sc1nccc(C(F)(F)F)n1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736192431 599289623 /nfs/dbraw/zinc/28/96/23/599289623.db2.gz MTRDWRHCLHOBLF-MRVPVSSYSA-N -1 3 352.345 3.529 20 0 FHADHM C[C@@H](Sc1nc2cc(F)c(F)cc2[nH]1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736194047 599289632 /nfs/dbraw/zinc/28/96/32/599289632.db2.gz XIUVVQPEGXVHHV-MRVPVSSYSA-N -1 3 358.377 3.875 20 0 FHADHM C[C@@H](Sc1nc2cc(F)c(F)cc2[nH]1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736194047 599289634 /nfs/dbraw/zinc/28/96/34/599289634.db2.gz XIUVVQPEGXVHHV-MRVPVSSYSA-N -1 3 358.377 3.875 20 0 FHADHM CC[C@H](C)NC(=O)[C@H](Sc1ccc(-c2nnn[n-]2)cc1Cl)C(C)C ZINC000825069313 607844468 /nfs/dbraw/zinc/84/44/68/607844468.db2.gz ZYPKZIUUEJHDRK-IINYFYTJSA-N -1 3 367.906 3.552 20 0 FHADHM CC[C@H](C)NC(=O)[C@H](Sc1ccc(-c2nn[n-]n2)cc1Cl)C(C)C ZINC000825069313 607844469 /nfs/dbraw/zinc/84/44/69/607844469.db2.gz ZYPKZIUUEJHDRK-IINYFYTJSA-N -1 3 367.906 3.552 20 0 FHADHM Cc1nccn1-c1ccc([C@H](C)Nc2ccc(F)cc2-c2nnn[n-]2)cc1 ZINC000822479283 607329128 /nfs/dbraw/zinc/32/91/28/607329128.db2.gz ZXWXAZUEZMFJLJ-LBPRGKRZSA-N -1 3 363.400 3.673 20 0 FHADHM Cc1nccn1-c1ccc([C@H](C)Nc2ccc(F)cc2-c2nn[n-]n2)cc1 ZINC000822479283 607329129 /nfs/dbraw/zinc/32/91/29/607329129.db2.gz ZXWXAZUEZMFJLJ-LBPRGKRZSA-N -1 3 363.400 3.673 20 0 FHADHM O=C(N[C@@H](c1ccc(Cl)cc1)C1CCC1)c1sccc1-c1nnn[n-]1 ZINC000737997542 598235454 /nfs/dbraw/zinc/23/54/54/598235454.db2.gz JXECCVAAYHLSJY-CQSZACIVSA-N -1 3 373.869 3.853 20 0 FHADHM O=C(N[C@@H](c1ccc(Cl)cc1)C1CCC1)c1sccc1-c1nn[n-]n1 ZINC000737997542 598235455 /nfs/dbraw/zinc/23/54/55/598235455.db2.gz JXECCVAAYHLSJY-CQSZACIVSA-N -1 3 373.869 3.853 20 0 FHADHM CCOc1ccc([C@H]2CCCN2c2cccc(F)c2-c2nnn[n-]2)cc1 ZINC000736637854 598235805 /nfs/dbraw/zinc/23/58/05/598235805.db2.gz RRARFZZYQLGQFO-MRXNPFEDSA-N -1 3 353.401 3.746 20 0 FHADHM CCOc1ccc([C@H]2CCCN2c2cccc(F)c2-c2nn[n-]n2)cc1 ZINC000736637854 598235806 /nfs/dbraw/zinc/23/58/06/598235806.db2.gz RRARFZZYQLGQFO-MRXNPFEDSA-N -1 3 353.401 3.746 20 0 FHADHM Fc1cccc(N2CCC[C@H](c3nc4ccccc4o3)C2)c1-c1nnn[n-]1 ZINC000737661027 598238845 /nfs/dbraw/zinc/23/88/45/598238845.db2.gz MMRGTLZHXDJPEK-LBPRGKRZSA-N -1 3 364.384 3.531 20 0 FHADHM Fc1cccc(N2CCC[C@H](c3nc4ccccc4o3)C2)c1-c1nn[n-]n1 ZINC000737661027 598238846 /nfs/dbraw/zinc/23/88/46/598238846.db2.gz MMRGTLZHXDJPEK-LBPRGKRZSA-N -1 3 364.384 3.531 20 0 FHADHM C[C@H]1CCC[C@@H]1NC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736263797 598242448 /nfs/dbraw/zinc/24/24/48/598242448.db2.gz SKRLKKYPSPZIPP-UGSOOPFHSA-N -1 3 363.421 3.577 20 0 FHADHM C[C@H]1CCC[C@@H]1NC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736263797 598242449 /nfs/dbraw/zinc/24/24/49/598242449.db2.gz SKRLKKYPSPZIPP-UGSOOPFHSA-N -1 3 363.421 3.577 20 0 FHADHM CC(C)(C)c1csc(CCNc2c(F)cc(-c3nnn[n-]3)cc2F)n1 ZINC000735652639 598244593 /nfs/dbraw/zinc/24/45/93/598244593.db2.gz OXRZIUQZMLRWTI-UHFFFAOYSA-N -1 3 364.425 3.554 20 0 FHADHM CC(C)(C)c1csc(CCNc2c(F)cc(-c3nn[n-]n3)cc2F)n1 ZINC000735652639 598244595 /nfs/dbraw/zinc/24/45/95/598244595.db2.gz OXRZIUQZMLRWTI-UHFFFAOYSA-N -1 3 364.425 3.554 20 0 FHADHM COc1ccccc1CCNc1ccc(-c2nn[n-]n2)cc1C(F)(F)F ZINC000737150073 598275343 /nfs/dbraw/zinc/27/53/43/598275343.db2.gz LXEKQLRXBYQRTN-UHFFFAOYSA-N -1 3 363.343 3.549 20 0 FHADHM CC(=CC(=O)N(C)c1ccc(-c2nnn[n-]2)cc1F)c1ccccc1Cl ZINC000735450527 598278410 /nfs/dbraw/zinc/27/84/10/598278410.db2.gz ZWHQGVXKHPMHDZ-LUAWRHEFSA-N -1 3 371.803 3.726 20 0 FHADHM CC(=CC(=O)N(C)c1ccc(-c2nn[n-]n2)cc1F)c1ccccc1Cl ZINC000735450527 598278412 /nfs/dbraw/zinc/27/84/12/598278412.db2.gz ZWHQGVXKHPMHDZ-LUAWRHEFSA-N -1 3 371.803 3.726 20 0 FHADHM CCCCCN(C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C)C(C)C ZINC000736447958 598280106 /nfs/dbraw/zinc/28/01/06/598280106.db2.gz VXGVUDNQKLMUFE-UHFFFAOYSA-N -1 3 361.494 3.856 20 0 FHADHM CCCCCN(C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C)C(C)C ZINC000736447958 598280108 /nfs/dbraw/zinc/28/01/08/598280108.db2.gz VXGVUDNQKLMUFE-UHFFFAOYSA-N -1 3 361.494 3.856 20 0 FHADHM CC[C@@H](NC(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)C1CCCCC1 ZINC000736362938 598283893 /nfs/dbraw/zinc/28/38/93/598283893.db2.gz LNAUUBJUXYXJEL-SUMWQHHRSA-N -1 3 356.474 3.586 20 0 FHADHM CC[C@@H](NC(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)C1CCCCC1 ZINC000736362938 598283894 /nfs/dbraw/zinc/28/38/94/598283894.db2.gz LNAUUBJUXYXJEL-SUMWQHHRSA-N -1 3 356.474 3.586 20 0 FHADHM CN(CCC1CCCCC1)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736791691 598292771 /nfs/dbraw/zinc/29/27/71/598292771.db2.gz GKOTYRRLTTZOAS-UHFFFAOYSA-N -1 3 362.865 3.954 20 0 FHADHM CN(CCC1CCCCC1)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736791691 598292772 /nfs/dbraw/zinc/29/27/72/598292772.db2.gz GKOTYRRLTTZOAS-UHFFFAOYSA-N -1 3 362.865 3.954 20 0 FHADHM C[C@H](Sc1cccc(Cl)c1)C(=O)Nc1ccccc1-c1nnn[n-]1 ZINC000736189131 598294084 /nfs/dbraw/zinc/29/40/84/598294084.db2.gz ASMFZLKJZDUGFW-JTQLQIEISA-N -1 3 359.842 3.639 20 0 FHADHM C[C@H](Sc1cccc(Cl)c1)C(=O)Nc1ccccc1-c1nn[n-]n1 ZINC000736189131 598294085 /nfs/dbraw/zinc/29/40/85/598294085.db2.gz ASMFZLKJZDUGFW-JTQLQIEISA-N -1 3 359.842 3.639 20 0 FHADHM C[C@@H](Sc1cccc(Cl)c1)C(=O)Nc1ccccc1-c1nnn[n-]1 ZINC000736189134 598294360 /nfs/dbraw/zinc/29/43/60/598294360.db2.gz ASMFZLKJZDUGFW-SNVBAGLBSA-N -1 3 359.842 3.639 20 0 FHADHM C[C@@H](Sc1cccc(Cl)c1)C(=O)Nc1ccccc1-c1nn[n-]n1 ZINC000736189134 598294362 /nfs/dbraw/zinc/29/43/62/598294362.db2.gz ASMFZLKJZDUGFW-SNVBAGLBSA-N -1 3 359.842 3.639 20 0 FHADHM CC(C)c1cccc(NC(=S)NCc2ccc(-c3nnn[n-]3)cc2F)c1 ZINC000735933449 598295395 /nfs/dbraw/zinc/29/53/95/598295395.db2.gz WTLIJFIMEPOEQF-UHFFFAOYSA-N -1 3 370.457 3.616 20 0 FHADHM CC(C)c1cccc(NC(=S)NCc2ccc(-c3nn[n-]n3)cc2F)c1 ZINC000735933449 598295397 /nfs/dbraw/zinc/29/53/97/598295397.db2.gz WTLIJFIMEPOEQF-UHFFFAOYSA-N -1 3 370.457 3.616 20 0 FHADHM CC[C@@H](C)Oc1ccccc1C=CC(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000729846028 598296856 /nfs/dbraw/zinc/29/68/56/598296856.db2.gz ZIRPCACWCVCRCD-QLKUMGTLSA-N -1 3 363.421 3.696 20 0 FHADHM CC[C@@H](C)Oc1ccccc1C=CC(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000729846028 598296859 /nfs/dbraw/zinc/29/68/59/598296859.db2.gz ZIRPCACWCVCRCD-QLKUMGTLSA-N -1 3 363.421 3.696 20 0 FHADHM CC[C@H](C)Oc1ccccc1C=CC(=O)Nc1ccccc1-c1nnn[n-]1 ZINC000736323550 598296985 /nfs/dbraw/zinc/29/69/85/598296985.db2.gz BCKTZVFIRWUOHO-FNDVETGQSA-N -1 3 363.421 3.696 20 0 FHADHM CC[C@H](C)Oc1ccccc1C=CC(=O)Nc1ccccc1-c1nn[n-]n1 ZINC000736323550 598296986 /nfs/dbraw/zinc/29/69/86/598296986.db2.gz BCKTZVFIRWUOHO-FNDVETGQSA-N -1 3 363.421 3.696 20 0 FHADHM CN(C(=O)CCCc1ccc(Cl)cc1)c1ccc(-c2nnn[n-]2)cc1F ZINC000736732878 598308417 /nfs/dbraw/zinc/30/84/17/598308417.db2.gz PGXMQWOJOMCTMY-UHFFFAOYSA-N -1 3 373.819 3.645 20 0 FHADHM CN(C(=O)CCCc1ccc(Cl)cc1)c1ccc(-c2nn[n-]n2)cc1F ZINC000736732878 598308419 /nfs/dbraw/zinc/30/84/19/598308419.db2.gz PGXMQWOJOMCTMY-UHFFFAOYSA-N -1 3 373.819 3.645 20 0 FHADHM CC(C)CN(CC(C)C)C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000735827122 598315375 /nfs/dbraw/zinc/31/53/75/598315375.db2.gz FVNSPPHKRDYIAH-UHFFFAOYSA-N -1 3 366.922 3.831 20 0 FHADHM CC(C)CN(CC(C)C)C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000735827122 598315376 /nfs/dbraw/zinc/31/53/76/598315376.db2.gz FVNSPPHKRDYIAH-UHFFFAOYSA-N -1 3 366.922 3.831 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)ccc1OCc1ccc(OC(C)C)cc1 ZINC000736625389 598315485 /nfs/dbraw/zinc/31/54/85/598315485.db2.gz DVINCUNBKZOYPR-UHFFFAOYSA-N -1 3 354.410 3.632 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)ccc1OCc1ccc(OC(C)C)cc1 ZINC000736625389 598315487 /nfs/dbraw/zinc/31/54/87/598315487.db2.gz DVINCUNBKZOYPR-UHFFFAOYSA-N -1 3 354.410 3.632 20 0 FHADHM CC(=O)c1cccc(NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c1 ZINC000735499325 598316518 /nfs/dbraw/zinc/31/65/18/598316518.db2.gz OJOAEAVGRPKREI-UHFFFAOYSA-N -1 3 372.841 3.532 20 0 FHADHM CC(=O)c1cccc(NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c1 ZINC000735499325 598316520 /nfs/dbraw/zinc/31/65/20/598316520.db2.gz OJOAEAVGRPKREI-UHFFFAOYSA-N -1 3 372.841 3.532 20 0 FHADHM C[C@@H]1CCC[C@@H](N(C)C(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)C1 ZINC000736247113 598318423 /nfs/dbraw/zinc/31/84/23/598318423.db2.gz AALYXPLVBKMRAZ-ZYHUDNBSSA-N -1 3 364.906 3.727 20 0 FHADHM C[C@@H]1CCC[C@@H](N(C)C(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)C1 ZINC000736247113 598318425 /nfs/dbraw/zinc/31/84/25/598318425.db2.gz AALYXPLVBKMRAZ-ZYHUDNBSSA-N -1 3 364.906 3.727 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1ccc(C(F)F)cc1 ZINC000736478741 598327432 /nfs/dbraw/zinc/32/74/32/598327432.db2.gz BEGNDEQAHRMURQ-UHFFFAOYSA-N -1 3 371.391 3.857 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1ccc(C(F)F)cc1 ZINC000736478741 598327434 /nfs/dbraw/zinc/32/74/34/598327434.db2.gz BEGNDEQAHRMURQ-UHFFFAOYSA-N -1 3 371.391 3.857 20 0 FHADHM C[C@@H](OC(=O)[C@@H]1CCCc2sccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488828 607351843 /nfs/dbraw/zinc/35/18/43/607351843.db2.gz VAEARSSHZFZQEI-IAQYHMDHSA-N -1 3 354.435 3.653 20 0 FHADHM C[C@@H](OC(=O)[C@@H]1CCCc2sccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488828 607351845 /nfs/dbraw/zinc/35/18/45/607351845.db2.gz VAEARSSHZFZQEI-IAQYHMDHSA-N -1 3 354.435 3.653 20 0 FHADHM C[C@H](NC(=O)c1sccc1-c1nnn[n-]1)c1csc2ccccc21 ZINC000736124872 598359946 /nfs/dbraw/zinc/35/99/46/598359946.db2.gz IHRWKNGXZBPLRT-VIFPVBQESA-N -1 3 355.448 3.634 20 0 FHADHM C[C@H](NC(=O)c1sccc1-c1nn[n-]n1)c1csc2ccccc21 ZINC000736124872 598359948 /nfs/dbraw/zinc/35/99/48/598359948.db2.gz IHRWKNGXZBPLRT-VIFPVBQESA-N -1 3 355.448 3.634 20 0 FHADHM C[C@@H](NC(=O)c1sccc1-c1nnn[n-]1)c1csc2ccccc21 ZINC000736124870 598360081 /nfs/dbraw/zinc/36/00/81/598360081.db2.gz IHRWKNGXZBPLRT-SECBINFHSA-N -1 3 355.448 3.634 20 0 FHADHM C[C@@H](NC(=O)c1sccc1-c1nn[n-]n1)c1csc2ccccc21 ZINC000736124870 598360083 /nfs/dbraw/zinc/36/00/83/598360083.db2.gz IHRWKNGXZBPLRT-SECBINFHSA-N -1 3 355.448 3.634 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)ccc1OC(=O)C[C@H](C)c1ccccc1F ZINC000736625545 598365392 /nfs/dbraw/zinc/36/53/92/598365392.db2.gz BIRPRGOQDVRJHP-LBPRGKRZSA-N -1 3 370.384 3.504 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)ccc1OC(=O)C[C@H](C)c1ccccc1F ZINC000736625545 598365394 /nfs/dbraw/zinc/36/53/94/598365394.db2.gz BIRPRGOQDVRJHP-LBPRGKRZSA-N -1 3 370.384 3.504 20 0 FHADHM Cc1cccc(C2(C(=O)OCc3ccc(-c4nnn[n-]4)cc3)CCCC2)c1 ZINC000737390743 598371483 /nfs/dbraw/zinc/37/14/83/598371483.db2.gz WRFFNANYVWDJEY-UHFFFAOYSA-N -1 3 362.433 3.730 20 0 FHADHM Cc1cccc(C2(C(=O)OCc3ccc(-c4nn[n-]n4)cc3)CCCC2)c1 ZINC000737390743 598371485 /nfs/dbraw/zinc/37/14/85/598371485.db2.gz WRFFNANYVWDJEY-UHFFFAOYSA-N -1 3 362.433 3.730 20 0 FHADHM CN(Cc1ccc(C(F)(F)F)cc1)c1ncc(-c2nnn[n-]2)cc1Cl ZINC000736816998 598386074 /nfs/dbraw/zinc/38/60/74/598386074.db2.gz STIFCYDXXZWHOB-UHFFFAOYSA-N -1 3 368.750 3.570 20 0 FHADHM CN(Cc1ccc(C(F)(F)F)cc1)c1ncc(-c2nn[n-]n2)cc1Cl ZINC000736816998 598386076 /nfs/dbraw/zinc/38/60/76/598386076.db2.gz STIFCYDXXZWHOB-UHFFFAOYSA-N -1 3 368.750 3.570 20 0 FHADHM CN(Cc1ccc(Cl)c(Cl)c1)c1ncc(-c2nnn[n-]2)cc1Cl ZINC000736817306 598386248 /nfs/dbraw/zinc/38/62/48/598386248.db2.gz XTTMNCLGFUQWCX-UHFFFAOYSA-N -1 3 369.643 3.858 20 0 FHADHM CN(Cc1ccc(Cl)c(Cl)c1)c1ncc(-c2nn[n-]n2)cc1Cl ZINC000736817306 598386249 /nfs/dbraw/zinc/38/62/49/598386249.db2.gz XTTMNCLGFUQWCX-UHFFFAOYSA-N -1 3 369.643 3.858 20 0 FHADHM Fc1cccc(Nc2cnn(-c3ccccc3Cl)c2)c1-c1nnn[n-]1 ZINC000737663077 598388367 /nfs/dbraw/zinc/38/83/67/598388367.db2.gz FLKRMJMBUDDJQU-UHFFFAOYSA-N -1 3 355.764 3.589 20 0 FHADHM Fc1cccc(Nc2cnn(-c3ccccc3Cl)c2)c1-c1nn[n-]n1 ZINC000737663077 598388369 /nfs/dbraw/zinc/38/83/69/598388369.db2.gz FLKRMJMBUDDJQU-UHFFFAOYSA-N -1 3 355.764 3.589 20 0 FHADHM C[C@H](Nc1ncc(-c2nnn[n-]2)cc1Cl)c1cccc(OC(F)F)c1 ZINC000736135459 598389088 /nfs/dbraw/zinc/38/90/88/598389088.db2.gz ABCGTLIMFSQEAP-QMMMGPOBSA-N -1 3 366.759 3.690 20 0 FHADHM C[C@H](Nc1ncc(-c2nn[n-]n2)cc1Cl)c1cccc(OC(F)F)c1 ZINC000736135459 598389089 /nfs/dbraw/zinc/38/90/89/598389089.db2.gz ABCGTLIMFSQEAP-QMMMGPOBSA-N -1 3 366.759 3.690 20 0 FHADHM CN(Cc1c(Cl)cccc1Cl)c1ncc(-c2nnn[n-]2)cc1Cl ZINC000736814991 598391721 /nfs/dbraw/zinc/39/17/21/598391721.db2.gz ONPYJJNKLOQPNN-UHFFFAOYSA-N -1 3 369.643 3.858 20 0 FHADHM CN(Cc1c(Cl)cccc1Cl)c1ncc(-c2nn[n-]n2)cc1Cl ZINC000736814991 598391723 /nfs/dbraw/zinc/39/17/23/598391723.db2.gz ONPYJJNKLOQPNN-UHFFFAOYSA-N -1 3 369.643 3.858 20 0 FHADHM Fc1ccc(CC2CCN(c3ncc(-c4nnn[n-]4)cc3Cl)CC2)cc1 ZINC000737651420 598394323 /nfs/dbraw/zinc/39/43/23/598394323.db2.gz UOBMBGFSLINBSO-UHFFFAOYSA-N -1 3 372.835 3.513 20 0 FHADHM Fc1ccc(CC2CCN(c3ncc(-c4nn[n-]n4)cc3Cl)CC2)cc1 ZINC000737651420 598394325 /nfs/dbraw/zinc/39/43/25/598394325.db2.gz UOBMBGFSLINBSO-UHFFFAOYSA-N -1 3 372.835 3.513 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)CC1=CCCCC1 ZINC000735830774 598394974 /nfs/dbraw/zinc/39/49/74/598394974.db2.gz ITMYZNDKPSVXJZ-UHFFFAOYSA-N -1 3 353.470 3.742 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)CC1=CCCCC1 ZINC000735830774 598394975 /nfs/dbraw/zinc/39/49/75/598394975.db2.gz ITMYZNDKPSVXJZ-UHFFFAOYSA-N -1 3 353.470 3.742 20 0 FHADHM O=C(CC1=CCCCC1)Nc1nc(-c2ccc(-c3nnn[n-]3)cc2)cs1 ZINC000737815510 598395091 /nfs/dbraw/zinc/39/50/91/598395091.db2.gz XGWIYFXSQYRAOR-UHFFFAOYSA-N -1 3 366.450 3.819 20 0 FHADHM O=C(CC1=CCCCC1)Nc1nc(-c2ccc(-c3nn[n-]n3)cc2)cs1 ZINC000737815510 598395092 /nfs/dbraw/zinc/39/50/92/598395092.db2.gz XGWIYFXSQYRAOR-UHFFFAOYSA-N -1 3 366.450 3.819 20 0 FHADHM CC[C@H](C)c1ccc(NC(=O)COc2ccc(-c3nn[n-]n3)cc2C)cc1 ZINC000736330477 598395970 /nfs/dbraw/zinc/39/59/70/598395970.db2.gz YTJYPFMXNKFUKD-ZDUSSCGKSA-N -1 3 365.437 3.706 20 0 FHADHM Cc1cc(C)c(NC(=O)[C@@H](C)Sc2ccc(-c3nnn[n-]3)cc2)c(C)c1 ZINC000737247653 598414542 /nfs/dbraw/zinc/41/45/42/598414542.db2.gz YUMZNWGAZRVHNW-CQSZACIVSA-N -1 3 367.478 3.911 20 0 FHADHM Cc1cc(C)c(NC(=O)[C@@H](C)Sc2ccc(-c3nn[n-]n3)cc2)c(C)c1 ZINC000737247653 598414543 /nfs/dbraw/zinc/41/45/43/598414543.db2.gz YUMZNWGAZRVHNW-CQSZACIVSA-N -1 3 367.478 3.911 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@@H](Sc1ccccc1)C(C)C ZINC000737291759 598418520 /nfs/dbraw/zinc/41/85/20/598418520.db2.gz OSGPHHQOOFOYSD-KRWDZBQOSA-N -1 3 367.478 3.931 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@@H](Sc1ccccc1)C(C)C ZINC000737291759 598418521 /nfs/dbraw/zinc/41/85/21/598418521.db2.gz OSGPHHQOOFOYSD-KRWDZBQOSA-N -1 3 367.478 3.931 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)[C@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000500684801 598419154 /nfs/dbraw/zinc/41/91/54/598419154.db2.gz OUYSVDVPUUSTFN-KBPBESRZSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)[C@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000500684801 598419156 /nfs/dbraw/zinc/41/91/56/598419156.db2.gz OUYSVDVPUUSTFN-KBPBESRZSA-N -1 3 374.231 3.916 20 0 FHADHM CCN(C(=O)c1sccc1SC)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736509662 598420711 /nfs/dbraw/zinc/42/07/11/598420711.db2.gz ZGBODPPCDJUQLA-LLVKDONJSA-N -1 3 373.507 3.873 20 0 FHADHM CCN(C(=O)c1sccc1SC)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736509662 598420712 /nfs/dbraw/zinc/42/07/12/598420712.db2.gz ZGBODPPCDJUQLA-LLVKDONJSA-N -1 3 373.507 3.873 20 0 FHADHM CC(C)[C@H](Sc1ccccc1)C(=O)OCc1ccc(-c2nnn[n-]2)cc1 ZINC000735736751 598425665 /nfs/dbraw/zinc/42/56/65/598425665.db2.gz WBKBESPMCLWKAI-KRWDZBQOSA-N -1 3 368.462 3.727 20 0 FHADHM CC(C)[C@H](Sc1ccccc1)C(=O)OCc1ccc(-c2nn[n-]n2)cc1 ZINC000735736751 598425667 /nfs/dbraw/zinc/42/56/67/598425667.db2.gz WBKBESPMCLWKAI-KRWDZBQOSA-N -1 3 368.462 3.727 20 0 FHADHM Cc1cccc(Oc2ccc(NC(=O)c3ccc(-c4nnn[n-]4)cn3)cc2)c1 ZINC000737410044 598436809 /nfs/dbraw/zinc/43/68/09/598436809.db2.gz DLAJHUCODKXJSH-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1cccc(Oc2ccc(NC(=O)c3ccc(-c4nn[n-]n4)cn3)cc2)c1 ZINC000737410044 598436811 /nfs/dbraw/zinc/43/68/11/598436811.db2.gz DLAJHUCODKXJSH-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM C[C@@H]1C[C@@H](CC(=O)N(C)Cc2ccc(-c3nnn[n-]3)cc2)CC(C)(C)C1 ZINC000736227967 598442333 /nfs/dbraw/zinc/44/23/33/598442333.db2.gz MOLCXWHZMLAVOO-ZBFHGGJFSA-N -1 3 355.486 3.678 20 0 FHADHM C[C@@H]1C[C@@H](CC(=O)N(C)Cc2ccc(-c3nn[n-]n3)cc2)CC(C)(C)C1 ZINC000736227967 598442335 /nfs/dbraw/zinc/44/23/35/598442335.db2.gz MOLCXWHZMLAVOO-ZBFHGGJFSA-N -1 3 355.486 3.678 20 0 FHADHM O=C(Nc1ccc(SC2CCCC2)cc1)c1ccc(-c2nnn[n-]2)cn1 ZINC000738173105 598444241 /nfs/dbraw/zinc/44/42/41/598444241.db2.gz BTIXNGXONGZJJD-UHFFFAOYSA-N -1 3 366.450 3.549 20 0 FHADHM O=C(Nc1ccc(SC2CCCC2)cc1)c1ccc(-c2nn[n-]n2)cn1 ZINC000738173105 598444243 /nfs/dbraw/zinc/44/42/43/598444243.db2.gz BTIXNGXONGZJJD-UHFFFAOYSA-N -1 3 366.450 3.549 20 0 FHADHM C[C@H](c1ccccc1)N(C(=O)c1ccc(-c2nnn[n-]2)cn1)c1ccccc1 ZINC000736204056 598446553 /nfs/dbraw/zinc/44/65/53/598446553.db2.gz PPMICAHKRVKFQR-OAHLLOKOSA-N -1 3 370.416 3.670 20 0 FHADHM C[C@H](c1ccccc1)N(C(=O)c1ccc(-c2nn[n-]n2)cn1)c1ccccc1 ZINC000736204056 598446555 /nfs/dbraw/zinc/44/65/55/598446555.db2.gz PPMICAHKRVKFQR-OAHLLOKOSA-N -1 3 370.416 3.670 20 0 FHADHM CN(C(=O)[C@@H]1C[C@@H]1c1cccc2ccccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000736733219 598448222 /nfs/dbraw/zinc/44/82/22/598448222.db2.gz SVQZPMHYGFOQFR-WOJBJXKFSA-N -1 3 369.428 3.786 20 0 FHADHM CN(C(=O)[C@@H]1C[C@@H]1c1cccc2ccccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000736733219 598448224 /nfs/dbraw/zinc/44/82/24/598448224.db2.gz SVQZPMHYGFOQFR-WOJBJXKFSA-N -1 3 369.428 3.786 20 0 FHADHM CN(C(=O)[C@@H]1C[C@H]1c1cccc2ccccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000736733216 598448432 /nfs/dbraw/zinc/44/84/32/598448432.db2.gz SVQZPMHYGFOQFR-VQTJNVASSA-N -1 3 369.428 3.786 20 0 FHADHM CN(C(=O)[C@@H]1C[C@H]1c1cccc2ccccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000736733216 598448434 /nfs/dbraw/zinc/44/84/34/598448434.db2.gz SVQZPMHYGFOQFR-VQTJNVASSA-N -1 3 369.428 3.786 20 0 FHADHM Clc1ccc(C2(CNc3ncc(-c4nnn[n-]4)cc3Cl)CC2)cc1 ZINC000737570126 598459524 /nfs/dbraw/zinc/45/95/24/598459524.db2.gz BYJVVEBSTJOHNF-UHFFFAOYSA-N -1 3 361.236 3.712 20 0 FHADHM Clc1ccc(C2(CNc3ncc(-c4nn[n-]n4)cc3Cl)CC2)cc1 ZINC000737570126 598459526 /nfs/dbraw/zinc/45/95/26/598459526.db2.gz BYJVVEBSTJOHNF-UHFFFAOYSA-N -1 3 361.236 3.712 20 0 FHADHM O=C(Nc1cccc(SC(F)F)c1)Nc1cccc(-c2nnn[n-]2)c1 ZINC000738183675 598468987 /nfs/dbraw/zinc/46/89/87/598468987.db2.gz MAFMEVSCUFJICE-UHFFFAOYSA-N -1 3 362.365 3.825 20 0 FHADHM O=C(Nc1cccc(SC(F)F)c1)Nc1cccc(-c2nn[n-]n2)c1 ZINC000738183675 598468988 /nfs/dbraw/zinc/46/89/88/598468988.db2.gz MAFMEVSCUFJICE-UHFFFAOYSA-N -1 3 362.365 3.825 20 0 FHADHM CC(=CC(=O)OCc1ccc(-c2nnn[n-]2)cc1F)c1ccccc1Cl ZINC000735446596 598473710 /nfs/dbraw/zinc/47/37/10/598473710.db2.gz BJXZURWVEKARLO-FLIBITNWSA-N -1 3 372.787 3.806 20 0 FHADHM CC(=CC(=O)OCc1ccc(-c2nn[n-]n2)cc1F)c1ccccc1Cl ZINC000735446596 598473712 /nfs/dbraw/zinc/47/37/12/598473712.db2.gz BJXZURWVEKARLO-FLIBITNWSA-N -1 3 372.787 3.806 20 0 FHADHM CC[C@](C)(NC(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000736312906 598483616 /nfs/dbraw/zinc/48/36/16/598483616.db2.gz DEZRLCDMNULMIS-VLIAUNLRSA-N -1 3 364.453 3.552 20 0 FHADHM CC[C@](C)(NC(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000736312906 598483618 /nfs/dbraw/zinc/48/36/18/598483618.db2.gz DEZRLCDMNULMIS-VLIAUNLRSA-N -1 3 364.453 3.552 20 0 FHADHM Cc1ccc(OCCC(=O)O[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1C ZINC000737366979 598487379 /nfs/dbraw/zinc/48/73/79/598487379.db2.gz YIGNBAVEGNAZDI-OAHLLOKOSA-N -1 3 366.421 3.557 20 0 FHADHM Cc1ccc(OCCC(=O)O[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1C ZINC000737366979 598487380 /nfs/dbraw/zinc/48/73/80/598487380.db2.gz YIGNBAVEGNAZDI-OAHLLOKOSA-N -1 3 366.421 3.557 20 0 FHADHM C[C@@H](CC(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C)c1ccc(F)cc1 ZINC000735973651 598488078 /nfs/dbraw/zinc/48/80/78/598488078.db2.gz CFWXCNFZSSTGPN-LBPRGKRZSA-N -1 3 370.432 3.695 20 0 FHADHM C[C@@H](CC(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C)c1ccc(F)cc1 ZINC000735973651 598488079 /nfs/dbraw/zinc/48/80/79/598488079.db2.gz CFWXCNFZSSTGPN-LBPRGKRZSA-N -1 3 370.432 3.695 20 0 FHADHM CC(C)CN(C(=O)Cc1cccc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000735818185 598494763 /nfs/dbraw/zinc/49/47/63/598494763.db2.gz JMVAPVFALWYYJT-UHFFFAOYSA-N -1 3 369.856 3.752 20 0 FHADHM CC(C)CN(C(=O)Cc1cccc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000735818185 598494764 /nfs/dbraw/zinc/49/47/64/598494764.db2.gz JMVAPVFALWYYJT-UHFFFAOYSA-N -1 3 369.856 3.752 20 0 FHADHM CCN(C(=O)Cc1cccc(Cl)c1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736504453 598494804 /nfs/dbraw/zinc/49/48/04/598494804.db2.gz DKRHSMOPKDJZKP-ZDUSSCGKSA-N -1 3 369.856 3.672 20 0 FHADHM CCN(C(=O)Cc1cccc(Cl)c1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736504453 598494806 /nfs/dbraw/zinc/49/48/06/598494806.db2.gz DKRHSMOPKDJZKP-ZDUSSCGKSA-N -1 3 369.856 3.672 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccc3ncccc3c2)c1-c1nnn[n-]1 ZINC000736674584 598513958 /nfs/dbraw/zinc/51/39/58/598513958.db2.gz DORXEMUAROPRKO-UHFFFAOYSA-N -1 3 364.434 3.600 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccc3ncccc3c2)c1-c1nn[n-]n1 ZINC000736674584 598513960 /nfs/dbraw/zinc/51/39/60/598513960.db2.gz DORXEMUAROPRKO-UHFFFAOYSA-N -1 3 364.434 3.600 20 0 FHADHM O=C(C[C@H]1CCCc2ccccc21)OCc1cc(-c2nnn[n-]2)ccc1F ZINC000737823979 598515362 /nfs/dbraw/zinc/51/53/62/598515362.db2.gz SQFUESXENRGPRK-CQSZACIVSA-N -1 3 366.396 3.559 20 0 FHADHM O=C(C[C@H]1CCCc2ccccc21)OCc1cc(-c2nn[n-]n2)ccc1F ZINC000737823979 598515365 /nfs/dbraw/zinc/51/53/65/598515365.db2.gz SQFUESXENRGPRK-CQSZACIVSA-N -1 3 366.396 3.559 20 0 FHADHM CCc1c(C)sc(NC(=O)c2c(F)cccc2Cl)c1-c1nnn[n-]1 ZINC000736676430 598519355 /nfs/dbraw/zinc/51/93/55/598519355.db2.gz UYZWGJXJASDXRF-UHFFFAOYSA-N -1 3 365.821 3.844 20 0 FHADHM CCc1c(C)sc(NC(=O)c2c(F)cccc2Cl)c1-c1nn[n-]n1 ZINC000736676430 598519357 /nfs/dbraw/zinc/51/93/57/598519357.db2.gz UYZWGJXJASDXRF-UHFFFAOYSA-N -1 3 365.821 3.844 20 0 FHADHM CCCCOc1ccccc1NCCOc1ccc(-c2nn[n-]n2)cc1 ZINC000736462685 598522700 /nfs/dbraw/zinc/52/27/00/598522700.db2.gz GFWHVXZOAJRPNH-UHFFFAOYSA-N -1 3 353.426 3.537 20 0 FHADHM Fc1cccc(N[C@H]2CCc3c2cccc3Br)c1-c1nnn[n-]1 ZINC000737660000 598523518 /nfs/dbraw/zinc/52/35/18/598523518.db2.gz HJRSBZULHPWVCB-ZDUSSCGKSA-N -1 3 374.217 3.868 20 0 FHADHM Fc1cccc(N[C@H]2CCc3c2cccc3Br)c1-c1nn[n-]n1 ZINC000737660000 598523520 /nfs/dbraw/zinc/52/35/20/598523520.db2.gz HJRSBZULHPWVCB-ZDUSSCGKSA-N -1 3 374.217 3.868 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@H]1NC(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000735796714 598527760 /nfs/dbraw/zinc/52/77/60/598527760.db2.gz HDQMGDLQECDLBF-QILLFSRXSA-N -1 3 370.501 3.832 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@H]1NC(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000735796714 598527762 /nfs/dbraw/zinc/52/77/62/598527762.db2.gz HDQMGDLQECDLBF-QILLFSRXSA-N -1 3 370.501 3.832 20 0 FHADHM Cc1sc(NC(=O)c2cc(Cl)ccc2F)c(-c2nnn[n-]2)c1C ZINC000737560865 598535309 /nfs/dbraw/zinc/53/53/09/598535309.db2.gz DECYUKYKDGMPHW-UHFFFAOYSA-N -1 3 351.794 3.590 20 0 FHADHM Cc1sc(NC(=O)c2cc(Cl)ccc2F)c(-c2nn[n-]n2)c1C ZINC000737560865 598535311 /nfs/dbraw/zinc/53/53/11/598535311.db2.gz DECYUKYKDGMPHW-UHFFFAOYSA-N -1 3 351.794 3.590 20 0 FHADHM C[C@@H](NC(=S)Nc1ccccc1-c1nnn[n-]1)C(C)(C)c1ccccc1 ZINC000736126031 598537646 /nfs/dbraw/zinc/53/76/46/598537646.db2.gz LSFMLKUWBILHON-CYBMUJFWSA-N -1 3 366.494 3.519 20 0 FHADHM C[C@@H](NC(=S)Nc1ccccc1-c1nn[n-]n1)C(C)(C)c1ccccc1 ZINC000736126031 598537648 /nfs/dbraw/zinc/53/76/48/598537648.db2.gz LSFMLKUWBILHON-CYBMUJFWSA-N -1 3 366.494 3.519 20 0 FHADHM C[C@@H]1CCC[C@@H](CC(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(F)F)C1 ZINC000736247184 598543600 /nfs/dbraw/zinc/54/36/00/598543600.db2.gz AZHDAALLUXKNMO-GHMZBOCLSA-N -1 3 365.384 3.623 20 0 FHADHM C[C@@H]1CCC[C@@H](CC(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(F)F)C1 ZINC000736247184 598543601 /nfs/dbraw/zinc/54/36/01/598543601.db2.gz AZHDAALLUXKNMO-GHMZBOCLSA-N -1 3 365.384 3.623 20 0 FHADHM CC[C@H](C)c1ccc(NC(=O)COc2ccc(-c3nnn[n-]3)c(F)c2)cc1 ZINC000736327950 598547261 /nfs/dbraw/zinc/54/72/61/598547261.db2.gz MXINYGFAJVFFJY-LBPRGKRZSA-N -1 3 369.400 3.537 20 0 FHADHM CC[C@H](C)c1ccc(NC(=O)COc2ccc(-c3nn[n-]n3)c(F)c2)cc1 ZINC000736327950 598547262 /nfs/dbraw/zinc/54/72/62/598547262.db2.gz MXINYGFAJVFFJY-LBPRGKRZSA-N -1 3 369.400 3.537 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@@H](C)c1ccccc1F ZINC000735511284 598550911 /nfs/dbraw/zinc/55/09/11/598550911.db2.gz FVNPVVWVYXYGAB-AWEZNQCLSA-N -1 3 367.428 3.547 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@@H](C)c1ccccc1F ZINC000735511284 598550912 /nfs/dbraw/zinc/55/09/12/598550912.db2.gz FVNPVVWVYXYGAB-AWEZNQCLSA-N -1 3 367.428 3.547 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1Oc1nc(C(F)(F)F)nc2ccccc21 ZINC000737221248 598551261 /nfs/dbraw/zinc/55/12/61/598551261.db2.gz KHRZZNZPZIHZIC-UHFFFAOYSA-N -1 3 372.310 3.929 20 0 FHADHM CC[C@H](C)NC(=S)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736325476 598551546 /nfs/dbraw/zinc/55/15/46/598551546.db2.gz KBGCVLLMHIDMCK-LBPRGKRZSA-N -1 3 368.466 3.744 20 0 FHADHM CC[C@H](C)NC(=S)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736325476 598551547 /nfs/dbraw/zinc/55/15/47/598551547.db2.gz KBGCVLLMHIDMCK-LBPRGKRZSA-N -1 3 368.466 3.744 20 0 FHADHM FC(F)(F)c1ccccc1[C@H]1CCCN1c1ncccc1-c1nnn[n-]1 ZINC000737634704 598552079 /nfs/dbraw/zinc/55/20/79/598552079.db2.gz AQDOHFZKKAVXLH-CQSZACIVSA-N -1 3 360.343 3.622 20 0 FHADHM FC(F)(F)c1ccccc1[C@H]1CCCN1c1ncccc1-c1nn[n-]n1 ZINC000737634704 598552081 /nfs/dbraw/zinc/55/20/81/598552081.db2.gz AQDOHFZKKAVXLH-CQSZACIVSA-N -1 3 360.343 3.622 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1)c1ccccc1 ZINC000738171637 598555933 /nfs/dbraw/zinc/55/59/33/598555933.db2.gz ICGSLZPCJUEMIC-UHFFFAOYSA-N -1 3 357.373 3.911 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1)c1ccccc1 ZINC000738171637 598555935 /nfs/dbraw/zinc/55/59/35/598555935.db2.gz ICGSLZPCJUEMIC-UHFFFAOYSA-N -1 3 357.373 3.911 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1)C1CC1 ZINC000736115273 598562991 /nfs/dbraw/zinc/56/29/91/598562991.db2.gz GURUIFCQKRQKBH-GFCCVEGCSA-N -1 3 364.409 3.579 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1)C1CC1 ZINC000736115273 598562993 /nfs/dbraw/zinc/56/29/93/598562993.db2.gz GURUIFCQKRQKBH-GFCCVEGCSA-N -1 3 364.409 3.579 20 0 FHADHM CN(C(=O)CCCCCc1cccs1)c1cccc(-c2nnn[n-]2)c1 ZINC000736733557 598569805 /nfs/dbraw/zinc/56/98/05/598569805.db2.gz URTMGSAZPLQTFP-UHFFFAOYSA-N -1 3 355.467 3.694 20 0 FHADHM CN(C(=O)CCCCCc1cccs1)c1cccc(-c2nn[n-]n2)c1 ZINC000736733557 598569807 /nfs/dbraw/zinc/56/98/07/598569807.db2.gz URTMGSAZPLQTFP-UHFFFAOYSA-N -1 3 355.467 3.694 20 0 FHADHM FC(F)(F)c1cc(N[C@@H]2CCOc3ccccc32)ccc1-c1nnn[n-]1 ZINC000737633758 598572409 /nfs/dbraw/zinc/57/24/09/598572409.db2.gz VVFMQBOGPWWBRP-CQSZACIVSA-N -1 3 361.327 3.821 20 0 FHADHM FC(F)(F)c1cc(N[C@@H]2CCOc3ccccc32)ccc1-c1nn[n-]n1 ZINC000737633758 598572411 /nfs/dbraw/zinc/57/24/11/598572411.db2.gz VVFMQBOGPWWBRP-CQSZACIVSA-N -1 3 361.327 3.821 20 0 FHADHM COc1cc(CSc2nc(C)cc(C)c2-c2nnn[n-]2)ccc1SC ZINC000737046310 598585152 /nfs/dbraw/zinc/58/51/52/598585152.db2.gz AROXNHFTQLSULW-UHFFFAOYSA-N -1 3 373.507 3.901 20 0 FHADHM COc1cc(CSc2nc(C)cc(C)c2-c2nn[n-]n2)ccc1SC ZINC000737046310 598585154 /nfs/dbraw/zinc/58/51/54/598585154.db2.gz AROXNHFTQLSULW-UHFFFAOYSA-N -1 3 373.507 3.901 20 0 FHADHM Cc1cc(Oc2ccc(-c3nnn[n-]3)cc2)ccc1NC(=O)c1cc[nH]c1 ZINC000737280351 598589597 /nfs/dbraw/zinc/58/95/97/598589597.db2.gz QPEFZXSCQFVWGN-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM Cc1cc(Oc2ccc(-c3nn[n-]n3)cc2)ccc1NC(=O)c1cc[nH]c1 ZINC000737280351 598589598 /nfs/dbraw/zinc/58/95/98/598589598.db2.gz QPEFZXSCQFVWGN-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)c1cc(Cl)ccc1Cl ZINC000738168284 598592699 /nfs/dbraw/zinc/59/26/99/598592699.db2.gz YDBASRHBAXSKEN-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)c1cc(Cl)ccc1Cl ZINC000738168284 598592700 /nfs/dbraw/zinc/59/27/00/598592700.db2.gz YDBASRHBAXSKEN-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM c1ccc2c(c1)cccc2-c1noc(COc2ccc(-c3nn[n-]n3)cc2)n1 ZINC000738433740 598613245 /nfs/dbraw/zinc/61/32/45/598613245.db2.gz VAPFXJYVFVWDHA-UHFFFAOYSA-N -1 3 370.372 3.649 20 0 FHADHM c1ccc(-c2ccc(-c3noc(-c4ccc(-c5nnn[n-]5)cn4)n3)cc2)cc1 ZINC000738420871 598613359 /nfs/dbraw/zinc/61/33/59/598613359.db2.gz NMGZCFHSFJUUIA-UHFFFAOYSA-N -1 3 367.372 3.646 20 0 FHADHM c1ccc(-c2ccc(-c3noc(-c4ccc(-c5nn[n-]n5)cn4)n3)cc2)cc1 ZINC000738420871 598613361 /nfs/dbraw/zinc/61/33/61/598613361.db2.gz NMGZCFHSFJUUIA-UHFFFAOYSA-N -1 3 367.372 3.646 20 0 FHADHM Fc1ccc(N2CCC[C@@H]2c2nc3ccccc3s2)c(-c2nnn[n-]2)c1 ZINC000737660160 598629695 /nfs/dbraw/zinc/62/96/95/598629695.db2.gz NWRPGAOCCDZYRF-OAHLLOKOSA-N -1 3 366.425 3.957 20 0 FHADHM Fc1ccc(N2CCC[C@@H]2c2nc3ccccc3s2)c(-c2nn[n-]n2)c1 ZINC000737660160 598629696 /nfs/dbraw/zinc/62/96/96/598629696.db2.gz NWRPGAOCCDZYRF-OAHLLOKOSA-N -1 3 366.425 3.957 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)N1CCC(C2CCCCC2)CC1 ZINC000738160787 598629913 /nfs/dbraw/zinc/62/99/13/598629913.db2.gz BGDMCXIEZJULIE-UHFFFAOYSA-N -1 3 372.448 3.830 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)N1CCC(C2CCCCC2)CC1 ZINC000738160787 598629914 /nfs/dbraw/zinc/62/99/14/598629914.db2.gz BGDMCXIEZJULIE-UHFFFAOYSA-N -1 3 372.448 3.830 20 0 FHADHM CC(C)[C@@H](CNC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccccc1 ZINC000735711830 598631959 /nfs/dbraw/zinc/63/19/59/598631959.db2.gz YPLPIQZDBNOZQU-MRXNPFEDSA-N -1 3 368.416 3.567 20 0 FHADHM CC(C)[C@@H](CNC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccccc1 ZINC000735711830 598631960 /nfs/dbraw/zinc/63/19/60/598631960.db2.gz YPLPIQZDBNOZQU-MRXNPFEDSA-N -1 3 368.416 3.567 20 0 FHADHM O=C(CCCCOc1cccc(-c2nnn[n-]2)c1)Oc1cccc(Cl)c1 ZINC000737841599 598645505 /nfs/dbraw/zinc/64/55/05/598645505.db2.gz ONLMHXAOKFSCAM-UHFFFAOYSA-N -1 3 372.812 3.675 20 0 FHADHM O=C(CCCCOc1cccc(-c2nn[n-]n2)c1)Oc1cccc(Cl)c1 ZINC000737841599 598645507 /nfs/dbraw/zinc/64/55/07/598645507.db2.gz ONLMHXAOKFSCAM-UHFFFAOYSA-N -1 3 372.812 3.675 20 0 FHADHM Cc1cccc(OC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)c1C ZINC000737399848 598646611 /nfs/dbraw/zinc/64/66/11/598646611.db2.gz NDJSONNFUPUCFQ-UHFFFAOYSA-N -1 3 366.421 3.638 20 0 FHADHM Cc1cccc(OC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)c1C ZINC000737399848 598646613 /nfs/dbraw/zinc/64/66/13/598646613.db2.gz NDJSONNFUPUCFQ-UHFFFAOYSA-N -1 3 366.421 3.638 20 0 FHADHM Cc1cc(F)ccc1NC(=O)CCCCOc1cccc(-c2nnn[n-]2)c1 ZINC000737270118 598646662 /nfs/dbraw/zinc/64/66/62/598646662.db2.gz JBUXTBFFEFYLNQ-UHFFFAOYSA-N -1 3 369.400 3.502 20 0 FHADHM Cc1cc(F)ccc1NC(=O)CCCCOc1cccc(-c2nn[n-]n2)c1 ZINC000737270118 598646664 /nfs/dbraw/zinc/64/66/64/598646664.db2.gz JBUXTBFFEFYLNQ-UHFFFAOYSA-N -1 3 369.400 3.502 20 0 FHADHM C[C@H](CSc1ccccc1)C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000736047399 598647853 /nfs/dbraw/zinc/64/78/53/598647853.db2.gz PYCKIVLXNUGJED-LLVKDONJSA-N -1 3 373.869 3.887 20 0 FHADHM C[C@H](CSc1ccccc1)C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000736047399 598647854 /nfs/dbraw/zinc/64/78/54/598647854.db2.gz PYCKIVLXNUGJED-LLVKDONJSA-N -1 3 373.869 3.887 20 0 FHADHM CC[C@H](NC(=O)CSc1ccc(-c2nnn[n-]2)cc1)c1ccc(C)cc1 ZINC000736363109 598648258 /nfs/dbraw/zinc/64/82/58/598648258.db2.gz MLWQGJBBLRYGMJ-KRWDZBQOSA-N -1 3 367.478 3.535 20 0 FHADHM CC[C@H](NC(=O)CSc1ccc(-c2nn[n-]n2)cc1)c1ccc(C)cc1 ZINC000736363109 598648260 /nfs/dbraw/zinc/64/82/60/598648260.db2.gz MLWQGJBBLRYGMJ-KRWDZBQOSA-N -1 3 367.478 3.535 20 0 FHADHM O=C(CCCCOc1cccc(-c2nnn[n-]2)c1)NCCC1CCCCC1 ZINC000737831548 598651998 /nfs/dbraw/zinc/65/19/98/598651998.db2.gz ALWXIHZUANSPFS-UHFFFAOYSA-N -1 3 371.485 3.502 20 0 FHADHM O=C(CCCCOc1cccc(-c2nn[n-]n2)c1)NCCC1CCCCC1 ZINC000737831548 598651999 /nfs/dbraw/zinc/65/19/99/598651999.db2.gz ALWXIHZUANSPFS-UHFFFAOYSA-N -1 3 371.485 3.502 20 0 FHADHM CC[C@H]1CCCC[C@@H]1NC(=O)CCCCOc1cccc(-c2nnn[n-]2)c1 ZINC000736400209 598652635 /nfs/dbraw/zinc/65/26/35/598652635.db2.gz MZVUHOGOJRDNAE-YJBOKZPZSA-N -1 3 371.485 3.501 20 0 FHADHM CC[C@H]1CCCC[C@@H]1NC(=O)CCCCOc1cccc(-c2nn[n-]n2)c1 ZINC000736400209 598652638 /nfs/dbraw/zinc/65/26/38/598652638.db2.gz MZVUHOGOJRDNAE-YJBOKZPZSA-N -1 3 371.485 3.501 20 0 FHADHM CC1CCC(C)(NC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)CC1 ZINC000736237525 598655423 /nfs/dbraw/zinc/65/54/23/598655423.db2.gz QLIXJSORAKHTJZ-UHFFFAOYSA-N -1 3 371.485 3.501 20 0 FHADHM CC1CCC(C)(NC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)CC1 ZINC000736237525 598655425 /nfs/dbraw/zinc/65/54/25/598655425.db2.gz QLIXJSORAKHTJZ-UHFFFAOYSA-N -1 3 371.485 3.501 20 0 FHADHM O=C(CSc1ccc(-c2nnn[n-]2)cc1)N1CCC[C@@H]1C1CCCCC1 ZINC000737941931 598656078 /nfs/dbraw/zinc/65/60/78/598656078.db2.gz GUYVLFQAVJGRST-QGZVFWFLSA-N -1 3 371.510 3.530 20 0 FHADHM O=C(CSc1ccc(-c2nn[n-]n2)cc1)N1CCC[C@@H]1C1CCCCC1 ZINC000737941931 598656080 /nfs/dbraw/zinc/65/60/80/598656080.db2.gz GUYVLFQAVJGRST-QGZVFWFLSA-N -1 3 371.510 3.530 20 0 FHADHM CC(C)c1cccc(N(C)C(=O)CSc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000735928953 598656216 /nfs/dbraw/zinc/65/62/16/598656216.db2.gz SRLDYYKNTNZHNQ-UHFFFAOYSA-N -1 3 367.478 3.745 20 0 FHADHM CC(C)c1cccc(N(C)C(=O)CSc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735928953 598656218 /nfs/dbraw/zinc/65/62/18/598656218.db2.gz SRLDYYKNTNZHNQ-UHFFFAOYSA-N -1 3 367.478 3.745 20 0 FHADHM CC[C@H](Sc1ccccc1)C(=O)Nc1cc(-c2nnn[n-]2)ccc1C ZINC000736391191 598656427 /nfs/dbraw/zinc/65/64/27/598656427.db2.gz LEQOJXSXLHUAPU-INIZCTEOSA-N -1 3 353.451 3.685 20 0 FHADHM CC[C@H](Sc1ccccc1)C(=O)Nc1cc(-c2nn[n-]n2)ccc1C ZINC000736391191 598656428 /nfs/dbraw/zinc/65/64/28/598656428.db2.gz LEQOJXSXLHUAPU-INIZCTEOSA-N -1 3 353.451 3.685 20 0 FHADHM CC[C@@H](NC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)C(C)C ZINC000736362787 598656942 /nfs/dbraw/zinc/65/69/42/598656942.db2.gz JATWENZVKBWPLI-GOSISDBHSA-N -1 3 365.437 3.823 20 0 FHADHM CC[C@@H](NC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)C(C)C ZINC000736362787 598656944 /nfs/dbraw/zinc/65/69/44/598656944.db2.gz JATWENZVKBWPLI-GOSISDBHSA-N -1 3 365.437 3.823 20 0 FHADHM CC(C)(C)c1ccc(CCCC(=O)Nc2ccc(-c3nnn[n-]3)cn2)cc1 ZINC000735650546 598663732 /nfs/dbraw/zinc/66/37/32/598663732.db2.gz PTPHXOWQKIRBRP-UHFFFAOYSA-N -1 3 364.453 3.521 20 0 FHADHM CC(C)(C)c1ccc(CCCC(=O)Nc2ccc(-c3nn[n-]n3)cn2)cc1 ZINC000735650546 598663733 /nfs/dbraw/zinc/66/37/33/598663733.db2.gz PTPHXOWQKIRBRP-UHFFFAOYSA-N -1 3 364.453 3.521 20 0 FHADHM COc1ccc([C@@H]2CCN(c3ccc(-c4nnn[n-]4)c(Cl)c3)C2)cc1 ZINC000737077969 598668575 /nfs/dbraw/zinc/66/85/75/598668575.db2.gz XAEGJVHJRAWYQL-CYBMUJFWSA-N -1 3 355.829 3.523 20 0 FHADHM COc1ccc([C@@H]2CCN(c3ccc(-c4nn[n-]n4)c(Cl)c3)C2)cc1 ZINC000737077969 598668576 /nfs/dbraw/zinc/66/85/76/598668576.db2.gz XAEGJVHJRAWYQL-CYBMUJFWSA-N -1 3 355.829 3.523 20 0 FHADHM CC(C)C[C@H](C)Oc1cc(CNc2ccc(-c3nn[n-]n3)cc2)ccn1 ZINC000735761878 598674923 /nfs/dbraw/zinc/67/49/23/598674923.db2.gz QTRYFHZGIARNAH-AWEZNQCLSA-N -1 3 352.442 3.687 20 0 FHADHM Clc1ccc([C@@H]2CCN(c3ncc(-c4nnn[n-]4)cc3Cl)C2)cc1 ZINC000737571122 598680426 /nfs/dbraw/zinc/68/04/26/598680426.db2.gz SPSCMAVBYYATKT-LLVKDONJSA-N -1 3 361.236 3.562 20 0 FHADHM Clc1ccc([C@@H]2CCN(c3ncc(-c4nn[n-]n4)cc3Cl)C2)cc1 ZINC000737571122 598680429 /nfs/dbraw/zinc/68/04/29/598680429.db2.gz SPSCMAVBYYATKT-LLVKDONJSA-N -1 3 361.236 3.562 20 0 FHADHM COc1ccccc1-c1cccc(NC(=O)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737143411 598692845 /nfs/dbraw/zinc/69/28/45/598692845.db2.gz QNBBEPUBGCDPFL-UHFFFAOYSA-N -1 3 371.400 3.795 20 0 FHADHM COc1ccccc1-c1cccc(NC(=O)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737143411 598692846 /nfs/dbraw/zinc/69/28/46/598692846.db2.gz QNBBEPUBGCDPFL-UHFFFAOYSA-N -1 3 371.400 3.795 20 0 FHADHM O=C(Nc1ccccc1O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000738191702 598700155 /nfs/dbraw/zinc/70/01/55/598700155.db2.gz UUPGGXQXRXZLRZ-UHFFFAOYSA-N -1 3 373.372 3.617 20 0 FHADHM Cc1c2cccc(F)c2oc1C(=O)OCc1ccc(F)cc1-c1nnn[n-]1 ZINC000737209480 598704781 /nfs/dbraw/zinc/70/47/81/598704781.db2.gz QUVMCNGWZDWUEV-UHFFFAOYSA-N -1 3 370.315 3.557 20 0 FHADHM Cc1c2cccc(F)c2oc1C(=O)OCc1ccc(F)cc1-c1nn[n-]n1 ZINC000737209480 598704783 /nfs/dbraw/zinc/70/47/83/598704783.db2.gz QUVMCNGWZDWUEV-UHFFFAOYSA-N -1 3 370.315 3.557 20 0 FHADHM CC(C)[C@H](CC(=O)OCc1cc(-c2nnn[n-]2)ccc1F)c1ccccc1 ZINC000735709125 598712149 /nfs/dbraw/zinc/71/21/49/598712149.db2.gz PELGPQVWKCZJNB-KRWDZBQOSA-N -1 3 368.412 3.879 20 0 FHADHM CC(C)[C@H](CC(=O)OCc1cc(-c2nn[n-]n2)ccc1F)c1ccccc1 ZINC000735709125 598712151 /nfs/dbraw/zinc/71/21/51/598712151.db2.gz PELGPQVWKCZJNB-KRWDZBQOSA-N -1 3 368.412 3.879 20 0 FHADHM CC(C)[C@@H](CC(=O)OCc1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000735711163 598712278 /nfs/dbraw/zinc/71/22/78/598712278.db2.gz WHWSQMUBOYMFGU-GOSISDBHSA-N -1 3 350.422 3.740 20 0 FHADHM CC(C)[C@@H](CC(=O)OCc1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000735711163 598712279 /nfs/dbraw/zinc/71/22/79/598712279.db2.gz WHWSQMUBOYMFGU-GOSISDBHSA-N -1 3 350.422 3.740 20 0 FHADHM C[C@H](OC(=O)CSc1ccc(-c2nnn[n-]2)cc1)c1ccc(Cl)cc1 ZINC000736154683 598713160 /nfs/dbraw/zinc/71/31/60/598713160.db2.gz AADVIJBHVMWXAF-NSHDSACASA-N -1 3 374.853 3.917 20 0 FHADHM C[C@H](OC(=O)CSc1ccc(-c2nn[n-]n2)cc1)c1ccc(Cl)cc1 ZINC000736154683 598713162 /nfs/dbraw/zinc/71/31/62/598713162.db2.gz AADVIJBHVMWXAF-NSHDSACASA-N -1 3 374.853 3.917 20 0 FHADHM C[C@H](OC(=O)CSc1ccc(-c2nnn[n-]2)cc1)c1cccc(Cl)c1 ZINC000736155005 598713658 /nfs/dbraw/zinc/71/36/58/598713658.db2.gz FKFQXKBZYSVNNF-NSHDSACASA-N -1 3 374.853 3.917 20 0 FHADHM C[C@H](OC(=O)CSc1ccc(-c2nn[n-]n2)cc1)c1cccc(Cl)c1 ZINC000736155005 598713660 /nfs/dbraw/zinc/71/36/60/598713660.db2.gz FKFQXKBZYSVNNF-NSHDSACASA-N -1 3 374.853 3.917 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)N(CC1CC1)C1CCCCC1 ZINC000738164390 598731975 /nfs/dbraw/zinc/73/19/75/598731975.db2.gz YRPYXBXKUJFQII-UHFFFAOYSA-N -1 3 358.421 3.582 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)N(CC1CC1)C1CCCCC1 ZINC000738164390 598731976 /nfs/dbraw/zinc/73/19/76/598731976.db2.gz YRPYXBXKUJFQII-UHFFFAOYSA-N -1 3 358.421 3.582 20 0 FHADHM Cc1sc(NC(=O)Cc2c[nH]c3cccc(C)c23)c(-c2nnn[n-]2)c1C ZINC000737562606 598734991 /nfs/dbraw/zinc/73/49/91/598734991.db2.gz KMGWKLIXIBLSHX-UHFFFAOYSA-N -1 3 366.450 3.516 20 0 FHADHM Cc1sc(NC(=O)Cc2c[nH]c3cccc(C)c23)c(-c2nn[n-]n2)c1C ZINC000737562606 598734992 /nfs/dbraw/zinc/73/49/92/598734992.db2.gz KMGWKLIXIBLSHX-UHFFFAOYSA-N -1 3 366.450 3.516 20 0 FHADHM C[C@H](NC(=O)C(C)(C)c1ccccc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000736099210 598735648 /nfs/dbraw/zinc/73/56/48/598735648.db2.gz TXGINVNEOONHPX-LBPRGKRZSA-N -1 3 369.856 3.675 20 0 FHADHM C[C@H](NC(=O)C(C)(C)c1ccccc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000736099210 598735649 /nfs/dbraw/zinc/73/56/49/598735649.db2.gz TXGINVNEOONHPX-LBPRGKRZSA-N -1 3 369.856 3.675 20 0 FHADHM CCN(C(=O)CCc1ccccc1C)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736504160 598736384 /nfs/dbraw/zinc/73/63/84/598736384.db2.gz ARULJRDGFWLFSI-INIZCTEOSA-N -1 3 363.465 3.717 20 0 FHADHM CCN(C(=O)CCc1ccccc1C)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736504160 598736386 /nfs/dbraw/zinc/73/63/86/598736386.db2.gz ARULJRDGFWLFSI-INIZCTEOSA-N -1 3 363.465 3.717 20 0 FHADHM CC(C)Sc1ccc([C@@H](C)NC(=O)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000735921709 598743893 /nfs/dbraw/zinc/74/38/93/598743893.db2.gz ZGAVHSWXQQYJDO-CYBMUJFWSA-N -1 3 367.478 3.858 20 0 FHADHM CC(C)Sc1ccc([C@@H](C)NC(=O)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000735921709 598743894 /nfs/dbraw/zinc/74/38/94/598743894.db2.gz ZGAVHSWXQQYJDO-CYBMUJFWSA-N -1 3 367.478 3.858 20 0 FHADHM C[C@@H](O)c1ccc(CNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)cc1 ZINC000736151159 598745587 /nfs/dbraw/zinc/74/55/87/598745587.db2.gz LCMLVZGEOQZTPX-SNVBAGLBSA-N -1 3 363.343 3.551 20 0 FHADHM C[C@@H](O)c1ccc(CNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)cc1 ZINC000736151159 598745588 /nfs/dbraw/zinc/74/55/88/598745588.db2.gz LCMLVZGEOQZTPX-SNVBAGLBSA-N -1 3 363.343 3.551 20 0 FHADHM COCCSc1ccc([C@@H](C)Nc2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000737014569 598755704 /nfs/dbraw/zinc/75/57/04/598755704.db2.gz PGRPXNQJWUWXIN-GFCCVEGCSA-N -1 3 373.457 3.917 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1N[C@H](c1nccs1)c1ccccc1 ZINC000737559449 598757792 /nfs/dbraw/zinc/75/77/92/598757792.db2.gz YDZMOTVZUILDIM-ZDUSSCGKSA-N -1 3 369.841 3.573 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1N[C@H](c1nccs1)c1ccccc1 ZINC000737559449 598757794 /nfs/dbraw/zinc/75/77/94/598757794.db2.gz YDZMOTVZUILDIM-ZDUSSCGKSA-N -1 3 369.841 3.573 20 0 FHADHM Fc1cccc(N[C@@H](c2nccs2)c2ccccc2)c1-c1nnn[n-]1 ZINC000737659255 598758033 /nfs/dbraw/zinc/75/80/33/598758033.db2.gz BQKCYRPOHTUGEA-OAHLLOKOSA-N -1 3 352.398 3.664 20 0 FHADHM Fc1cccc(N[C@@H](c2nccs2)c2ccccc2)c1-c1nn[n-]n1 ZINC000737659255 598758034 /nfs/dbraw/zinc/75/80/34/598758034.db2.gz BQKCYRPOHTUGEA-OAHLLOKOSA-N -1 3 352.398 3.664 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@H](CC)Cc2ccccc2)s1 ZINC000736679321 598763272 /nfs/dbraw/zinc/76/32/72/598763272.db2.gz RJZGUHPBTSUVON-CYBMUJFWSA-N -1 3 355.467 3.698 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@H](CC)Cc2ccccc2)s1 ZINC000736679321 598763273 /nfs/dbraw/zinc/76/32/73/598763273.db2.gz RJZGUHPBTSUVON-CYBMUJFWSA-N -1 3 355.467 3.698 20 0 FHADHM Cc1ccccc1[C@H](C(C)C)N(C)C(=O)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000737416142 598764686 /nfs/dbraw/zinc/76/46/86/598764686.db2.gz XIUOUNWUOGGHRX-FQEVSTJZSA-N -1 3 363.465 3.573 20 0 FHADHM Cc1ccccc1[C@H](C(C)C)N(C)C(=O)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000737416142 598764687 /nfs/dbraw/zinc/76/46/87/598764687.db2.gz XIUOUNWUOGGHRX-FQEVSTJZSA-N -1 3 363.465 3.573 20 0 FHADHM Cc1ccccc1CNc1c(-c2nnn[n-]2)cnc2c(F)cc(F)cc21 ZINC000737428141 598770486 /nfs/dbraw/zinc/77/04/86/598770486.db2.gz KVSNGFUOGYBFBK-UHFFFAOYSA-N -1 3 352.348 3.614 20 0 FHADHM Cc1ccccc1CNc1c(-c2nn[n-]n2)cnc2c(F)cc(F)cc21 ZINC000737428141 598770488 /nfs/dbraw/zinc/77/04/88/598770488.db2.gz KVSNGFUOGYBFBK-UHFFFAOYSA-N -1 3 352.348 3.614 20 0 FHADHM Fc1ccc(CNc2c(-c3nnn[n-]3)cnc3c(F)cc(F)cc32)c(F)c1 ZINC000737647389 598772018 /nfs/dbraw/zinc/77/20/18/598772018.db2.gz DIZLEEVCELPRBU-UHFFFAOYSA-N -1 3 374.301 3.583 20 0 FHADHM Fc1ccc(CNc2c(-c3nn[n-]n3)cnc3c(F)cc(F)cc32)c(F)c1 ZINC000737647389 598772020 /nfs/dbraw/zinc/77/20/20/598772020.db2.gz DIZLEEVCELPRBU-UHFFFAOYSA-N -1 3 374.301 3.583 20 0 FHADHM Cc1cccc(CN(C)c2c(-c3nnn[n-]3)cnc3c(F)cc(F)cc32)c1 ZINC000737394812 598772096 /nfs/dbraw/zinc/77/20/96/598772096.db2.gz YBLIKDWIEGHBSR-UHFFFAOYSA-N -1 3 366.375 3.638 20 0 FHADHM Cc1cccc(CN(C)c2c(-c3nn[n-]n3)cnc3c(F)cc(F)cc32)c1 ZINC000737394812 598772098 /nfs/dbraw/zinc/77/20/98/598772098.db2.gz YBLIKDWIEGHBSR-UHFFFAOYSA-N -1 3 366.375 3.638 20 0 FHADHM CCN(C(=O)[C@@H]1CCc2ccccc21)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736503414 598790060 /nfs/dbraw/zinc/79/00/60/598790060.db2.gz WHZRGVMMKUCJQV-AUUYWEPGSA-N -1 3 361.449 3.506 20 0 FHADHM CCN(C(=O)[C@@H]1CCc2ccccc21)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736503414 598790062 /nfs/dbraw/zinc/79/00/62/598790062.db2.gz WHZRGVMMKUCJQV-AUUYWEPGSA-N -1 3 361.449 3.506 20 0 FHADHM CC(C)C(=O)Nc1ccc(CNc2ccc(Cl)cc2-c2nnn[n-]2)cc1 ZINC000735684746 598791234 /nfs/dbraw/zinc/79/12/34/598791234.db2.gz IRIUMOIQLFGWMT-UHFFFAOYSA-N -1 3 370.844 3.727 20 0 FHADHM CC(C)C(=O)Nc1ccc(CNc2ccc(Cl)cc2-c2nn[n-]n2)cc1 ZINC000735684746 598791235 /nfs/dbraw/zinc/79/12/35/598791235.db2.gz IRIUMOIQLFGWMT-UHFFFAOYSA-N -1 3 370.844 3.727 20 0 FHADHM CC(C)[C@@H](C)C(=O)Nc1sc2c(c1-c1nnn[n-]1)-c1ccccc1CC2 ZINC000735702581 598803643 /nfs/dbraw/zinc/80/36/43/598803643.db2.gz PMEVFOKAXBSXRG-LLVKDONJSA-N -1 3 367.478 3.924 20 0 FHADHM CC(C)[C@@H](C)C(=O)Nc1sc2c(c1-c1nn[n-]n1)-c1ccccc1CC2 ZINC000735702581 598803644 /nfs/dbraw/zinc/80/36/44/598803644.db2.gz PMEVFOKAXBSXRG-LLVKDONJSA-N -1 3 367.478 3.924 20 0 FHADHM CC(C)[C@H](C)C(=O)Nc1sc2c(c1-c1nnn[n-]1)-c1ccccc1CC2 ZINC000735702583 598803763 /nfs/dbraw/zinc/80/37/63/598803763.db2.gz PMEVFOKAXBSXRG-NSHDSACASA-N -1 3 367.478 3.924 20 0 FHADHM CC(C)[C@H](C)C(=O)Nc1sc2c(c1-c1nn[n-]n1)-c1ccccc1CC2 ZINC000735702583 598803764 /nfs/dbraw/zinc/80/37/64/598803764.db2.gz PMEVFOKAXBSXRG-NSHDSACASA-N -1 3 367.478 3.924 20 0 FHADHM COc1ccc2[nH]cc(CCNc3ccc(Cl)cc3-c3nnn[n-]3)c2c1 ZINC000737114750 598817628 /nfs/dbraw/zinc/81/76/28/598817628.db2.gz LNSQVTAYKNTIQQ-UHFFFAOYSA-N -1 3 368.828 3.665 20 0 FHADHM COc1ccc2[nH]cc(CCNc3ccc(Cl)cc3-c3nn[n-]n3)c2c1 ZINC000737114750 598817630 /nfs/dbraw/zinc/81/76/30/598817630.db2.gz LNSQVTAYKNTIQQ-UHFFFAOYSA-N -1 3 368.828 3.665 20 0 FHADHM CN(C(=O)CCCc1ccc(Cl)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736732640 599304448 /nfs/dbraw/zinc/30/44/48/599304448.db2.gz NAULTXOPDNPURN-UHFFFAOYSA-N -1 3 355.829 3.506 20 0 FHADHM CN(C(=O)CCCc1ccc(Cl)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736732640 599304451 /nfs/dbraw/zinc/30/44/51/599304451.db2.gz NAULTXOPDNPURN-UHFFFAOYSA-N -1 3 355.829 3.506 20 0 FHADHM Cc1ccc(NC(=S)Nc2ccc(OC(C)C)c(-c3nnn[n-]3)c2)cc1 ZINC000822254400 607368037 /nfs/dbraw/zinc/36/80/37/607368037.db2.gz ISXGKULRJLBOLW-UHFFFAOYSA-N -1 3 368.466 3.771 20 0 FHADHM Cc1ccc(NC(=S)Nc2ccc(OC(C)C)c(-c3nn[n-]n3)c2)cc1 ZINC000822254400 607368039 /nfs/dbraw/zinc/36/80/39/607368039.db2.gz ISXGKULRJLBOLW-UHFFFAOYSA-N -1 3 368.466 3.771 20 0 FHADHM C[C@H](N[C@@H](c1nccs1)c1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736131164 599311399 /nfs/dbraw/zinc/31/13/99/599311399.db2.gz JNMOOIPNWRTCEE-SUMWQHHRSA-N -1 3 362.462 3.763 20 0 FHADHM C[C@H](N[C@@H](c1nccs1)c1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736131164 599311400 /nfs/dbraw/zinc/31/14/00/599311400.db2.gz JNMOOIPNWRTCEE-SUMWQHHRSA-N -1 3 362.462 3.763 20 0 FHADHM C[C@@H](S[C@@H](C)C(=O)N(C)c1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736189696 599325504 /nfs/dbraw/zinc/32/55/04/599325504.db2.gz QKOCAUALMLLTPX-KGLIPLIRSA-N -1 3 367.478 3.712 20 0 FHADHM C[C@@H](S[C@@H](C)C(=O)N(C)c1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736189696 599325507 /nfs/dbraw/zinc/32/55/07/599325507.db2.gz QKOCAUALMLLTPX-KGLIPLIRSA-N -1 3 367.478 3.712 20 0 FHADHM COc1cc2nc(C)sc2cc1N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000737056028 599326694 /nfs/dbraw/zinc/32/66/94/599326694.db2.gz SSGPFJRNKPCUIJ-SNVBAGLBSA-N -1 3 366.450 3.967 20 0 FHADHM COc1cc2nc(C)sc2cc1N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000737056028 599326696 /nfs/dbraw/zinc/32/66/96/599326696.db2.gz SSGPFJRNKPCUIJ-SNVBAGLBSA-N -1 3 366.450 3.967 20 0 FHADHM COc1ccc(COCCS[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000737097021 599326711 /nfs/dbraw/zinc/32/67/11/599326711.db2.gz HCHRYKXUQXDHQW-AWEZNQCLSA-N -1 3 370.478 3.886 20 0 FHADHM COc1ccc(COCCS[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000737097021 599326713 /nfs/dbraw/zinc/32/67/13/599326713.db2.gz HCHRYKXUQXDHQW-AWEZNQCLSA-N -1 3 370.478 3.886 20 0 FHADHM Fc1ccc(NCc2csc(-c3ccsc3)n2)cc1-c1nnn[n-]1 ZINC000737657569 599331577 /nfs/dbraw/zinc/33/15/77/599331577.db2.gz XGCKNADGKSRCES-UHFFFAOYSA-N -1 3 358.427 3.803 20 0 FHADHM Fc1ccc(NCc2csc(-c3ccsc3)n2)cc1-c1nn[n-]n1 ZINC000737657569 599331579 /nfs/dbraw/zinc/33/15/79/599331579.db2.gz XGCKNADGKSRCES-UHFFFAOYSA-N -1 3 358.427 3.803 20 0 FHADHM C[C@H](SCC(=O)Nc1ccccc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000736189336 599332802 /nfs/dbraw/zinc/33/28/02/599332802.db2.gz PAEKJBCXUKWSGL-NSHDSACASA-N -1 3 373.869 3.953 20 0 FHADHM C[C@H](SCC(=O)Nc1ccccc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000736189336 599332805 /nfs/dbraw/zinc/33/28/05/599332805.db2.gz PAEKJBCXUKWSGL-NSHDSACASA-N -1 3 373.869 3.953 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1CNc1cccc(Cl)c1Cl ZINC000821737557 607369862 /nfs/dbraw/zinc/36/98/62/607369862.db2.gz XSRXFVGAXKXUBG-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CNc1cccc(Cl)c1Cl ZINC000821737557 607369865 /nfs/dbraw/zinc/36/98/65/607369865.db2.gz XSRXFVGAXKXUBG-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM CC(C)[C@H](Sc1ccccc1-c1nnn[n-]1)C(=O)N(C)c1ccccc1 ZINC000820031903 599342030 /nfs/dbraw/zinc/34/20/30/599342030.db2.gz JRRQILZZTNDRMU-KRWDZBQOSA-N -1 3 367.478 3.646 20 0 FHADHM CC(C)[C@H](Sc1ccccc1-c1nn[n-]n1)C(=O)N(C)c1ccccc1 ZINC000820031903 599342032 /nfs/dbraw/zinc/34/20/32/599342032.db2.gz JRRQILZZTNDRMU-KRWDZBQOSA-N -1 3 367.478 3.646 20 0 FHADHM CC(C)[C@H](Sc1ccccc1-c1nnn[n-]1)C(=O)N(C)C1CCCCC1 ZINC000820031662 599346210 /nfs/dbraw/zinc/34/62/10/599346210.db2.gz GZTCQTDBWVFDPC-KRWDZBQOSA-N -1 3 373.526 3.775 20 0 FHADHM CC(C)[C@H](Sc1ccccc1-c1nn[n-]n1)C(=O)N(C)C1CCCCC1 ZINC000820031662 599346212 /nfs/dbraw/zinc/34/62/12/599346212.db2.gz GZTCQTDBWVFDPC-KRWDZBQOSA-N -1 3 373.526 3.775 20 0 FHADHM CCc1cc2c(ncnc2N[C@H](C)c2cccc(-c3nnn[n-]3)c2)s1 ZINC000821476911 599351879 /nfs/dbraw/zinc/35/18/79/599351879.db2.gz UQSYWFBGSNZCIZ-SNVBAGLBSA-N -1 3 351.439 3.607 20 0 FHADHM CCc1cc2c(ncnc2N[C@H](C)c2cccc(-c3nn[n-]n3)c2)s1 ZINC000821476911 599351882 /nfs/dbraw/zinc/35/18/82/599351882.db2.gz UQSYWFBGSNZCIZ-SNVBAGLBSA-N -1 3 351.439 3.607 20 0 FHADHM Cc1sc2ncnc(N[C@H](C)c3cccc(-c4nnn[n-]4)c3)c2c1C ZINC000822563048 599353001 /nfs/dbraw/zinc/35/30/01/599353001.db2.gz DRAJPADIWIJUTE-SNVBAGLBSA-N -1 3 351.439 3.661 20 0 FHADHM Cc1sc2ncnc(N[C@H](C)c3cccc(-c4nn[n-]n4)c3)c2c1C ZINC000822563048 599353004 /nfs/dbraw/zinc/35/30/04/599353004.db2.gz DRAJPADIWIJUTE-SNVBAGLBSA-N -1 3 351.439 3.661 20 0 FHADHM CC(C)c1ccc(OCc2nnc(-c3cccc(-c4nnn[n-]4)c3)o2)cc1 ZINC000820192443 599381192 /nfs/dbraw/zinc/38/11/92/599381192.db2.gz OCXKJTBRLFJXPD-UHFFFAOYSA-N -1 3 362.393 3.619 20 0 FHADHM CC(C)c1ccc(OCc2nnc(-c3cccc(-c4nn[n-]n4)c3)o2)cc1 ZINC000820192443 599381193 /nfs/dbraw/zinc/38/11/93/599381193.db2.gz OCXKJTBRLFJXPD-UHFFFAOYSA-N -1 3 362.393 3.619 20 0 FHADHM C[C@H](NCc1csc(-c2cccs2)n1)c1cccc(-c2nn[n-]n2)c1 ZINC000820437837 599393127 /nfs/dbraw/zinc/39/31/27/599393127.db2.gz DLPIIAMKCSCMTA-NSHDSACASA-N -1 3 368.491 3.903 20 0 FHADHM COc1ccc([C@@H]2CCCN2c2cc(-c3nnn[n-]3)c3ccccc3n2)cc1 ZINC000737075505 599397441 /nfs/dbraw/zinc/39/74/41/599397441.db2.gz KPDLIALIESODSM-IBGZPJMESA-N -1 3 372.432 3.765 20 0 FHADHM COc1ccc([C@@H]2CCCN2c2cc(-c3nn[n-]n3)c3ccccc3n2)cc1 ZINC000737075505 599397446 /nfs/dbraw/zinc/39/74/46/599397446.db2.gz KPDLIALIESODSM-IBGZPJMESA-N -1 3 372.432 3.765 20 0 FHADHM C[C@@H](NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(Cl)cc1 ZINC000820353386 599398469 /nfs/dbraw/zinc/39/84/69/599398469.db2.gz ZPVBKQDGQVPKAG-NEPJUHHUSA-N -1 3 370.844 3.642 20 0 FHADHM C[C@@H](NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(Cl)cc1 ZINC000820353386 599398472 /nfs/dbraw/zinc/39/84/72/599398472.db2.gz ZPVBKQDGQVPKAG-NEPJUHHUSA-N -1 3 370.844 3.642 20 0 FHADHM CCc1ccc([C@H](C)NC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000821483078 599399538 /nfs/dbraw/zinc/39/95/38/599399538.db2.gz WZYNFJJXXMATNS-KBPBESRZSA-N -1 3 364.453 3.551 20 0 FHADHM CCc1ccc([C@H](C)NC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000821483078 599399540 /nfs/dbraw/zinc/39/95/40/599399540.db2.gz WZYNFJJXXMATNS-KBPBESRZSA-N -1 3 364.453 3.551 20 0 FHADHM c1ccc(C2CCN(c3cc(-c4nnn[n-]4)c4ccccc4n3)CC2)cc1 ZINC000738427524 599402636 /nfs/dbraw/zinc/40/26/36/599402636.db2.gz IRWGVDLDONNQCF-UHFFFAOYSA-N -1 3 356.433 3.799 20 0 FHADHM c1ccc(C2CCN(c3cc(-c4nn[n-]n4)c4ccccc4n3)CC2)cc1 ZINC000738427524 599402639 /nfs/dbraw/zinc/40/26/39/599402639.db2.gz IRWGVDLDONNQCF-UHFFFAOYSA-N -1 3 356.433 3.799 20 0 FHADHM CCCc1nc(CNc2ccc(OC(C)C)c(-c3nnn[n-]3)c2)cs1 ZINC000821142566 607374418 /nfs/dbraw/zinc/37/44/18/607374418.db2.gz KAKBWLJUXSAFNO-UHFFFAOYSA-N -1 3 358.471 3.675 20 0 FHADHM CCCc1nc(CNc2ccc(OC(C)C)c(-c3nn[n-]n3)c2)cs1 ZINC000821142566 607374420 /nfs/dbraw/zinc/37/44/20/607374420.db2.gz KAKBWLJUXSAFNO-UHFFFAOYSA-N -1 3 358.471 3.675 20 0 FHADHM CC(C)Oc1ccccc1CNc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000735914865 599413987 /nfs/dbraw/zinc/41/39/87/599413987.db2.gz VTJQDVHSDDLJSK-UHFFFAOYSA-N -1 3 360.421 3.814 20 0 FHADHM CC(C)Oc1ccccc1CNc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000735914865 599413989 /nfs/dbraw/zinc/41/39/89/599413989.db2.gz VTJQDVHSDDLJSK-UHFFFAOYSA-N -1 3 360.421 3.814 20 0 FHADHM Cc1ccc([C@@H](C)NC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c(C)c1 ZINC000822229422 599418098 /nfs/dbraw/zinc/41/80/98/599418098.db2.gz UPAISJDMSPCKOP-HUUCEWRRSA-N -1 3 364.453 3.605 20 0 FHADHM Cc1ccc([C@@H](C)NC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c(C)c1 ZINC000822229422 599418100 /nfs/dbraw/zinc/41/81/00/599418100.db2.gz UPAISJDMSPCKOP-HUUCEWRRSA-N -1 3 364.453 3.605 20 0 FHADHM c1ccc2c(c1)nc(NCc1cccc3cccnc31)cc2-c1nnn[n-]1 ZINC000738445083 599422080 /nfs/dbraw/zinc/42/20/80/599422080.db2.gz DAJDTRRSDARNOZ-UHFFFAOYSA-N -1 3 353.389 3.575 20 0 FHADHM c1ccc2c(c1)nc(NCc1cccc3cccnc31)cc2-c1nn[n-]n1 ZINC000738445083 599422083 /nfs/dbraw/zinc/42/20/83/599422083.db2.gz DAJDTRRSDARNOZ-UHFFFAOYSA-N -1 3 353.389 3.575 20 0 FHADHM C[C@H](NC(=O)NCC1CCCCCCC1)c1cccc(-c2nnn[n-]2)c1 ZINC000820360134 599422234 /nfs/dbraw/zinc/42/22/34/599422234.db2.gz XDBFNTXOFLPTAD-AWEZNQCLSA-N -1 3 356.474 3.587 20 0 FHADHM C[C@H](NC(=O)NCC1CCCCCCC1)c1cccc(-c2nn[n-]n2)c1 ZINC000820360134 599422238 /nfs/dbraw/zinc/42/22/38/599422238.db2.gz XDBFNTXOFLPTAD-AWEZNQCLSA-N -1 3 356.474 3.587 20 0 FHADHM CC[C@H](NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)C1CCCCC1 ZINC000820919769 599431419 /nfs/dbraw/zinc/43/14/19/599431419.db2.gz GLPJEOWXBKFSQQ-DYVFJYSZSA-N -1 3 356.474 3.586 20 0 FHADHM CC[C@H](NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)C1CCCCC1 ZINC000820919769 599431421 /nfs/dbraw/zinc/43/14/21/599431421.db2.gz GLPJEOWXBKFSQQ-DYVFJYSZSA-N -1 3 356.474 3.586 20 0 FHADHM CC(C)(CNc1cc(-c2nnn[n-]2)c2ccccc2n1)c1cccs1 ZINC000735671564 599437937 /nfs/dbraw/zinc/43/79/37/599437937.db2.gz ZPOQNCZDWGDBKO-UHFFFAOYSA-N -1 3 350.451 3.866 20 0 FHADHM CC(C)(CNc1cc(-c2nn[n-]n2)c2ccccc2n1)c1cccs1 ZINC000735671564 599437940 /nfs/dbraw/zinc/43/79/40/599437940.db2.gz ZPOQNCZDWGDBKO-UHFFFAOYSA-N -1 3 350.451 3.866 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(N[C@H]2CCCN(c3ccccc3)C2)c1 ZINC000737570711 599439860 /nfs/dbraw/zinc/43/98/60/599439860.db2.gz LJFWRNDGPGWZOQ-AWEZNQCLSA-N -1 3 354.845 3.601 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(N[C@H]2CCCN(c3ccccc3)C2)c1 ZINC000737570711 599439863 /nfs/dbraw/zinc/43/98/63/599439863.db2.gz LJFWRNDGPGWZOQ-AWEZNQCLSA-N -1 3 354.845 3.601 20 0 FHADHM Cc1ccc2sc(C=Cc3cnc4ccc(-c5nnn[n-]5)cn34)nc2c1 ZINC000737378444 599460745 /nfs/dbraw/zinc/46/07/45/599460745.db2.gz BSGHICUFKBHQEN-QPJJXVBHSA-N -1 3 359.418 3.603 20 0 FHADHM Cc1ccc2sc(C=Cc3cnc4ccc(-c5nn[n-]n5)cn34)nc2c1 ZINC000737378444 599460748 /nfs/dbraw/zinc/46/07/48/599460748.db2.gz BSGHICUFKBHQEN-QPJJXVBHSA-N -1 3 359.418 3.603 20 0 FHADHM C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000736234393 599471987 /nfs/dbraw/zinc/47/19/87/599471987.db2.gz IVEVVFSGAVOIEV-ZWNOBZJWSA-N -1 3 359.355 3.666 20 0 FHADHM C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000736234393 599471989 /nfs/dbraw/zinc/47/19/89/599471989.db2.gz IVEVVFSGAVOIEV-ZWNOBZJWSA-N -1 3 359.355 3.666 20 0 FHADHM C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1c1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000736238729 599474206 /nfs/dbraw/zinc/47/42/06/599474206.db2.gz ZSPHGNHRUOGTES-UKRRQHHQSA-N -1 3 374.423 3.936 20 0 FHADHM C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1c1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000736238729 599474208 /nfs/dbraw/zinc/47/42/08/599474208.db2.gz ZSPHGNHRUOGTES-UKRRQHHQSA-N -1 3 374.423 3.936 20 0 FHADHM Cc1ccccc1[C@H](C)N(C)C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000822345456 599479318 /nfs/dbraw/zinc/47/93/18/599479318.db2.gz JQEMGKMUXAHNEC-GJZGRUSLSA-N -1 3 364.453 3.639 20 0 FHADHM Cc1ccccc1[C@H](C)N(C)C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000822345456 599479320 /nfs/dbraw/zinc/47/93/20/599479320.db2.gz JQEMGKMUXAHNEC-GJZGRUSLSA-N -1 3 364.453 3.639 20 0 FHADHM C[C@H](NC(=O)N1CCC[C@@H]1C1CCCCC1)c1cccc(-c2nnn[n-]2)c1 ZINC000820352293 599485944 /nfs/dbraw/zinc/48/59/44/599485944.db2.gz TUJYAOMQXKKCQE-KBXCAEBGSA-N -1 3 368.485 3.682 20 0 FHADHM C[C@H](NC(=O)N1CCC[C@@H]1C1CCCCC1)c1cccc(-c2nn[n-]n2)c1 ZINC000820352293 599485946 /nfs/dbraw/zinc/48/59/46/599485946.db2.gz TUJYAOMQXKKCQE-KBXCAEBGSA-N -1 3 368.485 3.682 20 0 FHADHM Cc1occc1CN(C)c1c(-c2nnn[n-]2)cnc2ccc(Cl)cc21 ZINC000822552978 599493308 /nfs/dbraw/zinc/49/33/08/599493308.db2.gz GVVVQKIXUOGZCA-UHFFFAOYSA-N -1 3 354.801 3.606 20 0 FHADHM Cc1occc1CN(C)c1c(-c2nn[n-]n2)cnc2ccc(Cl)cc21 ZINC000822552978 599493311 /nfs/dbraw/zinc/49/33/11/599493311.db2.gz GVVVQKIXUOGZCA-UHFFFAOYSA-N -1 3 354.801 3.606 20 0 FHADHM CCC(CC)(C(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000820882512 599494390 /nfs/dbraw/zinc/49/43/90/599494390.db2.gz SCYCTBZGMXVNTA-UHFFFAOYSA-N -1 3 363.465 3.583 20 0 FHADHM CCC(CC)(C(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000820882512 599494391 /nfs/dbraw/zinc/49/43/91/599494391.db2.gz SCYCTBZGMXVNTA-UHFFFAOYSA-N -1 3 363.465 3.583 20 0 FHADHM Fc1ccc(NCc2nc3cc(Cl)ccc3s2)c(-c2nnn[n-]2)c1 ZINC000822782705 599497161 /nfs/dbraw/zinc/49/71/61/599497161.db2.gz BUJYYZCTTGOKRY-UHFFFAOYSA-N -1 3 360.805 3.881 20 0 FHADHM Fc1ccc(NCc2nc3cc(Cl)ccc3s2)c(-c2nn[n-]n2)c1 ZINC000822782705 599497164 /nfs/dbraw/zinc/49/71/64/599497164.db2.gz BUJYYZCTTGOKRY-UHFFFAOYSA-N -1 3 360.805 3.881 20 0 FHADHM CC(C)(C(=O)OCc1ccc(-c2nnn[n-]2)cc1F)c1cccc(Cl)c1 ZINC000735582293 599497927 /nfs/dbraw/zinc/49/79/27/599497927.db2.gz KEMFASAFZYQJAA-UHFFFAOYSA-N -1 3 374.803 3.680 20 0 FHADHM CC(C)(C(=O)OCc1ccc(-c2nn[n-]n2)cc1F)c1cccc(Cl)c1 ZINC000735582293 599497930 /nfs/dbraw/zinc/49/79/30/599497930.db2.gz KEMFASAFZYQJAA-UHFFFAOYSA-N -1 3 374.803 3.680 20 0 FHADHM C[C@@H](NC(=O)c1csc2c1CC[C@H](C)C2)c1cccc(-c2nnn[n-]2)c1 ZINC000820727092 599506897 /nfs/dbraw/zinc/50/68/97/599506897.db2.gz GMVMIZAXLOWDJE-NWDGAFQWSA-N -1 3 367.478 3.544 20 0 FHADHM C[C@@H](NC(=O)c1csc2c1CC[C@H](C)C2)c1cccc(-c2nn[n-]n2)c1 ZINC000820727092 599506898 /nfs/dbraw/zinc/50/68/98/599506898.db2.gz GMVMIZAXLOWDJE-NWDGAFQWSA-N -1 3 367.478 3.544 20 0 FHADHM Cc1ccc(C)n1C1CCN(c2c(-c3nnn[n-]3)cnc3ccccc32)CC1 ZINC000822232271 599508183 /nfs/dbraw/zinc/50/81/83/599508183.db2.gz ZHSARDADQJEWJS-UHFFFAOYSA-N -1 3 373.464 3.675 20 0 FHADHM Cc1ccc(C)n1C1CCN(c2c(-c3nn[n-]n3)cnc3ccccc32)CC1 ZINC000822232271 599508186 /nfs/dbraw/zinc/50/81/86/599508186.db2.gz ZHSARDADQJEWJS-UHFFFAOYSA-N -1 3 373.464 3.675 20 0 FHADHM C[C@@H](Cc1ccsc1)Nc1ccc(-c2nn[n-]n2)cc1C(F)(F)F ZINC000736066305 599520298 /nfs/dbraw/zinc/52/02/98/599520298.db2.gz NDMSSGCYLLDWEM-VIFPVBQESA-N -1 3 353.373 3.990 20 0 FHADHM COc1ccc(C)cc1CNc1ccc(-c2nn[n-]n2)cc1C(F)(F)F ZINC000737076511 599521247 /nfs/dbraw/zinc/52/12/47/599521247.db2.gz IWZGEXCOSXHKCC-UHFFFAOYSA-N -1 3 363.343 3.815 20 0 FHADHM Cc1cccc2c1CCN(c1ccc(-c3nn[n-]n3)cc1C(F)(F)F)C2 ZINC000737408611 599524944 /nfs/dbraw/zinc/52/49/44/599524944.db2.gz KJNXLGIFULAMFB-UHFFFAOYSA-N -1 3 359.355 3.757 20 0 FHADHM FC(F)(F)c1cc(-c2nn[n-]n2)ccc1N[C@@H]1CCN(c2ccccc2)C1 ZINC000737628576 599525245 /nfs/dbraw/zinc/52/52/45/599525245.db2.gz XQEFBWIOXCSOJP-CYBMUJFWSA-N -1 3 374.370 3.576 20 0 FHADHM CC(C)C[C@H](C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000820051789 599527818 /nfs/dbraw/zinc/52/78/18/599527818.db2.gz WNEVSLJLGWPKGB-BEFAXECRSA-N -1 3 363.465 3.874 20 0 FHADHM CC(C)C[C@H](C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000820051789 599527821 /nfs/dbraw/zinc/52/78/21/599527821.db2.gz WNEVSLJLGWPKGB-BEFAXECRSA-N -1 3 363.465 3.874 20 0 FHADHM CC[C@@H](Nc1c(F)cc(-c2nnn[n-]2)cc1F)c1ccc(F)cc1F ZINC000736371899 599528205 /nfs/dbraw/zinc/52/82/05/599528205.db2.gz ZNCWMRBPJDDKEE-CQSZACIVSA-N -1 3 351.307 3.986 20 0 FHADHM CC[C@@H](Nc1c(F)cc(-c2nn[n-]n2)cc1F)c1ccc(F)cc1F ZINC000736371899 599528206 /nfs/dbraw/zinc/52/82/06/599528206.db2.gz ZNCWMRBPJDDKEE-CQSZACIVSA-N -1 3 351.307 3.986 20 0 FHADHM CC[C@@H](Nc1ncc(-c2nnn[n-]2)cc1Cl)c1ccc(F)cc1F ZINC000736368933 599528399 /nfs/dbraw/zinc/52/83/99/599528399.db2.gz IRSGZXFMXGMRHT-CYBMUJFWSA-N -1 3 350.760 3.757 20 0 FHADHM CC[C@@H](Nc1ncc(-c2nn[n-]n2)cc1Cl)c1ccc(F)cc1F ZINC000736368933 599528400 /nfs/dbraw/zinc/52/84/00/599528400.db2.gz IRSGZXFMXGMRHT-CYBMUJFWSA-N -1 3 350.760 3.757 20 0 FHADHM Cc1ccc(C[C@@H](C)Nc2cc(-c3nnn[n-]3)c3ccccc3n2)s1 ZINC000737335131 599529097 /nfs/dbraw/zinc/52/90/97/599529097.db2.gz QIJRETPXEZTZCN-LLVKDONJSA-N -1 3 350.451 3.828 20 0 FHADHM Cc1ccc(C[C@@H](C)Nc2cc(-c3nn[n-]n3)c3ccccc3n2)s1 ZINC000737335131 599529101 /nfs/dbraw/zinc/52/91/01/599529101.db2.gz QIJRETPXEZTZCN-LLVKDONJSA-N -1 3 350.451 3.828 20 0 FHADHM Cc1ccccc1[C@H]1C[C@H](C)N(c2ncc(-c3nnn[n-]3)cc2Cl)C1 ZINC000737420227 599529197 /nfs/dbraw/zinc/52/91/97/599529197.db2.gz DLGCFQUUPFKDEC-JSGCOSHPSA-N -1 3 354.845 3.606 20 0 FHADHM Cc1ccccc1[C@H]1C[C@H](C)N(c2ncc(-c3nn[n-]n3)cc2Cl)C1 ZINC000737420227 599529200 /nfs/dbraw/zinc/52/92/00/599529200.db2.gz DLGCFQUUPFKDEC-JSGCOSHPSA-N -1 3 354.845 3.606 20 0 FHADHM Cc1c2cc(F)ccc2oc1C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000822020467 599529781 /nfs/dbraw/zinc/52/97/81/599529781.db2.gz CXGPERRBOJQUQW-LLVKDONJSA-N -1 3 365.368 3.551 20 0 FHADHM Cc1c2cc(F)ccc2oc1C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000822020467 599529783 /nfs/dbraw/zinc/52/97/83/599529783.db2.gz CXGPERRBOJQUQW-LLVKDONJSA-N -1 3 365.368 3.551 20 0 FHADHM COc1ccccc1[C@@H]1CCN(c2ccc(-c3nnn[n-]3)c(Cl)c2)C1 ZINC000737149546 599536905 /nfs/dbraw/zinc/53/69/05/599536905.db2.gz XGRSEIPDVOMEEI-GFCCVEGCSA-N -1 3 355.829 3.523 20 0 FHADHM COc1ccccc1[C@@H]1CCN(c2ccc(-c3nn[n-]n3)c(Cl)c2)C1 ZINC000737149546 599536909 /nfs/dbraw/zinc/53/69/09/599536909.db2.gz XGRSEIPDVOMEEI-GFCCVEGCSA-N -1 3 355.829 3.523 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCC2)c1ccsc1 ZINC000735571180 599539209 /nfs/dbraw/zinc/53/92/09/599539209.db2.gz UFMLAUOTYSSUMB-VIFPVBQESA-N -1 3 359.480 3.611 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCC2)c1ccsc1 ZINC000735571180 599539212 /nfs/dbraw/zinc/53/92/12/599539212.db2.gz UFMLAUOTYSSUMB-VIFPVBQESA-N -1 3 359.480 3.611 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)ccc1OC(=O)CC/C=C/c1ccccc1 ZINC000736625569 599539495 /nfs/dbraw/zinc/53/94/95/599539495.db2.gz CDSBWHYZYJHZHH-UXBLZVDNSA-N -1 3 364.405 3.664 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)ccc1OC(=O)CC/C=C/c1ccccc1 ZINC000736625569 599539497 /nfs/dbraw/zinc/53/94/97/599539497.db2.gz CDSBWHYZYJHZHH-UXBLZVDNSA-N -1 3 364.405 3.664 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CC[C@@H](C)C2)c1ccsc1 ZINC000736282013 599539552 /nfs/dbraw/zinc/53/95/52/599539552.db2.gz ZQWVBORVHLLDCG-NXEZZACHSA-N -1 3 373.507 3.857 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CC[C@@H](C)C2)c1ccsc1 ZINC000736282013 599539553 /nfs/dbraw/zinc/53/95/53/599539553.db2.gz ZQWVBORVHLLDCG-NXEZZACHSA-N -1 3 373.507 3.857 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@H](C)c1ccsc1 ZINC000735830182 599541267 /nfs/dbraw/zinc/54/12/67/599541267.db2.gz UATSVWHCPLEXIY-CQSZACIVSA-N -1 3 369.494 3.717 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@H](C)c1ccsc1 ZINC000735830182 599541268 /nfs/dbraw/zinc/54/12/68/599541268.db2.gz UATSVWHCPLEXIY-CQSZACIVSA-N -1 3 369.494 3.717 20 0 FHADHM C[C@@H](NC(=O)c1cc(Cl)ccc1Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000820392677 599541614 /nfs/dbraw/zinc/54/16/14/599541614.db2.gz YNOMRICXAWIQOT-SECBINFHSA-N -1 3 362.220 3.665 20 0 FHADHM C[C@@H](NC(=O)c1cc(Cl)ccc1Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000820392677 599541616 /nfs/dbraw/zinc/54/16/16/599541616.db2.gz YNOMRICXAWIQOT-SECBINFHSA-N -1 3 362.220 3.665 20 0 FHADHM CCN(C(=O)[C@H](C)c1ccsc1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736502570 599542119 /nfs/dbraw/zinc/54/21/19/599542119.db2.gz NYBPIOUCMYCSPL-CHWSQXEVSA-N -1 3 355.467 3.641 20 0 FHADHM CCN(C(=O)[C@H](C)c1ccsc1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736502570 599542121 /nfs/dbraw/zinc/54/21/21/599542121.db2.gz NYBPIOUCMYCSPL-CHWSQXEVSA-N -1 3 355.467 3.641 20 0 FHADHM Cc1cccc2c1ncc(-c1nnn[n-]1)c2N1CCCc2sccc2C1 ZINC000822334411 599545823 /nfs/dbraw/zinc/54/58/23/599545823.db2.gz CSCIXIZPCDYGLK-UHFFFAOYSA-N -1 3 362.462 3.738 20 0 FHADHM Cc1cccc2c1ncc(-c1nn[n-]n1)c2N1CCCc2sccc2C1 ZINC000822334411 599545825 /nfs/dbraw/zinc/54/58/25/599545825.db2.gz CSCIXIZPCDYGLK-UHFFFAOYSA-N -1 3 362.462 3.738 20 0 FHADHM CCc1ccc([C@H]2CCCCN2C(=O)Nc2cccc(-c3nnn[n-]3)c2)o1 ZINC000821482210 599550794 /nfs/dbraw/zinc/55/07/94/599550794.db2.gz RHXUKOIFTGORAM-MRXNPFEDSA-N -1 3 366.425 3.781 20 0 FHADHM CCc1ccc([C@H]2CCCCN2C(=O)Nc2cccc(-c3nn[n-]n3)c2)o1 ZINC000821482210 599550796 /nfs/dbraw/zinc/55/07/96/599550796.db2.gz RHXUKOIFTGORAM-MRXNPFEDSA-N -1 3 366.425 3.781 20 0 FHADHM Cc1ccc([C@H]2[C@H](C)CCCN2C(=O)c2sccc2-c2nnn[n-]2)cc1 ZINC000737332855 599558177 /nfs/dbraw/zinc/55/81/77/599558177.db2.gz WQZAFBBDIWOIGS-CZUORRHYSA-N -1 3 367.478 3.850 20 0 FHADHM Cc1ccc([C@H]2[C@H](C)CCCN2C(=O)c2sccc2-c2nn[n-]n2)cc1 ZINC000737332855 599558178 /nfs/dbraw/zinc/55/81/78/599558178.db2.gz WQZAFBBDIWOIGS-CZUORRHYSA-N -1 3 367.478 3.850 20 0 FHADHM CCC[C@H](C)NC(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736422554 599561760 /nfs/dbraw/zinc/56/17/60/599561760.db2.gz IYESNFKWQPHOMK-ZDUSSCGKSA-N -1 3 350.426 3.529 20 0 FHADHM Fc1ccc(C[C@@H]2CCN(c3c(-c4nnn[n-]4)cnc4ccccc43)C2)cc1 ZINC000822766269 599564863 /nfs/dbraw/zinc/56/48/63/599564863.db2.gz HCAUTPHWVTZQST-HNNXBMFYSA-N -1 3 374.423 3.623 20 0 FHADHM Fc1ccc(C[C@@H]2CCN(c3c(-c4nn[n-]n4)cnc4ccccc43)C2)cc1 ZINC000822766269 599564866 /nfs/dbraw/zinc/56/48/66/599564866.db2.gz HCAUTPHWVTZQST-HNNXBMFYSA-N -1 3 374.423 3.623 20 0 FHADHM CC(C)C(C)(C)NC(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735695226 599566104 /nfs/dbraw/zinc/56/61/04/599566104.db2.gz PYHOQYRRWUGFSR-UHFFFAOYSA-N -1 3 364.453 3.775 20 0 FHADHM CCC(C)(CC)NC(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736316403 599568958 /nfs/dbraw/zinc/56/89/58/599568958.db2.gz ZBOPKQIHJVTIBF-UHFFFAOYSA-N -1 3 364.453 3.919 20 0 FHADHM CCc1ccc([C@@H]2CCCCN2c2ncc(-c3nnn[n-]3)cc2Cl)o1 ZINC000821482077 599578751 /nfs/dbraw/zinc/57/87/51/599578751.db2.gz PXVBTNHQSDBXSY-AWEZNQCLSA-N -1 3 358.833 3.802 20 0 FHADHM CCc1ccc([C@@H]2CCCCN2c2ncc(-c3nn[n-]n3)cc2Cl)o1 ZINC000821482077 599578753 /nfs/dbraw/zinc/57/87/53/599578753.db2.gz PXVBTNHQSDBXSY-AWEZNQCLSA-N -1 3 358.833 3.802 20 0 FHADHM CC[C@@H](CC(=O)OCc1ccc(-c2nnn[n-]2)cc1)c1ccc(C)cc1 ZINC000736336019 599605005 /nfs/dbraw/zinc/60/50/05/599605005.db2.gz YIBLFXIQRUSLQT-INIZCTEOSA-N -1 3 350.422 3.802 20 0 FHADHM CC[C@@H](CC(=O)OCc1ccc(-c2nn[n-]n2)cc1)c1ccc(C)cc1 ZINC000736336019 599605007 /nfs/dbraw/zinc/60/50/07/599605007.db2.gz YIBLFXIQRUSLQT-INIZCTEOSA-N -1 3 350.422 3.802 20 0 FHADHM CC[C@H](CC(=O)OCc1ccc(-c2nnn[n-]2)cc1)c1ccc(C)cc1 ZINC000736336021 599605089 /nfs/dbraw/zinc/60/50/89/599605089.db2.gz YIBLFXIQRUSLQT-MRXNPFEDSA-N -1 3 350.422 3.802 20 0 FHADHM CC[C@H](CC(=O)OCc1ccc(-c2nn[n-]n2)cc1)c1ccc(C)cc1 ZINC000736336021 599605090 /nfs/dbraw/zinc/60/50/90/599605090.db2.gz YIBLFXIQRUSLQT-MRXNPFEDSA-N -1 3 350.422 3.802 20 0 FHADHM O=C(CC/C=C/c1ccccc1)OCc1ccc(-c2nnn[n-]2)cc1F ZINC000737825684 599606267 /nfs/dbraw/zinc/60/62/67/599606267.db2.gz NRZOWDTXUGBRLR-XBXARRHUSA-N -1 3 352.369 3.543 20 0 FHADHM O=C(CC/C=C/c1ccccc1)OCc1ccc(-c2nn[n-]n2)cc1F ZINC000737825684 599606268 /nfs/dbraw/zinc/60/62/68/599606268.db2.gz NRZOWDTXUGBRLR-XBXARRHUSA-N -1 3 352.369 3.543 20 0 FHADHM Cc1ccc([C@@H](C)C(=O)Nc2sc3c(c2-c2nnn[n-]2)CC[C@H](C)C3)o1 ZINC000822227635 599628752 /nfs/dbraw/zinc/62/87/52/599628752.db2.gz QDWHPRTVMDPHOJ-GXSJLCMTSA-N -1 3 371.466 3.697 20 0 FHADHM Cc1ccc([C@@H](C)C(=O)Nc2sc3c(c2-c2nn[n-]n2)CC[C@H](C)C3)o1 ZINC000822227635 599628753 /nfs/dbraw/zinc/62/87/53/599628753.db2.gz QDWHPRTVMDPHOJ-GXSJLCMTSA-N -1 3 371.466 3.697 20 0 FHADHM C[C@]1(C(=O)Nc2ccc(Cl)c(-c3nnn[n-]3)c2)CCc2ccccc2C1 ZINC000820577589 599629317 /nfs/dbraw/zinc/62/93/17/599629317.db2.gz RLMLVUPLIQSKKP-IBGZPJMESA-N -1 3 367.840 3.654 20 0 FHADHM C[C@]1(C(=O)Nc2ccc(Cl)c(-c3nn[n-]n3)c2)CCc2ccccc2C1 ZINC000820577589 599629318 /nfs/dbraw/zinc/62/93/18/599629318.db2.gz RLMLVUPLIQSKKP-IBGZPJMESA-N -1 3 367.840 3.654 20 0 FHADHM CCCCS[C@H](C)C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000821077675 599632907 /nfs/dbraw/zinc/63/29/07/599632907.db2.gz PUCDSRYFHVVBJI-SECBINFHSA-N -1 3 373.404 3.746 20 0 FHADHM CCCCS[C@H](C)C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000821077675 599632908 /nfs/dbraw/zinc/63/29/08/599632908.db2.gz PUCDSRYFHVVBJI-SECBINFHSA-N -1 3 373.404 3.746 20 0 FHADHM CCC(CC)(C(=O)OCc1cc(-c2nnn[n-]2)ccc1F)c1ccccc1 ZINC000820882497 599671972 /nfs/dbraw/zinc/67/19/72/599671972.db2.gz RXKFRZUFENKKTL-UHFFFAOYSA-N -1 3 368.412 3.807 20 0 FHADHM CCC(CC)(C(=O)OCc1cc(-c2nn[n-]n2)ccc1F)c1ccccc1 ZINC000820882497 599671973 /nfs/dbraw/zinc/67/19/73/599671973.db2.gz RXKFRZUFENKKTL-UHFFFAOYSA-N -1 3 368.412 3.807 20 0 FHADHM C[C@@H](NC(=O)NCc1ccc2ccccc2c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820375193 599674102 /nfs/dbraw/zinc/67/41/02/599674102.db2.gz ZRGNYZUFLYRYOH-CQSZACIVSA-N -1 3 372.432 3.580 20 0 FHADHM C[C@@H](NC(=O)NCc1ccc2ccccc2c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820375193 599674103 /nfs/dbraw/zinc/67/41/03/599674103.db2.gz ZRGNYZUFLYRYOH-CQSZACIVSA-N -1 3 372.432 3.580 20 0 FHADHM O=C(OC[C@@H]1CCCS1)c1ccccc1-c1ccccc1-c1nnn[n-]1 ZINC000823400971 599685279 /nfs/dbraw/zinc/68/52/79/599685279.db2.gz MOJUXNYIFPEEOX-ZDUSSCGKSA-N -1 3 366.446 3.586 20 0 FHADHM O=C(OC[C@@H]1CCCS1)c1ccccc1-c1ccccc1-c1nn[n-]n1 ZINC000823400971 599685280 /nfs/dbraw/zinc/68/52/80/599685280.db2.gz MOJUXNYIFPEEOX-ZDUSSCGKSA-N -1 3 366.446 3.586 20 0 FHADHM c1cc(-c2nc(-c3ccc(N4CCCCC4)cc3)no2)ccc1-c1nnn[n-]1 ZINC000823757931 599691878 /nfs/dbraw/zinc/69/18/78/599691878.db2.gz XSUYZPMDYRLRTC-UHFFFAOYSA-N -1 3 373.420 3.574 20 0 FHADHM c1cc(-c2nc(-c3ccc(N4CCCCC4)cc3)no2)ccc1-c1nn[n-]n1 ZINC000823757931 599691879 /nfs/dbraw/zinc/69/18/79/599691879.db2.gz XSUYZPMDYRLRTC-UHFFFAOYSA-N -1 3 373.420 3.574 20 0 FHADHM Cc1ccc([C@H](CNC(=O)Nc2ccc(F)c(NC(=O)[O-])c2)N(C)C)cc1 ZINC000738563257 599714899 /nfs/dbraw/zinc/71/48/99/599714899.db2.gz YWFUOCQSDZPLTP-KRWDZBQOSA-N -1 3 374.416 3.648 20 0 FHADHM CN(CCCc1cc(-c2ccc(F)cc2)no1)Cc1occc1C(=O)[O-] ZINC000737440668 599720564 /nfs/dbraw/zinc/72/05/64/599720564.db2.gz HZDMKTFZFXHWAQ-UHFFFAOYSA-N -1 3 358.369 3.837 20 0 FHADHM Cc1cscc1NC(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(C)C ZINC000826320739 607393510 /nfs/dbraw/zinc/39/35/10/607393510.db2.gz BRPZNSJXLVDEJD-UHFFFAOYSA-N -1 3 358.427 3.668 20 0 FHADHM Cc1cscc1NC(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(C)C ZINC000826320739 607393511 /nfs/dbraw/zinc/39/35/11/607393511.db2.gz BRPZNSJXLVDEJD-UHFFFAOYSA-N -1 3 358.427 3.668 20 0 FHADHM O=C([O-])Nc1ccc(CNC(=O)CN[C@H](c2ccccc2)C2CCC2)cc1 ZINC000740025701 599793900 /nfs/dbraw/zinc/79/39/00/599793900.db2.gz UEZMSOIYQDMUSU-HXUWFJFHSA-N -1 3 367.449 3.524 20 0 FHADHM Cc1cscc1NC(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000826321287 607394959 /nfs/dbraw/zinc/39/49/59/607394959.db2.gz YWLGZSICHIMKTR-UHFFFAOYSA-N -1 3 368.344 3.899 20 0 FHADHM Cc1cscc1NC(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000826321287 607394960 /nfs/dbraw/zinc/39/49/60/607394960.db2.gz YWLGZSICHIMKTR-UHFFFAOYSA-N -1 3 368.344 3.899 20 0 FHADHM CC[C@H](C(=O)Nc1ccc(OC(C)C)c(-c2nnn[n-]2)c1)c1ccccc1 ZINC000820843410 607400556 /nfs/dbraw/zinc/40/05/56/607400556.db2.gz YKGZZIOEVVXXNM-INIZCTEOSA-N -1 3 365.437 3.786 20 0 FHADHM CC[C@H](C(=O)Nc1ccc(OC(C)C)c(-c2nn[n-]n2)c1)c1ccccc1 ZINC000820843410 607400559 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O=C([O-])c1cccc(OCCN2CCC[C@H]2CC(=O)c2cccs2)c1 ZINC000833331791 602238932 /nfs/dbraw/zinc/23/89/32/602238932.db2.gz SKVUWKUQBRHSHR-HNNXBMFYSA-N -1 3 359.447 3.563 20 0 FHADHM C[C@@H](NC(=O)[O-])[C@H]1CCCCN1Cc1ccc(OCc2ccncc2)cc1 ZINC000739005102 602259521 /nfs/dbraw/zinc/25/95/21/602259521.db2.gz VXRLWSKNECNYNU-OXQOHEQNSA-N -1 3 369.465 3.671 20 0 FHADHM Cc1ccc([C@H](CNC(=O)Nc2cc(NC(=O)[O-])ccc2F)N(C)C)cc1 ZINC000740119223 603036608 /nfs/dbraw/zinc/03/66/08/603036608.db2.gz UTPHOJZCLPOOOM-KRWDZBQOSA-N -1 3 374.416 3.648 20 0 FHADHM CN(C(=O)[O-])c1ccc(OC(=O)[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000827899557 603045601 /nfs/dbraw/zinc/04/56/01/603045601.db2.gz HJPCZTOWYHEIPV-KRWDZBQOSA-N -1 3 368.433 3.618 20 0 FHADHM C[C@@H](NC1CCC(NC(=O)[O-])CC1)c1nc2ccccc2n1C(F)F ZINC000739034727 603087919 /nfs/dbraw/zinc/08/79/19/603087919.db2.gz ZYDWTSSCTPTNKM-VOMCLLRMSA-N -1 3 352.385 3.661 20 0 FHADHM COc1ccccc1[C@H](CNCc1cc2cc(F)ccc2o1)NC(=O)[O-] ZINC000829597993 603160366 /nfs/dbraw/zinc/16/03/66/603160366.db2.gz MIYZLKMTEJTGLH-INIZCTEOSA-N -1 3 358.369 3.679 20 0 FHADHM O=C([O-])NC[C@@H]1CCCC[C@@H]1NCc1csc(-c2ccsc2)n1 ZINC000832512578 603172665 /nfs/dbraw/zinc/17/26/65/603172665.db2.gz FYAQFDMQOZHDEM-FZMZJTMJSA-N -1 3 351.497 3.788 20 0 FHADHM O=C([O-])NC[C@@H]1CCCC[C@@H]1NCc1csc(-c2cccs2)n1 ZINC000832514564 603172675 /nfs/dbraw/zinc/17/26/75/603172675.db2.gz NIHRFDRKTHZFPV-AAEUAGOBSA-N -1 3 351.497 3.788 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1ccccc1SC(F)F ZINC000826250873 607651969 /nfs/dbraw/zinc/65/19/69/607651969.db2.gz WTOPGPYBHCHDDG-UHFFFAOYSA-N -1 3 361.377 3.742 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1ccccc1SC(F)F ZINC000826250873 607651970 /nfs/dbraw/zinc/65/19/70/607651970.db2.gz WTOPGPYBHCHDDG-UHFFFAOYSA-N -1 3 361.377 3.742 20 0 FHADHM CN(C(=O)c1ccc(NC(=O)[O-])cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000827938555 603885498 /nfs/dbraw/zinc/88/54/98/603885498.db2.gz NCWIMMPINAHUMY-IBGZPJMESA-N -1 3 367.449 3.513 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1-c1nc(-c2cccc(C(F)(F)F)c2)no1 ZINC000826243879 607658154 /nfs/dbraw/zinc/65/81/54/607658154.db2.gz ZJBYYSILLLCKCW-UHFFFAOYSA-N -1 3 372.310 3.911 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1-c1nc(-c2cccc(C(F)(F)F)c2)no1 ZINC000826243879 607658157 /nfs/dbraw/zinc/65/81/57/607658157.db2.gz ZJBYYSILLLCKCW-UHFFFAOYSA-N -1 3 372.310 3.911 20 0 FHADHM CCC1CCC(N(C(=O)c2ccc(-c3nnn[n-]3)cc2C)C2CC2)CC1 ZINC000825193509 607669627 /nfs/dbraw/zinc/66/96/27/607669627.db2.gz MBGUOQPHVIITQJ-UHFFFAOYSA-N -1 3 353.470 3.749 20 0 FHADHM CCC1CCC(N(C(=O)c2ccc(-c3nn[n-]n3)cc2C)C2CC2)CC1 ZINC000825193509 607669629 /nfs/dbraw/zinc/66/96/29/607669629.db2.gz MBGUOQPHVIITQJ-UHFFFAOYSA-N -1 3 353.470 3.749 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)CCCc1sccc1C ZINC000825621358 607669923 /nfs/dbraw/zinc/66/99/23/607669923.db2.gz QTIHUJKFTQRVBS-UHFFFAOYSA-N -1 3 371.466 3.597 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)CCCc1sccc1C ZINC000825621358 607669925 /nfs/dbraw/zinc/66/99/25/607669925.db2.gz QTIHUJKFTQRVBS-UHFFFAOYSA-N -1 3 371.466 3.597 20 0 FHADHM O=C(Nc1cccc2ccccc21)NC1(c2cccc(-c3nnn[n-]3)c2)CC1 ZINC000826457400 607674455 /nfs/dbraw/zinc/67/44/55/607674455.db2.gz ZSOZEVIIJJNLLD-UHFFFAOYSA-N -1 3 370.416 3.831 20 0 FHADHM O=C(Nc1cccc2ccccc21)NC1(c2cccc(-c3nn[n-]n3)c2)CC1 ZINC000826457400 607674456 /nfs/dbraw/zinc/67/44/56/607674456.db2.gz ZSOZEVIIJJNLLD-UHFFFAOYSA-N -1 3 370.416 3.831 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1ccc(Nc2ccccc2)nc1 ZINC000826250203 607678151 /nfs/dbraw/zinc/67/81/51/607678151.db2.gz PCMNLFJABDHNRU-UHFFFAOYSA-N -1 3 371.404 3.566 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1ccc(Nc2ccccc2)nc1 ZINC000826250203 607678153 /nfs/dbraw/zinc/67/81/53/607678153.db2.gz PCMNLFJABDHNRU-UHFFFAOYSA-N -1 3 371.404 3.566 20 0 FHADHM Cc1ccc(-c2ccncc2)cc1NC(=O)c1ccc(-c2nnn[n-]2)cc1C ZINC000826273371 607680868 /nfs/dbraw/zinc/68/08/68/607680868.db2.gz AQQZSSZPWCVLBQ-UHFFFAOYSA-N -1 3 370.416 3.798 20 0 FHADHM Cc1ccc(-c2ccncc2)cc1NC(=O)c1ccc(-c2nn[n-]n2)cc1C ZINC000826273371 607680870 /nfs/dbraw/zinc/68/08/70/607680870.db2.gz AQQZSSZPWCVLBQ-UHFFFAOYSA-N -1 3 370.416 3.798 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N(C)[C@H](C)Cc1ccc(Cl)cc1 ZINC000826243689 607693413 /nfs/dbraw/zinc/69/34/13/607693413.db2.gz RIPLWMMCTCONNT-CYBMUJFWSA-N -1 3 369.856 3.532 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N(C)[C@H](C)Cc1ccc(Cl)cc1 ZINC000826243689 607693414 /nfs/dbraw/zinc/69/34/14/607693414.db2.gz RIPLWMMCTCONNT-CYBMUJFWSA-N -1 3 369.856 3.532 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1CCCC[C@@H]1c1ccc(F)cc1 ZINC000826245252 607700087 /nfs/dbraw/zinc/70/00/87/607700087.db2.gz SDTQGNLDLYHZAC-GOSISDBHSA-N -1 3 365.412 3.682 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1CCCC[C@@H]1c1ccc(F)cc1 ZINC000826245252 607700090 /nfs/dbraw/zinc/70/00/90/607700090.db2.gz SDTQGNLDLYHZAC-GOSISDBHSA-N -1 3 365.412 3.682 20 0 FHADHM COc1cc2c(cc1OC)[C@@H](CC(=O)[O-])N(Cc1sccc1C)CC2 ZINC000833730355 604521163 /nfs/dbraw/zinc/52/11/63/604521163.db2.gz UXYKLGGZJLPCSR-OAHLLOKOSA-N -1 3 361.463 3.648 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1cccc(CC(F)(F)F)c1 ZINC000826250616 607697086 /nfs/dbraw/zinc/69/70/86/607697086.db2.gz JHWCKYXFCFSQMJ-UHFFFAOYSA-N -1 3 361.327 3.532 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1cccc(CC(F)(F)F)c1 ZINC000826250616 607697087 /nfs/dbraw/zinc/69/70/87/607697087.db2.gz JHWCKYXFCFSQMJ-UHFFFAOYSA-N -1 3 361.327 3.532 20 0 FHADHM C[C@@H](Oc1ccc(CN2CCC(Oc3ccccc3)CC2)cc1)C(=O)[O-] ZINC000833540349 604549759 /nfs/dbraw/zinc/54/97/59/604549759.db2.gz IZTMFXWHOKHXFU-MRXNPFEDSA-N -1 3 355.434 3.582 20 0 FHADHM C[C@H](Oc1ccc(CN2CCC(Oc3ccccc3)CC2)cc1)C(=O)[O-] ZINC000833540348 604549890 /nfs/dbraw/zinc/54/98/90/604549890.db2.gz IZTMFXWHOKHXFU-INIZCTEOSA-N -1 3 355.434 3.582 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1CC2(CCCC2)c2ccccc21 ZINC000826244401 607701566 /nfs/dbraw/zinc/70/15/66/607701566.db2.gz QSTLDQDACXPUCE-UHFFFAOYSA-N -1 3 359.433 3.647 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1CC2(CCCC2)c2ccccc21 ZINC000826244401 607701568 /nfs/dbraw/zinc/70/15/68/607701568.db2.gz QSTLDQDACXPUCE-UHFFFAOYSA-N -1 3 359.433 3.647 20 0 FHADHM COc1cccc(CN(Cc2ccccc2C(=O)[O-])C[C@@H]2CCCO2)c1 ZINC000582671378 604610080 /nfs/dbraw/zinc/61/00/80/604610080.db2.gz NRHDMJKIOMPKMT-IBGZPJMESA-N -1 3 355.434 3.575 20 0 FHADHM Cc1ccn(-c2ccccc2CN[C@H](C(=O)[O-])c2cccc(Cl)c2)n1 ZINC000832983336 604645626 /nfs/dbraw/zinc/64/56/26/604645626.db2.gz DMRLGWPFBPQWRI-SFHVURJKSA-N -1 3 355.825 3.750 20 0 FHADHM C[C@H](Oc1ccc(CN2CCS[C@@H](c3ccccc3)C2)cc1)C(=O)[O-] ZINC000833539721 604653531 /nfs/dbraw/zinc/65/35/31/604653531.db2.gz IAJKORYQJVHXNL-HNAYVOBHSA-N -1 3 357.475 3.829 20 0 FHADHM COc1cc(F)cc(CN[C@H](C(=O)[O-])c2ccc(Br)cc2)c1 ZINC000833729963 604686450 /nfs/dbraw/zinc/68/64/50/604686450.db2.gz VNRNGUDLVPJFNY-HNNXBMFYSA-N -1 3 368.202 3.512 20 0 FHADHM C[C@@H]1CCN(Cc2ccccc2)CCN1c1nc(Cl)c(C(=O)[O-])s1 ZINC000833616682 604833004 /nfs/dbraw/zinc/83/30/04/604833004.db2.gz ZSPWAQVYZZJJLO-GFCCVEGCSA-N -1 3 365.886 3.596 20 0 FHADHM C[C@H](Nc1ccc(NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)cc1)c1ccccc1 ZINC000824658671 607718768 /nfs/dbraw/zinc/71/87/68/607718768.db2.gz ZWWWKXSWXKCFLC-ZDUSSCGKSA-N -1 3 373.420 3.620 20 0 FHADHM C[C@H](Nc1ccc(NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)cc1)c1ccccc1 ZINC000824658671 607718770 /nfs/dbraw/zinc/71/87/70/607718770.db2.gz ZWWWKXSWXKCFLC-ZDUSSCGKSA-N -1 3 373.420 3.620 20 0 FHADHM CC(C)c1ccccc1OCCC(=O)OCc1ccc(-c2nnn[n-]2)cc1 ZINC000824352763 607719173 /nfs/dbraw/zinc/71/91/73/607719173.db2.gz MEAPQQNBMRNDJT-UHFFFAOYSA-N -1 3 366.421 3.502 20 0 FHADHM CC(C)c1ccccc1OCCC(=O)OCc1ccc(-c2nn[n-]n2)cc1 ZINC000824352763 607719174 /nfs/dbraw/zinc/71/91/74/607719174.db2.gz MEAPQQNBMRNDJT-UHFFFAOYSA-N -1 3 366.421 3.502 20 0 FHADHM CC(C)(C(=O)[O-])[C@H]1CCCN(CC(=O)Nc2ccc3ccccc3c2)C1 ZINC000833421573 604953509 /nfs/dbraw/zinc/95/35/09/604953509.db2.gz RWFUIAXBROOAKX-KRWDZBQOSA-N -1 3 354.450 3.601 20 0 FHADHM CC(C)(C(=O)[O-])[C@@H]1CCCN(Cc2nn(-c3ccccc3)c3c2CCC3)C1 ZINC000652500057 604954956 /nfs/dbraw/zinc/95/49/56/604954956.db2.gz YUSONDSKZVCRPJ-MRXNPFEDSA-N -1 3 367.493 3.684 20 0 FHADHM C[C@@H](N[C@@H](C(=O)[O-])c1cccnc1)c1ccc(OCc2cccnc2)cc1 ZINC000827716874 604990316 /nfs/dbraw/zinc/99/03/16/604990316.db2.gz BRVFMMABLFAICU-FOIQADDNSA-N -1 3 363.417 3.532 20 0 FHADHM Cc1ccc(CN2CCSCC2)cc1NCc1ccc(NC(=O)[O-])nc1 ZINC000830308760 605251846 /nfs/dbraw/zinc/25/18/46/605251846.db2.gz MPYAOJOEJSBHCC-UHFFFAOYSA-N -1 3 372.494 3.641 20 0 FHADHM C[C@@H](NC(=O)C[C@H](C)c1ccc(F)cc1F)c1cccc(-c2nnn[n-]2)c1 ZINC000824384585 607745466 /nfs/dbraw/zinc/74/54/66/607745466.db2.gz FFUMOHUIHMINRR-NWDGAFQWSA-N -1 3 371.391 3.516 20 0 FHADHM C[C@@H](NC(=O)C[C@H](C)c1ccc(F)cc1F)c1cccc(-c2nn[n-]n2)c1 ZINC000824384585 607745467 /nfs/dbraw/zinc/74/54/67/607745467.db2.gz FFUMOHUIHMINRR-NWDGAFQWSA-N -1 3 371.391 3.516 20 0 FHADHM Cc1oc(-c2ccsc2)nc1CN1C[C@@H]2CCC[C@H](NC(=O)[O-])[C@H]2C1 ZINC000833934611 605449771 /nfs/dbraw/zinc/44/97/71/605449771.db2.gz MLDPVTPIGSWWIC-QEJZJMRPSA-N -1 3 361.467 3.580 20 0 FHADHM O=C([O-])N1CCC[C@H]1[C@H]1CCCN(Cc2cnc(-c3ccccn3)s2)C1 ZINC000834104688 605473055 /nfs/dbraw/zinc/47/30/55/605473055.db2.gz FCJZDLQLLFSYML-YOEHRIQHSA-N -1 3 372.494 3.560 20 0 FHADHM O=C([O-])N1CCC[C@H]1[C@@H]1CCCCN1Cc1cnc(-c2ccncc2)s1 ZINC000834111128 605562304 /nfs/dbraw/zinc/56/23/04/605562304.db2.gz ZOSLJKJFNKIODC-IRXDYDNUSA-N -1 3 372.494 3.702 20 0 FHADHM CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)Nc1cccc2ccsc21 ZINC000825958512 607768200 /nfs/dbraw/zinc/76/82/00/607768200.db2.gz YXOLWHSJUHRLJG-UHFFFAOYSA-N -1 3 364.434 3.745 20 0 FHADHM CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)Nc1cccc2ccsc21 ZINC000825958512 607768201 /nfs/dbraw/zinc/76/82/01/607768201.db2.gz YXOLWHSJUHRLJG-UHFFFAOYSA-N -1 3 364.434 3.745 20 0 FHADHM CCC1(C(=O)Nc2nc(-c3cccc(-c4nnn[n-]4)c3)cs2)CCCC1 ZINC000825164494 607770107 /nfs/dbraw/zinc/77/01/07/607770107.db2.gz BJGSXVMCMHQCOH-UHFFFAOYSA-N -1 3 368.466 3.899 20 0 FHADHM CCC1(C(=O)Nc2nc(-c3cccc(-c4nn[n-]n4)c3)cs2)CCCC1 ZINC000825164494 607770108 /nfs/dbraw/zinc/77/01/08/607770108.db2.gz BJGSXVMCMHQCOH-UHFFFAOYSA-N -1 3 368.466 3.899 20 0 FHADHM C[C@H]1CC[C@@H](NC(=O)CCc2ccc(-c3nnn[n-]3)cc2)c2ccccc21 ZINC000824914923 607772026 /nfs/dbraw/zinc/77/20/26/607772026.db2.gz ADKRCWJFKFUNBM-IFXJQAMLSA-N -1 3 361.449 3.554 20 0 FHADHM C[C@H]1CC[C@@H](NC(=O)CCc2ccc(-c3nn[n-]n3)cc2)c2ccccc21 ZINC000824914923 607772027 /nfs/dbraw/zinc/77/20/27/607772027.db2.gz ADKRCWJFKFUNBM-IFXJQAMLSA-N -1 3 361.449 3.554 20 0 FHADHM Cc1nc2ccccc2n1C[C@H]1CCCN1Cc1cc(C(=O)[O-])ccc1F ZINC000833755788 605845142 /nfs/dbraw/zinc/84/51/42/605845142.db2.gz BDYODBXCOVAYLW-QGZVFWFLSA-N -1 3 367.424 3.847 20 0 FHADHM Cc1nc2ccccc2n1C[C@@H]1CCCN1Cc1cc(C(=O)[O-])ccc1F ZINC000833755787 605845159 /nfs/dbraw/zinc/84/51/59/605845159.db2.gz BDYODBXCOVAYLW-KRWDZBQOSA-N -1 3 367.424 3.847 20 0 FHADHM c1ccc2nc(NCCCOC3CCCCC3)c(-c3nnn[n-]3)cc2c1 ZINC000823802380 606032300 /nfs/dbraw/zinc/03/23/00/606032300.db2.gz LNLUAOARQAVVPT-UHFFFAOYSA-N -1 3 352.442 3.566 20 0 FHADHM c1ccc2nc(NCCCOC3CCCCC3)c(-c3nn[n-]n3)cc2c1 ZINC000823802380 606032306 /nfs/dbraw/zinc/03/23/06/606032306.db2.gz LNLUAOARQAVVPT-UHFFFAOYSA-N -1 3 352.442 3.566 20 0 FHADHM FC(F)(F)[C@H]1CCC[C@H](Nc2nc3ccccc3cc2-c2nnn[n-]2)C1 ZINC000822713915 606035295 /nfs/dbraw/zinc/03/52/95/606035295.db2.gz BMMBSPXICBGAMH-RYUDHWBXSA-N -1 3 362.359 3.948 20 0 FHADHM FC(F)(F)[C@H]1CCC[C@H](Nc2nc3ccccc3cc2-c2nn[n-]n2)C1 ZINC000822713915 606035299 /nfs/dbraw/zinc/03/52/99/606035299.db2.gz BMMBSPXICBGAMH-RYUDHWBXSA-N -1 3 362.359 3.948 20 0 FHADHM CN(Cc1nc(C(F)(F)F)cs1)c1ccc(Cl)cc1-c1nnn[n-]1 ZINC000821617043 606044886 /nfs/dbraw/zinc/04/48/86/606044886.db2.gz UCBJFPMBCULYRC-UHFFFAOYSA-N -1 3 374.779 3.632 20 0 FHADHM CN(Cc1nc(C(F)(F)F)cs1)c1ccc(Cl)cc1-c1nn[n-]n1 ZINC000821617043 606044893 /nfs/dbraw/zinc/04/48/93/606044893.db2.gz UCBJFPMBCULYRC-UHFFFAOYSA-N -1 3 374.779 3.632 20 0 FHADHM Fc1cccc([C@@H]2CCN(c3nc4ccccc4cc3-c3nnn[n-]3)C2)c1 ZINC000822786252 606075620 /nfs/dbraw/zinc/07/56/20/606075620.db2.gz GLZRCINRTKCSAB-OAHLLOKOSA-N -1 3 360.396 3.548 20 0 FHADHM Fc1cccc([C@@H]2CCN(c3nc4ccccc4cc3-c3nn[n-]n3)C2)c1 ZINC000822786252 606075626 /nfs/dbraw/zinc/07/56/26/606075626.db2.gz GLZRCINRTKCSAB-OAHLLOKOSA-N -1 3 360.396 3.548 20 0 FHADHM C[C@@H](C(=O)Nc1sccc1-c1nnn[n-]1)c1ccc(Cl)c(Cl)c1 ZINC000819876998 606099506 /nfs/dbraw/zinc/09/95/06/606099506.db2.gz MMQZCCDNFQIXRZ-SSDOTTSWSA-N -1 3 368.249 3.977 20 0 FHADHM C[C@@H](C(=O)Nc1sccc1-c1nn[n-]n1)c1ccc(Cl)c(Cl)c1 ZINC000819876998 606099509 /nfs/dbraw/zinc/09/95/09/606099509.db2.gz MMQZCCDNFQIXRZ-SSDOTTSWSA-N -1 3 368.249 3.977 20 0 FHADHM CC[C@H](C)[C@H](C)N(C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)C1CC1 ZINC000820859351 606117274 /nfs/dbraw/zinc/11/72/74/606117274.db2.gz DIXQNXOEKQFXIX-IHRRRGAJSA-N -1 3 356.474 3.536 20 0 FHADHM CC[C@H](C)[C@H](C)N(C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)C1CC1 ZINC000820859351 606117275 /nfs/dbraw/zinc/11/72/75/606117275.db2.gz DIXQNXOEKQFXIX-IHRRRGAJSA-N -1 3 356.474 3.536 20 0 FHADHM CC[C@@H](Oc1ccccc1C)C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820938302 606127463 /nfs/dbraw/zinc/12/74/63/606127463.db2.gz IDIKATJQVOMDFY-WMLDXEAASA-N -1 3 366.421 3.637 20 0 FHADHM CC[C@@H](Oc1ccccc1C)C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820938302 606127465 /nfs/dbraw/zinc/12/74/65/606127465.db2.gz IDIKATJQVOMDFY-WMLDXEAASA-N -1 3 366.421 3.637 20 0 FHADHM CC[C@H](C)Oc1ccc(NCc2ccc(OC)c(-c3nnn[n-]3)c2)cc1 ZINC000820875660 606132271 /nfs/dbraw/zinc/13/22/71/606132271.db2.gz BYOKEMRMCVVJBH-ZDUSSCGKSA-N -1 3 353.426 3.665 20 0 FHADHM CC[C@H](C)Oc1ccc(NCc2ccc(OC)c(-c3nn[n-]n3)c2)cc1 ZINC000820875660 606132273 /nfs/dbraw/zinc/13/22/73/606132273.db2.gz BYOKEMRMCVVJBH-ZDUSSCGKSA-N -1 3 353.426 3.665 20 0 FHADHM CSc1ccc(NC(=O)NCc2cccc(-c3nnn[n-]3)c2)cc1Cl ZINC000821983254 606162157 /nfs/dbraw/zinc/16/21/57/606162157.db2.gz FJFRAWLPCFZACT-UHFFFAOYSA-N -1 3 374.857 3.564 20 0 FHADHM CSc1ccc(NC(=O)NCc2cccc(-c3nn[n-]n3)c2)cc1Cl ZINC000821983254 606162158 /nfs/dbraw/zinc/16/21/58/606162158.db2.gz FJFRAWLPCFZACT-UHFFFAOYSA-N -1 3 374.857 3.564 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000819773542 606177150 /nfs/dbraw/zinc/17/71/50/606177150.db2.gz TYPSIKVKZSNCGO-UKVQZPPCSA-N -1 3 352.369 3.714 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000819773542 606177152 /nfs/dbraw/zinc/17/71/52/606177152.db2.gz TYPSIKVKZSNCGO-UKVQZPPCSA-N -1 3 352.369 3.714 20 0 FHADHM CC[C@@H](Oc1cccc(C)c1)C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820939464 606179942 /nfs/dbraw/zinc/17/99/42/606179942.db2.gz VCHNBEPVFHLQDD-KBXCAEBGSA-N -1 3 366.421 3.637 20 0 FHADHM CC[C@@H](Oc1cccc(C)c1)C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820939464 606179943 /nfs/dbraw/zinc/17/99/43/606179943.db2.gz VCHNBEPVFHLQDD-KBXCAEBGSA-N -1 3 366.421 3.637 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1O[C@@H](C)c1ncc(-c2ccccc2)o1 ZINC000821700365 606182645 /nfs/dbraw/zinc/18/26/45/606182645.db2.gz MAJBOXYYXWQAPG-LBPRGKRZSA-N -1 3 363.377 3.670 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1O[C@@H](C)c1ncc(-c2ccccc2)o1 ZINC000821700365 606182646 /nfs/dbraw/zinc/18/26/46/606182646.db2.gz MAJBOXYYXWQAPG-LBPRGKRZSA-N -1 3 363.377 3.670 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)CCCc1ccc(C)s1 ZINC000821406515 606184315 /nfs/dbraw/zinc/18/43/15/606184315.db2.gz HDPPVJAKSCRYPG-UHFFFAOYSA-N -1 3 371.466 3.597 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)CCCc1ccc(C)s1 ZINC000821406515 606184316 /nfs/dbraw/zinc/18/43/16/606184316.db2.gz HDPPVJAKSCRYPG-UHFFFAOYSA-N -1 3 371.466 3.597 20 0 FHADHM CCC1(C(=O)Nc2ccc(Oc3cccc(-c4nnn[n-]4)c3)nc2)CCC1 ZINC000820944017 606226147 /nfs/dbraw/zinc/22/61/47/606226147.db2.gz GCPNZGKLDYECFT-UHFFFAOYSA-N -1 3 364.409 3.573 20 0 FHADHM CCC1(C(=O)Nc2ccc(Oc3cccc(-c4nn[n-]n4)c3)nc2)CCC1 ZINC000820944017 606226149 /nfs/dbraw/zinc/22/61/49/606226149.db2.gz GCPNZGKLDYECFT-UHFFFAOYSA-N -1 3 364.409 3.573 20 0 FHADHM CCC(CC)N(C(=O)c1cc(-c2nnn[n-]2)cn1C)c1ccc(C)c(C)c1 ZINC000820897996 606236894 /nfs/dbraw/zinc/23/68/94/606236894.db2.gz RSOVZKVHPYWZRO-UHFFFAOYSA-N -1 3 366.469 3.657 20 0 FHADHM CCC(CC)N(C(=O)c1cc(-c2nn[n-]n2)cn1C)c1ccc(C)c(C)c1 ZINC000820897996 606236895 /nfs/dbraw/zinc/23/68/95/606236895.db2.gz RSOVZKVHPYWZRO-UHFFFAOYSA-N -1 3 366.469 3.657 20 0 FHADHM CCCc1sc(C(=O)Nc2ccc(F)cc2-c2nnn[n-]2)cc1CC ZINC000821142133 606261189 /nfs/dbraw/zinc/26/11/89/606261189.db2.gz FGWORBUHOAEEOO-UHFFFAOYSA-N -1 3 359.430 3.835 20 0 FHADHM CCCc1sc(C(=O)Nc2ccc(F)cc2-c2nn[n-]n2)cc1CC ZINC000821142133 606261191 /nfs/dbraw/zinc/26/11/91/606261191.db2.gz FGWORBUHOAEEOO-UHFFFAOYSA-N -1 3 359.430 3.835 20 0 FHADHM CCCCCCOCc1cccc(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)c1 ZINC000821056642 606263125 /nfs/dbraw/zinc/26/31/25/606263125.db2.gz VITRLQATFRPGJD-UHFFFAOYSA-N -1 3 368.441 3.544 20 0 FHADHM CCCCCCOCc1cccc(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)c1 ZINC000821056642 606263126 /nfs/dbraw/zinc/26/31/26/606263126.db2.gz VITRLQATFRPGJD-UHFFFAOYSA-N -1 3 368.441 3.544 20 0 FHADHM Cc1c(C(=O)Nc2ccc(F)cc2-c2nnn[n-]2)oc2c1c(C)ccc2C ZINC000822232239 606268745 /nfs/dbraw/zinc/26/87/45/606268745.db2.gz YEZDZTQILIQTIT-UHFFFAOYSA-N -1 3 365.368 3.930 20 0 FHADHM Cc1c(C(=O)Nc2ccc(F)cc2-c2nn[n-]n2)oc2c1c(C)ccc2C ZINC000822232239 606268747 /nfs/dbraw/zinc/26/87/47/606268747.db2.gz YEZDZTQILIQTIT-UHFFFAOYSA-N -1 3 365.368 3.930 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)c1cc2ccc(F)cc2s1 ZINC000823344146 606269148 /nfs/dbraw/zinc/26/91/48/606269148.db2.gz RPBWORSDQUPPSC-UHFFFAOYSA-N -1 3 357.345 3.612 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)c1cc2ccc(F)cc2s1 ZINC000823344146 606269150 /nfs/dbraw/zinc/26/91/50/606269150.db2.gz RPBWORSDQUPPSC-UHFFFAOYSA-N -1 3 357.345 3.612 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)C1CCC(c2ccccc2)CC1 ZINC000823344088 606275384 /nfs/dbraw/zinc/27/53/84/606275384.db2.gz QCDZYLXCZIVRGY-UHFFFAOYSA-N -1 3 365.412 3.918 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)C1CCC(c2ccccc2)CC1 ZINC000823344088 606275386 /nfs/dbraw/zinc/27/53/86/606275386.db2.gz QCDZYLXCZIVRGY-UHFFFAOYSA-N -1 3 365.412 3.918 20 0 FHADHM CCN(C(=O)c1ccc(Sc2ccccc2-c2nnn[n-]2)cc1)C1CC1 ZINC000821161161 606313170 /nfs/dbraw/zinc/31/31/70/606313170.db2.gz VRDFWWURGYVCDB-UHFFFAOYSA-N -1 3 365.462 3.642 20 0 FHADHM CCN(C(=O)c1ccc(Sc2ccccc2-c2nn[n-]n2)cc1)C1CC1 ZINC000821161161 606313171 /nfs/dbraw/zinc/31/31/71/606313171.db2.gz VRDFWWURGYVCDB-UHFFFAOYSA-N -1 3 365.462 3.642 20 0 FHADHM Cc1cc(C)n(-c2ccc(CSc3cccc(-c4nnn[n-]4)c3)cc2)n1 ZINC000822198025 606324748 /nfs/dbraw/zinc/32/47/48/606324748.db2.gz ZAXRZANJBDIEKN-UHFFFAOYSA-N -1 3 362.462 3.962 20 0 FHADHM Cc1cc(C)n(-c2ccc(CSc3cccc(-c4nn[n-]n4)c3)cc2)n1 ZINC000822198025 606324749 /nfs/dbraw/zinc/32/47/49/606324749.db2.gz ZAXRZANJBDIEKN-UHFFFAOYSA-N -1 3 362.462 3.962 20 0 FHADHM Cc1cc(C(=O)CSc2cccc(-c3nnn[n-]3)c2)c(C)n1C1CC1 ZINC000822167330 606327319 /nfs/dbraw/zinc/32/73/19/606327319.db2.gz CMUKOVAQCBRYRP-UHFFFAOYSA-N -1 3 353.451 3.595 20 0 FHADHM Cc1cc(C(=O)CSc2cccc(-c3nn[n-]n3)c2)c(C)n1C1CC1 ZINC000822167330 606327321 /nfs/dbraw/zinc/32/73/21/606327321.db2.gz CMUKOVAQCBRYRP-UHFFFAOYSA-N -1 3 353.451 3.595 20 0 FHADHM Cc1ccc2c(CSc3cccc(-c4nnn[n-]4)c3)cc(=O)oc2c1 ZINC000822274735 606327364 /nfs/dbraw/zinc/32/73/64/606327364.db2.gz HIKKEMGVFXEOKT-UHFFFAOYSA-N -1 3 350.403 3.574 20 0 FHADHM Cc1ccc2c(CSc3cccc(-c4nn[n-]n4)c3)cc(=O)oc2c1 ZINC000822274735 606327365 /nfs/dbraw/zinc/32/73/65/606327365.db2.gz HIKKEMGVFXEOKT-UHFFFAOYSA-N -1 3 350.403 3.574 20 0 FHADHM Cc1ccc(C(=O)CCC(=O)O[C@H](C)c2ccc(-c3nnn[n-]3)cc2)s1 ZINC000822224816 606339657 /nfs/dbraw/zinc/33/96/57/606339657.db2.gz AZOLRUSSPIPJNW-GFCCVEGCSA-N -1 3 370.434 3.504 20 0 FHADHM Cc1ccc(C(=O)CCC(=O)O[C@H](C)c2ccc(-c3nn[n-]n3)cc2)s1 ZINC000822224816 606339659 /nfs/dbraw/zinc/33/96/59/606339659.db2.gz AZOLRUSSPIPJNW-GFCCVEGCSA-N -1 3 370.434 3.504 20 0 FHADHM Cc1ccc(C(=O)CCC(=O)O[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)s1 ZINC000822224817 606339967 /nfs/dbraw/zinc/33/99/67/606339967.db2.gz AZOLRUSSPIPJNW-LBPRGKRZSA-N -1 3 370.434 3.504 20 0 FHADHM Cc1ccc(C(=O)CCC(=O)O[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)s1 ZINC000822224817 606339970 /nfs/dbraw/zinc/33/99/70/606339970.db2.gz AZOLRUSSPIPJNW-LBPRGKRZSA-N -1 3 370.434 3.504 20 0 FHADHM CC(C)Oc1ccccc1C(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820178051 606341796 /nfs/dbraw/zinc/34/17/96/606341796.db2.gz GDRSXWJDGGMHKP-CYBMUJFWSA-N -1 3 352.394 3.572 20 0 FHADHM CC(C)Oc1ccccc1C(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820178051 606341798 /nfs/dbraw/zinc/34/17/98/606341798.db2.gz GDRSXWJDGGMHKP-CYBMUJFWSA-N -1 3 352.394 3.572 20 0 FHADHM C[C@H](OC(=O)C1(c2cccc(F)c2)CCC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820489016 606342187 /nfs/dbraw/zinc/34/21/87/606342187.db2.gz XYWRVHCIGVTRTJ-ZDUSSCGKSA-N -1 3 366.396 3.732 20 0 FHADHM C[C@H](OC(=O)C1(c2cccc(F)c2)CCC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820489016 606342189 /nfs/dbraw/zinc/34/21/89/606342189.db2.gz XYWRVHCIGVTRTJ-ZDUSSCGKSA-N -1 3 366.396 3.732 20 0 FHADHM C[C@@H](OC(=O)CCc1ccc(Cl)s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820494836 606343813 /nfs/dbraw/zinc/34/38/13/606343813.db2.gz CCAYLCOWXLRPOU-SNVBAGLBSA-N -1 3 362.842 3.819 20 0 FHADHM C[C@@H](OC(=O)CCc1ccc(Cl)s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820494836 606343814 /nfs/dbraw/zinc/34/38/14/606343814.db2.gz CCAYLCOWXLRPOU-SNVBAGLBSA-N -1 3 362.842 3.819 20 0 FHADHM Cc1cccc2c(CC(=O)O[C@H](C)c3ccc(-c4nnn[n-]4)cc3)c[nH]c21 ZINC000822332372 606351601 /nfs/dbraw/zinc/35/16/01/606351601.db2.gz PAIVEBFUFFIZAY-CYBMUJFWSA-N -1 3 361.405 3.503 20 0 FHADHM Cc1cccc2c(CC(=O)O[C@H](C)c3ccc(-c4nn[n-]n4)cc3)c[nH]c21 ZINC000822332372 606351602 /nfs/dbraw/zinc/35/16/02/606351602.db2.gz PAIVEBFUFFIZAY-CYBMUJFWSA-N -1 3 361.405 3.503 20 0 FHADHM C[C@@H](OC(=O)Cc1csc2ccccc12)c1ccc(-c2nnn[n-]2)cc1 ZINC000820502807 606353116 /nfs/dbraw/zinc/35/31/16/606353116.db2.gz WBHZBUPJYLBGBD-GFCCVEGCSA-N -1 3 364.430 3.928 20 0 FHADHM C[C@@H](OC(=O)Cc1csc2ccccc12)c1ccc(-c2nn[n-]n2)cc1 ZINC000820502807 606353117 /nfs/dbraw/zinc/35/31/17/606353117.db2.gz WBHZBUPJYLBGBD-GFCCVEGCSA-N -1 3 364.430 3.928 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccnc2ccccc12)c1ccc(-c2nnn[n-]2)cc1 ZINC000820487428 606353885 /nfs/dbraw/zinc/35/38/85/606353885.db2.gz GQRCMAVXAFJICQ-PLSXKVAHSA-N -1 3 371.400 3.733 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccnc2ccccc12)c1ccc(-c2nn[n-]n2)cc1 ZINC000820487428 606353887 /nfs/dbraw/zinc/35/38/87/606353887.db2.gz GQRCMAVXAFJICQ-PLSXKVAHSA-N -1 3 371.400 3.733 20 0 FHADHM C[C@@H](CC(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1cccc(F)c1 ZINC000820225285 606354126 /nfs/dbraw/zinc/35/41/26/606354126.db2.gz FPYLKQPUKOLJRI-STQMWFEESA-N -1 3 354.385 3.804 20 0 FHADHM C[C@@H](CC(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1cccc(F)c1 ZINC000820225285 606354127 /nfs/dbraw/zinc/35/41/27/606354127.db2.gz FPYLKQPUKOLJRI-STQMWFEESA-N -1 3 354.385 3.804 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)N1CCC[C@@H]1C1CCCCC1 ZINC000823343970 606358409 /nfs/dbraw/zinc/35/84/09/606358409.db2.gz MIXDNVKOMFEKON-MRXNPFEDSA-N -1 3 358.421 3.582 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)N1CCC[C@@H]1C1CCCCC1 ZINC000823343970 606358411 /nfs/dbraw/zinc/35/84/11/606358411.db2.gz MIXDNVKOMFEKON-MRXNPFEDSA-N -1 3 358.421 3.582 20 0 FHADHM C[C@H](CC(=O)N(C)c1cc(Cl)ccc1-c1nnn[n-]1)c1ccccc1 ZINC000820219869 606412135 /nfs/dbraw/zinc/41/21/35/606412135.db2.gz KPFSMVJUKUYGGS-GFCCVEGCSA-N -1 3 355.829 3.677 20 0 FHADHM C[C@H](CC(=O)N(C)c1cc(Cl)ccc1-c1nn[n-]n1)c1ccccc1 ZINC000820219869 606412137 /nfs/dbraw/zinc/41/21/37/606412137.db2.gz KPFSMVJUKUYGGS-GFCCVEGCSA-N -1 3 355.829 3.677 20 0 FHADHM CC[C@H](NCc1ccc(-c2nnn[n-]2)s1)c1nc(C(F)(F)F)cs1 ZINC000820927168 606425514 /nfs/dbraw/zinc/42/55/14/606425514.db2.gz ZZIKRXMJLNSOBG-QMMMGPOBSA-N -1 3 374.417 3.644 20 0 FHADHM CC[C@H](NCc1ccc(-c2nn[n-]n2)s1)c1nc(C(F)(F)F)cs1 ZINC000820927168 606425516 /nfs/dbraw/zinc/42/55/16/606425516.db2.gz ZZIKRXMJLNSOBG-QMMMGPOBSA-N -1 3 374.417 3.644 20 0 FHADHM C[C@H]1CCCN1C(=O)c1ccc(Sc2ccccc2-c2nnn[n-]2)cc1 ZINC000820710642 606436308 /nfs/dbraw/zinc/43/63/08/606436308.db2.gz RIMUQUXHWJHBIO-ZDUSSCGKSA-N -1 3 365.462 3.642 20 0 FHADHM C[C@H]1CCCN1C(=O)c1ccc(Sc2ccccc2-c2nn[n-]n2)cc1 ZINC000820710642 606436310 /nfs/dbraw/zinc/43/63/10/606436310.db2.gz RIMUQUXHWJHBIO-ZDUSSCGKSA-N -1 3 365.462 3.642 20 0 FHADHM CC(C)OCCNc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1 ZINC000820145605 606461900 /nfs/dbraw/zinc/46/19/00/606461900.db2.gz BYCMGZQZWGTOOD-UHFFFAOYSA-N -1 3 357.389 3.635 20 0 FHADHM CC(C)OCCNc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1 ZINC000820145605 606461901 /nfs/dbraw/zinc/46/19/01/606461901.db2.gz BYCMGZQZWGTOOD-UHFFFAOYSA-N -1 3 357.389 3.635 20 0 FHADHM CC(C)(C)C(=O)c1ccc(NCCOc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000819899388 606463950 /nfs/dbraw/zinc/46/39/50/606463950.db2.gz UTUOJFBPZNUQKN-UHFFFAOYSA-N -1 3 365.437 3.586 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1N1CCCC[C@H]1Cc1ccccc1 ZINC000822562547 606476042 /nfs/dbraw/zinc/47/60/42/606476042.db2.gz AYTGMDAPMZMBNH-HNNXBMFYSA-N -1 3 354.845 3.517 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1N1CCCC[C@H]1Cc1ccccc1 ZINC000822562547 606476043 /nfs/dbraw/zinc/47/60/43/606476043.db2.gz AYTGMDAPMZMBNH-HNNXBMFYSA-N -1 3 354.845 3.517 20 0 FHADHM CN(Cc1ccc(Cl)c(Cl)c1)C(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000821609626 606480275 /nfs/dbraw/zinc/48/02/75/606480275.db2.gz FHOYYSHMUDUKIH-UHFFFAOYSA-N -1 3 368.249 3.507 20 0 FHADHM CN(Cc1ccc(Cl)c(Cl)c1)C(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000821609626 606480278 /nfs/dbraw/zinc/48/02/78/606480278.db2.gz FHOYYSHMUDUKIH-UHFFFAOYSA-N -1 3 368.249 3.507 20 0 FHADHM Cc1ccc(NC(=O)c2cc(-c3nnn[n-]3)cs2)cc1C(F)(F)F ZINC000822255039 606485860 /nfs/dbraw/zinc/48/58/60/606485860.db2.gz TWQCMHDEUSLMAQ-UHFFFAOYSA-N -1 3 353.329 3.508 20 0 FHADHM Cc1ccc(NC(=O)c2cc(-c3nn[n-]n3)cs2)cc1C(F)(F)F ZINC000822255039 606485862 /nfs/dbraw/zinc/48/58/62/606485862.db2.gz TWQCMHDEUSLMAQ-UHFFFAOYSA-N -1 3 353.329 3.508 20 0 FHADHM Cc1ccc(C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)CC(C)C)c(F)c1 ZINC000822226119 606506970 /nfs/dbraw/zinc/50/69/70/606506970.db2.gz DJCIRPCEFVNZOU-UHFFFAOYSA-N -1 3 367.428 3.613 20 0 FHADHM Cc1ccc(C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)CC(C)C)c(F)c1 ZINC000822226119 606506971 /nfs/dbraw/zinc/50/69/71/606506971.db2.gz DJCIRPCEFVNZOU-UHFFFAOYSA-N -1 3 367.428 3.613 20 0 FHADHM CCC1(C(=O)Nc2ccc(OCc3cccc(-c4nnn[n-]4)c3)cc2)CC1 ZINC000820944325 606548805 /nfs/dbraw/zinc/54/88/05/606548805.db2.gz KZUIEJSYLUCTOH-UHFFFAOYSA-N -1 3 363.421 3.574 20 0 FHADHM CCC1(C(=O)Nc2ccc(OCc3cccc(-c4nn[n-]n4)c3)cc2)CC1 ZINC000820944325 606548806 /nfs/dbraw/zinc/54/88/06/606548806.db2.gz KZUIEJSYLUCTOH-UHFFFAOYSA-N -1 3 363.421 3.574 20 0 FHADHM CC(C)c1ccc(C(C)(C)NC(=O)Cc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000820192262 606552095 /nfs/dbraw/zinc/55/20/95/606552095.db2.gz HGOHWWRSTUQYNP-UHFFFAOYSA-N -1 3 363.465 3.584 20 0 FHADHM CC(C)c1ccc(C(C)(C)NC(=O)Cc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000820192262 606552096 /nfs/dbraw/zinc/55/20/96/606552096.db2.gz HGOHWWRSTUQYNP-UHFFFAOYSA-N -1 3 363.465 3.584 20 0 FHADHM Cc1ccccc1[C@H](CC(C)C)NC(=O)Cc1cccc(-c2nnn[n-]2)c1 ZINC000822345758 606560853 /nfs/dbraw/zinc/56/08/53/606560853.db2.gz QTSSMPRGMGWYTN-IBGZPJMESA-N -1 3 363.465 3.621 20 0 FHADHM Cc1ccccc1[C@H](CC(C)C)NC(=O)Cc1cccc(-c2nn[n-]n2)c1 ZINC000822345758 606560855 /nfs/dbraw/zinc/56/08/55/606560855.db2.gz QTSSMPRGMGWYTN-IBGZPJMESA-N -1 3 363.465 3.621 20 0 FHADHM CCc1ccc(CC)c(NC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000821482922 606577701 /nfs/dbraw/zinc/57/77/01/606577701.db2.gz WLXYURSECRBYQL-ZDUSSCGKSA-N -1 3 364.453 3.874 20 0 FHADHM CCc1ccc(CC)c(NC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000821482922 606577703 /nfs/dbraw/zinc/57/77/03/606577703.db2.gz WLXYURSECRBYQL-ZDUSSCGKSA-N -1 3 364.453 3.874 20 0 FHADHM COc1cccc([C@H](C)CC(=O)Nc2ccc(Cl)c(-c3nnn[n-]3)c2)c1 ZINC000821858855 606602863 /nfs/dbraw/zinc/60/28/63/606602863.db2.gz HLSMYMQQZQLECX-LLVKDONJSA-N -1 3 371.828 3.661 20 0 FHADHM COc1cccc([C@H](C)CC(=O)Nc2ccc(Cl)c(-c3nn[n-]n3)c2)c1 ZINC000821858855 606602864 /nfs/dbraw/zinc/60/28/64/606602864.db2.gz HLSMYMQQZQLECX-LLVKDONJSA-N -1 3 371.828 3.661 20 0 FHADHM C[C@@H](NC(=O)c1cc2cccc(Cl)c2o1)c1cccc(-c2nnn[n-]2)c1 ZINC000820390076 606603998 /nfs/dbraw/zinc/60/39/98/606603998.db2.gz DWJREBFCURMORA-SNVBAGLBSA-N -1 3 367.796 3.757 20 0 FHADHM C[C@@H](NC(=O)c1cc2cccc(Cl)c2o1)c1cccc(-c2nn[n-]n2)c1 ZINC000820390076 606603999 /nfs/dbraw/zinc/60/39/99/606603999.db2.gz DWJREBFCURMORA-SNVBAGLBSA-N -1 3 367.796 3.757 20 0 FHADHM CC(C(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)CC(C)C)=C1CCCC1 ZINC000819857976 606618715 /nfs/dbraw/zinc/61/87/15/606618715.db2.gz WZKVDXHYCMHKRM-UHFFFAOYSA-N -1 3 353.470 3.742 20 0 FHADHM CC(C(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)CC(C)C)=C1CCCC1 ZINC000819857976 606618717 /nfs/dbraw/zinc/61/87/17/606618717.db2.gz WZKVDXHYCMHKRM-UHFFFAOYSA-N -1 3 353.470 3.742 20 0 FHADHM CC[C@@H](C)Oc1ccc(C(=O)N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000820875750 606626818 /nfs/dbraw/zinc/62/68/18/606626818.db2.gz DVZXBJXHFCFLPG-KGLIPLIRSA-N -1 3 365.437 3.535 20 0 FHADHM CC[C@@H](C)Oc1ccc(C(=O)N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000820875750 606626820 /nfs/dbraw/zinc/62/68/20/606626820.db2.gz DVZXBJXHFCFLPG-KGLIPLIRSA-N -1 3 365.437 3.535 20 0 FHADHM Cc1[nH]ccc1C(=O)Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1C ZINC000822211945 606628303 /nfs/dbraw/zinc/62/83/03/606628303.db2.gz VCITYSMEFRBICV-UHFFFAOYSA-N -1 3 374.404 3.856 20 0 FHADHM Cc1[nH]ccc1C(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1C ZINC000822211945 606628305 /nfs/dbraw/zinc/62/83/05/606628305.db2.gz VCITYSMEFRBICV-UHFFFAOYSA-N -1 3 374.404 3.856 20 0 FHADHM Clc1ccc(SCc2nnc(-c3ccccc3)o2)c(-c2nnn[n-]2)c1 ZINC000822578077 606630893 /nfs/dbraw/zinc/63/08/93/606630893.db2.gz CBKUEGPVGVHTGX-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1ccc(SCc2nnc(-c3ccccc3)o2)c(-c2nn[n-]n2)c1 ZINC000822578077 606630896 /nfs/dbraw/zinc/63/08/96/606630896.db2.gz CBKUEGPVGVHTGX-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM CC(C)(C)c1cnc(CNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)o1 ZINC000819958113 606638515 /nfs/dbraw/zinc/63/85/15/606638515.db2.gz INQVKAFIBIFOQV-UHFFFAOYSA-N -1 3 366.347 3.783 20 0 FHADHM CC(C)(C)c1cnc(CNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)o1 ZINC000819958113 606638516 /nfs/dbraw/zinc/63/85/16/606638516.db2.gz INQVKAFIBIFOQV-UHFFFAOYSA-N -1 3 366.347 3.783 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N([C@H](C)c1ccco1)C1CC1 ZINC000822217513 606657323 /nfs/dbraw/zinc/65/73/23/606657323.db2.gz GRRFHQWYPMLXDQ-GFCCVEGCSA-N -1 3 352.398 3.526 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N([C@H](C)c1ccco1)C1CC1 ZINC000822217513 606657324 /nfs/dbraw/zinc/65/73/24/606657324.db2.gz GRRFHQWYPMLXDQ-GFCCVEGCSA-N -1 3 352.398 3.526 20 0 FHADHM CC(C)N(C)C(=O)Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000820112534 606660259 /nfs/dbraw/zinc/66/02/59/606660259.db2.gz XGGPTKDYNRBEHD-UHFFFAOYSA-N -1 3 352.398 3.531 20 0 FHADHM CC(C)N(C)C(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000820112534 606660260 /nfs/dbraw/zinc/66/02/60/606660260.db2.gz XGGPTKDYNRBEHD-UHFFFAOYSA-N -1 3 352.398 3.531 20 0 FHADHM O=C(C=C1CCC1)Nc1sc2c(c1-c1nnn[n-]1)-c1ccccc1CC2 ZINC000822916734 606673927 /nfs/dbraw/zinc/67/39/27/606673927.db2.gz BQFOSGMARIAZBL-UHFFFAOYSA-N -1 3 363.446 3.743 20 0 FHADHM O=C(C=C1CCC1)Nc1sc2c(c1-c1nn[n-]n1)-c1ccccc1CC2 ZINC000822916734 606673928 /nfs/dbraw/zinc/67/39/28/606673928.db2.gz BQFOSGMARIAZBL-UHFFFAOYSA-N -1 3 363.446 3.743 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@@H](C)CSc1ccc(F)cc1 ZINC000822215951 606675596 /nfs/dbraw/zinc/67/55/96/606675596.db2.gz ADQDGKKOSPBERK-LBPRGKRZSA-N -1 3 371.441 3.681 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@@H](C)CSc1ccc(F)cc1 ZINC000822215951 606675597 /nfs/dbraw/zinc/67/55/97/606675597.db2.gz ADQDGKKOSPBERK-LBPRGKRZSA-N -1 3 371.441 3.681 20 0 FHADHM CCCCc1ccc(N(C)C(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)cc1 ZINC000821077831 606685136 /nfs/dbraw/zinc/68/51/36/606685136.db2.gz VUIPHXWKUJHEDK-UHFFFAOYSA-N -1 3 371.391 3.764 20 0 FHADHM CCCCc1ccc(N(C)C(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)cc1 ZINC000821077831 606685137 /nfs/dbraw/zinc/68/51/37/606685137.db2.gz VUIPHXWKUJHEDK-UHFFFAOYSA-N -1 3 371.391 3.764 20 0 FHADHM C[C@@H](NC(=O)N(C)C1CCC(C)(C)CC1)c1cccc(-c2nnn[n-]2)c1 ZINC000820341740 606719566 /nfs/dbraw/zinc/71/95/66/606719566.db2.gz RFDUSLVSFASLGD-CYBMUJFWSA-N -1 3 356.474 3.538 20 0 FHADHM C[C@@H](NC(=O)N(C)C1CCC(C)(C)CC1)c1cccc(-c2nn[n-]n2)c1 ZINC000820341740 606719567 /nfs/dbraw/zinc/71/95/67/606719567.db2.gz RFDUSLVSFASLGD-CYBMUJFWSA-N -1 3 356.474 3.538 20 0 FHADHM Cc1ccc(CNc2ccc(-c3nn[n-]n3)cc2)c(OCC(F)(F)F)c1 ZINC000822238457 606726392 /nfs/dbraw/zinc/72/63/92/606726392.db2.gz IPFVTHVWNYRPBH-UHFFFAOYSA-N -1 3 363.343 3.728 20 0 FHADHM C[C@@H](OC(=O)CCCc1ccc(F)c(F)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820496686 606746854 /nfs/dbraw/zinc/74/68/54/606746854.db2.gz NYWRXNUJGTUTIM-GFCCVEGCSA-N -1 3 372.375 3.772 20 0 FHADHM C[C@@H](OC(=O)CCCc1ccc(F)c(F)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820496686 606746855 /nfs/dbraw/zinc/74/68/55/606746855.db2.gz NYWRXNUJGTUTIM-GFCCVEGCSA-N -1 3 372.375 3.772 20 0 FHADHM Cc1nc(C)c(-c2nnn[n-]2)c(S[C@H](C)CCSc2ccccc2)n1 ZINC000822427809 606769280 /nfs/dbraw/zinc/76/92/80/606769280.db2.gz VQQVBINABXELNL-LLVKDONJSA-N -1 3 372.523 3.937 20 0 FHADHM Cc1nc(C)c(-c2nn[n-]n2)c(S[C@H](C)CCSc2ccccc2)n1 ZINC000822427809 606769281 /nfs/dbraw/zinc/76/92/81/606769281.db2.gz VQQVBINABXELNL-LLVKDONJSA-N -1 3 372.523 3.937 20 0 FHADHM CC(C)N(C)C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000820112398 606771580 /nfs/dbraw/zinc/77/15/80/606771580.db2.gz STIXHXWODNTECK-UHFFFAOYSA-N -1 3 352.398 3.531 20 0 FHADHM CC(C)N(C)C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000820112398 606771581 /nfs/dbraw/zinc/77/15/81/606771581.db2.gz STIXHXWODNTECK-UHFFFAOYSA-N -1 3 352.398 3.531 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(OCc2coc(-c3ccccc3)n2)c1 ZINC000822574011 606781489 /nfs/dbraw/zinc/78/14/89/606781489.db2.gz MZLOYZZJIXKFFK-UHFFFAOYSA-N -1 3 353.769 3.754 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(OCc2coc(-c3ccccc3)n2)c1 ZINC000822574011 606781491 /nfs/dbraw/zinc/78/14/91/606781491.db2.gz MZLOYZZJIXKFFK-UHFFFAOYSA-N -1 3 353.769 3.754 20 0 FHADHM Cc1ccc(C)c([C@H]2CCCN2C(=O)Nc2cccc(-c3nnn[n-]3)c2)c1 ZINC000822230723 606783067 /nfs/dbraw/zinc/78/30/67/606783067.db2.gz OLPYGDNEARWXNF-GOSISDBHSA-N -1 3 362.437 3.853 20 0 FHADHM Cc1ccc(C)c([C@H]2CCCN2C(=O)Nc2cccc(-c3nn[n-]n3)c2)c1 ZINC000822230723 606783069 /nfs/dbraw/zinc/78/30/69/606783069.db2.gz OLPYGDNEARWXNF-GOSISDBHSA-N -1 3 362.437 3.853 20 0 FHADHM CC[C@@H](C)N(C)C(=O)c1ccc(Oc2ccc(-c3nnn[n-]3)cc2C)cc1 ZINC000820875706 606789384 /nfs/dbraw/zinc/78/93/84/606789384.db2.gz CUSSQOWSDBYXTF-CQSZACIVSA-N -1 3 365.437 3.838 20 0 FHADHM CC[C@@H](C)N(C)C(=O)c1ccc(Oc2ccc(-c3nn[n-]n3)cc2C)cc1 ZINC000820875706 606789386 /nfs/dbraw/zinc/78/93/86/606789386.db2.gz CUSSQOWSDBYXTF-CQSZACIVSA-N -1 3 365.437 3.838 20 0 FHADHM CCCC[C@H](NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)C1CCC1 ZINC000821043687 606794970 /nfs/dbraw/zinc/79/49/70/606794970.db2.gz SPIWEMWHEQWDHB-GUYCJALGSA-N -1 3 356.474 3.586 20 0 FHADHM CCCC[C@H](NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)C1CCC1 ZINC000821043687 606794972 /nfs/dbraw/zinc/79/49/72/606794972.db2.gz SPIWEMWHEQWDHB-GUYCJALGSA-N -1 3 356.474 3.586 20 0 FHADHM Cc1ccc(Cl)c(NC(=O)CSCc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000822239774 606809758 /nfs/dbraw/zinc/80/97/58/606809758.db2.gz DFHUZRCCWSWSLK-UHFFFAOYSA-N -1 3 373.869 3.700 20 0 FHADHM Cc1ccc(Cl)c(NC(=O)CSCc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000822239774 606809759 /nfs/dbraw/zinc/80/97/59/606809759.db2.gz DFHUZRCCWSWSLK-UHFFFAOYSA-N -1 3 373.869 3.700 20 0 FHADHM CC(C)CN(C(=O)c1ccc(-c2nnn[n-]2)cc1)c1ccc(Cl)cc1 ZINC000820081460 606811836 /nfs/dbraw/zinc/81/18/36/606811836.db2.gz HCKLVRRBHHYNFI-UHFFFAOYSA-N -1 3 355.829 3.823 20 0 FHADHM CC(C)CN(C(=O)c1ccc(-c2nn[n-]n2)cc1)c1ccc(Cl)cc1 ZINC000820081460 606811838 /nfs/dbraw/zinc/81/18/38/606811838.db2.gz HCKLVRRBHHYNFI-UHFFFAOYSA-N -1 3 355.829 3.823 20 0 FHADHM O=C(Nc1ccccc1CCC(F)(F)F)c1cccc(-c2nnn[n-]2)c1 ZINC000823372642 606815907 /nfs/dbraw/zinc/81/59/07/606815907.db2.gz IUACGLUAILYPAN-UHFFFAOYSA-N -1 3 361.327 3.614 20 0 FHADHM O=C(Nc1ccccc1CCC(F)(F)F)c1cccc(-c2nn[n-]n2)c1 ZINC000823372642 606815908 /nfs/dbraw/zinc/81/59/08/606815908.db2.gz IUACGLUAILYPAN-UHFFFAOYSA-N -1 3 361.327 3.614 20 0 FHADHM Cc1cc(F)c(C(=O)N(CC(C)C)c2ccc(-c3nnn[n-]3)cc2)cc1F ZINC000822202133 606861491 /nfs/dbraw/zinc/86/14/91/606861491.db2.gz MPBYVPDSPZOKIL-UHFFFAOYSA-N -1 3 371.391 3.756 20 0 FHADHM Cc1cc(F)c(C(=O)N(CC(C)C)c2ccc(-c3nn[n-]n3)cc2)cc1F ZINC000822202133 606861493 /nfs/dbraw/zinc/86/14/93/606861493.db2.gz MPBYVPDSPZOKIL-UHFFFAOYSA-N -1 3 371.391 3.756 20 0 FHADHM c1ccc2oc(SCCCOc3cccc(-c4nnn[n-]4)c3)nc2c1 ZINC000823762145 606866378 /nfs/dbraw/zinc/86/63/78/606866378.db2.gz KCRVZOSPHNKRPE-UHFFFAOYSA-N -1 3 353.407 3.569 20 0 FHADHM c1ccc2oc(SCCCOc3cccc(-c4nn[n-]n4)c3)nc2c1 ZINC000823762145 606866379 /nfs/dbraw/zinc/86/63/79/606866379.db2.gz KCRVZOSPHNKRPE-UHFFFAOYSA-N -1 3 353.407 3.569 20 0 FHADHM C[C@@H](Nc1ccc(C(F)(F)F)cc1-c1nnn[n-]1)c1nc2ccccc2[nH]1 ZINC000820456955 606924090 /nfs/dbraw/zinc/92/40/90/606924090.db2.gz XUQBJKSWGWCTDE-SECBINFHSA-N -1 3 373.342 3.935 20 0 FHADHM C[C@@H](Nc1ccc(C(F)(F)F)cc1-c1nn[n-]n1)c1nc2ccccc2[nH]1 ZINC000820456955 606924092 /nfs/dbraw/zinc/92/40/92/606924092.db2.gz XUQBJKSWGWCTDE-SECBINFHSA-N -1 3 373.342 3.935 20 0 FHADHM CN(C(=O)c1cc(F)c(Cl)cc1Cl)c1ccccc1-c1nnn[n-]1 ZINC000821573300 606971751 /nfs/dbraw/zinc/97/17/51/606971751.db2.gz JULDTNRVOJOEKJ-UHFFFAOYSA-N -1 3 366.183 3.589 20 0 FHADHM CN(C(=O)c1cc(F)c(Cl)cc1Cl)c1ccccc1-c1nn[n-]n1 ZINC000821573300 606971753 /nfs/dbraw/zinc/97/17/53/606971753.db2.gz JULDTNRVOJOEKJ-UHFFFAOYSA-N -1 3 366.183 3.589 20 0 FHADHM CN(C(=O)c1ccc(-c2ccccc2)cc1)c1ccccc1-c1nnn[n-]1 ZINC000821573476 606974005 /nfs/dbraw/zinc/97/40/05/606974005.db2.gz RHJGUEKTKBYYGH-UHFFFAOYSA-N -1 3 355.401 3.810 20 0 FHADHM CN(C(=O)c1ccc(-c2ccccc2)cc1)c1ccccc1-c1nn[n-]n1 ZINC000821573476 606974006 /nfs/dbraw/zinc/97/40/06/606974006.db2.gz RHJGUEKTKBYYGH-UHFFFAOYSA-N -1 3 355.401 3.810 20 0 FHADHM C[C@H](NC(=O)Cc1ccc(C(C)(C)C)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820334251 606991729 /nfs/dbraw/zinc/99/17/29/606991729.db2.gz MCITVYPNEXYWCF-AWEZNQCLSA-N -1 3 363.465 3.584 20 0 FHADHM C[C@H](NC(=O)Cc1ccc(C(C)(C)C)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820334251 606991730 /nfs/dbraw/zinc/99/17/30/606991730.db2.gz MCITVYPNEXYWCF-AWEZNQCLSA-N -1 3 363.465 3.584 20 0 FHADHM Cc1ccc(-c2nnc(SCc3ccc(F)c(-c4nnn[n-]4)c3)o2)cc1 ZINC000822215387 607006522 /nfs/dbraw/zinc/00/65/22/607006522.db2.gz YKMMMVCPXGYNOD-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM Cc1ccc(-c2nnc(SCc3ccc(F)c(-c4nn[n-]n4)c3)o2)cc1 ZINC000822215387 607006524 /nfs/dbraw/zinc/00/65/24/607006524.db2.gz YKMMMVCPXGYNOD-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM Cc1cc(C)cc(NC(=O)[C@@H](C)Sc2cccc(-c3nnn[n-]3)c2)c1 ZINC000822196624 607015506 /nfs/dbraw/zinc/01/55/06/607015506.db2.gz QJQCVYWVDLYVIG-CYBMUJFWSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1cc(C)cc(NC(=O)[C@@H](C)Sc2cccc(-c3nn[n-]n3)c2)c1 ZINC000822196624 607015507 /nfs/dbraw/zinc/01/55/07/607015507.db2.gz QJQCVYWVDLYVIG-CYBMUJFWSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)c1ccc(-c2ccco2)s1 ZINC000822220196 607017629 /nfs/dbraw/zinc/01/76/29/607017629.db2.gz HTPUXCAYHITIJY-UHFFFAOYSA-N -1 3 351.391 3.749 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)c1ccc(-c2ccco2)s1 ZINC000822220196 607017631 /nfs/dbraw/zinc/01/76/31/607017631.db2.gz HTPUXCAYHITIJY-UHFFFAOYSA-N -1 3 351.391 3.749 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1OCc1ncc(-c2ccc(F)cc2)o1 ZINC000822221288 607029857 /nfs/dbraw/zinc/02/98/57/607029857.db2.gz IQTCEUZBRHVYLV-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1OCc1ncc(-c2ccc(F)cc2)o1 ZINC000822221288 607029858 /nfs/dbraw/zinc/02/98/58/607029858.db2.gz IQTCEUZBRHVYLV-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)c(CSCc2nc(-c3cccs3)no2)c1 ZINC000822757854 607033491 /nfs/dbraw/zinc/03/34/91/607033491.db2.gz GGDILFBMGHRCTO-UHFFFAOYSA-N -1 3 374.426 3.551 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)c(CSCc2nc(-c3cccs3)no2)c1 ZINC000822757854 607033492 /nfs/dbraw/zinc/03/34/92/607033492.db2.gz GGDILFBMGHRCTO-UHFFFAOYSA-N -1 3 374.426 3.551 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)c(CSC[C@@H]2OCCc3ccccc32)c1 ZINC000822758480 607035704 /nfs/dbraw/zinc/03/57/04/607035704.db2.gz PPWHZLHFYKPBEL-KRWDZBQOSA-N -1 3 356.426 3.553 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)c(CSC[C@@H]2OCCc3ccccc32)c1 ZINC000822758480 607035706 /nfs/dbraw/zinc/03/57/06/607035706.db2.gz PPWHZLHFYKPBEL-KRWDZBQOSA-N -1 3 356.426 3.553 20 0 FHADHM CC[C@H](Cc1ccccc1)N(CC)C(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000820915255 607036136 /nfs/dbraw/zinc/03/61/36/607036136.db2.gz UNXSJZSAGDHNLK-GOSISDBHSA-N -1 3 364.453 3.742 20 0 FHADHM CC[C@H](Cc1ccccc1)N(CC)C(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000820915255 607036138 /nfs/dbraw/zinc/03/61/38/607036138.db2.gz UNXSJZSAGDHNLK-GOSISDBHSA-N -1 3 364.453 3.742 20 0 FHADHM C[C@@H]1CC[C@H](CC(=O)N(Cc2ccco2)c2ccccc2-c2nnn[n-]2)C1 ZINC000820684168 607054630 /nfs/dbraw/zinc/05/46/30/607054630.db2.gz MSNVAQSFBRCQJX-CABCVRRESA-N -1 3 365.437 3.819 20 0 FHADHM C[C@@H]1CC[C@H](CC(=O)N(Cc2ccco2)c2ccccc2-c2nn[n-]n2)C1 ZINC000820684168 607054631 /nfs/dbraw/zinc/05/46/31/607054631.db2.gz MSNVAQSFBRCQJX-CABCVRRESA-N -1 3 365.437 3.819 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CN[C@H]1CCCOc2c(Cl)cccc21 ZINC000822739686 607058217 /nfs/dbraw/zinc/05/82/17/607058217.db2.gz BUPKUDQTRDHZLF-INIZCTEOSA-N -1 3 373.819 3.663 20 0 FHADHM C[C@@H](NC(=O)N(C1CC1)C1CCC(C)CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820690028 607065068 /nfs/dbraw/zinc/06/50/68/607065068.db2.gz FPFSHVDQOYDGRQ-XOYHFGRZSA-N -1 3 368.485 3.680 20 0 FHADHM C[C@@H](NC(=O)N(C1CC1)C1CCC(C)CC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820690028 607065070 /nfs/dbraw/zinc/06/50/70/607065070.db2.gz FPFSHVDQOYDGRQ-XOYHFGRZSA-N -1 3 368.485 3.680 20 0 FHADHM O=C(CC/C=C/c1ccccc1)OCc1cc(F)ccc1-c1nnn[n-]1 ZINC000822954931 607084256 /nfs/dbraw/zinc/08/42/56/607084256.db2.gz FVLPAUZKDMPESB-XBXARRHUSA-N -1 3 352.369 3.543 20 0 FHADHM O=C(CC/C=C/c1ccccc1)OCc1cc(F)ccc1-c1nn[n-]n1 ZINC000822954931 607084258 /nfs/dbraw/zinc/08/42/58/607084258.db2.gz FVLPAUZKDMPESB-XBXARRHUSA-N -1 3 352.369 3.543 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NC(=O)CC/C=C\c1ccccc1 ZINC000821294014 607100542 /nfs/dbraw/zinc/10/05/42/607100542.db2.gz PJCNBQVEAPBSHJ-POHAHGRESA-N -1 3 362.437 3.731 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cc2ccccc2s1 ZINC000821305113 607101069 /nfs/dbraw/zinc/10/10/69/607101069.db2.gz XOFJMNFCQRLBNI-UHFFFAOYSA-N -1 3 364.434 3.766 20 0 FHADHM C[C@@H]1CN(c2c(Cl)cccc2-c2nnn[n-]2)C[C@H](c2ccsc2)O1 ZINC000820768744 607115987 /nfs/dbraw/zinc/11/59/87/607115987.db2.gz PBYVUYMOBVOBTI-QMTHXVAHSA-N -1 3 361.858 3.548 20 0 FHADHM C[C@@H]1CN(c2c(Cl)cccc2-c2nn[n-]n2)C[C@H](c2ccsc2)O1 ZINC000820768744 607115988 /nfs/dbraw/zinc/11/59/88/607115988.db2.gz PBYVUYMOBVOBTI-QMTHXVAHSA-N -1 3 361.858 3.548 20 0 FHADHM COc1cccc2c1CC[C@H]2Nc1nc2ccccc2cc1-c1nnn[n-]1 ZINC000821877648 607119343 /nfs/dbraw/zinc/11/93/43/607119343.db2.gz ORODLXFRXIWFCB-QGZVFWFLSA-N -1 3 358.405 3.523 20 0 FHADHM COc1cccc2c1CC[C@H]2Nc1nc2ccccc2cc1-c1nn[n-]n1 ZINC000821877648 607119345 /nfs/dbraw/zinc/11/93/45/607119345.db2.gz ORODLXFRXIWFCB-QGZVFWFLSA-N -1 3 358.405 3.523 20 0 FHADHM Cc1ccc(-c2nnc([C@H](C)Oc3ccc(-c4nnn[n-]4)cc3F)o2)cc1 ZINC000822213844 607132978 /nfs/dbraw/zinc/13/29/78/607132978.db2.gz CVCNXLJEMVHXIO-NSHDSACASA-N -1 3 366.356 3.504 20 0 FHADHM Cc1ccc(-c2nnc([C@H](C)Oc3ccc(-c4nn[n-]n4)cc3F)o2)cc1 ZINC000822213844 607132980 /nfs/dbraw/zinc/13/29/80/607132980.db2.gz CVCNXLJEMVHXIO-NSHDSACASA-N -1 3 366.356 3.504 20 0 FHADHM Cc1ccc(-c2nc(COc3ccc(-c4nnn[n-]4)cc3F)cs2)o1 ZINC000822214241 607135101 /nfs/dbraw/zinc/13/51/01/607135101.db2.gz VZCPFSOREUATIK-UHFFFAOYSA-N -1 3 357.370 3.610 20 0 FHADHM Cc1ccc(-c2nc(COc3ccc(-c4nn[n-]n4)cc3F)cs2)o1 ZINC000822214241 607135102 /nfs/dbraw/zinc/13/51/02/607135102.db2.gz VZCPFSOREUATIK-UHFFFAOYSA-N -1 3 357.370 3.610 20 0 FHADHM Cc1ccc(-c2cc(COc3ccc(-c4nnn[n-]4)cc3F)on2)cc1 ZINC000822214081 607138239 /nfs/dbraw/zinc/13/82/39/607138239.db2.gz OKXDMXFUGJLZTH-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM Cc1ccc(-c2cc(COc3ccc(-c4nn[n-]n4)cc3F)on2)cc1 ZINC000822214081 607138240 /nfs/dbraw/zinc/13/82/40/607138240.db2.gz OKXDMXFUGJLZTH-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM CC(C)CC[C@H]1CCCN1C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820072268 607152932 /nfs/dbraw/zinc/15/29/32/607152932.db2.gz DDXKOSLTOIPXDV-WMLDXEAASA-N -1 3 356.474 3.538 20 0 FHADHM CC(C)CC[C@H]1CCCN1C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820072268 607152933 /nfs/dbraw/zinc/15/29/33/607152933.db2.gz DDXKOSLTOIPXDV-WMLDXEAASA-N -1 3 356.474 3.538 20 0 FHADHM Cc1ccccc1[C@H](C)OC(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000822345724 607158651 /nfs/dbraw/zinc/15/86/51/607158651.db2.gz QAOBAZQFIYPHHM-AWEZNQCLSA-N -1 3 368.462 3.713 20 0 FHADHM Cc1ccccc1[C@H](C)OC(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000822345724 607158653 /nfs/dbraw/zinc/15/86/53/607158653.db2.gz QAOBAZQFIYPHHM-AWEZNQCLSA-N -1 3 368.462 3.713 20 0 FHADHM Fc1ccccc1-c1nc(COc2ccc(-c3nnn[n-]3)cc2F)cs1 ZINC000822748390 607171626 /nfs/dbraw/zinc/17/16/26/607171626.db2.gz WUAHCHQKNKXFOU-UHFFFAOYSA-N -1 3 371.372 3.847 20 0 FHADHM Fc1ccccc1-c1nc(COc2ccc(-c3nn[n-]n3)cc2F)cs1 ZINC000822748390 607171627 /nfs/dbraw/zinc/17/16/27/607171627.db2.gz WUAHCHQKNKXFOU-UHFFFAOYSA-N -1 3 371.372 3.847 20 0 FHADHM CC(C)n1cc([C@H](C)Nc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)cn1 ZINC000820457301 607173460 /nfs/dbraw/zinc/17/34/60/607173460.db2.gz ZNXUFETXOMGCLS-JTQLQIEISA-N -1 3 365.363 3.836 20 0 FHADHM CC(C)n1cc([C@H](C)Nc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)cn1 ZINC000820457301 607173461 /nfs/dbraw/zinc/17/34/61/607173461.db2.gz ZNXUFETXOMGCLS-JTQLQIEISA-N -1 3 365.363 3.836 20 0 FHADHM C[C@@H](CCc1ccccc1F)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820254411 607189879 /nfs/dbraw/zinc/18/98/79/607189879.db2.gz PFUJDYYTGPWHEX-NSHDSACASA-N -1 3 373.819 3.867 20 0 FHADHM C[C@@H](CCc1ccccc1F)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820254411 607189880 /nfs/dbraw/zinc/18/98/80/607189880.db2.gz PFUJDYYTGPWHEX-NSHDSACASA-N -1 3 373.819 3.867 20 0 FHADHM Cc1cccc(OCCC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)c1C ZINC000822329011 607190031 /nfs/dbraw/zinc/19/00/31/607190031.db2.gz WVZSIGDPSPEEOF-UHFFFAOYSA-N -1 3 371.828 3.545 20 0 FHADHM Cc1cccc(OCCC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)c1C ZINC000822329011 607190032 /nfs/dbraw/zinc/19/00/32/607190032.db2.gz WVZSIGDPSPEEOF-UHFFFAOYSA-N -1 3 371.828 3.545 20 0 FHADHM Cc1ccccc1[C@H](C)CC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822345931 607190941 /nfs/dbraw/zinc/19/09/41/607190941.db2.gz WXKPFXJGCDYMMO-GFCCVEGCSA-N -1 3 355.829 3.961 20 0 FHADHM Cc1ccccc1[C@H](C)CC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822345931 607190942 /nfs/dbraw/zinc/19/09/42/607190942.db2.gz WXKPFXJGCDYMMO-GFCCVEGCSA-N -1 3 355.829 3.961 20 0 FHADHM C[C@@H](c1ccc(F)cc1)N(C)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820563617 607195549 /nfs/dbraw/zinc/19/55/49/607195549.db2.gz SFNNMDRGBIGCPL-JTQLQIEISA-N -1 3 374.807 3.884 20 0 FHADHM C[C@@H](c1ccc(F)cc1)N(C)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820563617 607195550 /nfs/dbraw/zinc/19/55/50/607195550.db2.gz SFNNMDRGBIGCPL-JTQLQIEISA-N -1 3 374.807 3.884 20 0 FHADHM C[C@H]1Cc2ccccc2[C@@H]1NC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820813640 607195609 /nfs/dbraw/zinc/19/56/09/607195609.db2.gz LIGRLLDLZOLYMV-MGPLVRAMSA-N -1 3 368.828 3.575 20 0 FHADHM C[C@H]1Cc2ccccc2[C@@H]1NC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820813640 607195610 /nfs/dbraw/zinc/19/56/10/607195610.db2.gz LIGRLLDLZOLYMV-MGPLVRAMSA-N -1 3 368.828 3.575 20 0 FHADHM C[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820675221 607196317 /nfs/dbraw/zinc/19/63/17/607196317.db2.gz ILFMIEVKTBFXJG-ZETOZRRWSA-N -1 3 360.849 3.705 20 0 FHADHM C[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820675221 607196318 /nfs/dbraw/zinc/19/63/18/607196318.db2.gz ILFMIEVKTBFXJG-ZETOZRRWSA-N -1 3 360.849 3.705 20 0 FHADHM Cc1ccc2c(c1)CC[C@@H]2NC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822274604 607196715 /nfs/dbraw/zinc/19/67/15/607196715.db2.gz CLZTWPZFLUBVJZ-HNNXBMFYSA-N -1 3 368.828 3.638 20 0 FHADHM Cc1ccc2c(c1)CC[C@@H]2NC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822274604 607196716 /nfs/dbraw/zinc/19/67/16/607196716.db2.gz CLZTWPZFLUBVJZ-HNNXBMFYSA-N -1 3 368.828 3.638 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N[C@@H]1CC[C@H]2CCC[C@H]2C1 ZINC000823319393 607196962 /nfs/dbraw/zinc/19/69/62/607196962.db2.gz TXORGEXYJPLEMP-NTZNESFSSA-N -1 3 360.849 3.610 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N[C@@H]1CC[C@H]2CCC[C@H]2C1 ZINC000823319393 607196963 /nfs/dbraw/zinc/19/69/63/607196963.db2.gz TXORGEXYJPLEMP-NTZNESFSSA-N -1 3 360.849 3.610 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N1CCC[C@H]1c1cccs1 ZINC000823315542 607197778 /nfs/dbraw/zinc/19/77/78/607197778.db2.gz ZDRMWWOWQFNGQU-ZDUSSCGKSA-N -1 3 374.857 3.951 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N1CCC[C@H]1c1cccs1 ZINC000823315542 607197779 /nfs/dbraw/zinc/19/77/79/607197779.db2.gz ZDRMWWOWQFNGQU-ZDUSSCGKSA-N -1 3 374.857 3.951 20 0 FHADHM CC[C@H](c1ccncc1)N(C)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820945782 607201409 /nfs/dbraw/zinc/20/14/09/607201409.db2.gz VMXKDLLHZYXODZ-OAHLLOKOSA-N -1 3 371.832 3.530 20 0 FHADHM CC[C@H](c1ccncc1)N(C)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820945782 607201410 /nfs/dbraw/zinc/20/14/10/607201410.db2.gz VMXKDLLHZYXODZ-OAHLLOKOSA-N -1 3 371.832 3.530 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N[C@@H]1CCCc2ccccc21 ZINC000823319732 607201520 /nfs/dbraw/zinc/20/15/20/607201520.db2.gz YAWIUIVBMJAUGH-OAHLLOKOSA-N -1 3 368.828 3.719 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N[C@@H]1CCCc2ccccc21 ZINC000823319732 607201521 /nfs/dbraw/zinc/20/15/21/607201521.db2.gz YAWIUIVBMJAUGH-OAHLLOKOSA-N -1 3 368.828 3.719 20 0 FHADHM CCc1cc(C)c(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCC3)o1 ZINC000821470010 607235515 /nfs/dbraw/zinc/23/55/15/607235515.db2.gz KVPCUGRMWQKUDE-UHFFFAOYSA-N -1 3 357.439 3.523 20 0 FHADHM CCc1cc(C)c(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCC3)o1 ZINC000821470010 607235516 /nfs/dbraw/zinc/23/55/16/607235516.db2.gz KVPCUGRMWQKUDE-UHFFFAOYSA-N -1 3 357.439 3.523 20 0 FHADHM Cc1ccc(SCC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)c(C)c1 ZINC000822266471 607242266 /nfs/dbraw/zinc/24/22/66/607242266.db2.gz ASKIKZCJDFMETC-UHFFFAOYSA-N -1 3 373.869 3.868 20 0 FHADHM Cc1ccc(SCC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)c(C)c1 ZINC000822266471 607242267 /nfs/dbraw/zinc/24/22/67/607242267.db2.gz ASKIKZCJDFMETC-UHFFFAOYSA-N -1 3 373.869 3.868 20 0 FHADHM O=C(Oc1ccc(-c2nnn[n-]2)cc1F)c1cccc(Cl)c1Cl ZINC000823449811 607244748 /nfs/dbraw/zinc/24/47/48/607244748.db2.gz DTLCDWBKVJZQPO-UHFFFAOYSA-N -1 3 353.140 3.532 20 0 FHADHM O=C(Oc1ccc(-c2nn[n-]n2)cc1F)c1cccc(Cl)c1Cl ZINC000823449811 607244749 /nfs/dbraw/zinc/24/47/49/607244749.db2.gz DTLCDWBKVJZQPO-UHFFFAOYSA-N -1 3 353.140 3.532 20 0 FHADHM O=C(Oc1ccc(-c2nnn[n-]2)cc1F)c1cc(Cl)sc1Cl ZINC000823449975 607249282 /nfs/dbraw/zinc/24/92/82/607249282.db2.gz GTAFQMNUADZKRY-UHFFFAOYSA-N -1 3 359.169 3.593 20 0 FHADHM O=C(Oc1ccc(-c2nn[n-]n2)cc1F)c1cc(Cl)sc1Cl ZINC000823449975 607249283 /nfs/dbraw/zinc/24/92/83/607249283.db2.gz GTAFQMNUADZKRY-UHFFFAOYSA-N -1 3 359.169 3.593 20 0 FHADHM O=C(Nc1sccc1-c1nnn[n-]1)c1ccc(CCC(F)(F)F)cc1 ZINC000826461322 607783450 /nfs/dbraw/zinc/78/34/50/607783450.db2.gz PRXFVRREQVLXQN-UHFFFAOYSA-N -1 3 367.356 3.675 20 0 FHADHM O=C(Nc1sccc1-c1nn[n-]n1)c1ccc(CCC(F)(F)F)cc1 ZINC000826461322 607783451 /nfs/dbraw/zinc/78/34/51/607783451.db2.gz PRXFVRREQVLXQN-UHFFFAOYSA-N -1 3 367.356 3.675 20 0 FHADHM C[C@H]1CC[C@@H](NC(=S)Nc2ccccc2-c2nnn[n-]2)c2ccccc21 ZINC000824917797 607783656 /nfs/dbraw/zinc/78/36/56/607783656.db2.gz NQYCKVVNEWICRG-YVEFUNNKSA-N -1 3 364.478 3.792 20 0 FHADHM C[C@H]1CC[C@@H](NC(=S)Nc2ccccc2-c2nn[n-]n2)c2ccccc21 ZINC000824917797 607783657 /nfs/dbraw/zinc/78/36/57/607783657.db2.gz NQYCKVVNEWICRG-YVEFUNNKSA-N -1 3 364.478 3.792 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@H]2C(=O)N(C)c2ccccc2-c2nnn[n-]2)cc1 ZINC000824347834 607787829 /nfs/dbraw/zinc/78/78/29/607787829.db2.gz PCCMTZNSIBJVLD-ZWKOTPCHSA-N -1 3 361.449 3.757 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@H]2C(=O)N(C)c2ccccc2-c2nn[n-]n2)cc1 ZINC000824347834 607787830 /nfs/dbraw/zinc/78/78/30/607787830.db2.gz PCCMTZNSIBJVLD-ZWKOTPCHSA-N -1 3 361.449 3.757 20 0 FHADHM Cc1cc(Cl)c(NC(=O)c2cc(-c3nnn[n-]3)cs2)cc1Cl ZINC000826267387 607791727 /nfs/dbraw/zinc/79/17/27/607791727.db2.gz CTYXSICHAJHQAF-UHFFFAOYSA-N -1 3 354.222 3.796 20 0 FHADHM Cc1cc(Cl)c(NC(=O)c2cc(-c3nn[n-]n3)cs2)cc1Cl ZINC000826267387 607791728 /nfs/dbraw/zinc/79/17/28/607791728.db2.gz CTYXSICHAJHQAF-UHFFFAOYSA-N -1 3 354.222 3.796 20 0 FHADHM O=C(c1cc(-c2nnn[n-]2)cs1)N(CC1CCCCC1)c1ccccn1 ZINC000826470184 607791846 /nfs/dbraw/zinc/79/18/46/607791846.db2.gz GWLSBPNGYXTJGA-UHFFFAOYSA-N -1 3 368.466 3.550 20 0 FHADHM O=C(c1cc(-c2nn[n-]n2)cs1)N(CC1CCCCC1)c1ccccn1 ZINC000826470184 607791847 /nfs/dbraw/zinc/79/18/47/607791847.db2.gz GWLSBPNGYXTJGA-UHFFFAOYSA-N -1 3 368.466 3.550 20 0 FHADHM CC1(CC(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(F)F)CCCCC1 ZINC000824816811 607793900 /nfs/dbraw/zinc/79/39/00/607793900.db2.gz IHTWZPXGAHJUPV-UHFFFAOYSA-N -1 3 365.384 3.767 20 0 FHADHM CC1(CC(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(F)F)CCCCC1 ZINC000824816811 607793901 /nfs/dbraw/zinc/79/39/01/607793901.db2.gz IHTWZPXGAHJUPV-UHFFFAOYSA-N -1 3 365.384 3.767 20 0 FHADHM Cc1ccc(Cl)cc1C(=O)Nc1ccc(OC(C)C)c(-c2nnn[n-]2)c1 ZINC000826289124 607794963 /nfs/dbraw/zinc/79/49/63/607794963.db2.gz LERZLEDYDNOSPY-UHFFFAOYSA-N -1 3 371.828 3.868 20 0 FHADHM Cc1ccc(Cl)cc1C(=O)Nc1ccc(OC(C)C)c(-c2nn[n-]n2)c1 ZINC000826289124 607794964 /nfs/dbraw/zinc/79/49/64/607794964.db2.gz LERZLEDYDNOSPY-UHFFFAOYSA-N -1 3 371.828 3.868 20 0 FHADHM CCSCc1ccc(C(=O)N(CC)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000825675119 607797800 /nfs/dbraw/zinc/79/78/00/607797800.db2.gz WLQSYGWDGGESLX-UHFFFAOYSA-N -1 3 367.478 3.787 20 0 FHADHM CCSCc1ccc(C(=O)N(CC)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000825675119 607797801 /nfs/dbraw/zinc/79/78/01/607797801.db2.gz WLQSYGWDGGESLX-UHFFFAOYSA-N -1 3 367.478 3.787 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NCc1cnoc1-c1ccco1 ZINC000824324739 607813602 /nfs/dbraw/zinc/81/36/02/607813602.db2.gz TVRTYAZVFVAWPV-UHFFFAOYSA-N -1 3 366.381 3.514 20 0 FHADHM CC(C)(C)SCCCC(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000824124464 607815192 /nfs/dbraw/zinc/81/51/92/607815192.db2.gz UCXQPTUCDWTQGT-UHFFFAOYSA-N -1 3 353.879 3.771 20 0 FHADHM CC(C)(C)SCCCC(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000824124464 607815193 /nfs/dbraw/zinc/81/51/93/607815193.db2.gz UCXQPTUCDWTQGT-UHFFFAOYSA-N -1 3 353.879 3.771 20 0 FHADHM CC(C)(C)SCCCC(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000824124203 607826092 /nfs/dbraw/zinc/82/60/92/607826092.db2.gz QHSQFSPXRPVZNA-UHFFFAOYSA-N -1 3 353.879 3.771 20 0 FHADHM CC(C)(C)SCCCC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000824124203 607826093 /nfs/dbraw/zinc/82/60/93/607826093.db2.gz QHSQFSPXRPVZNA-UHFFFAOYSA-N -1 3 353.879 3.771 20 0 FHADHM CCc1ccc(NC(=O)c2c(Cl)cc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000825712375 607832813 /nfs/dbraw/zinc/83/28/13/607832813.db2.gz POFUUXFDXAJQDZ-UHFFFAOYSA-N -1 3 362.220 3.988 20 0 FHADHM CCc1ccc(NC(=O)c2c(Cl)cc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000825712375 607832812 /nfs/dbraw/zinc/83/28/12/607832812.db2.gz POFUUXFDXAJQDZ-UHFFFAOYSA-N -1 3 362.220 3.988 20 0 FHADHM CC[C@H](C)NC(=O)[C@@H](Sc1ccc(-c2nnn[n-]2)cc1Cl)C(C)C ZINC000825069311 607844579 /nfs/dbraw/zinc/84/45/79/607844579.db2.gz ZYPKZIUUEJHDRK-HZMBPMFUSA-N -1 3 367.906 3.552 20 0 FHADHM CC[C@H](C)NC(=O)[C@@H](Sc1ccc(-c2nn[n-]n2)cc1Cl)C(C)C ZINC000825069311 607844580 /nfs/dbraw/zinc/84/45/80/607844580.db2.gz ZYPKZIUUEJHDRK-HZMBPMFUSA-N -1 3 367.906 3.552 20 0 FHADHM CCN(C(=O)c1ccc(C)c(OC)c1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825379089 607879028 /nfs/dbraw/zinc/87/90/28/607879028.db2.gz AFIQZVQMBZOLGI-UHFFFAOYSA-N -1 3 371.828 3.504 20 0 FHADHM CCN(C(=O)c1ccc(C)c(OC)c1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825379089 607879029 /nfs/dbraw/zinc/87/90/29/607879029.db2.gz AFIQZVQMBZOLGI-UHFFFAOYSA-N -1 3 371.828 3.504 20 0 FHADHM CCN(C(=O)[C@@H]1CCCC(C)(C)C1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825367216 607885840 /nfs/dbraw/zinc/88/58/40/607885840.db2.gz LEIFTEOJDFMKRE-WMLDXEAASA-N -1 3 355.486 3.993 20 0 FHADHM CCN(C(=O)[C@@H]1CCCC(C)(C)C1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825367216 607885841 /nfs/dbraw/zinc/88/58/41/607885841.db2.gz LEIFTEOJDFMKRE-WMLDXEAASA-N -1 3 355.486 3.993 20 0 FHADHM CC(C)[C@@H](C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccc(F)cc1 ZINC000824183980 607893759 /nfs/dbraw/zinc/89/37/59/607893759.db2.gz ABVAGPSZQQWKRG-MRXNPFEDSA-N -1 3 357.364 3.523 20 0 FHADHM CC(C)[C@@H](C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccc(F)cc1 ZINC000824183980 607893760 /nfs/dbraw/zinc/89/37/60/607893760.db2.gz ABVAGPSZQQWKRG-MRXNPFEDSA-N -1 3 357.364 3.523 20 0 FHADHM CN(C(=O)[C@@H]1CC[C@H]2CCCC[C@@H]2C1)c1ccc(-c2nnn[n-]2)cc1F ZINC000825812917 607926405 /nfs/dbraw/zinc/92/64/05/607926405.db2.gz XNQFFIURZAAYRE-UMVBOHGHSA-N -1 3 357.433 3.575 20 0 FHADHM CN(C(=O)[C@@H]1CC[C@H]2CCCC[C@@H]2C1)c1ccc(-c2nn[n-]n2)cc1F ZINC000825812917 607926406 /nfs/dbraw/zinc/92/64/06/607926406.db2.gz XNQFFIURZAAYRE-UMVBOHGHSA-N -1 3 357.433 3.575 20 0 FHADHM Cc1cc(C)c2ncc(-c3nnn[n-]3)c(N3CC=C(C(F)(F)F)CC3)c2c1 ZINC000826263434 607935670 /nfs/dbraw/zinc/93/56/70/607935670.db2.gz BLVMOQILTIZQCH-UHFFFAOYSA-N -1 3 374.370 3.731 20 0 FHADHM Cc1cc(C)c2ncc(-c3nn[n-]n3)c(N3CC=C(C(F)(F)F)CC3)c2c1 ZINC000826263434 607935671 /nfs/dbraw/zinc/93/56/71/607935671.db2.gz BLVMOQILTIZQCH-UHFFFAOYSA-N -1 3 374.370 3.731 20 0 FHADHM CCc1nc2sccc2c(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)n1 ZINC000825750701 607964789 /nfs/dbraw/zinc/96/47/89/607964789.db2.gz VTICIBALQDEINQ-JTQLQIEISA-N -1 3 351.439 3.607 20 0 FHADHM CCc1nc2sccc2c(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)n1 ZINC000825750701 607964790 /nfs/dbraw/zinc/96/47/90/607964790.db2.gz VTICIBALQDEINQ-JTQLQIEISA-N -1 3 351.439 3.607 20 0 FHADHM Cc1nnc(SCc2ccccc2-c2nnn[n-]2)n1[C@H]1CCC[C@@H](C)C1 ZINC000826337320 607965706 /nfs/dbraw/zinc/96/57/06/607965706.db2.gz KJODEMHKRMVHMC-DOMZBBRYSA-N -1 3 369.498 3.810 20 0 FHADHM Cc1nnc(SCc2ccccc2-c2nn[n-]n2)n1[C@H]1CCC[C@@H](C)C1 ZINC000826337320 607965707 /nfs/dbraw/zinc/96/57/07/607965707.db2.gz KJODEMHKRMVHMC-DOMZBBRYSA-N -1 3 369.498 3.810 20 0 FHADHM Cn1cc(-c2ccccc2CNc2c(Cl)cccc2-c2nnn[n-]2)cn1 ZINC000826356469 607966532 /nfs/dbraw/zinc/96/65/32/607966532.db2.gz SCKRLLWTIVGPFD-UHFFFAOYSA-N -1 3 365.828 3.533 20 0 FHADHM Cn1cc(-c2ccccc2CNc2c(Cl)cccc2-c2nn[n-]n2)cn1 ZINC000826356469 607966533 /nfs/dbraw/zinc/96/65/33/607966533.db2.gz SCKRLLWTIVGPFD-UHFFFAOYSA-N -1 3 365.828 3.533 20 0 FHADHM Cc1cc([C@H](NC(=O)Nc2ccc(-c3nnn[n-]3)cc2)C2CC2)ccc1F ZINC000826262680 607977540 /nfs/dbraw/zinc/97/75/40/607977540.db2.gz VLHCJIDEAHVDTD-QGZVFWFLSA-N -1 3 366.400 3.587 20 0 FHADHM Cc1cc([C@H](NC(=O)Nc2ccc(-c3nn[n-]n3)cc2)C2CC2)ccc1F ZINC000826262680 607977541 /nfs/dbraw/zinc/97/75/41/607977541.db2.gz VLHCJIDEAHVDTD-QGZVFWFLSA-N -1 3 366.400 3.587 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000823944016 607986017 /nfs/dbraw/zinc/98/60/17/607986017.db2.gz WXIQPJSOPRZNJS-KXXVWKPMSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000823944016 607986018 /nfs/dbraw/zinc/98/60/18/607986018.db2.gz WXIQPJSOPRZNJS-KXXVWKPMSA-N -1 3 367.840 3.801 20 0 FHADHM O=C(Oc1ccc(-c2nnn[n-]2)cc1)c1ccccc1CCC(F)(F)F ZINC000826468413 607986087 /nfs/dbraw/zinc/98/60/87/607986087.db2.gz PGHJVOKCRPRRQV-UHFFFAOYSA-N -1 3 362.311 3.581 20 0 FHADHM O=C(Oc1ccc(-c2nn[n-]n2)cc1)c1ccccc1CCC(F)(F)F ZINC000826468413 607986088 /nfs/dbraw/zinc/98/60/88/607986088.db2.gz PGHJVOKCRPRRQV-UHFFFAOYSA-N -1 3 362.311 3.581 20 0 FHADHM C[C@@H](NC(=O)c1cccc(-c2ccoc2)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824521238 608025671 /nfs/dbraw/zinc/02/56/71/608025671.db2.gz IOBZYYJIQVFGDH-CYBMUJFWSA-N -1 3 359.389 3.618 20 0 FHADHM C[C@@H](NC(=O)c1cccc(-c2ccoc2)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824521238 608025672 /nfs/dbraw/zinc/02/56/72/608025672.db2.gz IOBZYYJIQVFGDH-CYBMUJFWSA-N -1 3 359.389 3.618 20 0 FHADHM COc1cccc([C@@H](C)Nc2ccc(-c3nn[n-]n3)cc2Br)c1 ZINC000826214563 608047832 /nfs/dbraw/zinc/04/78/32/608047832.db2.gz PRBCQXVEAVCUDG-SNVBAGLBSA-N -1 3 374.242 3.811 20 0 FHADHM COc1cccc([C@H](C)Nc2ccc(-c3nn[n-]n3)cc2Br)c1 ZINC000826214562 608047995 /nfs/dbraw/zinc/04/79/95/608047995.db2.gz PRBCQXVEAVCUDG-JTQLQIEISA-N -1 3 374.242 3.811 20 0 FHADHM Cc1ccc(CNc2ccc(-c3nn[n-]n3)cc2Br)s1 ZINC000826288763 608048190 /nfs/dbraw/zinc/04/81/90/608048190.db2.gz VODBYPDQXDGDJC-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM Brc1cc(-c2nn[n-]n2)ccc1N1CCC[C@@H]1c1ccco1 ZINC000823826537 608050030 /nfs/dbraw/zinc/05/00/30/608050030.db2.gz KYZCJLBFNZLHII-CYBMUJFWSA-N -1 3 360.215 3.564 20 0 FHADHM Fc1cc(F)c2ncc(-c3nnn[n-]3)c(NC3CCC(F)(F)CC3)c2c1 ZINC000826372715 608053521 /nfs/dbraw/zinc/05/35/21/608053521.db2.gz IOXBJYNXVCRIMG-UHFFFAOYSA-N -1 3 366.322 3.683 20 0 FHADHM Fc1cc(F)c2ncc(-c3nn[n-]n3)c(NC3CCC(F)(F)CC3)c2c1 ZINC000826372715 608053522 /nfs/dbraw/zinc/05/35/22/608053522.db2.gz IOXBJYNXVCRIMG-UHFFFAOYSA-N -1 3 366.322 3.683 20 0 FHADHM O=C(OCc1cccc(-c2nnn[n-]2)c1)c1sccc1-c1ccccc1 ZINC000826465996 608063378 /nfs/dbraw/zinc/06/33/78/608063378.db2.gz LGBPCUJQOFLJHD-UHFFFAOYSA-N -1 3 362.414 3.952 20 0 FHADHM O=C(OCc1cccc(-c2nn[n-]n2)c1)c1sccc1-c1ccccc1 ZINC000826465996 608063379 /nfs/dbraw/zinc/06/33/79/608063379.db2.gz LGBPCUJQOFLJHD-UHFFFAOYSA-N -1 3 362.414 3.952 20 0 FHADHM O=C(OCc1ccc(-c2nnn[n-]2)cc1)c1sccc1-c1ccccc1 ZINC000826464703 608065147 /nfs/dbraw/zinc/06/51/47/608065147.db2.gz IXIKDGVJWDBSKV-UHFFFAOYSA-N -1 3 362.414 3.952 20 0 FHADHM O=C(OCc1ccc(-c2nn[n-]n2)cc1)c1sccc1-c1ccccc1 ZINC000826464703 608065148 /nfs/dbraw/zinc/06/51/48/608065148.db2.gz IXIKDGVJWDBSKV-UHFFFAOYSA-N -1 3 362.414 3.952 20 0 FHADHM OCCCCCCOc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000826510100 608095574 /nfs/dbraw/zinc/09/55/74/608095574.db2.gz XYBHCMXDOJVNIL-UHFFFAOYSA-N -1 3 354.410 3.591 20 0 FHADHM OCCCCCCOc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000826510100 608095575 /nfs/dbraw/zinc/09/55/75/608095575.db2.gz XYBHCMXDOJVNIL-UHFFFAOYSA-N -1 3 354.410 3.591 20 0 FHADHM CC[C@@H](C)n1ncc(Nc2ncc(-c3nnn[n-]3)cc2Cl)c1C1CC1 ZINC000825080919 608098532 /nfs/dbraw/zinc/09/85/32/608098532.db2.gz DCSSXGILLYHWHP-SECBINFHSA-N -1 3 358.837 3.704 20 0 FHADHM CC[C@@H](C)n1ncc(Nc2ncc(-c3nn[n-]n3)cc2Cl)c1C1CC1 ZINC000825080919 608098533 /nfs/dbraw/zinc/09/85/33/608098533.db2.gz DCSSXGILLYHWHP-SECBINFHSA-N -1 3 358.837 3.704 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N[C@H]1c2ccccc2CC[C@H]1C ZINC000826278121 608105756 /nfs/dbraw/zinc/10/57/56/608105756.db2.gz RMDJRQGRCCHYGR-FZKQIMNGSA-N -1 3 362.437 3.620 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N[C@H]1c2ccccc2CC[C@H]1C ZINC000826278121 608105757 /nfs/dbraw/zinc/10/57/57/608105757.db2.gz RMDJRQGRCCHYGR-FZKQIMNGSA-N -1 3 362.437 3.620 20 0 FHADHM COc1ccc(CNc2ccc(Cl)c(-c3nnn[n-]3)c2)cc1Cl ZINC000826203898 608110288 /nfs/dbraw/zinc/11/02/88/608110288.db2.gz LCOAFFXMTHMCLC-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM COc1ccc(CNc2ccc(Cl)c(-c3nn[n-]n3)c2)cc1Cl ZINC000826203898 608110289 /nfs/dbraw/zinc/11/02/89/608110289.db2.gz LCOAFFXMTHMCLC-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)c1cccc(SCC)c1 ZINC000825626064 608119919 /nfs/dbraw/zinc/11/99/19/608119919.db2.gz HCEALXMBOOHCIL-UHFFFAOYSA-N -1 3 369.450 3.630 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cccc(SCC)c1 ZINC000825626064 608119920 /nfs/dbraw/zinc/11/99/20/608119920.db2.gz HCEALXMBOOHCIL-UHFFFAOYSA-N -1 3 369.450 3.630 20 0 FHADHM COc1ccccc1[C@H]1CCCCN1c1cccc(F)c1-c1nnn[n-]1 ZINC000826218893 608124179 /nfs/dbraw/zinc/12/41/79/608124179.db2.gz NQBKNOKEZHPYCF-OAHLLOKOSA-N -1 3 353.401 3.746 20 0 FHADHM COc1ccccc1[C@H]1CCCCN1c1cccc(F)c1-c1nn[n-]n1 ZINC000826218893 608124180 /nfs/dbraw/zinc/12/41/80/608124180.db2.gz NQBKNOKEZHPYCF-OAHLLOKOSA-N -1 3 353.401 3.746 20 0 FHADHM C[C@@H](OC(=O)[C@H]1SCCc2ccccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000824716659 608182008 /nfs/dbraw/zinc/18/20/08/608182008.db2.gz ZWJPTLYZKUATET-PXAZEXFGSA-N -1 3 366.446 3.502 20 0 FHADHM C[C@@H](OC(=O)[C@H]1SCCc2ccccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000824716659 608182011 /nfs/dbraw/zinc/18/20/11/608182011.db2.gz ZWJPTLYZKUATET-PXAZEXFGSA-N -1 3 366.446 3.502 20 0 FHADHM C[C@@H](OC(=O)[C@@H]1CCCc2sccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000824714960 608182100 /nfs/dbraw/zinc/18/21/00/608182100.db2.gz PSJMOYGMWMCPDV-IAQYHMDHSA-N -1 3 354.435 3.653 20 0 FHADHM C[C@@H](OC(=O)[C@@H]1CCCc2sccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000824714960 608182103 /nfs/dbraw/zinc/18/21/03/608182103.db2.gz PSJMOYGMWMCPDV-IAQYHMDHSA-N -1 3 354.435 3.653 20 0 FHADHM CC[C@H](Oc1ccccc1C)C(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000825159127 608184196 /nfs/dbraw/zinc/18/41/96/608184196.db2.gz JLNWHLLMCABLGU-PBHICJAKSA-N -1 3 366.421 3.637 20 0 FHADHM CC[C@H](Oc1ccccc1C)C(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000825159127 608184198 /nfs/dbraw/zinc/18/41/98/608184198.db2.gz JLNWHLLMCABLGU-PBHICJAKSA-N -1 3 366.421 3.637 20 0 FHADHM Cc1nsc(Nc2ccc(Oc3cccc(-c4nnn[n-]4)c3)cc2)n1 ZINC000826340165 608184494 /nfs/dbraw/zinc/18/44/94/608184494.db2.gz KZXSWGCGEGVCNJ-UHFFFAOYSA-N -1 3 351.395 3.563 20 0 FHADHM Cc1nsc(Nc2ccc(Oc3cccc(-c4nn[n-]n4)c3)cc2)n1 ZINC000826340165 608184495 /nfs/dbraw/zinc/18/44/95/608184495.db2.gz KZXSWGCGEGVCNJ-UHFFFAOYSA-N -1 3 351.395 3.563 20 0 FHADHM Clc1cccc(SCc2ccn(-c3ccccc3)n2)c1-c1nnn[n-]1 ZINC000826353515 608207631 /nfs/dbraw/zinc/20/76/31/608207631.db2.gz SFRAYEKRUVCKJD-UHFFFAOYSA-N -1 3 368.853 3.998 20 0 FHADHM Clc1cccc(SCc2ccn(-c3ccccc3)n2)c1-c1nn[n-]n1 ZINC000826353515 608207632 /nfs/dbraw/zinc/20/76/32/608207632.db2.gz SFRAYEKRUVCKJD-UHFFFAOYSA-N -1 3 368.853 3.998 20 0 FHADHM Cc1ccc(C)n1C1CCN(c2ccc3cc(-c4nnn[n-]4)ccc3n2)CC1 ZINC000826285235 608225311 /nfs/dbraw/zinc/22/53/11/608225311.db2.gz SVKKYVPUJBIXHN-UHFFFAOYSA-N -1 3 373.464 3.675 20 0 FHADHM Cc1ccc(C)n1C1CCN(c2ccc3cc(-c4nn[n-]n4)ccc3n2)CC1 ZINC000826285235 608225312 /nfs/dbraw/zinc/22/53/12/608225312.db2.gz SVKKYVPUJBIXHN-UHFFFAOYSA-N -1 3 373.464 3.675 20 0 FHADHM COc1ccccc1[C@@H]1CCCN1c1ccc2cc(-c3nnn[n-]3)ccc2n1 ZINC000826218686 608226807 /nfs/dbraw/zinc/22/68/07/608226807.db2.gz IUYWZUQHELRTJA-SFHVURJKSA-N -1 3 372.432 3.765 20 0 FHADHM COc1ccccc1[C@@H]1CCCN1c1ccc2cc(-c3nn[n-]n3)ccc2n1 ZINC000826218686 608226808 /nfs/dbraw/zinc/22/68/08/608226808.db2.gz IUYWZUQHELRTJA-SFHVURJKSA-N -1 3 372.432 3.765 20 0 FHADHM CCc1nc([C@H](C)Nc2ccc3cc(-c4nnn[n-]4)ccc3n2)cs1 ZINC000825746528 608228151 /nfs/dbraw/zinc/22/81/51/608228151.db2.gz YOVSLTSJIYXLRB-JTQLQIEISA-N -1 3 351.439 3.607 20 0 FHADHM CCc1nc([C@H](C)Nc2ccc3cc(-c4nn[n-]n4)ccc3n2)cs1 ZINC000825746528 608228154 /nfs/dbraw/zinc/22/81/54/608228154.db2.gz YOVSLTSJIYXLRB-JTQLQIEISA-N -1 3 351.439 3.607 20 0 FHADHM Clc1cccc2c1CCN(c1ccc3cc(-c4nnn[n-]4)ccc3n1)C2 ZINC000826353522 608228786 /nfs/dbraw/zinc/22/87/86/608228786.db2.gz SRCRYYFCQKCWIY-UHFFFAOYSA-N -1 3 362.824 3.631 20 0 FHADHM Clc1cccc2c1CCN(c1ccc3cc(-c4nn[n-]n4)ccc3n1)C2 ZINC000826353522 608228788 /nfs/dbraw/zinc/22/87/88/608228788.db2.gz SRCRYYFCQKCWIY-UHFFFAOYSA-N -1 3 362.824 3.631 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nnn[n-]2)c1)[C@@H](c1ccccc1)C1CC1 ZINC000826453344 608229648 /nfs/dbraw/zinc/22/96/48/608229648.db2.gz HZKZZWVUKJDNQY-INIZCTEOSA-N -1 3 353.813 3.652 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nn[n-]n2)c1)[C@@H](c1ccccc1)C1CC1 ZINC000826453344 608229650 /nfs/dbraw/zinc/22/96/50/608229650.db2.gz HZKZZWVUKJDNQY-INIZCTEOSA-N -1 3 353.813 3.652 20 0 FHADHM c1oc(-c2ccccc2)nc1CNc1ccc2cc(-c3nnn[n-]3)ccc2n1 ZINC000826519478 608231468 /nfs/dbraw/zinc/23/14/68/608231468.db2.gz ZYEWIWZXMHMZDX-UHFFFAOYSA-N -1 3 369.388 3.682 20 0 FHADHM c1oc(-c2ccccc2)nc1CNc1ccc2cc(-c3nn[n-]n3)ccc2n1 ZINC000826519478 608231470 /nfs/dbraw/zinc/23/14/70/608231470.db2.gz ZYEWIWZXMHMZDX-UHFFFAOYSA-N -1 3 369.388 3.682 20 0 FHADHM Fc1cccc([C@@H](Nc2cccc(F)c2-c2nnn[n-]2)c2ccccn2)c1 ZINC000826376897 608234526 /nfs/dbraw/zinc/23/45/26/608234526.db2.gz XKNVVLGOYPIQLL-GOSISDBHSA-N -1 3 364.359 3.741 20 0 FHADHM Fc1cccc([C@@H](Nc2cccc(F)c2-c2nn[n-]n2)c2ccccn2)c1 ZINC000826376897 608234528 /nfs/dbraw/zinc/23/45/28/608234528.db2.gz XKNVVLGOYPIQLL-GOSISDBHSA-N -1 3 364.359 3.741 20 0 FHADHM Fc1cc(Br)c(NCc2ccccc2-c2nnn[n-]2)cc1F ZINC000826372317 608236710 /nfs/dbraw/zinc/23/67/10/608236710.db2.gz RFMZXNQPZRUYDQ-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1cc(Br)c(NCc2ccccc2-c2nn[n-]n2)cc1F ZINC000826372317 608236712 /nfs/dbraw/zinc/23/67/12/608236712.db2.gz RFMZXNQPZRUYDQ-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM CSc1cc(CNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)ccn1 ZINC000826230321 608241617 /nfs/dbraw/zinc/24/16/17/608241617.db2.gz NOGWZVWKUUPMAU-UHFFFAOYSA-N -1 3 366.372 3.615 20 0 FHADHM CSc1cc(CNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)ccn1 ZINC000826230321 608241619 /nfs/dbraw/zinc/24/16/19/608241619.db2.gz NOGWZVWKUUPMAU-UHFFFAOYSA-N -1 3 366.372 3.615 20 0 FHADHM CC[C@@H](OC(=O)c1sccc1-c1nnn[n-]1)c1cc(C)ccc1OC ZINC000825152864 608272063 /nfs/dbraw/zinc/27/20/63/608272063.db2.gz DMEYFNCYFARZJQ-CYBMUJFWSA-N -1 3 358.423 3.553 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)c(NCCOc2ccccc2-c2ccccc2)n1 ZINC000826276638 608278951 /nfs/dbraw/zinc/27/89/51/608278951.db2.gz PBXORHSTBFYUFR-UHFFFAOYSA-N -1 3 372.432 3.728 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)c(NCCOc2ccccc2-c2ccccc2)n1 ZINC000826276638 608278953 /nfs/dbraw/zinc/27/89/53/608278953.db2.gz PBXORHSTBFYUFR-UHFFFAOYSA-N -1 3 372.432 3.728 20 0 FHADHM CS[C@H](C)CCC(=O)Oc1ccc(-c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000826226385 608291484 /nfs/dbraw/zinc/29/14/84/608291484.db2.gz YPJDFFAOGNSDQT-CYBMUJFWSA-N -1 3 368.462 3.971 20 0 FHADHM CS[C@H](C)CCC(=O)Oc1ccc(-c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000826226385 608291486 /nfs/dbraw/zinc/29/14/86/608291486.db2.gz YPJDFFAOGNSDQT-CYBMUJFWSA-N -1 3 368.462 3.971 20 0 FHADHM Cc1scc(C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)CC(C)C)c1C ZINC000826350020 608301929 /nfs/dbraw/zinc/30/19/29/608301929.db2.gz FDCYEXJKTLCOLH-UHFFFAOYSA-N -1 3 369.494 3.843 20 0 FHADHM Cc1scc(C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)CC(C)C)c1C ZINC000826350020 608301931 /nfs/dbraw/zinc/30/19/31/608301931.db2.gz FDCYEXJKTLCOLH-UHFFFAOYSA-N -1 3 369.494 3.843 20 0 FHADHM CC(C)(C)OC(=O)NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000140410109 608303522 /nfs/dbraw/zinc/30/35/22/608303522.db2.gz VXHBFRKCTGMBAW-UHFFFAOYSA-N -1 3 351.410 3.558 20 0 FHADHM CC(C)(C)OC(=O)NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000140410109 608303524 /nfs/dbraw/zinc/30/35/24/608303524.db2.gz VXHBFRKCTGMBAW-UHFFFAOYSA-N -1 3 351.410 3.558 20 0 FHADHM CC(C)(C)OCc1ccccc1C(=O)OCc1ccccc1-c1nnn[n-]1 ZINC000824119787 608324871 /nfs/dbraw/zinc/32/48/71/608324871.db2.gz QGWCJMISCZHNLI-UHFFFAOYSA-N -1 3 366.421 3.539 20 0 FHADHM CC(C)(C)OCc1ccccc1C(=O)OCc1ccccc1-c1nn[n-]n1 ZINC000824119787 608324873 /nfs/dbraw/zinc/32/48/73/608324873.db2.gz QGWCJMISCZHNLI-UHFFFAOYSA-N -1 3 366.421 3.539 20 0 FHADHM O=C(C[C@@H]1C=CCC1)NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000826403878 608328267 /nfs/dbraw/zinc/32/82/67/608328267.db2.gz GVEVVXCISQKSIQ-OAHLLOKOSA-N -1 3 359.433 3.506 20 0 FHADHM O=C(C[C@@H]1C=CCC1)NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000826403878 608328270 /nfs/dbraw/zinc/32/82/70/608328270.db2.gz GVEVVXCISQKSIQ-OAHLLOKOSA-N -1 3 359.433 3.506 20 0 FHADHM CS[C@H](C)CCC(=O)Nc1sc2c(c1-c1nnn[n-]1)CC[C@H](C)C2 ZINC000826225621 608339038 /nfs/dbraw/zinc/33/90/38/608339038.db2.gz GPNFCQMCFBCUGF-VHSXEESVSA-N -1 3 365.528 3.523 20 0 FHADHM CS[C@H](C)CCC(=O)Nc1sc2c(c1-c1nn[n-]n1)CC[C@H](C)C2 ZINC000826225621 608339039 /nfs/dbraw/zinc/33/90/39/608339039.db2.gz GPNFCQMCFBCUGF-VHSXEESVSA-N -1 3 365.528 3.523 20 0 FHADHM CCCCS[C@H](C)C(=O)N(CC)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825296456 608341973 /nfs/dbraw/zinc/34/19/73/608341973.db2.gz JTZNVRAINVFOPK-LLVKDONJSA-N -1 3 367.906 3.795 20 0 FHADHM CCCCS[C@H](C)C(=O)N(CC)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825296456 608341975 /nfs/dbraw/zinc/34/19/75/608341975.db2.gz JTZNVRAINVFOPK-LLVKDONJSA-N -1 3 367.906 3.795 20 0 FHADHM c1c(CNc2nc3ccccc3cc2-c2nnn[n-]2)onc1-c1ccccc1 ZINC000826518965 608366846 /nfs/dbraw/zinc/36/68/46/608366846.db2.gz DXJLIZVYGAAARC-UHFFFAOYSA-N -1 3 369.388 3.682 20 0 FHADHM c1c(CNc2nc3ccccc3cc2-c2nn[n-]n2)onc1-c1ccccc1 ZINC000826518965 608366848 /nfs/dbraw/zinc/36/68/48/608366848.db2.gz DXJLIZVYGAAARC-UHFFFAOYSA-N -1 3 369.388 3.682 20 0 FHADHM Oc1cccc2c1CC[C@H]2Nc1ccc(-c2nn[n-]n2)cc1C(F)(F)F ZINC000826511543 608382155 /nfs/dbraw/zinc/38/21/55/608382155.db2.gz UQOWTNDFBPFVLY-CYBMUJFWSA-N -1 3 361.327 3.691 20 0 FHADHM Nc1ccc(SCCCOc2cccc(-c3nnn[n-]3)c2)c(Cl)c1 ZINC000826396155 608401831 /nfs/dbraw/zinc/40/18/31/608401831.db2.gz JWZPRLCXCHXDSQ-UHFFFAOYSA-N -1 3 361.858 3.664 20 0 FHADHM Nc1ccc(SCCCOc2cccc(-c3nn[n-]n3)c2)c(Cl)c1 ZINC000826396155 608401832 /nfs/dbraw/zinc/40/18/32/608401832.db2.gz JWZPRLCXCHXDSQ-UHFFFAOYSA-N -1 3 361.858 3.664 20 0 FHADHM Fc1c(CSCc2cnn(-c3ccccc3)c2)cccc1-c1nnn[n-]1 ZINC000826370891 608404739 /nfs/dbraw/zinc/40/47/39/608404739.db2.gz KWPCFQLRLAEERU-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM Fc1c(CSCc2cnn(-c3ccccc3)c2)cccc1-c1nn[n-]n1 ZINC000826370891 608404740 /nfs/dbraw/zinc/40/47/40/608404740.db2.gz KWPCFQLRLAEERU-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM CC[C@H](C)n1ncc(NCc2ccc(OC)c(-c3nnn[n-]3)c2)c1C1CC1 ZINC000825083312 608427834 /nfs/dbraw/zinc/42/78/34/608427834.db2.gz ZVBNAQFPKJZWLB-LBPRGKRZSA-N -1 3 367.457 3.532 20 0 FHADHM CC[C@H](C)n1ncc(NCc2ccc(OC)c(-c3nn[n-]n3)c2)c1C1CC1 ZINC000825083312 608427837 /nfs/dbraw/zinc/42/78/37/608427837.db2.gz ZVBNAQFPKJZWLB-LBPRGKRZSA-N -1 3 367.457 3.532 20 0 FHADHM C[C@@H](NCc1ccnc(-c2nnn[n-]2)c1)c1c(Cl)ccc(F)c1Cl ZINC000824626621 608439302 /nfs/dbraw/zinc/43/93/02/608439302.db2.gz PPCZIFFOJRUEOU-MRVPVSSYSA-N -1 3 367.215 3.558 20 0 FHADHM C[C@@H](NCc1ccnc(-c2nn[n-]n2)c1)c1c(Cl)ccc(F)c1Cl ZINC000824626621 608439303 /nfs/dbraw/zinc/43/93/03/608439303.db2.gz PPCZIFFOJRUEOU-MRVPVSSYSA-N -1 3 367.215 3.558 20 0 FHADHM C[C@@H](C(=O)OCc1cccc(-c2nnn[n-]2)c1F)c1ccc(Cl)s1 ZINC000824053499 608450513 /nfs/dbraw/zinc/45/05/13/608450513.db2.gz ZZUZGUIVZBXWLC-MRVPVSSYSA-N -1 3 366.805 3.568 20 0 FHADHM C[C@@H](C(=O)OCc1cccc(-c2nn[n-]n2)c1F)c1ccc(Cl)s1 ZINC000824053499 608450515 /nfs/dbraw/zinc/45/05/15/608450515.db2.gz ZZUZGUIVZBXWLC-MRVPVSSYSA-N -1 3 366.805 3.568 20 0 FHADHM C[C@H](NCc1csc(C2CCCC2)n1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824626690 608462514 /nfs/dbraw/zinc/46/25/14/608462514.db2.gz ROTFOURMZVGYDE-LBPRGKRZSA-N -1 3 354.483 3.832 20 0 FHADHM CC[C@H](OC(=O)c1sccc1-c1nnn[n-]1)c1ccc(F)cc1F ZINC000825154656 608500088 /nfs/dbraw/zinc/50/00/88/608500088.db2.gz RYIBHIVCIZSUMK-LBPRGKRZSA-N -1 3 350.350 3.515 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CN[C@H](C)c1c(F)cccc1Cl ZINC000826184282 608553419 /nfs/dbraw/zinc/55/34/19/608553419.db2.gz RCBSNCWLKHCQJB-SNVBAGLBSA-N -1 3 361.808 3.519 20 0 FHADHM CC(C)N(Cc1ccccc1)C(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000824296992 608572840 /nfs/dbraw/zinc/57/28/40/608572840.db2.gz NWXZREXMSLDLLV-UHFFFAOYSA-N -1 3 355.829 3.571 20 0 FHADHM CC(C)N(Cc1ccccc1)C(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000824296992 608572841 /nfs/dbraw/zinc/57/28/41/608572841.db2.gz NWXZREXMSLDLLV-UHFFFAOYSA-N -1 3 355.829 3.571 20 0 FHADHM C[C@H](NC(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1)c1ccc(Cl)s1 ZINC000824521295 608574865 /nfs/dbraw/zinc/57/48/65/608574865.db2.gz JRHRPLAKZNDBIL-ZETCQYMHSA-N -1 3 368.249 3.726 20 0 FHADHM C[C@H](NC(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1)c1ccc(Cl)s1 ZINC000824521295 608574866 /nfs/dbraw/zinc/57/48/66/608574866.db2.gz JRHRPLAKZNDBIL-ZETCQYMHSA-N -1 3 368.249 3.726 20 0 FHADHM C[C@@H]1[C@@H](C)CCCN1C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000824937801 608604808 /nfs/dbraw/zinc/60/48/08/608604808.db2.gz RJTSHONGOCBHAQ-VHSXEESVSA-N -1 3 368.363 3.538 20 0 FHADHM C[C@@H]1[C@@H](C)CCCN1C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000824937801 608604809 /nfs/dbraw/zinc/60/48/09/608604809.db2.gz RJTSHONGOCBHAQ-VHSXEESVSA-N -1 3 368.363 3.538 20 0 FHADHM Cc1cc(C)cc(C2=CCN(C(=O)Nc3ccc(-c4nnn[n-]4)cc3)CC2)c1 ZINC000826264233 608757519 /nfs/dbraw/zinc/75/75/19/608757519.db2.gz GQSMSRWJXWDHPQ-UHFFFAOYSA-N -1 3 374.448 3.805 20 0 FHADHM Cc1cc(C)cc(C2=CCN(C(=O)Nc3ccc(-c4nn[n-]n4)cc3)CC2)c1 ZINC000826264233 608757521 /nfs/dbraw/zinc/75/75/21/608757521.db2.gz GQSMSRWJXWDHPQ-UHFFFAOYSA-N -1 3 374.448 3.805 20 0 FHADHM COC[C@@H](Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)c1ccccc1 ZINC000826151397 608798243 /nfs/dbraw/zinc/79/82/43/608798243.db2.gz ACRQOXVUXLKPMX-OAHLLOKOSA-N -1 3 363.343 3.685 20 0 FHADHM COC[C@@H](Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)c1ccccc1 ZINC000826151397 608798246 /nfs/dbraw/zinc/79/82/46/608798246.db2.gz ACRQOXVUXLKPMX-OAHLLOKOSA-N -1 3 363.343 3.685 20 0 FHADHM COC[C@@H](Nc1ccc(C(F)(F)F)cc1-c1nnn[n-]1)c1ccccc1 ZINC000826152303 608798437 /nfs/dbraw/zinc/79/84/37/608798437.db2.gz VLSRFBSNIUVAQQ-OAHLLOKOSA-N -1 3 363.343 3.685 20 0 FHADHM COC[C@@H](Nc1ccc(C(F)(F)F)cc1-c1nn[n-]n1)c1ccccc1 ZINC000826152303 608798438 /nfs/dbraw/zinc/79/84/38/608798438.db2.gz VLSRFBSNIUVAQQ-OAHLLOKOSA-N -1 3 363.343 3.685 20 0 FHADHM CC[C@H](C)Oc1cc(CNc2ccc(-c3nn[n-]n3)cc2)ccc1OC ZINC000825075582 608867233 /nfs/dbraw/zinc/86/72/33/608867233.db2.gz QDMFCPLHWLAROD-ZDUSSCGKSA-N -1 3 353.426 3.665 20 0 FHADHM C[C@@H](NCc1coc(-c2cccs2)n1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824626660 609137714 /nfs/dbraw/zinc/13/77/14/609137714.db2.gz QOUHBAXCGVUAQC-SNVBAGLBSA-N -1 3 370.413 3.573 20 0 FHADHM C[C@@H](NCc1coc(-c2cccs2)n1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824626660 609137717 /nfs/dbraw/zinc/13/77/17/609137717.db2.gz QOUHBAXCGVUAQC-SNVBAGLBSA-N -1 3 370.413 3.573 20 0 FHADHM CCC(=O)Nc1ccc(C)c(N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000825034573 609157766 /nfs/dbraw/zinc/15/77/66/609157766.db2.gz LXNIDOJCHMPODL-ZDUSSCGKSA-N -1 3 350.426 3.697 20 0 FHADHM CCC(=O)Nc1ccc(C)c(N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000825034573 609157767 /nfs/dbraw/zinc/15/77/67/609157767.db2.gz LXNIDOJCHMPODL-ZDUSSCGKSA-N -1 3 350.426 3.697 20 0 FHADHM Cc1ccc(NC(=O)C(C)C)cc1N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000826290278 609158423 /nfs/dbraw/zinc/15/84/23/609158423.db2.gz HTYDYJZREWQOFV-AWEZNQCLSA-N -1 3 364.453 3.943 20 0 FHADHM Cc1ccc(NC(=O)C(C)C)cc1N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000826290278 609158425 /nfs/dbraw/zinc/15/84/25/609158425.db2.gz HTYDYJZREWQOFV-AWEZNQCLSA-N -1 3 364.453 3.943 20 0 FHADHM C[C@H](Nc1ccc(OCC(F)(F)F)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000824656252 609164079 /nfs/dbraw/zinc/16/40/79/609164079.db2.gz JOUQHHLSLORHJX-NSHDSACASA-N -1 3 363.343 3.981 20 0 FHADHM C[C@H](Nc1ccc(OCC(F)(F)F)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000824656252 609164081 /nfs/dbraw/zinc/16/40/81/609164081.db2.gz JOUQHHLSLORHJX-NSHDSACASA-N -1 3 363.343 3.981 20 0 FHADHM CC(C)C[C@@H]1C[C@H](Nc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)CCO1 ZINC000824243569 609171197 /nfs/dbraw/zinc/17/11/97/609171197.db2.gz JKXVJRHAGBWKMG-CHWSQXEVSA-N -1 3 369.391 3.891 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NCc1csc(CCC(C)C)n1 ZINC000825481369 609178401 /nfs/dbraw/zinc/17/84/01/609178401.db2.gz YEHLQVVUUXKQQA-UHFFFAOYSA-N -1 3 371.514 3.956 20 0 FHADHM C[C@H](Nc1ccc(N2CCCC2)c(F)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824656069 609180379 /nfs/dbraw/zinc/18/03/79/609180379.db2.gz HBOPLFACSBSCLZ-ZDUSSCGKSA-N -1 3 352.417 3.779 20 0 FHADHM C[C@H](Nc1ccc(N2CCCC2)c(F)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824656069 609180381 /nfs/dbraw/zinc/18/03/81/609180381.db2.gz HBOPLFACSBSCLZ-ZDUSSCGKSA-N -1 3 352.417 3.779 20 0 FHADHM COc1cc(CNc2ccc(Cl)c(-c3nnn[n-]3)c2)ccc1SC ZINC000826179163 609199577 /nfs/dbraw/zinc/19/95/77/609199577.db2.gz BWCPSASJCBGABD-UHFFFAOYSA-N -1 3 361.858 3.863 20 0 FHADHM COc1cc(CNc2ccc(Cl)c(-c3nn[n-]n3)c2)ccc1SC ZINC000826179163 609199578 /nfs/dbraw/zinc/19/95/78/609199578.db2.gz BWCPSASJCBGABD-UHFFFAOYSA-N -1 3 361.858 3.863 20 0 FHADHM O=C(N[C@@H](c1cccc(Cl)c1)C1CCCC1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC000826427539 609226724 /nfs/dbraw/zinc/22/67/24/609226724.db2.gz TUZVUWYDCHTMTK-MRXNPFEDSA-N -1 3 370.844 3.510 20 0 FHADHM O=C(N[C@@H](c1cccc(Cl)c1)C1CCCC1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC000826427539 609226725 /nfs/dbraw/zinc/22/67/25/609226725.db2.gz TUZVUWYDCHTMTK-MRXNPFEDSA-N -1 3 370.844 3.510 20 0 FHADHM C[C@H](Nc1ccc(OCC(F)F)cc1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824656531 609243360 /nfs/dbraw/zinc/24/33/60/609243360.db2.gz LHAACALJFGOWBZ-JTQLQIEISA-N -1 3 363.343 3.823 20 0 FHADHM C[C@H](Nc1ccc(OCC(F)F)cc1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824656531 609243361 /nfs/dbraw/zinc/24/33/61/609243361.db2.gz LHAACALJFGOWBZ-JTQLQIEISA-N -1 3 363.343 3.823 20 0 FHADHM C[C@@H](Nc1ccn(-c2ccccc2Cl)n1)c1cccc(-c2nnn[n-]2)c1 ZINC000824662145 609254442 /nfs/dbraw/zinc/25/44/42/609254442.db2.gz DNIBPWYWRSZBRK-GFCCVEGCSA-N -1 3 365.828 3.879 20 0 FHADHM C[C@@H](Nc1ccn(-c2ccccc2Cl)n1)c1cccc(-c2nn[n-]n2)c1 ZINC000824662145 609254444 /nfs/dbraw/zinc/25/44/44/609254444.db2.gz DNIBPWYWRSZBRK-GFCCVEGCSA-N -1 3 365.828 3.879 20 0 FHADHM CCOc1ccc2nc(NCc3cc(-c4nnn[n-]4)cs3)sc2c1 ZINC000825649248 609264250 /nfs/dbraw/zinc/26/42/50/609264250.db2.gz MWFCGGUIQXTQLI-UHFFFAOYSA-N -1 3 358.452 3.549 20 0 FHADHM CCOc1ccc2nc(NCc3cc(-c4nn[n-]n4)cs3)sc2c1 ZINC000825649248 609264251 /nfs/dbraw/zinc/26/42/51/609264251.db2.gz MWFCGGUIQXTQLI-UHFFFAOYSA-N -1 3 358.452 3.549 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1CNc1nc2cc(Cl)ccc2s1 ZINC000826372469 609266304 /nfs/dbraw/zinc/26/63/04/609266304.db2.gz XXSOPXBUFZBCQF-UHFFFAOYSA-N -1 3 360.805 3.881 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CNc1nc2cc(Cl)ccc2s1 ZINC000826372469 609266306 /nfs/dbraw/zinc/26/63/06/609266306.db2.gz XXSOPXBUFZBCQF-UHFFFAOYSA-N -1 3 360.805 3.881 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1CNc1nnc(C2CCCCC2)s1 ZINC000826372427 609266360 /nfs/dbraw/zinc/26/63/60/609266360.db2.gz VUDPUFINFCKHEY-UHFFFAOYSA-N -1 3 359.434 3.517 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CNc1nnc(C2CCCCC2)s1 ZINC000826372427 609266361 /nfs/dbraw/zinc/26/63/61/609266361.db2.gz VUDPUFINFCKHEY-UHFFFAOYSA-N -1 3 359.434 3.517 20 0 FHADHM c1cn(-c2ccccc2)nc1N[C@@H]1CCCc2cc(-c3nnn[n-]3)ccc21 ZINC000826520001 609271647 /nfs/dbraw/zinc/27/16/47/609271647.db2.gz XBOMAYKYWZPCAZ-GOSISDBHSA-N -1 3 357.421 3.542 20 0 FHADHM c1cn(-c2ccccc2)nc1N[C@@H]1CCCc2cc(-c3nn[n-]n3)ccc21 ZINC000826520001 609271649 /nfs/dbraw/zinc/27/16/49/609271649.db2.gz XBOMAYKYWZPCAZ-GOSISDBHSA-N -1 3 357.421 3.542 20 0 FHADHM COc1ccc(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c(Br)c1 ZINC000826210614 609282097 /nfs/dbraw/zinc/28/20/97/609282097.db2.gz YATARCMVMGVJRN-SNVBAGLBSA-N -1 3 374.242 3.811 20 0 FHADHM COc1ccc(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c(Br)c1 ZINC000826210614 609282099 /nfs/dbraw/zinc/28/20/99/609282099.db2.gz YATARCMVMGVJRN-SNVBAGLBSA-N -1 3 374.242 3.811 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1N[C@@H](C)c1nc2ccccc2o1 ZINC000825626933 609302795 /nfs/dbraw/zinc/30/27/95/609302795.db2.gz QUWHPFVVRXRZMQ-NSHDSACASA-N -1 3 350.382 3.580 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1N[C@@H](C)c1nc2ccccc2o1 ZINC000825626933 609302797 /nfs/dbraw/zinc/30/27/97/609302797.db2.gz QUWHPFVVRXRZMQ-NSHDSACASA-N -1 3 350.382 3.580 20 0 FHADHM CC(C)CCN(C)C(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000824249797 609311971 /nfs/dbraw/zinc/31/19/71/609311971.db2.gz USGQHXCUELMRKN-UHFFFAOYSA-N -1 3 365.437 3.777 20 0 FHADHM CC(C)CCN(C)C(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000824249797 609311972 /nfs/dbraw/zinc/31/19/72/609311972.db2.gz USGQHXCUELMRKN-UHFFFAOYSA-N -1 3 365.437 3.777 20 0 FHADHM CN(CC(C)(C)C)C(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000825897961 609316263 /nfs/dbraw/zinc/31/62/63/609316263.db2.gz SGIFIKCGZOREED-UHFFFAOYSA-N -1 3 365.437 3.777 20 0 FHADHM CN(CC(C)(C)C)C(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000825897961 609316265 /nfs/dbraw/zinc/31/62/65/609316265.db2.gz SGIFIKCGZOREED-UHFFFAOYSA-N -1 3 365.437 3.777 20 0 FHADHM CCN(CC1CC1)C(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000825417692 609317830 /nfs/dbraw/zinc/31/78/30/609317830.db2.gz SSESUKXXXFDFDW-UHFFFAOYSA-N -1 3 363.421 3.531 20 0 FHADHM CCN(CC1CC1)C(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000825417692 609317831 /nfs/dbraw/zinc/31/78/31/609317831.db2.gz SSESUKXXXFDFDW-UHFFFAOYSA-N -1 3 363.421 3.531 20 0 FHADHM CCC(CC)[C@@H]1C[C@H](Nc2ccc3cc(-c4nnn[n-]4)ccc3n2)CCO1 ZINC000825108337 609322474 /nfs/dbraw/zinc/32/24/74/609322474.db2.gz VYMBRFKHRDXHSQ-AEFFLSMTSA-N -1 3 366.469 3.811 20 0 FHADHM CCC(CC)[C@@H]1C[C@H](Nc2ccc3cc(-c4nn[n-]n4)ccc3n2)CCO1 ZINC000825108337 609322477 /nfs/dbraw/zinc/32/24/77/609322477.db2.gz VYMBRFKHRDXHSQ-AEFFLSMTSA-N -1 3 366.469 3.811 20 0 FHADHM CC(C)Oc1ccccc1CN[C@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000824333063 609326791 /nfs/dbraw/zinc/32/67/91/609326791.db2.gz CWDWSRYUGAPUMA-CYBMUJFWSA-N -1 3 355.417 3.644 20 0 FHADHM CC[C@H]1CCN(C(=O)c2ccccc2Oc2ccccc2-c2nnn[n-]2)C1 ZINC000825203702 609327383 /nfs/dbraw/zinc/32/73/83/609327383.db2.gz OKZFAQAFKNAEFL-AWEZNQCLSA-N -1 3 363.421 3.531 20 0 FHADHM CC[C@H]1CCN(C(=O)c2ccccc2Oc2ccccc2-c2nn[n-]n2)C1 ZINC000825203702 609327385 /nfs/dbraw/zinc/32/73/85/609327385.db2.gz OKZFAQAFKNAEFL-AWEZNQCLSA-N -1 3 363.421 3.531 20 0 FHADHM CCOc1ccccc1[C@H](C)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000825654116 609332563 /nfs/dbraw/zinc/33/25/63/609332563.db2.gz OPHNOGDXVAUSGB-STQMWFEESA-N -1 3 355.417 3.816 20 0 FHADHM C[C@@H](NC1(c2cccc(Cl)c2)CC1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824539917 609347581 /nfs/dbraw/zinc/34/75/81/609347581.db2.gz QXTDLHXVAWWQDQ-LLVKDONJSA-N -1 3 357.820 3.999 20 0 FHADHM C[C@H](Nc1cnn(-c2ccccc2F)c1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824662431 609347733 /nfs/dbraw/zinc/34/77/33/609347733.db2.gz KASGUBMYKBDESH-NSHDSACASA-N -1 3 367.363 3.504 20 0 FHADHM C[C@H](Nc1cnn(-c2ccccc2F)c1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824662431 609347735 /nfs/dbraw/zinc/34/77/35/609347735.db2.gz KASGUBMYKBDESH-NSHDSACASA-N -1 3 367.363 3.504 20 0 FHADHM C[C@@H](N[C@@H]1CCCOc2c(F)cccc21)c1ccc(-c2nn[n-]n2)cc1F ZINC000824546925 609348694 /nfs/dbraw/zinc/34/86/94/609348694.db2.gz LUAUUUIZKJCVSH-PIGZYNQJSA-N -1 3 371.391 3.709 20 0 FHADHM CCC(=O)Nc1ccc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2F)cc1 ZINC000825034930 609349626 /nfs/dbraw/zinc/34/96/26/609349626.db2.gz ULPHOBDCVNCKJE-NSHDSACASA-N -1 3 354.389 3.527 20 0 FHADHM CCC(=O)Nc1ccc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000825034930 609349628 /nfs/dbraw/zinc/34/96/28/609349628.db2.gz ULPHOBDCVNCKJE-NSHDSACASA-N -1 3 354.389 3.527 20 0 FHADHM O=C(N[C@@H](CC1CCC1)c1ccccc1)c1cc(-c2nnn[n-]2)cs1 ZINC000826426783 609350731 /nfs/dbraw/zinc/35/07/31/609350731.db2.gz WLNZCHKDNIYIEP-HNNXBMFYSA-N -1 3 353.451 3.590 20 0 FHADHM O=C(N[C@@H](CC1CCC1)c1ccccc1)c1cc(-c2nn[n-]n2)cs1 ZINC000826426783 609350733 /nfs/dbraw/zinc/35/07/33/609350733.db2.gz WLNZCHKDNIYIEP-HNNXBMFYSA-N -1 3 353.451 3.590 20 0 FHADHM Cc1nn(-c2ccccc2)cc1N[C@@H](C)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000826332960 609351598 /nfs/dbraw/zinc/35/15/98/609351598.db2.gz OGHSRHNKFRPOSF-LBPRGKRZSA-N -1 3 363.400 3.673 20 0 FHADHM Cc1nn(-c2ccccc2)cc1N[C@@H](C)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000826332960 609351602 /nfs/dbraw/zinc/35/16/02/609351602.db2.gz OGHSRHNKFRPOSF-LBPRGKRZSA-N -1 3 363.400 3.673 20 0 FHADHM C[C@H](c1ccccc1)N(C)Cc1ccc(-c2nn[n-]n2)cc1Br ZINC000824770168 609355881 /nfs/dbraw/zinc/35/58/81/609355881.db2.gz FWBDCYVFANZMBJ-GFCCVEGCSA-N -1 3 372.270 3.822 20 0 FHADHM O=C(NC1CCC(c2ccc(F)cc2)CC1)c1cc(-c2nnn[n-]2)cs1 ZINC000826430299 609409002 /nfs/dbraw/zinc/40/90/02/609409002.db2.gz YXDPSTLBZLZEBF-UHFFFAOYSA-N -1 3 371.441 3.524 20 0 FHADHM O=C(NC1CCC(c2ccc(F)cc2)CC1)c1cc(-c2nn[n-]n2)cs1 ZINC000826430299 609409004 /nfs/dbraw/zinc/40/90/04/609409004.db2.gz YXDPSTLBZLZEBF-UHFFFAOYSA-N -1 3 371.441 3.524 20 0 FHADHM OCc1ccc(COc2ccc(Oc3ccc(-c4nnn[n-]4)cc3)cc2)cc1 ZINC000826510320 609434072 /nfs/dbraw/zinc/43/40/72/609434072.db2.gz KDMRFRRXUYAQRN-UHFFFAOYSA-N -1 3 374.400 3.730 20 0 FHADHM OCc1ccc(COc2ccc(Oc3ccc(-c4nn[n-]n4)cc3)cc2)cc1 ZINC000826510320 609434074 /nfs/dbraw/zinc/43/40/74/609434074.db2.gz KDMRFRRXUYAQRN-UHFFFAOYSA-N -1 3 374.400 3.730 20 0 FHADHM CC[C@H](C)Sc1ccc(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)c(C)c1 ZINC000825075854 609449855 /nfs/dbraw/zinc/44/98/55/609449855.db2.gz RNNPJIKTSJRSPN-NSHDSACASA-N -1 3 356.455 3.646 20 0 FHADHM CC[C@H](C)Sc1ccc(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)c(C)c1 ZINC000825075854 609449857 /nfs/dbraw/zinc/44/98/57/609449857.db2.gz RNNPJIKTSJRSPN-NSHDSACASA-N -1 3 356.455 3.646 20 0 FHADHM Cc1cccnc1CSc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000826308500 609453108 /nfs/dbraw/zinc/45/31/08/609453108.db2.gz CCFDURJKUZNXCE-UHFFFAOYSA-N -1 3 351.357 3.881 20 0 FHADHM Cc1cccnc1CSc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000826308500 609453111 /nfs/dbraw/zinc/45/31/11/609453111.db2.gz CCFDURJKUZNXCE-UHFFFAOYSA-N -1 3 351.357 3.881 20 0 FHADHM COc1cc(CNc2cc(-c3nnn[n-]3)ccc2C)c(SC)cc1OC ZINC000826179688 609478663 /nfs/dbraw/zinc/47/86/63/609478663.db2.gz ZONUXOFTTPODSX-UHFFFAOYSA-N -1 3 371.466 3.526 20 0 FHADHM COc1cc(CNc2cc(-c3nn[n-]n3)ccc2C)c(SC)cc1OC ZINC000826179688 609478664 /nfs/dbraw/zinc/47/86/64/609478664.db2.gz ZONUXOFTTPODSX-UHFFFAOYSA-N -1 3 371.466 3.526 20 0 FHADHM CSc1c(F)cc(NCc2ccc(-c3nnn[n-]3)cc2F)cc1F ZINC000826229913 609481991 /nfs/dbraw/zinc/48/19/91/609481991.db2.gz WQONGQIHMZRRHV-UHFFFAOYSA-N -1 3 351.357 3.618 20 0 FHADHM CSc1c(F)cc(NCc2ccc(-c3nn[n-]n3)cc2F)cc1F ZINC000826229913 609481994 /nfs/dbraw/zinc/48/19/94/609481994.db2.gz WQONGQIHMZRRHV-UHFFFAOYSA-N -1 3 351.357 3.618 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NCc1ccc(CSC(F)F)o1 ZINC000826278699 609482614 /nfs/dbraw/zinc/48/26/14/609482614.db2.gz OPZYZVDRGRQGDL-UHFFFAOYSA-N -1 3 351.382 3.836 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NCc1ccc(CSC(F)F)o1 ZINC000826278699 609482616 /nfs/dbraw/zinc/48/26/16/609482616.db2.gz OPZYZVDRGRQGDL-UHFFFAOYSA-N -1 3 351.382 3.836 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NCc1ccc(F)cc1C(F)(F)F ZINC000826186581 609483361 /nfs/dbraw/zinc/48/33/61/609483361.db2.gz AKESNQBJIZHGDV-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NCc1ccc(F)cc1C(F)(F)F ZINC000826186581 609483363 /nfs/dbraw/zinc/48/33/63/609483363.db2.gz AKESNQBJIZHGDV-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM c1ncc(CNc2ccc(OCc3cccc(-c4nnn[n-]4)c3)cc2)s1 ZINC000826516254 609485413 /nfs/dbraw/zinc/48/54/13/609485413.db2.gz DBQQZRKLXKXFGQ-UHFFFAOYSA-N -1 3 364.434 3.514 20 0 FHADHM c1ncc(CNc2ccc(OCc3cccc(-c4nn[n-]n4)c3)cc2)s1 ZINC000826516254 609485415 /nfs/dbraw/zinc/48/54/15/609485415.db2.gz DBQQZRKLXKXFGQ-UHFFFAOYSA-N -1 3 364.434 3.514 20 0 FHADHM Cc1c(NCc2csc(-c3cccs3)n2)cccc1-c1nnn[n-]1 ZINC000826242788 609486762 /nfs/dbraw/zinc/48/67/62/609486762.db2.gz GGTCDVURYRCUBQ-UHFFFAOYSA-N -1 3 354.464 3.972 20 0 FHADHM Cc1c(NCc2csc(-c3cccs3)n2)cccc1-c1nn[n-]n1 ZINC000826242788 609486765 /nfs/dbraw/zinc/48/67/65/609486765.db2.gz GGTCDVURYRCUBQ-UHFFFAOYSA-N -1 3 354.464 3.972 20 0 FHADHM CCOC(=O)Nc1ccc(NCc2ccc(Cl)cc2)cc1-c1nnn[n-]1 ZINC000825553233 609488414 /nfs/dbraw/zinc/48/84/14/609488414.db2.gz OEYDRRLLMNLVOI-UHFFFAOYSA-N -1 3 372.816 3.701 20 0 FHADHM CCOC(=O)Nc1ccc(NCc2ccc(Cl)cc2)cc1-c1nn[n-]n1 ZINC000825553233 609488416 /nfs/dbraw/zinc/48/84/16/609488416.db2.gz OEYDRRLLMNLVOI-UHFFFAOYSA-N -1 3 372.816 3.701 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)[C@H](C)[C@@H](C)CC ZINC000825605547 609512123 /nfs/dbraw/zinc/51/21/23/609512123.db2.gz XDOOCUWXVSQUDS-VHSXEESVSA-N -1 3 352.822 3.506 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)[C@H](C)[C@@H](C)CC ZINC000825605547 609512124 /nfs/dbraw/zinc/51/21/24/609512124.db2.gz XDOOCUWXVSQUDS-VHSXEESVSA-N -1 3 352.822 3.506 20 0 FHADHM Fc1ccc(CNc2ccc(Cl)c(OC(F)F)c2)cc1-c1nnn[n-]1 ZINC000826374916 609513598 /nfs/dbraw/zinc/51/35/98/609513598.db2.gz RMEQPQHLHWWYLN-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM Fc1ccc(CNc2ccc(Cl)c(OC(F)F)c2)cc1-c1nn[n-]n1 ZINC000826374916 609513600 /nfs/dbraw/zinc/51/36/00/609513600.db2.gz RMEQPQHLHWWYLN-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM Cc1c(Cl)cnc(Nc2ccc(NC(=O)C(C)C)cc2)c1-c1nnn[n-]1 ZINC000826240157 609522463 /nfs/dbraw/zinc/52/24/63/609522463.db2.gz GDPINAWBIJCFFM-UHFFFAOYSA-N -1 3 371.832 3.562 20 0 FHADHM Cc1c(Cl)cnc(Nc2ccc(NC(=O)C(C)C)cc2)c1-c1nn[n-]n1 ZINC000826240157 609522465 /nfs/dbraw/zinc/52/24/65/609522465.db2.gz GDPINAWBIJCFFM-UHFFFAOYSA-N -1 3 371.832 3.562 20 0 FHADHM Cc1nc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)ccc1Br ZINC000826326720 609533233 /nfs/dbraw/zinc/53/32/33/609533233.db2.gz BDOLKYRMOPCRRH-VIFPVBQESA-N -1 3 359.231 3.506 20 0 FHADHM Cc1nc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)ccc1Br ZINC000826326720 609533235 /nfs/dbraw/zinc/53/32/35/609533235.db2.gz BDOLKYRMOPCRRH-VIFPVBQESA-N -1 3 359.231 3.506 20 0 FHADHM Cc1c(Cl)cnc(N2CC[C@H](C)C[C@H]2c2ccco2)c1-c1nnn[n-]1 ZINC000826237295 609565647 /nfs/dbraw/zinc/56/56/47/609565647.db2.gz VCFLUNXFYSZURL-GWCFXTLKSA-N -1 3 358.833 3.794 20 0 FHADHM Cc1c(Cl)cnc(N2CC[C@H](C)C[C@H]2c2ccco2)c1-c1nn[n-]n1 ZINC000826237295 609565649 /nfs/dbraw/zinc/56/56/49/609565649.db2.gz VCFLUNXFYSZURL-GWCFXTLKSA-N -1 3 358.833 3.794 20 0 FHADHM Cc1c(Cl)cnc(NC[C@@H](C)c2nc3ccccc3o2)c1-c1nnn[n-]1 ZINC000826239272 609566829 /nfs/dbraw/zinc/56/68/29/609566829.db2.gz BIGFBGDOJLMUDE-SECBINFHSA-N -1 3 369.816 3.580 20 0 FHADHM Cc1c(Cl)cnc(NC[C@@H](C)c2nc3ccccc3o2)c1-c1nn[n-]n1 ZINC000826239272 609566832 /nfs/dbraw/zinc/56/68/32/609566832.db2.gz BIGFBGDOJLMUDE-SECBINFHSA-N -1 3 369.816 3.580 20 0 FHADHM CSCCCCCCNc1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000826228021 609588106 /nfs/dbraw/zinc/58/81/06/609588106.db2.gz BMFHZRMHCGSXCH-UHFFFAOYSA-N -1 3 360.409 3.616 20 0 FHADHM CSCCCCCCNc1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000826228021 609588107 /nfs/dbraw/zinc/58/81/07/609588107.db2.gz BMFHZRMHCGSXCH-UHFFFAOYSA-N -1 3 360.409 3.616 20 0 FHADHM Cc1nc(-c2ccccc2)sc1NC(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000826323094 609591325 /nfs/dbraw/zinc/59/13/25/609591325.db2.gz PPJVNKKHRUBWJO-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1nc(-c2ccccc2)sc1NC(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC000826323094 609591328 /nfs/dbraw/zinc/59/13/28/609591328.db2.gz PPJVNKKHRUBWJO-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM COc1cccc([C@@H]2C[C@@H](C)CN2c2ncc(-c3nnn[n-]3)cc2Cl)c1 ZINC000826215206 609593011 /nfs/dbraw/zinc/59/30/11/609593011.db2.gz JHKKQFZJZYGZHJ-BZNIZROVSA-N -1 3 370.844 3.511 20 0 FHADHM COc1cccc([C@@H]2C[C@@H](C)CN2c2ncc(-c3nn[n-]n3)cc2Cl)c1 ZINC000826215206 609593014 /nfs/dbraw/zinc/59/30/14/609593014.db2.gz JHKKQFZJZYGZHJ-BZNIZROVSA-N -1 3 370.844 3.511 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)N1CCC[C@H]1/C=C\c1ccccc1 ZINC000826452440 609607378 /nfs/dbraw/zinc/60/73/78/609607378.db2.gz TZCJVFPTEWGWJD-ZHJQRIIBSA-N -1 3 360.421 3.576 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)N1CCC[C@H]1/C=C\c1ccccc1 ZINC000826452440 609607380 /nfs/dbraw/zinc/60/73/80/609607380.db2.gz TZCJVFPTEWGWJD-ZHJQRIIBSA-N -1 3 360.421 3.576 20 0 FHADHM C[C@H](C(=O)OCc1ccc(Cl)cc1-c1nnn[n-]1)c1ccccc1F ZINC000824052598 609612734 /nfs/dbraw/zinc/61/27/34/609612734.db2.gz PYRRHAUURNEPFP-JTQLQIEISA-N -1 3 360.776 3.506 20 0 FHADHM C[C@H](C(=O)OCc1ccc(Cl)cc1-c1nn[n-]n1)c1ccccc1F ZINC000824052598 609612735 /nfs/dbraw/zinc/61/27/35/609612735.db2.gz PYRRHAUURNEPFP-JTQLQIEISA-N -1 3 360.776 3.506 20 0 FHADHM CCCCSCCC(=O)Nc1cccc(-c2nc(CC)cc(=O)[n-]2)c1 ZINC000150726371 937079587 /nfs/dbraw/zinc/07/95/87/937079587.db2.gz ZEXWFNOHGOWIIY-UHFFFAOYSA-N -1 3 359.495 3.861 20 0 FHADHM COc1cc(-c2nc(C(F)(F)c3ccc(F)cc3)no2)cc(OC)c1[O-] ZINC000547618489 927076948 /nfs/dbraw/zinc/07/69/48/927076948.db2.gz IRXYWQIUDCSCOG-UHFFFAOYSA-N -1 3 366.295 3.739 20 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O=C(N[C@@H]1CC[C@H](c2ccccc2F)C1)c1cc(=O)c2ccccc2[n-]1 ZINC000366666415 943800293 /nfs/dbraw/zinc/80/02/93/943800293.db2.gz PTRZLWPIWXEUQK-UONOGXRCSA-N -1 3 350.393 3.733 20 0 FHADHM CC(C)Cc1ccc([C@@H](C)NC(=O)CN2CCCC[C@@H]2CCC(=O)[O-])cc1 ZINC000424257529 943809380 /nfs/dbraw/zinc/80/93/80/943809380.db2.gz KNFOAQYMMNRCQM-YLJYHZDGSA-N -1 3 374.525 3.782 20 0 FHADHM CSc1ccc(-c2nsc([N-]C(=O)c3cc(Cl)n(C)n3)n2)cc1 ZINC001126437664 943816025 /nfs/dbraw/zinc/81/60/25/943816025.db2.gz HFTXKUBUWQIFML-UHFFFAOYSA-N -1 3 365.871 3.566 20 0 FHADHM CC(=O)c1cccc(NC(=O)c2cc(-c3ccccc3Cl)[nH]n2)c1[O-] ZINC000515390856 943835501 /nfs/dbraw/zinc/83/55/01/943835501.db2.gz WLTFBCMAINAUKA-UHFFFAOYSA-N -1 3 355.781 3.891 20 0 FHADHM COc1cc(C(=O)N[C@@]2(c3ccc(Cl)cc3)C[C@@H]2C)cc(OC)c1[O-] ZINC000505738340 943918332 /nfs/dbraw/zinc/91/83/32/943918332.db2.gz QFVRRJHIIRMNFS-WLRWDXFRSA-N -1 3 361.825 3.728 20 0 FHADHM Fc1cccc(Oc2ccc(CNC3(c4nn[n-]n4)CCCC3)cc2)c1 ZINC000517070330 943971482 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CC1(C)CN(C(=O)c2cc([O-])ccc2Cl)C[C@@](C)(C(F)(F)F)O1 ZINC000505791998 944196234 /nfs/dbraw/zinc/19/62/34/944196234.db2.gz AQANPYHWTYFWEI-AWEZNQCLSA-N -1 3 351.752 3.618 20 0 FHADHM Cc1oc(-c2ccccc2)c(C(=O)Nc2ccc(-c3nnn[n-]3)cc2)c1C ZINC000436332963 944212117 /nfs/dbraw/zinc/21/21/17/944212117.db2.gz IWKKBBKJAUHTAS-UHFFFAOYSA-N -1 3 359.389 3.996 20 0 FHADHM Cc1oc(-c2ccccc2)c(C(=O)Nc2ccc(-c3nn[n-]n3)cc2)c1C ZINC000436332963 944212121 /nfs/dbraw/zinc/21/21/21/944212121.db2.gz IWKKBBKJAUHTAS-UHFFFAOYSA-N -1 3 359.389 3.996 20 0 FHADHM Cc1c(Br)cccc1C(=O)N=c1cc(-c2ccccc2)[n-][nH]1 ZINC000439023627 944263317 /nfs/dbraw/zinc/26/33/17/944263317.db2.gz WUOPQFXAHSAEKY-UHFFFAOYSA-N -1 3 356.223 3.822 20 0 FHADHM CN(Cc1ccc2c(c1)OCCO2)Cc1cccc([O-])c1Br ZINC000518330068 944277727 /nfs/dbraw/zinc/27/77/27/944277727.db2.gz UHRNXXVGWAGYCC-UHFFFAOYSA-N -1 3 364.239 3.558 20 0 FHADHM Cc1cc(=O)[n-]c(-c2cccc(NC(=O)c3occc3Br)c2)n1 ZINC000364316882 944302078 /nfs/dbraw/zinc/30/20/78/944302078.db2.gz 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366.461 3.568 20 0 FHADHM Cc1cccc(C(=O)Nc2ccc(Oc3cccc(C(N)=O)c3)cc2)c1[O-] ZINC000436556796 944413534 /nfs/dbraw/zinc/41/35/34/944413534.db2.gz LYIKWAYCTWVBAG-UHFFFAOYSA-N -1 3 362.385 3.844 20 0 FHADHM CCCCC1CCC(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2[O-])CC1 ZINC000436556650 944413574 /nfs/dbraw/zinc/41/35/74/944413574.db2.gz SRYDZHRTZBSWGD-FAFZWHIHSA-N -1 3 372.509 3.862 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(Cl)cc2C(=O)N2CCCC2)c([O-])c1 ZINC000436542397 944420169 /nfs/dbraw/zinc/42/01/69/944420169.db2.gz GVAINRJXMWUWCI-UHFFFAOYSA-N -1 3 358.825 3.842 20 0 FHADHM COc1ccc(C(=O)N[C@H](Cc2ccc(C)cc2)c2ccccn2)c([O-])c1 ZINC000436543861 944421073 /nfs/dbraw/zinc/42/10/73/944421073.db2.gz JRFLMFRODWBDNV-HXUWFJFHSA-N -1 3 362.429 3.818 20 0 FHADHM Cc1ccc(C(=O)Nc2cc(F)ccc2OC[C@@H]2CCCO2)c([O-])c1C ZINC000436557190 944426004 /nfs/dbraw/zinc/42/60/04/944426004.db2.gz STVOYDGXKMHAOS-HNNXBMFYSA-N -1 3 359.397 3.958 20 0 FHADHM CC(C)c1ccc(C(=O)NCCc2nc3cc(F)ccc3n2C)c([O-])c1 ZINC000436559468 944426420 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CC(C)c1ccc(C(=O)N[C@H](C)c2nc(Cc3ccccc3)no2)c([O-])c1 ZINC000436591238 944437837 /nfs/dbraw/zinc/43/78/37/944437837.db2.gz WAZNCRPKIJONNO-CQSZACIVSA-N -1 3 365.433 3.980 20 0 FHADHM CC(=O)c1ccc(C(=O)N(C)CCCOc2cccc(Cl)c2)cc1[O-] ZINC000436595386 944440953 /nfs/dbraw/zinc/44/09/53/944440953.db2.gz LMAQBOCKSOKVLJ-UHFFFAOYSA-N -1 3 361.825 3.789 20 0 FHADHM COc1ccc(C(=O)NC[C@@H](C)CSc2ccccc2OC)c([O-])c1 ZINC000436598255 944443113 /nfs/dbraw/zinc/44/31/13/944443113.db2.gz ZGKGYICIDLJWQN-CYBMUJFWSA-N -1 3 361.463 3.568 20 0 FHADHM O=C(c1ccccc1[O-])N1CC[C@@H](Oc2ccc(Cl)c(Cl)c2)C1 ZINC000436580208 944445461 /nfs/dbraw/zinc/44/54/61/944445461.db2.gz BGWFBZIHXVFVHC-GFCCVEGCSA-N -1 3 352.217 3.993 20 0 FHADHM COCCOCCN(Cc1ccccc1)C(=O)c1ccc(C(C)C)cc1[O-] ZINC000436587147 944449604 /nfs/dbraw/zinc/44/96/04/944449604.db2.gz VUADCSBMPZGLEB-UHFFFAOYSA-N -1 3 371.477 3.821 20 0 FHADHM Cc1ccc([C@H](Cn2ccnc2)NC(=O)c2cc(F)ccc2[O-])c(C)c1 ZINC000436600254 944453271 /nfs/dbraw/zinc/45/32/71/944453271.db2.gz 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O=C(Nc1ccccc1)Nc1cccc(CNC(=O)c2ccccc2[O-])c1 ZINC000436702709 944542560 /nfs/dbraw/zinc/54/25/60/944542560.db2.gz DUCXYIVQKJMCCV-UHFFFAOYSA-N -1 3 361.401 3.966 20 0 FHADHM COCCC[C@@H](CNC(=O)c1c([O-])cccc1O)c1ccc(Cl)cc1 ZINC000436706370 944546765 /nfs/dbraw/zinc/54/67/65/944546765.db2.gz CNMZWWVUZQGWQL-AWEZNQCLSA-N -1 3 363.841 3.691 20 0 FHADHM O=C([O-])[C@@H]1CN(Cc2csc(-c3ccco3)n2)C[C@H]1c1ccccc1 ZINC000516181456 944548640 /nfs/dbraw/zinc/54/86/40/944548640.db2.gz HIBQCTMQUPBRAD-JKSUJKDBSA-N -1 3 354.431 3.703 20 0 FHADHM CN(C)Cc1cc(CNC(=O)c2ccc3ccccc3c2[O-])ccc1F ZINC000436744211 944573103 /nfs/dbraw/zinc/57/31/03/944573103.db2.gz KKAIRRBIGRXDJE-UHFFFAOYSA-N -1 3 352.409 3.676 20 0 FHADHM C[C@@H]1C[C@H](C(C)(C)C)CCN1C(=O)[C@H]1CCCN1C(=O)c1ccccc1[O-] ZINC000436745865 944573715 /nfs/dbraw/zinc/57/37/15/944573715.db2.gz FCLXTZQBAOXIIO-JFIYKMOQSA-N -1 3 372.509 3.670 20 0 FHADHM CC1(C)Cc2ccc(C(=O)Nc3csc(-c4ccncc4)n3)c([O-])c2O1 ZINC000436728646 944575560 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CC[C@@H](C(=O)Nc1sc(C)c(C)c1-c1nn[n-]n1)c1ccc(OC)cc1 ZINC000825038401 947053542 /nfs/dbraw/zinc/05/35/42/947053542.db2.gz AVXZKNJOZHAFFH-CQSZACIVSA-N -1 3 371.466 3.686 20 0 FHADHM CCC(CC)n1nc(C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1C ZINC000825115086 947083787 /nfs/dbraw/zinc/08/37/87/947083787.db2.gz TYQCUEOFACTIRX-UHFFFAOYSA-N -1 3 373.848 3.638 20 0 FHADHM CCC(CC)n1nc(C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1C ZINC000825115086 947083798 /nfs/dbraw/zinc/08/37/98/947083798.db2.gz TYQCUEOFACTIRX-UHFFFAOYSA-N -1 3 373.848 3.638 20 0 FHADHM C[C@H]1C[C@@H](C(=O)N=c2cc(-c3cc(Cl)cc(Cl)c3)[n-][nH]2)CCC1=O ZINC000328932846 947114817 /nfs/dbraw/zinc/11/48/17/947114817.db2.gz DRFSTRIUVZUVET-UWVGGRQHSA-N -1 3 366.248 3.749 20 0 FHADHM CCCc1c(NCc2ccc(-c3nnn[n-]3)s2)cnn1-c1ccccc1 ZINC000825348465 947160925 /nfs/dbraw/zinc/16/09/25/947160925.db2.gz LXTKGKIEOMFRGM-UHFFFAOYSA-N -1 3 365.466 3.679 20 0 FHADHM CCN(C(=O)[C@H](C)CCCc1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825362515 947163295 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Cc1cc(=O)[n-]c([C@@H](C)N2CCO[C@@H](c3ccc(C(F)(F)F)cc3)C2)n1 ZINC000248712242 947309235 /nfs/dbraw/zinc/30/92/35/947309235.db2.gz CYSJBWGTELPMTD-IUODEOHRSA-N -1 3 367.371 3.644 20 0 FHADHM COc1cc(-c2nnn[n-]2)cc(Cl)c1OCCCc1ccsc1 ZINC000826167863 947529791 /nfs/dbraw/zinc/52/97/91/947529791.db2.gz UBBGTZHBZBYPKV-UHFFFAOYSA-N -1 3 350.831 3.602 20 0 FHADHM COc1cc(-c2nn[n-]n2)cc(Cl)c1OCCCc1ccsc1 ZINC000826167863 947529802 /nfs/dbraw/zinc/52/98/02/947529802.db2.gz UBBGTZHBZBYPKV-UHFFFAOYSA-N -1 3 350.831 3.602 20 0 FHADHM O=C(c1cc2c(cc1[O-])OCO2)N(Cc1ccco1)Cc1ccccc1 ZINC000093923421 947535524 /nfs/dbraw/zinc/53/55/24/947535524.db2.gz DWUKRYVXIXLHIY-UHFFFAOYSA-N -1 3 351.358 3.557 20 0 FHADHM CC(C)(C)OC(=O)Nc1cccc(CC(=O)[N-]OCCC(F)(F)F)c1 ZINC000162835182 947548841 /nfs/dbraw/zinc/54/88/41/947548841.db2.gz SBZRWSZPONKJTL-UHFFFAOYSA-N -1 3 362.348 3.576 20 0 FHADHM O=c1c2c3c(sc2ncn1N=Cc1cc(Cl)ccc1[O-])CCCC3 ZINC000254606661 947600992 /nfs/dbraw/zinc/60/09/92/947600992.db2.gz 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Cc1c(Cl)cnc(N2CC[C@@H]2c2ccc(Cl)cc2)c1-c1nnn[n-]1 ZINC000826238171 947700316 /nfs/dbraw/zinc/70/03/16/947700316.db2.gz YJAZPGTTXFUYQP-CYBMUJFWSA-N -1 3 361.236 3.828 20 0 FHADHM Cc1c(Cl)cnc(N2CC[C@@H]2c2ccc(Cl)cc2)c1-c1nn[n-]n1 ZINC000826238171 947700327 /nfs/dbraw/zinc/70/03/27/947700327.db2.gz YJAZPGTTXFUYQP-CYBMUJFWSA-N -1 3 361.236 3.828 20 0 FHADHM Cc1c(Cl)cnc(N[C@H]2CCCOc3cc(F)ccc32)c1-c1nnn[n-]1 ZINC000826239203 947705708 /nfs/dbraw/zinc/70/57/08/947705708.db2.gz ZVZNHPRLNAWCSQ-ZDUSSCGKSA-N -1 3 374.807 3.688 20 0 FHADHM Cc1c(Cl)cnc(N[C@H]2CCCOc3cc(F)ccc32)c1-c1nn[n-]n1 ZINC000826239203 947705718 /nfs/dbraw/zinc/70/57/18/947705718.db2.gz ZVZNHPRLNAWCSQ-ZDUSSCGKSA-N -1 3 374.807 3.688 20 0 FHADHM Cc1cc(C)c(C)c(S(=O)(=O)[N-]c2cccc(-n3ccnc3)c2)c1C ZINC000523932750 947738019 /nfs/dbraw/zinc/73/80/19/947738019.db2.gz AICQFLBIHQSJBZ-UHFFFAOYSA-N -1 3 355.463 3.907 20 0 FHADHM C/C(=C\c1ccccc1)CN(C)C(=O)c1c(C)cc(-c2nnn[n-]2)cc1C ZINC001573367113 947755279 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Cc1ccc([C@@H]2CCN(c3ccc4cc(-c5nnn[n-]5)ccc4n3)C2)cc1 ZINC000826286010 947825887 /nfs/dbraw/zinc/82/58/87/947825887.db2.gz PWJJJEWCRBGIJB-GOSISDBHSA-N -1 3 356.433 3.717 20 0 FHADHM Cc1ccc([C@@H]2CCN(c3ccc4cc(-c5nn[n-]n5)ccc4n3)C2)cc1 ZINC000826286010 947825895 /nfs/dbraw/zinc/82/58/95/947825895.db2.gz PWJJJEWCRBGIJB-GOSISDBHSA-N -1 3 356.433 3.717 20 0 FHADHM Cc1ccc(C[C@H](C)C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000826286883 947830831 /nfs/dbraw/zinc/83/08/31/947830831.db2.gz URLODERVFXYVKN-LBPRGKRZSA-N -1 3 355.829 3.646 20 0 FHADHM Cc1ccc(C[C@H](C)C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000826286883 947830838 /nfs/dbraw/zinc/83/08/38/947830838.db2.gz URLODERVFXYVKN-LBPRGKRZSA-N -1 3 355.829 3.646 20 0 FHADHM Cc1ccc(Cl)cc1NC(=O)C[C@@H](C)Nc1cccc(-c2nnn[n-]2)c1 ZINC000826289282 947839797 /nfs/dbraw/zinc/83/97/97/947839797.db2.gz TZFQJJHLXBAXEK-GFCCVEGCSA-N -1 3 370.844 3.658 20 0 FHADHM Cc1ccc(Cl)cc1NC(=O)C[C@@H](C)Nc1cccc(-c2nn[n-]n2)c1 ZINC000826289282 947839806 /nfs/dbraw/zinc/83/98/06/947839806.db2.gz TZFQJJHLXBAXEK-GFCCVEGCSA-N -1 3 370.844 3.658 20 0 FHADHM Cc1ccccc1[C@H]1CCN(c2ncc(Cl)c(C)c2-c2nnn[n-]2)C1 ZINC000826307113 947881607 /nfs/dbraw/zinc/88/16/07/947881607.db2.gz WWBZMRRVEVHFBX-ZDUSSCGKSA-N -1 3 354.845 3.526 20 0 FHADHM Cc1ccccc1[C@H]1CCN(c2ncc(Cl)c(C)c2-c2nn[n-]n2)C1 ZINC000826307113 947881614 /nfs/dbraw/zinc/88/16/14/947881614.db2.gz WWBZMRRVEVHFBX-ZDUSSCGKSA-N -1 3 354.845 3.526 20 0 FHADHM Cc1ccc(F)c(-c2cc(NC(=O)c3c[n-]c4ccccc4c3=O)n[nH]2)c1 ZINC000190097770 947922268 /nfs/dbraw/zinc/92/22/68/947922268.db2.gz DMSVEKFCBYXDDO-UHFFFAOYSA-N -1 3 362.364 3.618 20 0 FHADHM CCCCOc1ccc(C(=O)N2CC[C@H](Nc3ccccc3)C2)c([O-])c1 ZINC000190286196 947964101 /nfs/dbraw/zinc/96/41/01/947964101.db2.gz DNTDBOPMDSNUCM-KRWDZBQOSA-N -1 3 354.450 3.898 20 0 FHADHM C[C@@H](N[C@@H](C)Cc1ccc(Br)cc1)c1ncc(C(=O)[O-])s1 ZINC000314653354 948009585 /nfs/dbraw/zinc/00/95/85/948009585.db2.gz MVYSQPZVCSVTES-VHSXEESVSA-N -1 3 369.284 3.886 20 0 FHADHM CC(C)[C@@H](NC(=O)Nc1ccc2c(c1)C(=O)[N-]C2=O)c1ccc(Cl)cc1 ZINC000520490540 948070189 /nfs/dbraw/zinc/07/01/89/948070189.db2.gz SLGFCPPKCXKZFR-MRXNPFEDSA-N -1 3 371.824 3.742 20 0 FHADHM C[C@@H]1CCN(Cc2ccnc3c(Br)cccc23)C[C@@H]1C(=O)[O-] ZINC000563134338 948091523 /nfs/dbraw/zinc/09/15/23/948091523.db2.gz YUSMVVGEJKRFEC-RISCZKNCSA-N -1 3 363.255 3.540 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)c1cccc(Oc2ccccc2)c1 ZINC000520506743 948203528 /nfs/dbraw/zinc/20/35/28/948203528.db2.gz FIACXOAVNNNYNZ-UHFFFAOYSA-N -1 3 357.373 3.911 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)c1cccc(Oc2ccccc2)c1 ZINC000520506743 948203534 /nfs/dbraw/zinc/20/35/34/948203534.db2.gz FIACXOAVNNNYNZ-UHFFFAOYSA-N -1 3 357.373 3.911 20 0 FHADHM O=C(CCc1ccc2[nH]ccc2c1)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000826409412 948244887 /nfs/dbraw/zinc/24/48/87/948244887.db2.gz XRIONNPZSNGCJE-UHFFFAOYSA-N -1 3 366.812 3.573 20 0 FHADHM O=C(CCc1ccc2[nH]ccc2c1)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000826409412 948244897 /nfs/dbraw/zinc/24/48/97/948244897.db2.gz XRIONNPZSNGCJE-UHFFFAOYSA-N -1 3 366.812 3.573 20 0 FHADHM CC[C@@H](C)C(=O)N1CCC[C@H](C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)C1 ZINC000134219058 948270381 /nfs/dbraw/zinc/27/03/81/948270381.db2.gz HIFCNRUGMJMWFM-NEPJUHHUSA-N -1 3 372.387 3.634 20 0 FHADHM O=C([O-])[C@@H](CC1CCCC1)NCc1csc(-c2ccc3c(c2)OCO3)n1 ZINC000417576669 948280649 /nfs/dbraw/zinc/28/06/49/948280649.db2.gz KNADZVPDTFDALO-OAHLLOKOSA-N -1 3 374.462 3.662 20 0 FHADHM O=S(=O)([N-]CC1(CCO)CCCCC1)c1c(Cl)cccc1Cl ZINC000182492152 948287785 /nfs/dbraw/zinc/28/77/85/948287785.db2.gz QFISWYOMJXRDBQ-UHFFFAOYSA-N -1 3 366.310 3.605 20 0 FHADHM CCOC(=O)C(=Cc1cccc(F)c1)c1nc(=O)c2c(C)c(C)sc2[n-]1 ZINC000006210603 948325608 /nfs/dbraw/zinc/32/56/08/948325608.db2.gz FHRHCRCHBYVOLF-ZROIWOOFSA-N -1 3 372.421 3.844 20 0 FHADHM O=C(Nc1csc2ccccc12)c1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000826459729 948343179 /nfs/dbraw/zinc/34/31/79/948343179.db2.gz XIXQCIPAXKAEQU-UHFFFAOYSA-N -1 3 355.810 3.987 20 0 FHADHM O=C(Nc1csc2ccccc12)c1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000826459729 948343188 /nfs/dbraw/zinc/34/31/88/948343188.db2.gz XIXQCIPAXKAEQU-UHFFFAOYSA-N -1 3 355.810 3.987 20 0 FHADHM O=C([N-]c1cc(Cl)cc(F)c1F)c1cnc(-c2ncccn2)s1 ZINC000441610279 948356966 /nfs/dbraw/zinc/35/69/66/948356966.db2.gz LSIGNHVUELGTHV-UHFFFAOYSA-N -1 3 352.753 3.784 20 0 FHADHM CO[C@H](CNCc1ccc(-c2ccc(Cl)c(Cl)c2)o1)CC(=O)[O-] ZINC000417637115 948378223 /nfs/dbraw/zinc/37/82/23/948378223.db2.gz MQPKMIWEHYFIHC-LBPRGKRZSA-N -1 3 358.221 3.833 20 0 FHADHM COC(=O)c1ccc(C(=O)Nc2nc(-c3ccc(C)c(C)c3)cs2)[n-]1 ZINC000432424541 948386461 /nfs/dbraw/zinc/38/64/61/948386461.db2.gz JLKCHXBVNLBAOM-UHFFFAOYSA-N -1 3 355.419 3.794 20 0 FHADHM C[C@@H]1CC[C@](C)(/C=C/C(=O)NCc2ccc(-c3nnn[n-]3)cc2)C1(C)C ZINC001464879561 948530979 /nfs/dbraw/zinc/53/09/79/948530979.db2.gz IARSHWQEYPNTAA-RQCCPNNXSA-N -1 3 353.470 3.502 20 0 FHADHM C[C@@H]1CC[C@](C)(/C=C/C(=O)NCc2ccc(-c3nn[n-]n3)cc2)C1(C)C ZINC001464879561 948530984 /nfs/dbraw/zinc/53/09/84/948530984.db2.gz IARSHWQEYPNTAA-RQCCPNNXSA-N -1 3 353.470 3.502 20 0 FHADHM Cc1ccc(C[C@@H]2CCCN(C(=O)c3cc(=O)c4ccccc4[n-]3)C2)cc1 ZINC000050768817 948700460 /nfs/dbraw/zinc/70/04/60/948700460.db2.gz VNTBXUHYONLUIR-SFHVURJKSA-N -1 3 360.457 3.931 20 0 FHADHM C[C@H]([N-]S(=O)(=O)c1cc(F)cc(F)c1)c1nc(C(C)(C)C)cs1 ZINC000106893482 948710302 /nfs/dbraw/zinc/71/03/02/948710302.db2.gz BYQHXCHHANJXMA-VIFPVBQESA-N -1 3 360.451 3.758 20 0 FHADHM C[C@@H]([N-]S(=O)(=O)c1ccc(F)cc1F)c1nc(C(C)(C)C)cs1 ZINC000106893402 948710345 /nfs/dbraw/zinc/71/03/45/948710345.db2.gz DYCWGLVKVRWNIB-SECBINFHSA-N -1 3 360.451 3.758 20 0 FHADHM Cc1noc(C)c1C(C)(C)C(=O)Nc1cc(Br)ccc1[O-] ZINC000280841478 948726291 /nfs/dbraw/zinc/72/62/91/948726291.db2.gz QHOWZBTWCUTRBC-UHFFFAOYSA-N -1 3 353.216 3.676 20 0 FHADHM O=C(Nc1ncccc1[O-])c1cccc(-n2nccc2-c2ccccc2)c1 ZINC000063090590 948735100 /nfs/dbraw/zinc/73/51/00/948735100.db2.gz JTJJQVZPVCJVFH-UHFFFAOYSA-N -1 3 356.385 3.892 20 0 FHADHM C[C@H](C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C)c1ccc(Cl)cc1 ZINC001573755114 948752251 /nfs/dbraw/zinc/75/22/51/948752251.db2.gz AMYKRNNFWDFFRA-NSHDSACASA-N -1 3 372.860 3.819 20 0 FHADHM C[C@H](C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C)c1ccc(Cl)cc1 ZINC001573755114 948752258 /nfs/dbraw/zinc/75/22/58/948752258.db2.gz AMYKRNNFWDFFRA-NSHDSACASA-N -1 3 372.860 3.819 20 0 FHADHM C[C@@H](Cc1ccccc1Cl)[N-]S(=O)(=O)c1ccc(Cl)s1 ZINC000049335210 948763888 /nfs/dbraw/zinc/76/38/88/948763888.db2.gz ZZOLRPNBWUBGOA-VIFPVBQESA-N -1 3 350.292 3.964 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N[C@@H]2CC(C)(C)Oc3ccc(F)cc32)c1 ZINC000652818296 948777414 /nfs/dbraw/zinc/77/74/14/948777414.db2.gz CZOHOIOPXJYTAW-MRXNPFEDSA-N -1 3 372.396 3.522 20 0 FHADHM CC(C)NC(=O)Cc1ccc(NC(=O)c2cc3c(cc2[O-])CCCC3)cc1 ZINC000109191005 209300843 /nfs/dbraw/zinc/30/08/43/209300843.db2.gz HWKBVZJYIZCPLW-UHFFFAOYSA-N -1 3 366.461 3.590 20 0 FHADHM O=C([N-]c1nnc(C(F)F)s1)c1cc(F)cc(Br)c1 ZINC000108998695 209296290 /nfs/dbraw/zinc/29/62/90/209296290.db2.gz VPYGTTZDLFZGHH-UHFFFAOYSA-N -1 3 352.135 3.630 20 0 FHADHM CN(C)[C@H](C[N-]S(=O)(=O)c1c(Cl)cccc1Cl)c1ccccc1 ZINC000098068618 209203744 /nfs/dbraw/zinc/20/37/44/209203744.db2.gz LFXPSTWDTZIOJQ-OAHLLOKOSA-N -1 3 373.305 3.575 20 0 FHADHM O=C(Nc1ccccc1[O-])c1nn(-c2ccc(F)c(F)c2)c2c1CCC2 ZINC000045012447 208324328 /nfs/dbraw/zinc/32/43/28/208324328.db2.gz GGWFNCLIXQUTIH-UHFFFAOYSA-N -1 3 355.344 3.597 20 0 FHADHM O=C(Nc1nnc(-c2ccccn2)[n-]1)c1cc2c(s1)-c1ccccc1CC2 ZINC000047343208 208379278 /nfs/dbraw/zinc/37/92/78/208379278.db2.gz JNHWMPRQEFVDNM-UHFFFAOYSA-N -1 3 373.441 3.946 20 0 FHADHM O=C(Nc1nc(-c2ccccn2)n[n-]1)c1cc2c(s1)-c1ccccc1CC2 ZINC000047343208 208379281 /nfs/dbraw/zinc/37/92/81/208379281.db2.gz JNHWMPRQEFVDNM-UHFFFAOYSA-N -1 3 373.441 3.946 20 0 FHADHM O=C(Nc1n[n-]c(-c2ccccn2)n1)c1cc2c(s1)-c1ccccc1CC2 ZINC000047343208 208379288 /nfs/dbraw/zinc/37/92/88/208379288.db2.gz JNHWMPRQEFVDNM-UHFFFAOYSA-N -1 3 373.441 3.946 20 0 FHADHM CC(C)Cc1n[n-]c(=NC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)s1 ZINC000508899326 514946843 /nfs/dbraw/zinc/94/68/43/514946843.db2.gz OIXDRNRZQWXGQU-XJKSGUPXSA-N -1 3 361.515 3.550 20 0 FHADHM Cn1[n-]c(=NC(=O)c2cc(Cl)ccc2OC(F)F)cc1OC(F)F ZINC000491055044 515367118 /nfs/dbraw/zinc/36/71/18/515367118.db2.gz WDZUEBBKUAXFIF-UHFFFAOYSA-N -1 3 367.686 3.529 20 0 FHADHM CCN(C(=O)N=c1[n-]nc(C)s1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000473687110 515716001 /nfs/dbraw/zinc/71/60/01/515716001.db2.gz PKOUMHIDPHNMBR-CJNGLKHVSA-N -1 3 359.499 3.536 20 0 FHADHM O=C(N=c1cc([C@H]2CCCO2)[n-][nH]1)c1cc(F)c(F)cc1Br ZINC000473846051 515771791 /nfs/dbraw/zinc/77/17/91/515771791.db2.gz HWLIJABIRZDILJ-GFCCVEGCSA-N -1 3 372.169 3.554 20 0 FHADHM O=C(N=c1cc([C@H]2CCCO2)[n-][nH]1)c1cnc(Cc2ccccc2)s1 ZINC000473850266 515775632 /nfs/dbraw/zinc/77/56/32/515775632.db2.gz NGDCNKLQBZDCOL-CQSZACIVSA-N -1 3 354.435 3.561 20 0 FHADHM O=C(N=c1cc([C@H]2CCCO2)[n-][nH]1)c1c[nH]nc1-c1ccccc1Cl ZINC000473859415 515780909 /nfs/dbraw/zinc/78/09/09/515780909.db2.gz UKKUFDAXIZKKAP-CQSZACIVSA-N -1 3 357.801 3.557 20 0 FHADHM O=C(N=c1cc(-c2ccccc2)[n-][nH]1)c1cn(-c2ccccc2Cl)nn1 ZINC000497567575 516326711 /nfs/dbraw/zinc/32/67/11/516326711.db2.gz KFODEMZCSDISGT-UHFFFAOYSA-N -1 3 364.796 3.563 20 0 FHADHM Cc1cc(C)cc(-c2cc(=NC(=O)c3cccc(-n4ccnn4)c3)[nH][n-]2)c1 ZINC000535974571 516576473 /nfs/dbraw/zinc/57/64/73/516576473.db2.gz UAMYWCZOTFPKLO-UHFFFAOYSA-N -1 3 358.405 3.527 20 0 FHADHM CCCN(CCN1CCCCC1)C(=O)N=c1[n-]nc(-c2ccco2)s1 ZINC000515394183 517332889 /nfs/dbraw/zinc/33/28/89/517332889.db2.gz ZKALQEGYESZDSA-UHFFFAOYSA-N -1 3 363.487 3.528 20 0 FHADHM Cn1cc(C(=O)N=c2cc([C@@H]3CCCO3)[n-][nH]2)c(-c2ccccc2Cl)n1 ZINC000526960259 517412180 /nfs/dbraw/zinc/41/21/80/517412180.db2.gz RNTXNANMBMQKMP-HNNXBMFYSA-N -1 3 371.828 3.567 20 0 FHADHM O=C(Cc1csc(-c2ccccc2)n1)N=c1cc([C@@H]2CCCO2)[n-][nH]1 ZINC000526959882 517412261 /nfs/dbraw/zinc/41/22/61/517412261.db2.gz MRBXMSXUNKOGMU-HNNXBMFYSA-N -1 3 354.435 3.566 20 0 FHADHM O=C(N=c1cc([C@@H]2CCCO2)[n-][nH]1)c1c(F)cc(Br)cc1F ZINC000527208342 517562661 /nfs/dbraw/zinc/56/26/61/517562661.db2.gz BGQVMVRVYYDUKG-NSHDSACASA-N -1 3 372.169 3.554 20 0 FHADHM O=C(N=c1cc(-c2cccc(Cl)c2)[n-][nH]1)c1cc(-n2cccn2)ccn1 ZINC000605883051 520960551 /nfs/dbraw/zinc/96/05/51/520960551.db2.gz RXRABGOAQXDYRU-UHFFFAOYSA-N -1 3 364.796 3.563 20 0 FHADHM CN(Cc1ccccc1)[C@H]1CCN(C(=O)N=c2[n-]nc(C(C)(C)C)s2)C1 ZINC000608288968 521646335 /nfs/dbraw/zinc/64/63/35/521646335.db2.gz LZOWEHSVKXPSIY-HNNXBMFYSA-N -1 3 373.526 3.574 20 0 FHADHM O=C(N=c1cc(-c2cccc(Cl)c2)[n-][nH]1)c1ccn(C2CCOCC2)n1 ZINC000629953180 522544079 /nfs/dbraw/zinc/54/40/79/522544079.db2.gz KMWNTYRLFSNRNQ-UHFFFAOYSA-N -1 3 371.828 3.530 20 0 FHADHM Nc1c(Cl)c(F)cc(C(=O)N=c2cc([C@H]3CCCO3)[n-][nH]2)c1Cl ZINC000636144577 522769054 /nfs/dbraw/zinc/76/90/54/522769054.db2.gz RSTWROUDAJNYIF-SECBINFHSA-N -1 3 359.188 3.542 20 0 FHADHM Cc1ccc(NC(=O)c2cn[n-]c2-c2ccsc2)cc1C(=O)NC(C)C ZINC000186792107 567983933 /nfs/dbraw/zinc/98/39/33/567983933.db2.gz LSAGDKZMWAMFAV-UHFFFAOYSA-N -1 3 368.462 3.837 20 0 FHADHM Cc1ccc(NC(=O)c2c[n-]nc2-c2ccsc2)cc1C(=O)NC(C)C ZINC000186792107 567983934 /nfs/dbraw/zinc/98/39/34/567983934.db2.gz LSAGDKZMWAMFAV-UHFFFAOYSA-N -1 3 368.462 3.837 20 0 FHADHM COc1ccccc1CNC(=O)c1ccc(C(=O)c2cccc([O-])c2)cc1 ZINC000187024702 568002935 /nfs/dbraw/zinc/00/29/35/568002935.db2.gz NPFFMFHIRVLWNQ-UHFFFAOYSA-N -1 3 361.397 3.562 20 0 FHADHM COC(=O)c1sc([N-]C(=O)c2cnc(C3CC3)o2)nc1C1CCCC1 ZINC000603007493 568051208 /nfs/dbraw/zinc/05/12/08/568051208.db2.gz KHDOLNOOKXGJFH-UHFFFAOYSA-N -1 3 361.423 3.705 20 0 FHADHM CCSCC[C@@H](C)N(C)C(=O)N=c1[n-]n(CC(F)(F)F)cc1Cl ZINC000603043135 568054995 /nfs/dbraw/zinc/05/49/95/568054995.db2.gz LMTHLVVUGMJPJQ-SECBINFHSA-N -1 3 372.844 3.516 20 0 FHADHM C[C@@H](SCCc1nnn[n-]1)c1nnc(-c2ccc(Cl)cc2Cl)o1 ZINC000603341022 568087131 /nfs/dbraw/zinc/08/71/31/568087131.db2.gz VYCKBJHEMURSFW-SSDOTTSWSA-N -1 3 371.253 3.593 20 0 FHADHM C[C@@H](SCCc1nn[n-]n1)c1nnc(-c2ccc(Cl)cc2Cl)o1 ZINC000603341022 568087132 /nfs/dbraw/zinc/08/71/32/568087132.db2.gz VYCKBJHEMURSFW-SSDOTTSWSA-N -1 3 371.253 3.593 20 0 FHADHM O=S(=O)([N-]C[C@@H]1OCCc2ccccc21)c1ccc(Cl)c(Cl)c1 ZINC000603506885 568109839 /nfs/dbraw/zinc/10/98/39/568109839.db2.gz XKDQVDRWCZEJJA-INIZCTEOSA-N -1 3 372.273 3.586 20 0 FHADHM CC(C)c1cc(C(=O)N(C)Cc2nnc3ccccn32)c([O-])c(C(C)C)c1 ZINC000603547275 568118064 /nfs/dbraw/zinc/11/80/64/568118064.db2.gz KXYWZFYDBTYSIR-UHFFFAOYSA-N -1 3 366.465 3.954 20 0 FHADHM Cc1noc(C)c1[C@@H](C)[N-]S(=O)(=O)c1c(Cl)ccc(C)c1Cl ZINC000603718952 568147237 /nfs/dbraw/zinc/14/72/37/568147237.db2.gz WUAZMDZCVWXRTJ-SECBINFHSA-N -1 3 363.266 3.946 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)NCc3cc(C(C)C)no3)cc2)cc(=O)[n-]1 ZINC000603952429 568187578 /nfs/dbraw/zinc/18/75/78/568187578.db2.gz YXZOHWRZKNHDSO-UHFFFAOYSA-N -1 3 367.409 3.591 20 0 FHADHM O=S(=O)([N-]Cc1ccc2ccccc2n1)c1cccc(Cl)c1F ZINC000604149103 568217121 /nfs/dbraw/zinc/21/71/21/568217121.db2.gz YTTVXFGAAKXBNA-UHFFFAOYSA-N -1 3 350.802 3.506 20 0 FHADHM O=C(c1cc(=O)c2ccccc2[n-]1)N(Cc1ccc(F)cc1)CC1CC1 ZINC000604363657 568271104 /nfs/dbraw/zinc/27/11/04/568271104.db2.gz FAQOFDVFAYBLDD-UHFFFAOYSA-N -1 3 350.393 3.720 20 0 FHADHM CCOC(=O)c1[n-]c(C)nc1NC(=O)c1ccc(OC(C)C)cc1Cl ZINC000563148590 568284289 /nfs/dbraw/zinc/28/42/89/568284289.db2.gz QNWAIFPIKHVGOK-UHFFFAOYSA-N -1 3 365.817 3.588 20 0 FHADHM CCOC(=O)c1nc(C)[n-]c1NC(=O)c1ccc(OC(C)C)cc1Cl ZINC000563148590 568284290 /nfs/dbraw/zinc/28/42/90/568284290.db2.gz QNWAIFPIKHVGOK-UHFFFAOYSA-N -1 3 365.817 3.588 20 0 FHADHM O=C(N[C@@H](c1ccc(F)cc1)c1cccnc1)c1c[n-]c2ccccc2c1=O ZINC000365214852 568325555 /nfs/dbraw/zinc/32/55/55/568325555.db2.gz VKIDQPAWMYUSCK-FQEVSTJZSA-N -1 3 373.387 3.582 20 0 FHADHM Cc1ccc([O-])c(CNc2cc(I)ccc2C)n1 ZINC000301886295 568368261 /nfs/dbraw/zinc/36/82/61/568368261.db2.gz DPHKIGZFVIJGHV-UHFFFAOYSA-N -1 3 354.191 3.621 20 0 FHADHM Cc1ccc(-c2cc(C(=O)Nc3ccnc(OCC(F)(F)F)c3)n[n-]2)o1 ZINC000647747108 568379819 /nfs/dbraw/zinc/37/98/19/568379819.db2.gz XTOJHDMMFYEBFW-UHFFFAOYSA-N -1 3 366.299 3.567 20 0 FHADHM Cc1ccc(-c2cc(C(=O)Nc3ccnc(OCC(F)(F)F)c3)[n-]n2)o1 ZINC000647747108 568379820 /nfs/dbraw/zinc/37/98/20/568379820.db2.gz XTOJHDMMFYEBFW-UHFFFAOYSA-N -1 3 366.299 3.567 20 0 FHADHM O=C([O-])[C@@H](NCc1ccc(Br)c2cccnc12)c1ccccc1 ZINC000321830863 568380857 /nfs/dbraw/zinc/38/08/57/568380857.db2.gz FRMMMAUMGSWDDD-KRWDZBQOSA-N -1 3 371.234 3.913 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)c3c[n-]nc3-c3ccncc3)cc2)oc1C ZINC000604901117 568384667 /nfs/dbraw/zinc/38/46/67/568384667.db2.gz DDEZUMOHASSKCY-UHFFFAOYSA-N -1 3 359.389 3.996 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)c3cn[n-]c3-c3ccncc3)cc2)oc1C ZINC000604901117 568384668 /nfs/dbraw/zinc/38/46/68/568384668.db2.gz DDEZUMOHASSKCY-UHFFFAOYSA-N -1 3 359.389 3.996 20 0 FHADHM COc1ccc(C(=O)CSc2n[n-]c(-c3ccccn3)n2)cc1Cl ZINC000604932976 568395326 /nfs/dbraw/zinc/39/53/26/568395326.db2.gz INIYSVYYPASIMQ-UHFFFAOYSA-N -1 3 360.826 3.504 20 0 FHADHM CC1CCC(N(C(=O)CSc2n[n-]c(-c3ccccn3)n2)C2CC2)CC1 ZINC000604933254 568395445 /nfs/dbraw/zinc/39/54/45/568395445.db2.gz QVMSNMRMJQJVTD-UHFFFAOYSA-N -1 3 371.510 3.529 20 0 FHADHM Cc1ccc([N-]S(C)(=O)=O)c(NC(=O)C2CCC(C3CC3)CC2)c1 ZINC000669204684 568652489 /nfs/dbraw/zinc/65/24/89/568652489.db2.gz KQDRYUFXEPMCHM-UHFFFAOYSA-N -1 3 350.484 3.521 20 0 FHADHM Cc1csc(-c2cccc(C(=O)Nc3sccc3-c3nnn[n-]3)c2)n1 ZINC000737448193 598830048 /nfs/dbraw/zinc/83/00/48/598830048.db2.gz NILWVVSCSXWFEL-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM Cc1csc(-c2cccc(C(=O)Nc3sccc3-c3nn[n-]n3)c2)n1 ZINC000737448193 598830050 /nfs/dbraw/zinc/83/00/50/598830050.db2.gz NILWVVSCSXWFEL-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM CCCCSCCC(=O)Nc1sc(C)c(CC)c1-c1nnn[n-]1 ZINC000736463370 598831461 /nfs/dbraw/zinc/83/14/61/598831461.db2.gz OFCOQHBLPZLHID-UHFFFAOYSA-N -1 3 353.517 3.661 20 0 FHADHM CCCCSCCC(=O)Nc1sc(C)c(CC)c1-c1nn[n-]n1 ZINC000736463370 598831463 /nfs/dbraw/zinc/83/14/63/598831463.db2.gz OFCOQHBLPZLHID-UHFFFAOYSA-N -1 3 353.517 3.661 20 0 FHADHM CC/C=C(\C)C(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000736408567 598833824 /nfs/dbraw/zinc/83/38/24/598833824.db2.gz FBOURRDIBVYMPW-LFYBBSHMSA-N -1 3 353.451 3.568 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H]1CC[C@H](C)C[C@H]1C ZINC000736478744 598840224 /nfs/dbraw/zinc/84/02/24/598840224.db2.gz BHNWHEFQBNELOU-HDMKZQKVSA-N -1 3 370.501 3.613 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H]1CC[C@H](C)C[C@H]1C ZINC000736478744 598840225 /nfs/dbraw/zinc/84/02/25/598840225.db2.gz BHNWHEFQBNELOU-HDMKZQKVSA-N -1 3 370.501 3.613 20 0 FHADHM Cc1ccc2oc(SCc3cn4ccccc4c3-c3nnn[n-]3)nc2c1 ZINC000737380043 598861567 /nfs/dbraw/zinc/86/15/67/598861567.db2.gz LGJJARNHDJSLQJ-UHFFFAOYSA-N -1 3 362.418 3.861 20 0 FHADHM Cc1ccc2oc(SCc3cn4ccccc4c3-c3nn[n-]n3)nc2c1 ZINC000737380043 598861568 /nfs/dbraw/zinc/86/15/68/598861568.db2.gz LGJJARNHDJSLQJ-UHFFFAOYSA-N -1 3 362.418 3.861 20 0 FHADHM CCSc1cccc(NC(=O)N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736666535 598879719 /nfs/dbraw/zinc/87/97/19/598879719.db2.gz KTKLYOUKUZARMB-LBPRGKRZSA-N -1 3 368.466 3.861 20 0 FHADHM CCSc1cccc(NC(=O)N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736666535 598879720 /nfs/dbraw/zinc/87/97/20/598879720.db2.gz KTKLYOUKUZARMB-LBPRGKRZSA-N -1 3 368.466 3.861 20 0 FHADHM CCSc1cccc(NC(=O)N(C)Cc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736668071 598879857 /nfs/dbraw/zinc/87/98/57/598879857.db2.gz VDGUNKIZDVKBAG-UHFFFAOYSA-N -1 3 368.466 3.643 20 0 FHADHM CCSc1cccc(NC(=O)N(C)Cc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736668071 598879858 /nfs/dbraw/zinc/87/98/58/598879858.db2.gz VDGUNKIZDVKBAG-UHFFFAOYSA-N -1 3 368.466 3.643 20 0 FHADHM c1ccc(-c2ccc(-c3nnn[n-]3)c(SC[C@H]3CCCCO3)n2)cc1 ZINC000738421779 598902847 /nfs/dbraw/zinc/90/28/47/598902847.db2.gz VQHMATAONDLWDI-CQSZACIVSA-N -1 3 353.451 3.590 20 0 FHADHM c1ccc(-c2ccc(-c3nn[n-]n3)c(SC[C@H]3CCCCO3)n2)cc1 ZINC000738421779 598902849 /nfs/dbraw/zinc/90/28/49/598902849.db2.gz VQHMATAONDLWDI-CQSZACIVSA-N -1 3 353.451 3.590 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@H]2C(=O)N(C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000735924811 598910937 /nfs/dbraw/zinc/91/09/37/598910937.db2.gz VGFNTNRJPGPELQ-RTBURBONSA-N -1 3 361.449 3.757 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@H]2C(=O)N(C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000735924811 598910939 /nfs/dbraw/zinc/91/09/39/598910939.db2.gz VGFNTNRJPGPELQ-RTBURBONSA-N -1 3 361.449 3.757 20 0 FHADHM CC(C)C[C@H](C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000735755586 598939590 /nfs/dbraw/zinc/93/95/90/598939590.db2.gz HEJDABDCHDJNJY-KXBFYZLASA-N -1 3 363.465 3.874 20 0 FHADHM CC(C)C[C@H](C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000735755586 598939591 /nfs/dbraw/zinc/93/95/91/598939591.db2.gz HEJDABDCHDJNJY-KXBFYZLASA-N -1 3 363.465 3.874 20 0 FHADHM CC[C@@H]1CCC[C@@H](NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)C1 ZINC000736401134 598939661 /nfs/dbraw/zinc/93/96/61/598939661.db2.gz VWWCODCSNWFYQC-GHMZBOCLSA-N -1 3 364.906 3.775 20 0 FHADHM CC[C@@H]1CCC[C@@H](NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)C1 ZINC000736401134 598939662 /nfs/dbraw/zinc/93/96/62/598939662.db2.gz VWWCODCSNWFYQC-GHMZBOCLSA-N -1 3 364.906 3.775 20 0 FHADHM Fc1cc(NC[C@@H]2CCCOC2)ccc1Oc1ccccc1-c1nnn[n-]1 ZINC000822753296 607256182 /nfs/dbraw/zinc/25/61/82/607256182.db2.gz LYDRSLPEZGSFOP-ZDUSSCGKSA-N -1 3 369.400 3.637 20 0 FHADHM Fc1cc(NC[C@@H]2CCCOC2)ccc1Oc1ccccc1-c1nn[n-]n1 ZINC000822753296 607256183 /nfs/dbraw/zinc/25/61/83/607256183.db2.gz LYDRSLPEZGSFOP-ZDUSSCGKSA-N -1 3 369.400 3.637 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1OCCSC/C=C\c1ccccc1 ZINC000737032829 599009545 /nfs/dbraw/zinc/00/95/45/599009545.db2.gz PFXVHFJYLRDFQL-YVMONPNESA-N -1 3 368.462 3.701 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1OCCSC/C=C\c1ccccc1 ZINC000737032829 599009547 /nfs/dbraw/zinc/00/95/47/599009547.db2.gz PFXVHFJYLRDFQL-YVMONPNESA-N -1 3 368.462 3.701 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)nc1)C(C)(C)C ZINC000735561084 599015004 /nfs/dbraw/zinc/01/50/04/599015004.db2.gz VDRIPGRHUHXVIY-LBPRGKRZSA-N -1 3 366.425 3.675 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)nc1)C(C)(C)C ZINC000735561084 599015006 /nfs/dbraw/zinc/01/50/06/599015006.db2.gz VDRIPGRHUHXVIY-LBPRGKRZSA-N -1 3 366.425 3.675 20 0 FHADHM CC[C@@H](NC(=S)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1cccs1 ZINC000736370141 599013986 /nfs/dbraw/zinc/01/39/86/599013986.db2.gz MJBBVNFFJKYZPS-GFCCVEGCSA-N -1 3 362.459 3.505 20 0 FHADHM CC[C@@H](NC(=S)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1cccs1 ZINC000736370141 599013988 /nfs/dbraw/zinc/01/39/88/599013988.db2.gz MJBBVNFFJKYZPS-GFCCVEGCSA-N -1 3 362.459 3.505 20 0 FHADHM CC[C@@H]1CCC[C@H](NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)C1 ZINC000736395038 599023691 /nfs/dbraw/zinc/02/36/91/599023691.db2.gz GKSXXSFGNKIRFL-QAPCUYQASA-N -1 3 370.501 3.756 20 0 FHADHM CC[C@@H]1CCC[C@H](NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)C1 ZINC000736395038 599023692 /nfs/dbraw/zinc/02/36/92/599023692.db2.gz GKSXXSFGNKIRFL-QAPCUYQASA-N -1 3 370.501 3.756 20 0 FHADHM Cc1c(NCc2csc(-c3ccsc3)n2)cccc1-c1nnn[n-]1 ZINC000822122877 607257136 /nfs/dbraw/zinc/25/71/36/607257136.db2.gz RLWPATRGLLRPJM-UHFFFAOYSA-N -1 3 354.464 3.972 20 0 FHADHM Cc1c(NCc2csc(-c3ccsc3)n2)cccc1-c1nn[n-]n1 ZINC000822122877 607257137 /nfs/dbraw/zinc/25/71/37/607257137.db2.gz RLWPATRGLLRPJM-UHFFFAOYSA-N -1 3 354.464 3.972 20 0 FHADHM O=C(OCc1ccoc1)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000738234676 599027288 /nfs/dbraw/zinc/02/72/88/599027288.db2.gz KWSSPXGEZQDCFK-UHFFFAOYSA-N -1 3 361.361 3.560 20 0 FHADHM CCc1nc(C)c([C@@H](C)OC(=O)C=Cc2ccccc2-c2nnn[n-]2)s1 ZINC000736699530 599029370 /nfs/dbraw/zinc/02/93/70/599029370.db2.gz KYRXCMWIFFPMCJ-ZWLSGLHFSA-N -1 3 369.450 3.512 20 0 FHADHM CCc1nc(C)c([C@@H](C)OC(=O)C=Cc2ccccc2-c2nn[n-]n2)s1 ZINC000736699530 599029371 /nfs/dbraw/zinc/02/93/71/599029371.db2.gz KYRXCMWIFFPMCJ-ZWLSGLHFSA-N -1 3 369.450 3.512 20 0 FHADHM Cc1ccc([C@H]2CCCN2c2nc(C(F)(F)F)ccc2-c2nnn[n-]2)cc1 ZINC000737333637 599041867 /nfs/dbraw/zinc/04/18/67/599041867.db2.gz UWDRHUUOWRGRKJ-CQSZACIVSA-N -1 3 374.370 3.930 20 0 FHADHM Cc1ccc([C@H]2CCCN2c2nc(C(F)(F)F)ccc2-c2nn[n-]n2)cc1 ZINC000737333637 599041870 /nfs/dbraw/zinc/04/18/70/599041870.db2.gz UWDRHUUOWRGRKJ-CQSZACIVSA-N -1 3 374.370 3.930 20 0 FHADHM Cc1ccccc1[C@@H](C)N(C)c1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000737424776 599046580 /nfs/dbraw/zinc/04/65/80/599046580.db2.gz XJAMCRTZQDWRRO-LLVKDONJSA-N -1 3 362.359 3.786 20 0 FHADHM Cc1ccccc1[C@@H](C)N(C)c1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000737424776 599046583 /nfs/dbraw/zinc/04/65/83/599046583.db2.gz XJAMCRTZQDWRRO-LLVKDONJSA-N -1 3 362.359 3.786 20 0 FHADHM C[C@H](CCNc1nc(C(F)(F)F)ccc1-c1nnn[n-]1)c1ccccc1 ZINC000735987681 599050517 /nfs/dbraw/zinc/05/05/17/599050517.db2.gz XHZSYMFFZMRUEP-LLVKDONJSA-N -1 3 362.359 3.886 20 0 FHADHM C[C@H](CCNc1nc(C(F)(F)F)ccc1-c1nn[n-]n1)c1ccccc1 ZINC000735987681 599050520 /nfs/dbraw/zinc/05/05/20/599050520.db2.gz XHZSYMFFZMRUEP-LLVKDONJSA-N -1 3 362.359 3.886 20 0 FHADHM COc1cccc(-c2ccc(CNc3ccc(-c4nnn[n-]4)cn3)cc2)c1 ZINC000821853823 599054681 /nfs/dbraw/zinc/05/46/81/599054681.db2.gz BBTGDIKAHHXIRK-UHFFFAOYSA-N -1 3 358.405 3.549 20 0 FHADHM COc1cccc(-c2ccc(CNc3ccc(-c4nn[n-]n4)cn3)cc2)c1 ZINC000821853823 599054683 /nfs/dbraw/zinc/05/46/83/599054683.db2.gz BBTGDIKAHHXIRK-UHFFFAOYSA-N -1 3 358.405 3.549 20 0 FHADHM C[C@@H]1C[C@@H](c2cccc(F)c2)N(c2ncc(-c3nnn[n-]3)cc2Cl)C1 ZINC000820667620 599059743 /nfs/dbraw/zinc/05/97/43/599059743.db2.gz NCPCMANPEFDECM-BMIGLBTASA-N -1 3 358.808 3.642 20 0 FHADHM C[C@@H]1C[C@@H](c2cccc(F)c2)N(c2ncc(-c3nn[n-]n3)cc2Cl)C1 ZINC000820667620 599059745 /nfs/dbraw/zinc/05/97/45/599059745.db2.gz NCPCMANPEFDECM-BMIGLBTASA-N -1 3 358.808 3.642 20 0 FHADHM Clc1ccc(N2CC[C@H](COCc3ccccc3)C2)c(-c2nnn[n-]2)c1 ZINC000822574379 599063545 /nfs/dbraw/zinc/06/35/45/599063545.db2.gz TXODNUCAEMVRJF-HNNXBMFYSA-N -1 3 369.856 3.563 20 0 FHADHM Clc1ccc(N2CC[C@H](COCc3ccccc3)C2)c(-c2nn[n-]n2)c1 ZINC000822574379 599063547 /nfs/dbraw/zinc/06/35/47/599063547.db2.gz TXODNUCAEMVRJF-HNNXBMFYSA-N -1 3 369.856 3.563 20 0 FHADHM Cc1cccc(-c2noc(CSc3ccc(-c4nnn[n-]4)cc3F)n2)c1 ZINC000737380581 599064529 /nfs/dbraw/zinc/06/45/29/599064529.db2.gz PACJSMWCPFNDJD-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM Cc1cccc(-c2noc(CSc3ccc(-c4nn[n-]n4)cc3F)n2)c1 ZINC000737380581 599064531 /nfs/dbraw/zinc/06/45/31/599064531.db2.gz PACJSMWCPFNDJD-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM Clc1ccc2[nH]cc(CCNc3ncc(-c4nnn[n-]4)cc3Cl)c2c1 ZINC000822581727 599065714 /nfs/dbraw/zinc/06/57/14/599065714.db2.gz MHBRVPLEXGCINJ-UHFFFAOYSA-N -1 3 374.235 3.704 20 0 FHADHM Clc1ccc2[nH]cc(CCNc3ncc(-c4nn[n-]n4)cc3Cl)c2c1 ZINC000822581727 599065716 /nfs/dbraw/zinc/06/57/16/599065716.db2.gz MHBRVPLEXGCINJ-UHFFFAOYSA-N -1 3 374.235 3.704 20 0 FHADHM Cc1cccc(F)c1CNc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000822308589 599068587 /nfs/dbraw/zinc/06/85/87/599068587.db2.gz HTWWLOLYVAQBSR-UHFFFAOYSA-N -1 3 351.307 3.945 20 0 FHADHM Cc1cccc(F)c1CNc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000822308589 599068590 /nfs/dbraw/zinc/06/85/90/599068590.db2.gz HTWWLOLYVAQBSR-UHFFFAOYSA-N -1 3 351.307 3.945 20 0 FHADHM C[C@H](C(=O)Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1)c1ccco1 ZINC000735571595 599069538 /nfs/dbraw/zinc/06/95/38/599069538.db2.gz ZJNRHBXKYHXZMA-NSHDSACASA-N -1 3 365.418 3.930 20 0 FHADHM C[C@H](C(=O)Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1)c1ccco1 ZINC000735571595 599069540 /nfs/dbraw/zinc/06/95/40/599069540.db2.gz ZJNRHBXKYHXZMA-NSHDSACASA-N -1 3 365.418 3.930 20 0 FHADHM Cc1ccc([C@H]2CCCCN2C(=O)C=Cc2ccccc2-c2nnn[n-]2)cc1 ZINC000737329811 599082755 /nfs/dbraw/zinc/08/27/55/599082755.db2.gz LDVAPCHWMUOLIO-CLEWGBKMSA-N -1 3 373.460 3.942 20 0 FHADHM Cc1ccc([C@H]2CCCCN2C(=O)C=Cc2ccccc2-c2nn[n-]n2)cc1 ZINC000737329811 599082758 /nfs/dbraw/zinc/08/27/58/599082758.db2.gz LDVAPCHWMUOLIO-CLEWGBKMSA-N -1 3 373.460 3.942 20 0 FHADHM FC(F)(F)c1cc(-c2nn[n-]n2)ccc1N1CCC(C(F)(F)F)CC1 ZINC000822718678 599088385 /nfs/dbraw/zinc/08/83/85/599088385.db2.gz OLBWITCGWXASMC-UHFFFAOYSA-N -1 3 365.281 3.664 20 0 FHADHM CO[C@@H](CNc1ccc(Cl)cc1-c1nnn[n-]1)c1cccc(Cl)c1 ZINC000821677147 599090279 /nfs/dbraw/zinc/09/02/79/599090279.db2.gz PRGXUFFSCFYVLA-HNNXBMFYSA-N -1 3 364.236 3.973 20 0 FHADHM CO[C@@H](CNc1ccc(Cl)cc1-c1nn[n-]n1)c1cccc(Cl)c1 ZINC000821677147 599090282 /nfs/dbraw/zinc/09/02/82/599090282.db2.gz PRGXUFFSCFYVLA-HNNXBMFYSA-N -1 3 364.236 3.973 20 0 FHADHM CO[C@H](CNc1cc(Cl)ccc1-c1nnn[n-]1)c1cccc(Cl)c1 ZINC000821677470 599090869 /nfs/dbraw/zinc/09/08/69/599090869.db2.gz XRAUCQWFDPGEHU-OAHLLOKOSA-N -1 3 364.236 3.973 20 0 FHADHM CO[C@H](CNc1cc(Cl)ccc1-c1nn[n-]n1)c1cccc(Cl)c1 ZINC000821677470 599090872 /nfs/dbraw/zinc/09/08/72/599090872.db2.gz XRAUCQWFDPGEHU-OAHLLOKOSA-N -1 3 364.236 3.973 20 0 FHADHM C[C@H](CCC1CCCCC1)NC(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000735986970 599103411 /nfs/dbraw/zinc/10/34/11/599103411.db2.gz UZAJUALQMALWTD-HUUCEWRRSA-N -1 3 370.501 3.976 20 0 FHADHM C[C@H](CCC1CCCCC1)NC(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000735986970 599103412 /nfs/dbraw/zinc/10/34/12/599103412.db2.gz UZAJUALQMALWTD-HUUCEWRRSA-N -1 3 370.501 3.976 20 0 FHADHM Cc1cccc([C@H]2CCCN2C(=O)c2sccc2-c2nnn[n-]2)c1C ZINC000737389072 599103695 /nfs/dbraw/zinc/10/36/95/599103695.db2.gz IFLNCTHDBDQMPY-OAHLLOKOSA-N -1 3 353.451 3.522 20 0 FHADHM Cc1cccc([C@H]2CCCN2C(=O)c2sccc2-c2nn[n-]n2)c1C ZINC000737389072 599103697 /nfs/dbraw/zinc/10/36/97/599103697.db2.gz IFLNCTHDBDQMPY-OAHLLOKOSA-N -1 3 353.451 3.522 20 0 FHADHM CCCCC[C@@H](NC(=O)NCc1cccc(-c2nnn[n-]2)c1)C(C)(C)C ZINC000736441837 599104069 /nfs/dbraw/zinc/10/40/69/599104069.db2.gz VFXQWXYUXLCWCH-MRXNPFEDSA-N -1 3 358.490 3.661 20 0 FHADHM CCCCC[C@@H](NC(=O)NCc1cccc(-c2nn[n-]n2)c1)C(C)(C)C ZINC000736441837 599104071 /nfs/dbraw/zinc/10/40/71/599104071.db2.gz VFXQWXYUXLCWCH-MRXNPFEDSA-N -1 3 358.490 3.661 20 0 FHADHM FC(F)(F)c1csc(CCNc2cc(Cl)ccc2-c2nnn[n-]2)n1 ZINC000822728698 599105509 /nfs/dbraw/zinc/10/55/09/599105509.db2.gz JUNRXXLHWMTJMB-UHFFFAOYSA-N -1 3 374.779 3.650 20 0 FHADHM FC(F)(F)c1csc(CCNc2cc(Cl)ccc2-c2nn[n-]n2)n1 ZINC000822728698 599105510 /nfs/dbraw/zinc/10/55/10/599105510.db2.gz JUNRXXLHWMTJMB-UHFFFAOYSA-N -1 3 374.779 3.650 20 0 FHADHM CC(C)CC[C@@H](NC(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1)C(C)(C)C ZINC000735796705 599105707 /nfs/dbraw/zinc/10/57/07/599105707.db2.gz HBEZYZUONWRDPM-QGZVFWFLSA-N -1 3 372.517 3.859 20 0 FHADHM CC(C)CC[C@@H](NC(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1)C(C)(C)C ZINC000735796705 599105709 /nfs/dbraw/zinc/10/57/09/599105709.db2.gz HBEZYZUONWRDPM-QGZVFWFLSA-N -1 3 372.517 3.859 20 0 FHADHM C[C@H](Sc1ccccc1-c1nnn[n-]1)C(=O)Nc1ccc(Cl)cc1 ZINC000736193322 599108125 /nfs/dbraw/zinc/10/81/25/599108125.db2.gz OTFJKHRBCJBSLU-JTQLQIEISA-N -1 3 359.842 3.639 20 0 FHADHM C[C@H](Sc1ccccc1-c1nn[n-]n1)C(=O)Nc1ccc(Cl)cc1 ZINC000736193322 599108128 /nfs/dbraw/zinc/10/81/28/599108128.db2.gz OTFJKHRBCJBSLU-JTQLQIEISA-N -1 3 359.842 3.639 20 0 FHADHM O[C@@H](C[C@@H]1CCCN1c1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccccc1 ZINC000823675361 599109594 /nfs/dbraw/zinc/10/95/94/599109594.db2.gz WHALAMGNANYVHP-KSSFIOAISA-N -1 3 369.856 3.613 20 0 FHADHM O[C@@H](C[C@@H]1CCCN1c1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccccc1 ZINC000823675361 599109595 /nfs/dbraw/zinc/10/95/95/599109595.db2.gz WHALAMGNANYVHP-KSSFIOAISA-N -1 3 369.856 3.613 20 0 FHADHM Cn1c(CSc2ccccc2-c2nnn[n-]2)nc2cc(Cl)ccc21 ZINC000737592279 599109661 /nfs/dbraw/zinc/10/96/61/599109661.db2.gz MYGLILJWNWTXCR-UHFFFAOYSA-N -1 3 356.842 3.699 20 0 FHADHM Cn1c(CSc2ccccc2-c2nn[n-]n2)nc2cc(Cl)ccc21 ZINC000737592279 599109664 /nfs/dbraw/zinc/10/96/64/599109664.db2.gz MYGLILJWNWTXCR-UHFFFAOYSA-N -1 3 356.842 3.699 20 0 FHADHM Clc1cccc(-c2noc(CSc3ccccc3-c3nnn[n-]3)n2)c1 ZINC000737576571 599110217 /nfs/dbraw/zinc/11/02/17/599110217.db2.gz ZDOYVDHUFDBWNJ-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1cccc(-c2noc(CSc3ccccc3-c3nn[n-]n3)n2)c1 ZINC000737576571 599110220 /nfs/dbraw/zinc/11/02/20/599110220.db2.gz ZDOYVDHUFDBWNJ-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM COC(=O)[C@@H](SCc1cccc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736903010 599113230 /nfs/dbraw/zinc/11/32/30/599113230.db2.gz XQYRRLNVXGRUCO-HNNXBMFYSA-N -1 3 374.853 3.668 20 0 FHADHM COC(=O)[C@@H](SCc1cccc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736903010 599113233 /nfs/dbraw/zinc/11/32/33/599113233.db2.gz XQYRRLNVXGRUCO-HNNXBMFYSA-N -1 3 374.853 3.668 20 0 FHADHM COc1ccccc1[C@H](C)SCCOc1ccc(-c2nn[n-]n2)cc1 ZINC000821883386 599128359 /nfs/dbraw/zinc/12/83/59/599128359.db2.gz UZUJCPQFMVGFES-ZDUSSCGKSA-N -1 3 356.451 3.749 20 0 FHADHM COc1ccccc1[C@H](C)SCCOc1ccccc1-c1nnn[n-]1 ZINC000821883194 599128390 /nfs/dbraw/zinc/12/83/90/599128390.db2.gz RZPXSHXFTRLFOJ-ZDUSSCGKSA-N -1 3 356.451 3.749 20 0 FHADHM COc1ccccc1[C@H](C)SCCOc1ccccc1-c1nn[n-]n1 ZINC000821883194 599128394 /nfs/dbraw/zinc/12/83/94/599128394.db2.gz RZPXSHXFTRLFOJ-ZDUSSCGKSA-N -1 3 356.451 3.749 20 0 FHADHM CC(C)[C@H](C)S[C@@H](C)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820550765 599130654 /nfs/dbraw/zinc/13/06/54/599130654.db2.gz YRROZZQCTSRPQR-UWVGGRQHSA-N -1 3 353.879 3.625 20 0 FHADHM CC(C)[C@H](C)S[C@@H](C)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820550765 599130655 /nfs/dbraw/zinc/13/06/55/599130655.db2.gz YRROZZQCTSRPQR-UWVGGRQHSA-N -1 3 353.879 3.625 20 0 FHADHM CCc1nc(C)c([C@@H](C)N(C)Cc2ccc(-c3nnn[n-]3)cc2F)s1 ZINC000736697922 599135656 /nfs/dbraw/zinc/13/56/56/599135656.db2.gz DHUCTZSZSFEFRT-LLVKDONJSA-N -1 3 360.462 3.526 20 0 FHADHM CCc1nc(C)c([C@@H](C)N(C)Cc2ccc(-c3nn[n-]n3)cc2F)s1 ZINC000736697922 599135658 /nfs/dbraw/zinc/13/56/58/599135658.db2.gz DHUCTZSZSFEFRT-LLVKDONJSA-N -1 3 360.462 3.526 20 0 FHADHM Cc1cc(Oc2ccc(-c3nnn[n-]3)cc2)ccc1NC(=O)/C=C/C1CC1 ZINC000822211904 599144756 /nfs/dbraw/zinc/14/47/56/599144756.db2.gz SPGCHPUAVYSDNJ-NYYWCZLTSA-N -1 3 361.405 3.872 20 0 FHADHM Cc1cc(Oc2ccc(-c3nn[n-]n3)cc2)ccc1NC(=O)/C=C/C1CC1 ZINC000822211904 599144757 /nfs/dbraw/zinc/14/47/57/599144757.db2.gz SPGCHPUAVYSDNJ-NYYWCZLTSA-N -1 3 361.405 3.872 20 0 FHADHM C[C@H](SCc1nnc(-c2cccc(-c3nnn[n-]3)c2)o1)c1cccs1 ZINC000736192840 599166489 /nfs/dbraw/zinc/16/64/89/599166489.db2.gz MQGNIRFKAREBEK-JTQLQIEISA-N -1 3 370.463 3.973 20 0 FHADHM C[C@H](SCc1nnc(-c2cccc(-c3nn[n-]n3)c2)o1)c1cccs1 ZINC000736192840 599166492 /nfs/dbraw/zinc/16/64/92/599166492.db2.gz MQGNIRFKAREBEK-JTQLQIEISA-N -1 3 370.463 3.973 20 0 FHADHM Cc1ccccc1-c1cnc(COc2ccc(-c3nnn[n-]3)c(F)c2)o1 ZINC000737419487 599167870 /nfs/dbraw/zinc/16/78/70/599167870.db2.gz XXYXWEUVSGQKDR-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM Cc1ccccc1-c1cnc(COc2ccc(-c3nn[n-]n3)c(F)c2)o1 ZINC000737419487 599167871 /nfs/dbraw/zinc/16/78/71/599167871.db2.gz XXYXWEUVSGQKDR-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM CC[C@@H](Cc1ccccc1)N(C)C(=S)Nc1ccccc1-c1nnn[n-]1 ZINC000736351690 599173253 /nfs/dbraw/zinc/17/32/53/599173253.db2.gz RBROTPIMAMISDD-HNNXBMFYSA-N -1 3 366.494 3.517 20 0 FHADHM CC[C@@H](Cc1ccccc1)N(C)C(=S)Nc1ccccc1-c1nn[n-]n1 ZINC000736351690 599173254 /nfs/dbraw/zinc/17/32/54/599173254.db2.gz RBROTPIMAMISDD-HNNXBMFYSA-N -1 3 366.494 3.517 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)[C@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1 ZINC000525157454 599177360 /nfs/dbraw/zinc/17/73/60/599177360.db2.gz RXWZJCQJQHHPBV-CABCVRRESA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)[C@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1 ZINC000525157454 599177364 /nfs/dbraw/zinc/17/73/64/599177364.db2.gz RXWZJCQJQHHPBV-CABCVRRESA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1cc2cccc(F)c2o1 ZINC000738151950 599181395 /nfs/dbraw/zinc/18/13/95/599181395.db2.gz LTXINNFHUGFDBK-UHFFFAOYSA-N -1 3 357.732 3.658 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1cc2cccc(F)c2o1 ZINC000738151950 599181397 /nfs/dbraw/zinc/18/13/97/599181397.db2.gz LTXINNFHUGFDBK-UHFFFAOYSA-N -1 3 357.732 3.658 20 0 FHADHM Cc1ccc([C@H]2CCCN2C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)o1 ZINC000737328756 599189173 /nfs/dbraw/zinc/18/91/73/599189173.db2.gz CTWBXBCYQQDKJD-CQSZACIVSA-N -1 3 372.816 3.791 20 0 FHADHM Cc1ccc([C@H]2CCCN2C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)o1 ZINC000737328756 599189175 /nfs/dbraw/zinc/18/91/75/599189175.db2.gz CTWBXBCYQQDKJD-CQSZACIVSA-N -1 3 372.816 3.791 20 0 FHADHM Cc1ccccc1[C@H](C)CC(=O)OCc1ccc(F)cc1-c1nnn[n-]1 ZINC000737423339 599186641 /nfs/dbraw/zinc/18/66/41/599186641.db2.gz QPVLQVLQMMYECF-CYBMUJFWSA-N -1 3 354.385 3.551 20 0 FHADHM Cc1ccccc1[C@H](C)CC(=O)OCc1ccc(F)cc1-c1nn[n-]n1 ZINC000737423339 599186644 /nfs/dbraw/zinc/18/66/44/599186644.db2.gz QPVLQVLQMMYECF-CYBMUJFWSA-N -1 3 354.385 3.551 20 0 FHADHM CC(C)n1ccc(COc2ccc(-c3ccc(-c4nnn[n-]4)cc3)cc2)n1 ZINC000735964681 599192114 /nfs/dbraw/zinc/19/21/14/599192114.db2.gz FFTOVIPSUVHNEG-UHFFFAOYSA-N -1 3 360.421 3.890 20 0 FHADHM CC(C)n1ccc(COc2ccc(-c3ccc(-c4nn[n-]n4)cc3)cc2)n1 ZINC000735964681 599192118 /nfs/dbraw/zinc/19/21/18/599192118.db2.gz FFTOVIPSUVHNEG-UHFFFAOYSA-N -1 3 360.421 3.890 20 0 FHADHM O=C(CCc1ccc(-c2nnn[n-]2)cc1)N1CCCC2(C1)CCCCCC2 ZINC000822978984 599202869 /nfs/dbraw/zinc/20/28/69/599202869.db2.gz UXTOMYVOAFYGHE-UHFFFAOYSA-N -1 3 367.497 3.762 20 0 FHADHM O=C(CCc1ccc(-c2nn[n-]n2)cc1)N1CCCC2(C1)CCCCCC2 ZINC000822978984 599202871 /nfs/dbraw/zinc/20/28/71/599202871.db2.gz UXTOMYVOAFYGHE-UHFFFAOYSA-N -1 3 367.497 3.762 20 0 FHADHM O=C(/C=C\C1CC1)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1 ZINC000822924227 599219310 /nfs/dbraw/zinc/21/93/10/599219310.db2.gz ZFUWJEUBBMWAGU-YFHOEESVSA-N -1 3 365.368 3.703 20 0 FHADHM O=C(/C=C\C1CC1)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1 ZINC000822924227 599219313 /nfs/dbraw/zinc/21/93/13/599219313.db2.gz ZFUWJEUBBMWAGU-YFHOEESVSA-N -1 3 365.368 3.703 20 0 FHADHM CCc1ccc([C@H]2C[C@H](C)CCN2C(=O)c2sccc2-c2nnn[n-]2)o1 ZINC000821480822 599221183 /nfs/dbraw/zinc/22/11/83/599221183.db2.gz FIWQVMBYGDGAMO-BXUZGUMPSA-N -1 3 371.466 3.697 20 0 FHADHM CCc1ccc([C@H]2C[C@H](C)CCN2C(=O)c2sccc2-c2nn[n-]n2)o1 ZINC000821480822 599221186 /nfs/dbraw/zinc/22/11/86/599221186.db2.gz FIWQVMBYGDGAMO-BXUZGUMPSA-N -1 3 371.466 3.697 20 0 FHADHM CCC[C@]1(C)CCCN(C(=O)CSCc2ccc(-c3nnn[n-]3)cc2)C1 ZINC000821028759 599221200 /nfs/dbraw/zinc/22/12/00/599221200.db2.gz ZDVSYLIVYBVJET-LJQANCHMSA-N -1 3 373.526 3.529 20 0 FHADHM CCC[C@]1(C)CCCN(C(=O)CSCc2ccc(-c3nn[n-]n3)cc2)C1 ZINC000821028759 599221202 /nfs/dbraw/zinc/22/12/02/599221202.db2.gz ZDVSYLIVYBVJET-LJQANCHMSA-N -1 3 373.526 3.529 20 0 FHADHM CC(C)[C@@H]1CCCCN1C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000735751642 599221978 /nfs/dbraw/zinc/22/19/78/599221978.db2.gz WHYYJHMTHPDFKR-AWEZNQCLSA-N -1 3 364.906 3.727 20 0 FHADHM CC(C)[C@@H]1CCCCN1C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000735751642 599221980 /nfs/dbraw/zinc/22/19/80/599221980.db2.gz WHYYJHMTHPDFKR-AWEZNQCLSA-N -1 3 364.906 3.727 20 0 FHADHM Cc1cccc([C@@H](C)SCC(=O)Nc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000822289458 599226461 /nfs/dbraw/zinc/22/64/61/599226461.db2.gz XXJMKXMYEGNLTB-CYBMUJFWSA-N -1 3 353.451 3.608 20 0 FHADHM Cc1cccc([C@@H](C)SCC(=O)Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000822289458 599226462 /nfs/dbraw/zinc/22/64/62/599226462.db2.gz XXJMKXMYEGNLTB-CYBMUJFWSA-N -1 3 353.451 3.608 20 0 FHADHM Cc1nc(C)c(CSCCCOc2ccc(-c3nn[n-]n3)cc2)s1 ZINC000822432045 599224277 /nfs/dbraw/zinc/22/42/77/599224277.db2.gz UPQKZHYIVYSKLE-UHFFFAOYSA-N -1 3 361.496 3.642 20 0 FHADHM C[C@H](CCSc1ccccc1)OC(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000820249343 607260941 /nfs/dbraw/zinc/26/09/41/607260941.db2.gz UYMPSHRVRFTRPH-CYBMUJFWSA-N -1 3 354.435 3.594 20 0 FHADHM C[C@H](CCSc1ccccc1)OC(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC000820249343 607260942 /nfs/dbraw/zinc/26/09/42/607260942.db2.gz UYMPSHRVRFTRPH-CYBMUJFWSA-N -1 3 354.435 3.594 20 0 FHADHM C[C@@H](CCSc1ccccc1)OC(=O)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000820248541 607261715 /nfs/dbraw/zinc/26/17/15/607261715.db2.gz JOPWKQYUNBDKCX-AWEZNQCLSA-N -1 3 368.462 3.523 20 0 FHADHM C[C@@H](CCSc1ccccc1)OC(=O)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000820248541 607261716 /nfs/dbraw/zinc/26/17/16/607261716.db2.gz JOPWKQYUNBDKCX-AWEZNQCLSA-N -1 3 368.462 3.523 20 0 FHADHM C[C@@H](CCSc1ccccc1)OC(=O)c1sccc1-c1nnn[n-]1 ZINC000820248153 607261829 /nfs/dbraw/zinc/26/18/29/607261829.db2.gz CZIMDFLVNWOTTQ-NSHDSACASA-N -1 3 360.464 3.656 20 0 FHADHM C[C@@H]1C[C@@H]1[C@H](NC(=O)c1cccc(-c2nnn[n-]2)c1)c1ccc(Cl)cc1 ZINC000736231695 599226622 /nfs/dbraw/zinc/22/66/22/599226622.db2.gz CCTHAMJFLBLPSV-ZTFRIQLXSA-N -1 3 367.840 3.647 20 0 FHADHM C[C@@H]1C[C@@H]1[C@H](NC(=O)c1cccc(-c2nn[n-]n2)c1)c1ccc(Cl)cc1 ZINC000736231695 599226625 /nfs/dbraw/zinc/22/66/25/599226625.db2.gz CCTHAMJFLBLPSV-ZTFRIQLXSA-N -1 3 367.840 3.647 20 0 FHADHM Cc1ccccc1NC(=O)CCS[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000822362439 599226769 /nfs/dbraw/zinc/22/67/69/599226769.db2.gz SYFCNFRQKFDXMR-CQSZACIVSA-N -1 3 367.478 3.998 20 0 FHADHM Cc1ccccc1NC(=O)CCS[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000822362439 599226772 /nfs/dbraw/zinc/22/67/72/599226772.db2.gz SYFCNFRQKFDXMR-CQSZACIVSA-N -1 3 367.478 3.998 20 0 FHADHM Cc1ccc(C)c(N(C(=O)c2ncc(-c3nnn[n-]3)cc2Cl)C(C)C)c1 ZINC000822231614 607263967 /nfs/dbraw/zinc/26/39/67/607263967.db2.gz ADUMKKHRNPDBLZ-UHFFFAOYSA-N -1 3 370.844 3.587 20 0 FHADHM Cc1ccc(C)c(N(C(=O)c2ncc(-c3nn[n-]n3)cc2Cl)C(C)C)c1 ZINC000822231614 607263968 /nfs/dbraw/zinc/26/39/68/607263968.db2.gz ADUMKKHRNPDBLZ-UHFFFAOYSA-N -1 3 370.844 3.587 20 0 FHADHM Cc1cccc2c(CCC(=O)Nc3cccc(-c4nn[n-]n4)c3C)c[nH]c21 ZINC000822065986 607268821 /nfs/dbraw/zinc/26/88/21/607268821.db2.gz CXJNJEQYGVVFBN-UHFFFAOYSA-N -1 3 360.421 3.536 20 0 FHADHM Cc1c(NC(=O)[C@@H]2C[C@@H]2c2cccc(Cl)c2)cccc1-c1nnn[n-]1 ZINC000822061516 607267025 /nfs/dbraw/zinc/26/70/25/607267025.db2.gz OSQBQYYURPYYRH-HUUCEWRRSA-N -1 3 353.813 3.571 20 0 FHADHM Cc1c(NC(=O)[C@@H]2C[C@@H]2c2cccc(Cl)c2)cccc1-c1nn[n-]n1 ZINC000822061516 607267026 /nfs/dbraw/zinc/26/70/26/607267026.db2.gz OSQBQYYURPYYRH-HUUCEWRRSA-N -1 3 353.813 3.571 20 0 FHADHM CC[C@H](NC(=S)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1cccs1 ZINC000820920317 599238387 /nfs/dbraw/zinc/23/83/87/599238387.db2.gz OWYZWJAGLGDPSE-RISCZKNCSA-N -1 3 372.523 3.605 20 0 FHADHM CC[C@H](NC(=S)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1cccs1 ZINC000820920317 599238389 /nfs/dbraw/zinc/23/83/89/599238389.db2.gz OWYZWJAGLGDPSE-RISCZKNCSA-N -1 3 372.523 3.605 20 0 FHADHM Cc1cccc2c(CCC(=O)Nc3cccc(-c4nnn[n-]4)c3C)c[nH]c21 ZINC000822065986 607268820 /nfs/dbraw/zinc/26/88/20/607268820.db2.gz CXJNJEQYGVVFBN-UHFFFAOYSA-N -1 3 360.421 3.536 20 0 FHADHM C[C@@H]1C[C@@H](c2cccc(F)c2)N(C(=O)Nc2ccc(-c3nnn[n-]3)cc2)C1 ZINC000820668302 599242964 /nfs/dbraw/zinc/24/29/64/599242964.db2.gz RJJZDOLBVQBORO-PXAZEXFGSA-N -1 3 366.400 3.621 20 0 FHADHM C[C@@H]1C[C@@H](c2cccc(F)c2)N(C(=O)Nc2ccc(-c3nn[n-]n3)cc2)C1 ZINC000820668302 599242967 /nfs/dbraw/zinc/24/29/67/599242967.db2.gz RJJZDOLBVQBORO-PXAZEXFGSA-N -1 3 366.400 3.621 20 0 FHADHM Cc1c(NC(=O)CCCOc2ccc(Cl)cc2)cccc1-c1nnn[n-]1 ZINC000822068033 607271576 /nfs/dbraw/zinc/27/15/76/607271576.db2.gz OFBHYSFXXZNKDG-UHFFFAOYSA-N -1 3 371.828 3.626 20 0 FHADHM Cc1c(NC(=O)CCCOc2ccc(Cl)cc2)cccc1-c1nn[n-]n1 ZINC000822068033 607271577 /nfs/dbraw/zinc/27/15/77/607271577.db2.gz OFBHYSFXXZNKDG-UHFFFAOYSA-N -1 3 371.828 3.626 20 0 FHADHM C[C@@H]1C[C@H](c2ccccc2F)N(C(=O)Nc2cccc(-c3nnn[n-]3)c2)C1 ZINC000820669165 599245629 /nfs/dbraw/zinc/24/56/29/599245629.db2.gz ZGOQJVSTYIJBNO-SJKOYZFVSA-N -1 3 366.400 3.621 20 0 FHADHM C[C@@H]1C[C@H](c2ccccc2F)N(C(=O)Nc2cccc(-c3nn[n-]n3)c2)C1 ZINC000820669165 599245631 /nfs/dbraw/zinc/24/56/31/599245631.db2.gz ZGOQJVSTYIJBNO-SJKOYZFVSA-N -1 3 366.400 3.621 20 0 FHADHM CCN(C(=O)/C=C/C1CCCCC1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736501492 599248186 /nfs/dbraw/zinc/24/81/86/599248186.db2.gz CTLRRGWJCQFJER-HNRFISLBSA-N -1 3 353.470 3.913 20 0 FHADHM CCN(C(=O)/C=C/C1CCCCC1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736501492 599248189 /nfs/dbraw/zinc/24/81/89/599248189.db2.gz CTLRRGWJCQFJER-HNRFISLBSA-N -1 3 353.470 3.913 20 0 FHADHM Cc1ccc(Cl)cc1NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000822240021 599248187 /nfs/dbraw/zinc/24/81/87/599248187.db2.gz ORQXVWYBYVWXKJ-NSHDSACASA-N -1 3 356.817 3.711 20 0 FHADHM Cc1ccc(Cl)cc1NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000822240021 599248190 /nfs/dbraw/zinc/24/81/90/599248190.db2.gz ORQXVWYBYVWXKJ-NSHDSACASA-N -1 3 356.817 3.711 20 0 FHADHM Cc1c(NC(=O)N(C)[C@@H](C)c2ccc(F)cc2)cccc1-c1nnn[n-]1 ZINC000822075383 607281338 /nfs/dbraw/zinc/28/13/38/607281338.db2.gz CVJAJHFWSCRCQN-LBPRGKRZSA-N -1 3 354.389 3.539 20 0 FHADHM Cc1c(NC(=O)N(C)[C@@H](C)c2ccc(F)cc2)cccc1-c1nn[n-]n1 ZINC000822075383 607281339 /nfs/dbraw/zinc/28/13/39/607281339.db2.gz CVJAJHFWSCRCQN-LBPRGKRZSA-N -1 3 354.389 3.539 20 0 FHADHM CCCOc1cccc(NC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000821138550 599252119 /nfs/dbraw/zinc/25/21/19/599252119.db2.gz BAJLDGWXAKNOJZ-ZDUSSCGKSA-N -1 3 366.425 3.538 20 0 FHADHM CCCOc1cccc(NC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000821138550 599252120 /nfs/dbraw/zinc/25/21/20/599252120.db2.gz BAJLDGWXAKNOJZ-ZDUSSCGKSA-N -1 3 366.425 3.538 20 0 FHADHM Cc1c(NC(=O)NCc2csc3ccccc23)cccc1-c1nnn[n-]1 ZINC000822103380 607281829 /nfs/dbraw/zinc/28/18/29/607281829.db2.gz GBTAWFUWWTYTGC-UHFFFAOYSA-N -1 3 364.434 3.712 20 0 FHADHM Cc1c(NC(=O)NCc2csc3ccccc23)cccc1-c1nn[n-]n1 ZINC000822103380 607281830 /nfs/dbraw/zinc/28/18/30/607281830.db2.gz GBTAWFUWWTYTGC-UHFFFAOYSA-N -1 3 364.434 3.712 20 0 FHADHM Cc1c(NC(=O)N2CC[C@@H](c3ccccc3)[C@@H]2C)cccc1-c1nnn[n-]1 ZINC000822084907 607288324 /nfs/dbraw/zinc/28/83/24/607288324.db2.gz RVCUWGJOAMZYOA-WMLDXEAASA-N -1 3 362.437 3.585 20 0 FHADHM Cc1c(NC(=O)N2CC[C@@H](c3ccccc3)[C@@H]2C)cccc1-c1nn[n-]n1 ZINC000822084907 607288325 /nfs/dbraw/zinc/28/83/25/607288325.db2.gz RVCUWGJOAMZYOA-WMLDXEAASA-N -1 3 362.437 3.585 20 0 FHADHM CN(Cc1cccs1)c1c(-c2nnn[n-]2)cnc2ccc(Cl)cc21 ZINC000736828081 599255347 /nfs/dbraw/zinc/25/53/47/599255347.db2.gz HHJPNSTXYALRDI-UHFFFAOYSA-N -1 3 356.842 3.766 20 0 FHADHM CN(Cc1cccs1)c1c(-c2nn[n-]n2)cnc2ccc(Cl)cc21 ZINC000736828081 599255349 /nfs/dbraw/zinc/25/53/49/599255349.db2.gz HHJPNSTXYALRDI-UHFFFAOYSA-N -1 3 356.842 3.766 20 0 FHADHM Cc1ccccc1CN(C)c1c(-c2nnn[n-]2)cnc2c(F)ccc(F)c21 ZINC000737428662 599256214 /nfs/dbraw/zinc/25/62/14/599256214.db2.gz SKBFYKCQOJRMHN-UHFFFAOYSA-N -1 3 366.375 3.638 20 0 FHADHM Cc1ccccc1CN(C)c1c(-c2nn[n-]n2)cnc2c(F)ccc(F)c21 ZINC000737428662 599256215 /nfs/dbraw/zinc/25/62/15/599256215.db2.gz SKBFYKCQOJRMHN-UHFFFAOYSA-N -1 3 366.375 3.638 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@H]2c2cccs2)cccc1-c1nnn[n-]1 ZINC000822083500 607284041 /nfs/dbraw/zinc/28/40/41/607284041.db2.gz BSHNCMGSBIGNBX-AWEZNQCLSA-N -1 3 354.439 3.606 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@H]2c2cccs2)cccc1-c1nn[n-]n1 ZINC000822083500 607284042 /nfs/dbraw/zinc/28/40/42/607284042.db2.gz BSHNCMGSBIGNBX-AWEZNQCLSA-N -1 3 354.439 3.606 20 0 FHADHM Cc1c(NC(=O)N[C@H](c2ccccc2)C(C)C)cccc1-c1nnn[n-]1 ZINC000822091068 607284372 /nfs/dbraw/zinc/28/43/72/607284372.db2.gz NKYNUOBTDJEAFH-KRWDZBQOSA-N -1 3 350.426 3.694 20 0 FHADHM Cc1c(NC(=O)N[C@H](c2ccccc2)C(C)C)cccc1-c1nn[n-]n1 ZINC000822091068 607284373 /nfs/dbraw/zinc/28/43/73/607284373.db2.gz NKYNUOBTDJEAFH-KRWDZBQOSA-N -1 3 350.426 3.694 20 0 FHADHM Cc1cc(F)cc2c1ncc(-c1nnn[n-]1)c2N1Cc2ccccc2[C@H](C)C1 ZINC000737264512 599257324 /nfs/dbraw/zinc/25/73/24/599257324.db2.gz SCCWBTQPMGWDKS-CYBMUJFWSA-N -1 3 374.423 3.986 20 0 FHADHM Cc1cc(F)cc2c1ncc(-c1nn[n-]n1)c2N1Cc2ccccc2[C@H](C)C1 ZINC000737264512 599257326 /nfs/dbraw/zinc/25/73/26/599257326.db2.gz SCCWBTQPMGWDKS-CYBMUJFWSA-N -1 3 374.423 3.986 20 0 FHADHM Cc1c(NC(=O)N([C@H](C)c2ccco2)C2CC2)cccc1-c1nnn[n-]1 ZINC000822075264 607285411 /nfs/dbraw/zinc/28/54/11/607285411.db2.gz ANVUFOUARRPKSC-GFCCVEGCSA-N -1 3 352.398 3.526 20 0 FHADHM Cc1c(NC(=O)N([C@H](C)c2ccco2)C2CC2)cccc1-c1nn[n-]n1 ZINC000822075264 607285412 /nfs/dbraw/zinc/28/54/12/607285412.db2.gz ANVUFOUARRPKSC-GFCCVEGCSA-N -1 3 352.398 3.526 20 0 FHADHM Cc1c(NC(=O)N[C@H](C)c2cccc(Cl)c2)cccc1-c1nnn[n-]1 ZINC000822090734 607285672 /nfs/dbraw/zinc/28/56/72/607285672.db2.gz MPCVFIQIMJJMTK-LLVKDONJSA-N -1 3 356.817 3.711 20 0 FHADHM Cc1c(NC(=O)N[C@H](C)c2cccc(Cl)c2)cccc1-c1nn[n-]n1 ZINC000822090734 607285673 /nfs/dbraw/zinc/28/56/73/607285673.db2.gz MPCVFIQIMJJMTK-LLVKDONJSA-N -1 3 356.817 3.711 20 0 FHADHM CC[C@@H]1c2ccsc2CCN1C(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000821002240 607285971 /nfs/dbraw/zinc/28/59/71/607285971.db2.gz VFHISEQYYYPZLO-OAHLLOKOSA-N -1 3 368.466 3.778 20 0 FHADHM CC[C@@H]1c2ccsc2CCN1C(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000821002240 607285972 /nfs/dbraw/zinc/28/59/72/607285972.db2.gz VFHISEQYYYPZLO-OAHLLOKOSA-N -1 3 368.466 3.778 20 0 FHADHM CCc1ccc([C@H](C)NC(=O)Nc2cccc(-c3nnn[n-]3)c2C)cc1 ZINC000821482518 607287124 /nfs/dbraw/zinc/28/71/24/607287124.db2.gz SFZCCLHHVQJUPF-ZDUSSCGKSA-N -1 3 350.426 3.620 20 0 FHADHM CCc1ccc([C@H](C)NC(=O)Nc2cccc(-c3nn[n-]n3)c2C)cc1 ZINC000821482518 607287125 /nfs/dbraw/zinc/28/71/25/607287125.db2.gz SFZCCLHHVQJUPF-ZDUSSCGKSA-N -1 3 350.426 3.620 20 0 FHADHM Cc1c(NC(=O)N[C@@H]2CCc3c2cccc3Cl)cccc1-c1nnn[n-]1 ZINC000822092661 607289498 /nfs/dbraw/zinc/28/94/98/607289498.db2.gz YGDHSLAIQNEMFZ-MRXNPFEDSA-N -1 3 368.828 3.638 20 0 FHADHM Cc1c(NC(=O)N[C@@H]2CCc3c2cccc3Cl)cccc1-c1nn[n-]n1 ZINC000822092661 607289499 /nfs/dbraw/zinc/28/94/99/607289499.db2.gz YGDHSLAIQNEMFZ-MRXNPFEDSA-N -1 3 368.828 3.638 20 0 FHADHM Cc1ccccc1[C@H]1CCN(C(=O)Nc2cccc(-c3nnn[n-]3)c2C)C1 ZINC000822351589 607289516 /nfs/dbraw/zinc/28/95/16/607289516.db2.gz OWFGWRBIHDELCG-HNNXBMFYSA-N -1 3 362.437 3.505 20 0 FHADHM Cc1ccccc1[C@H]1CCN(C(=O)Nc2cccc(-c3nn[n-]n3)c2C)C1 ZINC000822351589 607289517 /nfs/dbraw/zinc/28/95/17/607289517.db2.gz OWFGWRBIHDELCG-HNNXBMFYSA-N -1 3 362.437 3.505 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@@]3(CC=CCC3)C2)cccc1-c1nnn[n-]1 ZINC000822084495 607289874 /nfs/dbraw/zinc/28/98/74/607289874.db2.gz LEYHCZUNCBJJRH-IBGZPJMESA-N -1 3 352.442 3.529 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@@]3(CC=CCC3)C2)cccc1-c1nn[n-]n1 ZINC000822084495 607289875 /nfs/dbraw/zinc/28/98/75/607289875.db2.gz LEYHCZUNCBJJRH-IBGZPJMESA-N -1 3 352.442 3.529 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@]3(CC=CCC3)C2)cccc1-c1nnn[n-]1 ZINC000822084496 607290091 /nfs/dbraw/zinc/29/00/91/607290091.db2.gz LEYHCZUNCBJJRH-LJQANCHMSA-N -1 3 352.442 3.529 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@]3(CC=CCC3)C2)cccc1-c1nn[n-]n1 ZINC000822084496 607290092 /nfs/dbraw/zinc/29/00/92/607290092.db2.gz LEYHCZUNCBJJRH-LJQANCHMSA-N -1 3 352.442 3.529 20 0 FHADHM Cc1ccccc1[C@@H](C)N(C)C(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000822345633 607291088 /nfs/dbraw/zinc/29/10/88/607291088.db2.gz NLECWPWBLDPXLS-CQSZACIVSA-N -1 3 350.426 3.708 20 0 FHADHM Cc1ccccc1[C@@H](C)N(C)C(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000822345633 607291089 /nfs/dbraw/zinc/29/10/89/607291089.db2.gz NLECWPWBLDPXLS-CQSZACIVSA-N -1 3 350.426 3.708 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@@H]2c2ccsc2)cccc1-c1nnn[n-]1 ZINC000822084490 607292547 /nfs/dbraw/zinc/29/25/47/607292547.db2.gz LBTYJBFIBFHCBQ-OAHLLOKOSA-N -1 3 354.439 3.606 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@@H]2c2ccsc2)cccc1-c1nn[n-]n1 ZINC000822084490 607292548 /nfs/dbraw/zinc/29/25/48/607292548.db2.gz LBTYJBFIBFHCBQ-OAHLLOKOSA-N -1 3 354.439 3.606 20 0 FHADHM CC[C@@H](Sc1ccccc1)C(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000820937692 607293902 /nfs/dbraw/zinc/29/39/02/607293902.db2.gz BZJOATBMJOOICC-MRXNPFEDSA-N -1 3 353.451 3.685 20 0 FHADHM CC[C@@H](Sc1ccccc1)C(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000820937692 607293903 /nfs/dbraw/zinc/29/39/03/607293903.db2.gz BZJOATBMJOOICC-MRXNPFEDSA-N -1 3 353.451 3.685 20 0 FHADHM O[C@@H]1CCCC[C@@H]1CCCNc1ccc(-c2nn[n-]n2)cc1C(F)(F)F ZINC000823706782 607306784 /nfs/dbraw/zinc/30/67/84/607306784.db2.gz PCMFXLOSQQTYLZ-IAQYHMDHSA-N -1 3 369.391 3.629 20 0 FHADHM CCCCOc1ccc(OC)cc1NCc1ccc(-c2nnn[n-]2)s1 ZINC000821077679 607312097 /nfs/dbraw/zinc/31/20/97/607312097.db2.gz PVBBOYOBYUBKFQ-UHFFFAOYSA-N -1 3 359.455 3.728 20 0 FHADHM Cc1c(NCc2ccc(-c3nnn[n-]3)s2)cccc1OCC(F)(F)F ZINC000822123007 607316236 /nfs/dbraw/zinc/31/62/36/607316236.db2.gz SLRJUUQAIMJALA-UHFFFAOYSA-N -1 3 369.372 3.790 20 0 FHADHM C[C@@H](NC(=O)Nc1ncc(C(C)(C)C)s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820379538 599296573 /nfs/dbraw/zinc/29/65/73/599296573.db2.gz CPZHUYRWBHAOCG-SNVBAGLBSA-N -1 3 371.470 3.503 20 0 FHADHM CN(c1ccccc1NCc1ccc(-c2nnn[n-]2)s1)C1CCCC1 ZINC000821618969 607318434 /nfs/dbraw/zinc/31/84/34/607318434.db2.gz DBDZHCVUEYOYFQ-UHFFFAOYSA-N -1 3 354.483 3.919 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)CCc1cccc(C)c1 ZINC000736487890 599276626 /nfs/dbraw/zinc/27/66/26/599276626.db2.gz JOPRDRXXHWCJKA-UHFFFAOYSA-N -1 3 364.453 3.568 20 0 FHADHM O=C(Nc1cccc(NC2CCCC2)c1)c1sccc1-c1nnn[n-]1 ZINC000738184966 599276672 /nfs/dbraw/zinc/27/66/72/599276672.db2.gz FWHOOPYOOGUNTQ-UHFFFAOYSA-N -1 3 354.439 3.535 20 0 FHADHM O=C(Nc1cccc(NC2CCCC2)c1)c1sccc1-c1nn[n-]n1 ZINC000738184966 599276674 /nfs/dbraw/zinc/27/66/74/599276674.db2.gz FWHOOPYOOGUNTQ-UHFFFAOYSA-N -1 3 354.439 3.535 20 0 FHADHM CCSc1cccc(NC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000821461663 599281316 /nfs/dbraw/zinc/28/13/16/599281316.db2.gz RDEYQGWWNKZGMY-GFCCVEGCSA-N -1 3 368.466 3.861 20 0 FHADHM CCSc1cccc(NC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000821461663 599281320 /nfs/dbraw/zinc/28/13/20/599281320.db2.gz RDEYQGWWNKZGMY-GFCCVEGCSA-N -1 3 368.466 3.861 20 0 FHADHM Cc1ccc2cccc(NC(=O)N[C@H](C)c3cccc(-c4nnn[n-]4)c3)c2n1 ZINC000822279590 599282590 /nfs/dbraw/zinc/28/25/90/599282590.db2.gz BQTJVEABOBOBFE-CYBMUJFWSA-N -1 3 373.420 3.606 20 0 FHADHM Cc1ccc2cccc(NC(=O)N[C@H](C)c3cccc(-c4nn[n-]n4)c3)c2n1 ZINC000822279590 599282592 /nfs/dbraw/zinc/28/25/92/599282592.db2.gz BQTJVEABOBOBFE-CYBMUJFWSA-N -1 3 373.420 3.606 20 0 FHADHM O=C(NCCC1CC1)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000823182537 599283140 /nfs/dbraw/zinc/28/31/40/599283140.db2.gz MCLZPOLAJCWHFS-UHFFFAOYSA-N -1 3 364.409 3.581 20 0 FHADHM O=C(NCCC1CC1)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000823182537 599283141 /nfs/dbraw/zinc/28/31/41/599283141.db2.gz MCLZPOLAJCWHFS-UHFFFAOYSA-N -1 3 364.409 3.581 20 0 FHADHM C[C@@H](Sc1nnc(-c2ccc(F)cc2)o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736191114 599285137 /nfs/dbraw/zinc/28/51/37/599285137.db2.gz IBFFLUXXVIGEOB-SNVBAGLBSA-N -1 3 368.397 3.909 20 0 FHADHM C[C@@H](Sc1nnc(-c2ccc(F)cc2)o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736191114 599285139 /nfs/dbraw/zinc/28/51/39/599285139.db2.gz IBFFLUXXVIGEOB-SNVBAGLBSA-N -1 3 368.397 3.909 20 0 FHADHM CCC[C@H](C)N(C)C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000821015293 599286227 /nfs/dbraw/zinc/28/62/27/599286227.db2.gz OORNFJWDPWMTBU-VIFPVBQESA-N -1 3 356.352 3.538 20 0 FHADHM CCC[C@H](C)N(C)C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000821015293 599286229 /nfs/dbraw/zinc/28/62/29/599286229.db2.gz OORNFJWDPWMTBU-VIFPVBQESA-N -1 3 356.352 3.538 20 0 FHADHM C[C@@H]1CCCC[C@H]1NC(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000820704668 599286720 /nfs/dbraw/zinc/28/67/20/599286720.db2.gz PHJZKGPYXVTDBS-NOZJJQNGSA-N -1 3 368.363 3.586 20 0 FHADHM C[C@@H]1CCCC[C@H]1NC(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000820704668 599286722 /nfs/dbraw/zinc/28/67/22/599286722.db2.gz PHJZKGPYXVTDBS-NOZJJQNGSA-N -1 3 368.363 3.586 20 0 FHADHM CCCCN(C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)C1CC1 ZINC000821060391 599289206 /nfs/dbraw/zinc/28/92/06/599289206.db2.gz DAJFDJFUPZGVLQ-UHFFFAOYSA-N -1 3 368.363 3.682 20 0 FHADHM CCCCN(C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)C1CC1 ZINC000821060391 599289207 /nfs/dbraw/zinc/28/92/07/599289207.db2.gz DAJFDJFUPZGVLQ-UHFFFAOYSA-N -1 3 368.363 3.682 20 0 FHADHM Cc1cc(C)c2cc(C(=O)Nc3cccc(-c4nnn[n-]4)c3C)sc2n1 ZINC000822195300 607321578 /nfs/dbraw/zinc/32/15/78/607321578.db2.gz OAIHWZCPSBPICL-UHFFFAOYSA-N -1 3 364.434 3.654 20 0 FHADHM Cc1cc(C)c2cc(C(=O)Nc3cccc(-c4nn[n-]n4)c3C)sc2n1 ZINC000822195300 607321579 /nfs/dbraw/zinc/32/15/79/607321579.db2.gz OAIHWZCPSBPICL-UHFFFAOYSA-N -1 3 364.434 3.654 20 0 FHADHM Cc1c(NC(=O)c2ccnc(Oc3ccccc3)c2)cccc1-c1nnn[n-]1 ZINC000822115322 607321966 /nfs/dbraw/zinc/32/19/66/607321966.db2.gz BHIFXPOKHQIVEP-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1c(NC(=O)c2ccnc(Oc3ccccc3)c2)cccc1-c1nn[n-]n1 ZINC000822115322 607321967 /nfs/dbraw/zinc/32/19/67/607321967.db2.gz BHIFXPOKHQIVEP-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM C[C@H]1CCCCCN1C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000820703086 599290895 /nfs/dbraw/zinc/29/08/95/599290895.db2.gz CSDVBKCLVRYVBN-JTQLQIEISA-N -1 3 368.363 3.682 20 0 FHADHM C[C@H]1CCCCCN1C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000820703086 599290896 /nfs/dbraw/zinc/29/08/96/599290896.db2.gz CSDVBKCLVRYVBN-JTQLQIEISA-N -1 3 368.363 3.682 20 0 FHADHM CC1(C)CCN(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)CC1 ZINC000820596882 599291346 /nfs/dbraw/zinc/29/13/46/599291346.db2.gz SRRKWOMAFKIEFE-UHFFFAOYSA-N -1 3 368.363 3.539 20 0 FHADHM CC1(C)CCN(C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)CC1 ZINC000820596882 599291347 /nfs/dbraw/zinc/29/13/47/599291347.db2.gz SRRKWOMAFKIEFE-UHFFFAOYSA-N -1 3 368.363 3.539 20 0 FHADHM Cn1c2ccccc2nc1[C@H](NC1CCC(C(=O)[O-])CC1)c1ccccc1 ZINC000263445045 598114811 /nfs/dbraw/zinc/11/48/11/598114811.db2.gz XOGNVMSZNPJYID-LBXVMSDZSA-N -1 3 363.461 3.896 20 0 FHADHM COc1ccc(Cn2cc(C)c(-c3nnn[n-]3)c2)cc1SC(F)(F)F ZINC000821828098 607330296 /nfs/dbraw/zinc/33/02/96/607330296.db2.gz PYVCQHCHBWYUPY-UHFFFAOYSA-N -1 3 369.372 3.645 20 0 FHADHM COc1ccc(Cn2cc(C)c(-c3nn[n-]n3)c2)cc1SC(F)(F)F ZINC000821828098 607330297 /nfs/dbraw/zinc/33/02/97/607330297.db2.gz PYVCQHCHBWYUPY-UHFFFAOYSA-N -1 3 369.372 3.645 20 0 FHADHM CN1CCC(N(Cc2ccccc2)C(=O)Nc2ccccc2C(=O)[O-])CC1 ZINC000820620794 598178661 /nfs/dbraw/zinc/17/86/61/598178661.db2.gz UBIITVWUHHWFQA-UHFFFAOYSA-N -1 3 367.449 3.513 20 0 FHADHM COc1ccc(Oc2cc(CNCc3cccc(C(=O)[O-])c3)ccn2)cc1 ZINC000820849951 598202818 /nfs/dbraw/zinc/20/28/18/598202818.db2.gz ZZRATTPFXUOLBX-UHFFFAOYSA-N -1 3 364.401 3.871 20 0 FHADHM Fc1cccc(Nc2cc(F)c(N3CCCC3)c(F)c2)c1-c1nnn[n-]1 ZINC000737665697 598241073 /nfs/dbraw/zinc/24/10/73/598241073.db2.gz UQSRELITFWNZJW-UHFFFAOYSA-N -1 3 360.343 3.628 20 0 FHADHM Fc1cccc(Nc2cc(F)c(N3CCCC3)c(F)c2)c1-c1nn[n-]n1 ZINC000737665697 598241074 /nfs/dbraw/zinc/24/10/74/598241074.db2.gz UQSRELITFWNZJW-UHFFFAOYSA-N -1 3 360.343 3.628 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1NC[C@@H]1CCN(c2ccc(Cl)cc2)C1 ZINC000737641757 598242488 /nfs/dbraw/zinc/24/24/88/598242488.db2.gz XXRGXIJZQSIPIM-LBPRGKRZSA-N -1 3 372.835 3.598 20 0 FHADHM Cc1nnc(NCc2ccc(Oc3ccccc3)cc2)c(-c2nnn[n-]2)c1C ZINC000737533567 598245513 /nfs/dbraw/zinc/24/55/13/598245513.db2.gz NGIHZCLVWXRXLD-UHFFFAOYSA-N -1 3 373.420 3.678 20 0 FHADHM Cc1nnc(NCc2ccc(Oc3ccccc3)cc2)c(-c2nn[n-]n2)c1C ZINC000737533567 598245515 /nfs/dbraw/zinc/24/55/15/598245515.db2.gz NGIHZCLVWXRXLD-UHFFFAOYSA-N -1 3 373.420 3.678 20 0 FHADHM CCc1cccc2c1OCC[C@H]2Nc1c(F)cc(-c2nnn[n-]2)cc1F ZINC000736695317 598248174 /nfs/dbraw/zinc/24/81/74/598248174.db2.gz LFNMCBGAVKVUDQ-OAHLLOKOSA-N -1 3 357.364 3.643 20 0 FHADHM CCc1cccc2c1OCC[C@H]2Nc1c(F)cc(-c2nn[n-]n2)cc1F ZINC000736695317 598248175 /nfs/dbraw/zinc/24/81/75/598248175.db2.gz LFNMCBGAVKVUDQ-OAHLLOKOSA-N -1 3 357.364 3.643 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)N[C@H](c1ccc(F)cc1)C1CCC1 ZINC000738179636 598254593 /nfs/dbraw/zinc/25/45/93/598254593.db2.gz ZIGCLXNMXWIGCR-KRWDZBQOSA-N -1 3 366.400 3.669 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)N[C@H](c1ccc(F)cc1)C1CCC1 ZINC000738179636 598254595 /nfs/dbraw/zinc/25/45/95/598254595.db2.gz ZIGCLXNMXWIGCR-KRWDZBQOSA-N -1 3 366.400 3.669 20 0 FHADHM FC(F)(F)c1cc(N2CCc3sccc3C2)ccc1-c1nnn[n-]1 ZINC000737633436 598275775 /nfs/dbraw/zinc/27/57/75/598275775.db2.gz RFBZMKRZSKFPIW-UHFFFAOYSA-N -1 3 351.357 3.510 20 0 FHADHM FC(F)(F)c1cc(N2CCc3sccc3C2)ccc1-c1nn[n-]n1 ZINC000737633436 598275776 /nfs/dbraw/zinc/27/57/76/598275776.db2.gz RFBZMKRZSKFPIW-UHFFFAOYSA-N -1 3 351.357 3.510 20 0 FHADHM CC[C@H](C)Oc1ccccc1C=CC(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000729833919 598296467 /nfs/dbraw/zinc/29/64/67/598296467.db2.gz NZVIKAYDFKVYIH-NYHXXUGCSA-N -1 3 363.421 3.696 20 0 FHADHM CC[C@H](C)Oc1ccccc1C=CC(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000729833919 598296469 /nfs/dbraw/zinc/29/64/69/598296469.db2.gz NZVIKAYDFKVYIH-NYHXXUGCSA-N -1 3 363.421 3.696 20 0 FHADHM C[C@@H]1CCC[C@H](NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)[C@@H]1C ZINC000736249124 598316826 /nfs/dbraw/zinc/31/68/26/598316826.db2.gz FDQRFAIOCIZMAI-RULNRJAQSA-N -1 3 364.906 3.631 20 0 FHADHM C[C@@H]1CCC[C@H](NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)[C@@H]1C ZINC000736249124 598316824 /nfs/dbraw/zinc/31/68/24/598316824.db2.gz FDQRFAIOCIZMAI-RULNRJAQSA-N -1 3 364.906 3.631 20 0 FHADHM S=C(Nc1cccc(Cl)c1)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000738409533 598318613 /nfs/dbraw/zinc/31/86/13/598318613.db2.gz RNCKDAYSEWLCFG-UHFFFAOYSA-N -1 3 365.249 3.982 20 0 FHADHM S=C(Nc1cccc(Cl)c1)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000738409533 598318615 /nfs/dbraw/zinc/31/86/15/598318615.db2.gz RNCKDAYSEWLCFG-UHFFFAOYSA-N -1 3 365.249 3.982 20 0 FHADHM CCCCc1ccc(NC(=O)NCc2ccc(-c3nnn[n-]3)cc2F)cc1 ZINC000736466070 598321430 /nfs/dbraw/zinc/32/14/30/598321430.db2.gz IUVYTBYBEGIEKU-UHFFFAOYSA-N -1 3 368.416 3.670 20 0 FHADHM CCCCc1ccc(NC(=O)NCc2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000736466070 598321432 /nfs/dbraw/zinc/32/14/32/598321432.db2.gz IUVYTBYBEGIEKU-UHFFFAOYSA-N -1 3 368.416 3.670 20 0 FHADHM Brc1cccc([C@@H]2C[C@@H]2Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735369817 598353798 /nfs/dbraw/zinc/35/37/98/598353798.db2.gz XKILONNHEYAXFE-GJZGRUSLSA-N -1 3 356.227 3.597 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CCC2(CCCCC2)CC1 ZINC000737290700 598361377 /nfs/dbraw/zinc/36/13/77/598361377.db2.gz FRBWJAQZKCOZPZ-UHFFFAOYSA-N -1 3 354.458 3.753 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CCC2(CCCCC2)CC1 ZINC000737290700 598361378 /nfs/dbraw/zinc/36/13/78/598361378.db2.gz FRBWJAQZKCOZPZ-UHFFFAOYSA-N -1 3 354.458 3.753 20 0 FHADHM FC(F)(F)c1cccc(CNc2ncc(-c3nnn[n-]3)cc2Cl)c1 ZINC000737635918 598387017 /nfs/dbraw/zinc/38/70/17/598387017.db2.gz QBRCWWLOWRUWPX-UHFFFAOYSA-N -1 3 354.723 3.546 20 0 FHADHM FC(F)(F)c1cccc(CNc2ncc(-c3nn[n-]n3)cc2Cl)c1 ZINC000737635918 598387018 /nfs/dbraw/zinc/38/70/18/598387018.db2.gz QBRCWWLOWRUWPX-UHFFFAOYSA-N -1 3 354.723 3.546 20 0 FHADHM Fc1cccc2c1SCC[C@H]2Nc1ncc(-c2nnn[n-]2)cc1Cl ZINC000737663113 598390214 /nfs/dbraw/zinc/39/02/14/598390214.db2.gz GORKMHSVBPPZAA-GFCCVEGCSA-N -1 3 362.821 3.703 20 0 FHADHM Fc1cccc2c1SCC[C@H]2Nc1ncc(-c2nn[n-]n2)cc1Cl ZINC000737663113 598390215 /nfs/dbraw/zinc/39/02/15/598390215.db2.gz GORKMHSVBPPZAA-GFCCVEGCSA-N -1 3 362.821 3.703 20 0 FHADHM CC(C)Oc1ccc([C@H](C)Nc2ncc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000735915547 598390394 /nfs/dbraw/zinc/39/03/94/598390394.db2.gz PCCPKVHMBJFRTR-NSHDSACASA-N -1 3 358.833 3.875 20 0 FHADHM CC(C)Oc1ccc([C@H](C)Nc2ncc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000735915547 598390396 /nfs/dbraw/zinc/39/03/96/598390396.db2.gz PCCPKVHMBJFRTR-NSHDSACASA-N -1 3 358.833 3.875 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1NCc1ccc(-c2ccccc2)o1 ZINC000737557454 598391514 /nfs/dbraw/zinc/39/15/14/598391514.db2.gz FCRAKPLEBVDEJV-UHFFFAOYSA-N -1 3 352.785 3.787 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1NCc1ccc(-c2ccccc2)o1 ZINC000737557454 598391515 /nfs/dbraw/zinc/39/15/15/598391515.db2.gz FCRAKPLEBVDEJV-UHFFFAOYSA-N -1 3 352.785 3.787 20 0 FHADHM CC[C@@H](C)c1ccc(NC(=O)COc2ccc(-c3nn[n-]n3)cc2C)cc1 ZINC000736330475 598396124 /nfs/dbraw/zinc/39/61/24/598396124.db2.gz YTJYPFMXNKFUKD-CYBMUJFWSA-N -1 3 365.437 3.706 20 0 FHADHM CSc1cccc(NC(=O)[C@H](C)Sc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737190966 598414792 /nfs/dbraw/zinc/41/47/92/598414792.db2.gz KPGCEXUMGUZONB-NSHDSACASA-N -1 3 371.491 3.708 20 0 FHADHM CSc1cccc(NC(=O)[C@H](C)Sc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737190966 598414794 /nfs/dbraw/zinc/41/47/94/598414794.db2.gz KPGCEXUMGUZONB-NSHDSACASA-N -1 3 371.491 3.708 20 0 FHADHM Cc1cc(Cl)ccc1NC(=O)[C@@H](C)Sc1ccc(-c2nnn[n-]2)cc1 ZINC000737265758 598414931 /nfs/dbraw/zinc/41/49/31/598414931.db2.gz YLCQDZOWZDKKTO-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM Cc1cc(Cl)ccc1NC(=O)[C@@H](C)Sc1ccc(-c2nn[n-]n2)cc1 ZINC000737265758 598414933 /nfs/dbraw/zinc/41/49/33/598414933.db2.gz YLCQDZOWZDKKTO-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM CSc1ccc(NC(=O)[C@@H](C)Sc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000737191596 598417246 /nfs/dbraw/zinc/41/72/46/598417246.db2.gz SILCJANUBYFRLT-LLVKDONJSA-N -1 3 371.491 3.708 20 0 FHADHM CSc1ccc(NC(=O)[C@@H](C)Sc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000737191596 598417248 /nfs/dbraw/zinc/41/72/48/598417248.db2.gz SILCJANUBYFRLT-LLVKDONJSA-N -1 3 371.491 3.708 20 0 FHADHM Cc1ccccc1[C@@H](C)NC(=O)[C@@H](C)Sc1ccc(-c2nnn[n-]2)cc1 ZINC000737419925 598417295 /nfs/dbraw/zinc/41/72/95/598417295.db2.gz GMHUZQDILRGQCE-ZIAGYGMSSA-N -1 3 367.478 3.533 20 0 FHADHM Cc1ccccc1[C@@H](C)NC(=O)[C@@H](C)Sc1ccc(-c2nn[n-]n2)cc1 ZINC000737419925 598417296 /nfs/dbraw/zinc/41/72/96/598417296.db2.gz GMHUZQDILRGQCE-ZIAGYGMSSA-N -1 3 367.478 3.533 20 0 FHADHM Cc1cc(F)ccc1NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C(C)C ZINC000737270245 598426537 /nfs/dbraw/zinc/42/65/37/598426537.db2.gz MAQXJYOTSGDWOP-UHFFFAOYSA-N -1 3 368.416 3.757 20 0 FHADHM Cc1cc(F)ccc1NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C(C)C ZINC000737270245 598426539 /nfs/dbraw/zinc/42/65/39/598426539.db2.gz MAQXJYOTSGDWOP-UHFFFAOYSA-N -1 3 368.416 3.757 20 0 FHADHM CC[C@@H]1CCCC[C@H]1NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C(C)C ZINC000736399623 598429915 /nfs/dbraw/zinc/42/99/15/598429915.db2.gz JDBSSDHOKWRBAL-SJLPKXTDSA-N -1 3 370.501 3.756 20 0 FHADHM CC[C@@H]1CCCC[C@H]1NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C(C)C ZINC000736399623 598429917 /nfs/dbraw/zinc/42/99/17/598429917.db2.gz JDBSSDHOKWRBAL-SJLPKXTDSA-N -1 3 370.501 3.756 20 0 FHADHM CC(C)c1ccc([C@@H](NC(=O)c2ccc(-c3nnn[n-]3)cn2)C(C)C)cc1 ZINC000735925180 598439653 /nfs/dbraw/zinc/43/96/53/598439653.db2.gz YUBRMJPXXRHQQU-SFHVURJKSA-N -1 3 364.453 3.512 20 0 FHADHM CC(C)c1ccc([C@@H](NC(=O)c2ccc(-c3nn[n-]n3)cn2)C(C)C)cc1 ZINC000735925180 598439654 /nfs/dbraw/zinc/43/96/54/598439654.db2.gz YUBRMJPXXRHQQU-SFHVURJKSA-N -1 3 364.453 3.512 20 0 FHADHM Clc1cc2c(cc1SCc1ccccc1-c1nnn[n-]1)OCCO2 ZINC000737564719 598440011 /nfs/dbraw/zinc/44/00/11/598440011.db2.gz JPNOSVWPMUCSSN-UHFFFAOYSA-N -1 3 360.826 3.584 20 0 FHADHM Clc1cc2c(cc1SCc1ccccc1-c1nn[n-]n1)OCCO2 ZINC000737564719 598440012 /nfs/dbraw/zinc/44/00/12/598440012.db2.gz JPNOSVWPMUCSSN-UHFFFAOYSA-N -1 3 360.826 3.584 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)C1(c2cccc(C(F)(F)F)c2)CC1 ZINC000104367915 598440480 /nfs/dbraw/zinc/44/04/80/598440480.db2.gz XEWZQMMDZIIZJS-UHFFFAOYSA-N -1 3 373.338 3.556 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)C1(c2cccc(C(F)(F)F)c2)CC1 ZINC000104367915 598440481 /nfs/dbraw/zinc/44/04/81/598440481.db2.gz XEWZQMMDZIIZJS-UHFFFAOYSA-N -1 3 373.338 3.556 20 0 FHADHM CC(C)(NC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1ccc(Cl)cc1 ZINC000735671737 598449857 /nfs/dbraw/zinc/44/98/57/598449857.db2.gz DODSFCSFRRZRRW-KPKJPENVSA-N -1 3 367.840 3.585 20 0 FHADHM CC(C)(NC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1ccc(Cl)cc1 ZINC000735671737 598449859 /nfs/dbraw/zinc/44/98/59/598449859.db2.gz DODSFCSFRRZRRW-KPKJPENVSA-N -1 3 367.840 3.585 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)[C@@H]1C[C@@H]1c1cccc2ccccc21 ZINC000738164392 598453331 /nfs/dbraw/zinc/45/33/31/598453331.db2.gz YRYOFTXWWFAHMA-IAGOWNOFSA-N -1 3 373.391 3.901 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)[C@@H]1C[C@@H]1c1cccc2ccccc21 ZINC000738164392 598453332 /nfs/dbraw/zinc/45/33/32/598453332.db2.gz YRYOFTXWWFAHMA-IAGOWNOFSA-N -1 3 373.391 3.901 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)N1CCC[C@@H](c2ccccc2)CC1 ZINC000737801739 598456498 /nfs/dbraw/zinc/45/64/98/598456498.db2.gz TXWZXARNRMKWPQ-MENFKHAKSA-N -1 3 373.460 3.676 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)N1CCC[C@@H](c2ccccc2)CC1 ZINC000737801739 598456500 /nfs/dbraw/zinc/45/65/00/598456500.db2.gz TXWZXARNRMKWPQ-MENFKHAKSA-N -1 3 373.460 3.676 20 0 FHADHM Clc1ccc(Br)cc1NCc1ccc(-c2nnn[n-]2)cc1 ZINC000737570099 598458977 /nfs/dbraw/zinc/45/89/77/598458977.db2.gz AZMZMKGRXALTOH-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM Clc1ccc(Br)cc1NCc1ccc(-c2nn[n-]n2)cc1 ZINC000737570099 598458979 /nfs/dbraw/zinc/45/89/79/598458979.db2.gz AZMZMKGRXALTOH-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM c1ccc([C@@H]2CCCN(c3nc4c(cc3-c3nnn[n-]3)CCC4)CC2)cc1 ZINC000738429304 598460091 /nfs/dbraw/zinc/46/00/91/598460091.db2.gz WUGMSGRHICFEPT-MRXNPFEDSA-N -1 3 360.465 3.525 20 0 FHADHM c1ccc([C@@H]2CCCN(c3nc4c(cc3-c3nn[n-]n3)CCC4)CC2)cc1 ZINC000738429304 598460092 /nfs/dbraw/zinc/46/00/92/598460092.db2.gz WUGMSGRHICFEPT-MRXNPFEDSA-N -1 3 360.465 3.525 20 0 FHADHM C[C@@H](CN(C)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccccc1 ZINC000735999054 598473872 /nfs/dbraw/zinc/47/38/72/598473872.db2.gz ZZGRINAZGPORDH-LBPRGKRZSA-N -1 3 370.844 3.788 20 0 FHADHM C[C@@H](CN(C)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccccc1 ZINC000735999054 598473873 /nfs/dbraw/zinc/47/38/73/598473873.db2.gz ZZGRINAZGPORDH-LBPRGKRZSA-N -1 3 370.844 3.788 20 0 FHADHM Cc1ccc2c(CC(=O)O[C@H](C)c3cccc(-c4nnn[n-]4)c3)c[nH]c2c1 ZINC000737371997 598483671 /nfs/dbraw/zinc/48/36/71/598483671.db2.gz STRLZAQMZVSNQF-CYBMUJFWSA-N -1 3 361.405 3.503 20 0 FHADHM Cc1ccc2c(CC(=O)O[C@H](C)c3cccc(-c4nn[n-]n4)c3)c[nH]c2c1 ZINC000737371997 598483673 /nfs/dbraw/zinc/48/36/73/598483673.db2.gz STRLZAQMZVSNQF-CYBMUJFWSA-N -1 3 361.405 3.503 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)CCSc1ccccc1 ZINC000735659602 598487877 /nfs/dbraw/zinc/48/78/77/598487877.db2.gz DQNOQOYRPJFQAX-UHFFFAOYSA-N -1 3 370.482 3.544 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)CCSc1ccccc1 ZINC000735659602 598487878 /nfs/dbraw/zinc/48/78/78/598487878.db2.gz DQNOQOYRPJFQAX-UHFFFAOYSA-N -1 3 370.482 3.544 20 0 FHADHM CCc1ccc([C@@H](C)C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1 ZINC000736688773 598496977 /nfs/dbraw/zinc/49/69/77/598496977.db2.gz RVGFOJVJQSPWDC-LLVKDONJSA-N -1 3 355.829 3.825 20 0 FHADHM CCc1ccc([C@@H](C)C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1 ZINC000736688773 598496978 /nfs/dbraw/zinc/49/69/78/598496978.db2.gz RVGFOJVJQSPWDC-LLVKDONJSA-N -1 3 355.829 3.825 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)[C@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000590030803 598513282 /nfs/dbraw/zinc/51/32/82/598513282.db2.gz GLEGLUSXJXMQFQ-STQMWFEESA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)[C@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000590030803 598513284 /nfs/dbraw/zinc/51/32/84/598513284.db2.gz GLEGLUSXJXMQFQ-STQMWFEESA-N -1 3 374.231 3.916 20 0 FHADHM CCc1c(C)sc(NC(=O)Cc2cc3ccccc3o2)c1-c1nnn[n-]1 ZINC000736676973 598513838 /nfs/dbraw/zinc/51/38/38/598513838.db2.gz XKDJCBZXXGKIAW-UHFFFAOYSA-N -1 3 367.434 3.726 20 0 FHADHM CCc1c(C)sc(NC(=O)Cc2cc3ccccc3o2)c1-c1nn[n-]n1 ZINC000736676973 598513840 /nfs/dbraw/zinc/51/38/40/598513840.db2.gz XKDJCBZXXGKIAW-UHFFFAOYSA-N -1 3 367.434 3.726 20 0 FHADHM C[C@@H](OC(=O)c1csc(-c2ccoc2)n1)c1cccc(-c2nnn[n-]2)c1 ZINC000736161716 598515880 /nfs/dbraw/zinc/51/58/80/598515880.db2.gz FDOUGFNOBOQJAC-SNVBAGLBSA-N -1 3 367.390 3.501 20 0 FHADHM C[C@@H](OC(=O)c1csc(-c2ccoc2)n1)c1cccc(-c2nn[n-]n2)c1 ZINC000736161716 598515882 /nfs/dbraw/zinc/51/58/82/598515882.db2.gz FDOUGFNOBOQJAC-SNVBAGLBSA-N -1 3 367.390 3.501 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H](CC)c2ccccc2)c1-c1nnn[n-]1 ZINC000736669734 598516320 /nfs/dbraw/zinc/51/63/20/598516320.db2.gz IYPBVIWYXIHGKQ-AWEZNQCLSA-N -1 3 355.467 3.931 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H](CC)c2ccccc2)c1-c1nn[n-]n1 ZINC000736669734 598516322 /nfs/dbraw/zinc/51/63/22/598516322.db2.gz IYPBVIWYXIHGKQ-AWEZNQCLSA-N -1 3 355.467 3.931 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@@H]1NC(=O)CCc1ccc(-c2nnn[n-]2)cc1 ZINC000735796344 598519039 /nfs/dbraw/zinc/51/90/39/598519039.db2.gz AHCUOGJBEXKKFM-WMZOPIPTSA-N -1 3 355.486 3.520 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@@H]1NC(=O)CCc1ccc(-c2nn[n-]n2)cc1 ZINC000735796344 598519041 /nfs/dbraw/zinc/51/90/41/598519041.db2.gz AHCUOGJBEXKKFM-WMZOPIPTSA-N -1 3 355.486 3.520 20 0 FHADHM CC(C)CC[C@H]1CCC[C@@H]1NC(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1 ZINC000735798546 598528601 /nfs/dbraw/zinc/52/86/01/598528601.db2.gz XPYPFMIKZIXGQF-AEFFLSMTSA-N -1 3 370.501 3.613 20 0 FHADHM CC(C)CC[C@H]1CCC[C@@H]1NC(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1 ZINC000735798546 598528603 /nfs/dbraw/zinc/52/86/03/598528603.db2.gz XPYPFMIKZIXGQF-AEFFLSMTSA-N -1 3 370.501 3.613 20 0 FHADHM O=C(OCCCOc1ccc2ccccc2c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000738220482 598532098 /nfs/dbraw/zinc/53/20/98/598532098.db2.gz JDCJRWIHFXEQOV-UHFFFAOYSA-N -1 3 374.400 3.646 20 0 FHADHM O=C(OCCCOc1ccc2ccccc2c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000738220482 598532100 /nfs/dbraw/zinc/53/21/00/598532100.db2.gz JDCJRWIHFXEQOV-UHFFFAOYSA-N -1 3 374.400 3.646 20 0 FHADHM O=C(Nc1ccccc1-c1nnn[n-]1)[C@@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000738191043 598533715 /nfs/dbraw/zinc/53/37/15/598533715.db2.gz IAFYPAXPXFYZPY-ZWKOTPCHSA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1ccccc1-c1nn[n-]n1)[C@@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000738191043 598533717 /nfs/dbraw/zinc/53/37/17/598533717.db2.gz IAFYPAXPXFYZPY-ZWKOTPCHSA-N -1 3 355.401 3.762 20 0 FHADHM Cc1sc(NC(=O)c2ccc(Cl)cc2F)c(-c2nnn[n-]2)c1C ZINC000737563771 598535226 /nfs/dbraw/zinc/53/52/26/598535226.db2.gz QAIVFDYZEQQGPE-UHFFFAOYSA-N -1 3 351.794 3.590 20 0 FHADHM Cc1sc(NC(=O)c2ccc(Cl)cc2F)c(-c2nn[n-]n2)c1C ZINC000737563771 598535228 /nfs/dbraw/zinc/53/52/28/598535228.db2.gz QAIVFDYZEQQGPE-UHFFFAOYSA-N -1 3 351.794 3.590 20 0 FHADHM CCCCC(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)cc1C ZINC000736439300 598541812 /nfs/dbraw/zinc/54/18/12/598541812.db2.gz OQKRJCBEADNQCG-UHFFFAOYSA-N -1 3 365.437 3.883 20 0 FHADHM CCCCC(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)cc1C ZINC000736439300 598541813 /nfs/dbraw/zinc/54/18/13/598541813.db2.gz OQKRJCBEADNQCG-UHFFFAOYSA-N -1 3 365.437 3.883 20 0 FHADHM CC(C)CCC(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000735796423 598543007 /nfs/dbraw/zinc/54/30/07/598543007.db2.gz BUJBDEVROVYYTQ-UHFFFAOYSA-N -1 3 365.437 3.820 20 0 FHADHM CC(C)CCC(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000735796423 598543008 /nfs/dbraw/zinc/54/30/08/598543008.db2.gz BUJBDEVROVYYTQ-UHFFFAOYSA-N -1 3 365.437 3.820 20 0 FHADHM CC(=O)c1c(C)cc(C)c(COc2ccc(-c3nnn[n-]3)c(F)c2)c1C ZINC000735497571 598547320 /nfs/dbraw/zinc/54/73/20/598547320.db2.gz RKECMGZPAHPVJX-UHFFFAOYSA-N -1 3 354.385 3.713 20 0 FHADHM CC(=O)c1c(C)cc(C)c(COc2ccc(-c3nn[n-]n3)c(F)c2)c1C ZINC000735497571 598547322 /nfs/dbraw/zinc/54/73/22/598547322.db2.gz RKECMGZPAHPVJX-UHFFFAOYSA-N -1 3 354.385 3.713 20 0 FHADHM Cc1sc(NC(=O)c2ccccc2OCC(C)C)c(-c2nnn[n-]2)c1C ZINC000737565794 598551997 /nfs/dbraw/zinc/55/19/97/598551997.db2.gz XNJHWVAEMNIVKB-UHFFFAOYSA-N -1 3 371.466 3.832 20 0 FHADHM Cc1sc(NC(=O)c2ccccc2OCC(C)C)c(-c2nn[n-]n2)c1C ZINC000737565794 598551998 /nfs/dbraw/zinc/55/19/98/598551998.db2.gz XNJHWVAEMNIVKB-UHFFFAOYSA-N -1 3 371.466 3.832 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@@H](C)c1ccccc1F ZINC000736481189 598552524 /nfs/dbraw/zinc/55/25/24/598552524.db2.gz WBKBFPSTFOCIAA-AWEZNQCLSA-N -1 3 367.428 3.548 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@@H](C)c1ccccc1F ZINC000736481189 598552526 /nfs/dbraw/zinc/55/25/26/598552526.db2.gz WBKBFPSTFOCIAA-AWEZNQCLSA-N -1 3 367.428 3.548 20 0 FHADHM CCN(C(=O)[C@@H](C)c1ccccc1F)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736503227 598552628 /nfs/dbraw/zinc/55/26/28/598552628.db2.gz UEHLLJAPMUIQNU-UONOGXRCSA-N -1 3 367.428 3.719 20 0 FHADHM CCN(C(=O)[C@@H](C)c1ccccc1F)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736503227 598552631 /nfs/dbraw/zinc/55/26/31/598552631.db2.gz UEHLLJAPMUIQNU-UONOGXRCSA-N -1 3 367.428 3.719 20 0 FHADHM CC[C@@H](OC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1ccc(OC)cc1 ZINC000736379800 598584413 /nfs/dbraw/zinc/58/44/13/598584413.db2.gz DMYQKFKEPSNHNW-LVMGUKCRSA-N -1 3 364.405 3.583 20 0 FHADHM CC[C@@H](OC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1ccc(OC)cc1 ZINC000736379800 598584415 /nfs/dbraw/zinc/58/44/15/598584415.db2.gz DMYQKFKEPSNHNW-LVMGUKCRSA-N -1 3 364.405 3.583 20 0 FHADHM Cc1c2cc(F)ccc2sc1C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000737209456 598584778 /nfs/dbraw/zinc/58/47/78/598584778.db2.gz QFOMXEGFQTUTNS-UHFFFAOYSA-N -1 3 371.372 3.920 20 0 FHADHM Cc1c2cc(F)ccc2sc1C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000737209456 598584779 /nfs/dbraw/zinc/58/47/79/598584779.db2.gz QFOMXEGFQTUTNS-UHFFFAOYSA-N -1 3 371.372 3.920 20 0 FHADHM Cc1cccc(OCCCCC(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)c1 ZINC000737402235 598584978 /nfs/dbraw/zinc/58/49/78/598584978.db2.gz UJFHIBVKBFKKEB-UHFFFAOYSA-N -1 3 369.400 3.502 20 0 FHADHM Cc1cccc(OCCCCC(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)c1 ZINC000737402235 598584980 /nfs/dbraw/zinc/58/49/80/598584980.db2.gz UJFHIBVKBFKKEB-UHFFFAOYSA-N -1 3 369.400 3.502 20 0 FHADHM Cc1c2cccc(C)c2oc1C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000737209030 598585369 /nfs/dbraw/zinc/58/53/69/598585369.db2.gz ILQWESSWTHGJDM-UHFFFAOYSA-N -1 3 351.341 3.621 20 0 FHADHM Cc1c2cccc(C)c2oc1C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000737209030 598585370 /nfs/dbraw/zinc/58/53/70/598585370.db2.gz ILQWESSWTHGJDM-UHFFFAOYSA-N -1 3 351.341 3.621 20 0 FHADHM Cc1cc2occ(CC(=O)Nc3ccc(F)c(-c4nnn[n-]4)c3)c2cc1C ZINC000737286121 598590640 /nfs/dbraw/zinc/59/06/40/598590640.db2.gz ZMVJKQQQFSKIMH-UHFFFAOYSA-N -1 3 365.368 3.550 20 0 FHADHM Cc1cc2occ(CC(=O)Nc3ccc(F)c(-c4nn[n-]n4)c3)c2cc1C ZINC000737286121 598590641 /nfs/dbraw/zinc/59/06/41/598590641.db2.gz ZMVJKQQQFSKIMH-UHFFFAOYSA-N -1 3 365.368 3.550 20 0 FHADHM Fc1cc(-c2nnn[n-]2)cc(F)c1N[C@@H](c1ccccc1)c1ccccn1 ZINC000737638567 598592415 /nfs/dbraw/zinc/59/24/15/598592415.db2.gz IJZUJFADSDKYBO-KRWDZBQOSA-N -1 3 364.359 3.741 20 0 FHADHM Fc1cc(-c2nn[n-]n2)cc(F)c1N[C@@H](c1ccccc1)c1ccccn1 ZINC000737638567 598592416 /nfs/dbraw/zinc/59/24/16/598592416.db2.gz IJZUJFADSDKYBO-KRWDZBQOSA-N -1 3 364.359 3.741 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccc(Cl)cc1Cl ZINC000738168303 598592471 /nfs/dbraw/zinc/59/24/71/598592471.db2.gz YVCPRSPWCILLJA-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccc(Cl)cc1Cl ZINC000738168303 598592473 /nfs/dbraw/zinc/59/24/73/598592473.db2.gz YVCPRSPWCILLJA-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)C1(c2cccc(F)c2)CCCC1 ZINC000738164121 598592573 /nfs/dbraw/zinc/59/25/73/598592573.db2.gz YKXQVLZKCNKASS-UHFFFAOYSA-N -1 3 369.375 3.595 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)C1(c2cccc(F)c2)CCCC1 ZINC000738164121 598592576 /nfs/dbraw/zinc/59/25/76/598592576.db2.gz YKXQVLZKCNKASS-UHFFFAOYSA-N -1 3 369.375 3.595 20 0 FHADHM Cc1cc(-c2noc(CSc3ccc(-c4nnn[n-]4)cc3)n2)ccc1F ZINC000737226112 598611243 /nfs/dbraw/zinc/61/12/43/598611243.db2.gz PHJFVEXOBUVTGR-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM Cc1cc(-c2noc(CSc3ccc(-c4nn[n-]n4)cc3)n2)ccc1F ZINC000737226112 598611244 /nfs/dbraw/zinc/61/12/44/598611244.db2.gz PHJFVEXOBUVTGR-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM Cc1ccc([C@@H](C)N(C)C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)c(C)c1 ZINC000737320532 598626285 /nfs/dbraw/zinc/62/62/85/598626285.db2.gz MPQQPMOGEQFUCG-CYBMUJFWSA-N -1 3 368.416 3.848 20 0 FHADHM Cc1ccc([C@@H](C)N(C)C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)c(C)c1 ZINC000737320532 598626287 /nfs/dbraw/zinc/62/62/87/598626287.db2.gz MPQQPMOGEQFUCG-CYBMUJFWSA-N -1 3 368.416 3.848 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1N1CCC(COc2ccccc2)CC1 ZINC000737574474 598635353 /nfs/dbraw/zinc/63/53/53/598635353.db2.gz KPEHFLPVGIDTHL-UHFFFAOYSA-N -1 3 369.856 3.816 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1N1CCC(COc2ccccc2)CC1 ZINC000737574474 598635355 /nfs/dbraw/zinc/63/53/55/598635355.db2.gz KPEHFLPVGIDTHL-UHFFFAOYSA-N -1 3 369.856 3.816 20 0 FHADHM Cc1ccc(C)c(NC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)c1 ZINC000737323266 598643769 /nfs/dbraw/zinc/64/37/69/598643769.db2.gz SAQQRJCECJQYRX-UHFFFAOYSA-N -1 3 365.437 3.671 20 0 FHADHM Cc1ccc(C)c(NC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)c1 ZINC000737323266 598643771 /nfs/dbraw/zinc/64/37/71/598643771.db2.gz SAQQRJCECJQYRX-UHFFFAOYSA-N -1 3 365.437 3.671 20 0 FHADHM C[C@H](CSc1ccccc1)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736046443 598646393 /nfs/dbraw/zinc/64/63/93/598646393.db2.gz JSVYFAHXYPQGOP-LLVKDONJSA-N -1 3 373.869 3.887 20 0 FHADHM C[C@H](CSc1ccccc1)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736046443 598646394 /nfs/dbraw/zinc/64/63/94/598646394.db2.gz JSVYFAHXYPQGOP-LLVKDONJSA-N -1 3 373.869 3.887 20 0 FHADHM C[C@H]1CCCCN1C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736269362 598647497 /nfs/dbraw/zinc/64/74/97/598647497.db2.gz WHKDTEIHYVTJPG-AWEZNQCLSA-N -1 3 363.421 3.674 20 0 FHADHM C[C@H]1CCCCN1C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736269362 598647499 /nfs/dbraw/zinc/64/74/99/598647499.db2.gz WHKDTEIHYVTJPG-AWEZNQCLSA-N -1 3 363.421 3.674 20 0 FHADHM CCCCN(C(=O)CSc1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000736450669 598648542 /nfs/dbraw/zinc/64/85/42/598648542.db2.gz BQZCZGVSNYSHGI-UHFFFAOYSA-N -1 3 367.478 3.792 20 0 FHADHM CCCCN(C(=O)CSc1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000736450669 598648540 /nfs/dbraw/zinc/64/85/40/598648540.db2.gz BQZCZGVSNYSHGI-UHFFFAOYSA-N -1 3 367.478 3.792 20 0 FHADHM CC(C)(C)c1cccc(OC(=O)CSc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000735652330 598648703 /nfs/dbraw/zinc/64/87/03/598648703.db2.gz GMHNQUQHDUAQCU-UHFFFAOYSA-N -1 3 368.462 3.862 20 0 FHADHM CC(C)(C)c1cccc(OC(=O)CSc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735652330 598648705 /nfs/dbraw/zinc/64/87/05/598648705.db2.gz GMHNQUQHDUAQCU-UHFFFAOYSA-N -1 3 368.462 3.862 20 0 FHADHM CC(C)[C@H](CC(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000735711166 598651396 /nfs/dbraw/zinc/65/13/96/598651396.db2.gz WHYXAKHIEFRKEU-IBGZPJMESA-N -1 3 363.465 3.655 20 0 FHADHM CC(C)[C@H](CC(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000735711166 598651398 /nfs/dbraw/zinc/65/13/98/598651398.db2.gz WHYXAKHIEFRKEU-IBGZPJMESA-N -1 3 363.465 3.655 20 0 FHADHM CC[C@@H](C)N(C)C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736321293 598653035 /nfs/dbraw/zinc/65/30/35/598653035.db2.gz APVHUGWMENLOER-CYBMUJFWSA-N -1 3 351.410 3.530 20 0 FHADHM CC[C@@H](C)N(C)C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736321293 598653037 /nfs/dbraw/zinc/65/30/37/598653037.db2.gz APVHUGWMENLOER-CYBMUJFWSA-N -1 3 351.410 3.530 20 0 FHADHM Clc1cc(NCCCCOCCc2ccccc2)ccc1-c1nnn[n-]1 ZINC000737565649 598654922 /nfs/dbraw/zinc/65/49/22/598654922.db2.gz NRQUVDPLZHTEJH-UHFFFAOYSA-N -1 3 371.872 3.972 20 0 FHADHM Clc1cc(NCCCCOCCc2ccccc2)ccc1-c1nn[n-]n1 ZINC000737565649 598654924 /nfs/dbraw/zinc/65/49/24/598654924.db2.gz NRQUVDPLZHTEJH-UHFFFAOYSA-N -1 3 371.872 3.972 20 0 FHADHM Fc1ccc2c(c1)[C@@H](Nc1ccc(-c3nnn[n-]3)c(Cl)c1)CCCO2 ZINC000737664098 598656551 /nfs/dbraw/zinc/65/65/51/598656551.db2.gz BFQGNIZCABDRJU-HNNXBMFYSA-N -1 3 359.792 3.985 20 0 FHADHM Fc1ccc2c(c1)[C@@H](Nc1ccc(-c3nn[n-]n3)c(Cl)c1)CCCO2 ZINC000737664098 598656553 /nfs/dbraw/zinc/65/65/53/598656553.db2.gz BFQGNIZCABDRJU-HNNXBMFYSA-N -1 3 359.792 3.985 20 0 FHADHM O=C(CSc1ccc(-c2nnn[n-]2)cc1)N(CC1CC1)C1CCCCC1 ZINC000737942647 598659193 /nfs/dbraw/zinc/65/91/93/598659193.db2.gz MNHUVRMHIXEAGE-UHFFFAOYSA-N -1 3 371.510 3.530 20 0 FHADHM O=C(CSc1ccc(-c2nn[n-]n2)cc1)N(CC1CC1)C1CCCCC1 ZINC000737942647 598659195 /nfs/dbraw/zinc/65/91/95/598659195.db2.gz MNHUVRMHIXEAGE-UHFFFAOYSA-N -1 3 371.510 3.530 20 0 FHADHM CCCC[C@H](NC(=O)c1ccc(-c2nnn[n-]2)cc1)c1ccc(OC)cc1 ZINC000736436751 598661279 /nfs/dbraw/zinc/66/12/79/598661279.db2.gz GHXVASREIINTKG-SFHVURJKSA-N -1 3 365.437 3.537 20 0 FHADHM CCCC[C@H](NC(=O)c1ccc(-c2nn[n-]n2)cc1)c1ccc(OC)cc1 ZINC000736436751 598661281 /nfs/dbraw/zinc/66/12/81/598661281.db2.gz GHXVASREIINTKG-SFHVURJKSA-N -1 3 365.437 3.537 20 0 FHADHM Cc1ccc(-c2ccc(C(=O)Nc3ccc(-c4nnn[n-]4)cn3)c(F)c2)cc1 ZINC000737288336 598662530 /nfs/dbraw/zinc/66/25/30/598662530.db2.gz NLUDCVJQEFGCFY-UHFFFAOYSA-N -1 3 374.379 3.629 20 0 FHADHM Cc1ccc(-c2ccc(C(=O)Nc3ccc(-c4nn[n-]n4)cn3)c(F)c2)cc1 ZINC000737288336 598662532 /nfs/dbraw/zinc/66/25/32/598662532.db2.gz NLUDCVJQEFGCFY-UHFFFAOYSA-N -1 3 374.379 3.629 20 0 FHADHM Fc1ccc(COc2ccc(Oc3ccccn3)cc2)c(-c2nnn[n-]2)c1 ZINC000737647463 598675432 /nfs/dbraw/zinc/67/54/32/598675432.db2.gz FFVLNZGBJZAGRD-UHFFFAOYSA-N -1 3 363.352 3.772 20 0 FHADHM Fc1ccc(COc2ccc(Oc3ccccn3)cc2)c(-c2nn[n-]n2)c1 ZINC000737647463 598675433 /nfs/dbraw/zinc/67/54/33/598675433.db2.gz FFVLNZGBJZAGRD-UHFFFAOYSA-N -1 3 363.352 3.772 20 0 FHADHM COc1ccccc1Oc1ccc(CNc2ncccc2-c2nnn[n-]2)cc1 ZINC000737155324 598677039 /nfs/dbraw/zinc/67/70/39/598677039.db2.gz IGSNJJAJSSEUFC-UHFFFAOYSA-N -1 3 374.404 3.675 20 0 FHADHM COc1ccccc1Oc1ccc(CNc2ncccc2-c2nn[n-]n2)cc1 ZINC000737155324 598677041 /nfs/dbraw/zinc/67/70/41/598677041.db2.gz IGSNJJAJSSEUFC-UHFFFAOYSA-N -1 3 374.404 3.675 20 0 FHADHM Fc1ccc(COc2ccccc2OCC(F)(F)F)c(-c2nnn[n-]2)c1 ZINC000737651640 598677530 /nfs/dbraw/zinc/67/75/30/598677530.db2.gz YOBBCEGLKQPTLW-UHFFFAOYSA-N -1 3 368.290 3.526 20 0 FHADHM Fc1ccc(COc2ccccc2OCC(F)(F)F)c(-c2nn[n-]n2)c1 ZINC000737651640 598677531 /nfs/dbraw/zinc/67/75/31/598677531.db2.gz YOBBCEGLKQPTLW-UHFFFAOYSA-N -1 3 368.290 3.526 20 0 FHADHM Fc1ccc(CSCc2cc(-c3ccco3)on2)c(-c2nnn[n-]2)c1 ZINC000737650468 598696691 /nfs/dbraw/zinc/69/66/91/598696691.db2.gz RLVIFQOIJBWBOV-UHFFFAOYSA-N -1 3 357.370 3.687 20 0 FHADHM Fc1ccc(CSCc2cc(-c3ccco3)on2)c(-c2nn[n-]n2)c1 ZINC000737650468 598696693 /nfs/dbraw/zinc/69/66/93/598696693.db2.gz RLVIFQOIJBWBOV-UHFFFAOYSA-N -1 3 357.370 3.687 20 0 FHADHM Cc1ccccc1NC(=O)[C@@H](C)SCc1ccc(F)cc1-c1nnn[n-]1 ZINC000737436313 598696717 /nfs/dbraw/zinc/69/67/17/598696717.db2.gz RNNXESGRYAJUKV-GFCCVEGCSA-N -1 3 371.441 3.575 20 0 FHADHM Cc1ccccc1NC(=O)[C@@H](C)SCc1ccc(F)cc1-c1nn[n-]n1 ZINC000737436313 598696720 /nfs/dbraw/zinc/69/67/20/598696720.db2.gz RNNXESGRYAJUKV-GFCCVEGCSA-N -1 3 371.441 3.575 20 0 FHADHM CC(C)(Cc1ccccc1Cl)NC(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000735670893 598697596 /nfs/dbraw/zinc/69/75/96/598697596.db2.gz GVVMGWXIPWTVNI-UHFFFAOYSA-N -1 3 370.844 3.663 20 0 FHADHM CC(C)(Cc1ccccc1Cl)NC(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000735670893 598697597 /nfs/dbraw/zinc/69/75/97/598697597.db2.gz GVVMGWXIPWTVNI-UHFFFAOYSA-N -1 3 370.844 3.663 20 0 FHADHM CCCCc1nc(Cn2ccc(-c3ccc(-c4nnn[n-]4)cc3)n2)cs1 ZINC000736467044 598722504 /nfs/dbraw/zinc/72/25/04/598722504.db2.gz RKMGMDLZXAYMLZ-UHFFFAOYSA-N -1 3 365.466 3.578 20 0 FHADHM CCCCc1nc(Cn2ccc(-c3ccc(-c4nn[n-]n4)cc3)n2)cs1 ZINC000736467044 598722506 /nfs/dbraw/zinc/72/25/06/598722506.db2.gz RKMGMDLZXAYMLZ-UHFFFAOYSA-N -1 3 365.466 3.578 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)CCc1ccccc1C ZINC000736479432 598736396 /nfs/dbraw/zinc/73/63/96/598736396.db2.gz KEYFVXJGSDHRLF-UHFFFAOYSA-N -1 3 363.465 3.547 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)CCc1ccccc1C ZINC000736479432 598736398 /nfs/dbraw/zinc/73/63/98/598736398.db2.gz KEYFVXJGSDHRLF-UHFFFAOYSA-N -1 3 363.465 3.547 20 0 FHADHM CC[C@H](Cc1ccccc1)C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2 ZINC000736353750 598762905 /nfs/dbraw/zinc/76/29/05/598762905.db2.gz XSTXSZSVTICJJY-CYBMUJFWSA-N -1 3 367.478 3.624 20 0 FHADHM CC[C@H](Cc1ccccc1)C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2 ZINC000736353750 598762907 /nfs/dbraw/zinc/76/29/07/598762907.db2.gz XSTXSZSVTICJJY-CYBMUJFWSA-N -1 3 367.478 3.624 20 0 FHADHM Fc1cc(F)c2ncc(-c3nnn[n-]3)c(N[C@@H]3CCc4ccccc43)c2c1 ZINC000737645248 598770871 /nfs/dbraw/zinc/77/08/71/598770871.db2.gz UITDNFFMWAIZKB-MRXNPFEDSA-N -1 3 364.359 3.793 20 0 FHADHM Fc1cc(F)c2ncc(-c3nn[n-]n3)c(N[C@@H]3CCc4ccccc43)c2c1 ZINC000737645248 598770872 /nfs/dbraw/zinc/77/08/72/598770872.db2.gz UITDNFFMWAIZKB-MRXNPFEDSA-N -1 3 364.359 3.793 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N(Cc1ccc(F)cc1)C(C)C ZINC000737293051 598782658 /nfs/dbraw/zinc/78/26/58/598782658.db2.gz YZZGNGCJTAOUPL-UHFFFAOYSA-N -1 3 368.416 3.757 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N(Cc1ccc(F)cc1)C(C)C ZINC000737293051 598782659 /nfs/dbraw/zinc/78/26/59/598782659.db2.gz YZZGNGCJTAOUPL-UHFFFAOYSA-N -1 3 368.416 3.757 20 0 FHADHM CC[C@H](C)NC(=S)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736327323 598789062 /nfs/dbraw/zinc/78/90/62/598789062.db2.gz QUWYMSRHAORKIC-LBPRGKRZSA-N -1 3 368.466 3.744 20 0 FHADHM CC[C@H](C)NC(=S)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736327323 598789063 /nfs/dbraw/zinc/78/90/63/598789063.db2.gz QUWYMSRHAORKIC-LBPRGKRZSA-N -1 3 368.466 3.744 20 0 FHADHM CC(C)[C@H](c1ccccc1)N(C)C(=O)C=Cc1ccccc1-c1nnn[n-]1 ZINC000735736380 598791044 /nfs/dbraw/zinc/79/10/44/598791044.db2.gz UBCGIWIUHCNZTL-FBRRREGBSA-N -1 3 361.449 3.736 20 0 FHADHM CC(C)[C@H](c1ccccc1)N(C)C(=O)C=Cc1ccccc1-c1nn[n-]n1 ZINC000735736380 598791045 /nfs/dbraw/zinc/79/10/45/598791045.db2.gz UBCGIWIUHCNZTL-FBRRREGBSA-N -1 3 361.449 3.736 20 0 FHADHM Fc1ccc(CN(Cc2ccccc2)c2ncccc2-c2nnn[n-]2)cc1 ZINC000737649394 598817328 /nfs/dbraw/zinc/81/73/28/598817328.db2.gz LYTXHMGXOCKITC-UHFFFAOYSA-N -1 3 360.396 3.608 20 0 FHADHM Fc1ccc(CN(Cc2ccccc2)c2ncccc2-c2nn[n-]n2)cc1 ZINC000737649394 598817329 /nfs/dbraw/zinc/81/73/29/598817329.db2.gz LYTXHMGXOCKITC-UHFFFAOYSA-N -1 3 360.396 3.608 20 0 FHADHM O=C(C=Cc1ccco1)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737805334 598821833 /nfs/dbraw/zinc/82/18/33/598821833.db2.gz HJBDUSYGZFPMAT-ZHACJKMWSA-N -1 3 373.372 3.904 20 0 FHADHM O=C(C=Cc1ccco1)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737805334 598821834 /nfs/dbraw/zinc/82/18/34/598821834.db2.gz HJBDUSYGZFPMAT-ZHACJKMWSA-N -1 3 373.372 3.904 20 0 FHADHM CCCc1nc(CSCc2cc(-c3nnn[n-]3)ccc2OC)cs1 ZINC000821143682 607367618 /nfs/dbraw/zinc/36/76/18/607367618.db2.gz WDCOFOJVKYNOPZ-UHFFFAOYSA-N -1 3 361.496 3.718 20 0 FHADHM CCCc1nc(CSCc2cc(-c3nn[n-]n3)ccc2OC)cs1 ZINC000821143682 607367619 /nfs/dbraw/zinc/36/76/19/607367619.db2.gz WDCOFOJVKYNOPZ-UHFFFAOYSA-N -1 3 361.496 3.718 20 0 FHADHM C[C@@H](NC(=O)Nc1ncc(C(C)(C)C)s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820379538 599296571 /nfs/dbraw/zinc/29/65/71/599296571.db2.gz CPZHUYRWBHAOCG-SNVBAGLBSA-N -1 3 371.470 3.503 20 0 FHADHM CN(Cc1nc2ccccc2s1)c1cccc(Cl)c1-c1nnn[n-]1 ZINC000821618209 599308813 /nfs/dbraw/zinc/30/88/13/599308813.db2.gz VQVYBHNYGGLVTP-UHFFFAOYSA-N -1 3 356.842 3.766 20 0 FHADHM CN(Cc1nc2ccccc2s1)c1cccc(Cl)c1-c1nn[n-]n1 ZINC000821618209 599308816 /nfs/dbraw/zinc/30/88/16/599308816.db2.gz VQVYBHNYGGLVTP-UHFFFAOYSA-N -1 3 356.842 3.766 20 0 FHADHM CCCCc1ccc(CC(=O)N(CC)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000736467032 599309079 /nfs/dbraw/zinc/30/90/79/599309079.db2.gz QZTGVRFGZMSRGV-UHFFFAOYSA-N -1 3 363.465 3.805 20 0 FHADHM CCCCc1ccc(CC(=O)N(CC)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000736467032 599309082 /nfs/dbraw/zinc/30/90/82/599309082.db2.gz QZTGVRFGZMSRGV-UHFFFAOYSA-N -1 3 363.465 3.805 20 0 FHADHM CC(=O)c1cc(F)ccc1NCCSCc1ccccc1-c1nnn[n-]1 ZINC000819835287 599310673 /nfs/dbraw/zinc/31/06/73/599310673.db2.gz VAQYRIRYNJIXCZ-UHFFFAOYSA-N -1 3 371.441 3.554 20 0 FHADHM CC(=O)c1cc(F)ccc1NCCSCc1ccccc1-c1nn[n-]n1 ZINC000819835287 599310676 /nfs/dbraw/zinc/31/06/76/599310676.db2.gz VAQYRIRYNJIXCZ-UHFFFAOYSA-N -1 3 371.441 3.554 20 0 FHADHM CCN(C(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736501300 599311245 /nfs/dbraw/zinc/31/12/45/599311245.db2.gz CIDYTXCACBKMGU-OLZOCXBDSA-N -1 3 367.375 3.588 20 0 FHADHM CCN(C(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736501300 599311248 /nfs/dbraw/zinc/31/12/48/599311248.db2.gz CIDYTXCACBKMGU-OLZOCXBDSA-N -1 3 367.375 3.588 20 0 FHADHM CCN(C(=O)CCc1ccc(C(C)C)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736505634 599311573 /nfs/dbraw/zinc/31/15/73/599311573.db2.gz PPRRMRVMHZQDMY-UHFFFAOYSA-N -1 3 363.465 3.976 20 0 FHADHM CCN(C(=O)CCc1ccc(C(C)C)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736505634 599311575 /nfs/dbraw/zinc/31/15/75/599311575.db2.gz PPRRMRVMHZQDMY-UHFFFAOYSA-N -1 3 363.465 3.976 20 0 FHADHM C[C@@H](SCc1cccc(C(=O)N(C)C)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736193761 599326295 /nfs/dbraw/zinc/32/62/95/599326295.db2.gz SLOAKDZGKHCWEZ-CYBMUJFWSA-N -1 3 367.478 3.563 20 0 FHADHM C[C@@H](SCc1cccc(C(=O)N(C)C)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736193761 599326293 /nfs/dbraw/zinc/32/62/93/599326293.db2.gz SLOAKDZGKHCWEZ-CYBMUJFWSA-N -1 3 367.478 3.563 20 0 FHADHM COc1ccc(OC(C)C)c(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737109452 599326751 /nfs/dbraw/zinc/32/67/51/599326751.db2.gz RCVGDWRQPNCOMD-ZDUSSCGKSA-N -1 3 353.426 3.836 20 0 FHADHM COc1ccc(OC(C)C)c(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737109452 599326752 /nfs/dbraw/zinc/32/67/52/599326752.db2.gz RCVGDWRQPNCOMD-ZDUSSCGKSA-N -1 3 353.426 3.836 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NCc1csc(-c2ccc(C)o2)n1 ZINC000737061594 599328446 /nfs/dbraw/zinc/32/84/46/599328446.db2.gz BFHMPDWLPXVPTI-UHFFFAOYSA-N -1 3 368.422 3.512 20 0 FHADHM C[C@@H](S[C@H](C)c1ccc(-c2nnn[n-]2)cc1)C(=O)NC1CCC(C)CC1 ZINC000736243693 599328463 /nfs/dbraw/zinc/32/84/63/599328463.db2.gz YHMVRTKBMOZGST-YXXKGXSTSA-N -1 3 373.526 3.744 20 0 FHADHM C[C@@H](S[C@H](C)c1ccc(-c2nn[n-]n2)cc1)C(=O)NC1CCC(C)CC1 ZINC000736243693 599328465 /nfs/dbraw/zinc/32/84/65/599328465.db2.gz YHMVRTKBMOZGST-YXXKGXSTSA-N -1 3 373.526 3.744 20 0 FHADHM Cc1ccccc1NC(=O)[C@@H](C)S[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000737433729 599329247 /nfs/dbraw/zinc/32/92/47/599329247.db2.gz BSEWRRKWFWQQMJ-UONOGXRCSA-N -1 3 367.478 3.997 20 0 FHADHM Cc1ccccc1NC(=O)[C@@H](C)S[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000737433729 599329249 /nfs/dbraw/zinc/32/92/49/599329249.db2.gz BSEWRRKWFWQQMJ-UONOGXRCSA-N -1 3 367.478 3.997 20 0 FHADHM Cc1cc(C)cc(NC(=O)CS[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737250847 599329502 /nfs/dbraw/zinc/32/95/02/599329502.db2.gz PRPVNJJGAOCUMW-CQSZACIVSA-N -1 3 367.478 3.916 20 0 FHADHM Cc1cc(C)cc(NC(=O)CS[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737250847 599329503 /nfs/dbraw/zinc/32/95/03/599329503.db2.gz PRPVNJJGAOCUMW-CQSZACIVSA-N -1 3 367.478 3.916 20 0 FHADHM Fc1ccc(C(F)(F)F)cc1NCCOc1cccc(-c2nnn[n-]2)c1 ZINC000737647200 599331424 /nfs/dbraw/zinc/33/14/24/599331424.db2.gz CMRUDOZCUJTKLQ-UHFFFAOYSA-N -1 3 367.306 3.516 20 0 FHADHM Fc1ccc(C(F)(F)F)cc1NCCOc1cccc(-c2nn[n-]n2)c1 ZINC000737647200 599331427 /nfs/dbraw/zinc/33/14/27/599331427.db2.gz CMRUDOZCUJTKLQ-UHFFFAOYSA-N -1 3 367.306 3.516 20 0 FHADHM Cc1ccc(NC(=O)CS[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1F ZINC000737356938 599333885 /nfs/dbraw/zinc/33/38/85/599333885.db2.gz KGEFJSOREYFWSR-GFCCVEGCSA-N -1 3 371.441 3.747 20 0 FHADHM Cc1ccc(NC(=O)CS[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1F ZINC000737356938 599333888 /nfs/dbraw/zinc/33/38/88/599333888.db2.gz KGEFJSOREYFWSR-GFCCVEGCSA-N -1 3 371.441 3.747 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1CSCc1ccn(C2CCCC2)n1 ZINC000821752649 607369868 /nfs/dbraw/zinc/36/98/68/607369868.db2.gz PFEVYYIEURBCMV-UHFFFAOYSA-N -1 3 370.482 3.620 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CSCc1ccn(C2CCCC2)n1 ZINC000821752649 607369870 /nfs/dbraw/zinc/36/98/70/607369870.db2.gz PFEVYYIEURBCMV-UHFFFAOYSA-N -1 3 370.482 3.620 20 0 FHADHM CC(C)[C@H](Sc1ccccc1-c1nnn[n-]1)C(=O)NC1CCCCCC1 ZINC000820032606 599341600 /nfs/dbraw/zinc/34/16/00/599341600.db2.gz OJVWEFPMLURHQU-KRWDZBQOSA-N -1 3 373.526 3.822 20 0 FHADHM CC(C)[C@H](Sc1ccccc1-c1nn[n-]n1)C(=O)NC1CCCCCC1 ZINC000820032606 599341603 /nfs/dbraw/zinc/34/16/03/599341603.db2.gz OJVWEFPMLURHQU-KRWDZBQOSA-N -1 3 373.526 3.822 20 0 FHADHM Cc1ccc(NC(=O)[C@H](C)Sc2ccccc2-c2nnn[n-]2)cc1C ZINC000822242620 599342582 /nfs/dbraw/zinc/34/25/82/599342582.db2.gz RMHBZYIAJWVUGM-ZDUSSCGKSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1ccc(NC(=O)[C@H](C)Sc2ccccc2-c2nn[n-]n2)cc1C ZINC000822242620 599342584 /nfs/dbraw/zinc/34/25/84/599342584.db2.gz RMHBZYIAJWVUGM-ZDUSSCGKSA-N -1 3 353.451 3.603 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1CNc1cc(C(F)(F)F)ccc1F ZINC000821731703 607370528 /nfs/dbraw/zinc/37/05/28/607370528.db2.gz FEAPKIGMTXOERW-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CNc1cc(C(F)(F)F)ccc1F ZINC000821731703 607370530 /nfs/dbraw/zinc/37/05/30/607370530.db2.gz FEAPKIGMTXOERW-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1CNc1cc(Cl)ccc1SC ZINC000821731422 607370689 /nfs/dbraw/zinc/37/06/89/607370689.db2.gz CRUJVUCSQLUWLA-UHFFFAOYSA-N -1 3 361.858 3.863 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CNc1cc(Cl)ccc1SC ZINC000821731422 607370692 /nfs/dbraw/zinc/37/06/92/607370692.db2.gz CRUJVUCSQLUWLA-UHFFFAOYSA-N -1 3 361.858 3.863 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1CNc1cccc(Cl)c1OC(C)C ZINC000821736097 607371401 /nfs/dbraw/zinc/37/14/01/607371401.db2.gz AXTUVCPOGIJNGX-UHFFFAOYSA-N -1 3 373.844 3.928 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CNc1cccc(Cl)c1OC(C)C ZINC000821736097 607371403 /nfs/dbraw/zinc/37/14/03/607371403.db2.gz AXTUVCPOGIJNGX-UHFFFAOYSA-N -1 3 373.844 3.928 20 0 FHADHM C[C@H](CC(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCCC2)n1cccc1 ZINC000735978426 599369251 /nfs/dbraw/zinc/36/92/51/599369251.db2.gz WFRZJVGNYCWPIW-GFCCVEGCSA-N -1 3 370.482 3.588 20 0 FHADHM C[C@H](CC(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCCC2)n1cccc1 ZINC000735978426 599369252 /nfs/dbraw/zinc/36/92/52/599369252.db2.gz WFRZJVGNYCWPIW-GFCCVEGCSA-N -1 3 370.482 3.588 20 0 FHADHM CSCCCC(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCCCC2 ZINC000737181233 599372774 /nfs/dbraw/zinc/37/27/74/599372774.db2.gz LXHYLEMOBZMFLP-UHFFFAOYSA-N -1 3 365.528 3.669 20 0 FHADHM CSCCCC(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCCCC2 ZINC000737181233 599372775 /nfs/dbraw/zinc/37/27/75/599372775.db2.gz LXHYLEMOBZMFLP-UHFFFAOYSA-N -1 3 365.528 3.669 20 0 FHADHM Cc1cccc([C@H](C)OC(=O)CSCc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737391330 599376766 /nfs/dbraw/zinc/37/67/66/599376766.db2.gz ZXKQSVYUEWZERW-AWEZNQCLSA-N -1 3 368.462 3.713 20 0 FHADHM Cc1cccc([C@H](C)OC(=O)CSCc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737391330 599376768 /nfs/dbraw/zinc/37/67/68/599376768.db2.gz ZXKQSVYUEWZERW-AWEZNQCLSA-N -1 3 368.462 3.713 20 0 FHADHM C[C@H](NCc1cc(-c2nnn[n-]2)ccc1F)c1ncc(-c2ccccc2)o1 ZINC000820427006 599384592 /nfs/dbraw/zinc/38/45/92/599384592.db2.gz OPAMHIBWQRDKFO-LBPRGKRZSA-N -1 3 364.384 3.512 20 0 FHADHM C[C@H](NCc1cc(-c2nn[n-]n2)ccc1F)c1ncc(-c2ccccc2)o1 ZINC000820427006 599384595 /nfs/dbraw/zinc/38/45/95/599384595.db2.gz OPAMHIBWQRDKFO-LBPRGKRZSA-N -1 3 364.384 3.512 20 0 FHADHM CCO[C@H](C)c1nc(COc2c(C)cc(-c3nn[n-]n3)cc2C)cs1 ZINC000821346643 599388596 /nfs/dbraw/zinc/38/85/96/599388596.db2.gz NJSAXKGRIPOIMK-GFCCVEGCSA-N -1 3 359.455 3.617 20 0 FHADHM CCO[C@@H](C)c1nc(COc2c(C)cc(-c3nn[n-]n3)cc2C)cs1 ZINC000821346654 599388833 /nfs/dbraw/zinc/38/88/33/599388833.db2.gz NJSAXKGRIPOIMK-LBPRGKRZSA-N -1 3 359.455 3.617 20 0 FHADHM Clc1ccc(OCCNc2cc(-c3nnn[n-]3)c3ccccc3n2)cc1 ZINC000737573585 599397762 /nfs/dbraw/zinc/39/77/62/599397762.db2.gz NIVAGLMRCXGCNB-UHFFFAOYSA-N -1 3 366.812 3.559 20 0 FHADHM Clc1ccc(OCCNc2cc(-c3nn[n-]n3)c3ccccc3n2)cc1 ZINC000737573585 599397767 /nfs/dbraw/zinc/39/77/67/599397767.db2.gz NIVAGLMRCXGCNB-UHFFFAOYSA-N -1 3 366.812 3.559 20 0 FHADHM CCCn1ccc2ccc(NC(=O)c3sccc3-c3nnn[n-]3)cc21 ZINC000821149563 599412188 /nfs/dbraw/zinc/41/21/88/599412188.db2.gz ZZYXGVGRSHZPIX-UHFFFAOYSA-N -1 3 352.423 3.545 20 0 FHADHM CCCn1ccc2ccc(NC(=O)c3sccc3-c3nn[n-]n3)cc21 ZINC000821149563 599412189 /nfs/dbraw/zinc/41/21/89/599412189.db2.gz ZZYXGVGRSHZPIX-UHFFFAOYSA-N -1 3 352.423 3.545 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(NCc2ccc(OC3CCCC3)nc2)c1 ZINC000737571261 599412772 /nfs/dbraw/zinc/41/27/72/599412772.db2.gz YTIJKRVDTDJBIW-UHFFFAOYSA-N -1 3 370.844 3.849 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(NCc2ccc(OC3CCCC3)nc2)c1 ZINC000737571261 599412775 /nfs/dbraw/zinc/41/27/75/599412775.db2.gz YTIJKRVDTDJBIW-UHFFFAOYSA-N -1 3 370.844 3.849 20 0 FHADHM COc1ccc(CC[C@@H](C)Nc2cc(-c3nnn[n-]3)c3ccccc3n2)cc1 ZINC000737085745 599418930 /nfs/dbraw/zinc/41/89/30/599418930.db2.gz AEYVWXQDYQBGFY-CQSZACIVSA-N -1 3 374.448 3.857 20 0 FHADHM COc1ccc(CC[C@@H](C)Nc2cc(-c3nn[n-]n3)c3ccccc3n2)cc1 ZINC000737085745 599418932 /nfs/dbraw/zinc/41/89/32/599418932.db2.gz AEYVWXQDYQBGFY-CQSZACIVSA-N -1 3 374.448 3.857 20 0 FHADHM COc1ccc(CCCNc2cc(Cl)ccc2-c2nnn[n-]2)cc1OC ZINC000737088690 599419080 /nfs/dbraw/zinc/41/90/80/599419080.db2.gz NZJSJBGFQBIQLH-UHFFFAOYSA-N -1 3 373.844 3.582 20 0 FHADHM COc1ccc(CCCNc2cc(Cl)ccc2-c2nn[n-]n2)cc1OC ZINC000737088690 599419082 /nfs/dbraw/zinc/41/90/82/599419082.db2.gz NZJSJBGFQBIQLH-UHFFFAOYSA-N -1 3 373.844 3.582 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(NCCCCOCc2ccccc2)c1 ZINC000737570397 599423244 /nfs/dbraw/zinc/42/32/44/599423244.db2.gz GSNVKUQDHCLLKH-UHFFFAOYSA-N -1 3 357.845 3.929 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(NCCCCOCc2ccccc2)c1 ZINC000737570397 599423245 /nfs/dbraw/zinc/42/32/45/599423245.db2.gz GSNVKUQDHCLLKH-UHFFFAOYSA-N -1 3 357.845 3.929 20 0 FHADHM CC[C@@H](NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)C1CCCCC1 ZINC000820919767 599431163 /nfs/dbraw/zinc/43/11/63/599431163.db2.gz GLPJEOWXBKFSQQ-CXAGYDPISA-N -1 3 356.474 3.586 20 0 FHADHM CC[C@@H](NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)C1CCCCC1 ZINC000820919767 599431166 /nfs/dbraw/zinc/43/11/66/599431166.db2.gz GLPJEOWXBKFSQQ-CXAGYDPISA-N -1 3 356.474 3.586 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H](C)C[C@@H](C)CC ZINC000821104427 599458728 /nfs/dbraw/zinc/45/87/28/599458728.db2.gz CQCZUTCLHFDVPZ-GJZGRUSLSA-N -1 3 358.490 3.613 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H](C)C[C@@H](C)CC ZINC000821104427 599458729 /nfs/dbraw/zinc/45/87/29/599458729.db2.gz CQCZUTCLHFDVPZ-GJZGRUSLSA-N -1 3 358.490 3.613 20 0 FHADHM CN(Cc1ccccc1C(F)(F)F)c1ccc(F)cc1-c1nnn[n-]1 ZINC000821614421 599468753 /nfs/dbraw/zinc/46/87/53/599468753.db2.gz FOLVWDGJJNJWOD-UHFFFAOYSA-N -1 3 351.307 3.661 20 0 FHADHM CN(Cc1ccccc1C(F)(F)F)c1ccc(F)cc1-c1nn[n-]n1 ZINC000821614421 599468757 /nfs/dbraw/zinc/46/87/57/599468757.db2.gz FOLVWDGJJNJWOD-UHFFFAOYSA-N -1 3 351.307 3.661 20 0 FHADHM C[C@@H](Nc1ccc(F)cc1-c1nnn[n-]1)c1cccc(Br)c1 ZINC000820455452 599468916 /nfs/dbraw/zinc/46/89/16/599468916.db2.gz IQAIYOIBRYTYOH-SECBINFHSA-N -1 3 362.206 3.941 20 0 FHADHM C[C@@H](Nc1ccc(F)cc1-c1nn[n-]n1)c1cccc(Br)c1 ZINC000820455452 599468919 /nfs/dbraw/zinc/46/89/19/599468919.db2.gz IQAIYOIBRYTYOH-SECBINFHSA-N -1 3 362.206 3.941 20 0 FHADHM C[C@H](NC(=O)N(C)CCC1CCCCC1)c1cccc(-c2nnn[n-]2)c1 ZINC000820339492 599470183 /nfs/dbraw/zinc/47/01/83/599470183.db2.gz CYRZLAHMUVMOEV-AWEZNQCLSA-N -1 3 356.474 3.540 20 0 FHADHM C[C@H](NC(=O)N(C)CCC1CCCCC1)c1cccc(-c2nn[n-]n2)c1 ZINC000820339492 599470186 /nfs/dbraw/zinc/47/01/86/599470186.db2.gz CYRZLAHMUVMOEV-AWEZNQCLSA-N -1 3 356.474 3.540 20 0 FHADHM C[C@H]1C[C@H](c2ccc(F)cc2)CN1c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000736234386 599472354 /nfs/dbraw/zinc/47/23/54/599472354.db2.gz IVEVVFSGAVOIEV-GWCFXTLKSA-N -1 3 359.355 3.666 20 0 FHADHM C[C@H]1C[C@H](c2ccc(F)cc2)CN1c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000736234386 599472356 /nfs/dbraw/zinc/47/23/56/599472356.db2.gz IVEVVFSGAVOIEV-GWCFXTLKSA-N -1 3 359.355 3.666 20 0 FHADHM C[C@H]1C[C@@H](c2ccc(F)cc2)CN1c1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000736238727 599474448 /nfs/dbraw/zinc/47/44/48/599474448.db2.gz ZSPHGNHRUOGTES-DZGCQCFKSA-N -1 3 374.423 3.936 20 0 FHADHM C[C@H]1C[C@@H](c2ccc(F)cc2)CN1c1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000736238727 599474450 /nfs/dbraw/zinc/47/44/50/599474450.db2.gz ZSPHGNHRUOGTES-DZGCQCFKSA-N -1 3 374.423 3.936 20 0 FHADHM CCO[C@H](C)c1nc(CN(C)[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cs1 ZINC000736616639 599475007 /nfs/dbraw/zinc/47/50/07/599475007.db2.gz OPKNQQNUHFTWGV-QWHCGFSZSA-N -1 3 372.498 3.614 20 0 FHADHM CCO[C@H](C)c1nc(CN(C)[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cs1 ZINC000736616639 599475009 /nfs/dbraw/zinc/47/50/09/599475009.db2.gz OPKNQQNUHFTWGV-QWHCGFSZSA-N -1 3 372.498 3.614 20 0 FHADHM Cc1ccccc1[C@@H](C)N(C)C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000822345457 599479814 /nfs/dbraw/zinc/47/98/14/599479814.db2.gz JQEMGKMUXAHNEC-HUUCEWRRSA-N -1 3 364.453 3.639 20 0 FHADHM Cc1ccccc1[C@@H](C)N(C)C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000822345457 599479818 /nfs/dbraw/zinc/47/98/18/599479818.db2.gz JQEMGKMUXAHNEC-HUUCEWRRSA-N -1 3 364.453 3.639 20 0 FHADHM C[C@H](Cc1ccc(Cl)cc1)N(C)C(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000736056201 599492497 /nfs/dbraw/zinc/49/24/97/599492497.db2.gz LAQRXNOKLCGGAU-GFCCVEGCSA-N -1 3 370.844 3.615 20 0 FHADHM C[C@H](Cc1ccc(Cl)cc1)N(C)C(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000736056201 599492498 /nfs/dbraw/zinc/49/24/98/599492498.db2.gz LAQRXNOKLCGGAU-GFCCVEGCSA-N -1 3 370.844 3.615 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)N1CCCCC[C@H]1c1ccco1 ZINC000738161570 599502278 /nfs/dbraw/zinc/50/22/78/599502278.db2.gz FTUXEMKEQXIIKT-HNNXBMFYSA-N -1 3 370.388 3.748 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)N1CCCCC[C@H]1c1ccco1 ZINC000738161570 599502281 /nfs/dbraw/zinc/50/22/81/599502281.db2.gz FTUXEMKEQXIIKT-HNNXBMFYSA-N -1 3 370.388 3.748 20 0 FHADHM Cc1ccc(N[C@@H](C)C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1C ZINC000737360547 599504519 /nfs/dbraw/zinc/50/45/19/599504519.db2.gz QFDGXMDXIPKSJE-LBPRGKRZSA-N -1 3 370.844 3.576 20 0 FHADHM Cc1ccc(N[C@@H](C)C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1C ZINC000737360547 599504521 /nfs/dbraw/zinc/50/45/21/599504521.db2.gz QFDGXMDXIPKSJE-LBPRGKRZSA-N -1 3 370.844 3.576 20 0 FHADHM FC(F)(F)c1cc(-c2nn[n-]n2)ccc1NC[C@@H]1CCc2ccccc2N1 ZINC000822718201 599524675 /nfs/dbraw/zinc/52/46/75/599524675.db2.gz CBZQTZHGPHMNOT-ZDUSSCGKSA-N -1 3 374.370 3.724 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CC[C@@H](C)C2)c1cccs1 ZINC000736280333 599539453 /nfs/dbraw/zinc/53/94/53/599539453.db2.gz QFDQNMKNXQTZLQ-ZJUUUORDSA-N -1 3 373.507 3.857 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CC[C@@H](C)C2)c1cccs1 ZINC000736280333 599539455 /nfs/dbraw/zinc/53/94/55/599539455.db2.gz QFDQNMKNXQTZLQ-ZJUUUORDSA-N -1 3 373.507 3.857 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@H](C)c1cccs1 ZINC000735829742 599541449 /nfs/dbraw/zinc/54/14/49/599541449.db2.gz NJTQZXRLGHCQIP-CQSZACIVSA-N -1 3 369.494 3.717 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@H](C)c1cccs1 ZINC000735829742 599541451 /nfs/dbraw/zinc/54/14/51/599541451.db2.gz NJTQZXRLGHCQIP-CQSZACIVSA-N -1 3 369.494 3.717 20 0 FHADHM CC[C@H](CC(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1)c1ccc(C)cc1 ZINC000736331420 599542245 /nfs/dbraw/zinc/54/22/45/599542245.db2.gz JSTZUNAHVUHPHM-QGZVFWFLSA-N -1 3 363.465 3.717 20 0 FHADHM CC[C@H](CC(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1)c1ccc(C)cc1 ZINC000736331420 599542247 /nfs/dbraw/zinc/54/22/47/599542247.db2.gz JSTZUNAHVUHPHM-QGZVFWFLSA-N -1 3 363.465 3.717 20 0 FHADHM CC[C@@H](Sc1ccccc1)C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820939848 599542728 /nfs/dbraw/zinc/54/27/28/599542728.db2.gz ZFOFUCBIGZSURS-CXAGYDPISA-N -1 3 367.478 3.615 20 0 FHADHM CC[C@@H](Sc1ccccc1)C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820939848 599542730 /nfs/dbraw/zinc/54/27/30/599542730.db2.gz ZFOFUCBIGZSURS-CXAGYDPISA-N -1 3 367.478 3.615 20 0 FHADHM CC1CCC(OC2CCN(c3ccc(F)cc3-c3nnn[n-]3)CC2)CC1 ZINC000820690016 599543811 /nfs/dbraw/zinc/54/38/11/599543811.db2.gz FJKWOBWWBMPCSD-UHFFFAOYSA-N -1 3 359.449 3.570 20 0 FHADHM CC1CCC(OC2CCN(c3ccc(F)cc3-c3nn[n-]n3)CC2)CC1 ZINC000820690016 599543813 /nfs/dbraw/zinc/54/38/13/599543813.db2.gz FJKWOBWWBMPCSD-UHFFFAOYSA-N -1 3 359.449 3.570 20 0 FHADHM CC[C@H](CC(=O)Nc1cc(-c2nnn[n-]2)ccc1OC)c1ccc(C)cc1 ZINC000736334100 599543947 /nfs/dbraw/zinc/54/39/47/599543947.db2.gz SMSJGGQSPQYVMK-CQSZACIVSA-N -1 3 365.437 3.706 20 0 FHADHM CC[C@H](CC(=O)Nc1cc(-c2nn[n-]n2)ccc1OC)c1ccc(C)cc1 ZINC000736334100 599543949 /nfs/dbraw/zinc/54/39/49/599543949.db2.gz SMSJGGQSPQYVMK-CQSZACIVSA-N -1 3 365.437 3.706 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)CC/C=C\c1ccccc1 ZINC000735661973 599543987 /nfs/dbraw/zinc/54/39/87/599543987.db2.gz ZAFBMTJSABDYAA-XFFZJAGNSA-N -1 3 364.453 3.855 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)CC/C=C\c1ccccc1 ZINC000735661973 599543989 /nfs/dbraw/zinc/54/39/89/599543989.db2.gz ZAFBMTJSABDYAA-XFFZJAGNSA-N -1 3 364.453 3.855 20 0 FHADHM CC(C)c1ccc([C@@H](C)CC(=O)Nc2ccc(-c3nnn[n-]3)cn2)cc1 ZINC000735923044 599544111 /nfs/dbraw/zinc/54/41/11/599544111.db2.gz JBEAMQVMNQAYFG-ZDUSSCGKSA-N -1 3 350.426 3.517 20 0 FHADHM CC(C)c1ccc([C@@H](C)CC(=O)Nc2ccc(-c3nn[n-]n3)cn2)cc1 ZINC000735923044 599544113 /nfs/dbraw/zinc/54/41/13/599544113.db2.gz JBEAMQVMNQAYFG-ZDUSSCGKSA-N -1 3 350.426 3.517 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)C1(c2cccs2)CCCCC1 ZINC000738162008 599545723 /nfs/dbraw/zinc/54/57/23/599545723.db2.gz IHHGNTKCFNOIQR-UHFFFAOYSA-N -1 3 371.441 3.908 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)C1(c2cccs2)CCCCC1 ZINC000738162008 599545725 /nfs/dbraw/zinc/54/57/25/599545725.db2.gz IHHGNTKCFNOIQR-UHFFFAOYSA-N -1 3 371.441 3.908 20 0 FHADHM O[C@H](CNc1c(Cl)cccc1-c1nnn[n-]1)c1ccc2ccccc2c1 ZINC000823690433 599548457 /nfs/dbraw/zinc/54/84/57/599548457.db2.gz OMIPLGCMWNTUAM-QGZVFWFLSA-N -1 3 365.824 3.819 20 0 FHADHM O[C@H](CNc1c(Cl)cccc1-c1nn[n-]n1)c1ccc2ccccc2c1 ZINC000823690433 599548458 /nfs/dbraw/zinc/54/84/58/599548458.db2.gz OMIPLGCMWNTUAM-QGZVFWFLSA-N -1 3 365.824 3.819 20 0 FHADHM Cc1ccc(NC(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(C)C)s1 ZINC000822248879 599551549 /nfs/dbraw/zinc/55/15/49/599551549.db2.gz ROJIHEGZBYOMEY-UHFFFAOYSA-N -1 3 358.427 3.668 20 0 FHADHM Cc1ccc(NC(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(C)C)s1 ZINC000822248879 599551551 /nfs/dbraw/zinc/55/15/51/599551551.db2.gz ROJIHEGZBYOMEY-UHFFFAOYSA-N -1 3 358.427 3.668 20 0 FHADHM Cc1cc(NC(=O)Nc2ccc(-c3nnn[n-]3)cc2)ccc1OC(C)C ZINC000822208184 599551686 /nfs/dbraw/zinc/55/16/86/599551686.db2.gz FRQURHWEHJSPNM-UHFFFAOYSA-N -1 3 352.398 3.606 20 0 FHADHM Cc1cc(NC(=O)Nc2ccc(-c3nn[n-]n3)cc2)ccc1OC(C)C ZINC000822208184 599551687 /nfs/dbraw/zinc/55/16/87/599551687.db2.gz FRQURHWEHJSPNM-UHFFFAOYSA-N -1 3 352.398 3.606 20 0 FHADHM Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)Nc2cccc(-c3nnn[n-]3)c2)o1 ZINC000822233706 599555774 /nfs/dbraw/zinc/55/57/74/599555774.db2.gz TWHBFVZWFDPCIG-WBMJQRKESA-N -1 3 366.425 3.773 20 0 FHADHM Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)Nc2cccc(-c3nn[n-]n3)c2)o1 ZINC000822233706 599555777 /nfs/dbraw/zinc/55/57/77/599555777.db2.gz TWHBFVZWFDPCIG-WBMJQRKESA-N -1 3 366.425 3.773 20 0 FHADHM CC[C@@H](NC(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1)C(C)C ZINC000736365962 599564425 /nfs/dbraw/zinc/56/44/25/599564425.db2.gz ZZIGTASPXILHSK-GOSISDBHSA-N -1 3 364.453 3.775 20 0 FHADHM Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)Nc2cccc(-c3nnn[n-]3)c2)C1 ZINC000737421467 599599664 /nfs/dbraw/zinc/59/96/64/599599664.db2.gz NIQLTMFQXXYAAV-GOEBONIOSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)Nc2cccc(-c3nn[n-]n3)c2)C1 ZINC000737421467 599599665 /nfs/dbraw/zinc/59/96/65/599599665.db2.gz NIQLTMFQXXYAAV-GOEBONIOSA-N -1 3 362.437 3.585 20 0 FHADHM CS[C@@H]1CCCCN(c2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)C1 ZINC000821956722 607386072 /nfs/dbraw/zinc/38/60/72/607386072.db2.gz WLIQGCHJFNXEDJ-LLVKDONJSA-N -1 3 357.405 3.607 20 0 FHADHM CS[C@@H]1CCCCN(c2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)C1 ZINC000821956722 607386074 /nfs/dbraw/zinc/38/60/74/607386074.db2.gz WLIQGCHJFNXEDJ-LLVKDONJSA-N -1 3 357.405 3.607 20 0 FHADHM C[C@H](OC(=O)[C@@H]1C[C@H]1c1cc(F)ccc1F)c1cccc(-c2nnn[n-]2)c1 ZINC000820488770 599622229 /nfs/dbraw/zinc/62/22/29/599622229.db2.gz UBEZPHWBCIVJJG-JMPLFQLZSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@@H]1C[C@H]1c1cc(F)ccc1F)c1cccc(-c2nn[n-]n2)c1 ZINC000820488770 599622230 /nfs/dbraw/zinc/62/22/30/599622230.db2.gz UBEZPHWBCIVJJG-JMPLFQLZSA-N -1 3 370.359 3.553 20 0 FHADHM Cc1sc(NC(=O)[C@H]2SCCc3ccccc32)c(-c2nnn[n-]2)c1C ZINC000822557000 599628824 /nfs/dbraw/zinc/62/88/24/599628824.db2.gz DXIQCAMDPBKSKD-AWEZNQCLSA-N -1 3 371.491 3.514 20 0 FHADHM Cc1sc(NC(=O)[C@H]2SCCc3ccccc32)c(-c2nn[n-]n2)c1C ZINC000822557000 599628825 /nfs/dbraw/zinc/62/88/25/599628825.db2.gz DXIQCAMDPBKSKD-AWEZNQCLSA-N -1 3 371.491 3.514 20 0 FHADHM CC(C)[C@H](C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccccc1 ZINC000820017562 599629392 /nfs/dbraw/zinc/62/93/92/599629392.db2.gz ZYGKWNKVDQOJFT-INIZCTEOSA-N -1 3 355.829 3.898 20 0 FHADHM CC(C)[C@H](C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccccc1 ZINC000820017562 599629393 /nfs/dbraw/zinc/62/93/93/599629393.db2.gz ZYGKWNKVDQOJFT-INIZCTEOSA-N -1 3 355.829 3.898 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)/C=C(\C)C(C)(C)C ZINC000821390474 599629614 /nfs/dbraw/zinc/62/96/14/599629614.db2.gz YBSCDDSMHFJSLY-JXMROGBWSA-N -1 3 364.833 3.817 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)/C=C(\C)C(C)(C)C ZINC000821390474 599629615 /nfs/dbraw/zinc/62/96/15/599629615.db2.gz YBSCDDSMHFJSLY-JXMROGBWSA-N -1 3 364.833 3.817 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccc(OC2CCC2)cc1 ZINC000823309423 599630024 /nfs/dbraw/zinc/63/00/24/599630024.db2.gz YSJSIBFROFCMSX-UHFFFAOYSA-N -1 3 369.812 3.704 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccc(OC2CCC2)cc1 ZINC000823309423 599630025 /nfs/dbraw/zinc/63/00/25/599630025.db2.gz YSJSIBFROFCMSX-UHFFFAOYSA-N -1 3 369.812 3.704 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)c(C)c1 ZINC000822226312 599632144 /nfs/dbraw/zinc/63/21/44/599632144.db2.gz LYKYJBYNPHCKLG-UHFFFAOYSA-N -1 3 361.327 3.755 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)c(C)c1 ZINC000822226312 599632145 /nfs/dbraw/zinc/63/21/45/599632145.db2.gz LYKYJBYNPHCKLG-UHFFFAOYSA-N -1 3 361.327 3.755 20 0 FHADHM CCS[C@H](C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)C(C)C ZINC000821449553 599632766 /nfs/dbraw/zinc/63/27/66/599632766.db2.gz VAXQJWRXPZWDTI-LBPRGKRZSA-N -1 3 373.404 3.602 20 0 FHADHM CCS[C@H](C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)C(C)C ZINC000821449553 599632767 /nfs/dbraw/zinc/63/27/67/599632767.db2.gz VAXQJWRXPZWDTI-LBPRGKRZSA-N -1 3 373.404 3.602 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)[C@H]1CCc2ccccc21 ZINC000823303454 599634024 /nfs/dbraw/zinc/63/40/24/599634024.db2.gz IVCULUBBZOHOFX-ZDUSSCGKSA-N -1 3 373.338 3.554 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)[C@H]1CCc2ccccc21 ZINC000823303454 599634025 /nfs/dbraw/zinc/63/40/25/599634025.db2.gz IVCULUBBZOHOFX-ZDUSSCGKSA-N -1 3 373.338 3.554 20 0 FHADHM CCC(C)(C)CC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)CC(F)(F)F ZINC000820848359 599648111 /nfs/dbraw/zinc/64/81/11/599648111.db2.gz VTHZGSGIPPSLQT-UHFFFAOYSA-N -1 3 369.391 3.584 20 0 FHADHM CCC(C)(C)CC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)CC(F)(F)F ZINC000820848359 599648112 /nfs/dbraw/zinc/64/81/12/599648112.db2.gz VTHZGSGIPPSLQT-UHFFFAOYSA-N -1 3 369.391 3.584 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)NC1CCC(C)(C)CC1 ZINC000821104717 599675952 /nfs/dbraw/zinc/67/59/52/599675952.db2.gz OKTJXMWYGWFSRM-UHFFFAOYSA-N -1 3 370.501 3.757 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)NC1CCC(C)(C)CC1 ZINC000821104717 599675953 /nfs/dbraw/zinc/67/59/53/599675953.db2.gz OKTJXMWYGWFSRM-UHFFFAOYSA-N -1 3 370.501 3.757 20 0 FHADHM C[C@@H](CCOc1ccccc1)C(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820248586 599684122 /nfs/dbraw/zinc/68/41/22/599684122.db2.gz KTILHLGPXPRILS-GJZGRUSLSA-N -1 3 366.421 3.576 20 0 FHADHM C[C@@H](CCOc1ccccc1)C(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820248586 599684123 /nfs/dbraw/zinc/68/41/23/599684123.db2.gz KTILHLGPXPRILS-GJZGRUSLSA-N -1 3 366.421 3.576 20 0 FHADHM CC(C)C[C@H]1CCN(c2c(-c3nnn[n-]3)cnc3c(F)cc(F)cc32)C1 ZINC000820067497 599686306 /nfs/dbraw/zinc/68/63/06/599686306.db2.gz JMVRPPOENJFRQX-LLVKDONJSA-N -1 3 358.396 3.566 20 0 FHADHM CC(C)C[C@H]1CCN(c2c(-c3nn[n-]n3)cnc3c(F)cc(F)cc32)C1 ZINC000820067497 599686307 /nfs/dbraw/zinc/68/63/07/599686307.db2.gz JMVRPPOENJFRQX-LLVKDONJSA-N -1 3 358.396 3.566 20 0 FHADHM CCC(=CC(=O)Nc1ccccc1-c1nnn[n-]1)c1cccc(Cl)c1 ZINC000820832517 599689760 /nfs/dbraw/zinc/68/97/60/599689760.db2.gz KPRUENAIEQFXSR-QXMHVHEDSA-N -1 3 353.813 3.952 20 0 FHADHM CCC(=CC(=O)Nc1ccccc1-c1nn[n-]n1)c1cccc(Cl)c1 ZINC000820832517 599689761 /nfs/dbraw/zinc/68/97/61/599689761.db2.gz KPRUENAIEQFXSR-QXMHVHEDSA-N -1 3 353.813 3.952 20 0 FHADHM c1cc(-c2nnn[n-]2)cc(-c2nc(-c3ccc(N4CCCCC4)cc3)no2)c1 ZINC000823737704 599691893 /nfs/dbraw/zinc/69/18/93/599691893.db2.gz ISWYSTFLDMIIDU-UHFFFAOYSA-N -1 3 373.420 3.574 20 0 FHADHM c1cc(-c2nn[n-]n2)cc(-c2nc(-c3ccc(N4CCCCC4)cc3)no2)c1 ZINC000823737704 599691894 /nfs/dbraw/zinc/69/18/94/599691894.db2.gz ISWYSTFLDMIIDU-UHFFFAOYSA-N -1 3 373.420 3.574 20 0 FHADHM Cc1c(F)cccc1NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C(C)C ZINC000822034423 599693574 /nfs/dbraw/zinc/69/35/74/599693574.db2.gz CJSFCMSLPHQMIF-UHFFFAOYSA-N -1 3 368.416 3.757 20 0 FHADHM Cc1c(F)cccc1NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C(C)C ZINC000822034423 599693575 /nfs/dbraw/zinc/69/35/75/599693575.db2.gz CJSFCMSLPHQMIF-UHFFFAOYSA-N -1 3 368.416 3.757 20 0 FHADHM CC(C)Oc1ccc(NC(=O)[C@@H](C)c2cccc(F)c2)cc1-c1nnn[n-]1 ZINC000820160011 607399469 /nfs/dbraw/zinc/39/94/69/607399469.db2.gz COMHOLTXLCUDCJ-LBPRGKRZSA-N -1 3 369.400 3.535 20 0 FHADHM CC(C)Oc1ccc(NC(=O)[C@@H](C)c2cccc(F)c2)cc1-c1nn[n-]n1 ZINC000820160011 607399471 /nfs/dbraw/zinc/39/94/71/607399471.db2.gz COMHOLTXLCUDCJ-LBPRGKRZSA-N -1 3 369.400 3.535 20 0 FHADHM COc1ccc([C@@H](NCc2cccc(OCC(F)(F)F)c2)C(=O)[O-])cc1 ZINC000737970656 599857147 /nfs/dbraw/zinc/85/71/47/599857147.db2.gz NMRZGNBGJZPNBN-MRXNPFEDSA-N -1 3 369.339 3.552 20 0 FHADHM O=C([O-])CN(CCSc1ccccc1F)Cc1ccc(F)c(F)c1 ZINC000739794164 599866161 /nfs/dbraw/zinc/86/61/61/599866161.db2.gz VSRGKDCSLNVDHB-UHFFFAOYSA-N -1 3 355.381 3.783 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@H]1C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000826316703 607403218 /nfs/dbraw/zinc/40/32/18/607403218.db2.gz WGUNUQLXQGIUOE-NILFDRSVSA-N -1 3 354.435 3.645 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@H]1C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000826316703 607403220 /nfs/dbraw/zinc/40/32/20/607403220.db2.gz WGUNUQLXQGIUOE-NILFDRSVSA-N -1 3 354.435 3.645 20 0 FHADHM Cc1ccc(C)c(C(=O)Nc2ccc(OC(C)C)c(-c3nnn[n-]3)c2)c1 ZINC000822230766 607404572 /nfs/dbraw/zinc/40/45/72/607404572.db2.gz PWCVKHZQXMEURG-UHFFFAOYSA-N -1 3 351.410 3.523 20 0 FHADHM Cc1ccc(C)c(C(=O)Nc2ccc(OC(C)C)c(-c3nn[n-]n3)c2)c1 ZINC000822230766 607404573 /nfs/dbraw/zinc/40/45/73/607404573.db2.gz PWCVKHZQXMEURG-UHFFFAOYSA-N -1 3 351.410 3.523 20 0 FHADHM Cc1ccc2c(c1)[C@H]1CN(C)CC[C@H]1N2C(=O)c1cccc(NC(=O)[O-])c1 ZINC000738669817 599898932 /nfs/dbraw/zinc/89/89/32/599898932.db2.gz IUDKDHLHCFDKGK-IEBWSBKVSA-N -1 3 365.433 3.533 20 0 FHADHM Cc1ccsc1CCCC(=O)OCc1ccc(-c2nnn[n-]2)cc1C ZINC000826253600 607407855 /nfs/dbraw/zinc/40/78/55/607407855.db2.gz WTLQNICKQHWHLW-UHFFFAOYSA-N -1 3 356.451 3.611 20 0 FHADHM Cc1ccsc1CCCC(=O)OCc1ccc(-c2nn[n-]n2)cc1C ZINC000826253600 607407856 /nfs/dbraw/zinc/40/78/56/607407856.db2.gz WTLQNICKQHWHLW-UHFFFAOYSA-N -1 3 356.451 3.611 20 0 FHADHM COc1cc2c(cc1OC)[C@H](CC(=O)[O-])N(Cc1cc(C)cc(C)c1)CC2 ZINC000737905588 599985365 /nfs/dbraw/zinc/98/53/65/599985365.db2.gz MYQFQYYOEVCMTI-IBGZPJMESA-N -1 3 369.461 3.895 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1COC(=O)CCSc1ccc(F)cc1 ZINC000826253488 607413049 /nfs/dbraw/zinc/41/30/49/607413049.db2.gz SCSUHMMCTGOKSQ-UHFFFAOYSA-N -1 3 372.425 3.540 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1COC(=O)CCSc1ccc(F)cc1 ZINC000826253488 607413050 /nfs/dbraw/zinc/41/30/50/607413050.db2.gz SCSUHMMCTGOKSQ-UHFFFAOYSA-N -1 3 372.425 3.540 20 0 FHADHM C[C@@](NCc1cccc(F)c1)(C(=O)[O-])c1cccc(Br)c1 ZINC000041768215 600079525 /nfs/dbraw/zinc/07/95/25/600079525.db2.gz XEJYBSHYPPFRRA-INIZCTEOSA-N -1 3 352.203 3.678 20 0 FHADHM CC(C)Oc1ccc(NC(=O)N[C@H](C)c2cccs2)cc1-c1nnn[n-]1 ZINC000820164131 607423828 /nfs/dbraw/zinc/42/38/28/607423828.db2.gz DREALPBPDXAVKZ-LLVKDONJSA-N -1 3 372.454 3.598 20 0 FHADHM CC(C)Oc1ccc(NC(=O)N[C@H](C)c2cccs2)cc1-c1nn[n-]n1 ZINC000820164131 607423829 /nfs/dbraw/zinc/42/38/29/607423829.db2.gz DREALPBPDXAVKZ-LLVKDONJSA-N -1 3 372.454 3.598 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@H]1C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2 ZINC000826316480 607428605 /nfs/dbraw/zinc/42/86/05/607428605.db2.gz POGCNDYUKXUGHJ-GHMZBOCLSA-N -1 3 371.491 3.529 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@H]1C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2 ZINC000826316480 607428607 /nfs/dbraw/zinc/42/86/07/607428607.db2.gz POGCNDYUKXUGHJ-GHMZBOCLSA-N -1 3 371.491 3.529 20 0 FHADHM CC(C)Oc1ccc(NC(=O)N2CCC(C(C)C)CC2)cc1-c1nnn[n-]1 ZINC000820166382 607430635 /nfs/dbraw/zinc/43/06/35/607430635.db2.gz XLUIGHZCXVVOHA-UHFFFAOYSA-N -1 3 372.473 3.554 20 0 FHADHM CC(C)Oc1ccc(NC(=O)N2CCC(C(C)C)CC2)cc1-c1nn[n-]n1 ZINC000820166382 607430636 /nfs/dbraw/zinc/43/06/36/607430636.db2.gz XLUIGHZCXVVOHA-UHFFFAOYSA-N -1 3 372.473 3.554 20 0 FHADHM Cc1cc(CN[C@@H](C(=O)[O-])c2ccc(Br)cc2)ccc1F ZINC000426813373 600418722 /nfs/dbraw/zinc/41/87/22/600418722.db2.gz WUQULLIYIPWWGJ-OAHLLOKOSA-N -1 3 352.203 3.812 20 0 FHADHM COc1cc(CN[C@H](C(=O)[O-])c2ccccc2)ccc1OCC(F)(F)F ZINC000426763850 600423931 /nfs/dbraw/zinc/42/39/31/600423931.db2.gz FDFQAJIWHYPOBQ-INIZCTEOSA-N -1 3 369.339 3.552 20 0 FHADHM O=C([O-])[C@H](NCc1ccc(OC2CCCC2)nc1)c1cccc(Cl)c1 ZINC000739499978 600425874 /nfs/dbraw/zinc/42/58/74/600425874.db2.gz MKXQSEYHGUFNFJ-GOSISDBHSA-N -1 3 360.841 3.972 20 0 FHADHM O=C([O-])[C@@H](NCc1cc2ccccc2[nH]1)c1ccc(Br)cc1 ZINC000739501831 600431612 /nfs/dbraw/zinc/43/16/12/600431612.db2.gz ZQXZRHQUOXQHRY-INIZCTEOSA-N -1 3 359.223 3.846 20 0 FHADHM COc1cc(CN[C@H](C(=O)[O-])c2cccc(Cl)c2)c2ccccc2n1 ZINC000832000337 600756758 /nfs/dbraw/zinc/75/67/58/600756758.db2.gz NWXUKLLWDJVNFD-SFHVURJKSA-N -1 3 356.809 3.812 20 0 FHADHM C[C@H]1CN2CCCC[C@@H]2CN1Cc1csc(-c2cccc(C(=O)[O-])c2)n1 ZINC000828499487 600830622 /nfs/dbraw/zinc/83/06/22/600830622.db2.gz AMCBHYZKSWDBOA-KBXCAEBGSA-N -1 3 371.506 3.567 20 0 FHADHM O=C([O-])C[C@H]1CN(C(=O)c2cccc(CN3CCCC3)c2)c2ccccc21 ZINC000739647013 600910786 /nfs/dbraw/zinc/91/07/86/600910786.db2.gz SCGXFVZSWFVVNV-SFHVURJKSA-N -1 3 364.445 3.501 20 0 FHADHM Cn1cc([C@@H]2CCCN([C@H](C(=O)[O-])c3ccc(Cl)cc3Cl)C2)cn1 ZINC000833042861 600994840 /nfs/dbraw/zinc/99/48/40/600994840.db2.gz CEZIQCXHXWDBLS-BZNIZROVSA-N -1 3 368.264 3.732 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)c(CSCc2noc(C3CCCCC3)n2)c1 ZINC000822758489 607479783 /nfs/dbraw/zinc/47/97/83/607479783.db2.gz PVEXEPWNKOBTJO-UHFFFAOYSA-N -1 3 374.445 3.870 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)c(CSCc2noc(C3CCCCC3)n2)c1 ZINC000822758489 607479785 /nfs/dbraw/zinc/47/97/85/607479785.db2.gz PVEXEPWNKOBTJO-UHFFFAOYSA-N -1 3 374.445 3.870 20 0 FHADHM c1cc(-c2nnn[n-]2)ccc1CSCc1noc(C2CCCCC2)n1 ZINC000823742404 607479941 /nfs/dbraw/zinc/47/99/41/607479941.db2.gz FIQRYDGOBRSCGE-UHFFFAOYSA-N -1 3 356.455 3.731 20 0 FHADHM c1cc(-c2nn[n-]n2)ccc1CSCc1noc(C2CCCCC2)n1 ZINC000823742404 607479942 /nfs/dbraw/zinc/47/99/42/607479942.db2.gz FIQRYDGOBRSCGE-UHFFFAOYSA-N -1 3 356.455 3.731 20 0 FHADHM Cc1ncccc1NCc1cccc(OCc2cccc(-c3nnn[n-]3)c2)c1 ZINC000822477993 607491223 /nfs/dbraw/zinc/49/12/23/607491223.db2.gz ONJZXPCWAUYWOC-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM Cc1ncccc1NCc1cccc(OCc2cccc(-c3nn[n-]n3)c2)c1 ZINC000822477993 607491224 /nfs/dbraw/zinc/49/12/24/607491224.db2.gz ONJZXPCWAUYWOC-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM Cc1ccc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1C(=O)[O-] ZINC000832945548 601141468 /nfs/dbraw/zinc/14/14/68/601141468.db2.gz VNSAOPMFKLLSJR-MRXNPFEDSA-N -1 3 373.478 3.713 20 0 FHADHM Cc1ccncc1NCc1cccc(OCc2cccc(-c3nnn[n-]3)c2)c1 ZINC000822379600 607493470 /nfs/dbraw/zinc/49/34/70/607493470.db2.gz QOHZLFUZFQRYNG-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM Cc1ccncc1NCc1cccc(OCc2cccc(-c3nn[n-]n3)c2)c1 ZINC000822379600 607493471 /nfs/dbraw/zinc/49/34/71/607493471.db2.gz QOHZLFUZFQRYNG-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM CC(C)c1ncc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCC3)s1 ZINC000820206051 607493788 /nfs/dbraw/zinc/49/37/88/607493788.db2.gz BLPBSKXDARNYMK-UHFFFAOYSA-N -1 3 374.495 3.639 20 0 FHADHM CC(C)c1ncc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCC3)s1 ZINC000820206051 607493790 /nfs/dbraw/zinc/49/37/90/607493790.db2.gz BLPBSKXDARNYMK-UHFFFAOYSA-N -1 3 374.495 3.639 20 0 FHADHM C[C@H](OC(=O)c1ccc(-c2nnc(C3CC3)[nH]2)cc1)c1ccc(C(=O)[O-])o1 ZINC000827854165 601188363 /nfs/dbraw/zinc/18/83/63/601188363.db2.gz RDDUJCVDQOGANE-JTQLQIEISA-N -1 3 367.361 3.558 20 0 FHADHM C[C@@H](C(=O)[O-])[C@@H](NCC(=O)N[C@@H](C)c1ccccc1Cl)c1ccccc1 ZINC000827637393 601203241 /nfs/dbraw/zinc/20/32/41/601203241.db2.gz SQMXMDPTDTWARK-BIENJYKASA-N -1 3 374.868 3.569 20 0 FHADHM Cc1ccc(NC(=O)[C@@H](NCC2(C(=O)[O-])CCCC2)c2ccccc2)cc1 ZINC000832941158 601369160 /nfs/dbraw/zinc/36/91/60/601369160.db2.gz GRGAYEALHFZXHN-IBGZPJMESA-N -1 3 366.461 3.909 20 0 FHADHM Cc1ccc(C)c(NC(=O)[C@H](c2ccccc2)N2C[C@@H](C)[C@H](C(=O)[O-])C2)c1 ZINC000263384666 601537864 /nfs/dbraw/zinc/53/78/64/601537864.db2.gz XWRFFRCMDXCXLF-POAQFYNOSA-N -1 3 366.461 3.636 20 0 FHADHM CC(C)c1ccccc1NC(=O)CN[C@@H](c1ccccc1)[C@@H](C)C(=O)[O-] ZINC000827134095 601650584 /nfs/dbraw/zinc/65/05/84/601650584.db2.gz CYIIAHJZWZMMPQ-FOIQADDNSA-N -1 3 354.450 3.800 20 0 FHADHM CC(C)c1cccc(NC(=O)CN[C@H](c2ccccc2)[C@@H](C)C(=O)[O-])c1 ZINC000827134361 601652462 /nfs/dbraw/zinc/65/24/62/601652462.db2.gz UHWBHGMTKLLHNJ-QRWLVFNGSA-N -1 3 354.450 3.800 20 0 FHADHM O=C([O-])CC[C@H](NCc1cnc(-c2ccncc2)s1)c1ccccc1 ZINC000833221943 601833563 /nfs/dbraw/zinc/83/35/63/601833563.db2.gz DWBKSMCOJHPTPV-KRWDZBQOSA-N -1 3 353.447 3.901 20 0 FHADHM O=C([O-])N1CCC(N(Cc2cc(-c3ccc(F)cc3)no2)C2CC2)CC1 ZINC000740499748 601932098 /nfs/dbraw/zinc/93/20/98/601932098.db2.gz IZQYKCZRIWAEIK-UHFFFAOYSA-N -1 3 359.401 3.588 20 0 FHADHM C[C@@H](c1nnc(-c2ccc(Cl)cc2Cl)o1)N1C[C@@H](C)[C@H](C(=O)[O-])C1 ZINC000828421486 601964063 /nfs/dbraw/zinc/96/40/63/601964063.db2.gz GDADWBHLTXXLSC-VDDIYKPWSA-N -1 3 370.236 3.757 20 0 FHADHM O=C([O-])[C@H](NCc1ccc2c(c1)OCO2)c1cc(Cl)cc(Cl)c1 ZINC000833169856 601971786 /nfs/dbraw/zinc/97/17/86/601971786.db2.gz MACVXOLXIXKSJZ-OAHLLOKOSA-N -1 3 354.189 3.638 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)CC[C@H](C)c1ccccc1 ZINC000825620990 607537372 /nfs/dbraw/zinc/53/73/72/607537372.db2.gz LTEXRZGEAWNPQQ-AWEZNQCLSA-N -1 3 365.437 3.788 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)CC[C@H](C)c1ccccc1 ZINC000825620990 607537374 /nfs/dbraw/zinc/53/73/74/607537374.db2.gz LTEXRZGEAWNPQQ-AWEZNQCLSA-N -1 3 365.437 3.788 20 0 FHADHM COc1cc(OC)cc([C@@H](N[C@H]2CCSc3ccccc32)C(=O)[O-])c1 ZINC000832050948 602164111 /nfs/dbraw/zinc/16/41/11/602164111.db2.gz TYSAPXJETXGXSH-FUHWJXTLSA-N -1 3 359.447 3.656 20 0 FHADHM COc1cc(OC)cc([C@@H](N[C@H](C)c2cccc(OC(C)C)c2)C(=O)[O-])c1 ZINC000832051749 602166786 /nfs/dbraw/zinc/16/67/86/602166786.db2.gz XOGDIZURMKJJKX-JLTOFOAXSA-N -1 3 373.449 3.968 20 0 FHADHM CCOc1cccc([C@H](C)N[C@H](C(=O)[O-])c2cc(OC)cc(OC)c2)c1 ZINC000830100088 602169536 /nfs/dbraw/zinc/16/95/36/602169536.db2.gz VKMUSCSCQUPGHD-DJJJIMSYSA-N -1 3 359.422 3.579 20 0 FHADHM COc1cc(OC)cc([C@@H](NCc2ccc(C)cc2SC)C(=O)[O-])c1 ZINC000832056329 602176104 /nfs/dbraw/zinc/17/61/04/602176104.db2.gz BTGYPIHLJYVPMJ-GOSISDBHSA-N -1 3 361.463 3.650 20 0 FHADHM CC[C@@](C)(CC(=O)[O-])NCc1csc(-c2ccc(OC)c(OC)c2)n1 ZINC000828665707 602215659 /nfs/dbraw/zinc/21/56/59/602215659.db2.gz WYPPGDYCXSPCLX-SFHVURJKSA-N -1 3 364.467 3.560 20 0 FHADHM CC[C@](C)(CC(=O)[O-])NCc1ncc(-c2ccc(Br)cc2)o1 ZINC000828671526 602217848 /nfs/dbraw/zinc/21/78/48/602217848.db2.gz FAFSCCRHZGIXIU-MRXNPFEDSA-N -1 3 367.243 3.837 20 0 FHADHM C[C@H](CCC(=O)OCc1ccc(-c2nnn[n-]2)cc1F)c1ccccc1 ZINC000824400333 607553053 /nfs/dbraw/zinc/55/30/53/607553053.db2.gz FKGQTDOOBSKHKA-CYBMUJFWSA-N -1 3 354.385 3.633 20 0 FHADHM C[C@H](CCC(=O)OCc1ccc(-c2nn[n-]n2)cc1F)c1ccccc1 ZINC000824400333 607553055 /nfs/dbraw/zinc/55/30/55/607553055.db2.gz FKGQTDOOBSKHKA-CYBMUJFWSA-N -1 3 354.385 3.633 20 0 FHADHM CC[C@H](SC)C(=O)Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000825159133 607577742 /nfs/dbraw/zinc/57/77/42/607577742.db2.gz JNWIULNABXHMQC-INIZCTEOSA-N -1 3 369.450 3.739 20 0 FHADHM CC[C@H](SC)C(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000825159133 607577744 /nfs/dbraw/zinc/57/77/44/607577744.db2.gz JNWIULNABXHMQC-INIZCTEOSA-N -1 3 369.450 3.739 20 0 FHADHM CC[C@@H](SC)C(=O)Oc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000825160062 607589068 /nfs/dbraw/zinc/58/90/68/607589068.db2.gz XHYVEHVPFCPBGX-MRXNPFEDSA-N -1 3 370.434 3.706 20 0 FHADHM CC[C@@H](SC)C(=O)Oc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000825160062 607589069 /nfs/dbraw/zinc/58/90/69/607589069.db2.gz XHYVEHVPFCPBGX-MRXNPFEDSA-N -1 3 370.434 3.706 20 0 FHADHM O=C([O-])Nc1ccc(C(=O)N(CCN2CCCC2)c2ccccc2)cc1 ZINC000738662902 603009125 /nfs/dbraw/zinc/00/91/25/603009125.db2.gz ZIWOAMXWHSPNNQ-UHFFFAOYSA-N -1 3 353.422 3.519 20 0 FHADHM CN(C(=O)[O-])c1ccc(OC(=O)c2cccc(CN3CCCC3)c2)cc1 ZINC000827914231 603046192 /nfs/dbraw/zinc/04/61/92/603046192.db2.gz IURHSDFQXSOSLG-UHFFFAOYSA-N -1 3 354.406 3.616 20 0 FHADHM O=C([O-])NC[C@@H]1CCCC[C@H]1NCc1csc(-c2cccs2)n1 ZINC000832514570 603172511 /nfs/dbraw/zinc/17/25/11/603172511.db2.gz NIHRFDRKTHZFPV-WCQYABFASA-N -1 3 351.497 3.788 20 0 FHADHM CN(C)[C@@H]1Cc2ccccc2N(C(=O)c2ccc(NC(=O)[O-])cc2Cl)C1 ZINC000739605273 603244999 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Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1ccc2c3c(cccc31)CC2 ZINC000826250073 607653936 /nfs/dbraw/zinc/65/39/36/607653936.db2.gz JIFSKAGDQNVYKO-UHFFFAOYSA-N -1 3 355.401 3.679 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1ccc2c3c(cccc31)CC2 ZINC000826250073 607653937 /nfs/dbraw/zinc/65/39/37/607653937.db2.gz JIFSKAGDQNVYKO-UHFFFAOYSA-N -1 3 355.401 3.679 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N[C@@H](C)c1cccc2ccccc21 ZINC000826247340 607650454 /nfs/dbraw/zinc/65/04/54/607650454.db2.gz ZYWSQYHSOCMWFU-AWEZNQCLSA-N -1 3 357.417 3.819 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N[C@@H](C)c1cccc2ccccc21 ZINC000826247340 607650456 /nfs/dbraw/zinc/65/04/56/607650456.db2.gz ZYWSQYHSOCMWFU-AWEZNQCLSA-N -1 3 357.417 3.819 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1CC[C@@H](C)Sc2ccccc21 ZINC000826244051 607654632 /nfs/dbraw/zinc/65/46/32/607654632.db2.gz FTWJCEMTHAHSCE-CYBMUJFWSA-N -1 3 365.462 3.706 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1CC[C@@H](C)Sc2ccccc21 ZINC000826244051 607654633 /nfs/dbraw/zinc/65/46/33/607654633.db2.gz FTWJCEMTHAHSCE-CYBMUJFWSA-N -1 3 365.462 3.706 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@@H]1C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000826316322 607655649 /nfs/dbraw/zinc/65/56/49/607655649.db2.gz KJOYMDGMGQYQJD-MNOVXSKESA-N -1 3 359.842 3.632 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@@H]1C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000826316322 607655650 /nfs/dbraw/zinc/65/56/50/607655650.db2.gz KJOYMDGMGQYQJD-MNOVXSKESA-N -1 3 359.842 3.632 20 0 FHADHM Cc1ccsc1CCCC(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000826316004 607656007 /nfs/dbraw/zinc/65/60/07/607656007.db2.gz AKKZQZCFQKSYPV-UHFFFAOYSA-N -1 3 361.858 3.851 20 0 FHADHM Cc1ccsc1CCCC(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000826316004 607656008 /nfs/dbraw/zinc/65/60/08/607656008.db2.gz AKKZQZCFQKSYPV-UHFFFAOYSA-N -1 3 361.858 3.851 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N(C)[C@H](C)c1cccc(Cl)c1 ZINC000826243696 607660432 /nfs/dbraw/zinc/66/04/32/607660432.db2.gz RTXKFLULAHJQCS-GFCCVEGCSA-N -1 3 355.829 3.662 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N(C)[C@H](C)c1cccc(Cl)c1 ZINC000826243696 607660433 /nfs/dbraw/zinc/66/04/33/607660433.db2.gz RTXKFLULAHJQCS-GFCCVEGCSA-N -1 3 355.829 3.662 20 0 FHADHM O=C([O-])N1CCc2c1cccc2NC(=O)c1cccc(CN2CCCC2)c1 ZINC000831797919 603951847 /nfs/dbraw/zinc/95/18/47/603951847.db2.gz YMYWVLAQCYNDRA-UHFFFAOYSA-N -1 3 365.433 3.575 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1nc2c(s1)CCCCCC2 ZINC000826250515 607671202 /nfs/dbraw/zinc/67/12/02/607671202.db2.gz FEUWBTCHTWWGJG-UHFFFAOYSA-N -1 3 368.466 3.543 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1nc2c(s1)CCCCCC2 ZINC000826250515 607671204 /nfs/dbraw/zinc/67/12/04/607671204.db2.gz FEUWBTCHTWWGJG-UHFFFAOYSA-N -1 3 368.466 3.543 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N(C)CCc1cccc2ccccc21 ZINC000826243755 607677740 /nfs/dbraw/zinc/67/77/40/607677740.db2.gz UNNGSKCRICUAOJ-UHFFFAOYSA-N -1 3 371.444 3.643 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N(C)CCc1cccc2ccccc21 ZINC000826243755 607677742 /nfs/dbraw/zinc/67/77/42/607677742.db2.gz UNNGSKCRICUAOJ-UHFFFAOYSA-N -1 3 371.444 3.643 20 0 FHADHM Cc1c([C@@H](C)N[C@H]2CCCN(C(=O)[O-])C2)cnn1-c1cc(C)ccc1C ZINC000832923696 604286503 /nfs/dbraw/zinc/28/65/03/604286503.db2.gz AOXMBNBSPMCDCP-WBVHZDCISA-N -1 3 356.470 3.591 20 0 FHADHM CCSCc1cccc(NC(=O)c2ccc(-c3nnn[n-]3)cc2C)c1 ZINC000825674052 607694670 /nfs/dbraw/zinc/69/46/70/607694670.db2.gz HCRYSRQLGQSEAE-UHFFFAOYSA-N -1 3 353.451 3.681 20 0 FHADHM CCSCc1cccc(NC(=O)c2ccc(-c3nn[n-]n3)cc2C)c1 ZINC000825674052 607694671 /nfs/dbraw/zinc/69/46/71/607694671.db2.gz HCRYSRQLGQSEAE-UHFFFAOYSA-N -1 3 353.451 3.681 20 0 FHADHM C[C@@H]1CCN(C(=O)Nc2cc(C(=O)[O-])cs2)CCN1Cc1ccccc1 ZINC000828279403 604494451 /nfs/dbraw/zinc/49/44/51/604494451.db2.gz ZIQWVDKMWRIUIZ-CQSZACIVSA-N -1 3 373.478 3.575 20 0 FHADHM C[C@H]1CCN(C(=O)Nc2cc(C(=O)[O-])cs2)CCN1Cc1ccccc1 ZINC000828279402 604494588 /nfs/dbraw/zinc/49/45/88/604494588.db2.gz ZIQWVDKMWRIUIZ-AWEZNQCLSA-N -1 3 373.478 3.575 20 0 FHADHM C[C@@H](Oc1ccc(CN(C)CCOc2ccccc2Cl)cc1)C(=O)[O-] ZINC000833538672 604523437 /nfs/dbraw/zinc/52/34/37/604523437.db2.gz URVVVCZFJVHMBG-CQSZACIVSA-N -1 3 363.841 3.703 20 0 FHADHM C[C@@H]1CN(c2ccc(C(=O)[O-])cc2)CCN1Cc1nccc2ccccc21 ZINC000833635753 604620583 /nfs/dbraw/zinc/62/05/83/604620583.db2.gz XRTLIGPJKYVJAQ-MRXNPFEDSA-N -1 3 361.445 3.644 20 0 FHADHM C[C@H](Oc1ccc(CN2CCC[C@@H]2c2ccc3c(c2)OCO3)cc1)C(=O)[O-] ZINC000833538491 604631138 /nfs/dbraw/zinc/63/11/38/604631138.db2.gz CVACENGMLAAPIE-KBXCAEBGSA-N -1 3 369.417 3.604 20 0 FHADHM Cc1ccn(-c2ccccc2CN[C@@H](C(=O)[O-])c2cccc(Cl)c2)n1 ZINC000832983335 604646079 /nfs/dbraw/zinc/64/60/79/604646079.db2.gz DMRLGWPFBPQWRI-GOSISDBHSA-N -1 3 355.825 3.750 20 0 FHADHM Fc1cccc(F)c1-c1nc(COc2ccc(-c3nnn[n-]3)c(F)c2)co1 ZINC000826372546 607712497 /nfs/dbraw/zinc/71/24/97/607712497.db2.gz BEYHJNYCUPGTGR-UHFFFAOYSA-N -1 3 373.294 3.518 20 0 FHADHM Fc1cccc(F)c1-c1nc(COc2ccc(-c3nn[n-]n3)c(F)c2)co1 ZINC000826372546 607712499 /nfs/dbraw/zinc/71/24/99/607712499.db2.gz BEYHJNYCUPGTGR-UHFFFAOYSA-N -1 3 373.294 3.518 20 0 FHADHM COc1ccccc1[C@H](CN[C@@H](C)c1ccc2ccccc2n1)NC(=O)[O-] ZINC000829599369 604760986 /nfs/dbraw/zinc/76/09/86/604760986.db2.gz USXXZQITHZXXIM-LIRRHRJNSA-N -1 3 365.433 3.903 20 0 FHADHM CN(C(=O)CN[C@@H](c1ccc(F)cc1)C1CCC1)c1ccccc1C(=O)[O-] ZINC000833686553 604948805 /nfs/dbraw/zinc/94/88/05/604948805.db2.gz ZDXLNCDYJKMUBL-HXUWFJFHSA-N -1 3 370.424 3.618 20 0 FHADHM CC[C@](C)(COc1ncccc1Cl)NCc1cc(C)c(C(=O)[O-])o1 ZINC000833638560 604989372 /nfs/dbraw/zinc/98/93/72/604989372.db2.gz UMQVSZIWIYBPKX-QGZVFWFLSA-N -1 3 352.818 3.672 20 0 FHADHM O=C([O-])[C@@H](NCc1ccc(CN2CCc3ccccc32)cc1)c1cccnc1 ZINC000833166012 604991884 /nfs/dbraw/zinc/99/18/84/604991884.db2.gz NGJWYHNNYCHNAV-QFIPXVFZSA-N -1 3 373.456 3.560 20 0 FHADHM O=C([O-])[C@@H](NCc1cccc(COCc2ccccc2)c1)c1cccnc1 ZINC000833169853 604993813 /nfs/dbraw/zinc/99/38/13/604993813.db2.gz LUBSAMRJRXGRPQ-NRFANRHFSA-N -1 3 362.429 3.714 20 0 FHADHM CC(C)C[C@H](NCC(=O)NCc1ccc(NC(=O)[O-])cc1)c1ccccc1 ZINC000833484869 605062334 /nfs/dbraw/zinc/06/23/34/605062334.db2.gz STAHZQQUIPPBML-IBGZPJMESA-N -1 3 369.465 3.770 20 0 FHADHM C[C@@]1(NCc2coc(-c3ccc(F)c(F)c3)n2)CCCC[C@@H]1C(=O)[O-] ZINC000833570946 605069903 /nfs/dbraw/zinc/06/99/03/605069903.db2.gz WXUFWCAXYITTSE-FZKQIMNGSA-N -1 3 350.365 3.743 20 0 FHADHM C[C@@H](NC(=O)[O-])c1ccc(CN[C@@H](C)c2ccc([S@@](C)=O)cc2)cc1 ZINC000825502876 605118701 /nfs/dbraw/zinc/11/87/01/605118701.db2.gz LZHVCDQXPKXBHO-KTTFQHEFSA-N -1 3 360.479 3.603 20 0 FHADHM C[C@@H](NCc1ccc([C@@H](C)NC(=O)[O-])cc1)c1ccc2c(c1)OCCO2 ZINC000825502738 605118877 /nfs/dbraw/zinc/11/88/77/605118877.db2.gz KCPKMYPFZLALOY-ZIAGYGMSSA-N -1 3 356.422 3.637 20 0 FHADHM CC(C)(C(=O)[O-])[C@@H](NCC(=O)Nc1ccccc1Cl)c1ccccc1 ZINC000833412225 605177988 /nfs/dbraw/zinc/17/79/88/605177988.db2.gz IOYAZWIFHHOPLQ-KRWDZBQOSA-N -1 3 360.841 3.720 20 0 FHADHM C[C@@H](Oc1ccccc1NC(=O)c1ccc(-c2nnn[n-]2)[nH]1)c1ccccc1 ZINC000824754708 607739639 /nfs/dbraw/zinc/73/96/39/607739639.db2.gz JOTZNROSCOJVIH-CYBMUJFWSA-N -1 3 374.404 3.587 20 0 FHADHM C[C@@H](Oc1ccccc1NC(=O)c1ccc(-c2nn[n-]n2)[nH]1)c1ccccc1 ZINC000824754708 607739640 /nfs/dbraw/zinc/73/96/40/607739640.db2.gz JOTZNROSCOJVIH-CYBMUJFWSA-N -1 3 374.404 3.587 20 0 FHADHM CC(=O)Nc1ccc(CN[C@H](C(=O)[O-])c2ccccc2C(F)(F)F)cc1 ZINC000833400036 605259554 /nfs/dbraw/zinc/25/95/54/605259554.db2.gz XFTRAEWRFPMXNJ-INIZCTEOSA-N -1 3 366.339 3.579 20 0 FHADHM CC[C@H](CSc1ccccc1)NC(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000825126945 607757383 /nfs/dbraw/zinc/75/73/83/607757383.db2.gz KGZJPBSIUOMMGB-CQSZACIVSA-N -1 3 368.466 3.559 20 0 FHADHM CC1([C@@H]2CCCN([C@H](C(=O)[O-])c3cc(Cl)cc(Cl)c3)C2)OCCO1 ZINC000833565173 605444210 /nfs/dbraw/zinc/44/42/10/605444210.db2.gz YMJJJZUVHILCNW-DOMZBBRYSA-N -1 3 374.264 3.594 20 0 FHADHM CC1([C@H]2CCCN([C@@H](C(=O)[O-])c3cc(Cl)cc(Cl)c3)C2)OCCO1 ZINC000833565175 605444368 /nfs/dbraw/zinc/44/43/68/605444368.db2.gz YMJJJZUVHILCNW-SWLSCSKDSA-N -1 3 374.264 3.594 20 0 FHADHM O=C([O-])N1CCC[C@@H]1[C@@H]1CCCN(Cc2cnc(-c3ccncc3)s2)C1 ZINC000834103449 605468699 /nfs/dbraw/zinc/46/86/99/605468699.db2.gz BLECRELNOBUJSX-NVXWUHKLSA-N -1 3 372.494 3.560 20 0 FHADHM O=C([O-])N1CCc2cccc(CN3CC=C(c4c[nH]c5ncccc45)CC3)c21 ZINC000834121894 605469334 /nfs/dbraw/zinc/46/93/34/605469334.db2.gz CYVWWPZTQVEYKA-UHFFFAOYSA-N -1 3 374.444 3.893 20 0 FHADHM C[C@H](c1ccc(C(=O)[O-])o1)N1CCC(n2ccc(C(F)(F)F)n2)CC1 ZINC000574578925 605474215 /nfs/dbraw/zinc/47/42/15/605474215.db2.gz WKCXDNHTWJLYGH-SNVBAGLBSA-N -1 3 357.332 3.591 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)N1CC[C@H]1c1cccc(F)c1 ZINC000826452424 607758176 /nfs/dbraw/zinc/75/81/76/607758176.db2.gz SUTRYTWEPZDCFR-HNNXBMFYSA-N -1 3 372.791 3.638 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)N1CC[C@H]1c1cccc(F)c1 ZINC000826452424 607758177 /nfs/dbraw/zinc/75/81/77/607758177.db2.gz SUTRYTWEPZDCFR-HNNXBMFYSA-N -1 3 372.791 3.638 20 0 FHADHM CC[C@H](CSc1ccccc1)NC(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000825126945 607757384 /nfs/dbraw/zinc/75/73/84/607757384.db2.gz KGZJPBSIUOMMGB-CQSZACIVSA-N -1 3 368.466 3.559 20 0 FHADHM Cc1cc(C(=O)N[C@H](CN2CCCC2)c2ccccc2)ccc1NC(=O)[O-] ZINC000829939427 605593752 /nfs/dbraw/zinc/59/37/52/605593752.db2.gz DYKCVTBOAIXBAR-LJQANCHMSA-N -1 3 367.449 3.652 20 0 FHADHM C[C@H]1CCC[C@@H](C(=O)Nc2nc(-c3cccc(-c4nnn[n-]4)c3)cs2)C1 ZINC000824928435 607770161 /nfs/dbraw/zinc/77/01/61/607770161.db2.gz SLHVKVCIRBNMFH-SMDDNHRTSA-N -1 3 368.466 3.755 20 0 FHADHM C[C@H]1CCC[C@@H](C(=O)Nc2nc(-c3cccc(-c4nn[n-]n4)c3)cs2)C1 ZINC000824928435 607770162 /nfs/dbraw/zinc/77/01/62/607770162.db2.gz SLHVKVCIRBNMFH-SMDDNHRTSA-N -1 3 368.466 3.755 20 0 FHADHM CC(C)(C)CCC(=O)Nc1nc(-c2cccc(-c3nnn[n-]3)c2)cs1 ZINC000824086836 607770249 /nfs/dbraw/zinc/77/02/49/607770249.db2.gz NRUGIYLBCSQAKH-UHFFFAOYSA-N -1 3 356.455 3.755 20 0 FHADHM CC(C)(C)CCC(=O)Nc1nc(-c2cccc(-c3nn[n-]n3)c2)cs1 ZINC000824086836 607770250 /nfs/dbraw/zinc/77/02/50/607770250.db2.gz NRUGIYLBCSQAKH-UHFFFAOYSA-N -1 3 356.455 3.755 20 0 FHADHM CCCC1(C(=O)Nc2nc(-c3cccc(-c4nnn[n-]4)c3)cs2)CCC1 ZINC000825247106 607770289 /nfs/dbraw/zinc/77/02/89/607770289.db2.gz ARKAEZVBJMVHFA-UHFFFAOYSA-N -1 3 368.466 3.899 20 0 FHADHM CCCC1(C(=O)Nc2nc(-c3cccc(-c4nn[n-]n4)c3)cs2)CCC1 ZINC000825247106 607770290 /nfs/dbraw/zinc/77/02/90/607770290.db2.gz ARKAEZVBJMVHFA-UHFFFAOYSA-N -1 3 368.466 3.899 20 0 FHADHM Cc1ccc(C(=O)Nc2nc(-c3cccc(-c4nnn[n-]4)c3)cs2)cc1 ZINC000826282357 607770463 /nfs/dbraw/zinc/77/04/63/607770463.db2.gz KFNOYHOWEYPRAY-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1ccc(C(=O)Nc2nc(-c3cccc(-c4nn[n-]n4)c3)cs2)cc1 ZINC000826282357 607770464 /nfs/dbraw/zinc/77/04/64/607770464.db2.gz KFNOYHOWEYPRAY-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM O=C([O-])N[C@H]1C[C@H](NCc2ccc(N3CCCCC3)nc2)c2ccccc21 ZINC000834159872 605792574 /nfs/dbraw/zinc/79/25/74/605792574.db2.gz ZDJFEGNICDSYIK-OALUTQOASA-N -1 3 366.465 3.615 20 0 FHADHM Cc1noc(C)c1CCN[C@H](CNC(=O)[O-])c1ccc2ccccc2c1 ZINC000833931289 605973810 /nfs/dbraw/zinc/97/38/10/605973810.db2.gz OBIONUCZCAFWJR-LJQANCHMSA-N -1 3 353.422 3.586 20 0 FHADHM O=C([O-])N1CCC[C@@H]1[C@@H]1CCC[C@H]1NCc1coc(-c2cccs2)n1 ZINC000834107591 605989018 /nfs/dbraw/zinc/98/90/18/605989018.db2.gz MZROFIQBZSGTQL-RBSFLKMASA-N -1 3 361.467 3.804 20 0 FHADHM CC(C)Oc1ccc(CNc2nc3ccccc3cc2-c2nnn[n-]2)cc1 ZINC000820155598 606035942 /nfs/dbraw/zinc/03/59/42/606035942.db2.gz SKCRKOPZTBNIGC-UHFFFAOYSA-N -1 3 360.421 3.814 20 0 FHADHM CC(C)Oc1ccc(CNc2nc3ccccc3cc2-c2nn[n-]n2)cc1 ZINC000820155598 606035946 /nfs/dbraw/zinc/03/59/46/606035946.db2.gz SKCRKOPZTBNIGC-UHFFFAOYSA-N -1 3 360.421 3.814 20 0 FHADHM CC[C@H](C)[C@H](C)N(C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000820860572 606114961 /nfs/dbraw/zinc/11/49/61/606114961.db2.gz KBRHQELETVAIGK-MJBXVCDLSA-N -1 3 356.474 3.536 20 0 FHADHM CC[C@H](C)[C@H](C)N(C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000820860572 606114962 /nfs/dbraw/zinc/11/49/62/606114962.db2.gz KBRHQELETVAIGK-MJBXVCDLSA-N -1 3 356.474 3.536 20 0 FHADHM COc1ccccc1[C@@H]1CCCN1c1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000821889522 606125119 /nfs/dbraw/zinc/12/51/19/606125119.db2.gz BZFVSJHXEHSSKT-SFHVURJKSA-N -1 3 372.432 3.765 20 0 FHADHM COc1ccccc1[C@@H]1CCCN1c1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000821889522 606125121 /nfs/dbraw/zinc/12/51/21/606125121.db2.gz BZFVSJHXEHSSKT-SFHVURJKSA-N -1 3 372.432 3.765 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@H](CC)Oc2ccccc2C)s1 ZINC000821465683 606125995 /nfs/dbraw/zinc/12/59/95/606125995.db2.gz NMSWXYBHCCCZRD-AWEZNQCLSA-N -1 3 371.466 3.595 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@H](CC)Oc2ccccc2C)s1 ZINC000821465683 606125996 /nfs/dbraw/zinc/12/59/96/606125996.db2.gz NMSWXYBHCCCZRD-AWEZNQCLSA-N -1 3 371.466 3.595 20 0 FHADHM CC[C@@H](Oc1ccccc1C)C(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820938301 606127244 /nfs/dbraw/zinc/12/72/44/606127244.db2.gz IDIKATJQVOMDFY-RHSMWYFYSA-N -1 3 366.421 3.637 20 0 FHADHM CC[C@@H](Oc1ccccc1C)C(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820938301 606127246 /nfs/dbraw/zinc/12/72/46/606127246.db2.gz IDIKATJQVOMDFY-RHSMWYFYSA-N -1 3 366.421 3.637 20 0 FHADHM C[C@H](c1ccc(Cl)cc1)[C@@H](C)N(C)C(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000820562718 606149495 /nfs/dbraw/zinc/14/94/95/606149495.db2.gz ILWMCNYQMADADX-QWHCGFSZSA-N -1 3 369.856 3.784 20 0 FHADHM C[C@H](c1ccc(Cl)cc1)[C@@H](C)N(C)C(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC000820562718 606149497 /nfs/dbraw/zinc/14/94/97/606149497.db2.gz ILWMCNYQMADADX-QWHCGFSZSA-N -1 3 369.856 3.784 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1O[C@H](C)c1ncc(-c2ccccc2)o1 ZINC000821700364 606182482 /nfs/dbraw/zinc/18/24/82/606182482.db2.gz MAJBOXYYXWQAPG-GFCCVEGCSA-N -1 3 363.377 3.670 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1O[C@H](C)c1ncc(-c2ccccc2)o1 ZINC000821700364 606182483 /nfs/dbraw/zinc/18/24/83/606182483.db2.gz MAJBOXYYXWQAPG-GFCCVEGCSA-N -1 3 363.377 3.670 20 0 FHADHM CN(C(=O)c1ccc(-c2nnn[n-]2)cc1)C1c2ccccc2-c2ccccc21 ZINC000821573288 606183129 /nfs/dbraw/zinc/18/31/29/606183129.db2.gz JMICUAZLEFGPDS-UHFFFAOYSA-N -1 3 367.412 3.709 20 0 FHADHM CN(C(=O)c1ccc(-c2nn[n-]n2)cc1)C1c2ccccc2-c2ccccc21 ZINC000821573288 606183131 /nfs/dbraw/zinc/18/31/31/606183131.db2.gz JMICUAZLEFGPDS-UHFFFAOYSA-N -1 3 367.412 3.709 20 0 FHADHM CCC1(C(=O)Nc2nc(-c3ccc(-c4nnn[n-]4)cc3)cs2)CCC1 ZINC000820944327 606208578 /nfs/dbraw/zinc/20/85/78/606208578.db2.gz LCTBYRMFYWOMFG-UHFFFAOYSA-N -1 3 354.439 3.509 20 0 FHADHM CCC1(C(=O)Nc2nc(-c3ccc(-c4nn[n-]n4)cc3)cs2)CCC1 ZINC000820944327 606208580 /nfs/dbraw/zinc/20/85/80/606208580.db2.gz LCTBYRMFYWOMFG-UHFFFAOYSA-N -1 3 354.439 3.509 20 0 FHADHM CC(C)n1c2ccccc2nc1[C@@H]1CCCN1c1ncccc1-c1nnn[n-]1 ZINC000820211619 606239748 /nfs/dbraw/zinc/23/97/48/606239748.db2.gz TVLIUBCDQZULCV-KRWDZBQOSA-N -1 3 374.452 3.534 20 0 FHADHM CC(C)n1c2ccccc2nc1[C@@H]1CCCN1c1ncccc1-c1nn[n-]n1 ZINC000820211619 606239750 /nfs/dbraw/zinc/23/97/50/606239750.db2.gz TVLIUBCDQZULCV-KRWDZBQOSA-N -1 3 374.452 3.534 20 0 FHADHM C[C@H](c1ccccc1)N(Cc1ccccc1)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC000820570774 606263072 /nfs/dbraw/zinc/26/30/72/606263072.db2.gz RBDLTMXJKCTYMX-OAHLLOKOSA-N -1 3 372.432 3.598 20 0 FHADHM C[C@H](c1ccccc1)N(Cc1ccccc1)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC000820570774 606263073 /nfs/dbraw/zinc/26/30/73/606263073.db2.gz RBDLTMXJKCTYMX-OAHLLOKOSA-N -1 3 372.432 3.598 20 0 FHADHM CC[C@@H](C)N(C)C(=O)c1ccc(Sc2ccccc2-c2nnn[n-]2)cc1 ZINC000820875959 606318158 /nfs/dbraw/zinc/31/81/58/606318158.db2.gz JGKHYTXWHRIDFR-CYBMUJFWSA-N -1 3 367.478 3.888 20 0 FHADHM CC[C@@H](C)N(C)C(=O)c1ccc(Sc2ccccc2-c2nn[n-]n2)cc1 ZINC000820875959 606318160 /nfs/dbraw/zinc/31/81/60/606318160.db2.gz JGKHYTXWHRIDFR-CYBMUJFWSA-N -1 3 367.478 3.888 20 0 FHADHM Cc1cc(Cl)ccc1OCC(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000822202382 606341963 /nfs/dbraw/zinc/34/19/63/606341963.db2.gz XVGHWLQINAOSKA-GFCCVEGCSA-N -1 3 372.812 3.512 20 0 FHADHM Cc1cc(Cl)ccc1OCC(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000822202382 606341965 /nfs/dbraw/zinc/34/19/65/606341965.db2.gz XVGHWLQINAOSKA-GFCCVEGCSA-N -1 3 372.812 3.512 20 0 FHADHM Cc1[nH]c2ccccc2c1CC(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000822010057 606343699 /nfs/dbraw/zinc/34/36/99/606343699.db2.gz LNZNPQKESXIPNE-CYBMUJFWSA-N -1 3 361.405 3.503 20 0 FHADHM Cc1[nH]c2ccccc2c1CC(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000822010057 606343700 /nfs/dbraw/zinc/34/37/00/606343700.db2.gz LNZNPQKESXIPNE-CYBMUJFWSA-N -1 3 361.405 3.503 20 0 FHADHM C[C@H](OC(=O)CCc1c[nH]c2ccccc12)c1ccc(-c2nnn[n-]2)cc1 ZINC000820497876 606349317 /nfs/dbraw/zinc/34/93/17/606349317.db2.gz WAGMRWRTIFEDAB-ZDUSSCGKSA-N -1 3 361.405 3.585 20 0 FHADHM C[C@H](OC(=O)CCc1c[nH]c2ccccc12)c1ccc(-c2nn[n-]n2)cc1 ZINC000820497876 606349319 /nfs/dbraw/zinc/34/93/19/606349319.db2.gz WAGMRWRTIFEDAB-ZDUSSCGKSA-N -1 3 361.405 3.585 20 0 FHADHM C[C@@H](OC(=O)CCOc1ccccc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000820496692 606352454 /nfs/dbraw/zinc/35/24/54/606352454.db2.gz ODBNUCDOHVSXMV-GFCCVEGCSA-N -1 3 372.812 3.593 20 0 FHADHM C[C@@H](OC(=O)CCOc1ccccc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000820496692 606352455 /nfs/dbraw/zinc/35/24/55/606352455.db2.gz ODBNUCDOHVSXMV-GFCCVEGCSA-N -1 3 372.812 3.593 20 0 FHADHM Cc1nc(C(C)(C)C)sc1C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000822423773 606353734 /nfs/dbraw/zinc/35/37/34/606353734.db2.gz OLBBXFFWADAJQU-NSHDSACASA-N -1 3 371.466 3.847 20 0 FHADHM Cc1nc(C(C)(C)C)sc1C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000822423773 606353736 /nfs/dbraw/zinc/35/37/36/606353736.db2.gz OLBBXFFWADAJQU-NSHDSACASA-N -1 3 371.466 3.847 20 0 FHADHM C[C@H](CSc1ccccc1)C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820292825 606353842 /nfs/dbraw/zinc/35/38/42/606353842.db2.gz HSAQASXFPOXTLN-KGLIPLIRSA-N -1 3 368.462 3.899 20 0 FHADHM C[C@H](CSc1ccccc1)C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820292825 606353844 /nfs/dbraw/zinc/35/38/44/606353844.db2.gz HSAQASXFPOXTLN-KGLIPLIRSA-N -1 3 368.462 3.899 20 0 FHADHM C[C@@H](OC(=O)c1cnc(C(C)(C)C)s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820519474 606356270 /nfs/dbraw/zinc/35/62/70/606356270.db2.gz VAZMNQPKEGCEQR-SNVBAGLBSA-N -1 3 357.439 3.539 20 0 FHADHM C[C@@H](OC(=O)c1cnc(C(C)(C)C)s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820519474 606356272 /nfs/dbraw/zinc/35/62/72/606356272.db2.gz VAZMNQPKEGCEQR-SNVBAGLBSA-N -1 3 357.439 3.539 20 0 FHADHM CCSc1cccc(NC(=O)Nc2ccc(F)cc2-c2nnn[n-]2)c1 ZINC000821461460 606357338 /nfs/dbraw/zinc/35/73/38/606357338.db2.gz OXECECYCLMOIPJ-UHFFFAOYSA-N -1 3 358.402 3.762 20 0 FHADHM CCSc1cccc(NC(=O)Nc2ccc(F)cc2-c2nn[n-]n2)c1 ZINC000821461460 606357340 /nfs/dbraw/zinc/35/73/40/606357340.db2.gz OXECECYCLMOIPJ-UHFFFAOYSA-N -1 3 358.402 3.762 20 0 FHADHM CSC[C@@H](C)C(=O)Oc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000821956453 606359876 /nfs/dbraw/zinc/35/98/76/606359876.db2.gz PDAFJAVIZVWXPP-GFCCVEGCSA-N -1 3 370.434 3.564 20 0 FHADHM CSC[C@@H](C)C(=O)Oc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000821956453 606359877 /nfs/dbraw/zinc/35/98/77/606359877.db2.gz PDAFJAVIZVWXPP-GFCCVEGCSA-N -1 3 370.434 3.564 20 0 FHADHM COc1ccc(CCCC(=O)O[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000821790961 606360024 /nfs/dbraw/zinc/36/00/24/606360024.db2.gz XNBSFAJJRITTCX-CQSZACIVSA-N -1 3 366.421 3.502 20 0 FHADHM COc1ccc(CCCC(=O)O[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000821790961 606360026 /nfs/dbraw/zinc/36/00/26/606360026.db2.gz XNBSFAJJRITTCX-CQSZACIVSA-N -1 3 366.421 3.502 20 0 FHADHM Cc1c(C(=O)O[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cnc2ccccc12 ZINC000822021407 606395895 /nfs/dbraw/zinc/39/58/95/606395895.db2.gz ZPDTWRIICGFTNY-ZDUSSCGKSA-N -1 3 359.389 3.641 20 0 FHADHM Cc1c(C(=O)O[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cnc2ccccc12 ZINC000822021407 606395897 /nfs/dbraw/zinc/39/58/97/606395897.db2.gz ZPDTWRIICGFTNY-ZDUSSCGKSA-N -1 3 359.389 3.641 20 0 FHADHM c1cc(-c2nnn[n-]2)sc1CNc1ccc(COC2CCCC2)cc1 ZINC000823756465 606422920 /nfs/dbraw/zinc/42/29/20/606422920.db2.gz AHKWLKNWDOSHAW-UHFFFAOYSA-N -1 3 355.467 4.000 20 0 FHADHM Cc1cccc2c1ncc(-c1nnn[n-]1)c2N1CCc2sccc2[C@@H]1C ZINC000822334502 606444023 /nfs/dbraw/zinc/44/40/23/606444023.db2.gz DRCVJZXRNQLECM-LBPRGKRZSA-N -1 3 362.462 3.909 20 0 FHADHM Cc1cccc2c1ncc(-c1nn[n-]n1)c2N1CCc2sccc2[C@@H]1C ZINC000822334502 606444025 /nfs/dbraw/zinc/44/40/25/606444025.db2.gz DRCVJZXRNQLECM-LBPRGKRZSA-N -1 3 362.462 3.909 20 0 FHADHM Cc1cc(C)c2ncc(-c3nnn[n-]3)c(N3CCC[C@H]3c3cccnc3)c2c1 ZINC000822195221 606444480 /nfs/dbraw/zinc/44/44/80/606444480.db2.gz KLZDNCCLLZKGFT-SFHVURJKSA-N -1 3 371.448 3.768 20 0 FHADHM Cc1cc(C)c2ncc(-c3nn[n-]n3)c(N3CCC[C@H]3c3cccnc3)c2c1 ZINC000822195221 606444481 /nfs/dbraw/zinc/44/44/81/606444481.db2.gz KLZDNCCLLZKGFT-SFHVURJKSA-N -1 3 371.448 3.768 20 0 FHADHM Cc1ccc(NCc2cccc(-c3nnn[n-]3)c2)c(OCC(F)(F)F)c1 ZINC000822259342 606450600 /nfs/dbraw/zinc/45/06/00/606450600.db2.gz VDCUQIPXKHSILJ-UHFFFAOYSA-N -1 3 363.343 3.728 20 0 FHADHM Cc1ccc(NCc2cccc(-c3nn[n-]n3)c2)c(OCC(F)(F)F)c1 ZINC000822259342 606450602 /nfs/dbraw/zinc/45/06/02/606450602.db2.gz VDCUQIPXKHSILJ-UHFFFAOYSA-N -1 3 363.343 3.728 20 0 FHADHM Cc1cc(NCc2cccc(-c3nnn[n-]3)c2)ccc1OCC(F)(F)F ZINC000822209283 606460859 /nfs/dbraw/zinc/46/08/59/606460859.db2.gz BADKZPZWTXQLDQ-UHFFFAOYSA-N -1 3 363.343 3.728 20 0 FHADHM Cc1cc(NCc2cccc(-c3nn[n-]n3)c2)ccc1OCC(F)(F)F ZINC000822209283 606460861 /nfs/dbraw/zinc/46/08/61/606460861.db2.gz BADKZPZWTXQLDQ-UHFFFAOYSA-N -1 3 363.343 3.728 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1Oc1ccc(-c2cscn2)cc1 ZINC000822568404 606471536 /nfs/dbraw/zinc/47/15/36/606471536.db2.gz PKXWWJYQSYYGSI-UHFFFAOYSA-N -1 3 356.798 3.831 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1Oc1ccc(-c2cscn2)cc1 ZINC000822568404 606471538 /nfs/dbraw/zinc/47/15/38/606471538.db2.gz PKXWWJYQSYYGSI-UHFFFAOYSA-N -1 3 356.798 3.831 20 0 FHADHM CCCN(C(=O)c1cc(-c2nnn[n-]2)cs1)[C@@H](CC)c1ccccc1 ZINC000821081863 606492056 /nfs/dbraw/zinc/49/20/56/606492056.db2.gz CHTRZPIKOYQBNT-HNNXBMFYSA-N -1 3 355.467 3.932 20 0 FHADHM CCCN(C(=O)c1cc(-c2nn[n-]n2)cs1)[C@@H](CC)c1ccccc1 ZINC000821081863 606492057 /nfs/dbraw/zinc/49/20/57/606492057.db2.gz CHTRZPIKOYQBNT-HNNXBMFYSA-N -1 3 355.467 3.932 20 0 FHADHM O=C(N[C@H](c1ccccc1)C1CCCC1)c1cc(-c2nnn[n-]2)cs1 ZINC000823140355 606496304 /nfs/dbraw/zinc/49/63/04/606496304.db2.gz SZOMWSJMUXLHQN-MRXNPFEDSA-N -1 3 353.451 3.590 20 0 FHADHM O=C(N[C@H](c1ccccc1)C1CCCC1)c1cc(-c2nn[n-]n2)cs1 ZINC000823140355 606496305 /nfs/dbraw/zinc/49/63/05/606496305.db2.gz SZOMWSJMUXLHQN-MRXNPFEDSA-N -1 3 353.451 3.590 20 0 FHADHM Cc1ccc(-c2ccncc2)cc1NC(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000822214115 606502822 /nfs/dbraw/zinc/50/28/22/606502822.db2.gz PZSVNASIDOVJKJ-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1ccc(-c2ccncc2)cc1NC(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000822214115 606502824 /nfs/dbraw/zinc/50/28/24/606502824.db2.gz PZSVNASIDOVJKJ-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM CCc1c(C)sc(NC(=O)C2(Cc3ccccc3)CC2)c1-c1nnn[n-]1 ZINC000821465962 606505877 /nfs/dbraw/zinc/50/58/77/606505877.db2.gz RYPZUOBWFXJUMF-UHFFFAOYSA-N -1 3 367.478 3.760 20 0 FHADHM CCc1c(C)sc(NC(=O)C2(Cc3ccccc3)CC2)c1-c1nn[n-]n1 ZINC000821465962 606505878 /nfs/dbraw/zinc/50/58/78/606505878.db2.gz RYPZUOBWFXJUMF-UHFFFAOYSA-N -1 3 367.478 3.760 20 0 FHADHM O=C(Nc1ccc(OC2CCCCC2)cc1)c1cc(-c2nnn[n-]2)cs1 ZINC000823350397 606513208 /nfs/dbraw/zinc/51/32/08/606513208.db2.gz LOXOGOUOGCCTRH-UHFFFAOYSA-N -1 3 369.450 3.892 20 0 FHADHM O=C(Nc1ccc(OC2CCCCC2)cc1)c1cc(-c2nn[n-]n2)cs1 ZINC000823350397 606513210 /nfs/dbraw/zinc/51/32/10/606513210.db2.gz LOXOGOUOGCCTRH-UHFFFAOYSA-N -1 3 369.450 3.892 20 0 FHADHM O=C(NC(c1cccs1)c1cccs1)c1cc(-c2nnn[n-]2)cs1 ZINC000823139485 606515232 /nfs/dbraw/zinc/51/52/32/606515232.db2.gz GAVLWMUMYICJOL-UHFFFAOYSA-N -1 3 373.488 3.571 20 0 FHADHM O=C(NC(c1cccs1)c1cccs1)c1cc(-c2nn[n-]n2)cs1 ZINC000823139485 606515233 /nfs/dbraw/zinc/51/52/33/606515233.db2.gz GAVLWMUMYICJOL-UHFFFAOYSA-N -1 3 373.488 3.571 20 0 FHADHM CCC1(CNC(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)CCC1 ZINC000820962278 606552792 /nfs/dbraw/zinc/55/27/92/606552792.db2.gz MMWCSTQHSJENJQ-UHFFFAOYSA-N -1 3 361.449 3.844 20 0 FHADHM CCC1(CNC(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)CCC1 ZINC000820962278 606552793 /nfs/dbraw/zinc/55/27/93/606552793.db2.gz MMWCSTQHSJENJQ-UHFFFAOYSA-N -1 3 361.449 3.844 20 0 FHADHM CCc1ccc(CC)c(NC(=O)N(C)Cc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000821480770 606577533 /nfs/dbraw/zinc/57/75/33/606577533.db2.gz DWIAWGMVICYJMA-UHFFFAOYSA-N -1 3 364.453 3.655 20 0 FHADHM CCc1ccc(CC)c(NC(=O)N(C)Cc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000821480770 606577535 /nfs/dbraw/zinc/57/75/35/606577535.db2.gz DWIAWGMVICYJMA-UHFFFAOYSA-N -1 3 364.453 3.655 20 0 FHADHM CC(C)n1ccnc1SCc1ccc(-c2nnn[n-]2)cc1OC(F)F ZINC000820215542 606588549 /nfs/dbraw/zinc/58/85/49/606588549.db2.gz WPFCAILXHWVUNG-UHFFFAOYSA-N -1 3 366.397 3.538 20 0 FHADHM CC(C)n1ccnc1SCc1ccc(-c2nn[n-]n2)cc1OC(F)F ZINC000820215542 606588550 /nfs/dbraw/zinc/58/85/50/606588550.db2.gz WPFCAILXHWVUNG-UHFFFAOYSA-N -1 3 366.397 3.538 20 0 FHADHM Fc1cccnc1NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000822796801 606593210 /nfs/dbraw/zinc/59/32/10/606593210.db2.gz ZDPRCADKJAIUKO-UHFFFAOYSA-N -1 3 352.398 3.741 20 0 FHADHM Cc1cc(C)c(-c2nnn[n-]2)c(NC[C@H]2CCC[C@H](C(F)(F)F)C2)n1 ZINC000822192834 606594827 /nfs/dbraw/zinc/59/48/27/606594827.db2.gz CIYBQZUZTLLDLZ-RYUDHWBXSA-N -1 3 354.380 3.659 20 0 FHADHM Cc1cc(C)c(-c2nn[n-]n2)c(NC[C@H]2CCC[C@H](C(F)(F)F)C2)n1 ZINC000822192834 606594829 /nfs/dbraw/zinc/59/48/29/606594829.db2.gz CIYBQZUZTLLDLZ-RYUDHWBXSA-N -1 3 354.380 3.659 20 0 FHADHM C[C@H](C(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1)c1ccc2ccccc2c1 ZINC000819856661 606601677 /nfs/dbraw/zinc/60/16/77/606601677.db2.gz KBVONPKLLVVXAW-HNNXBMFYSA-N -1 3 371.444 3.782 20 0 FHADHM C[C@H](C(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1)c1ccc2ccccc2c1 ZINC000819856661 606601678 /nfs/dbraw/zinc/60/16/78/606601678.db2.gz KBVONPKLLVVXAW-HNNXBMFYSA-N -1 3 371.444 3.782 20 0 FHADHM Cc1cc(CCCC(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)c(C)s1 ZINC000822199832 606602685 /nfs/dbraw/zinc/60/26/85/606602685.db2.gz JIGRCNBZEWREEZ-UHFFFAOYSA-N -1 3 359.430 3.646 20 0 FHADHM Cc1cc(CCCC(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)c(C)s1 ZINC000822199832 606602686 /nfs/dbraw/zinc/60/26/86/606602686.db2.gz JIGRCNBZEWREEZ-UHFFFAOYSA-N -1 3 359.430 3.646 20 0 FHADHM COc1cccc([C@@H](C)CC(=O)O[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000821859271 606613045 /nfs/dbraw/zinc/61/30/45/606613045.db2.gz NNIOMBGPHXHERI-KBPBESRZSA-N -1 3 366.421 3.673 20 0 FHADHM COc1cccc([C@@H](C)CC(=O)O[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000821859271 606613046 /nfs/dbraw/zinc/61/30/46/606613046.db2.gz NNIOMBGPHXHERI-KBPBESRZSA-N -1 3 366.421 3.673 20 0 FHADHM Cc1cc(CCCC(=O)OCc2cccc(-c3nnn[n-]3)c2)c(C)s1 ZINC000822200043 606613150 /nfs/dbraw/zinc/61/31/50/606613150.db2.gz RVSVJNSPDDRNAC-UHFFFAOYSA-N -1 3 356.451 3.611 20 0 FHADHM Cc1cc(CCCC(=O)OCc2cccc(-c3nn[n-]n3)c2)c(C)s1 ZINC000822200043 606613152 /nfs/dbraw/zinc/61/31/52/606613152.db2.gz RVSVJNSPDDRNAC-UHFFFAOYSA-N -1 3 356.451 3.611 20 0 FHADHM c1csc(Oc2ccc(OCc3ccccc3-c3nnn[n-]3)cc2)n1 ZINC000823771587 606617272 /nfs/dbraw/zinc/61/72/72/606617272.db2.gz APNLTJNPHVYNFM-UHFFFAOYSA-N -1 3 351.391 3.695 20 0 FHADHM c1csc(Oc2ccc(OCc3ccccc3-c3nn[n-]n3)cc2)n1 ZINC000823771587 606617274 /nfs/dbraw/zinc/61/72/74/606617274.db2.gz APNLTJNPHVYNFM-UHFFFAOYSA-N -1 3 351.391 3.695 20 0 FHADHM c1ccc2c(c1)cccc2-c1noc(Cc2cccc(-c3nnn[n-]3)c2)n1 ZINC000823751613 606620484 /nfs/dbraw/zinc/62/04/84/606620484.db2.gz MXPOYVHNNGPMBK-UHFFFAOYSA-N -1 3 354.373 3.661 20 0 FHADHM c1ccc2c(c1)cccc2-c1noc(Cc2cccc(-c3nn[n-]n3)c2)n1 ZINC000823751613 606620485 /nfs/dbraw/zinc/62/04/85/606620485.db2.gz MXPOYVHNNGPMBK-UHFFFAOYSA-N -1 3 354.373 3.661 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)C/C=C/c2ccc(C)cc2)s1 ZINC000821465178 606622542 /nfs/dbraw/zinc/62/25/42/606622542.db2.gz CYUPLHOAEXVVSR-SNAWJCMRSA-N -1 3 353.451 3.841 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)C/C=C/c2ccc(C)cc2)s1 ZINC000821465178 606622544 /nfs/dbraw/zinc/62/25/44/606622544.db2.gz CYUPLHOAEXVVSR-SNAWJCMRSA-N -1 3 353.451 3.841 20 0 FHADHM O=C(Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1)C1CC(F)(F)C1 ZINC000823383122 606623177 /nfs/dbraw/zinc/62/31/77/606623177.db2.gz LZPLFWWUIXNZDD-UHFFFAOYSA-N -1 3 361.377 3.579 20 0 FHADHM O=C(Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1)C1CC(F)(F)C1 ZINC000823383122 606623179 /nfs/dbraw/zinc/62/31/79/606623179.db2.gz LZPLFWWUIXNZDD-UHFFFAOYSA-N -1 3 361.377 3.579 20 0 FHADHM CC[C@H](C)Oc1ccc(C(=O)N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000820875751 606626560 /nfs/dbraw/zinc/62/65/60/606626560.db2.gz DVZXBJXHFCFLPG-UONOGXRCSA-N -1 3 365.437 3.535 20 0 FHADHM CC[C@H](C)Oc1ccc(C(=O)N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000820875751 606626562 /nfs/dbraw/zinc/62/65/62/606626562.db2.gz DVZXBJXHFCFLPG-UONOGXRCSA-N -1 3 365.437 3.535 20 0 FHADHM CC(C)c1noc([C@H](C)Sc2ccc(Cl)cc2-c2nnn[n-]2)n1 ZINC000820211327 606628128 /nfs/dbraw/zinc/62/81/28/606628128.db2.gz IOWMWHCAARQGJU-QMMMGPOBSA-N -1 3 350.835 3.880 20 0 FHADHM CC(C)c1noc([C@H](C)Sc2ccc(Cl)cc2-c2nn[n-]n2)n1 ZINC000820211327 606628131 /nfs/dbraw/zinc/62/81/31/606628131.db2.gz IOWMWHCAARQGJU-QMMMGPOBSA-N -1 3 350.835 3.880 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)CC1CCCCCC1 ZINC000820117298 606629386 /nfs/dbraw/zinc/62/93/86/606629386.db2.gz ZTOHBDVKXLQADQ-UHFFFAOYSA-N -1 3 355.486 3.964 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)CC1CCCCCC1 ZINC000820117298 606629387 /nfs/dbraw/zinc/62/93/87/606629387.db2.gz ZTOHBDVKXLQADQ-UHFFFAOYSA-N -1 3 355.486 3.964 20 0 FHADHM CCCC[C@H](CCC)CNC(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1 ZINC000821040918 606632801 /nfs/dbraw/zinc/63/28/01/606632801.db2.gz VIYCMQQHKNOZDY-HNNXBMFYSA-N -1 3 358.490 3.615 20 0 FHADHM CCCC[C@H](CCC)CNC(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1 ZINC000821040918 606632802 /nfs/dbraw/zinc/63/28/02/606632802.db2.gz VIYCMQQHKNOZDY-HNNXBMFYSA-N -1 3 358.490 3.615 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1OCc1ncc(-c2ccccc2F)o1 ZINC000822136321 606637800 /nfs/dbraw/zinc/63/78/00/606637800.db2.gz LLNXYOFOWPYMKE-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM O=C(Oc1cc(Cl)ccc1Cl)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000823443974 606665022 /nfs/dbraw/zinc/66/50/22/606665022.db2.gz IIIGTFCITRNOPG-UHFFFAOYSA-N -1 3 371.130 3.671 20 0 FHADHM O=C(Oc1cc(Cl)ccc1Cl)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000823443974 606665023 /nfs/dbraw/zinc/66/50/23/606665023.db2.gz IIIGTFCITRNOPG-UHFFFAOYSA-N -1 3 371.130 3.671 20 0 FHADHM Cc1ccc(NC(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)c(C)n1 ZINC000822254442 606692990 /nfs/dbraw/zinc/69/29/90/606692990.db2.gz JXUGKADBTJMJIF-UHFFFAOYSA-N -1 3 370.416 3.798 20 0 FHADHM Cc1ccc(NC(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)c(C)n1 ZINC000822254442 606692991 /nfs/dbraw/zinc/69/29/91/606692991.db2.gz JXUGKADBTJMJIF-UHFFFAOYSA-N -1 3 370.416 3.798 20 0 FHADHM FC(F)(F)c1ccc(NCCc2ccc(Cl)nc2)c(-c2nnn[n-]2)c1 ZINC000822729239 606721816 /nfs/dbraw/zinc/72/18/16/606721816.db2.gz XDYOXZNGBVNWRH-UHFFFAOYSA-N -1 3 368.750 3.589 20 0 FHADHM FC(F)(F)c1ccc(NCCc2ccc(Cl)nc2)c(-c2nn[n-]n2)c1 ZINC000822729239 606721818 /nfs/dbraw/zinc/72/18/18/606721818.db2.gz XDYOXZNGBVNWRH-UHFFFAOYSA-N -1 3 368.750 3.589 20 0 FHADHM CCCC1(C(=O)NCc2cccc(-c3ccc(-c4nnn[n-]4)s3)c2)CC1 ZINC000821027168 606732562 /nfs/dbraw/zinc/73/25/62/606732562.db2.gz LFIXBTUJEQTEMF-UHFFFAOYSA-N -1 3 367.478 3.792 20 0 FHADHM Cc1cccc(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)c1F ZINC000822284081 606735024 /nfs/dbraw/zinc/73/50/24/606735024.db2.gz IVYZWJNCVNIMPF-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM Cc1cccc(C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)c1F ZINC000822284081 606735025 /nfs/dbraw/zinc/73/50/25/606735025.db2.gz IVYZWJNCVNIMPF-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM C[C@@H](OC(=O)c1c(F)cc(-c2nnn[n-]2)cc1F)c1ccc(Cl)cc1 ZINC000820500846 606754622 /nfs/dbraw/zinc/75/46/22/606754622.db2.gz GYZICALFIGKHFY-MRVPVSSYSA-N -1 3 364.739 3.716 20 0 FHADHM C[C@@H](OC(=O)c1c(F)cc(-c2nn[n-]n2)cc1F)c1ccc(Cl)cc1 ZINC000820500846 606754623 /nfs/dbraw/zinc/75/46/23/606754623.db2.gz GYZICALFIGKHFY-MRVPVSSYSA-N -1 3 364.739 3.716 20 0 FHADHM CC(C)C[C@@H](OC(=O)CCc1ccc(-c2nnn[n-]2)cc1)c1ccccn1 ZINC000820063655 606763751 /nfs/dbraw/zinc/76/37/51/606763751.db2.gz YELQBKPJLFVYBI-GOSISDBHSA-N -1 3 365.437 3.525 20 0 FHADHM CC(C)C[C@@H](OC(=O)CCc1ccc(-c2nn[n-]n2)cc1)c1ccccn1 ZINC000820063655 606763752 /nfs/dbraw/zinc/76/37/52/606763752.db2.gz YELQBKPJLFVYBI-GOSISDBHSA-N -1 3 365.437 3.525 20 0 FHADHM CC(C)(C)OCCCNc1ccccc1Oc1ncccc1-c1nnn[n-]1 ZINC000819949945 606764258 /nfs/dbraw/zinc/76/42/58/606764258.db2.gz DGXCDRXYGOKUBP-UHFFFAOYSA-N -1 3 368.441 3.671 20 0 FHADHM Fc1ccc(-c2nc(COc3cc(Cl)ccc3-c3nnn[n-]3)co2)cc1 ZINC000822753633 606783301 /nfs/dbraw/zinc/78/33/01/606783301.db2.gz QNMOETUZLPFYPO-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM Fc1ccc(-c2nc(COc3cc(Cl)ccc3-c3nn[n-]n3)co2)cc1 ZINC000822753633 606783303 /nfs/dbraw/zinc/78/33/03/606783303.db2.gz QNMOETUZLPFYPO-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM Cc1ccc(C)c([C@@H]2CCCN2C(=O)c2cc(-c3nnn[n-]3)cs2)c1 ZINC000822230748 606807668 /nfs/dbraw/zinc/80/76/68/606807668.db2.gz PDLJHTVXSIZMLP-HNNXBMFYSA-N -1 3 353.451 3.522 20 0 FHADHM Cc1ccc(C)c([C@@H]2CCCN2C(=O)c2cc(-c3nn[n-]n3)cs2)c1 ZINC000822230748 606807669 /nfs/dbraw/zinc/80/76/69/606807669.db2.gz PDLJHTVXSIZMLP-HNNXBMFYSA-N -1 3 353.451 3.522 20 0 FHADHM C[C@H](SCc1ccccc1-c1nnn[n-]1)c1nc(-c2ccccc2)no1 ZINC000820548514 606827740 /nfs/dbraw/zinc/82/77/40/606827740.db2.gz BBHVAPSHCAXHSN-LBPRGKRZSA-N -1 3 364.434 3.911 20 0 FHADHM C[C@H](SCc1ccccc1-c1nn[n-]n1)c1nc(-c2ccccc2)no1 ZINC000820548514 606827741 /nfs/dbraw/zinc/82/77/41/606827741.db2.gz BBHVAPSHCAXHSN-LBPRGKRZSA-N -1 3 364.434 3.911 20 0 FHADHM Clc1ncccc1CSCCCOc1cccc(-c2nnn[n-]2)c1 ZINC000822590701 606841051 /nfs/dbraw/zinc/84/10/51/606841051.db2.gz NAKOFBOGDDUXAY-UHFFFAOYSA-N -1 3 361.858 3.617 20 0 FHADHM Clc1ncccc1CSCCCOc1cccc(-c2nn[n-]n2)c1 ZINC000822590701 606841053 /nfs/dbraw/zinc/84/10/53/606841053.db2.gz NAKOFBOGDDUXAY-UHFFFAOYSA-N -1 3 361.858 3.617 20 0 FHADHM COc1c(C)cnc(CSc2ccc(-c3nnn[n-]3)cc2Cl)c1C ZINC000821698370 606851756 /nfs/dbraw/zinc/85/17/56/606851756.db2.gz GTPZGZBVUCUZAO-UHFFFAOYSA-N -1 3 361.858 3.833 20 0 FHADHM COc1c(C)cnc(CSc2ccc(-c3nn[n-]n3)cc2Cl)c1C ZINC000821698370 606851757 /nfs/dbraw/zinc/85/17/57/606851757.db2.gz GTPZGZBVUCUZAO-UHFFFAOYSA-N -1 3 361.858 3.833 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nnn[n-]2)c1)c1cccc(Cl)c1F ZINC000823331232 606853527 /nfs/dbraw/zinc/85/35/27/606853527.db2.gz CWROSCOOEXVLCQ-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nn[n-]n2)c1)c1cccc(Cl)c1F ZINC000823331232 606853529 /nfs/dbraw/zinc/85/35/29/606853529.db2.gz CWROSCOOEXVLCQ-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM CC(C)C[C@H]1CCCCN1C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820063229 606870599 /nfs/dbraw/zinc/87/05/99/606870599.db2.gz UMSKVGLMVCVJFM-WMLDXEAASA-N -1 3 356.474 3.538 20 0 FHADHM CC(C)C[C@H]1CCCCN1C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820063229 606870600 /nfs/dbraw/zinc/87/06/00/606870600.db2.gz UMSKVGLMVCVJFM-WMLDXEAASA-N -1 3 356.474 3.538 20 0 FHADHM C[C@@H](NC(=O)OC(C)(C)C)c1nc(-c2ccc(-c3nnn[n-]3)cc2)cs1 ZINC000820385548 606876438 /nfs/dbraw/zinc/87/64/38/606876438.db2.gz UBBKIHJZVATXJA-SNVBAGLBSA-N -1 3 372.454 3.576 20 0 FHADHM C[C@@H](NC(=O)OC(C)(C)C)c1nc(-c2ccc(-c3nn[n-]n3)cc2)cs1 ZINC000820385548 606876439 /nfs/dbraw/zinc/87/64/39/606876439.db2.gz UBBKIHJZVATXJA-SNVBAGLBSA-N -1 3 372.454 3.576 20 0 FHADHM CCC[C@@H]1CCCN(C(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(C)C)C1 ZINC000821041125 606905649 /nfs/dbraw/zinc/90/56/49/606905649.db2.gz ZJTZWXBBXRDOIE-CQSZACIVSA-N -1 3 372.473 3.698 20 0 FHADHM CCC[C@@H]1CCCN(C(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(C)C)C1 ZINC000821041125 606905651 /nfs/dbraw/zinc/90/56/51/606905651.db2.gz ZJTZWXBBXRDOIE-CQSZACIVSA-N -1 3 372.473 3.698 20 0 FHADHM CCc1nc2c(s1)[C@H](N(C)Cc1ccc(-c3nnn[n-]3)cc1F)CCC2 ZINC000821509656 606933672 /nfs/dbraw/zinc/93/36/72/606933672.db2.gz KMXZDQUHQXOICI-OAHLLOKOSA-N -1 3 372.473 3.534 20 0 FHADHM CCc1nc2c(s1)[C@H](N(C)Cc1ccc(-c3nn[n-]n3)cc1F)CCC2 ZINC000821509656 606933674 /nfs/dbraw/zinc/93/36/74/606933674.db2.gz KMXZDQUHQXOICI-OAHLLOKOSA-N -1 3 372.473 3.534 20 0 FHADHM C[C@H](NC(=O)Nc1cc(F)cc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820372865 606954553 /nfs/dbraw/zinc/95/45/53/606954553.db2.gz COEKAIOMZBKPMJ-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM C[C@H](NC(=O)Nc1cc(F)cc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820372865 606954554 /nfs/dbraw/zinc/95/45/54/606954554.db2.gz COEKAIOMZBKPMJ-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM C[C@H](c1nc2ccccc2s1)N(C)Cc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000820570865 606958691 /nfs/dbraw/zinc/95/86/91/606958691.db2.gz SBAVBZYHKCMARY-LLVKDONJSA-N -1 3 368.441 3.809 20 0 FHADHM C[C@H](c1nc2ccccc2s1)N(C)Cc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000820570865 606958692 /nfs/dbraw/zinc/95/86/92/606958692.db2.gz SBAVBZYHKCMARY-LLVKDONJSA-N -1 3 368.441 3.809 20 0 FHADHM CC(C)Cc1ccc(C(=O)N(C)c2cc(Cl)ccc2-c2nnn[n-]2)cc1 ZINC000820108755 606960459 /nfs/dbraw/zinc/96/04/59/606960459.db2.gz QWEAALQNDYHSCS-UHFFFAOYSA-N -1 3 369.856 3.995 20 0 FHADHM CC(C)Cc1ccc(C(=O)N(C)c2cc(Cl)ccc2-c2nn[n-]n2)cc1 ZINC000820108755 606960460 /nfs/dbraw/zinc/96/04/60/606960460.db2.gz QWEAALQNDYHSCS-UHFFFAOYSA-N -1 3 369.856 3.995 20 0 FHADHM Cc1ccccc1[C@H](C)CC(=O)N(C)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000822345846 606961506 /nfs/dbraw/zinc/96/15/06/606961506.db2.gz ULKVYUCABVGYTB-CYBMUJFWSA-N -1 3 369.856 3.985 20 0 FHADHM Cc1ccccc1[C@H](C)CC(=O)N(C)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000822345846 606961509 /nfs/dbraw/zinc/96/15/09/606961509.db2.gz ULKVYUCABVGYTB-CYBMUJFWSA-N -1 3 369.856 3.985 20 0 FHADHM C[C@@H](Cc1ccc(F)cc1)C(=O)N(C)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000820292421 606962348 /nfs/dbraw/zinc/96/23/48/606962348.db2.gz FRMSWFPTZGFAPQ-NSHDSACASA-N -1 3 373.819 3.501 20 0 FHADHM C[C@@H](Cc1ccc(F)cc1)C(=O)N(C)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000820292421 606962350 /nfs/dbraw/zinc/96/23/50/606962350.db2.gz FRMSWFPTZGFAPQ-NSHDSACASA-N -1 3 373.819 3.501 20 0 FHADHM CN(C(=O)c1cccc(Cl)c1F)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821574464 606963719 /nfs/dbraw/zinc/96/37/19/606963719.db2.gz HYDZKEFSVNTCHM-UHFFFAOYSA-N -1 3 366.183 3.589 20 0 FHADHM CN(C(=O)c1cccc(Cl)c1F)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821574464 606963721 /nfs/dbraw/zinc/96/37/21/606963721.db2.gz HYDZKEFSVNTCHM-UHFFFAOYSA-N -1 3 366.183 3.589 20 0 FHADHM Cc1ccccc1[C@@H](C)CC(=O)N(C)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000822345847 606963765 /nfs/dbraw/zinc/96/37/65/606963765.db2.gz ULKVYUCABVGYTB-ZDUSSCGKSA-N -1 3 369.856 3.985 20 0 FHADHM Cc1ccccc1[C@@H](C)CC(=O)N(C)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000822345847 606963767 /nfs/dbraw/zinc/96/37/67/606963767.db2.gz ULKVYUCABVGYTB-ZDUSSCGKSA-N -1 3 369.856 3.985 20 0 FHADHM CCCc1ccc(C(=O)N(C)c2cc(Cl)ccc2-c2nnn[n-]2)cc1 ZINC000821139245 606964004 /nfs/dbraw/zinc/96/40/04/606964004.db2.gz REVSCXGFSIUDCZ-UHFFFAOYSA-N -1 3 355.829 3.749 20 0 FHADHM CCCc1ccc(C(=O)N(C)c2cc(Cl)ccc2-c2nn[n-]n2)cc1 ZINC000821139245 606964005 /nfs/dbraw/zinc/96/40/05/606964005.db2.gz REVSCXGFSIUDCZ-UHFFFAOYSA-N -1 3 355.829 3.749 20 0 FHADHM Cc1c2ccccc2oc1C(=O)N(C)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000822015960 606965582 /nfs/dbraw/zinc/96/55/82/606965582.db2.gz RFJNFHSUHBYSCH-UHFFFAOYSA-N -1 3 367.796 3.851 20 0 FHADHM Cc1c2ccccc2oc1C(=O)N(C)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000822015960 606965583 /nfs/dbraw/zinc/96/55/83/606965583.db2.gz RFJNFHSUHBYSCH-UHFFFAOYSA-N -1 3 367.796 3.851 20 0 FHADHM Fc1ccc([C@@H]2CCCN2Cc2ccc(F)c(-c3nnn[n-]3)c2)cc1F ZINC000822767179 606972402 /nfs/dbraw/zinc/97/24/02/606972402.db2.gz ZAFYJNMYSJXUNJ-KRWDZBQOSA-N -1 3 359.355 3.621 20 0 FHADHM Fc1ccc([C@@H]2CCCN2Cc2ccc(F)c(-c3nn[n-]n3)c2)cc1F ZINC000822767179 606972404 /nfs/dbraw/zinc/97/24/04/606972404.db2.gz ZAFYJNMYSJXUNJ-KRWDZBQOSA-N -1 3 359.355 3.621 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1N[C@@H](C)c1cccc(Br)c1 ZINC000821766412 606975926 /nfs/dbraw/zinc/97/59/26/606975926.db2.gz WGQSJQLXCOUMLY-JTQLQIEISA-N -1 3 374.242 3.811 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1N[C@@H](C)c1cccc(Br)c1 ZINC000821766412 606975928 /nfs/dbraw/zinc/97/59/28/606975928.db2.gz WGQSJQLXCOUMLY-JTQLQIEISA-N -1 3 374.242 3.811 20 0 FHADHM CC(C)c1ccc(NC(=O)CSc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000820192515 607012575 /nfs/dbraw/zinc/01/25/75/607012575.db2.gz RBPYABZLWCLTEX-UHFFFAOYSA-N -1 3 353.451 3.721 20 0 FHADHM CC(C)c1ccc(NC(=O)CSc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000820192515 607012577 /nfs/dbraw/zinc/01/25/77/607012577.db2.gz RBPYABZLWCLTEX-UHFFFAOYSA-N -1 3 353.451 3.721 20 0 FHADHM COc1ccc(C(=O)CSc2cccc(-c3nnn[n-]3)c2)cc1Cl ZINC000821769191 607014174 /nfs/dbraw/zinc/01/41/74/607014174.db2.gz FGHNGRKNPRDEGN-UHFFFAOYSA-N -1 3 360.826 3.504 20 0 FHADHM COc1ccc(C(=O)CSc2cccc(-c3nn[n-]n3)c2)cc1Cl ZINC000821769191 607014175 /nfs/dbraw/zinc/01/41/75/607014175.db2.gz FGHNGRKNPRDEGN-UHFFFAOYSA-N -1 3 360.826 3.504 20 0 FHADHM CCC[C@@H](NC(=O)CSc1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000821021783 607017102 /nfs/dbraw/zinc/01/71/02/607017102.db2.gz OZOKFMCMBCFOGL-QGZVFWFLSA-N -1 3 367.478 3.616 20 0 FHADHM CCC[C@@H](NC(=O)CSc1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000821021783 607017104 /nfs/dbraw/zinc/01/71/04/607017104.db2.gz OZOKFMCMBCFOGL-QGZVFWFLSA-N -1 3 367.478 3.616 20 0 FHADHM Cc1ccc(NC(=O)[C@H](C)Sc2cccc(-c3nnn[n-]3)c2)c(Cl)c1 ZINC000822242369 607017698 /nfs/dbraw/zinc/01/76/98/607017698.db2.gz JMHMCIBITFAMIY-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM Cc1ccc(NC(=O)[C@H](C)Sc2cccc(-c3nn[n-]n3)c2)c(Cl)c1 ZINC000822242369 607017700 /nfs/dbraw/zinc/01/77/00/607017700.db2.gz JMHMCIBITFAMIY-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccc(-c2ccco2)s1 ZINC000823337672 607022127 /nfs/dbraw/zinc/02/21/27/607022127.db2.gz QDNBAZCKZZVECV-UHFFFAOYSA-N -1 3 355.354 3.580 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccc(-c2ccco2)s1 ZINC000823337672 607022128 /nfs/dbraw/zinc/02/21/28/607022128.db2.gz QDNBAZCKZZVECV-UHFFFAOYSA-N -1 3 355.354 3.580 20 0 FHADHM Cc1cc(C)n(-c2ccc([C@H](C)Nc3ccc(-c4nn[n-]n4)cc3)cc2)n1 ZINC000822197565 607027777 /nfs/dbraw/zinc/02/77/77/607027777.db2.gz GCZQZAKOUINYSR-HNNXBMFYSA-N -1 3 359.437 3.842 20 0 FHADHM CC(C)C[C@H]1CCCN(C(=O)Nc2cc(-c3nnn[n-]3)cn2C(C)(C)C)C1 ZINC000820069138 607033726 /nfs/dbraw/zinc/03/37/26/607033726.db2.gz WMAYMLAFWWTKAT-CQSZACIVSA-N -1 3 373.505 3.713 20 0 FHADHM CC(C)C[C@H]1CCCN(C(=O)Nc2cc(-c3nn[n-]n3)cn2C(C)(C)C)C1 ZINC000820069138 607033727 /nfs/dbraw/zinc/03/37/27/607033727.db2.gz WMAYMLAFWWTKAT-CQSZACIVSA-N -1 3 373.505 3.713 20 0 FHADHM CCOc1cc(Cl)ccc1NC(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000821394587 607034294 /nfs/dbraw/zinc/03/42/94/607034294.db2.gz MHVSYKRRLLYLIC-UHFFFAOYSA-N -1 3 358.789 3.563 20 0 FHADHM CCOc1cc(Cl)ccc1NC(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000821394587 607034296 /nfs/dbraw/zinc/03/42/96/607034296.db2.gz MHVSYKRRLLYLIC-UHFFFAOYSA-N -1 3 358.789 3.563 20 0 FHADHM Cc1cc(Oc2ncc(-c3nnn[n-]3)cc2Cl)ccc1Br ZINC000822211897 607043727 /nfs/dbraw/zinc/04/37/27/607043727.db2.gz SKNQBXYQBSLATL-UHFFFAOYSA-N -1 3 366.606 3.778 20 0 FHADHM Cc1cc(Oc2ncc(-c3nn[n-]n3)cc2Cl)ccc1Br ZINC000822211897 607043729 /nfs/dbraw/zinc/04/37/29/607043729.db2.gz SKNQBXYQBSLATL-UHFFFAOYSA-N -1 3 366.606 3.778 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)C1(c2c(Cl)cccc2Cl)CC1 ZINC000468789205 607051823 /nfs/dbraw/zinc/05/18/23/607051823.db2.gz CORGPIPSIYIMLY-UHFFFAOYSA-N -1 3 374.231 3.844 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)C1(c2c(Cl)cccc2Cl)CC1 ZINC000468789205 607051826 /nfs/dbraw/zinc/05/18/26/607051826.db2.gz CORGPIPSIYIMLY-UHFFFAOYSA-N -1 3 374.231 3.844 20 0 FHADHM C[C@H]1CC[C@@H](CC(=O)N(Cc2ccco2)c2ccccc2-c2nnn[n-]2)C1 ZINC000820684171 607054757 /nfs/dbraw/zinc/05/47/57/607054757.db2.gz MSNVAQSFBRCQJX-LSDHHAIUSA-N -1 3 365.437 3.819 20 0 FHADHM C[C@H]1CC[C@@H](CC(=O)N(Cc2ccco2)c2ccccc2-c2nn[n-]n2)C1 ZINC000820684171 607054759 /nfs/dbraw/zinc/05/47/59/607054759.db2.gz MSNVAQSFBRCQJX-LSDHHAIUSA-N -1 3 365.437 3.819 20 0 FHADHM C[C@H]1CN(c2ccc(-c3nnn[n-]3)c(Cl)c2)C[C@H](c2ccsc2)O1 ZINC000820768573 607115997 /nfs/dbraw/zinc/11/59/97/607115997.db2.gz ODCKUKXRWIDTNS-ZUZCIYMTSA-N -1 3 361.858 3.548 20 0 FHADHM C[C@H]1CN(c2ccc(-c3nn[n-]n3)c(Cl)c2)C[C@H](c2ccsc2)O1 ZINC000820768573 607115999 /nfs/dbraw/zinc/11/59/99/607115999.db2.gz ODCKUKXRWIDTNS-ZUZCIYMTSA-N -1 3 361.858 3.548 20 0 FHADHM C[C@H](OC(=O)/C=C\SCc1ccco1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488895 607131125 /nfs/dbraw/zinc/13/11/25/607131125.db2.gz WGLDHCNHTQLKSP-CUZBXDDWSA-N -1 3 356.407 3.511 20 0 FHADHM C[C@H](OC(=O)/C=C\SCc1ccco1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488895 607131127 /nfs/dbraw/zinc/13/11/27/607131127.db2.gz WGLDHCNHTQLKSP-CUZBXDDWSA-N -1 3 356.407 3.511 20 0 FHADHM c1ccc2nc(N[C@@H]3CCOC4(CCCCC4)C3)c(-c3nnn[n-]3)cc2c1 ZINC000823802400 607131629 /nfs/dbraw/zinc/13/16/29/607131629.db2.gz LZVPXVRRVGBJDK-OAHLLOKOSA-N -1 3 364.453 3.709 20 0 FHADHM c1ccc2nc(N[C@@H]3CCOC4(CCCCC4)C3)c(-c3nn[n-]n3)cc2c1 ZINC000823802400 607131630 /nfs/dbraw/zinc/13/16/30/607131630.db2.gz LZVPXVRRVGBJDK-OAHLLOKOSA-N -1 3 364.453 3.709 20 0 FHADHM O=C([C@H]1CC12CCC2)N(Cc1ccccc1)c1ccccc1-c1nnn[n-]1 ZINC000822916902 607144585 /nfs/dbraw/zinc/14/45/85/607144585.db2.gz HYEVYQQDSBFEFC-QGZVFWFLSA-N -1 3 359.433 3.590 20 0 FHADHM O=C([C@H]1CC12CCC2)N(Cc1ccccc1)c1ccccc1-c1nn[n-]n1 ZINC000822916902 607144587 /nfs/dbraw/zinc/14/45/87/607144587.db2.gz HYEVYQQDSBFEFC-QGZVFWFLSA-N -1 3 359.433 3.590 20 0 FHADHM CCCC1(C(=O)Nc2ccc(Oc3cccc(-c4nnn[n-]4)c3)nc2)CC1 ZINC000821027602 607154918 /nfs/dbraw/zinc/15/49/18/607154918.db2.gz OIECWTGLGWUDFC-UHFFFAOYSA-N -1 3 364.409 3.573 20 0 FHADHM CCCC1(C(=O)Nc2ccc(Oc3cccc(-c4nn[n-]n4)c3)nc2)CC1 ZINC000821027602 607154919 /nfs/dbraw/zinc/15/49/19/607154919.db2.gz OIECWTGLGWUDFC-UHFFFAOYSA-N -1 3 364.409 3.573 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)c1ccc2sccc2c1 ZINC000819976238 607156623 /nfs/dbraw/zinc/15/66/23/607156623.db2.gz RJRPPBXBHILSQT-UHFFFAOYSA-N -1 3 366.450 3.890 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)c1ccc2sccc2c1 ZINC000819976238 607156624 /nfs/dbraw/zinc/15/66/24/607156624.db2.gz RJRPPBXBHILSQT-UHFFFAOYSA-N -1 3 366.450 3.890 20 0 FHADHM CCc1cc(C)c(C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)CC(C)C)o1 ZINC000821471204 607156681 /nfs/dbraw/zinc/15/66/81/607156681.db2.gz WZBYGOLICGRTIJ-UHFFFAOYSA-N -1 3 367.453 3.629 20 0 FHADHM CCc1cc(C)c(C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)CC(C)C)o1 ZINC000821471204 607156682 /nfs/dbraw/zinc/15/66/82/607156682.db2.gz WZBYGOLICGRTIJ-UHFFFAOYSA-N -1 3 367.453 3.629 20 0 FHADHM C[C@H]1CCc2sc(C(=O)Nc3ccc(-c4nnn[n-]4)cc3Cl)cc2C1 ZINC000820733486 607189681 /nfs/dbraw/zinc/18/96/81/607189681.db2.gz GIYZSZZCKTZKIE-VIFPVBQESA-N -1 3 373.869 3.959 20 0 FHADHM C[C@H]1CCc2sc(C(=O)Nc3ccc(-c4nn[n-]n4)cc3Cl)cc2C1 ZINC000820733486 607189682 /nfs/dbraw/zinc/18/96/82/607189682.db2.gz GIYZSZZCKTZKIE-VIFPVBQESA-N -1 3 373.869 3.959 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000823315625 607190503 /nfs/dbraw/zinc/19/05/03/607190503.db2.gz ZUEXTIDWIUKPDP-NXEZZACHSA-N -1 3 373.766 3.827 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000823315625 607190504 /nfs/dbraw/zinc/19/05/04/607190504.db2.gz ZUEXTIDWIUKPDP-NXEZZACHSA-N -1 3 373.766 3.827 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccc(OCC2CC2)cc1 ZINC000823319102 607191289 /nfs/dbraw/zinc/19/12/89/607191289.db2.gz RBEXVBYQUGZUCB-UHFFFAOYSA-N -1 3 369.812 3.561 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccc(OCC2CC2)cc1 ZINC000823319102 607191290 /nfs/dbraw/zinc/19/12/90/607191290.db2.gz RBEXVBYQUGZUCB-UHFFFAOYSA-N -1 3 369.812 3.561 20 0 FHADHM CCc1cc(C)c(C(=O)N(CC(C)C)c2ccc(-c3nnn[n-]3)cc2)o1 ZINC000821471235 607192352 /nfs/dbraw/zinc/19/23/52/607192352.db2.gz XHNUPFMLYFUZPI-UHFFFAOYSA-N -1 3 353.426 3.633 20 0 FHADHM CCc1cc(C)c(C(=O)N(CC(C)C)c2ccc(-c3nn[n-]n3)cc2)o1 ZINC000821471235 607192353 /nfs/dbraw/zinc/19/23/53/607192353.db2.gz XHNUPFMLYFUZPI-UHFFFAOYSA-N -1 3 353.426 3.633 20 0 FHADHM CCN(Cc1ccc(C)cc1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000821221671 607195729 /nfs/dbraw/zinc/19/57/29/607195729.db2.gz LMLFRSIZJWOKDL-UHFFFAOYSA-N -1 3 370.844 3.883 20 0 FHADHM CCN(Cc1ccc(C)cc1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000821221671 607195730 /nfs/dbraw/zinc/19/57/30/607195730.db2.gz LMLFRSIZJWOKDL-UHFFFAOYSA-N -1 3 370.844 3.883 20 0 FHADHM Cc1ccc2c(c1)CC[C@H]2NC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822274605 607196595 /nfs/dbraw/zinc/19/65/95/607196595.db2.gz CLZTWPZFLUBVJZ-OAHLLOKOSA-N -1 3 368.828 3.638 20 0 FHADHM Cc1ccc2c(c1)CC[C@H]2NC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822274605 607196596 /nfs/dbraw/zinc/19/65/96/607196596.db2.gz CLZTWPZFLUBVJZ-OAHLLOKOSA-N -1 3 368.828 3.638 20 0 FHADHM Cc1cc([C@H](C)NC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)ccc1F ZINC000822191316 607196826 /nfs/dbraw/zinc/19/68/26/607196826.db2.gz IEEGXEBIDNYRQO-JTQLQIEISA-N -1 3 374.807 3.850 20 0 FHADHM Cc1cc([C@H](C)NC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)ccc1F ZINC000822191316 607196827 /nfs/dbraw/zinc/19/68/27/607196827.db2.gz IEEGXEBIDNYRQO-JTQLQIEISA-N -1 3 374.807 3.850 20 0 FHADHM CCC[C@H](C)[C@@H]1CCCN1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000821015621 607197424 /nfs/dbraw/zinc/19/74/24/607197424.db2.gz RMUHDGVVZMZCJK-NHYWBVRUSA-N -1 3 362.865 3.953 20 0 FHADHM CCC[C@H](C)[C@@H]1CCCN1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000821015621 607197425 /nfs/dbraw/zinc/19/74/25/607197425.db2.gz RMUHDGVVZMZCJK-NHYWBVRUSA-N -1 3 362.865 3.953 20 0 FHADHM Cc1cccc2c1CC[C@H]2NC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822341404 607201240 /nfs/dbraw/zinc/20/12/40/607201240.db2.gz XBLQAXFHYYQXCN-OAHLLOKOSA-N -1 3 368.828 3.638 20 0 FHADHM Cc1cccc2c1CC[C@H]2NC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822341404 607201241 /nfs/dbraw/zinc/20/12/41/607201241.db2.gz XBLQAXFHYYQXCN-OAHLLOKOSA-N -1 3 368.828 3.638 20 0 FHADHM Cc1cccc(-c2cncc(C(=O)N(C)c3cccc(-c4nnn[n-]4)c3)c2)c1 ZINC000822283797 607210694 /nfs/dbraw/zinc/21/06/94/607210694.db2.gz CVQMEKXKOYPMLC-UHFFFAOYSA-N -1 3 370.416 3.514 20 0 FHADHM Cc1cccc(-c2cncc(C(=O)N(C)c3cccc(-c4nn[n-]n4)c3)c2)c1 ZINC000822283797 607210695 /nfs/dbraw/zinc/21/06/95/607210695.db2.gz CVQMEKXKOYPMLC-UHFFFAOYSA-N -1 3 370.416 3.514 20 0 FHADHM Cc1nc(CSc2nc3c(cc2-c2nnn[n-]2)CCCC3)sc1C ZINC000822449988 607224329 /nfs/dbraw/zinc/22/43/29/607224329.db2.gz XWTHXROWQIJPOA-UHFFFAOYSA-N -1 3 358.496 3.506 20 0 FHADHM Cc1nc(CSc2nc3c(cc2-c2nn[n-]n2)CCCC3)sc1C ZINC000822449988 607224330 /nfs/dbraw/zinc/22/43/30/607224330.db2.gz XWTHXROWQIJPOA-UHFFFAOYSA-N -1 3 358.496 3.506 20 0 FHADHM CC[C@H](Oc1cccc(C)c1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820939760 607241985 /nfs/dbraw/zinc/24/19/85/607241985.db2.gz XUGLNAZPKGGHPC-INIZCTEOSA-N -1 3 371.828 3.625 20 0 FHADHM CC[C@H](Oc1cccc(C)c1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820939760 607241986 /nfs/dbraw/zinc/24/19/86/607241986.db2.gz XUGLNAZPKGGHPC-INIZCTEOSA-N -1 3 371.828 3.625 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccccc1OCC1CC1 ZINC000823318883 607242736 /nfs/dbraw/zinc/24/27/36/607242736.db2.gz MWNAVFDJGDQMGB-UHFFFAOYSA-N -1 3 369.812 3.561 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccccc1OCC1CC1 ZINC000823318883 607242737 /nfs/dbraw/zinc/24/27/37/607242737.db2.gz MWNAVFDJGDQMGB-UHFFFAOYSA-N -1 3 369.812 3.561 20 0 FHADHM Cc1ccc2cccc(C(=O)Nc3ccc(-c4nnn[n-]4)cc3Cl)c2n1 ZINC000822280694 607243059 /nfs/dbraw/zinc/24/30/59/607243059.db2.gz WKJCBAXYJQBWCJ-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1ccc2cccc(C(=O)Nc3ccc(-c4nn[n-]n4)cc3Cl)c2n1 ZINC000822280694 607243060 /nfs/dbraw/zinc/24/30/60/607243060.db2.gz WKJCBAXYJQBWCJ-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM CC(C)c1cccc(O[C@@H](C)C(=O)Oc2ccc(-c3nnn[n-]3)cc2F)c1 ZINC000820535671 607245878 /nfs/dbraw/zinc/24/58/78/607245878.db2.gz PTWSLWVANSAKGR-LBPRGKRZSA-N -1 3 370.384 3.502 20 0 FHADHM CC(C)c1cccc(O[C@@H](C)C(=O)Oc2ccc(-c3nn[n-]n3)cc2F)c1 ZINC000820535671 607245879 /nfs/dbraw/zinc/24/58/79/607245879.db2.gz PTWSLWVANSAKGR-LBPRGKRZSA-N -1 3 370.384 3.502 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@H](C)c2ccc(F)cc2)cc1-c1nnn[n-]1 ZINC000825544566 607784675 /nfs/dbraw/zinc/78/46/75/607784675.db2.gz CKWTWVPEZLOLOI-LLVKDONJSA-N -1 3 370.388 3.747 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@H](C)c2ccc(F)cc2)cc1-c1nn[n-]n1 ZINC000825544566 607784676 /nfs/dbraw/zinc/78/46/76/607784676.db2.gz CKWTWVPEZLOLOI-LLVKDONJSA-N -1 3 370.388 3.747 20 0 FHADHM CC1(C)C[C@H]1C(=O)Nc1sc2c(c1-c1nnn[n-]1)-c1ccccc1CC2 ZINC000824796639 607785489 /nfs/dbraw/zinc/78/54/89/607785489.db2.gz SEAJOBZVHAVGMZ-LBPRGKRZSA-N -1 3 365.462 3.678 20 0 FHADHM CC1(C)C[C@H]1C(=O)Nc1sc2c(c1-c1nn[n-]n1)-c1ccccc1CC2 ZINC000824796639 607785490 /nfs/dbraw/zinc/78/54/90/607785490.db2.gz SEAJOBZVHAVGMZ-LBPRGKRZSA-N -1 3 365.462 3.678 20 0 FHADHM CC(C)c1ccccc1OCCC(=O)Nc1ccc(F)cc1-c1nnn[n-]1 ZINC000824352542 607786093 /nfs/dbraw/zinc/78/60/93/607786093.db2.gz HZGJWIADMHXQLC-UHFFFAOYSA-N -1 3 369.400 3.537 20 0 FHADHM CC(C)c1ccccc1OCCC(=O)Nc1ccc(F)cc1-c1nn[n-]n1 ZINC000824352542 607786094 /nfs/dbraw/zinc/78/60/94/607786094.db2.gz HZGJWIADMHXQLC-UHFFFAOYSA-N -1 3 369.400 3.537 20 0 FHADHM CN(C(=O)c1cc2cccc(Cl)c2o1)c1ccccc1-c1nnn[n-]1 ZINC000825826010 607788475 /nfs/dbraw/zinc/78/84/75/607788475.db2.gz RRJDNBPRGNBTNB-UHFFFAOYSA-N -1 3 353.769 3.543 20 0 FHADHM CN(C(=O)c1cc2cccc(Cl)c2o1)c1ccccc1-c1nn[n-]n1 ZINC000825826010 607788476 /nfs/dbraw/zinc/78/84/76/607788476.db2.gz RRJDNBPRGNBTNB-UHFFFAOYSA-N -1 3 353.769 3.543 20 0 FHADHM CN(C(=O)c1ccc(Oc2ccccc2)o1)c1ccccc1-c1nnn[n-]1 ZINC000825830585 607790719 /nfs/dbraw/zinc/79/07/19/607790719.db2.gz XHFYIWOTXUZAPA-UHFFFAOYSA-N -1 3 361.361 3.529 20 0 FHADHM CN(C(=O)c1ccc(Oc2ccccc2)o1)c1ccccc1-c1nn[n-]n1 ZINC000825830585 607790720 /nfs/dbraw/zinc/79/07/20/607790720.db2.gz XHFYIWOTXUZAPA-UHFFFAOYSA-N -1 3 361.361 3.529 20 0 FHADHM O=C(Cc1cc2c(ccc3ccccc23)o1)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000130066411 607792108 /nfs/dbraw/zinc/79/21/08/607792108.db2.gz MDDBELABTKJAGT-UHFFFAOYSA-N -1 3 369.384 3.947 20 0 FHADHM O=C(Cc1cc2c(ccc3ccccc23)o1)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000130066411 607792109 /nfs/dbraw/zinc/79/21/09/607792109.db2.gz MDDBELABTKJAGT-UHFFFAOYSA-N -1 3 369.384 3.947 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)NCCC1=CCCC1 ZINC000824255734 607794433 /nfs/dbraw/zinc/79/44/33/607794433.db2.gz VMCVTKXMYGQBNG-UHFFFAOYSA-N -1 3 368.485 3.535 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)NCCC1=CCCC1 ZINC000824255734 607794434 /nfs/dbraw/zinc/79/44/34/607794434.db2.gz VMCVTKXMYGQBNG-UHFFFAOYSA-N -1 3 368.485 3.535 20 0 FHADHM CC(C)CC[C@H](C)NC(=O)c1c(Cl)cc(-c2nnn[n-]2)cc1Cl ZINC000824242782 607833272 /nfs/dbraw/zinc/83/32/72/607833272.db2.gz BKFUKZNQTJBXQJ-VIFPVBQESA-N -1 3 356.257 3.728 20 0 FHADHM CC(C)CC[C@H](C)NC(=O)c1c(Cl)cc(-c2nn[n-]n2)cc1Cl ZINC000824242782 607833273 /nfs/dbraw/zinc/83/32/73/607833273.db2.gz BKFUKZNQTJBXQJ-VIFPVBQESA-N -1 3 356.257 3.728 20 0 FHADHM O=C(Nc1ccc2c(c1)CCC2)c1c(Cl)cc(-c2nnn[n-]2)cc1Cl ZINC000826455639 607833674 /nfs/dbraw/zinc/83/36/74/607833674.db2.gz XTMWWIPTXUDUPB-UHFFFAOYSA-N -1 3 374.231 3.915 20 0 FHADHM O=C(Nc1ccc2c(c1)CCC2)c1c(Cl)cc(-c2nn[n-]n2)cc1Cl ZINC000826455639 607833675 /nfs/dbraw/zinc/83/36/75/607833675.db2.gz XTMWWIPTXUDUPB-UHFFFAOYSA-N -1 3 374.231 3.915 20 0 FHADHM Clc1cc(-c2nnn[n-]2)ccc1SCc1ccc2c(c1)OCCO2 ZINC000826350830 607845842 /nfs/dbraw/zinc/84/58/42/607845842.db2.gz NGPAMZKGLPCCPB-UHFFFAOYSA-N -1 3 360.826 3.584 20 0 FHADHM Clc1cc(-c2nn[n-]n2)ccc1SCc1ccc2c(c1)OCCO2 ZINC000826350830 607845843 /nfs/dbraw/zinc/84/58/43/607845843.db2.gz NGPAMZKGLPCCPB-UHFFFAOYSA-N -1 3 360.826 3.584 20 0 FHADHM CC(C)n1ccn(CN(C)c2cc(Cl)ccc2-c2nnn[n-]2)c1=S ZINC000824377806 607847990 /nfs/dbraw/zinc/84/79/90/607847990.db2.gz NVLZGNUWXAHGLX-UHFFFAOYSA-N -1 3 363.878 3.527 20 0 FHADHM CC(C)n1ccn(CN(C)c2cc(Cl)ccc2-c2nn[n-]n2)c1=S ZINC000824377806 607847991 /nfs/dbraw/zinc/84/79/91/607847991.db2.gz NVLZGNUWXAHGLX-UHFFFAOYSA-N -1 3 363.878 3.527 20 0 FHADHM O=C(CCc1ccc(-c2nnn[n-]2)cc1)Nc1cccnc1-c1ccccc1 ZINC000826408386 607855956 /nfs/dbraw/zinc/85/59/56/607855956.db2.gz DCJZLSHVDIRUJE-UHFFFAOYSA-N -1 3 370.416 3.500 20 0 FHADHM O=C(CCc1ccc(-c2nn[n-]n2)cc1)Nc1cccnc1-c1ccccc1 ZINC000826408386 607855957 /nfs/dbraw/zinc/85/59/57/607855957.db2.gz DCJZLSHVDIRUJE-UHFFFAOYSA-N -1 3 370.416 3.500 20 0 FHADHM CCN(C(=O)c1cc(C)c(C)s1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825379998 607878959 /nfs/dbraw/zinc/87/89/59/607878959.db2.gz NGNYJGWBNSOGDG-UHFFFAOYSA-N -1 3 361.858 3.865 20 0 FHADHM CCN(C(=O)c1cc(C)c(C)s1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825379998 607878960 /nfs/dbraw/zinc/87/89/60/607878960.db2.gz NGNYJGWBNSOGDG-UHFFFAOYSA-N -1 3 361.858 3.865 20 0 FHADHM CC1(C)CCC[C@@H](C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)C1 ZINC000824803340 607881252 /nfs/dbraw/zinc/88/12/52/607881252.db2.gz TYCJWWXXQSNMMH-MRXNPFEDSA-N -1 3 353.470 3.574 20 0 FHADHM CC1(C)CCC[C@@H](C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)C1 ZINC000824803340 607881253 /nfs/dbraw/zinc/88/12/53/607881253.db2.gz TYCJWWXXQSNMMH-MRXNPFEDSA-N -1 3 353.470 3.574 20 0 FHADHM C[C@H](NC(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1cccc(-c2nnn[n-]2)c1 ZINC000824472820 607905894 /nfs/dbraw/zinc/90/58/94/607905894.db2.gz XCEDWERQKMVVFL-KJGCVMFHSA-N -1 3 353.470 3.650 20 0 FHADHM C[C@H](NC(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1cccc(-c2nn[n-]n2)c1 ZINC000824472820 607905895 /nfs/dbraw/zinc/90/58/95/607905895.db2.gz XCEDWERQKMVVFL-KJGCVMFHSA-N -1 3 353.470 3.650 20 0 FHADHM Cc1c(NC(=O)[C@H](C)Cc2cccc(Cl)c2)cccc1-c1nnn[n-]1 ZINC000826240610 607908672 /nfs/dbraw/zinc/90/86/72/607908672.db2.gz BIMTXHNLICTWNC-LLVKDONJSA-N -1 3 355.829 3.646 20 0 FHADHM Cc1c(NC(=O)[C@H](C)Cc2cccc(Cl)c2)cccc1-c1nn[n-]n1 ZINC000826240610 607908673 /nfs/dbraw/zinc/90/86/73/607908673.db2.gz BIMTXHNLICTWNC-LLVKDONJSA-N -1 3 355.829 3.646 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)Nc1ccc(F)cc1-c1nnn[n-]1 ZINC000823943607 607927194 /nfs/dbraw/zinc/92/71/94/607927194.db2.gz QOCUYJVORADQNX-NTMALXAHSA-N -1 3 357.776 3.701 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)Nc1ccc(F)cc1-c1nn[n-]n1 ZINC000823943607 607927195 /nfs/dbraw/zinc/92/71/95/607927195.db2.gz QOCUYJVORADQNX-NTMALXAHSA-N -1 3 357.776 3.701 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000823943142 607969448 /nfs/dbraw/zinc/96/94/48/607969448.db2.gz ONCKMIIXHVSYIA-HHQWOOOKSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000823943142 607969449 /nfs/dbraw/zinc/96/94/49/607969449.db2.gz ONCKMIIXHVSYIA-HHQWOOOKSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000823943913 607970197 /nfs/dbraw/zinc/97/01/97/607970197.db2.gz VAFVUTADKACFIQ-QBFSEMIESA-N -1 3 367.840 3.582 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000823943913 607970198 /nfs/dbraw/zinc/97/01/98/607970198.db2.gz VAFVUTADKACFIQ-QBFSEMIESA-N -1 3 367.840 3.582 20 0 FHADHM CC(C)CN(C(=O)C1CCC(F)(F)CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824249714 607980032 /nfs/dbraw/zinc/98/00/32/607980032.db2.gz SYMOYWLMDXQXPV-UHFFFAOYSA-N -1 3 363.412 3.681 20 0 FHADHM CC(C)CN(C(=O)C1CCC(F)(F)CC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824249714 607980033 /nfs/dbraw/zinc/98/00/33/607980033.db2.gz SYMOYWLMDXQXPV-UHFFFAOYSA-N -1 3 363.412 3.681 20 0 FHADHM Cc1cc([C@@H](NC(=O)c2ccc(-c3nnn[n-]3)cc2C)C2CC2)ccc1F ZINC000826262211 608009367 /nfs/dbraw/zinc/00/93/67/608009367.db2.gz HZEDRQRIGQPOFD-SFHVURJKSA-N -1 3 365.412 3.504 20 0 FHADHM Cc1cc([C@@H](NC(=O)c2ccc(-c3nn[n-]n3)cc2C)C2CC2)ccc1F ZINC000826262211 608009368 /nfs/dbraw/zinc/00/93/68/608009368.db2.gz HZEDRQRIGQPOFD-SFHVURJKSA-N -1 3 365.412 3.504 20 0 FHADHM CC(C)[C@H]1CCc2ccccc2N1C(=O)c1sccc1-c1nnn[n-]1 ZINC000824226269 608029461 /nfs/dbraw/zinc/02/94/61/608029461.db2.gz WZAYTCPZIAPKAA-CQSZACIVSA-N -1 3 353.451 3.546 20 0 FHADHM CC(C)[C@H]1CCc2ccccc2N1C(=O)c1sccc1-c1nn[n-]n1 ZINC000824226269 608029462 /nfs/dbraw/zinc/02/94/62/608029462.db2.gz WZAYTCPZIAPKAA-CQSZACIVSA-N -1 3 353.451 3.546 20 0 FHADHM c1ccc(C[C@@H]2c3ccccc3CCN2c2ccc(-c3nnn[n-]3)cn2)cc1 ZINC000826520888 608053635 /nfs/dbraw/zinc/05/36/35/608053635.db2.gz ULXZFSHROWWIME-HXUWFJFHSA-N -1 3 368.444 3.608 20 0 FHADHM c1ccc(C[C@@H]2c3ccccc3CCN2c2ccc(-c3nn[n-]n3)cn2)cc1 ZINC000826520888 608053636 /nfs/dbraw/zinc/05/36/36/608053636.db2.gz ULXZFSHROWWIME-HXUWFJFHSA-N -1 3 368.444 3.608 20 0 FHADHM CC[C@H](C)n1ncc(NC(=O)Nc2ccc(-c3nnn[n-]3)cc2)c1C1CC1 ZINC000825081638 608100497 /nfs/dbraw/zinc/10/04/97/608100497.db2.gz LALKNIFGKLSVSB-NSHDSACASA-N -1 3 366.429 3.556 20 0 FHADHM CC[C@H](C)n1ncc(NC(=O)Nc2ccc(-c3nn[n-]n3)cc2)c1C1CC1 ZINC000825081638 608100498 /nfs/dbraw/zinc/10/04/98/608100498.db2.gz LALKNIFGKLSVSB-NSHDSACASA-N -1 3 366.429 3.556 20 0 FHADHM Fc1cccc(F)c1-c1csc(COc2ccc(-c3nn[n-]n3)cc2)n1 ZINC000826377329 608144163 /nfs/dbraw/zinc/14/41/63/608144163.db2.gz NDHSSZCUAKNXET-UHFFFAOYSA-N -1 3 371.372 3.847 20 0 FHADHM Cc1cc(C)c(-c2nnn[n-]2)c(SCc2nc(Cl)ccc2Cl)n1 ZINC000826263184 608144373 /nfs/dbraw/zinc/14/43/73/608144373.db2.gz OVPFKKJGUKSERA-UHFFFAOYSA-N -1 3 367.265 3.873 20 0 FHADHM Cc1cc(C)c(-c2nn[n-]n2)c(SCc2nc(Cl)ccc2Cl)n1 ZINC000826263184 608144374 /nfs/dbraw/zinc/14/43/74/608144374.db2.gz OVPFKKJGUKSERA-UHFFFAOYSA-N -1 3 367.265 3.873 20 0 FHADHM CC(C)c1ccc(/C=C/CC(=O)NCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824347726 608151200 /nfs/dbraw/zinc/15/12/00/608151200.db2.gz LRMCTPHUHOSSAD-SNAWJCMRSA-N -1 3 361.449 3.710 20 0 FHADHM CC(C)c1ccc(/C=C/CC(=O)NCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824347726 608151203 /nfs/dbraw/zinc/15/12/03/608151203.db2.gz LRMCTPHUHOSSAD-SNAWJCMRSA-N -1 3 361.449 3.710 20 0 FHADHM CC(C)c1ccc(/C=C\CC(=O)NCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824347725 608151231 /nfs/dbraw/zinc/15/12/31/608151231.db2.gz LRMCTPHUHOSSAD-PLNGDYQASA-N -1 3 361.449 3.710 20 0 FHADHM CC(C)c1ccc(/C=C\CC(=O)NCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824347725 608151233 /nfs/dbraw/zinc/15/12/33/608151233.db2.gz LRMCTPHUHOSSAD-PLNGDYQASA-N -1 3 361.449 3.710 20 0 FHADHM Cc1cnc([C@H](C)SCc2ccc(-c3nnn[n-]3)cc2OC(F)F)o1 ZINC000826317476 608154010 /nfs/dbraw/zinc/15/40/10/608154010.db2.gz DTUSECCKLYTNLF-VIFPVBQESA-N -1 3 367.381 3.759 20 0 FHADHM Cc1cnc([C@H](C)SCc2ccc(-c3nn[n-]n3)cc2OC(F)F)o1 ZINC000826317476 608154012 /nfs/dbraw/zinc/15/40/12/608154012.db2.gz DTUSECCKLYTNLF-VIFPVBQESA-N -1 3 367.381 3.759 20 0 FHADHM C[C@@H](NCc1ncc(-c2ccccc2)s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824633077 608157610 /nfs/dbraw/zinc/15/76/10/608157610.db2.gz HETPYTWPSRMVLE-CYBMUJFWSA-N -1 3 362.462 3.841 20 0 FHADHM C[C@@H](OC(=O)C1(c2cccc(Cl)c2)CC1)c1cccc(-c2nnn[n-]2)c1 ZINC000824713366 608181767 /nfs/dbraw/zinc/18/17/67/608181767.db2.gz HSLYYKGYXWKLSS-GFCCVEGCSA-N -1 3 368.824 3.856 20 0 FHADHM C[C@@H](OC(=O)C1(c2cccc(Cl)c2)CC1)c1cccc(-c2nn[n-]n2)c1 ZINC000824713366 608181769 /nfs/dbraw/zinc/18/17/69/608181769.db2.gz HSLYYKGYXWKLSS-GFCCVEGCSA-N -1 3 368.824 3.856 20 0 FHADHM C[C@@H](OC(=O)C1(c2cccc(F)c2)CCC1)c1cccc(-c2nnn[n-]2)c1 ZINC000824713353 608184611 /nfs/dbraw/zinc/18/46/11/608184611.db2.gz HRCDHVDTFSVSHQ-CYBMUJFWSA-N -1 3 366.396 3.732 20 0 FHADHM C[C@@H](OC(=O)C1(c2cccc(F)c2)CCC1)c1cccc(-c2nn[n-]n2)c1 ZINC000824713353 608184612 /nfs/dbraw/zinc/18/46/12/608184612.db2.gz HRCDHVDTFSVSHQ-CYBMUJFWSA-N -1 3 366.396 3.732 20 0 FHADHM CCCCC[C@H](C)NC(=O)CSc1cccc(Cl)c1-c1nnn[n-]1 ZINC000825267265 608207102 /nfs/dbraw/zinc/20/71/02/608207102.db2.gz KEWLVNXTXWCHAW-NSHDSACASA-N -1 3 367.906 3.697 20 0 FHADHM CCCCC[C@H](C)NC(=O)CSc1cccc(Cl)c1-c1nn[n-]n1 ZINC000825267265 608207104 /nfs/dbraw/zinc/20/71/04/608207104.db2.gz KEWLVNXTXWCHAW-NSHDSACASA-N -1 3 367.906 3.697 20 0 FHADHM Cc1cccc([C@@H](Nc2cccc(F)c2-c2nnn[n-]2)c2ccccn2)c1 ZINC000826297243 608230918 /nfs/dbraw/zinc/23/09/18/608230918.db2.gz ZMRZODQJFQTPQT-LJQANCHMSA-N -1 3 360.396 3.911 20 0 FHADHM Cc1cccc([C@@H](Nc2cccc(F)c2-c2nn[n-]n2)c2ccccn2)c1 ZINC000826297243 608230919 /nfs/dbraw/zinc/23/09/19/608230919.db2.gz ZMRZODQJFQTPQT-LJQANCHMSA-N -1 3 360.396 3.911 20 0 FHADHM Cc1cccc([C@H](NCc2ccc(-c3nnn[n-]3)cc2F)c2ccccn2)c1 ZINC000826297066 608241512 /nfs/dbraw/zinc/24/15/12/608241512.db2.gz UKEPGSJQTLEXQI-FQEVSTJZSA-N -1 3 374.423 3.588 20 0 FHADHM Cc1cccc([C@H](NCc2ccc(-c3nn[n-]n3)cc2F)c2ccccn2)c1 ZINC000826297066 608241513 /nfs/dbraw/zinc/24/15/13/608241513.db2.gz UKEPGSJQTLEXQI-FQEVSTJZSA-N -1 3 374.423 3.588 20 0 FHADHM CC(C)(CNC(=O)CCc1ccc(-c2nnn[n-]2)cc1)C1CCCCC1 ZINC000824158365 608244294 /nfs/dbraw/zinc/24/42/94/608244294.db2.gz UBBKWIVMXYWXRC-UHFFFAOYSA-N -1 3 355.486 3.522 20 0 FHADHM CC(C)(CNC(=O)CCc1ccc(-c2nn[n-]n2)cc1)C1CCCCC1 ZINC000824158365 608244296 /nfs/dbraw/zinc/24/42/96/608244296.db2.gz UBBKWIVMXYWXRC-UHFFFAOYSA-N -1 3 355.486 3.522 20 0 FHADHM C[C@H](CC(=O)N(C)c1ccccc1-c1nnn[n-]1)Cc1ccc(Cl)cc1 ZINC000824384346 608261426 /nfs/dbraw/zinc/26/14/26/608261426.db2.gz AUAGXGAMECXLFC-ZDUSSCGKSA-N -1 3 369.856 3.752 20 0 FHADHM C[C@H](CC(=O)N(C)c1ccccc1-c1nn[n-]n1)Cc1ccc(Cl)cc1 ZINC000824384346 608261428 /nfs/dbraw/zinc/26/14/28/608261428.db2.gz AUAGXGAMECXLFC-ZDUSSCGKSA-N -1 3 369.856 3.752 20 0 FHADHM Cc1sc(NC(=O)C=Cc2ccc3[nH]ccc3c2)c(-c2nnn[n-]2)c1C ZINC000826349241 608265073 /nfs/dbraw/zinc/26/50/73/608265073.db2.gz AOJBWXAVEZGIES-XQRVVYSFSA-N -1 3 364.434 3.678 20 0 FHADHM Cc1sc(NC(=O)C=Cc2ccc3[nH]ccc3c2)c(-c2nn[n-]n2)c1C ZINC000826349241 608265074 /nfs/dbraw/zinc/26/50/74/608265074.db2.gz AOJBWXAVEZGIES-XQRVVYSFSA-N -1 3 364.434 3.678 20 0 FHADHM CCOc1cccc2cc([C@H](C)Nc3nc(C)ccc3-c3nnn[n-]3)oc21 ZINC000825653367 608270516 /nfs/dbraw/zinc/27/05/16/608270516.db2.gz BYFFYHXXKSOCBK-LBPRGKRZSA-N -1 3 364.409 3.888 20 0 FHADHM CCOc1cccc2cc([C@H](C)Nc3nc(C)ccc3-c3nn[n-]n3)oc21 ZINC000825653367 608270517 /nfs/dbraw/zinc/27/05/17/608270517.db2.gz BYFFYHXXKSOCBK-LBPRGKRZSA-N -1 3 364.409 3.888 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)c(N2Cc3ccccc3[C@@H](c3ccccc3)C2)n1 ZINC000826274827 608274239 /nfs/dbraw/zinc/27/42/39/608274239.db2.gz GJYSXFBEDNQBHK-HXUWFJFHSA-N -1 3 368.444 3.722 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)c(N2Cc3ccccc3[C@@H](c3ccccc3)C2)n1 ZINC000826274827 608274241 /nfs/dbraw/zinc/27/42/41/608274241.db2.gz GJYSXFBEDNQBHK-HXUWFJFHSA-N -1 3 368.444 3.722 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)C=Cc2ccc3[nH]ccc3c2)s1 ZINC000825694576 608275560 /nfs/dbraw/zinc/27/55/60/608275560.db2.gz UVZRFNKTHUTUHK-GQCTYLIASA-N -1 3 364.434 3.624 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)C=Cc2ccc3[nH]ccc3c2)s1 ZINC000825694576 608275561 /nfs/dbraw/zinc/27/55/61/608275561.db2.gz UVZRFNKTHUTUHK-GQCTYLIASA-N -1 3 364.434 3.624 20 0 FHADHM CCN(C(=O)c1csc(C)c1C)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825391242 608299726 /nfs/dbraw/zinc/29/97/26/608299726.db2.gz XDHPUCKOPFTMSO-GFCCVEGCSA-N -1 3 355.467 3.768 20 0 FHADHM CCN(C(=O)c1csc(C)c1C)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825391242 608299728 /nfs/dbraw/zinc/29/97/28/608299728.db2.gz XDHPUCKOPFTMSO-GFCCVEGCSA-N -1 3 355.467 3.768 20 0 FHADHM Cn1nccc1CSCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000826366320 608300105 /nfs/dbraw/zinc/30/01/05/608300105.db2.gz CCEGDJKYBHXYBT-UHFFFAOYSA-N -1 3 362.462 3.701 20 0 FHADHM Cn1nccc1CSCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000826366320 608300106 /nfs/dbraw/zinc/30/01/06/608300106.db2.gz CCEGDJKYBHXYBT-UHFFFAOYSA-N -1 3 362.462 3.701 20 0 FHADHM CC(C)(C)OCc1ccccc1C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000824119718 608301812 /nfs/dbraw/zinc/30/18/12/608301812.db2.gz OYJCYEGSPRMINZ-UHFFFAOYSA-N -1 3 369.400 3.573 20 0 FHADHM CC(C)(C)OCc1ccccc1C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000824119718 608301814 /nfs/dbraw/zinc/30/18/14/608301814.db2.gz OYJCYEGSPRMINZ-UHFFFAOYSA-N -1 3 369.400 3.573 20 0 FHADHM O=C(NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1)[C@@H]1CC12CCCC2 ZINC000826440491 608304065 /nfs/dbraw/zinc/30/40/65/608304065.db2.gz OFOVQCHEXMLPKO-IBGZPJMESA-N -1 3 373.460 3.730 20 0 FHADHM O=C(NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1)[C@@H]1CC12CCCC2 ZINC000826440491 608304066 /nfs/dbraw/zinc/30/40/66/608304066.db2.gz OFOVQCHEXMLPKO-IBGZPJMESA-N -1 3 373.460 3.730 20 0 FHADHM O=C(NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1)[C@@H]1CC=CCC1 ZINC000826440417 608306117 /nfs/dbraw/zinc/30/61/17/608306117.db2.gz LYIYFANEHFORKP-QGZVFWFLSA-N -1 3 359.433 3.506 20 0 FHADHM O=C(NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1)[C@@H]1CC=CCC1 ZINC000826440417 608306119 /nfs/dbraw/zinc/30/61/19/608306119.db2.gz LYIYFANEHFORKP-QGZVFWFLSA-N -1 3 359.433 3.506 20 0 FHADHM CSc1cc(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)ccc1F ZINC000826229723 608311561 /nfs/dbraw/zinc/31/15/61/608311561.db2.gz OSYMMHSUJPPYKF-UHFFFAOYSA-N -1 3 363.805 3.633 20 0 FHADHM CSc1cc(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)ccc1F ZINC000826229723 608311563 /nfs/dbraw/zinc/31/15/63/608311563.db2.gz OSYMMHSUJPPYKF-UHFFFAOYSA-N -1 3 363.805 3.633 20 0 FHADHM C[C@H](C(=O)NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1)C(C)(C)C ZINC000824039633 608326788 /nfs/dbraw/zinc/32/67/88/608326788.db2.gz GCLGDBYEDODRKW-CQSZACIVSA-N -1 3 363.465 3.832 20 0 FHADHM C[C@H](C(=O)NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1)C(C)(C)C ZINC000824039633 608326790 /nfs/dbraw/zinc/32/67/90/608326790.db2.gz GCLGDBYEDODRKW-CQSZACIVSA-N -1 3 363.465 3.832 20 0 FHADHM O=C(C[C@H]1C=CCC1)NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000826403877 608327979 /nfs/dbraw/zinc/32/79/79/608327979.db2.gz GVEVVXCISQKSIQ-HNNXBMFYSA-N -1 3 359.433 3.506 20 0 FHADHM O=C(C[C@H]1C=CCC1)NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000826403877 608327981 /nfs/dbraw/zinc/32/79/81/608327981.db2.gz GVEVVXCISQKSIQ-HNNXBMFYSA-N -1 3 359.433 3.506 20 0 FHADHM CCN(C(=O)[C@@H](C)c1ccsc1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825367424 608343971 /nfs/dbraw/zinc/34/39/71/608343971.db2.gz PTSBGGRZWCFVCS-JTQLQIEISA-N -1 3 361.858 3.738 20 0 FHADHM CCN(C(=O)[C@@H](C)c1ccsc1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825367424 608343972 /nfs/dbraw/zinc/34/39/72/608343972.db2.gz PTSBGGRZWCFVCS-JTQLQIEISA-N -1 3 361.858 3.738 20 0 FHADHM c1c(CNc2cc(-c3nnn[n-]3)c3ccccc3n2)onc1-c1ccccc1 ZINC000826519455 608367187 /nfs/dbraw/zinc/36/71/87/608367187.db2.gz ZCCNDNSXKIRDEU-UHFFFAOYSA-N -1 3 369.388 3.682 20 0 FHADHM c1c(CNc2cc(-c3nn[n-]n3)c3ccccc3n2)onc1-c1ccccc1 ZINC000826519455 608367189 /nfs/dbraw/zinc/36/71/89/608367189.db2.gz ZCCNDNSXKIRDEU-UHFFFAOYSA-N -1 3 369.388 3.682 20 0 FHADHM CCCCCn1cc(CNc2c(Cl)cccc2-c2nnn[n-]2)c(C)n1 ZINC000825281638 608444883 /nfs/dbraw/zinc/44/48/83/608444883.db2.gz IDBGPURAWFDICF-UHFFFAOYSA-N -1 3 359.865 3.827 20 0 FHADHM CCCCCn1cc(CNc2c(Cl)cccc2-c2nn[n-]n2)c(C)n1 ZINC000825281638 608444884 /nfs/dbraw/zinc/44/48/84/608444884.db2.gz IDBGPURAWFDICF-UHFFFAOYSA-N -1 3 359.865 3.827 20 0 FHADHM CCc1cccc(NC(=O)N2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)c1 ZINC000825722432 608468872 /nfs/dbraw/zinc/46/88/72/608468872.db2.gz GAQOSHFSFPKKFG-UHFFFAOYSA-N -1 3 374.448 3.750 20 0 FHADHM CCc1cccc(NC(=O)N2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)c1 ZINC000825722432 608468873 /nfs/dbraw/zinc/46/88/73/608468873.db2.gz GAQOSHFSFPKKFG-UHFFFAOYSA-N -1 3 374.448 3.750 20 0 FHADHM Cc1cscc1NC(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000826320996 608474276 /nfs/dbraw/zinc/47/42/76/608474276.db2.gz NCEHHSDEIKGUEL-UHFFFAOYSA-N -1 3 366.450 3.558 20 0 FHADHM Cc1cscc1NC(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000826320996 608474278 /nfs/dbraw/zinc/47/42/78/608474278.db2.gz NCEHHSDEIKGUEL-UHFFFAOYSA-N -1 3 366.450 3.558 20 0 FHADHM C[C@@H]1CCCC[C@H]1CC(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000824936154 608487685 /nfs/dbraw/zinc/48/76/85/608487685.db2.gz FEHLRSGBEIOSQK-BEFAXECRSA-N -1 3 365.481 3.699 20 0 FHADHM C[C@@H]1CCCC[C@H]1CC(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000824936154 608487686 /nfs/dbraw/zinc/48/76/86/608487686.db2.gz FEHLRSGBEIOSQK-BEFAXECRSA-N -1 3 365.481 3.699 20 0 FHADHM CN(Cc1ccc(-c2nnn[n-]2)s1)Cc1cccc(Cl)c1Cl ZINC000825966316 608500819 /nfs/dbraw/zinc/50/08/19/608500819.db2.gz XRYRMKKBSVJMGH-UHFFFAOYSA-N -1 3 354.266 3.867 20 0 FHADHM CN(Cc1ccc(-c2nn[n-]n2)s1)Cc1cccc(Cl)c1Cl ZINC000825966316 608500820 /nfs/dbraw/zinc/50/08/20/608500820.db2.gz XRYRMKKBSVJMGH-UHFFFAOYSA-N -1 3 354.266 3.867 20 0 FHADHM c1coc(CN(Cc2ccc(-c3nnn[n-]3)s2)Cc2ccccc2)c1 ZINC000826521458 608501392 /nfs/dbraw/zinc/50/13/92/608501392.db2.gz MZUXSVQZLOLBPV-UHFFFAOYSA-N -1 3 351.435 3.724 20 0 FHADHM c1coc(CN(Cc2ccc(-c3nn[n-]n3)s2)Cc2ccccc2)c1 ZINC000826521458 608501393 /nfs/dbraw/zinc/50/13/93/608501393.db2.gz MZUXSVQZLOLBPV-UHFFFAOYSA-N -1 3 351.435 3.724 20 0 FHADHM Cc1oc(-c2ccccc2)nc1CNC1(c2cccc(-c3nn[n-]n3)c2)CC1 ZINC000826340031 608531071 /nfs/dbraw/zinc/53/10/71/608531071.db2.gz FAXASFNZFWDVFA-UHFFFAOYSA-N -1 3 372.432 3.609 20 0 FHADHM CN(Cc1cccc(-c2nnn[n-]2)c1)C(=O)Nc1ccc(-c2ccc[nH]2)cc1 ZINC000825971309 608547319 /nfs/dbraw/zinc/54/73/19/608547319.db2.gz AYEPGPMHZAXPCJ-UHFFFAOYSA-N -1 3 373.420 3.526 20 0 FHADHM CN(Cc1cccc(-c2nn[n-]n2)c1)C(=O)Nc1ccc(-c2ccc[nH]2)cc1 ZINC000825971309 608547320 /nfs/dbraw/zinc/54/73/20/608547320.db2.gz AYEPGPMHZAXPCJ-UHFFFAOYSA-N -1 3 373.420 3.526 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CN[C@@H](C)c1c(F)cccc1Cl ZINC000826184281 608553471 /nfs/dbraw/zinc/55/34/71/608553471.db2.gz RCBSNCWLKHCQJB-JTQLQIEISA-N -1 3 361.808 3.519 20 0 FHADHM Fc1ccc(CN(Cc2ccc(-c3nnn[n-]3)o2)C2CCCC2)c(F)c1 ZINC000826374025 608570399 /nfs/dbraw/zinc/57/03/99/608570399.db2.gz ISUPUWPCHVWPSD-UHFFFAOYSA-N -1 3 359.380 3.683 20 0 FHADHM C[C@H](NC(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1)c1ccc(Cl)cc1 ZINC000824520995 608573010 /nfs/dbraw/zinc/57/30/10/608573010.db2.gz HGIXIJGFNBMVKC-VIFPVBQESA-N -1 3 362.220 3.665 20 0 FHADHM C[C@H](NC(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1)c1ccc(Cl)cc1 ZINC000824520995 608573012 /nfs/dbraw/zinc/57/30/12/608573012.db2.gz HGIXIJGFNBMVKC-VIFPVBQESA-N -1 3 362.220 3.665 20 0 FHADHM CC[C@@H](C)N(Cc1ccccc1)C(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000825068591 608573141 /nfs/dbraw/zinc/57/31/41/608573141.db2.gz UGDLVULYIGQAET-CYBMUJFWSA-N -1 3 369.856 3.961 20 0 FHADHM CC[C@@H](C)N(Cc1ccccc1)C(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000825068591 608573142 /nfs/dbraw/zinc/57/31/42/608573142.db2.gz UGDLVULYIGQAET-CYBMUJFWSA-N -1 3 369.856 3.961 20 0 FHADHM Fc1ccc(Oc2ncc(-c3nnn[n-]3)cc2Cl)cc1Br ZINC000826375994 608588516 /nfs/dbraw/zinc/58/85/16/608588516.db2.gz KEVJJRGXLSRWCQ-UHFFFAOYSA-N -1 3 370.569 3.609 20 0 FHADHM Fc1ccc(Oc2ncc(-c3nn[n-]n3)cc2Cl)cc1Br ZINC000826375994 608588518 /nfs/dbraw/zinc/58/85/18/608588518.db2.gz KEVJJRGXLSRWCQ-UHFFFAOYSA-N -1 3 370.569 3.609 20 0 FHADHM Cc1ccc(-c2nnc(SCc3cccc(-c4nnn[n-]4)c3F)o2)cc1 ZINC000826273675 608669457 /nfs/dbraw/zinc/66/94/57/608669457.db2.gz OZPVHCOIKCQOPN-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM Cc1ccc(-c2nnc(SCc3cccc(-c4nn[n-]n4)c3F)o2)cc1 ZINC000826273675 608669458 /nfs/dbraw/zinc/66/94/58/608669458.db2.gz OZPVHCOIKCQOPN-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM Clc1cc(Cl)c2ncnc(OCc3ccccc3-c3nnn[n-]3)c2c1 ZINC000826351136 608675054 /nfs/dbraw/zinc/67/50/54/608675054.db2.gz YIOVXQLUZSLTGP-UHFFFAOYSA-N -1 3 373.203 3.696 20 0 FHADHM Clc1cc(Cl)c2ncnc(OCc3ccccc3-c3nn[n-]n3)c2c1 ZINC000826351136 608675057 /nfs/dbraw/zinc/67/50/57/608675057.db2.gz YIOVXQLUZSLTGP-UHFFFAOYSA-N -1 3 373.203 3.696 20 0 FHADHM c1cc(-c2nnn[n-]2)oc1CN1Cc2ccccc2C[C@H]1c1ccccc1 ZINC000826520359 608726470 /nfs/dbraw/zinc/72/64/70/608726470.db2.gz HOAORZMCNUGMSV-IBGZPJMESA-N -1 3 357.417 3.759 20 0 FHADHM Cc1ccc(C)c([C@H]2CN(Cc3cc(-c4nnn[n-]4)cs3)[C@@H](C)CO2)c1 ZINC000826284975 608729280 /nfs/dbraw/zinc/72/92/80/608729280.db2.gz MKTCKUXHVAYNKS-KBXCAEBGSA-N -1 3 369.494 3.507 20 0 FHADHM Cc1ccc(C)c([C@H]2CN(Cc3cc(-c4nn[n-]n4)cs3)[C@@H](C)CO2)c1 ZINC000826284975 608729283 /nfs/dbraw/zinc/72/92/83/608729283.db2.gz MKTCKUXHVAYNKS-KBXCAEBGSA-N -1 3 369.494 3.507 20 0 FHADHM Brc1ccccc1[C@@H]1CCCN1Cc1ccc(-c2nnn[n-]2)o1 ZINC000823831982 608742139 /nfs/dbraw/zinc/74/21/39/608742139.db2.gz HTJYDSLHUDAADJ-AWEZNQCLSA-N -1 3 374.242 3.559 20 0 FHADHM Brc1ccccc1[C@@H]1CCCN1Cc1ccc(-c2nn[n-]n2)o1 ZINC000823831982 608742141 /nfs/dbraw/zinc/74/21/41/608742141.db2.gz HTJYDSLHUDAADJ-AWEZNQCLSA-N -1 3 374.242 3.559 20 0 FHADHM CCc1cccc2c(C3CCN(c4cnccc4-c4nnn[n-]4)CC3)c[nH]c21 ZINC000825721759 608777637 /nfs/dbraw/zinc/77/76/37/608777637.db2.gz ALFCERIGMQVGQE-UHFFFAOYSA-N -1 3 373.464 3.689 20 0 FHADHM CCc1cccc2c(C3CCN(c4cnccc4-c4nn[n-]n4)CC3)c[nH]c21 ZINC000825721759 608777640 /nfs/dbraw/zinc/77/76/40/608777640.db2.gz ALFCERIGMQVGQE-UHFFFAOYSA-N -1 3 373.464 3.689 20 0 FHADHM O=C(O[C@H](C1CCCCC1)C(F)(F)F)c1cc(-c2nnn[n-]2)cs1 ZINC000826462488 608827017 /nfs/dbraw/zinc/82/70/17/608827017.db2.gz ZKTLAOAKNIWEHR-LLVKDONJSA-N -1 3 360.361 3.596 20 0 FHADHM O=C(O[C@H](C1CCCCC1)C(F)(F)F)c1cc(-c2nn[n-]n2)cs1 ZINC000826462488 608827020 /nfs/dbraw/zinc/82/70/20/608827020.db2.gz ZKTLAOAKNIWEHR-LLVKDONJSA-N -1 3 360.361 3.596 20 0 FHADHM O=C(O[C@@H](C1CCCCC1)C(F)(F)F)c1cc(-c2nnn[n-]2)cs1 ZINC000826462489 608827468 /nfs/dbraw/zinc/82/74/68/608827468.db2.gz ZKTLAOAKNIWEHR-NSHDSACASA-N -1 3 360.361 3.596 20 0 FHADHM O=C(O[C@@H](C1CCCCC1)C(F)(F)F)c1cc(-c2nn[n-]n2)cs1 ZINC000826462489 608827470 /nfs/dbraw/zinc/82/74/70/608827470.db2.gz ZKTLAOAKNIWEHR-NSHDSACASA-N -1 3 360.361 3.596 20 0 FHADHM Clc1cscc1CN1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000826353871 608858461 /nfs/dbraw/zinc/85/84/61/608858461.db2.gz HJAPXKNBXTXTAU-UHFFFAOYSA-N -1 3 357.870 3.871 20 0 FHADHM CCCC(=CC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1)CCC ZINC000825220836 608885576 /nfs/dbraw/zinc/88/55/76/608885576.db2.gz WZGRBJBNEJNLSL-UHFFFAOYSA-N -1 3 353.470 3.884 20 0 FHADHM CCCC(=CC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1)CCC ZINC000825220836 608885578 /nfs/dbraw/zinc/88/55/78/608885578.db2.gz WZGRBJBNEJNLSL-UHFFFAOYSA-N -1 3 353.470 3.884 20 0 FHADHM COc1cccc(F)c1[C@@H](C)N[C@@H](C)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000826216486 609146517 /nfs/dbraw/zinc/14/65/17/609146517.db2.gz ASJNQAHIQNTGIF-WDEREUQCSA-N -1 3 359.380 3.565 20 0 FHADHM COc1cccc(F)c1[C@@H](C)N[C@@H](C)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000826216486 609146518 /nfs/dbraw/zinc/14/65/18/609146518.db2.gz ASJNQAHIQNTGIF-WDEREUQCSA-N -1 3 359.380 3.565 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CCC[C@H]1/C=C/c1ccccc1 ZINC000826278380 609157355 /nfs/dbraw/zinc/15/73/55/609157355.db2.gz ZHJZVQUJLXNHRT-KSEUIEODSA-N -1 3 374.448 3.885 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CCC[C@H]1/C=C/c1ccccc1 ZINC000826278380 609157358 /nfs/dbraw/zinc/15/73/58/609157358.db2.gz ZHJZVQUJLXNHRT-KSEUIEODSA-N -1 3 374.448 3.885 20 0 FHADHM C[C@@H](Nc1ccc(NC(=O)c2ccco2)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000824656751 609163640 /nfs/dbraw/zinc/16/36/40/609163640.db2.gz MFHZREOCPPNDIE-CYBMUJFWSA-N -1 3 374.404 3.885 20 0 FHADHM C[C@@H](Nc1ccc(NC(=O)c2ccco2)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000824656751 609163642 /nfs/dbraw/zinc/16/36/42/609163642.db2.gz MFHZREOCPPNDIE-CYBMUJFWSA-N -1 3 374.404 3.885 20 0 FHADHM CCOc1cc(N[C@H]2CCCc3cc(-c4nnn[n-]4)ccc32)ccc1OC ZINC000825615700 609174220 /nfs/dbraw/zinc/17/42/20/609174220.db2.gz HGYULESPTLLEBM-KRWDZBQOSA-N -1 3 365.437 3.764 20 0 FHADHM CCOc1cc(N[C@H]2CCCc3cc(-c4nn[n-]n4)ccc32)ccc1OC ZINC000825615700 609174221 /nfs/dbraw/zinc/17/42/21/609174221.db2.gz HGYULESPTLLEBM-KRWDZBQOSA-N -1 3 365.437 3.764 20 0 FHADHM C[C@H](Nc1ccc(N2CCCCC2)cn1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824656455 609178232 /nfs/dbraw/zinc/17/82/32/609178232.db2.gz KFNISGLDEFMCNU-ZDUSSCGKSA-N -1 3 367.432 3.564 20 0 FHADHM C[C@H](Nc1ccc(N2CCCCC2)cn1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824656455 609178233 /nfs/dbraw/zinc/17/82/33/609178233.db2.gz KFNISGLDEFMCNU-ZDUSSCGKSA-N -1 3 367.432 3.564 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NCc1coc(-c2ccccc2)n1 ZINC000825480856 609179138 /nfs/dbraw/zinc/17/91/38/609179138.db2.gz NQWOTAHZBKLKJK-UHFFFAOYSA-N -1 3 361.409 3.566 20 0 FHADHM CCOc1ccc(N[C@@H]2CCCc3cc(-c4nnn[n-]4)ccc32)cc1F ZINC000825643707 609180034 /nfs/dbraw/zinc/18/00/34/609180034.db2.gz RVRWULDEGXGSDB-QGZVFWFLSA-N -1 3 353.401 3.894 20 0 FHADHM CCOc1ccc(N[C@@H]2CCCc3cc(-c4nn[n-]n4)ccc32)cc1F ZINC000825643707 609180036 /nfs/dbraw/zinc/18/00/36/609180036.db2.gz RVRWULDEGXGSDB-QGZVFWFLSA-N -1 3 353.401 3.894 20 0 FHADHM CCC(O)(CC)COc1ccccc1Oc1ccc(-c2nnn[n-]2)cc1F ZINC000825155084 609186167 /nfs/dbraw/zinc/18/61/67/609186167.db2.gz YKHKUKHTDPTVAC-UHFFFAOYSA-N -1 3 372.400 3.728 20 0 FHADHM CCC(O)(CC)COc1ccccc1Oc1ccc(-c2nn[n-]n2)cc1F ZINC000825155084 609186169 /nfs/dbraw/zinc/18/61/69/609186169.db2.gz YKHKUKHTDPTVAC-UHFFFAOYSA-N -1 3 372.400 3.728 20 0 FHADHM C[C@@H](Nc1cnn(-c2ccccc2F)c1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824663074 609253267 /nfs/dbraw/zinc/25/32/67/609253267.db2.gz VOOVRHRDHLBGNT-LLVKDONJSA-N -1 3 367.363 3.504 20 0 FHADHM C[C@@H](Nc1cnn(-c2ccccc2F)c1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824663074 609253269 /nfs/dbraw/zinc/25/32/69/609253269.db2.gz VOOVRHRDHLBGNT-LLVKDONJSA-N -1 3 367.363 3.504 20 0 FHADHM Cc1cnn(-c2ccc(C)cc2N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000826280466 609253877 /nfs/dbraw/zinc/25/38/77/609253877.db2.gz COLFHCJKNYQNCA-OAHLLOKOSA-N -1 3 359.437 3.842 20 0 FHADHM Cc1cnn(-c2ccc(C)cc2N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000826280466 609253880 /nfs/dbraw/zinc/25/38/80/609253880.db2.gz COLFHCJKNYQNCA-OAHLLOKOSA-N -1 3 359.437 3.842 20 0 FHADHM C[C@@H](Nc1cc2c(cc1Cl)OCO2)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824648010 609254336 /nfs/dbraw/zinc/25/43/36/609254336.db2.gz CUAXNIZEJPFUMI-MRVPVSSYSA-N -1 3 361.764 3.561 20 0 FHADHM C[C@@H](Nc1cc2c(cc1Cl)OCO2)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824648010 609254338 /nfs/dbraw/zinc/25/43/38/609254338.db2.gz CUAXNIZEJPFUMI-MRVPVSSYSA-N -1 3 361.764 3.561 20 0 FHADHM CCOc1cc2c(cc1N[C@H](C)c1ccc(-c3nnn[n-]3)cc1)O[C@H](C)C2 ZINC000825621502 609273877 /nfs/dbraw/zinc/27/38/77/609273877.db2.gz VFVGRDWTRVDBBL-CHWSQXEVSA-N -1 3 365.437 3.762 20 0 FHADHM CCOc1cc2c(cc1N[C@H](C)c1ccc(-c3nn[n-]n3)cc1)O[C@H](C)C2 ZINC000825621502 609273878 /nfs/dbraw/zinc/27/38/78/609273878.db2.gz VFVGRDWTRVDBBL-CHWSQXEVSA-N -1 3 365.437 3.762 20 0 FHADHM CCn1ncc2ccc(N[C@H]3CCCc4cc(-c5nnn[n-]5)ccc43)cc21 ZINC000825806910 609276769 /nfs/dbraw/zinc/27/67/69/609276769.db2.gz JPCYZXCTMJACOJ-SFHVURJKSA-N -1 3 359.437 3.726 20 0 FHADHM CCn1ncc2ccc(N[C@H]3CCCc4cc(-c5nn[n-]n5)ccc43)cc21 ZINC000825806910 609276770 /nfs/dbraw/zinc/27/67/70/609276770.db2.gz JPCYZXCTMJACOJ-SFHVURJKSA-N -1 3 359.437 3.726 20 0 FHADHM COc1cc(Br)cc(N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000826177088 609279944 /nfs/dbraw/zinc/27/99/44/609279944.db2.gz QUISDQQDGFXTPG-SNVBAGLBSA-N -1 3 374.242 3.811 20 0 FHADHM COc1cc(Br)cc(N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000826177088 609279946 /nfs/dbraw/zinc/27/99/46/609279946.db2.gz QUISDQQDGFXTPG-SNVBAGLBSA-N -1 3 374.242 3.811 20 0 FHADHM COc1ccc(N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c(Br)c1 ZINC000826210321 609281995 /nfs/dbraw/zinc/28/19/95/609281995.db2.gz MTOOSRDWLKOWKJ-SNVBAGLBSA-N -1 3 374.242 3.811 20 0 FHADHM COc1ccc(N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c(Br)c1 ZINC000826210321 609281997 /nfs/dbraw/zinc/28/19/97/609281997.db2.gz MTOOSRDWLKOWKJ-SNVBAGLBSA-N -1 3 374.242 3.811 20 0 FHADHM CC(C)Nc1ccc(F)cc1NC(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000824304887 609300945 /nfs/dbraw/zinc/30/09/45/609300945.db2.gz IBECMEQUIJPKOA-UHFFFAOYSA-N -1 3 374.807 3.732 20 0 FHADHM CC(C)Nc1ccc(F)cc1NC(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000824304887 609300946 /nfs/dbraw/zinc/30/09/46/609300946.db2.gz IBECMEQUIJPKOA-UHFFFAOYSA-N -1 3 374.807 3.732 20 0 FHADHM Brc1cc(-c2nnn[n-]2)ccc1CSc1cccs1 ZINC000823820732 609308493 /nfs/dbraw/zinc/30/84/93/609308493.db2.gz JKWVPLJMBOWFNM-UHFFFAOYSA-N -1 3 353.270 3.983 20 0 FHADHM Brc1cc(-c2nn[n-]n2)ccc1CSc1cccs1 ZINC000823820732 609308495 /nfs/dbraw/zinc/30/84/95/609308495.db2.gz JKWVPLJMBOWFNM-UHFFFAOYSA-N -1 3 353.270 3.983 20 0 FHADHM Clc1ccc(C2=CCN(c3ccc(-c4nnn[n-]4)cn3)CC2)cc1Cl ZINC000826351167 609312516 /nfs/dbraw/zinc/31/25/16/609312516.db2.gz AEYIDBQJVJZPAJ-UHFFFAOYSA-N -1 3 373.247 3.862 20 0 FHADHM Clc1ccc(C2=CCN(c3ccc(-c4nn[n-]n4)cn3)CC2)cc1Cl ZINC000826351167 609312518 /nfs/dbraw/zinc/31/25/18/609312518.db2.gz AEYIDBQJVJZPAJ-UHFFFAOYSA-N -1 3 373.247 3.862 20 0 FHADHM Cc1nn(-c2ccccc2)cc1CNc1ccc(Cl)cc1-c1nnn[n-]1 ZINC000826333238 609317254 /nfs/dbraw/zinc/31/72/54/609317254.db2.gz ZONLJECVDAXPHF-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM Cc1nn(-c2ccccc2)cc1CNc1ccc(Cl)cc1-c1nn[n-]n1 ZINC000826333238 609317256 /nfs/dbraw/zinc/31/72/56/609317256.db2.gz ZONLJECVDAXPHF-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM Cc1nc2cc(NC(=O)c3ccc(Cl)c(-c4nnn[n-]4)c3)ccc2s1 ZINC000826328438 609318917 /nfs/dbraw/zinc/31/89/17/609318917.db2.gz RHABVVSXAIDGFA-UHFFFAOYSA-N -1 3 370.825 3.691 20 0 FHADHM Cc1nc2cc(NC(=O)c3ccc(Cl)c(-c4nn[n-]n4)c3)ccc2s1 ZINC000826328438 609318919 /nfs/dbraw/zinc/31/89/19/609318919.db2.gz RHABVVSXAIDGFA-UHFFFAOYSA-N -1 3 370.825 3.691 20 0 FHADHM CCC(CC)[C@@H]1C[C@@H](Nc2cc(-c3nnn[n-]3)c3ccccc3n2)CCO1 ZINC000825107522 609322161 /nfs/dbraw/zinc/32/21/61/609322161.db2.gz PRXKCCXKIORCRY-KSSFIOAISA-N -1 3 366.469 3.811 20 0 FHADHM CCC(CC)[C@@H]1C[C@@H](Nc2cc(-c3nn[n-]n3)c3ccccc3n2)CCO1 ZINC000825107522 609322163 /nfs/dbraw/zinc/32/21/63/609322163.db2.gz PRXKCCXKIORCRY-KSSFIOAISA-N -1 3 366.469 3.811 20 0 FHADHM COCC[C@@H](Nc1cc(-c2nnn[n-]2)c2ccccc2n1)c1ccc(C)o1 ZINC000826155124 609322540 /nfs/dbraw/zinc/32/25/40/609322540.db2.gz HBXJRINCOUPLFI-MRXNPFEDSA-N -1 3 364.409 3.506 20 0 FHADHM COCC[C@@H](Nc1cc(-c2nn[n-]n2)c2ccccc2n1)c1ccc(C)o1 ZINC000826155124 609322541 /nfs/dbraw/zinc/32/25/41/609322541.db2.gz HBXJRINCOUPLFI-MRXNPFEDSA-N -1 3 364.409 3.506 20 0 FHADHM Fc1cccc2c1OCCC[C@H]2Nc1c(F)cc(-c2nnn[n-]2)cc1F ZINC000826371624 609324506 /nfs/dbraw/zinc/32/45/06/609324506.db2.gz MZDBQADKFFXWIV-CQSZACIVSA-N -1 3 361.327 3.610 20 0 FHADHM Fc1cccc2c1OCCC[C@H]2Nc1c(F)cc(-c2nn[n-]n2)cc1F ZINC000826371624 609324508 /nfs/dbraw/zinc/32/45/08/609324508.db2.gz MZDBQADKFFXWIV-CQSZACIVSA-N -1 3 361.327 3.610 20 0 FHADHM CC1(CNC(=O)c2ccccc2Oc2ccccc2-c2nnn[n-]2)CCC1 ZINC000824823335 609327179 /nfs/dbraw/zinc/32/71/79/609327179.db2.gz MJUUKTMBLKAFLK-UHFFFAOYSA-N -1 3 363.421 3.579 20 0 FHADHM CC1(CNC(=O)c2ccccc2Oc2ccccc2-c2nn[n-]n2)CCC1 ZINC000824823335 609327181 /nfs/dbraw/zinc/32/71/81/609327181.db2.gz MJUUKTMBLKAFLK-UHFFFAOYSA-N -1 3 363.421 3.579 20 0 FHADHM CC(C)COc1ccccc1CN[C@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000824271437 609328593 /nfs/dbraw/zinc/32/85/93/609328593.db2.gz NLQIUHLYPCYRDT-CQSZACIVSA-N -1 3 369.444 3.891 20 0 FHADHM CC(C)C(=O)Nc1ccc(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2F)cc1 ZINC000824185285 609345891 /nfs/dbraw/zinc/34/58/91/609345891.db2.gz USIUFLKJSKOGFE-GFCCVEGCSA-N -1 3 368.416 3.773 20 0 FHADHM CC(C)C(=O)Nc1ccc(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000824185285 609345893 /nfs/dbraw/zinc/34/58/93/609345893.db2.gz USIUFLKJSKOGFE-GFCCVEGCSA-N -1 3 368.416 3.773 20 0 FHADHM CCOc1cc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2F)ccc1OC ZINC000825615807 609346314 /nfs/dbraw/zinc/34/63/14/609346314.db2.gz LNUPSLYNVYKMBS-NSHDSACASA-N -1 3 357.389 3.586 20 0 FHADHM CCOc1cc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2F)ccc1OC ZINC000825615807 609346316 /nfs/dbraw/zinc/34/63/16/609346316.db2.gz LNUPSLYNVYKMBS-NSHDSACASA-N -1 3 357.389 3.586 20 0 FHADHM Cc1csc(C2(N[C@H](C)c3ccc(-c4nnn[n-]4)cc3F)CCC2)n1 ZINC000826320403 609348619 /nfs/dbraw/zinc/34/86/19/609348619.db2.gz PHDHQUUUGGNRKX-LLVKDONJSA-N -1 3 358.446 3.501 20 0 FHADHM Cc1csc(C2(N[C@H](C)c3ccc(-c4nn[n-]n4)cc3F)CCC2)n1 ZINC000826320403 609348623 /nfs/dbraw/zinc/34/86/23/609348623.db2.gz PHDHQUUUGGNRKX-LLVKDONJSA-N -1 3 358.446 3.501 20 0 FHADHM C[C@@H](Nc1ccc2c(c1)CCCN2C)c1ccc(-c2nnn[n-]2)cc1F ZINC000824657539 609349031 /nfs/dbraw/zinc/34/90/31/609349031.db2.gz QVWSINMAKCUTLL-GFCCVEGCSA-N -1 3 352.417 3.561 20 0 FHADHM C[C@@H](Nc1ccc2c(c1)CCCN2C)c1ccc(-c2nn[n-]n2)cc1F ZINC000824657539 609349034 /nfs/dbraw/zinc/34/90/34/609349034.db2.gz QVWSINMAKCUTLL-GFCCVEGCSA-N -1 3 352.417 3.561 20 0 FHADHM C[C@@H]1c2ccccc2CN1Cc1ccc(-c2nnn[n-]2)cc1Br ZINC000825029270 609363112 /nfs/dbraw/zinc/36/31/12/609363112.db2.gz QADIQJIATHPMQA-LLVKDONJSA-N -1 3 370.254 3.706 20 0 FHADHM C[C@@H]1c2ccccc2CN1Cc1ccc(-c2nn[n-]n2)cc1Br ZINC000825029270 609363114 /nfs/dbraw/zinc/36/31/14/609363114.db2.gz QADIQJIATHPMQA-LLVKDONJSA-N -1 3 370.254 3.706 20 0 FHADHM CC1CCN(C(=O)c2ccccc2Oc2ccccc2-c2nnn[n-]2)CC1 ZINC000824952767 609363810 /nfs/dbraw/zinc/36/38/10/609363810.db2.gz ARSSYYOCPYOWCR-UHFFFAOYSA-N -1 3 363.421 3.531 20 0 FHADHM CC1CCN(C(=O)c2ccccc2Oc2ccccc2-c2nn[n-]n2)CC1 ZINC000824952767 609363811 /nfs/dbraw/zinc/36/38/11/609363811.db2.gz ARSSYYOCPYOWCR-UHFFFAOYSA-N -1 3 363.421 3.531 20 0 FHADHM Cc1ccc(-c2ccc(C(=O)Nc3ccccc3-c3nnn[n-]3)s2)o1 ZINC000826273737 609371368 /nfs/dbraw/zinc/37/13/68/609371368.db2.gz RKXPUEPNQJRTRH-UHFFFAOYSA-N -1 3 351.391 3.749 20 0 FHADHM Cc1ccc(-c2ccc(C(=O)Nc3ccccc3-c3nn[n-]n3)s2)o1 ZINC000826273737 609371370 /nfs/dbraw/zinc/37/13/70/609371370.db2.gz RKXPUEPNQJRTRH-UHFFFAOYSA-N -1 3 351.391 3.749 20 0 FHADHM O=C(NC1CCC(c2ccc(F)cc2)CC1)c1sccc1-c1nnn[n-]1 ZINC000826429587 609409136 /nfs/dbraw/zinc/40/91/36/609409136.db2.gz IBYXGWVCXHDKNX-UHFFFAOYSA-N -1 3 371.441 3.524 20 0 FHADHM O=C(NC1CCC(c2ccc(F)cc2)CC1)c1sccc1-c1nn[n-]n1 ZINC000826429587 609409140 /nfs/dbraw/zinc/40/91/40/609409140.db2.gz IBYXGWVCXHDKNX-UHFFFAOYSA-N -1 3 371.441 3.524 20 0 FHADHM Cc1ccccc1CNc1ccn(-c2ccc(Cl)cc2-c2nnn[n-]2)n1 ZINC000826307503 609446042 /nfs/dbraw/zinc/44/60/42/609446042.db2.gz KYUGAEJXDKFCAL-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM Cc1ccccc1CNc1ccn(-c2ccc(Cl)cc2-c2nn[n-]n2)n1 ZINC000826307503 609446044 /nfs/dbraw/zinc/44/60/44/609446044.db2.gz KYUGAEJXDKFCAL-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM CC(C)n1ccc(CSc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)n1 ZINC000824371782 609452082 /nfs/dbraw/zinc/45/20/82/609452082.db2.gz SCFNEFSWHGVZJQ-UHFFFAOYSA-N -1 3 368.388 3.955 20 0 FHADHM CC(C)n1ccc(CSc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)n1 ZINC000824371782 609452084 /nfs/dbraw/zinc/45/20/84/609452084.db2.gz SCFNEFSWHGVZJQ-UHFFFAOYSA-N -1 3 368.388 3.955 20 0 FHADHM COc1ncccc1CSc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000826222518 609452812 /nfs/dbraw/zinc/45/28/12/609452812.db2.gz ZNGXDEWUVJYFKU-UHFFFAOYSA-N -1 3 367.356 3.581 20 0 FHADHM COc1ncccc1CSc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000826222518 609452813 /nfs/dbraw/zinc/45/28/13/609452813.db2.gz ZNGXDEWUVJYFKU-UHFFFAOYSA-N -1 3 367.356 3.581 20 0 FHADHM O=C(CSc1ccc(-c2nnn[n-]2)cc1)Nc1csc2ccccc12 ZINC000826420983 609459435 /nfs/dbraw/zinc/45/94/35/609459435.db2.gz MFEHCQPTUYDYES-UHFFFAOYSA-N -1 3 367.459 3.812 20 0 FHADHM O=C(CSc1ccc(-c2nn[n-]n2)cc1)Nc1csc2ccccc12 ZINC000826420983 609459437 /nfs/dbraw/zinc/45/94/37/609459437.db2.gz MFEHCQPTUYDYES-UHFFFAOYSA-N -1 3 367.459 3.812 20 0 FHADHM COc1c(Cl)cc(NCc2cccc(-c3nnn[n-]3)c2F)cc1Cl ZINC000826166932 609478024 /nfs/dbraw/zinc/47/80/24/609478024.db2.gz IDJTXZHLFDZKEJ-UHFFFAOYSA-N -1 3 368.199 3.933 20 0 FHADHM COc1c(Cl)cc(NCc2cccc(-c3nn[n-]n3)c2F)cc1Cl ZINC000826166932 609478026 /nfs/dbraw/zinc/47/80/26/609478026.db2.gz IDJTXZHLFDZKEJ-UHFFFAOYSA-N -1 3 368.199 3.933 20 0 FHADHM CCCOc1cc(CNc2cc(-c3nnn[n-]3)ccc2C)ccc1OC ZINC000825338953 609478649 /nfs/dbraw/zinc/47/86/49/609478649.db2.gz LGZOFNMEZOYKQF-UHFFFAOYSA-N -1 3 353.426 3.585 20 0 FHADHM CCCOc1cc(CNc2cc(-c3nn[n-]n3)ccc2C)ccc1OC ZINC000825338953 609478650 /nfs/dbraw/zinc/47/86/50/609478650.db2.gz LGZOFNMEZOYKQF-UHFFFAOYSA-N -1 3 353.426 3.585 20 0 FHADHM CSc1c(F)cc(NCc2cc(-c3nnn[n-]3)ccc2F)cc1F ZINC000826229481 609482022 /nfs/dbraw/zinc/48/20/22/609482022.db2.gz GEPFNNIPONEFEP-UHFFFAOYSA-N -1 3 351.357 3.618 20 0 FHADHM CSc1c(F)cc(NCc2cc(-c3nn[n-]n3)ccc2F)cc1F ZINC000826229481 609482025 /nfs/dbraw/zinc/48/20/25/609482025.db2.gz GEPFNNIPONEFEP-UHFFFAOYSA-N -1 3 351.357 3.618 20 0 FHADHM Cc1cnc(C(=O)Oc2ccc(-c3ccc(-c4nnn[n-]4)cc3)cc2)c(C)c1 ZINC000826317834 609505627 /nfs/dbraw/zinc/50/56/27/609505627.db2.gz OJFOAXGBZFPLJN-UHFFFAOYSA-N -1 3 371.400 3.765 20 0 FHADHM Cc1cnc(C(=O)Oc2ccc(-c3ccc(-c4nn[n-]n4)cc3)cc2)c(C)c1 ZINC000826317834 609505628 /nfs/dbraw/zinc/50/56/28/609505628.db2.gz OJFOAXGBZFPLJN-UHFFFAOYSA-N -1 3 371.400 3.765 20 0 FHADHM FC(F)Oc1cc(NCc2ccccc2-c2nnn[n-]2)ccc1Cl ZINC000826369963 609513372 /nfs/dbraw/zinc/51/33/72/609513372.db2.gz XGVJAJZDJFFAML-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM FC(F)Oc1cc(NCc2ccccc2-c2nn[n-]n2)ccc1Cl ZINC000826369963 609513374 /nfs/dbraw/zinc/51/33/74/609513374.db2.gz XGVJAJZDJFFAML-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM CCOc1ccc([C@H](C)Nc2nccc(C)c2-c2nnn[n-]2)cc1OCC ZINC000825638292 609519394 /nfs/dbraw/zinc/51/93/94/609519394.db2.gz JANYDVBXKDBYFP-ZDUSSCGKSA-N -1 3 368.441 3.541 20 0 FHADHM CCOc1ccc([C@H](C)Nc2nccc(C)c2-c2nn[n-]n2)cc1OCC ZINC000825638292 609519396 /nfs/dbraw/zinc/51/93/96/609519396.db2.gz JANYDVBXKDBYFP-ZDUSSCGKSA-N -1 3 368.441 3.541 20 0 FHADHM Cc1ccnc(N[C@H](C)c2ccccc2Br)c1-c1nnn[n-]1 ZINC000826312042 609527339 /nfs/dbraw/zinc/52/73/39/609527339.db2.gz UOPCTXDLWBOMFC-SNVBAGLBSA-N -1 3 359.231 3.506 20 0 FHADHM Cc1ccnc(N[C@H](C)c2ccccc2Br)c1-c1nn[n-]n1 ZINC000826312042 609527341 /nfs/dbraw/zinc/52/73/41/609527341.db2.gz UOPCTXDLWBOMFC-SNVBAGLBSA-N -1 3 359.231 3.506 20 0 FHADHM CC[C@H](C)[C@@H](C)C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)nc1 ZINC000825051823 609527687 /nfs/dbraw/zinc/52/76/87/609527687.db2.gz SMCHPYRDXVICRP-QWHCGFSZSA-N -1 3 366.425 3.675 20 0 FHADHM CC[C@H](C)[C@@H](C)C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)nc1 ZINC000825051823 609527688 /nfs/dbraw/zinc/52/76/88/609527688.db2.gz SMCHPYRDXVICRP-QWHCGFSZSA-N -1 3 366.425 3.675 20 0 FHADHM Cc1c(Cl)cnc(N2CCC(c3ccccc3)CC2)c1-c1nnn[n-]1 ZINC000826237912 609528710 /nfs/dbraw/zinc/52/87/10/609528710.db2.gz PXEYFLGKMISSGE-UHFFFAOYSA-N -1 3 354.845 3.608 20 0 FHADHM Cc1c(Cl)cnc(N2CCC(c3ccccc3)CC2)c1-c1nn[n-]n1 ZINC000826237912 609528713 /nfs/dbraw/zinc/52/87/13/609528713.db2.gz PXEYFLGKMISSGE-UHFFFAOYSA-N -1 3 354.845 3.608 20 0 FHADHM CC[C@@H](Nc1ncc(Cl)c(C)c1-c1nnn[n-]1)c1ccccc1OC ZINC000825146277 609532294 /nfs/dbraw/zinc/53/22/94/609532294.db2.gz BKKXBLQJZXETQK-CYBMUJFWSA-N -1 3 358.833 3.795 20 0 FHADHM CC[C@@H](Nc1ncc(Cl)c(C)c1-c1nn[n-]n1)c1ccccc1OC ZINC000825146277 609532296 /nfs/dbraw/zinc/53/22/96/609532296.db2.gz BKKXBLQJZXETQK-CYBMUJFWSA-N -1 3 358.833 3.795 20 0 FHADHM Cc1c(Cl)cnc(NCc2csc(-c3ccco3)n2)c1-c1nnn[n-]1 ZINC000826240117 609576843 /nfs/dbraw/zinc/57/68/43/609576843.db2.gz CRZYXIMQEXYBHN-UHFFFAOYSA-N -1 3 373.829 3.552 20 0 FHADHM Cc1c(Cl)cnc(NCc2csc(-c3ccco3)n2)c1-c1nn[n-]n1 ZINC000826240117 609576845 /nfs/dbraw/zinc/57/68/45/609576845.db2.gz CRZYXIMQEXYBHN-UHFFFAOYSA-N -1 3 373.829 3.552 20 0 FHADHM Cc1c(Cl)cnc(N[C@H]2CCOC3(CCCCC3)C2)c1-c1nnn[n-]1 ZINC000826239746 609578412 /nfs/dbraw/zinc/57/84/12/609578412.db2.gz PCUKFIRAKSZLBN-LBPRGKRZSA-N -1 3 362.865 3.517 20 0 FHADHM Cc1c(Cl)cnc(N[C@H]2CCOC3(CCCCC3)C2)c1-c1nn[n-]n1 ZINC000826239746 609578414 /nfs/dbraw/zinc/57/84/14/609578414.db2.gz PCUKFIRAKSZLBN-LBPRGKRZSA-N -1 3 362.865 3.517 20 0 FHADHM COc1cccc([C@H]2C[C@@H](C)CN2c2ccc(-c3nn[n-]n3)cc2F)c1 ZINC000826215274 609592980 /nfs/dbraw/zinc/59/29/80/609592980.db2.gz KLHACZJRXBOIGJ-KZULUSFZSA-N -1 3 353.401 3.602 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CNCc1ccc(Oc2ccccc2)o1 ZINC000826373778 609594237 /nfs/dbraw/zinc/59/42/37/609594237.db2.gz ZCOLLHLUWUGVAZ-UHFFFAOYSA-N -1 3 365.368 3.681 20 0 FHADHM Fc1cccc([C@@H](NCc2ccc(-c3nnn[n-]3)cc2)C(F)(F)F)c1F ZINC000826376604 609608659 /nfs/dbraw/zinc/60/86/59/609608659.db2.gz KTXADASDUAXRCI-CQSZACIVSA-N -1 3 369.297 3.538 20 0 FHADHM Fc1cccc([C@@H](NCc2ccc(-c3nn[n-]n3)cc2)C(F)(F)F)c1F ZINC000826376604 609608661 /nfs/dbraw/zinc/60/86/61/609608661.db2.gz KTXADASDUAXRCI-CQSZACIVSA-N -1 3 369.297 3.538 20 0 FHADHM O=c1[nH]c(CC(F)(F)F)c([O-])n1-c1ccc(COC2CCCC2)cc1 ZINC000277996890 936333640 /nfs/dbraw/zinc/33/36/40/936333640.db2.gz KGZKBECVPMSRMP-AWEZNQCLSA-N -1 3 356.344 3.523 20 0 FHADHM O=C1[N-]C(=O)C(=CNc2ccc(COC3CCCC3)cc2)c2ccccc21 ZINC000255561551 936363950 /nfs/dbraw/zinc/36/39/50/936363950.db2.gz CJKFPVFFJNHTAD-MOSHPQCFSA-N -1 3 362.429 3.869 20 0 FHADHM C[C@H]1CCN(C(=O)NCc2ccc([O-])c(Br)c2)C[C@H](C)C1 ZINC000506374587 945065308 /nfs/dbraw/zinc/06/53/08/945065308.db2.gz DRGXMUADBUFJAG-NWDGAFQWSA-N -1 3 355.276 3.732 20 0 FHADHM O=C([O-])c1cccc(CCNCc2cc(F)ccc2Br)c1 ZINC000426679647 937105260 /nfs/dbraw/zinc/10/52/60/937105260.db2.gz IPDVOPFMFKJULP-UHFFFAOYSA-N -1 3 352.203 3.619 20 0 FHADHM C[C@H]1CC[C@H]([N-]S(=O)(=O)c2c(Cl)cccc2Br)C1 ZINC000304326940 927313515 /nfs/dbraw/zinc/31/35/15/927313515.db2.gz TVWLPFXBWGZZPI-IUCAKERBSA-N -1 3 352.681 3.569 20 0 FHADHM CCC1([N-]S(=O)(=O)c2cc(Cl)ccc2C(F)(F)F)CCOCC1 ZINC000510050445 927461920 /nfs/dbraw/zinc/46/19/20/927461920.db2.gz QPQQDTJCKWOMDU-UHFFFAOYSA-N -1 3 371.808 3.596 20 0 FHADHM CN(Cc1c2ccccc2sc1C(=O)[O-])C[C@H]1COc2ccccc2O1 ZINC000583147529 937168723 /nfs/dbraw/zinc/16/87/23/937168723.db2.gz NHMQWAYACLUJSE-ZDUSSCGKSA-N -1 3 369.442 3.871 20 0 FHADHM CN(Cc1c2ccccc2sc1C(=O)[O-])C[C@@H]1COc2ccccc2O1 ZINC000583147526 937168797 /nfs/dbraw/zinc/16/87/97/937168797.db2.gz NHMQWAYACLUJSE-CYBMUJFWSA-N -1 3 369.442 3.871 20 0 FHADHM Cc1ccc(C(=O)NCC2(c3ccc(Cl)cc3)CCOCC2)c([O-])c1 ZINC000108951966 927683727 /nfs/dbraw/zinc/68/37/27/927683727.db2.gz AFCVRUHWQQNYDE-UHFFFAOYSA-N -1 3 359.853 3.832 20 0 FHADHM COc1ccc([C@H](CC(=O)[O-])NCc2cccc(Br)c2)cc1 ZINC000683171604 927748306 /nfs/dbraw/zinc/74/83/06/927748306.db2.gz MZWHRYJOISFZMS-INIZCTEOSA-N -1 3 364.239 3.763 20 0 FHADHM CC[C@H](C)Oc1cc(CN[C@H](C(=O)[O-])c2ccc(F)cc2)ccc1OC ZINC000683172243 927754167 /nfs/dbraw/zinc/75/41/67/927754167.db2.gz BDVHCFKIEXDZBR-DJJJIMSYSA-N -1 3 361.413 3.927 20 0 FHADHM Cc1ccc(F)cc1CN[C@@H](C(=O)[O-])c1cccc(Br)c1 ZINC000683175628 927770729 /nfs/dbraw/zinc/77/07/29/927770729.db2.gz ZBTMHTZQTGYCEN-OAHLLOKOSA-N -1 3 352.203 3.812 20 0 FHADHM Cn1cc(CN[C@@H]2C[C@@H](C(=O)[O-])c3ccccc32)c(C2CCCCC2)n1 ZINC000579814689 927849148 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Cc1cc(Cl)cc(C(=O)Nc2ccc(-c3nc(C)cc(=O)[n-]3)cc2)c1 ZINC000150864706 937301136 /nfs/dbraw/zinc/30/11/36/937301136.db2.gz HRRKFQZMKSPVLJ-UHFFFAOYSA-N -1 3 353.809 3.959 20 0 FHADHM CC(C)(C)OCc1cc(C[N-]C(=O)C(F)(F)c2ccccc2F)no1 ZINC000275006509 929151187 /nfs/dbraw/zinc/15/11/87/929151187.db2.gz OYEDYQUUDRDFCY-UHFFFAOYSA-N -1 3 356.344 3.537 20 0 FHADHM C[C@@H](NC(=O)CCCc1ccc([O-])c(F)c1)c1cnn(CC2CCC2)c1 ZINC000890672369 929206499 /nfs/dbraw/zinc/20/64/99/929206499.db2.gz VEEDWDCVSLCZJR-CQSZACIVSA-N -1 3 359.445 3.728 20 0 FHADHM CSc1ccc(Cl)c(C(=O)Nc2ccccc2[N-]S(C)(=O)=O)c1 ZINC000060102471 929332549 /nfs/dbraw/zinc/33/25/49/929332549.db2.gz CZCWPNUJOXNNPM-UHFFFAOYSA-N -1 3 370.883 3.686 20 0 FHADHM COCCOc1ccc(CC(=O)Nc2ccc([O-])c(C(F)(F)F)c2)cc1 ZINC000430300863 929545493 /nfs/dbraw/zinc/54/54/93/929545493.db2.gz JCCUTDNJXVDAMD-UHFFFAOYSA-N -1 3 369.339 3.617 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N2CCCCC[C@@H]2c2ccncc2)c1 ZINC000121851230 929751322 /nfs/dbraw/zinc/75/13/22/929751322.db2.gz 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COc1ccc(S(=O)(=O)[N-]c2cc(F)cc(F)c2F)cc1Cl ZINC000431158112 933972640 /nfs/dbraw/zinc/97/26/40/933972640.db2.gz HSTGVPRBTNXGMR-UHFFFAOYSA-N -1 3 351.733 3.567 20 0 FHADHM CCOC(=O)c1csc([C@H]2CCCN2C(=O)c2ccc(CC)cc2[O-])n1 ZINC000276923012 934002495 /nfs/dbraw/zinc/00/24/95/934002495.db2.gz WRIYLPCLSFXMFI-OAHLLOKOSA-N -1 3 374.462 3.565 20 0 FHADHM COC(=O)c1cccc2[n-]c(NC(=O)CCc3cccc(Cl)c3)nc21 ZINC000535729917 934323647 /nfs/dbraw/zinc/32/36/47/934323647.db2.gz QSGBYEWWHWENCL-UHFFFAOYSA-N -1 3 357.797 3.574 20 0 FHADHM C[C@@H]1Cc2cc(F)ccc2[C@@H](C)N1C(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000535818808 934490076 /nfs/dbraw/zinc/49/00/76/934490076.db2.gz GWSKYLBFHZEYCB-CHWSQXEVSA-N -1 3 350.393 3.815 20 0 FHADHM Cc1nc(-c2ccc(S(=O)(=O)[N-]C[C@]3(C)CC3(F)F)s2)cs1 ZINC000657154835 934514988 /nfs/dbraw/zinc/51/49/88/934514988.db2.gz DHXIBWCFZXWPTK-LBPRGKRZSA-N -1 3 364.464 3.504 20 0 FHADHM Cc1cc(Br)sc1S(=O)(=O)[N-]CC[C@@]1(C)CC1(F)F ZINC000657156448 934530756 /nfs/dbraw/zinc/53/07/56/934530756.db2.gz FPZYPLUGNXKSOC-JTQLQIEISA-N -1 3 374.272 3.533 20 0 FHADHM COC(=O)c1cccc2[n-]c(NC(=O)C3(c4ccc(F)cc4)CCC3)nc21 ZINC000610953361 934652413 /nfs/dbraw/zinc/65/24/13/934652413.db2.gz FCUIQUSBMAZPAL-UHFFFAOYSA-N -1 3 367.380 3.549 20 0 FHADHM COC(=O)c1cccc2[n-]c(NC(=O)c3cc4cc(Cl)ccc4[nH]3)nc21 ZINC000610953336 934652598 /nfs/dbraw/zinc/65/25/98/934652598.db2.gz GWHHZFNWBVVVSQ-UHFFFAOYSA-N -1 3 368.780 3.737 20 0 FHADHM COc1ccc([C@@H](CC(=O)[O-])NCc2ccc(Cl)s2)cc1OC ZINC000277235235 934823511 /nfs/dbraw/zinc/82/35/11/934823511.db2.gz IVJYGUMZKWEPPY-GFCCVEGCSA-N -1 3 355.843 3.724 20 0 FHADHM O=S(=O)([N-][C@@H]1CCC(F)(F)C1)c1cc(Cl)ccc1Br ZINC000684658838 934850871 /nfs/dbraw/zinc/85/08/71/934850871.db2.gz CIEQYEKVFWDBII-MRVPVSSYSA-N -1 3 374.634 3.569 20 0 FHADHM C[C@@H]([N-]S(=O)(=O)c1ccc(Cl)cc1Cl)c1c(F)cncc1F ZINC000511027772 934953952 /nfs/dbraw/zinc/95/39/52/934953952.db2.gz ILWYCMFWJNIQRH-SSDOTTSWSA-N -1 3 367.204 3.706 20 0 FHADHM CC[C@@H](CSc1ccc(C)c(C)c1)NC(=O)NCc1ncccc1[O-] ZINC000472120733 935088865 /nfs/dbraw/zinc/08/88/65/935088865.db2.gz UJVAUYLCJLRQCZ-HNNXBMFYSA-N -1 3 359.495 3.774 20 0 FHADHM Cc1nc(CSc2nc(-c3ccccc3)ccc2-c2nnn[n-]2)oc1C ZINC000737476275 945077352 /nfs/dbraw/zinc/07/73/52/945077352.db2.gz ADNWSUMCKNYYRN-UHFFFAOYSA-N -1 3 364.434 3.826 20 0 FHADHM Cc1nc(CSc2nc(-c3ccccc3)ccc2-c2nn[n-]n2)oc1C ZINC000737476275 945077358 /nfs/dbraw/zinc/07/73/58/945077358.db2.gz ADNWSUMCKNYYRN-UHFFFAOYSA-N -1 3 364.434 3.826 20 0 FHADHM CC[C@@H](C)NC(=O)c1cccc(CNC(=O)c2cc([O-])ccc2Cl)c1 ZINC000277431484 935166409 /nfs/dbraw/zinc/16/64/09/935166409.db2.gz MYQUNOCWRFSSPD-GFCCVEGCSA-N -1 3 360.841 3.504 20 0 FHADHM CC(C)CC(=O)Nc1cccc(CNC(=O)NCc2ccc([O-])c(F)c2)c1 ZINC000157798069 935197129 /nfs/dbraw/zinc/19/71/29/935197129.db2.gz ICMJUQUSPRKARP-UHFFFAOYSA-N -1 3 373.428 3.515 20 0 FHADHM CC(C)C(C)(C)NC(=O)C[C@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000518151794 945086106 /nfs/dbraw/zinc/08/61/06/945086106.db2.gz QNTLEOIQFHGMJI-IBGZPJMESA-N -1 3 368.477 3.804 20 0 FHADHM CC(C)C(C)(C)NC(=O)C[C@@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000518151798 945086526 /nfs/dbraw/zinc/08/65/26/945086526.db2.gz QNTLEOIQFHGMJI-LJQANCHMSA-N -1 3 368.477 3.804 20 0 FHADHM O=C(N=c1cc(-c2ccccc2)[n-][nH]1)c1cc(F)cc(Br)c1 ZINC000519067060 945090538 /nfs/dbraw/zinc/09/05/38/945090538.db2.gz BMFCCHNXYUEXAD-UHFFFAOYSA-N -1 3 360.186 3.653 20 0 FHADHM O=C([N-]c1nc(-c2cccc(C(F)(F)F)c2)cs1)c1cccc[n+]1[O-] ZINC000121779783 935350820 /nfs/dbraw/zinc/35/08/20/935350820.db2.gz SIZGNYDXIMIABE-UHFFFAOYSA-N -1 3 365.336 3.715 20 0 FHADHM Fc1ccc(F)c(CNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)c1 ZINC000737659683 945108902 /nfs/dbraw/zinc/10/89/02/945108902.db2.gz LXHSNGPDMONGMX-UHFFFAOYSA-N -1 3 355.270 3.776 20 0 FHADHM Fc1ccc(F)c(CNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)c1 ZINC000737659683 945108908 /nfs/dbraw/zinc/10/89/08/945108908.db2.gz LXHSNGPDMONGMX-UHFFFAOYSA-N -1 3 355.270 3.776 20 0 FHADHM C[C@H]1CN(Cc2ccccc2NC(=O)c2cc([O-])ccc2Cl)C[C@H](C)O1 ZINC000277561504 935571401 /nfs/dbraw/zinc/57/14/01/935571401.db2.gz XDZJIRDGTMZPLP-KBPBESRZSA-N -1 3 374.868 3.907 20 0 FHADHM CC(C)N(Cc1nc2ccccc2c(=O)[nH]1)Cc1c(F)ccc([O-])c1F ZINC000507295753 945113337 /nfs/dbraw/zinc/11/33/37/945113337.db2.gz PIEDONFOCRPZKU-UHFFFAOYSA-N -1 3 359.376 3.730 20 0 FHADHM C[C@@H](c1ccc(Cl)cc1)[C@H](C)N(C)C(=O)c1nnc2ccccc2c1[O-] ZINC000176669616 935670053 /nfs/dbraw/zinc/67/00/53/935670053.db2.gz IKAFKTNYVIDSMI-OLZOCXBDSA-N -1 3 369.852 3.841 20 0 FHADHM CCCCCN(Cc1ccc(F)cc1)C(=O)CCc1c(C)nc(C)[n-]c1=O ZINC000073001898 935741139 /nfs/dbraw/zinc/74/11/39/935741139.db2.gz JJUWLDCYBHBVIM-UHFFFAOYSA-N -1 3 373.472 3.677 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)C1(c2ccc(F)cc2)CCCCC1 ZINC000519099528 945121724 /nfs/dbraw/zinc/12/17/24/945121724.db2.gz ZEFJUCZMLNSMOS-UHFFFAOYSA-N -1 3 365.412 3.846 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)C1(c2ccc(F)cc2)CCCCC1 ZINC000519099528 945121727 /nfs/dbraw/zinc/12/17/27/945121727.db2.gz ZEFJUCZMLNSMOS-UHFFFAOYSA-N -1 3 365.412 3.846 20 0 FHADHM [O-]C(=NO[C@H]1CCCCO1)Nc1ccnn1Cc1cccc2ccccc21 ZINC000159301650 935832059 /nfs/dbraw/zinc/83/20/59/935832059.db2.gz QXQCPLCALAFZMV-IBGZPJMESA-N -1 3 366.421 3.664 20 0 FHADHM CC(=O)Nc1ccc(Cl)cc1[N-]S(=O)(=O)/C=C/c1ccc(F)cc1 ZINC000176697935 935869994 /nfs/dbraw/zinc/86/99/94/935869994.db2.gz HQFWMUMFOVUORH-CMDGGOBGSA-N -1 3 368.817 3.850 20 0 FHADHM CCn1c(COc2ccc(C)cc2)nnc1SCc1ncccc1[O-] ZINC000582617920 935879238 /nfs/dbraw/zinc/87/92/38/935879238.db2.gz RPVFRIHFUSLIGS-UHFFFAOYSA-N -1 3 356.451 3.578 20 0 FHADHM CC(=O)Nc1cc(Cl)ccc1[N-]S(=O)(=O)/C=C/c1ccc(F)cc1 ZINC000176706694 935885297 /nfs/dbraw/zinc/88/52/97/935885297.db2.gz WGSLHNQCWMKFNN-CMDGGOBGSA-N -1 3 368.817 3.850 20 0 FHADHM CCC[C@@H](C)CC(=O)Nc1cc(C(F)(F)F)ccc1[N-]S(C)(=O)=O ZINC000519115635 945137541 /nfs/dbraw/zinc/13/75/41/945137541.db2.gz FIIMYTGTVCNFCO-SNVBAGLBSA-N -1 3 366.405 3.842 20 0 FHADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CCC2(C1)CCOCC2 ZINC000075540778 936009368 /nfs/dbraw/zinc/00/93/68/936009368.db2.gz KOFIYXJUEVQIOS-UHFFFAOYSA-N -1 3 365.473 3.820 20 0 FHADHM Cc1cccc(S(=O)(=O)[N-]c2ccc(OCc3cccnc3)cc2)c1 ZINC000728514752 936010342 /nfs/dbraw/zinc/01/03/42/936010342.db2.gz VCYZQFNKRJHVPR-UHFFFAOYSA-N -1 3 354.431 3.770 20 0 FHADHM Cc1c2cc(F)ccc2oc1S(=O)(=O)[N-][C@H]1CCCC12CCOCC2 ZINC000548761408 936040438 /nfs/dbraw/zinc/04/04/38/936040438.db2.gz QAMROQJNYKZAOI-INIZCTEOSA-N -1 3 367.442 3.508 20 0 FHADHM O=C(N=c1cc2ccccn2[n-]1)NCc1ccc(COc2ccccc2)cc1 ZINC000548763183 936067520 /nfs/dbraw/zinc/06/75/20/936067520.db2.gz PWLRKWHUTYQROZ-UHFFFAOYSA-N -1 3 372.428 3.657 20 0 FHADHM O=C(N=c1cc2ccccn2[n-]1)N[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000548763301 936070907 /nfs/dbraw/zinc/07/09/07/936070907.db2.gz SLLHVBPRARVANA-SWLSCSKDSA-N -1 3 361.232 3.741 20 0 FHADHM CC(C)(C)c1csc(C[N-]S(=O)(=O)c2cnc3ccsc3c2)n1 ZINC000437220158 945145847 /nfs/dbraw/zinc/14/58/47/945145847.db2.gz PQUYJCXMZMDWQT-UHFFFAOYSA-N -1 3 367.521 3.529 20 0 FHADHM COc1cccc(F)c1[C@H](C)Nc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1 ZINC000078421196 936152920 /nfs/dbraw/zinc/15/29/20/936152920.db2.gz IZPQJTXQJXJGQT-ZDUSSCGKSA-N -1 3 368.412 3.770 20 0 FHADHM CCOC(=O)c1nc(Cl)nc(Cl)c1Nc1cc(F)c([O-])c(F)c1 ZINC001213374843 936215441 /nfs/dbraw/zinc/21/54/41/936215441.db2.gz BXKYXLKSUIXFKH-UHFFFAOYSA-N -1 3 364.135 3.688 20 0 FHADHM Cc1cccnc1OC1CCN(C(=O)c2cc([O-])c3ccccc3c2)CC1 ZINC000582861425 936228049 /nfs/dbraw/zinc/22/80/49/936228049.db2.gz XPXJNWYJIIGSME-UHFFFAOYSA-N -1 3 362.429 3.932 20 0 FHADHM Cc1ccc(C(=O)N2CCC[C@H](C(=O)Nc3ccc(Cl)cc3[O-])C2)cc1 ZINC000153528685 936243057 /nfs/dbraw/zinc/24/30/57/936243057.db2.gz IYXLNKNZOASDLZ-HNNXBMFYSA-N -1 3 372.852 3.845 20 0 FHADHM CC(=O)c1cccc(NC(=O)C2(c3cccc(Cl)c3)CCOCC2)c1[O-] ZINC000583526752 938292301 /nfs/dbraw/zinc/29/23/01/938292301.db2.gz ZOUUHRNKDJIULR-UHFFFAOYSA-N -1 3 373.836 3.935 20 0 FHADHM [O-]C(=NO[C@H]1CCCCO1)Nc1cc(Br)c(F)cc1Cl ZINC000161886420 938416143 /nfs/dbraw/zinc/41/61/43/938416143.db2.gz PZBKEXGLHFQWHV-NSHDSACASA-N -1 3 367.602 3.821 20 0 FHADHM O=C([N-]O[C@H]1CCCCO1)Nc1cc(Br)c(F)cc1Cl ZINC000161886420 938416145 /nfs/dbraw/zinc/41/61/45/938416145.db2.gz PZBKEXGLHFQWHV-NSHDSACASA-N -1 3 367.602 3.821 20 0 FHADHM CCC(C)(C)c1ccc(CN2CCC[C@@H](n3cc(C(=O)[O-])nn3)C2)cc1 ZINC000583877356 938461516 /nfs/dbraw/zinc/46/15/16/938461516.db2.gz GQHUKQVTONUBSU-QGZVFWFLSA-N -1 3 356.470 3.501 20 0 FHADHM CCOC(=O)c1ccc(NC(=O)CCc2ccccc2OCC)c([O-])c1 ZINC000536193797 938544570 /nfs/dbraw/zinc/54/45/70/938544570.db2.gz UYWHLZQQPJXXEO-UHFFFAOYSA-N -1 3 357.406 3.539 20 0 FHADHM O=C(NCc1ccc([O-])c(Br)c1)c1cc(-c2ccccc2)no1 ZINC000151554413 938574260 /nfs/dbraw/zinc/57/42/60/938574260.db2.gz XHGLNBMILPJYLN-UHFFFAOYSA-N -1 3 373.206 3.740 20 0 FHADHM Cc1cc(S(=O)(=O)[N-][C@H](C)C[C@H](O)c2cccs2)sc1Cl ZINC000188126421 938581397 /nfs/dbraw/zinc/58/13/97/938581397.db2.gz WAAROCLMNZRRAO-ZJUUUORDSA-N -1 3 365.929 3.562 20 0 FHADHM O=C([O-])c1csc(CN(CCc2ccc(Cl)cc2)CC2CC2)n1 ZINC000565102562 938586470 /nfs/dbraw/zinc/58/64/70/938586470.db2.gz HGOGIDGSCBRLNK-UHFFFAOYSA-N -1 3 350.871 3.949 20 0 FHADHM O=C(NCc1ccc([O-])c(Br)c1)c1ccc(F)c(F)c1F ZINC000151613670 938603699 /nfs/dbraw/zinc/60/36/99/938603699.db2.gz SZMANOFOHXGJOL-UHFFFAOYSA-N -1 3 360.129 3.502 20 0 FHADHM O=C(Cc1cccc(Cl)c1)NCc1ccc([O-])c(Br)c1 ZINC000151618527 938606344 /nfs/dbraw/zinc/60/63/44/938606344.db2.gz KETNKHXJUVFEET-UHFFFAOYSA-N -1 3 354.631 3.667 20 0 FHADHM CSc1ccsc1C(=O)NCc1ccc([O-])c(Br)c1 ZINC000151646720 938612632 /nfs/dbraw/zinc/61/26/32/938612632.db2.gz WZCDGSCUZWHUTQ-UHFFFAOYSA-N -1 3 358.282 3.868 20 0 FHADHM Cc1nc(C)c(CCC(=O)NC(C)(C)c2ccc(C(C)(C)C)cc2)c(=O)[n-]1 ZINC000151689131 938629573 /nfs/dbraw/zinc/62/95/73/938629573.db2.gz XWPGNJNECSWCTH-UHFFFAOYSA-N -1 3 369.509 3.668 20 0 FHADHM C[C@H]1[C@H](C(=O)[O-])CCN1Cc1cc(Cl)ccc1OCc1cccnc1 ZINC000584178236 938630349 /nfs/dbraw/zinc/63/03/49/938630349.db2.gz ITKAYRVFYREESM-SUMWQHHRSA-N -1 3 360.841 3.609 20 0 FHADHM O=S(=O)(CCc1cccs1)[N-]c1cc(F)c(OC(F)F)cc1F ZINC000584238125 938650535 /nfs/dbraw/zinc/65/05/35/938650535.db2.gz GRBLFAFJZNJKHN-UHFFFAOYSA-N -1 3 369.361 3.612 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)N3CCC(F)(F)[C@@H](C)C3)cc2)cc(=O)[n-]1 ZINC000584260326 938659681 /nfs/dbraw/zinc/65/96/81/938659681.db2.gz ZEOAODXHCAKBAD-NSHDSACASA-N -1 3 362.380 3.667 20 0 FHADHM [O-]C(=NO[C@@H]1CCCCO1)Nc1ccc(Oc2cccc(F)c2F)nc1 ZINC000278713997 938676675 /nfs/dbraw/zinc/67/66/75/938676675.db2.gz REMRXUZCOUNLQI-OAHLLOKOSA-N -1 3 365.336 3.732 20 0 FHADHM O=C([N-]O[C@@H]1CCCCO1)Nc1ccc(Oc2cccc(F)c2F)nc1 ZINC000278713997 938676677 /nfs/dbraw/zinc/67/66/77/938676677.db2.gz REMRXUZCOUNLQI-OAHLLOKOSA-N -1 3 365.336 3.732 20 0 FHADHM Cc1ccc([C@@H]2OCCC[C@@H]2NC(=O)NCc2ccc([O-])c(F)c2)cc1 ZINC000080717623 938696781 /nfs/dbraw/zinc/69/67/81/938696781.db2.gz UQGSJGGDOBSMLP-HKUYNNGSSA-N -1 3 358.413 3.559 20 0 FHADHM CSc1nc(=O)[n-]c(C)c1C(=O)Nc1cnc(-c2ccccc2)s1 ZINC000092505177 938914555 /nfs/dbraw/zinc/91/45/55/938914555.db2.gz XNHZTJSQKQZCHF-UHFFFAOYSA-N -1 3 358.448 3.588 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N2CC=C(c3cccc(C)c3)CC2)c1 ZINC000092695582 938918377 /nfs/dbraw/zinc/91/83/77/938918377.db2.gz PCPKRZASDKAJTG-UHFFFAOYSA-N -1 3 350.418 3.589 20 0 FHADHM Cc1ccc(C(=O)N2C[C@H](O)C[C@@H]2c2ccc(C(F)(F)F)cc2)c([O-])c1 ZINC000093245546 938928099 /nfs/dbraw/zinc/92/80/99/938928099.db2.gz BJMPRFKZTPETRX-GDBMZVCRSA-N -1 3 365.351 3.668 20 0 FHADHM Cn1cc(-c2ccnc(/C=C/c3cc([O-])ccc3Br)n2)cn1 ZINC000093903007 938931902 /nfs/dbraw/zinc/93/19/02/938931902.db2.gz LHMIAVZQZPKCOV-GORDUTHDSA-N -1 3 357.211 3.516 20 0 FHADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N(C[C@@H]1CCOC1)C1CC1 ZINC000094056458 938933131 /nfs/dbraw/zinc/93/31/31/938933131.db2.gz YQSIHOQDVBIWEM-IBGZPJMESA-N -1 3 365.473 3.819 20 0 FHADHM CC(C)(C)C(C)(C)[N-]S(=O)(=O)c1cc(F)ccc1Br ZINC000431578551 938982781 /nfs/dbraw/zinc/98/27/81/938982781.db2.gz MMOWUPOBARTVRM-UHFFFAOYSA-N -1 3 352.269 3.691 20 0 FHADHM Cc1c(Cl)c(C(F)(F)F)nn1CC(=O)Nc1cc(Cl)ccc1[O-] ZINC000143458525 938995771 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FHADHM O=C(Nc1nc(-c2c(F)cccc2F)co1)c1c[n-]c2ccccc2c1=O ZINC000378203451 942393257 /nfs/dbraw/zinc/39/32/57/942393257.db2.gz QUWZFOZGMXCVQD-UHFFFAOYSA-N -1 3 367.311 3.714 20 0 FHADHM CCOc1cccc2cc([C@@H](C)NC(=O)c3cccc4n[n-]nc43)oc21 ZINC000189620413 942418196 /nfs/dbraw/zinc/41/81/96/942418196.db2.gz HEOICSQMKIYOTJ-LLVKDONJSA-N -1 3 350.378 3.594 20 0 FHADHM CO[C@H](Cc1ccccc1)CS(=O)(=O)[N-]c1c(C)c(F)ccc1Cl ZINC000421247830 942455122 /nfs/dbraw/zinc/45/51/22/942455122.db2.gz JPNWXINDNBIPBD-CQSZACIVSA-N -1 3 371.861 3.787 20 0 FHADHM Cc1[nH]c2ccc(Cl)cc2c1C(=O)N=c1[nH][n-]c(-c2ccncc2)c1C ZINC000378317676 942571092 /nfs/dbraw/zinc/57/10/92/942571092.db2.gz PCXIADQJUFBPND-UHFFFAOYSA-N -1 3 365.824 3.897 20 0 FHADHM O=C(N1CCCc2c(=O)[n-]cnc21)C(F)(F)c1cc(Cl)ccc1Cl ZINC000893206302 942591240 /nfs/dbraw/zinc/59/12/40/942591240.db2.gz XLPVGQVSBTWCSZ-UHFFFAOYSA-N -1 3 374.174 3.560 20 0 FHADHM CC(C)c1nnc(SCc2nc3c4ccccc4oc3c(=O)[n-]2)n1C ZINC000502640370 942606317 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Cc1c(NC(=O)CCCc2ccc([O-])c(F)c2)cccc1NC(=O)N(C)C ZINC000473551334 943062700 /nfs/dbraw/zinc/06/27/00/943062700.db2.gz LQEOEWVMTLWQCP-UHFFFAOYSA-N -1 3 373.428 3.895 20 0 FHADHM C[C@@H](OC(=O)c1cc(Cl)c(Cl)[n-]1)C(=O)N[C@H](C)c1ccc(F)cc1 ZINC000028485967 943118719 /nfs/dbraw/zinc/11/87/19/943118719.db2.gz XSTGUKCUSHDUTJ-RKDXNWHRSA-N -1 3 373.211 3.883 20 0 FHADHM Cc1csc(Nc2ccc(NC(=O)c3cc(F)cc4n[n-]nc43)cc2)n1 ZINC000503312107 943119278 /nfs/dbraw/zinc/11/92/78/943119278.db2.gz NTIHTVMYKHDKTE-UHFFFAOYSA-N -1 3 368.397 3.858 20 0 FHADHM O=C(NC1c2ccccc2Oc2ccccc21)c1cc(F)cc2n[n-]nc21 ZINC000503489967 943206611 /nfs/dbraw/zinc/20/66/11/943206611.db2.gz STDQQNGZMMAZHQ-UHFFFAOYSA-N -1 3 360.348 3.722 20 0 FHADHM Cc1ccc(Cl)c(S(=O)(=O)[N-]CCCc2ccccn2)c1Cl ZINC000435222618 943274842 /nfs/dbraw/zinc/27/48/42/943274842.db2.gz LVTDSLDSXFQUEK-UHFFFAOYSA-N -1 3 359.278 3.608 20 0 FHADHM Cc1ccc(-n2ncc(NC(=O)c3cccc4n[n-]nc43)c2C(C)C)cc1 ZINC000514768346 943278162 /nfs/dbraw/zinc/27/81/62/943278162.db2.gz QRNHZBVWYJMILQ-UHFFFAOYSA-N -1 3 360.421 3.828 20 0 FHADHM COC[C@H](C)Oc1ccc(Cl)cc1NCc1cc(=O)[n-]c(C2CC2)n1 ZINC000417022308 943298652 /nfs/dbraw/zinc/29/86/52/943298652.db2.gz HNECSVDVXXZTME-NSHDSACASA-N -1 3 363.845 3.739 20 0 FHADHM CCCN(C(=O)c1ccccc1NCc1cc(=O)[n-]c(C2CC2)n1)C(C)C ZINC000417030181 943304144 /nfs/dbraw/zinc/30/41/44/943304144.db2.gz WJUORJOVJNIEIV-UHFFFAOYSA-N -1 3 368.481 3.932 20 0 FHADHM CCC(CC)[C@H]([N-]S(=O)(=O)c1cc(C(=O)OC)co1)c1cccs1 ZINC000513796494 943310000 /nfs/dbraw/zinc/31/00/00/943310000.db2.gz WALJYQTZIOJPJM-HNNXBMFYSA-N -1 3 371.480 3.584 20 0 FHADHM C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)c1cc(=O)[n-]c(C2CC2)n1 ZINC000584663868 943348157 /nfs/dbraw/zinc/34/81/57/943348157.db2.gz OIHYQDSMXABSRJ-VIFPVBQESA-N -1 3 366.248 3.727 20 0 FHADHM CC(=O)c1cccc(NC(=O)c2ccc(C(=O)OC(C)(C)C)cc2)c1[O-] ZINC000514938036 943406885 /nfs/dbraw/zinc/40/68/85/943406885.db2.gz DLWUOEAGDRNOBT-UHFFFAOYSA-N -1 3 355.390 3.802 20 0 FHADHM 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ZINC000417621981 943756096 /nfs/dbraw/zinc/75/60/96/943756096.db2.gz HSUAAAXIOFMCOB-VIFPVBQESA-N -1 3 363.282 3.968 20 0 FHADHM O=C([O-])[C@H]1C[C@@H](NCc2csc(Br)c2)c2ccccc21 ZINC000417621592 943756929 /nfs/dbraw/zinc/75/69/29/943756929.db2.gz HIWSRSQILSDTRI-QWHCGFSZSA-N -1 3 352.253 3.913 20 0 FHADHM COc1cc(CN[C@H]2C[C@@H](C(=O)[O-])c3ccccc32)ccc1OC(C)C ZINC000417628385 943779028 /nfs/dbraw/zinc/77/90/28/943779028.db2.gz WDSBMBMJDCLUPN-MSOLQXFVSA-N -1 3 355.434 3.885 20 0 FHADHM CCOc1ccc(CN[C@H]2C[C@H](C(=O)[O-])c3ccccc32)cc1OCC ZINC000417637617 943787951 /nfs/dbraw/zinc/78/79/51/943787951.db2.gz ZENHPBOHRPDOQB-ROUUACIJSA-N -1 3 355.434 3.887 20 0 FHADHM CNC(=O)Cc1ccc(-c2noc(-c3ccc(C(C)C)cc3[O-])n2)cc1 ZINC000424235133 943799364 /nfs/dbraw/zinc/79/93/64/943799364.db2.gz HYWJECGCJXMKHB-UHFFFAOYSA-N -1 3 351.406 3.521 20 0 FHADHM O=C([O-])CC[C@@H]1CCCCN1Cc1coc(-c2ccc(F)c(F)c2)n1 ZINC000424250352 943805876 /nfs/dbraw/zinc/80/58/76/943805876.db2.gz BNABMJBJPLGGJX-AWEZNQCLSA-N -1 3 350.365 3.839 20 0 FHADHM O=C([O-])C[C@@H]1CCCC[C@@H]1NCc1csc(COc2ccccc2)n1 ZINC000417665805 943809643 /nfs/dbraw/zinc/80/96/43/943809643.db2.gz DLDFKLREJTULES-YOEHRIQHSA-N -1 3 360.479 3.845 20 0 FHADHM C[C@@H]1C[C@@H]1[C@@H](NC(=O)c1cc(=O)[n-]c(C2CC2)n1)c1ccc(Cl)cc1 ZINC000516935853 943843825 /nfs/dbraw/zinc/84/38/25/943843825.db2.gz LKGGFPMHBZNNFF-SEHCQNQUSA-N -1 3 357.841 3.840 20 0 FHADHM COc1cc(C(=O)N[C@@H]2C[C@H]2c2cccc3ccccc32)cc(OC)c1[O-] ZINC000435963525 943904301 /nfs/dbraw/zinc/90/43/01/943904301.db2.gz VFRURFRTXJSSSA-ZWKOTPCHSA-N -1 3 363.413 3.849 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2ccc3[nH]c(C4CCC4)nc3c2)cc1C ZINC000436003661 943936854 /nfs/dbraw/zinc/93/68/54/943936854.db2.gz IGQYKGBEBURSDK-UHFFFAOYSA-N -1 3 371.462 3.948 20 0 FHADHM CCSCC[C@H](C)[N-]S(=O)(=O)c1csc(-c2ccccc2)n1 ZINC000437714453 944060786 /nfs/dbraw/zinc/06/07/86/944060786.db2.gz CRVNPGWLFIQYPH-LBPRGKRZSA-N -1 3 356.538 3.620 20 0 FHADHM CC(C)[C@H](C(=O)N=c1cc(-c2cc(F)cc(F)c2)[n-][nH]1)c1cccnc1 ZINC000436189085 944082486 /nfs/dbraw/zinc/08/24/86/944082486.db2.gz PXPDTOODIGDMIX-SFHVURJKSA-N -1 3 356.376 3.550 20 0 FHADHM Cc1ccc(Cl)c(S(=O)(=O)[N-]CC2CCSCC2)c1Cl ZINC000500122278 944139588 /nfs/dbraw/zinc/13/95/88/944139588.db2.gz LZZWSHRSJLSEJP-UHFFFAOYSA-N -1 3 354.324 3.723 20 0 FHADHM C[C@]1(CNC(=O)c2cc([O-])c3ccccc3c2)OCCc2sccc21 ZINC000460974421 944151083 /nfs/dbraw/zinc/15/10/83/944151083.db2.gz UYXPCUITAQZZRD-HXUWFJFHSA-N -1 3 353.443 3.825 20 0 FHADHM CN(c1ccccc1)c1ccccc1C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000515749451 944177038 /nfs/dbraw/zinc/17/70/38/944177038.db2.gz UMOXOXBKKATDEA-UHFFFAOYSA-N -1 3 370.416 3.887 20 0 FHADHM CN(c1ccccc1)c1ccccc1C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000515749451 944177041 /nfs/dbraw/zinc/17/70/41/944177041.db2.gz UMOXOXBKKATDEA-UHFFFAOYSA-N -1 3 370.416 3.887 20 0 FHADHM Cc1cccc(CN(C)Cc2nc(=O)c3c(-c4ccco4)csc3[n-]2)n1 ZINC000437900277 944207627 /nfs/dbraw/zinc/20/76/27/944207627.db2.gz XAGDCELNDSGZDH-UHFFFAOYSA-N -1 3 366.446 3.992 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)C1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000436333005 944212251 /nfs/dbraw/zinc/21/22/51/944212251.db2.gz JDNJQVACPKCSOW-UHFFFAOYSA-N -1 3 373.338 3.556 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)C1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000436333005 944212255 /nfs/dbraw/zinc/21/22/55/944212255.db2.gz JDNJQVACPKCSOW-UHFFFAOYSA-N -1 3 373.338 3.556 20 0 FHADHM COc1ccc(Cl)cc1NCCC(=O)N=c1cc(-c2ccccc2)[n-][nH]1 ZINC000439018954 944273500 /nfs/dbraw/zinc/27/35/00/944273500.db2.gz KBSBDQHILFZLON-UHFFFAOYSA-N -1 3 370.840 3.601 20 0 FHADHM Cc1ccc(Br)cc1C(=O)N=c1cc(-c2ccccc2)[n-][nH]1 ZINC000439019343 944273762 /nfs/dbraw/zinc/27/37/62/944273762.db2.gz KJUOAPXVJRALON-UHFFFAOYSA-N -1 3 356.223 3.822 20 0 FHADHM CCNc1nc(C(=O)[N-]c2nnc([C@H](CC)c3ccccc3)s2)cs1 ZINC000425941063 944291923 /nfs/dbraw/zinc/29/19/23/944291923.db2.gz CPNVGANGUOSXGT-GFCCVEGCSA-N -1 3 373.507 3.643 20 0 FHADHM C[C@H](CSc1nc2c(cnn2-c2ccccc2)c(=O)[n-]1)C(F)(F)F ZINC000439055422 944301027 /nfs/dbraw/zinc/30/10/27/944301027.db2.gz LHJBLFALZIUTCC-SECBINFHSA-N -1 3 354.357 3.812 20 0 FHADHM O=C([O-])c1ccc(N2CCC(NCc3ccsc3Cl)CC2)cc1 ZINC000426665731 944332467 /nfs/dbraw/zinc/33/24/67/944332467.db2.gz MIEBDJQZESUVCK-UHFFFAOYSA-N -1 3 350.871 3.858 20 0 FHADHM Cc1ccc(C(=O)Nc2nnc(Cc3cccc(F)c3)s2)c([O-])c1C ZINC000436484781 944368405 /nfs/dbraw/zinc/36/84/05/944368405.db2.gz NOAVGFAWGOWCCQ-UHFFFAOYSA-N -1 3 357.410 3.843 20 0 FHADHM Cc1ccccc1-c1cc(=NC(=O)[C@H]2C[C@H]2c2cccc(F)c2F)[nH][n-]1 ZINC000439148594 944379086 /nfs/dbraw/zinc/37/90/86/944379086.db2.gz ZHYDRVGYLHVWCX-GJZGRUSLSA-N -1 3 353.372 3.827 20 0 FHADHM COc1cccc(C(=O)Nc2nnc(-c3cccc(Cl)c3)s2)c1[O-] ZINC000436518376 944405876 /nfs/dbraw/zinc/40/58/76/944405876.db2.gz QZAGDJPMUPCVGV-UHFFFAOYSA-N -1 3 361.810 3.825 20 0 FHADHM Cc1ccc(C(=O)Nc2cccc(C(=O)N3CCCC3)c2C)c([O-])c1C ZINC000436547886 944406273 /nfs/dbraw/zinc/40/62/73/944406273.db2.gz YTHOUGLJKURSLJ-UHFFFAOYSA-N -1 3 352.434 3.806 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(Cc3nnc4ccccn43)cc2)c([O-])c1 ZINC000436547489 944407565 /nfs/dbraw/zinc/40/75/65/944407565.db2.gz QJVCKYQJTFPXDS-UHFFFAOYSA-N -1 3 358.401 3.586 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(C(=O)NC3CCCC3)cc2C)c([O-])c1 ZINC000436550774 944408903 /nfs/dbraw/zinc/40/89/03/944408903.db2.gz UPUFOAWPEOTIMD-UHFFFAOYSA-N -1 3 352.434 3.934 20 0 FHADHM COCc1csc(NC(=O)c2cc(OCc3ccccc3)ccc2[O-])n1 ZINC000436552420 944411667 /nfs/dbraw/zinc/41/16/67/944411667.db2.gz WMJIAFNFSTWOTD-UHFFFAOYSA-N -1 3 370.430 3.826 20 0 FHADHM Cc1ccc(C(=O)Nc2ccccc2NC(=O)N2CCCC2)c([O-])c1C ZINC000436553621 944412133 /nfs/dbraw/zinc/41/21/33/944412133.db2.gz DLGDEJKDGTUCFC-UHFFFAOYSA-N -1 3 353.422 3.889 20 0 FHADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CCC[C@H]2COCC[C@@H]21 ZINC000436576638 944424665 /nfs/dbraw/zinc/42/46/65/944424665.db2.gz PUVDQDRQKJCVMA-ICSRJNTNSA-N -1 3 351.446 3.624 20 0 FHADHM Cc1ccc(N2CCC(NC(=O)c3ccc(C(C)C)cc3[O-])CC2)nc1 ZINC000436562841 944428974 /nfs/dbraw/zinc/42/89/74/944428974.db2.gz KTQRPNVKBSOASB-UHFFFAOYSA-N -1 3 353.466 3.618 20 0 FHADHM O=c1[nH]c(-c2ccc([O-])cc2Cl)nc2cc(Br)c(F)cc12 ZINC000436562955 944429005 /nfs/dbraw/zinc/42/90/05/944429005.db2.gz LSXIZKNHYGEFBN-UHFFFAOYSA-N -1 3 369.577 3.851 20 0 FHADHM COc1ccc(C(=O)NCCc2nc(-c3ccccc3)c(C)s2)c([O-])c1 ZINC000436567735 944432423 /nfs/dbraw/zinc/43/24/23/944432423.db2.gz YDPPZSGWJGWHBR-UHFFFAOYSA-N -1 3 368.458 3.805 20 0 FHADHM O=C(N[C@H]1CCOC2(CCC2)C1)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436593285 944438773 /nfs/dbraw/zinc/43/87/73/944438773.db2.gz DAZTXDSYYTWKMR-SFHVURJKSA-N -1 3 351.446 3.815 20 0 FHADHM C[C@H]1Cc2cc(S(=O)(=O)[N-]c3ccc(C(F)(F)F)cc3)ccc2O1 ZINC000518492611 944439208 /nfs/dbraw/zinc/43/92/08/944439208.db2.gz GCTYBJQQMFENGQ-JTQLQIEISA-N -1 3 357.353 3.830 20 0 FHADHM COc1cc([C@@H](C)NC(=O)c2ccc(O)cc2[O-])ccc1OCC(C)C ZINC000436599567 944443929 /nfs/dbraw/zinc/44/39/29/944443929.db2.gz DOEPQEGJVDJYIP-CYBMUJFWSA-N -1 3 359.422 3.632 20 0 FHADHM C[C@@H](NC(=O)c1cc(CCc2ccccc2)ccc1[O-])[C@@H]1CCCOC1 ZINC000436579056 944444362 /nfs/dbraw/zinc/44/43/62/944444362.db2.gz TZSJIKVFXKUCIJ-VQIMIIECSA-N -1 3 353.462 3.722 20 0 FHADHM COc1ccc(C(=O)N(CCC(F)(F)F)Cc2ccccc2)c([O-])c1 ZINC000436582239 944446042 /nfs/dbraw/zinc/44/60/42/944446042.db2.gz DJVQLMNRTVRQFG-UHFFFAOYSA-N -1 3 353.340 3.996 20 0 FHADHM Cn1ncc2c1CCC[C@H]2NC(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436583074 944447138 /nfs/dbraw/zinc/44/71/38/944447138.db2.gz NBHLGYHSMDFPRB-LJQANCHMSA-N -1 3 361.445 3.524 20 0 FHADHM COc1cc(OC)c(NC(=O)c2ccc3c(c2[O-])OC(C)(C)C3)cc1F ZINC000436583189 944447187 /nfs/dbraw/zinc/44/71/87/944447187.db2.gz JVBXQEZKCLERSP-UHFFFAOYSA-N -1 3 361.369 3.514 20 0 FHADHM CC(C)OC(=O)[C@@H](C)N(C)C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436585089 944448769 /nfs/dbraw/zinc/44/87/69/944448769.db2.gz IQRZYEYSSJRBFR-MRXNPFEDSA-N -1 3 369.461 3.590 20 0 FHADHM O=C([N-]c1nccc2sccc21)c1sccc1S(=O)(=O)C(F)F ZINC000162662579 944450522 /nfs/dbraw/zinc/45/05/22/944450522.db2.gz GGUPUHQEBWHABN-UHFFFAOYSA-N -1 3 374.415 3.606 20 0 FHADHM COc1ccc(C(=O)N2CCC[C@H]2c2nc3cc(Cl)ccc3[nH]2)c([O-])c1 ZINC000436590621 944451458 /nfs/dbraw/zinc/45/14/58/944451458.db2.gz TVPGLYUDEVWALQ-INIZCTEOSA-N -1 3 371.824 3.908 20 0 FHADHM O=C(Nc1ccc(-n2ccc(C(F)(F)F)n2)cc1)c1c([O-])cccc1O ZINC000436599121 944453001 /nfs/dbraw/zinc/45/30/01/944453001.db2.gz CEDPMOCONHQGDG-UHFFFAOYSA-N -1 3 363.295 3.555 20 0 FHADHM COc1cc(-c2nc(-c3ccc(O)c4ccccc34)no2)cc(OC)c1[O-] ZINC000436604596 944455699 /nfs/dbraw/zinc/45/56/99/944455699.db2.gz AXZOEVUBDVOOCH-UHFFFAOYSA-N -1 3 364.357 3.985 20 0 FHADHM Cc1cnn([C@H]2CCN(C(=O)c3cc(Oc4ccccc4)ccc3[O-])C2)c1 ZINC000436607381 944458495 /nfs/dbraw/zinc/45/84/95/944458495.db2.gz IPUXGGULAPHJLX-INIZCTEOSA-N -1 3 363.417 3.777 20 0 FHADHM COc1ccc(C(=O)NCCCc2cccc(C(F)(F)F)c2)c([O-])c1 ZINC000436630617 944471300 /nfs/dbraw/zinc/47/13/00/944471300.db2.gz OIYLKDVXWUCCFV-UHFFFAOYSA-N -1 3 353.340 3.782 20 0 FHADHM CN(C)CCN(Cc1ccccc1F)C(=O)c1cc(F)cc(Cl)c1[O-] ZINC000436634329 944474919 /nfs/dbraw/zinc/47/49/19/944474919.db2.gz HAEVLMVVHFFIEM-UHFFFAOYSA-N -1 3 368.811 3.528 20 0 FHADHM CCCCOc1ccc(C(=O)N2CC[C@H](n3cc(Cl)cn3)C2)c([O-])c1 ZINC000436621273 944478756 /nfs/dbraw/zinc/47/87/56/944478756.db2.gz VMEDEAJDIYPHET-AWEZNQCLSA-N -1 3 363.845 3.508 20 0 FHADHM CCOc1ccccc1N1CCN(C(=O)c2ccc(C(C)C)cc2[O-])CC1 ZINC000436622241 944480051 /nfs/dbraw/zinc/48/00/51/944480051.db2.gz BWDIVTZLNPFPDR-UHFFFAOYSA-N -1 3 368.477 3.877 20 0 FHADHM Cc1ccc(C(=O)NCc2cc(Oc3ccc(F)cc3)ccn2)c([O-])c1 ZINC000436673056 944506323 /nfs/dbraw/zinc/50/63/23/944506323.db2.gz NMHSIDFVKQLRAB-UHFFFAOYSA-N -1 3 352.365 3.957 20 0 FHADHM O=C(NCCC1CCOCC1)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436674082 944507063 /nfs/dbraw/zinc/50/70/63/944507063.db2.gz GXKCORGXLTXDAN-UHFFFAOYSA-N -1 3 353.462 3.724 20 0 FHADHM COC(=O)c1cccc2[n-]c(NC(=O)c3ccc4[nH]c(C)c(C)c4c3)nc21 ZINC000438347577 944527634 /nfs/dbraw/zinc/52/76/34/944527634.db2.gz ULPBWHPEBJDZGV-UHFFFAOYSA-N -1 3 362.389 3.700 20 0 FHADHM Cc1nc[nH]c1CC(=O)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000436710071 944531816 /nfs/dbraw/zinc/53/18/16/944531816.db2.gz YJUHVINTCSZRMG-UHFFFAOYSA-N -1 3 364.430 3.882 20 0 FHADHM COc1ccc(C(=O)N2CCn3c(cc4ccc(Cl)cc43)C2)c([O-])c1 ZINC000436709194 944531898 /nfs/dbraw/zinc/53/18/98/944531898.db2.gz MLLRPHKUBBVAIX-UHFFFAOYSA-N -1 3 356.809 3.665 20 0 FHADHM COC(=O)c1cccc2[n-]c(NC(=O)C3(c4cccc(Cl)c4)CC3)nc21 ZINC000438361542 944532394 /nfs/dbraw/zinc/53/23/94/944532394.db2.gz VQJJDDSBAPRFDH-UHFFFAOYSA-N -1 3 369.808 3.673 20 0 FHADHM Cc1cc2cc(CN3CCN(C(=O)c4ccccc4[O-])CC3)oc2cc1C ZINC000436696158 944534476 /nfs/dbraw/zinc/53/44/76/944534476.db2.gz HBAZGNHZBXGISV-UHFFFAOYSA-N -1 3 364.445 3.713 20 0 FHADHM CC[C@@H](NCc1csc(-c2cccc(Br)c2)n1)C(=O)[O-] ZINC000516181821 944547835 /nfs/dbraw/zinc/54/78/35/944547835.db2.gz XZFNOXYBYFLVBG-GFCCVEGCSA-N -1 3 355.257 3.525 20 0 FHADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1CCC[C@@H]1[C@@H]1CCCO1 ZINC000436711425 944552127 /nfs/dbraw/zinc/55/21/27/944552127.db2.gz 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FHADHM COc1ccc([C@H](NCc2ccc(OCC(C)C)cc2)C(=O)[O-])cc1F ZINC000426777563 944794722 /nfs/dbraw/zinc/79/47/22/944794722.db2.gz OMUJFBNLZWBFOJ-IBGZPJMESA-N -1 3 361.413 3.785 20 0 FHADHM COc1cc(C)c(CN[C@H](C(=O)[O-])c2ccc(Cl)c(C)c2)cc1OC ZINC000426779541 944797755 /nfs/dbraw/zinc/79/77/55/944797755.db2.gz IWSWMVWZYAHIHP-SFHVURJKSA-N -1 3 363.841 3.890 20 0 FHADHM CCSc1cccc(NC(=O)CCNC(=O)c2ccc(C)cc2[O-])c1 ZINC000436915785 944798268 /nfs/dbraw/zinc/79/82/68/944798268.db2.gz QDZVRIACIKIAPP-UHFFFAOYSA-N -1 3 358.463 3.571 20 0 FHADHM Cc1cc(Cc2noc(-c3cc(OCc4ccccc4)ccc3[O-])n2)no1 ZINC000436931572 944805264 /nfs/dbraw/zinc/80/52/64/944805264.db2.gz LHBGTSJFFWFDLH-UHFFFAOYSA-N -1 3 363.373 3.908 20 0 FHADHM Cc1c([O-])ccc2c(CN3CCO[C@H](c4cccc(F)c4)C3)cc(=O)oc12 ZINC000066848878 944812245 /nfs/dbraw/zinc/81/22/45/944812245.db2.gz RBUGOAHICXZNJE-IBGZPJMESA-N -1 3 369.392 3.520 20 0 FHADHM Cc1cncnc1-c1noc(-c2cc(OCc3ccccc3)ccc2[O-])n1 ZINC000436933828 944821098 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O=C([O-])[C@@H](NCc1cc(Cl)c2c(c1)OCCCO2)c1cccc(F)c1 ZINC000426821624 944845570 /nfs/dbraw/zinc/84/55/70/944845570.db2.gz VKLWEZZQRRNRAW-INIZCTEOSA-N -1 3 365.788 3.556 20 0 FHADHM C[C@@H](CCC(C)(C)C)C(=O)NC1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436969125 944846076 /nfs/dbraw/zinc/84/60/76/944846076.db2.gz YMDNYTHQLXRCOS-HNNXBMFYSA-N -1 3 360.498 3.575 20 0 FHADHM COc1ccc([C@H](NCc2ccc(OC(F)(F)F)cc2)C(=O)[O-])cc1F ZINC000426823766 944847497 /nfs/dbraw/zinc/84/74/97/944847497.db2.gz JYLYVAQJNRTINI-HNNXBMFYSA-N -1 3 373.302 3.648 20 0 FHADHM CCN(C(=O)c1ccc2c(c1[O-])CCCC2)c1ccc(OC)c(OC)c1 ZINC000436951804 944848528 /nfs/dbraw/zinc/84/85/28/944848528.db2.gz SENINNUNXGAOJE-UHFFFAOYSA-N -1 3 355.434 3.955 20 0 FHADHM Cc1ccc(C(=O)NCc2ccc(Oc3cccc(F)c3)nc2)c([O-])c1 ZINC000436961232 944856509 /nfs/dbraw/zinc/85/65/09/944856509.db2.gz JLPQOYFKWYXRKO-UHFFFAOYSA-N -1 3 352.365 3.957 20 0 FHADHM CN(C(=O)c1ccccc1[O-])[C@@H]1CCOc2ccc(Br)cc21 ZINC000438639276 944874832 /nfs/dbraw/zinc/87/48/32/944874832.db2.gz VLLYPWFHXLYFLR-CQSZACIVSA-N -1 3 362.223 3.751 20 0 FHADHM CCCCOc1ccc(C(=O)N2CCO[C@@H](Cc3ccccc3)C2)c([O-])c1 ZINC000436987329 944878879 /nfs/dbraw/zinc/87/88/79/944878879.db2.gz IYTMYVOUYJJGCE-IBGZPJMESA-N -1 3 369.461 3.655 20 0 FHADHM O=C([O-])[C@@H]1Cc2ccccc2CN1Cc1cccc(OC(F)(F)F)c1 ZINC000140701988 944880511 /nfs/dbraw/zinc/88/05/11/944880511.db2.gz UKPMBYALGFGQKA-INIZCTEOSA-N -1 3 351.324 3.597 20 0 FHADHM C[C@H](c1cccc(Cl)c1F)N1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436993449 944886887 /nfs/dbraw/zinc/88/68/87/944886887.db2.gz CFGHQRCXXXNKSK-CYBMUJFWSA-N -1 3 362.832 3.704 20 0 FHADHM COc1cccc([C@@H](C)CCCC(=O)N=c2cc([C@@H]3CCCO3)[n-][nH]2)c1 ZINC000473850553 944887059 /nfs/dbraw/zinc/88/70/59/944887059.db2.gz OFDLHRXEGSYDKY-KSSFIOAISA-N -1 3 357.454 3.604 20 0 FHADHM CC(C)c1ccc(C(=O)NCc2noc(-c3ccccc3F)n2)c([O-])c1 ZINC000436997217 944892190 /nfs/dbraw/zinc/89/21/90/944892190.db2.gz FXMRVVYVCVIZQI-UHFFFAOYSA-N -1 3 355.369 3.635 20 0 FHADHM COc1cccc(-c2nc(C3(c4ccccc4)CCOCC3)no2)c1[O-] ZINC000518007406 944911755 /nfs/dbraw/zinc/91/17/55/944911755.db2.gz UKXAKWKBRQKYGX-UHFFFAOYSA-N -1 3 352.390 3.547 20 0 FHADHM COc1ccc([O-])c(-c2nc(-c3ccc(OC(C)C)c(OC)c3)no2)c1 ZINC000437000291 944916317 /nfs/dbraw/zinc/91/63/17/944916317.db2.gz MTKGBVAUYNLXAF-UHFFFAOYSA-N -1 3 356.378 3.914 20 0 FHADHM C[C@H](O)CC(C)(C)CNC(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000439733625 944929558 /nfs/dbraw/zinc/92/95/58/944929558.db2.gz SDAZHIQHFWIGJC-INIZCTEOSA-N -1 3 355.478 3.704 20 0 FHADHM C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N=c1cc([C@H]2CCCO2)[n-][nH]1 ZINC000473853141 944973980 /nfs/dbraw/zinc/97/39/80/944973980.db2.gz WFBUPAYTSQAFNU-XHDPSFHLSA-N -1 3 367.371 3.519 20 0 FHADHM COC(=O)c1ccc(C(=O)Nc2ccc3[nH]c(-c4ccccc4)nc3c2)[n-]1 ZINC000507152677 945002626 /nfs/dbraw/zinc/00/26/26/945002626.db2.gz XYGDTALEPCEMHO-UHFFFAOYSA-N -1 3 360.373 3.597 20 0 FHADHM CC1CCN([C@H](CNC(=O)c2cccc(C(=O)[O-])c2)c2ccccc2)CC1 ZINC000516569621 945021998 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362.433 3.749 20 0 FHADHM O=S(=O)([N-]Cc1ccccc1OC1CCC1)c1ccc(Cl)cc1F ZINC000522799835 945838924 /nfs/dbraw/zinc/83/89/24/945838924.db2.gz QXAPBMASSTWTLM-UHFFFAOYSA-N -1 3 369.845 3.889 20 0 FHADHM Cc1c2cc(F)ccc2oc1S(=O)(=O)[N-][C@@H]1CCCc2cc(N)ccc21 ZINC000440854047 945984404 /nfs/dbraw/zinc/98/44/04/945984404.db2.gz ZVKJGPUPXGVGCY-QGZVFWFLSA-N -1 3 374.437 3.818 20 0 FHADHM COc1ccc(S[C@H](C)C(=O)N=c2cc(-c3ccccc3)[n-][nH]2)cc1 ZINC000519998487 946019750 /nfs/dbraw/zinc/01/97/50/946019750.db2.gz ITZQFKXMXQXCGK-CYBMUJFWSA-N -1 3 353.447 3.627 20 0 FHADHM Cc1ccc(OCCCC(=O)Nc2ccccc2-c2nnn[n-]2)c(Cl)c1 ZINC000822263075 946037257 /nfs/dbraw/zinc/03/72/57/946037257.db2.gz IZTVHUGDWOYCNT-UHFFFAOYSA-N -1 3 371.828 3.626 20 0 FHADHM Cc1ccc(OCCCC(=O)Nc2ccccc2-c2nn[n-]n2)c(Cl)c1 ZINC000822263075 946037273 /nfs/dbraw/zinc/03/72/73/946037273.db2.gz IZTVHUGDWOYCNT-UHFFFAOYSA-N -1 3 371.828 3.626 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N3CCc4cccc(F)c4C3)nc2)n1 ZINC000301966581 946057662 /nfs/dbraw/zinc/05/76/62/946057662.db2.gz OOOUMPOIOPMYHN-UHFFFAOYSA-N -1 3 350.397 3.508 20 0 FHADHM Cc1cc(F)ccc1[N-]S(=O)(=O)c1cc2c(c(Cl)c1)O[C@H](C)C2 ZINC000522881354 946058097 /nfs/dbraw/zinc/05/80/97/946058097.db2.gz RXFMHZHELFYYIA-SNVBAGLBSA-N -1 3 355.818 3.912 20 0 FHADHM C[C@@H]1CCCN(C(=O)c2c[n-]c3ccc(Br)cc3c2=O)[C@@H]1C ZINC000444257412 946139675 /nfs/dbraw/zinc/13/96/75/946139675.db2.gz PKQQNFYFPULUHB-GHMZBOCLSA-N -1 3 363.255 3.551 20 0 FHADHM C[C@@H]1C(=O)CC[C@H](C(=O)Nc2cc(Br)ccc2[O-])C1(C)C ZINC000444262572 946145981 /nfs/dbraw/zinc/14/59/81/946145981.db2.gz VNAQCBPNMAVGGV-MWLCHTKSSA-N -1 3 354.244 3.735 20 0 FHADHM C[C@H]1CCCCCN1C(=O)c1c[n-]c2ccc(Br)cc2c1=O ZINC000444271622 946155875 /nfs/dbraw/zinc/15/58/75/946155875.db2.gz USAPHPOTARKOEY-NSHDSACASA-N -1 3 363.255 3.695 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NCc3cc(F)ccc3OC)nc2)n1 ZINC000302406346 946219517 /nfs/dbraw/zinc/21/95/17/946219517.db2.gz GNJJWMFQOALABL-UHFFFAOYSA-N -1 3 354.385 3.566 20 0 FHADHM Cc1conc1[N-]C(=O)c1nc(-c2cccs2)n(-c2ccccc2)n1 ZINC000123719575 946221949 /nfs/dbraw/zinc/22/19/49/946221949.db2.gz KGWCZHVSYISFHK-UHFFFAOYSA-N -1 3 351.391 3.545 20 0 FHADHM CSc1ccc([O-])c(C(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)c1 ZINC000665582873 946228190 /nfs/dbraw/zinc/22/81/90/946228190.db2.gz SWDILHIRFVNVKI-MRXNPFEDSA-N -1 3 371.458 3.863 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CCCO[C@H]3CC(C)C)nc2)n1 ZINC000302521107 946241833 /nfs/dbraw/zinc/24/18/33/946241833.db2.gz YXVOEPZXEGIFAU-SJORKVTESA-N -1 3 356.470 3.812 20 0 FHADHM CCc1ccc([O-])c(C(=O)Nc2cccc(CS(=O)(=O)C(C)C)c2)c1 ZINC000112402335 946244324 /nfs/dbraw/zinc/24/43/24/946244324.db2.gz PMLACWOPGNVJAM-UHFFFAOYSA-N -1 3 361.463 3.530 20 0 FHADHM O=c1cc(CN2CCc3nc(-c4ccccc4)sc3C2)nc(C2CC2)[n-]1 ZINC000661544110 946252457 /nfs/dbraw/zinc/25/24/57/946252457.db2.gz KGBOPSPNZMBNQV-UHFFFAOYSA-N -1 3 364.474 3.741 20 0 FHADHM O=C(Nc1nnc(C(F)(F)F)[n-]1)c1ccc2[nH]c3c(c2c1)CCCCC3 ZINC000028987582 946275722 /nfs/dbraw/zinc/27/57/22/946275722.db2.gz UBMAXKBQCDYHSE-UHFFFAOYSA-N -1 3 363.343 3.826 20 0 FHADHM O=C(Nc1nc(C(F)(F)F)n[n-]1)c1ccc2[nH]c3c(c2c1)CCCCC3 ZINC000028987582 946275732 /nfs/dbraw/zinc/27/57/32/946275732.db2.gz UBMAXKBQCDYHSE-UHFFFAOYSA-N -1 3 363.343 3.826 20 0 FHADHM CCSc1ccc([C@@H](C)NC(=O)c2cc(NC(C)=O)ccc2[O-])cc1 ZINC000103526100 946314735 /nfs/dbraw/zinc/31/47/35/946314735.db2.gz CGFVTWJUOLDUEZ-GFCCVEGCSA-N -1 3 358.463 3.954 20 0 FHADHM COCCc1nsc([N-][C@H](C(=O)Nc2ccccc2)c2ccccc2)n1 ZINC000302812154 946334627 /nfs/dbraw/zinc/33/46/27/946334627.db2.gz HIGLDMULEVUUEG-KRWDZBQOSA-N -1 3 368.462 3.519 20 0 FHADHM CSC(C)(C)C[N-]S(=O)(=O)c1c(Cl)cccc1Br ZINC000310691182 946364853 /nfs/dbraw/zinc/36/48/53/946364853.db2.gz XLAIVMUSSXWBLZ-UHFFFAOYSA-N -1 3 372.737 3.522 20 0 FHADHM CC(C)(C)[C@H]1CCN(C(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)C1 ZINC000824079093 946577338 /nfs/dbraw/zinc/57/73/38/946577338.db2.gz MIKVQFSRZSNYBJ-JTQLQIEISA-N -1 3 364.906 3.585 20 0 FHADHM CC(C)(C)[C@H]1CCN(C(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)C1 ZINC000824079093 946577347 /nfs/dbraw/zinc/57/73/47/946577347.db2.gz MIKVQFSRZSNYBJ-JTQLQIEISA-N -1 3 364.906 3.585 20 0 FHADHM CC(C)(C)Sc1cc(C(=O)Nc2ccc(F)cc2-c2nnn[n-]2)ccn1 ZINC000824123226 946596800 /nfs/dbraw/zinc/59/68/00/946596800.db2.gz AIGVWQUSZCMHJL-UHFFFAOYSA-N -1 3 372.429 3.544 20 0 FHADHM CC(C)(C)Sc1cc(C(=O)Nc2ccc(F)cc2-c2nn[n-]n2)ccn1 ZINC000824123226 946596806 /nfs/dbraw/zinc/59/68/06/946596806.db2.gz AIGVWQUSZCMHJL-UHFFFAOYSA-N -1 3 372.429 3.544 20 0 FHADHM CC(C)Oc1cc(F)ccc1NC(=O)Nc1ccc(F)cc1-c1nnn[n-]1 ZINC000824319038 946657490 /nfs/dbraw/zinc/65/74/90/946657490.db2.gz CMOQZICFHWXJGW-UHFFFAOYSA-N -1 3 374.351 3.576 20 0 FHADHM CC(C)Oc1cc(F)ccc1NC(=O)Nc1ccc(F)cc1-c1nn[n-]n1 ZINC000824319038 946657498 /nfs/dbraw/zinc/65/74/98/946657498.db2.gz CMOQZICFHWXJGW-UHFFFAOYSA-N -1 3 374.351 3.576 20 0 FHADHM CC(C)Oc1ccc(NC(=O)CCCc2ccsc2)cc1-c1nnn[n-]1 ZINC000824324093 946660093 /nfs/dbraw/zinc/66/00/93/946660093.db2.gz GJXFDYKYMNZUTE-UHFFFAOYSA-N -1 3 371.466 3.677 20 0 FHADHM CC(C)Oc1ccc(NC(=O)CCCc2ccsc2)cc1-c1nn[n-]n1 ZINC000824324093 946660100 /nfs/dbraw/zinc/66/01/00/946660100.db2.gz GJXFDYKYMNZUTE-UHFFFAOYSA-N -1 3 371.466 3.677 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2ccc(Oc3ccncc3)cc2)cc1 ZINC000050534567 946678597 /nfs/dbraw/zinc/67/85/97/946678597.db2.gz BJZIGGQMGMVHBQ-UHFFFAOYSA-N -1 3 356.403 3.683 20 0 FHADHM Cc1cc(C)n(-c2ccc([N-]S(=O)(=O)c3ccc(C)c(F)c3)cc2)n1 ZINC000614781110 946712575 /nfs/dbraw/zinc/71/25/75/946712575.db2.gz OSVCNXWOYGNQDE-UHFFFAOYSA-N -1 3 359.426 3.737 20 0 FHADHM O=S(=O)([N-]C1(c2ccccc2)CCC1)c1cnc(Cl)c(Cl)c1 ZINC000303854867 946714858 /nfs/dbraw/zinc/71/48/58/946714858.db2.gz VNYTUWZAMXNSQU-UHFFFAOYSA-N -1 3 357.262 3.746 20 0 FHADHM C[C@@H](NC(=O)C1=CCCC1)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824472029 946725525 /nfs/dbraw/zinc/72/55/25/946725525.db2.gz UPLSPTREYDQRPU-CQSZACIVSA-N -1 3 359.433 3.821 20 0 FHADHM C[C@@H](NC(=O)C1=CCCC1)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824472029 946725537 /nfs/dbraw/zinc/72/55/37/946725537.db2.gz UPLSPTREYDQRPU-CQSZACIVSA-N -1 3 359.433 3.821 20 0 FHADHM C[C@H](NC(=O)/C=C\C1CC1)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824479844 946731209 /nfs/dbraw/zinc/73/12/09/946731209.db2.gz QEHCVMYJMGHQRD-VDBIKXPHSA-N -1 3 359.433 3.677 20 0 FHADHM C[C@H](NC(=O)/C=C\C1CC1)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824479844 946731218 /nfs/dbraw/zinc/73/12/18/946731218.db2.gz QEHCVMYJMGHQRD-VDBIKXPHSA-N -1 3 359.433 3.677 20 0 FHADHM C[C@@H](NC(=O)Nc1csc2ccccc12)c1cccc(-c2nnn[n-]2)c1 ZINC000824505426 946749036 /nfs/dbraw/zinc/74/90/36/946749036.db2.gz CJTXDYCCXMEOLQ-LLVKDONJSA-N -1 3 364.434 3.964 20 0 FHADHM C[C@@H](NC(=O)Nc1csc2ccccc12)c1cccc(-c2nn[n-]n2)c1 ZINC000824505426 946749048 /nfs/dbraw/zinc/74/90/48/946749048.db2.gz CJTXDYCCXMEOLQ-LLVKDONJSA-N -1 3 364.434 3.964 20 0 FHADHM O=S(=O)(C[C@@H]1CCCCO1)[N-]c1ccc(Cl)c(C(F)(F)F)c1 ZINC000110096353 946852289 /nfs/dbraw/zinc/85/22/89/946852289.db2.gz 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ZINC000824712542 946907216 /nfs/dbraw/zinc/90/72/16/946907216.db2.gz ATCUJUGDWAPTMS-BZNIZROVSA-N -1 3 368.824 3.854 20 0 FHADHM COc1ccc(Cl)c(S(=O)(=O)[N-][C@H]2CCC[C@@H](C(F)(F)F)C2)c1 ZINC000112361199 946913773 /nfs/dbraw/zinc/91/37/73/946913773.db2.gz KUMSEDDAOVFMQK-ZJUUUORDSA-N -1 3 371.808 3.748 20 0 FHADHM Cc1ccc([C@@H](CNC(=O)c2cc(F)c([O-])c(Cl)c2)N(C)C)cc1 ZINC000184330808 947056036 /nfs/dbraw/zinc/05/60/36/947056036.db2.gz FUYYCPLISOIPJH-MRXNPFEDSA-N -1 3 350.821 3.526 20 0 FHADHM CC[C@@H](C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccc(OC)cc1 ZINC000825039835 947057154 /nfs/dbraw/zinc/05/71/54/947057154.db2.gz XCRKFGNNRBRFLU-CQSZACIVSA-N -1 3 371.828 3.661 20 0 FHADHM CC[C@@H](C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccc(OC)cc1 ZINC000825039835 947057166 /nfs/dbraw/zinc/05/71/66/947057166.db2.gz XCRKFGNNRBRFLU-CQSZACIVSA-N -1 3 371.828 3.661 20 0 FHADHM CN(C)CCN(Cc1cccc(F)c1)C(=O)c1cc(F)c([O-])c(Cl)c1 ZINC000184336341 947076993 /nfs/dbraw/zinc/07/69/93/947076993.db2.gz YXHMSYOBFOWGEZ-UHFFFAOYSA-N -1 3 368.811 3.528 20 0 FHADHM CCC(CC)n1nc(C)cc1C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825113731 947080078 /nfs/dbraw/zinc/08/00/78/947080078.db2.gz DVJBQLJSPOFBSA-UHFFFAOYSA-N -1 3 373.848 3.638 20 0 FHADHM CCC(CC)n1nc(C)cc1C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825113731 947080087 /nfs/dbraw/zinc/08/00/87/947080087.db2.gz DVJBQLJSPOFBSA-UHFFFAOYSA-N -1 3 373.848 3.638 20 0 FHADHM O=C(NCc1ccc([O-])c(Br)c1)c1c[nH]c2cc(F)ccc21 ZINC000192972363 947128179 /nfs/dbraw/zinc/12/81/79/947128179.db2.gz NLKWBGHYVDCRJS-UHFFFAOYSA-N -1 3 363.186 3.705 20 0 FHADHM CO[C@]1(C)C[C@@H](N(C)Cc2oc(-c3ccccc3)nc2C(=O)[O-])C1(C)C ZINC000652439696 947134829 /nfs/dbraw/zinc/13/48/29/947134829.db2.gz WRFKUYSYUJZEKD-FOIQADDNSA-N -1 3 358.438 3.675 20 0 FHADHM O=C([O-])[C@@H]1CN(Cc2cccc(OCC(F)(F)F)c2)Cc2ccccc21 ZINC000652470773 947185286 /nfs/dbraw/zinc/18/52/86/947185286.db2.gz JFAVLNHMDKATKN-QGZVFWFLSA-N -1 3 365.351 3.812 20 0 FHADHM CC(C)(CC1CCCCCC1)NCC1=Nc2ccccc2S(=O)(=O)[N-]1 ZINC000444808126 947222502 /nfs/dbraw/zinc/22/25/02/947222502.db2.gz ZCTOXZQVDOXRKS-UHFFFAOYSA-N -1 3 363.527 3.737 20 0 FHADHM CCc1ccc(-c2noc(CN3CCC[C@@H](C(C)(C)C(=O)[O-])C3)n2)cc1 ZINC000652500421 947249256 /nfs/dbraw/zinc/24/92/56/947249256.db2.gz RHFQBCVVCKLPCE-MRXNPFEDSA-N -1 3 357.454 3.622 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N(C)[C@@H]3CCc4ccccc4C3)nc2)n1 ZINC000301252184 947252277 /nfs/dbraw/zinc/25/22/77/947252277.db2.gz DNKGZNXJYXJGGB-LJQANCHMSA-N -1 3 360.461 3.800 20 0 FHADHM COc1ccc(Sc2nc3c(cnn3-c3ccccc3)c(=O)[n-]2)cc1 ZINC000301335096 947291559 /nfs/dbraw/zinc/29/15/59/947291559.db2.gz GBCVSNZINJEJBS-UHFFFAOYSA-N -1 3 350.403 3.681 20 0 FHADHM Cc1cc(=O)[n-]c([C@H](C)N2CCO[C@@H](c3ccc(Cl)c(Cl)c3)C2)n1 ZINC000248723430 947309661 /nfs/dbraw/zinc/30/96/61/947309661.db2.gz HHXZXGRCDYPKDB-XHDPSFHLSA-N -1 3 368.264 3.932 20 0 FHADHM Cc1ccc(-c2nc([C@@H]3CN(Cc4ccccc4)C[C@@H](C)O3)no2)c([O-])c1 ZINC000665010719 947310336 /nfs/dbraw/zinc/31/03/36/947310336.db2.gz JLPQJTDHOFMPIO-BEFAXECRSA-N -1 3 365.433 3.713 20 0 FHADHM COc1ccccc1Sc1nc2c(cnn2-c2ccccc2)c(=O)[n-]1 ZINC000301379048 947316637 /nfs/dbraw/zinc/31/66/37/947316637.db2.gz SSJUSORJGKLVHC-UHFFFAOYSA-N -1 3 350.403 3.681 20 0 FHADHM CCOC(=O)CCc1ccc([N-]S(=O)(=O)c2ccc(C)c(C)c2)cc1 ZINC000523533958 947343997 /nfs/dbraw/zinc/34/39/97/947343997.db2.gz DGZMBFXSALFCKN-UHFFFAOYSA-N -1 3 361.463 3.600 20 0 FHADHM O=S(=O)([N-]CCc1cc2ccccc2o1)c1ccc(Cl)cc1F ZINC000523572128 947381721 /nfs/dbraw/zinc/38/17/21/947381721.db2.gz OGXYWSPFRYHFJO-UHFFFAOYSA-N -1 3 353.802 3.746 20 0 FHADHM O=S(=O)([N-]CCC[C@H]1CCCC[C@H]1O)c1c(Cl)cccc1Cl ZINC000127728727 947564877 /nfs/dbraw/zinc/56/48/77/947564877.db2.gz DZFPKGDQBPZAOH-BXUZGUMPSA-N -1 3 366.310 3.603 20 0 FHADHM COc1ccc(Cl)cc1-c1cc(=NC(=O)C[C@H](C)c2cccnc2)[nH][n-]1 ZINC000523756476 947572177 /nfs/dbraw/zinc/57/21/77/947572177.db2.gz SWIMEGXBPMZFCZ-LBPRGKRZSA-N -1 3 370.840 3.688 20 0 FHADHM O=C([O-])c1ccc(N2CCC(NCc3ccc(F)c(F)c3F)CC2)cc1 ZINC000663258922 947577892 /nfs/dbraw/zinc/57/78/92/947577892.db2.gz MWIDUEJWUMCFKT-UHFFFAOYSA-N -1 3 364.367 3.561 20 0 FHADHM COc1ccc(CN[C@@H](C(=O)[O-])c2cccc(C(F)(F)F)c2)cc1OC ZINC000663260634 947581366 /nfs/dbraw/zinc/58/13/66/947581366.db2.gz CRMAZEICMUVBBO-MRXNPFEDSA-N -1 3 369.339 3.638 20 0 FHADHM COc1cc2ccccc2cc1CNC[C@H](CCC(=O)[O-])C(F)(F)F ZINC000663261535 947584819 /nfs/dbraw/zinc/58/48/19/947584819.db2.gz KOFCTICYUFOSTN-HNNXBMFYSA-N -1 3 355.356 3.981 20 0 FHADHM CCOC(=O)c1sc2ncnc([N-]c3nc(C(C)=O)cs3)c2c1C ZINC000045913762 947594386 /nfs/dbraw/zinc/59/43/86/947594386.db2.gz WPFAOPQLUVEXIZ-UHFFFAOYSA-N -1 3 362.436 3.579 20 0 FHADHM Cc1c(Cl)cnc(NCc2ccccc2OC(C)C)c1-c1nnn[n-]1 ZINC000826240199 947711595 /nfs/dbraw/zinc/71/15/95/947711595.db2.gz IGTUAJWZUCPDPK-UHFFFAOYSA-N -1 3 358.833 3.623 20 0 FHADHM Cc1c(Cl)cnc(NCc2ccccc2OC(C)C)c1-c1nn[n-]n1 ZINC000826240199 947711606 /nfs/dbraw/zinc/71/16/06/947711606.db2.gz IGTUAJWZUCPDPK-UHFFFAOYSA-N -1 3 358.833 3.623 20 0 FHADHM CC(=CC(=O)Nc1ccc(OC(C)C)c(-c2nnn[n-]2)c1)c1ccccc1 ZINC001573363962 947716682 /nfs/dbraw/zinc/71/66/82/947716682.db2.gz ORNGLZLZCMYPRJ-KAMYIIQDSA-N -1 3 363.421 3.696 20 0 FHADHM CC(=CC(=O)Nc1ccc(OC(C)C)c(-c2nn[n-]n2)c1)c1ccccc1 ZINC001573363962 947716694 /nfs/dbraw/zinc/71/66/94/947716694.db2.gz ORNGLZLZCMYPRJ-KAMYIIQDSA-N -1 3 363.421 3.696 20 0 FHADHM Cc1c(N[C@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)cnn1-c1ccccc1 ZINC000826242509 947719901 /nfs/dbraw/zinc/71/99/01/947719901.db2.gz SAEJQCMYIYWQPK-GFCCVEGCSA-N -1 3 363.400 3.673 20 0 FHADHM Cc1c(N[C@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)cnn1-c1ccccc1 ZINC000826242509 947719905 /nfs/dbraw/zinc/71/99/05/947719905.db2.gz SAEJQCMYIYWQPK-GFCCVEGCSA-N -1 3 363.400 3.673 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1COC(=O)[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000826253579 947732298 /nfs/dbraw/zinc/73/22/98/947732298.db2.gz VRNHOADZLQJPSG-JSGCOSHPSA-N -1 3 368.359 3.587 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1COC(=O)[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000826253579 947732311 /nfs/dbraw/zinc/73/23/11/947732311.db2.gz VRNHOADZLQJPSG-JSGCOSHPSA-N -1 3 368.359 3.587 20 0 FHADHM Cc1oncc1C(=O)Nc1ccc([O-])c(C(=O)N[C@@H]2CCC[C@H](C)CC2)c1 ZINC000189472375 947739286 /nfs/dbraw/zinc/73/92/86/947739286.db2.gz OZTUXUMEZNHMJB-GXTWGEPZSA-N -1 3 371.437 3.640 20 0 FHADHM C/C(=C/C1CCC(C)CC1)C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC001573367232 947755987 /nfs/dbraw/zinc/75/59/87/947755987.db2.gz YOXKOCUDEXKGSP-YXIIKWTHSA-N -1 3 353.470 3.817 20 0 FHADHM C/C(=C/C1CCC(C)CC1)C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC001573367232 947755994 /nfs/dbraw/zinc/75/59/94/947755994.db2.gz YOXKOCUDEXKGSP-YXIIKWTHSA-N -1 3 353.470 3.817 20 0 FHADHM C/C(=C\c1ccccc1)CN(C)c1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC001573367319 947757730 /nfs/dbraw/zinc/75/77/30/947757730.db2.gz ZPBHGGRGPDIHTL-ZRDIBKRKSA-N -1 3 374.370 3.820 20 0 FHADHM C/C(=C\c1ccccc1)CN(C)c1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC001573367319 947757740 /nfs/dbraw/zinc/75/77/40/947757740.db2.gz ZPBHGGRGPDIHTL-ZRDIBKRKSA-N -1 3 374.370 3.820 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)n1 ZINC000826274536 947795046 /nfs/dbraw/zinc/79/50/46/947795046.db2.gz USAAJBFEVJDHAY-ZDUSSCGKSA-N -1 3 374.370 3.583 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)n1 ZINC000826274536 947795057 /nfs/dbraw/zinc/79/50/57/947795057.db2.gz USAAJBFEVJDHAY-ZDUSSCGKSA-N -1 3 374.370 3.583 20 0 FHADHM Cc1ccc(C(=O)Nc2cc(-c3nnn[n-]3)cn2C(C)(C)C)c(Cl)c1C ZINC000826282438 947812323 /nfs/dbraw/zinc/81/23/23/947812323.db2.gz OUHNQBQXTLIQPQ-UHFFFAOYSA-N -1 3 372.860 3.946 20 0 FHADHM Cc1ccc(C(=O)Nc2cc(-c3nn[n-]n3)cn2C(C)(C)C)c(Cl)c1C ZINC000826282438 947812330 /nfs/dbraw/zinc/81/23/30/947812330.db2.gz OUHNQBQXTLIQPQ-UHFFFAOYSA-N -1 3 372.860 3.946 20 0 FHADHM Cc1ccc(C2CCN(c3ccc4cc(-c5nnn[n-]5)ccc4n3)CC2)cn1 ZINC000826286302 947827795 /nfs/dbraw/zinc/82/77/95/947827795.db2.gz XUBMGFIMWLAYAB-UHFFFAOYSA-N -1 3 371.448 3.502 20 0 FHADHM Cc1ccc(C2CCN(c3ccc4cc(-c5nn[n-]n5)ccc4n3)CC2)cn1 ZINC000826286302 947827798 /nfs/dbraw/zinc/82/77/98/947827798.db2.gz XUBMGFIMWLAYAB-UHFFFAOYSA-N -1 3 371.448 3.502 20 0 FHADHM Cc1ccc(Cl)c2ccc(NC(=O)c3sccc3-c3nnn[n-]3)nc12 ZINC000826289248 947839709 /nfs/dbraw/zinc/83/97/09/947839709.db2.gz RUPHFMJYWIHXDC-UHFFFAOYSA-N -1 3 370.825 3.691 20 0 FHADHM Cc1ccc(Cl)c2ccc(NC(=O)c3sccc3-c3nn[n-]n3)nc12 ZINC000826289248 947839712 /nfs/dbraw/zinc/83/97/12/947839712.db2.gz RUPHFMJYWIHXDC-UHFFFAOYSA-N -1 3 370.825 3.691 20 0 FHADHM Cc1ccccc1NC(=O)CCSc1cccc(Cl)c1-c1nnn[n-]1 ZINC000826307745 947881875 /nfs/dbraw/zinc/88/18/75/947881875.db2.gz VABDGWGBLABFQV-UHFFFAOYSA-N -1 3 373.869 3.949 20 0 FHADHM Cc1ccccc1NC(=O)CCSc1cccc(Cl)c1-c1nn[n-]n1 ZINC000826307745 947881886 /nfs/dbraw/zinc/88/18/86/947881886.db2.gz VABDGWGBLABFQV-UHFFFAOYSA-N -1 3 373.869 3.949 20 0 FHADHM FC(F)c1n[n-]c(=NCCCN(Cc2ccccc2)Cc2ccccc2)o1 ZINC000432313810 947937709 /nfs/dbraw/zinc/93/77/09/947937709.db2.gz TXIUAXJGCQGTEG-UHFFFAOYSA-N -1 3 372.419 3.934 20 0 FHADHM Cc1nc(C(C)C)sc1[C@@H](C)OC(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000826323919 947947604 /nfs/dbraw/zinc/94/76/04/947947604.db2.gz XKFULDIMLILZLU-LLVKDONJSA-N -1 3 357.439 3.673 20 0 FHADHM Cc1nc(C(C)C)sc1[C@@H](C)OC(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC000826323919 947947607 /nfs/dbraw/zinc/94/76/07/947947607.db2.gz XKFULDIMLILZLU-LLVKDONJSA-N -1 3 357.439 3.673 20 0 FHADHM O=S(=O)([N-][C@@H]1CCCc2occc21)c1csc(-c2ccccc2)n1 ZINC000500443507 947968716 /nfs/dbraw/zinc/96/87/16/947968716.db2.gz YUQWPCJPJRTCIV-CQSZACIVSA-N -1 3 360.460 3.759 20 0 FHADHM Cc1nnc(N[C@H](C)c2ccc(-c3cccc(-c4nnn[n-]4)c3)cc2)s1 ZINC000826335952 947969176 /nfs/dbraw/zinc/96/91/76/947969176.db2.gz HXMZFDWAPLRIPI-LLVKDONJSA-N -1 3 363.450 3.867 20 0 FHADHM Cc1nnc(N[C@H](C)c2ccc(-c3cccc(-c4nn[n-]n4)c3)cc2)s1 ZINC000826335952 947969181 /nfs/dbraw/zinc/96/91/81/947969181.db2.gz HXMZFDWAPLRIPI-LLVKDONJSA-N -1 3 363.450 3.867 20 0 FHADHM Cc1nnc(N[C@@H](C)c2ccc(-c3cccc(-c4nnn[n-]4)c3)cc2)s1 ZINC000826335953 947970784 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FHADHM CCOC(=O)c1ccc(NC(=O)c2cnn(C3CCCCC3)c2C)c([O-])c1 ZINC000512009151 948183067 /nfs/dbraw/zinc/18/30/67/948183067.db2.gz MSSGARJURKEORK-UHFFFAOYSA-N -1 3 371.437 3.831 20 0 FHADHM CCOC(=O)C(=Cc1cccc(F)c1)c1nc(=O)c2c(C)c(C)sc2[n-]1 ZINC000006024487 948191977 /nfs/dbraw/zinc/19/19/77/948191977.db2.gz FHRHCRCHBYVOLF-NTEUORMPSA-N -1 3 372.421 3.844 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2cc(Cl)c(N)c(Cl)c2)cc1F ZINC000032588854 948218309 /nfs/dbraw/zinc/21/83/09/948218309.db2.gz CRQRFBKEGDSXMA-UHFFFAOYSA-N -1 3 365.213 3.524 20 0 FHADHM O=C(CCCc1ccc2ccccc2c1)Nc1ccccc1-c1nnn[n-]1 ZINC000826406961 948236804 /nfs/dbraw/zinc/23/68/04/948236804.db2.gz VEOZFJKFHJIIJP-UHFFFAOYSA-N -1 3 357.417 3.981 20 0 FHADHM O=C(CCCc1ccc2ccccc2c1)Nc1ccccc1-c1nn[n-]n1 ZINC000826406961 948236810 /nfs/dbraw/zinc/23/68/10/948236810.db2.gz VEOZFJKFHJIIJP-UHFFFAOYSA-N -1 3 357.417 3.981 20 0 FHADHM Cc1ccc(C(=O)N2C[C@@H](O)C[C@@H]2c2cccc(C(F)(F)F)c2)c([O-])c1 ZINC000093242711 948277854 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/nfs/dbraw/zinc/25/98/57/568259857.db2.gz RUAIFXDHLNMXBP-LKUPVBHCSA-N -1 3 374.525 3.808 20 0 FHADHM CCOC(=O)c1[n-]c(C)nc1NC(=O)c1sc(C2CCCC2)nc1C ZINC000525798123 568332534 /nfs/dbraw/zinc/33/25/34/568332534.db2.gz GDKSQSUHPNKSSH-UHFFFAOYSA-N -1 3 362.455 3.570 20 0 FHADHM CCOC(=O)c1nc(C)[n-]c1NC(=O)c1sc(C2CCCC2)nc1C ZINC000525798123 568332535 /nfs/dbraw/zinc/33/25/35/568332535.db2.gz GDKSQSUHPNKSSH-UHFFFAOYSA-N -1 3 362.455 3.570 20 0 FHADHM O=S(=O)([N-]C1(c2nccs2)CCCC1)c1cc(F)ccc1Cl ZINC000604769757 568362778 /nfs/dbraw/zinc/36/27/78/568362778.db2.gz NEUWMMZZBKQOPX-UHFFFAOYSA-N -1 3 360.863 3.683 20 0 FHADHM C[C@@H](Sc1nnc([N-]c2ccccc2F)s1)C(=O)NC1CCCC1 ZINC000003514790 568365633 /nfs/dbraw/zinc/36/56/33/568365633.db2.gz GWLVSUZFXLQFPC-SNVBAGLBSA-N -1 3 366.487 3.960 20 0 FHADHM COc1cc(CN2CCCC[C@@H]2C(=O)[O-])ccc1OCc1ccccc1 ZINC000003754662 568369968 /nfs/dbraw/zinc/36/99/68/568369968.db2.gz LZWTUGCIJZFGSD-GOSISDBHSA-N -1 3 355.434 3.713 20 0 FHADHM Cc1nc(COc2ccc(C(=O)Nc3cc(Cl)cc(C)c3[O-])cc2)no1 ZINC000604902028 568385066 /nfs/dbraw/zinc/38/50/66/568385066.db2.gz WFNKCBDFOQKIJL-UHFFFAOYSA-N -1 3 373.796 3.877 20 0 FHADHM C[C@@H](Sc1n[n-]c(-c2ccccn2)n1)C(=O)c1ccc2c(c1)CCC2 ZINC000604933259 568395459 /nfs/dbraw/zinc/39/54/59/568395459.db2.gz RWUPJNVJPHSMIG-GFCCVEGCSA-N -1 3 350.447 3.719 20 0 FHADHM O=C(Nc1ccccc1[O-])c1nc(-c2cccs2)n(-c2ccccc2)n1 ZINC000010892920 568446669 /nfs/dbraw/zinc/44/66/69/568446669.db2.gz WTEHZEJJSZKNOR-UHFFFAOYSA-N -1 3 362.414 3.954 20 0 FHADHM CO[C@H](CC(C)C)CS(=O)(=O)[N-]c1ccc(COC(C)(C)C)cc1 ZINC000643269553 568450404 /nfs/dbraw/zinc/45/04/04/568450404.db2.gz XYRHKIYOXXLNPS-QGZVFWFLSA-N -1 3 357.516 3.805 20 0 FHADHM O=S(=O)([N-]Cc1ccccc1C(F)(F)F)c1cccc2cccnc21 ZINC000033551343 568523611 /nfs/dbraw/zinc/52/36/11/568523611.db2.gz QKRVCGIVIPIBKT-UHFFFAOYSA-N -1 3 366.364 3.732 20 0 FHADHM CC1(C)CN(C(=O)c2cc(CCc3ccccc3)ccc2[O-])CCCO1 ZINC000605022674 568525943 /nfs/dbraw/zinc/52/59/43/568525943.db2.gz ZCLJHWVBHPYJGR-UHFFFAOYSA-N -1 3 353.462 3.819 20 0 FHADHM c1c(CNC2(c3nn[n-]n3)CCCC2)c2ccccc2n1Cc1ccccc1 ZINC000605075764 568554080 /nfs/dbraw/zinc/55/40/80/568554080.db2.gz JWZSEQHJWYDSEK-UHFFFAOYSA-N -1 3 372.476 3.762 20 0 FHADHM c1c(CNC2(c3nnn[n-]3)CCCC2)c2ccccc2n1Cc1ccccc1 ZINC000605075764 568554081 /nfs/dbraw/zinc/55/40/81/568554081.db2.gz JWZSEQHJWYDSEK-UHFFFAOYSA-N -1 3 372.476 3.762 20 0 FHADHM CCCCSCCC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C(C)C ZINC000736463903 598830494 /nfs/dbraw/zinc/83/04/94/598830494.db2.gz SBJYLTJULJYMHN-UHFFFAOYSA-N -1 3 361.515 3.527 20 0 FHADHM CCCCSCCC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C(C)C ZINC000736463903 598830497 /nfs/dbraw/zinc/83/04/97/598830497.db2.gz SBJYLTJULJYMHN-UHFFFAOYSA-N -1 3 361.515 3.527 20 0 FHADHM C[C@H](C(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1)C(C)(C)C ZINC000735547106 598833766 /nfs/dbraw/zinc/83/37/66/598833766.db2.gz KFHAWCPIPFOLNF-GFCCVEGCSA-N -1 3 369.494 3.894 20 0 FHADHM O=C(NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1)[C@@H]1CC=CCC1 ZINC000738113263 598836922 /nfs/dbraw/zinc/83/69/22/598836922.db2.gz YFXXAWTUIPULHE-CQSZACIVSA-N -1 3 365.462 3.568 20 0 FHADHM CC[C@H](OC(=O)CNc1ccc(-c2nn[n-]n2)cc1)c1ccc(Cl)cc1 ZINC000736383428 598843729 /nfs/dbraw/zinc/84/37/29/598843729.db2.gz RGJJXMJVKYDXHO-INIZCTEOSA-N -1 3 371.828 3.627 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)Nc1ccccc1OC(C)C ZINC000737293280 598851203 /nfs/dbraw/zinc/85/12/03/598851203.db2.gz AEHUTKXVBREQBN-UHFFFAOYSA-N -1 3 352.398 3.606 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)Nc1ccccc1OC(C)C ZINC000737293280 598851204 /nfs/dbraw/zinc/85/12/04/598851204.db2.gz AEHUTKXVBREQBN-UHFFFAOYSA-N -1 3 352.398 3.606 20 0 FHADHM Fc1cccc(NCc2cccc(-c3ccc(-c4nnn[n-]4)s3)c2)n1 ZINC000737663280 598854966 /nfs/dbraw/zinc/85/49/66/598854966.db2.gz IJMUNMNSWZIWJR-UHFFFAOYSA-N -1 3 352.398 3.741 20 0 FHADHM C[C@@H](Nc1ncc(-c2nnn[n-]2)cc1Cl)c1ncc(-c2ccccc2)o1 ZINC000736136067 598855310 /nfs/dbraw/zinc/85/53/10/598855310.db2.gz DPPUERKBWQVIDV-SNVBAGLBSA-N -1 3 367.800 3.743 20 0 FHADHM C[C@@H](Nc1ncc(-c2nn[n-]n2)cc1Cl)c1ncc(-c2ccccc2)o1 ZINC000736136067 598855311 /nfs/dbraw/zinc/85/53/11/598855311.db2.gz DPPUERKBWQVIDV-SNVBAGLBSA-N -1 3 367.800 3.743 20 0 FHADHM FC(F)(F)c1csc(CSCc2cccc(-c3nnn[n-]3)c2)n1 ZINC000826369007 607786132 /nfs/dbraw/zinc/78/61/32/607786132.db2.gz JETKJYZKVRVVFI-UHFFFAOYSA-N -1 3 357.386 3.775 20 0 FHADHM FC(F)(F)c1csc(CSCc2cccc(-c3nn[n-]n3)c2)n1 ZINC000826369007 607786133 /nfs/dbraw/zinc/78/61/33/607786133.db2.gz JETKJYZKVRVVFI-UHFFFAOYSA-N -1 3 357.386 3.775 20 0 FHADHM COc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)[C@H](C)CC1CCCC1 ZINC000737024421 598903419 /nfs/dbraw/zinc/90/34/19/598903419.db2.gz HUKIKQFDZQAXFM-SNVBAGLBSA-N -1 3 364.833 3.651 20 0 FHADHM COc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)[C@H](C)CC1CCCC1 ZINC000737024421 598903420 /nfs/dbraw/zinc/90/34/20/598903420.db2.gz HUKIKQFDZQAXFM-SNVBAGLBSA-N -1 3 364.833 3.651 20 0 FHADHM CC[C@H](CC1CCCCC1)C(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000736349400 598903654 /nfs/dbraw/zinc/90/36/54/598903654.db2.gz GKMXKPHJLZLLQB-QGZVFWFLSA-N -1 3 355.486 3.822 20 0 FHADHM CC[C@H](CC1CCCCC1)C(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000736349400 598903656 /nfs/dbraw/zinc/90/36/56/598903656.db2.gz GKMXKPHJLZLLQB-QGZVFWFLSA-N -1 3 355.486 3.822 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@@H]2C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)cc1 ZINC000735924114 598912327 /nfs/dbraw/zinc/91/23/27/598912327.db2.gz QJOIXURNZJRYKK-HOTGVXAUSA-N -1 3 365.412 3.871 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@@H]2C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)cc1 ZINC000735924114 598912328 /nfs/dbraw/zinc/91/23/28/598912328.db2.gz QJOIXURNZJRYKK-HOTGVXAUSA-N -1 3 365.412 3.871 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1Nc1ccc(Cc2ccncc2)cc1 ZINC000737559431 598934880 /nfs/dbraw/zinc/93/48/80/598934880.db2.gz XGVCPCPIDCQNJN-UHFFFAOYSA-N -1 3 363.812 3.645 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1Nc1ccc(Cc2ccncc2)cc1 ZINC000737559431 598934882 /nfs/dbraw/zinc/93/48/82/598934882.db2.gz XGVCPCPIDCQNJN-UHFFFAOYSA-N -1 3 363.812 3.645 20 0 FHADHM CC(C)[C@H](Nc1ncc(-c2nnn[n-]2)cc1Cl)c1nc2ccccc2[nH]1 ZINC000735921537 598935709 /nfs/dbraw/zinc/93/57/09/598935709.db2.gz SZLLCYZOUFCPQA-AWEZNQCLSA-N -1 3 368.832 3.601 20 0 FHADHM CC(C)[C@H](Nc1ncc(-c2nn[n-]n2)cc1Cl)c1nc2ccccc2[nH]1 ZINC000735921537 598935711 /nfs/dbraw/zinc/93/57/11/598935711.db2.gz SZLLCYZOUFCPQA-AWEZNQCLSA-N -1 3 368.832 3.601 20 0 FHADHM CC(C)C[C@H]1CCCCCN1C(=S)Nc1ccccc1-c1nnn[n-]1 ZINC000735795527 598939625 /nfs/dbraw/zinc/93/96/25/598939625.db2.gz NUOHUEIMRBLONY-CQSZACIVSA-N -1 3 358.515 3.854 20 0 FHADHM CC(C)C[C@H]1CCCCCN1C(=S)Nc1ccccc1-c1nn[n-]n1 ZINC000735795527 598939626 /nfs/dbraw/zinc/93/96/26/598939626.db2.gz NUOHUEIMRBLONY-CQSZACIVSA-N -1 3 358.515 3.854 20 0 FHADHM Cc1ccc(OC(=O)CSCc2ccc(-c3nnn[n-]3)cc2)c(Cl)c1 ZINC000737363916 598942970 /nfs/dbraw/zinc/94/29/70/598942970.db2.gz GRHXUWJUWHZPIE-UHFFFAOYSA-N -1 3 374.853 3.667 20 0 FHADHM Cc1ccc(OC(=O)CSCc2ccc(-c3nn[n-]n3)cc2)c(Cl)c1 ZINC000737363916 598942973 /nfs/dbraw/zinc/94/29/73/598942973.db2.gz GRHXUWJUWHZPIE-UHFFFAOYSA-N -1 3 374.853 3.667 20 0 FHADHM CC[C@H]1CCCN(C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)C1 ZINC000820981793 599293557 /nfs/dbraw/zinc/29/35/57/599293557.db2.gz XCQLMELOUIAHQC-JTQLQIEISA-N -1 3 368.363 3.539 20 0 FHADHM CC(C)[C@@H]1CCCN(C(=O)Nc2cc(-c3nnn[n-]3)cn2C(C)(C)C)CC1 ZINC000735748072 598962256 /nfs/dbraw/zinc/96/22/56/598962256.db2.gz HDFHSBUMVNUJQO-CQSZACIVSA-N -1 3 373.505 3.713 20 0 FHADHM CC(C)[C@@H]1CCCN(C(=O)Nc2cc(-c3nn[n-]n3)cn2C(C)(C)C)CC1 ZINC000735748072 598962258 /nfs/dbraw/zinc/96/22/58/598962258.db2.gz HDFHSBUMVNUJQO-CQSZACIVSA-N -1 3 373.505 3.713 20 0 FHADHM C[C@H](C(=O)Nc1nc(-c2ccc(-c3nnn[n-]3)cc2)cs1)C(C)(C)C ZINC000735569069 599014757 /nfs/dbraw/zinc/01/47/57/599014757.db2.gz DFKCHEWQQYCXRS-SNVBAGLBSA-N -1 3 356.455 3.611 20 0 FHADHM C[C@H](C(=O)Nc1nc(-c2ccc(-c3nn[n-]n3)cc2)cs1)C(C)(C)C ZINC000735569069 599014760 /nfs/dbraw/zinc/01/47/60/599014760.db2.gz DFKCHEWQQYCXRS-SNVBAGLBSA-N -1 3 356.455 3.611 20 0 FHADHM CC(C)C[C@H]1CCCCCN1C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000735795516 599018993 /nfs/dbraw/zinc/01/89/93/599018993.db2.gz NODSXMGVLNCLBK-CRAIPNDOSA-N -1 3 370.501 3.928 20 0 FHADHM CC(C)C[C@H]1CCCCCN1C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000735795516 599018995 /nfs/dbraw/zinc/01/89/95/599018995.db2.gz NODSXMGVLNCLBK-CRAIPNDOSA-N -1 3 370.501 3.928 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CCCCC[C@@H]1CC(C)C ZINC000737292182 599021395 /nfs/dbraw/zinc/02/13/95/599021395.db2.gz SYJCTAXNMHUXJX-MRXNPFEDSA-N -1 3 356.474 3.998 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CCCCC[C@@H]1CC(C)C ZINC000737292182 599021398 /nfs/dbraw/zinc/02/13/98/599021398.db2.gz SYJCTAXNMHUXJX-MRXNPFEDSA-N -1 3 356.474 3.998 20 0 FHADHM CC[C@@H]1CCC[C@H](NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)C1 ZINC000736398237 599023613 /nfs/dbraw/zinc/02/36/13/599023613.db2.gz ZUCVPAJQXFDHMA-PBHICJAKSA-N -1 3 368.485 3.510 20 0 FHADHM CC[C@@H]1CCC[C@H](NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)C1 ZINC000736398237 599023615 /nfs/dbraw/zinc/02/36/15/599023615.db2.gz ZUCVPAJQXFDHMA-PBHICJAKSA-N -1 3 368.485 3.510 20 0 FHADHM C[C@@H](Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1)c1ccc(F)c(F)c1 ZINC000736137531 599038596 /nfs/dbraw/zinc/03/85/96/599038596.db2.gz MWAYOLMLPDPVHY-SSDOTTSWSA-N -1 3 370.285 3.732 20 0 FHADHM C[C@@H](Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1)c1ccc(F)c(F)c1 ZINC000736137531 599038599 /nfs/dbraw/zinc/03/85/99/599038599.db2.gz MWAYOLMLPDPVHY-SSDOTTSWSA-N -1 3 370.285 3.732 20 0 FHADHM CC(C)c1csc([C@H]2CCCN(c3ccc(F)cc3-c3nnn[n-]3)C2)n1 ZINC000820197843 599043110 /nfs/dbraw/zinc/04/31/10/599043110.db2.gz NVJOCBWSQKIBSK-LBPRGKRZSA-N -1 3 372.473 3.970 20 0 FHADHM CC(C)c1csc([C@H]2CCCN(c3ccc(F)cc3-c3nn[n-]n3)C2)n1 ZINC000820197843 599043113 /nfs/dbraw/zinc/04/31/13/599043113.db2.gz NVJOCBWSQKIBSK-LBPRGKRZSA-N -1 3 372.473 3.970 20 0 FHADHM CC(C)c1csc([C@@H]2CCCN(c3ccc(-c4nn[n-]n4)cc3)C2)n1 ZINC000820197451 599043159 /nfs/dbraw/zinc/04/31/59/599043159.db2.gz JBSHDSLMUDHCJK-CQSZACIVSA-N -1 3 354.483 3.831 20 0 FHADHM C[C@H](c1ncc(-c2ccccc2)o1)N(C)Cc1cccc(-c2nn[n-]n2)c1 ZINC000736203289 599047431 /nfs/dbraw/zinc/04/74/31/599047431.db2.gz LSHQJOGOOPNYCS-CQSZACIVSA-N -1 3 360.421 3.715 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N2CCC[C@H]2C2CCCCC2)n1 ZINC000737631489 599047862 /nfs/dbraw/zinc/04/78/62/599047862.db2.gz DVTGHOCSLAAJDQ-ZDUSSCGKSA-N -1 3 366.391 3.830 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N2CCC[C@H]2C2CCCCC2)n1 ZINC000737631489 599047865 /nfs/dbraw/zinc/04/78/65/599047865.db2.gz DVTGHOCSLAAJDQ-ZDUSSCGKSA-N -1 3 366.391 3.830 20 0 FHADHM COc1ccc(-c2ccc(CNc3ccc(-c4nnn[n-]4)cn3)cc2)cc1 ZINC000821727623 599057775 /nfs/dbraw/zinc/05/77/75/599057775.db2.gz LCDDANCWWAGQAG-UHFFFAOYSA-N -1 3 358.405 3.549 20 0 FHADHM COc1ccc(-c2ccc(CNc3ccc(-c4nn[n-]n4)cn3)cc2)cc1 ZINC000821727623 599057777 /nfs/dbraw/zinc/05/77/77/599057777.db2.gz LCDDANCWWAGQAG-UHFFFAOYSA-N -1 3 358.405 3.549 20 0 FHADHM C[C@H]1C[C@H](c2ccccc2)CN1c1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000736234788 599060596 /nfs/dbraw/zinc/06/05/96/599060596.db2.gz KPKFMTYKAZDZRB-AAEUAGOBSA-N -1 3 374.370 3.663 20 0 FHADHM C[C@H]1C[C@H](c2ccccc2)CN1c1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000736234788 599060599 /nfs/dbraw/zinc/06/05/99/599060599.db2.gz KPKFMTYKAZDZRB-AAEUAGOBSA-N -1 3 374.370 3.663 20 0 FHADHM Fc1cccc(N[C@@H](c2ccccc2)C2CCOCC2)c1-c1nnn[n-]1 ZINC000737662332 599061600 /nfs/dbraw/zinc/06/16/00/599061600.db2.gz UUAMDFPHNBDENX-SFHVURJKSA-N -1 3 353.401 3.586 20 0 FHADHM Fc1cccc(N[C@@H](c2ccccc2)C2CCOCC2)c1-c1nn[n-]n1 ZINC000737662332 599061603 /nfs/dbraw/zinc/06/16/03/599061603.db2.gz UUAMDFPHNBDENX-SFHVURJKSA-N -1 3 353.401 3.586 20 0 FHADHM COc1cc(CNc2ccc(Cl)cc2-c2nnn[n-]2)c2ccccc2n1 ZINC000821717657 599061962 /nfs/dbraw/zinc/06/19/62/599061962.db2.gz SFIQSIQZIKTBCP-UHFFFAOYSA-N -1 3 366.812 3.689 20 0 FHADHM COc1cc(CNc2ccc(Cl)cc2-c2nn[n-]n2)c2ccccc2n1 ZINC000821717657 599061965 /nfs/dbraw/zinc/06/19/65/599061965.db2.gz SFIQSIQZIKTBCP-UHFFFAOYSA-N -1 3 366.812 3.689 20 0 FHADHM CCCn1c(C)cc(C(=O)CSc2ccc(-c3nnn[n-]3)cc2F)c1C ZINC000736499696 599063061 /nfs/dbraw/zinc/06/30/61/599063061.db2.gz IKKREPKCYYBCKP-UHFFFAOYSA-N -1 3 373.457 3.809 20 0 FHADHM CCCn1c(C)cc(C(=O)CSc2ccc(-c3nn[n-]n3)cc2F)c1C ZINC000736499696 599063065 /nfs/dbraw/zinc/06/30/65/599063065.db2.gz IKKREPKCYYBCKP-UHFFFAOYSA-N -1 3 373.457 3.809 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1N1CC[C@H](COCc2ccccc2)C1 ZINC000822581712 599063384 /nfs/dbraw/zinc/06/33/84/599063384.db2.gz LLHBODBYXAWIGN-HNNXBMFYSA-N -1 3 369.856 3.563 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1N1CC[C@H](COCc2ccccc2)C1 ZINC000822581712 599063387 /nfs/dbraw/zinc/06/33/87/599063387.db2.gz LLHBODBYXAWIGN-HNNXBMFYSA-N -1 3 369.856 3.563 20 0 FHADHM C[C@H](Sc1ccc(-c2nnn[n-]2)cc1F)c1nc(-c2ccccc2)no1 ZINC000736192891 599063477 /nfs/dbraw/zinc/06/34/77/599063477.db2.gz NBHURDGGDUMABI-JTQLQIEISA-N -1 3 368.397 3.909 20 0 FHADHM C[C@H](Sc1ccc(-c2nn[n-]n2)cc1F)c1nc(-c2ccccc2)no1 ZINC000736192891 599063480 /nfs/dbraw/zinc/06/34/80/599063480.db2.gz NBHURDGGDUMABI-JTQLQIEISA-N -1 3 368.397 3.909 20 0 FHADHM C[C@@H](Sc1ccc(-c2nnn[n-]2)cc1F)c1nc(-c2cccs2)no1 ZINC000736193694 599065434 /nfs/dbraw/zinc/06/54/34/599065434.db2.gz RTBYYTBNMVJWCU-MRVPVSSYSA-N -1 3 374.426 3.971 20 0 FHADHM C[C@@H](Sc1ccc(-c2nn[n-]n2)cc1F)c1nc(-c2cccs2)no1 ZINC000736193694 599065437 /nfs/dbraw/zinc/06/54/37/599065437.db2.gz RTBYYTBNMVJWCU-MRVPVSSYSA-N -1 3 374.426 3.971 20 0 FHADHM Cc1cccc(F)c1CNc1ccc(-c2nn[n-]n2)cc1C(F)(F)F ZINC000822309164 599068710 /nfs/dbraw/zinc/06/87/10/599068710.db2.gz ODOFUIWNUIPDMH-UHFFFAOYSA-N -1 3 351.307 3.945 20 0 FHADHM O=C([C@H]1C[C@@H]1C1CCCCC1)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000737781413 599069031 /nfs/dbraw/zinc/06/90/31/599069031.db2.gz APEFNLJRHJDYCV-MOPGFXCFSA-N -1 3 365.481 3.574 20 0 FHADHM O=C([C@H]1C[C@@H]1C1CCCCC1)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000737781413 599069034 /nfs/dbraw/zinc/06/90/34/599069034.db2.gz APEFNLJRHJDYCV-MOPGFXCFSA-N -1 3 365.481 3.574 20 0 FHADHM C[C@@H]1[C@@H](C)CCCN1C(=O)c1ccccc1-c1ccccc1-c1nnn[n-]1 ZINC000736264327 599081814 /nfs/dbraw/zinc/08/18/14/599081814.db2.gz CVUWYTBSAYYNID-LSDHHAIUSA-N -1 3 361.449 3.794 20 0 FHADHM C[C@@H]1[C@@H](C)CCCN1C(=O)c1ccccc1-c1ccccc1-c1nn[n-]n1 ZINC000736264327 599081816 /nfs/dbraw/zinc/08/18/16/599081816.db2.gz CVUWYTBSAYYNID-LSDHHAIUSA-N -1 3 361.449 3.794 20 0 FHADHM Cc1ccc([C@H]2CCCCN2C(=O)C=Cc2ccccc2-c2nnn[n-]2)cc1 ZINC000737329816 599082711 /nfs/dbraw/zinc/08/27/11/599082711.db2.gz LDVAPCHWMUOLIO-FBRRREGBSA-N -1 3 373.460 3.942 20 0 FHADHM Cc1ccc([C@H]2CCCCN2C(=O)C=Cc2ccccc2-c2nn[n-]n2)cc1 ZINC000737329816 599082713 /nfs/dbraw/zinc/08/27/13/599082713.db2.gz LDVAPCHWMUOLIO-FBRRREGBSA-N -1 3 373.460 3.942 20 0 FHADHM Fc1cc(F)c2ncc(-c3nnn[n-]3)c(NCC(C3CC3)C3CC3)c2c1 ZINC000822754000 599086579 /nfs/dbraw/zinc/08/65/79/599086579.db2.gz VSEPLIUDZAOBNO-UHFFFAOYSA-N -1 3 356.380 3.541 20 0 FHADHM Fc1cc(F)c2ncc(-c3nn[n-]n3)c(NCC(C3CC3)C3CC3)c2c1 ZINC000822754000 599086582 /nfs/dbraw/zinc/08/65/82/599086582.db2.gz VSEPLIUDZAOBNO-UHFFFAOYSA-N -1 3 356.380 3.541 20 0 FHADHM Fc1ccc(N2CC[C@@H](CSc3ccccc3)C2)c(-c2nnn[n-]2)c1 ZINC000822778062 599088849 /nfs/dbraw/zinc/08/88/49/599088849.db2.gz BRWZFSQNJPENPT-CYBMUJFWSA-N -1 3 355.442 3.624 20 0 FHADHM Fc1ccc(N2CC[C@@H](CSc3ccccc3)C2)c(-c2nn[n-]n2)c1 ZINC000822778062 599088851 /nfs/dbraw/zinc/08/88/51/599088851.db2.gz BRWZFSQNJPENPT-CYBMUJFWSA-N -1 3 355.442 3.624 20 0 FHADHM C[C@@H](Nc1c(F)cc(-c2nn[n-]n2)cc1F)c1cccc(-n2ccnc2)c1 ZINC000820450101 599094686 /nfs/dbraw/zinc/09/46/86/599094686.db2.gz HAVGGNNWXIRVBK-LLVKDONJSA-N -1 3 367.363 3.504 20 0 FHADHM C[C@@H](Sc1ccccc1-c1nnn[n-]1)C(=O)Nc1ccccc1Cl ZINC000736191826 599108281 /nfs/dbraw/zinc/10/82/81/599108281.db2.gz IVLLPSPVTHLYBQ-SNVBAGLBSA-N -1 3 359.842 3.639 20 0 FHADHM C[C@@H](Sc1ccccc1-c1nn[n-]n1)C(=O)Nc1ccccc1Cl ZINC000736191826 599108285 /nfs/dbraw/zinc/10/82/85/599108285.db2.gz IVLLPSPVTHLYBQ-SNVBAGLBSA-N -1 3 359.842 3.639 20 0 FHADHM Cc1ccc([C@H]2OCCC[C@H]2CNc2cccc(F)c2-c2nnn[n-]2)cc1 ZINC000822233572 599108388 /nfs/dbraw/zinc/10/83/88/599108388.db2.gz RLDFUAFUISKGGN-HNAYVOBHSA-N -1 3 367.428 3.894 20 0 FHADHM Cc1ccc([C@H]2OCCC[C@H]2CNc2cccc(F)c2-c2nn[n-]n2)cc1 ZINC000822233572 599108391 /nfs/dbraw/zinc/10/83/91/599108391.db2.gz RLDFUAFUISKGGN-HNAYVOBHSA-N -1 3 367.428 3.894 20 0 FHADHM Cc1ccc([C@H]2OCCC[C@@H]2CNc2ccc(F)cc2-c2nnn[n-]2)cc1 ZINC000822233077 599108820 /nfs/dbraw/zinc/10/88/20/599108820.db2.gz HPRGOWCWSRLSKX-DNVCBOLYSA-N -1 3 367.428 3.894 20 0 FHADHM Cc1ccc([C@H]2OCCC[C@@H]2CNc2ccc(F)cc2-c2nn[n-]n2)cc1 ZINC000822233077 599108824 /nfs/dbraw/zinc/10/88/24/599108824.db2.gz HPRGOWCWSRLSKX-DNVCBOLYSA-N -1 3 367.428 3.894 20 0 FHADHM Cc1ccc2c(CSc3ccccc3-c3nnn[n-]3)cc(=O)oc2c1 ZINC000737371898 599110400 /nfs/dbraw/zinc/11/04/00/599110400.db2.gz PHNSASGRCOCGDN-UHFFFAOYSA-N -1 3 350.403 3.574 20 0 FHADHM Cc1ccc2c(CSc3ccccc3-c3nn[n-]n3)cc(=O)oc2c1 ZINC000737371898 599110401 /nfs/dbraw/zinc/11/04/01/599110401.db2.gz PHNSASGRCOCGDN-UHFFFAOYSA-N -1 3 350.403 3.574 20 0 FHADHM Cc1nccc(Nc2ccc(Oc3ccccc3-c3nnn[n-]3)c(F)c2)n1 ZINC000822472438 599111255 /nfs/dbraw/zinc/11/12/55/599111255.db2.gz SYRZEBQGXCHWPW-UHFFFAOYSA-N -1 3 363.356 3.640 20 0 FHADHM Cc1nccc(Nc2ccc(Oc3ccccc3-c3nn[n-]n3)c(F)c2)n1 ZINC000822472438 599111258 /nfs/dbraw/zinc/11/12/58/599111258.db2.gz SYRZEBQGXCHWPW-UHFFFAOYSA-N -1 3 363.356 3.640 20 0 FHADHM Cc1ccc(C)c(NC(=O)[C@@H](C)Sc2ccccc2-c2nnn[n-]2)c1 ZINC000737324043 599111943 /nfs/dbraw/zinc/11/19/43/599111943.db2.gz ZCRYRINBDBGMQZ-CYBMUJFWSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1ccc(C)c(NC(=O)[C@@H](C)Sc2ccccc2-c2nn[n-]n2)c1 ZINC000737324043 599111945 /nfs/dbraw/zinc/11/19/45/599111945.db2.gz ZCRYRINBDBGMQZ-CYBMUJFWSA-N -1 3 353.451 3.603 20 0 FHADHM COC(=O)[C@H](Sc1cccc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736900782 599112716 /nfs/dbraw/zinc/11/27/16/599112716.db2.gz GHCPRFSPQHRZCV-CQSZACIVSA-N -1 3 360.826 3.527 20 0 FHADHM COC(=O)[C@H](Sc1cccc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736900782 599112719 /nfs/dbraw/zinc/11/27/19/599112719.db2.gz GHCPRFSPQHRZCV-CQSZACIVSA-N -1 3 360.826 3.527 20 0 FHADHM CCO[C@H]1C[C@H](Nc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)C12CCC2 ZINC000736614946 599120055 /nfs/dbraw/zinc/12/00/55/599120055.db2.gz WHSFOCLSFKMPBZ-KBPBESRZSA-N -1 3 367.375 3.645 20 0 FHADHM CC(C)[C@@H](C)S[C@H](C)C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2 ZINC000820549095 599130704 /nfs/dbraw/zinc/13/07/04/599130704.db2.gz KDLZCSFWTVVWBR-NXEZZACHSA-N -1 3 365.528 3.522 20 0 FHADHM CC(C)[C@@H](C)S[C@H](C)C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2 ZINC000820549095 599130706 /nfs/dbraw/zinc/13/07/06/599130706.db2.gz KDLZCSFWTVVWBR-NXEZZACHSA-N -1 3 365.528 3.522 20 0 FHADHM CC(=CC(=O)Nc1cccc(-c2nnn[n-]2)c1)c1cccc(C(F)(F)F)c1 ZINC000742501629 599131456 /nfs/dbraw/zinc/13/14/56/599131456.db2.gz PIXDHGNVVVXQNV-DHZHZOJOSA-N -1 3 373.338 3.928 20 0 FHADHM CC(=CC(=O)Nc1cccc(-c2nn[n-]n2)c1)c1cccc(C(F)(F)F)c1 ZINC000742501629 599131459 /nfs/dbraw/zinc/13/14/59/599131459.db2.gz PIXDHGNVVVXQNV-DHZHZOJOSA-N -1 3 373.338 3.928 20 0 FHADHM Cc1cncc(C(=O)Nc2ccc(Oc3ccccc3-c3nnn[n-]3)cc2)c1 ZINC000822400199 599145271 /nfs/dbraw/zinc/14/52/71/599145271.db2.gz ZFKAMSWNHIKVLZ-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1cncc(C(=O)Nc2ccc(Oc3ccccc3-c3nn[n-]n3)cc2)c1 ZINC000822400199 599145273 /nfs/dbraw/zinc/14/52/73/599145273.db2.gz ZFKAMSWNHIKVLZ-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1cc(F)cc(C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)CC(C)C)c1 ZINC000822203163 599147580 /nfs/dbraw/zinc/14/75/80/599147580.db2.gz HNSACVMNJABURB-UHFFFAOYSA-N -1 3 367.428 3.613 20 0 FHADHM Cc1cc(F)cc(C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)CC(C)C)c1 ZINC000822203163 599147583 /nfs/dbraw/zinc/14/75/83/599147583.db2.gz HNSACVMNJABURB-UHFFFAOYSA-N -1 3 367.428 3.613 20 0 FHADHM Cc1ccc([C@@H]2CCC[C@@H]2N(C)C(=O)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000822232971 599161989 /nfs/dbraw/zinc/16/19/89/599161989.db2.gz FPPUSWJBCZKRGB-OALUTQOASA-N -1 3 361.449 3.583 20 0 FHADHM Cc1ccc([C@@H]2CCC[C@@H]2N(C)C(=O)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000822232971 599161992 /nfs/dbraw/zinc/16/19/92/599161992.db2.gz FPPUSWJBCZKRGB-OALUTQOASA-N -1 3 361.449 3.583 20 0 FHADHM C[C@@H](SCc1nnc(-c2cccc(-c3nnn[n-]3)c2)o1)c1cccs1 ZINC000736192843 599166609 /nfs/dbraw/zinc/16/66/09/599166609.db2.gz MQGNIRFKAREBEK-SNVBAGLBSA-N -1 3 370.463 3.973 20 0 FHADHM C[C@@H](SCc1nnc(-c2cccc(-c3nn[n-]n3)c2)o1)c1cccs1 ZINC000736192843 599166612 /nfs/dbraw/zinc/16/66/12/599166612.db2.gz MQGNIRFKAREBEK-SNVBAGLBSA-N -1 3 370.463 3.973 20 0 FHADHM Cc1nc(CSc2ccc(-c3nnn[n-]3)cc2F)nc2ccccc12 ZINC000737478578 599167858 /nfs/dbraw/zinc/16/78/58/599167858.db2.gz WQJFXBOQOUACFL-UHFFFAOYSA-N -1 3 352.398 3.550 20 0 FHADHM Cc1nc(CSc2ccc(-c3nn[n-]n3)cc2F)nc2ccccc12 ZINC000737478578 599167859 /nfs/dbraw/zinc/16/78/59/599167859.db2.gz WQJFXBOQOUACFL-UHFFFAOYSA-N -1 3 352.398 3.550 20 0 FHADHM Fc1cc(F)c2ncc(-c3nnn[n-]3)c(N3CCC[C@@H]3c3ccco3)c2c1 ZINC000737645409 599169863 /nfs/dbraw/zinc/16/98/63/599169863.db2.gz WZKMBJZCXWFFOF-CQSZACIVSA-N -1 3 368.347 3.628 20 0 FHADHM Fc1cc(F)c2ncc(-c3nn[n-]n3)c(N3CCC[C@@H]3c3ccco3)c2c1 ZINC000737645409 599169865 /nfs/dbraw/zinc/16/98/65/599169865.db2.gz WZKMBJZCXWFFOF-CQSZACIVSA-N -1 3 368.347 3.628 20 0 FHADHM C[C@H](C(=O)Oc1ccc(-c2nnn[n-]2)cc1)c1ccccc1C(F)(F)F ZINC000735572059 599174292 /nfs/dbraw/zinc/17/42/92/599174292.db2.gz PTJUKFRKQRHQBT-JTQLQIEISA-N -1 3 362.311 3.595 20 0 FHADHM C[C@H](C(=O)Oc1ccc(-c2nn[n-]n2)cc1)c1ccccc1C(F)(F)F ZINC000735572059 599174294 /nfs/dbraw/zinc/17/42/94/599174294.db2.gz PTJUKFRKQRHQBT-JTQLQIEISA-N -1 3 362.311 3.595 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@H](C)c1cccc(Cl)c1 ZINC000736636049 599184660 /nfs/dbraw/zinc/18/46/60/599184660.db2.gz NLSYWSXXICOWGZ-LLVKDONJSA-N -1 3 371.828 3.661 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@H](C)c1cccc(Cl)c1 ZINC000736636049 599184662 /nfs/dbraw/zinc/18/46/62/599184662.db2.gz NLSYWSXXICOWGZ-LLVKDONJSA-N -1 3 371.828 3.661 20 0 FHADHM Cc1ccncc1C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000737443673 599190436 /nfs/dbraw/zinc/19/04/36/599190436.db2.gz IPYWIKMCLZHTHR-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccncc1C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000737443673 599190439 /nfs/dbraw/zinc/19/04/39/599190439.db2.gz IPYWIKMCLZHTHR-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM O=C(c1ccccc1-c1ccccc1-c1nnn[n-]1)N1CCC2(CCCC2)C1 ZINC000823493481 599207814 /nfs/dbraw/zinc/20/78/14/599207814.db2.gz ODLJHYZUVOGJEY-UHFFFAOYSA-N -1 3 373.460 3.940 20 0 FHADHM O=C(c1ccccc1-c1ccccc1-c1nn[n-]n1)N1CCC2(CCCC2)C1 ZINC000823493481 599207815 /nfs/dbraw/zinc/20/78/15/599207815.db2.gz ODLJHYZUVOGJEY-UHFFFAOYSA-N -1 3 373.460 3.940 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)NC(C)(C)c1cccs1 ZINC000735671697 599212042 /nfs/dbraw/zinc/21/20/42/599212042.db2.gz BNZWPUIKLYZINR-UHFFFAOYSA-N -1 3 373.486 3.542 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)NC(C)(C)c1cccs1 ZINC000735671697 599212043 /nfs/dbraw/zinc/21/20/43/599212043.db2.gz BNZWPUIKLYZINR-UHFFFAOYSA-N -1 3 373.486 3.542 20 0 FHADHM CC(C)(NC(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1cccs1 ZINC000735671686 599216095 /nfs/dbraw/zinc/21/60/95/599216095.db2.gz AUKJYQIZPRZLMT-UHFFFAOYSA-N -1 3 362.846 3.638 20 0 FHADHM CC(C)(NC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1cccs1 ZINC000735671686 599216098 /nfs/dbraw/zinc/21/60/98/599216098.db2.gz AUKJYQIZPRZLMT-UHFFFAOYSA-N -1 3 362.846 3.638 20 0 FHADHM CCc1ccc([C@H]2C[C@@H](C)CCN2C(=O)c2cccc(-c3nnn[n-]3)c2)o1 ZINC000821482516 599220988 /nfs/dbraw/zinc/22/09/88/599220988.db2.gz SEKAQZAYGKTODU-SUMWQHHRSA-N -1 3 365.437 3.636 20 0 FHADHM CCc1ccc([C@H]2C[C@@H](C)CCN2C(=O)c2cccc(-c3nn[n-]n3)c2)o1 ZINC000821482516 599220991 /nfs/dbraw/zinc/22/09/91/599220991.db2.gz SEKAQZAYGKTODU-SUMWQHHRSA-N -1 3 365.437 3.636 20 0 FHADHM CC[C@@H]1CCCN(C(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)CC1 ZINC000736402562 599221905 /nfs/dbraw/zinc/22/19/05/599221905.db2.gz NYXKPVCXROPCSI-LLVKDONJSA-N -1 3 364.906 3.729 20 0 FHADHM CC[C@@H]1CCCN(C(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)CC1 ZINC000736402562 599221907 /nfs/dbraw/zinc/22/19/07/599221907.db2.gz NYXKPVCXROPCSI-LLVKDONJSA-N -1 3 364.906 3.729 20 0 FHADHM C[C@H](SCc1nccn1CC(F)(F)F)c1ccc(-c2nnn[n-]2)cc1 ZINC000820550100 599222449 /nfs/dbraw/zinc/22/24/49/599222449.db2.gz UPNNKGIKBRQEDX-JTQLQIEISA-N -1 3 368.388 3.620 20 0 FHADHM C[C@H](SCc1nccn1CC(F)(F)F)c1ccc(-c2nn[n-]n2)cc1 ZINC000820550100 599222450 /nfs/dbraw/zinc/22/24/50/599222450.db2.gz UPNNKGIKBRQEDX-JTQLQIEISA-N -1 3 368.388 3.620 20 0 FHADHM C[C@@H]1C[C@H]1[C@H](NC(=O)c1cccc(-c2nnn[n-]2)c1)c1ccc(Cl)cc1 ZINC000736231693 599225461 /nfs/dbraw/zinc/22/54/61/599225461.db2.gz CCTHAMJFLBLPSV-SSKCKEOISA-N -1 3 367.840 3.647 20 0 FHADHM C[C@@H]1C[C@H]1[C@H](NC(=O)c1cccc(-c2nn[n-]n2)c1)c1ccc(Cl)cc1 ZINC000736231693 599225462 /nfs/dbraw/zinc/22/54/62/599225462.db2.gz CCTHAMJFLBLPSV-SSKCKEOISA-N -1 3 367.840 3.647 20 0 FHADHM C[C@@H]1C[C@H]1[C@@H](NC(=O)c1sccc1-c1nnn[n-]1)c1ccc(Cl)cc1 ZINC000736233676 599226340 /nfs/dbraw/zinc/22/63/40/599226340.db2.gz GJIRQBGKTVUXJE-FZQKWOKYSA-N -1 3 373.869 3.709 20 0 FHADHM C[C@@H]1C[C@H]1[C@@H](NC(=O)c1sccc1-c1nn[n-]n1)c1ccc(Cl)cc1 ZINC000736233676 599226342 /nfs/dbraw/zinc/22/63/42/599226342.db2.gz GJIRQBGKTVUXJE-FZQKWOKYSA-N -1 3 373.869 3.709 20 0 FHADHM CC[C@@H]1CCCN(c2c(-c3nnn[n-]3)cnc3c(F)cc(F)cc32)CC1 ZINC000736403352 599230545 /nfs/dbraw/zinc/23/05/45/599230545.db2.gz UOBPLXZTAMVFER-LLVKDONJSA-N -1 3 358.396 3.710 20 0 FHADHM CC[C@@H]1CCCN(c2c(-c3nn[n-]n3)cnc3c(F)cc(F)cc32)CC1 ZINC000736403352 599230548 /nfs/dbraw/zinc/23/05/48/599230548.db2.gz UOBPLXZTAMVFER-LLVKDONJSA-N -1 3 358.396 3.710 20 0 FHADHM C[C@H](CCSc1ccccc1)OC(=O)Cc1cccc(-c2nnn[n-]2)c1 ZINC000820248484 607261997 /nfs/dbraw/zinc/26/19/97/607261997.db2.gz ILUDMAKXMFUVSR-CQSZACIVSA-N -1 3 368.462 3.523 20 0 FHADHM C[C@H](CCSc1ccccc1)OC(=O)Cc1cccc(-c2nn[n-]n2)c1 ZINC000820248484 607261998 /nfs/dbraw/zinc/26/19/98/607261998.db2.gz ILUDMAKXMFUVSR-CQSZACIVSA-N -1 3 368.462 3.523 20 0 FHADHM CC(C)n1ncc2cc(Nc3ncc(-c4nnn[n-]4)cc3Cl)ccc21 ZINC000735963517 599232554 /nfs/dbraw/zinc/23/25/54/599232554.db2.gz GHPBWZUJUPSQTC-UHFFFAOYSA-N -1 3 354.805 3.589 20 0 FHADHM CC(C)n1ncc2cc(Nc3ncc(-c4nn[n-]n4)cc3Cl)ccc21 ZINC000735963517 599232555 /nfs/dbraw/zinc/23/25/55/599232555.db2.gz GHPBWZUJUPSQTC-UHFFFAOYSA-N -1 3 354.805 3.589 20 0 FHADHM O=C(Nc1nc(C=Cc2ccccc2)cs1)c1ccc(-c2nnn[n-]2)cc1 ZINC000738211473 599228107 /nfs/dbraw/zinc/22/81/07/599228107.db2.gz NRGCQYXHZDGIKP-IZZDOVSWSA-N -1 3 374.429 3.746 20 0 FHADHM O=C(Nc1nc(C=Cc2ccccc2)cs1)c1ccc(-c2nn[n-]n2)cc1 ZINC000738211473 599228108 /nfs/dbraw/zinc/22/81/08/599228108.db2.gz NRGCQYXHZDGIKP-IZZDOVSWSA-N -1 3 374.429 3.746 20 0 FHADHM Cc1cc(C)cc(NC(=S)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000822196843 599239219 /nfs/dbraw/zinc/23/92/19/599239219.db2.gz YJHPXXFOWNGZPV-ZDUSSCGKSA-N -1 3 352.467 3.531 20 0 FHADHM Cc1cc(C)cc(NC(=S)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000822196843 599239222 /nfs/dbraw/zinc/23/92/22/599239222.db2.gz YJHPXXFOWNGZPV-ZDUSSCGKSA-N -1 3 352.467 3.531 20 0 FHADHM Cc1cccc(NC(=S)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1C ZINC000822323360 599239309 /nfs/dbraw/zinc/23/93/09/599239309.db2.gz FSGZBFSJYHZAQM-CYBMUJFWSA-N -1 3 352.467 3.531 20 0 FHADHM Cc1cccc(NC(=S)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1C ZINC000822323360 599239312 /nfs/dbraw/zinc/23/93/12/599239312.db2.gz FSGZBFSJYHZAQM-CYBMUJFWSA-N -1 3 352.467 3.531 20 0 FHADHM CC(C)c1ccc(NC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000820192363 599240419 /nfs/dbraw/zinc/24/04/19/599240419.db2.gz LDTOZSTVANZZAZ-CYBMUJFWSA-N -1 3 350.426 3.873 20 0 FHADHM CC(C)c1ccc(NC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000820192363 599240421 /nfs/dbraw/zinc/24/04/21/599240421.db2.gz LDTOZSTVANZZAZ-CYBMUJFWSA-N -1 3 350.426 3.873 20 0 FHADHM Cc1c(NC(=O)c2ccc(SC(C)C)cc2)cccc1-c1nnn[n-]1 ZINC000822109682 607268975 /nfs/dbraw/zinc/26/89/75/607268975.db2.gz UGEUIDAMZOJXIR-UHFFFAOYSA-N -1 3 353.451 3.928 20 0 FHADHM Cc1c(NC(=O)c2ccc(SC(C)C)cc2)cccc1-c1nn[n-]n1 ZINC000822109682 607268976 /nfs/dbraw/zinc/26/89/76/607268976.db2.gz UGEUIDAMZOJXIR-UHFFFAOYSA-N -1 3 353.451 3.928 20 0 FHADHM Cc1cc(O[C@@H](C)C(=O)Nc2cccc(-c3nnn[n-]3)c2C)ccc1Cl ZINC000822210974 607269260 /nfs/dbraw/zinc/26/92/60/607269260.db2.gz ZEFVOUVUTDWTHO-LBPRGKRZSA-N -1 3 371.828 3.543 20 0 FHADHM Cc1cc(O[C@@H](C)C(=O)Nc2cccc(-c3nn[n-]n3)c2C)ccc1Cl ZINC000822210974 607269261 /nfs/dbraw/zinc/26/92/61/607269261.db2.gz ZEFVOUVUTDWTHO-LBPRGKRZSA-N -1 3 371.828 3.543 20 0 FHADHM CC(C)(Cc1ccccc1)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000735671333 599246449 /nfs/dbraw/zinc/24/64/49/599246449.db2.gz UOOLJQHJDUOLRL-UHFFFAOYSA-N -1 3 355.829 3.728 20 0 FHADHM CC(C)(Cc1ccccc1)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000735671333 599246451 /nfs/dbraw/zinc/24/64/51/599246451.db2.gz UOOLJQHJDUOLRL-UHFFFAOYSA-N -1 3 355.829 3.728 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)/C=C\C1CCCCC1 ZINC000735873591 599247981 /nfs/dbraw/zinc/24/79/81/599247981.db2.gz CRECZUWMNZAHBO-RAXLEYEMSA-N -1 3 353.470 3.740 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)/C=C\C1CCCCC1 ZINC000735873591 599247983 /nfs/dbraw/zinc/24/79/83/599247983.db2.gz CRECZUWMNZAHBO-RAXLEYEMSA-N -1 3 353.470 3.740 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cc3cc(F)ccc3o2)c1-c1nnn[n-]1 ZINC000736674385 599248722 /nfs/dbraw/zinc/24/87/22/599248722.db2.gz CCZHAWXFDBICFB-UHFFFAOYSA-N -1 3 371.397 3.937 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cc3cc(F)ccc3o2)c1-c1nn[n-]n1 ZINC000736674385 599248724 /nfs/dbraw/zinc/24/87/24/599248724.db2.gz CCZHAWXFDBICFB-UHFFFAOYSA-N -1 3 371.397 3.937 20 0 FHADHM C[C@@H](NC(=O)Nc1nc(C(C)(C)C)cs1)c1cccc(-c2nnn[n-]2)c1 ZINC000820380279 599249250 /nfs/dbraw/zinc/24/92/50/599249250.db2.gz PCPQQWCIVAGBHT-SNVBAGLBSA-N -1 3 371.470 3.503 20 0 FHADHM C[C@@H](NC(=O)Nc1nc(C(C)(C)C)cs1)c1cccc(-c2nn[n-]n2)c1 ZINC000820380279 599249255 /nfs/dbraw/zinc/24/92/55/599249255.db2.gz PCPQQWCIVAGBHT-SNVBAGLBSA-N -1 3 371.470 3.503 20 0 FHADHM CCN(C(=O)c1scnc1C1CC1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825390434 608345840 /nfs/dbraw/zinc/34/58/40/608345840.db2.gz DUUSVGBEOMQNAG-UHFFFAOYSA-N -1 3 374.857 3.521 20 0 FHADHM CCN(C(=O)c1scnc1C1CC1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825390434 608345842 /nfs/dbraw/zinc/34/58/42/608345842.db2.gz DUUSVGBEOMQNAG-UHFFFAOYSA-N -1 3 374.857 3.521 20 0 FHADHM CC[C@H](Cc1ccccc1)N(C)C(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000820915305 607289805 /nfs/dbraw/zinc/28/98/05/607289805.db2.gz VBYWJZAJAARTMQ-MRXNPFEDSA-N -1 3 364.453 3.660 20 0 FHADHM CC[C@H](Cc1ccccc1)N(C)C(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000820915305 607289806 /nfs/dbraw/zinc/28/98/06/607289806.db2.gz VBYWJZAJAARTMQ-MRXNPFEDSA-N -1 3 364.453 3.660 20 0 FHADHM Cc1cccc([C@H]2CCCCCN2C(=O)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000737391095 599262290 /nfs/dbraw/zinc/26/22/90/599262290.db2.gz XVDPTAIPCMDNLP-LJQANCHMSA-N -1 3 361.449 3.933 20 0 FHADHM Cc1cccc([C@H]2CCCCCN2C(=O)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000737391095 599262292 /nfs/dbraw/zinc/26/22/92/599262292.db2.gz XVDPTAIPCMDNLP-LJQANCHMSA-N -1 3 361.449 3.933 20 0 FHADHM Cc1c(NC(=O)N(CC2CCCCC2)C2CC2)cccc1-c1nnn[n-]1 ZINC000822075792 607292010 /nfs/dbraw/zinc/29/20/10/607292010.db2.gz IVICNOQRKROYRD-UHFFFAOYSA-N -1 3 354.458 3.752 20 0 FHADHM Cc1c(NC(=O)N(CC2CCCCC2)C2CC2)cccc1-c1nn[n-]n1 ZINC000822075792 607292011 /nfs/dbraw/zinc/29/20/11/607292011.db2.gz IVICNOQRKROYRD-UHFFFAOYSA-N -1 3 354.458 3.752 20 0 FHADHM Cc1c(NC(=O)C(C)(C)Oc2cccc(Cl)c2)cccc1-c1nnn[n-]1 ZINC000822061426 607295029 /nfs/dbraw/zinc/29/50/29/607295029.db2.gz NOZLYHYUCCPRJQ-UHFFFAOYSA-N -1 3 371.828 3.625 20 0 FHADHM Cc1c(NC(=O)C(C)(C)Oc2cccc(Cl)c2)cccc1-c1nn[n-]n1 ZINC000822061426 607295030 /nfs/dbraw/zinc/29/50/30/607295030.db2.gz NOZLYHYUCCPRJQ-UHFFFAOYSA-N -1 3 371.828 3.625 20 0 FHADHM CCC(CC)(CC)NC(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(C)C ZINC000820887367 599263223 /nfs/dbraw/zinc/26/32/23/599263223.db2.gz AVNJEZGDQIDQRC-UHFFFAOYSA-N -1 3 360.462 3.744 20 0 FHADHM CCC(CC)(CC)NC(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(C)C ZINC000820887367 599263231 /nfs/dbraw/zinc/26/32/31/599263231.db2.gz AVNJEZGDQIDQRC-UHFFFAOYSA-N -1 3 360.462 3.744 20 0 FHADHM Cc1nc(-c2cccc(NCc3ccc(-c4nnn[n-]4)s3)c2)cs1 ZINC000822418639 607309373 /nfs/dbraw/zinc/30/93/73/607309373.db2.gz BAIBIIXDTQLEJK-UHFFFAOYSA-N -1 3 354.464 3.972 20 0 FHADHM c1sc(CNc2ccc3c(c2)OC2(CCCCC2)O3)cc1-c1nnn[n-]1 ZINC000823767930 607311249 /nfs/dbraw/zinc/31/12/49/607311249.db2.gz ZZOGWGWTSDGGQS-UHFFFAOYSA-N -1 3 369.450 3.972 20 0 FHADHM c1sc(CNc2ccc3c(c2)OC2(CCCCC2)O3)cc1-c1nn[n-]n1 ZINC000823767930 607311250 /nfs/dbraw/zinc/31/12/50/607311250.db2.gz ZZOGWGWTSDGGQS-UHFFFAOYSA-N -1 3 369.450 3.972 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccn(C(CC)CC)n2)c1-c1nnn[n-]1 ZINC000821465804 607314064 /nfs/dbraw/zinc/31/40/64/607314064.db2.gz QBAIJLCTSAKQSI-UHFFFAOYSA-N -1 3 373.486 3.609 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccn(C(CC)CC)n2)c1-c1nn[n-]n1 ZINC000821465804 607314065 /nfs/dbraw/zinc/31/40/65/607314065.db2.gz QBAIJLCTSAKQSI-UHFFFAOYSA-N -1 3 373.486 3.609 20 0 FHADHM Cc1csc(-c2ccc(NCc3ccc(-c4nnn[n-]4)s3)cc2)n1 ZINC000822408693 607315191 /nfs/dbraw/zinc/31/51/91/607315191.db2.gz GUDWYUGYEXIWGA-UHFFFAOYSA-N -1 3 354.464 3.972 20 0 FHADHM O[C@H]1CCCC[C@@H]1CCCNc1ccc(C(F)(F)F)cc1-c1nnn[n-]1 ZINC000823704549 607306343 /nfs/dbraw/zinc/30/63/43/607306343.db2.gz CBUZXMVSDNPKEE-ABAIWWIYSA-N -1 3 369.391 3.629 20 0 FHADHM O[C@H]1CCCC[C@@H]1CCCNc1ccc(C(F)(F)F)cc1-c1nn[n-]n1 ZINC000823704549 607306344 /nfs/dbraw/zinc/30/63/44/607306344.db2.gz CBUZXMVSDNPKEE-ABAIWWIYSA-N -1 3 369.391 3.629 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N[C@H]2CSc3ccccc32)n1 ZINC000737632879 599269372 /nfs/dbraw/zinc/26/93/72/599269372.db2.gz OEDKZWUPKGOYSQ-JTQLQIEISA-N -1 3 364.356 3.539 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N[C@H]2CSc3ccccc32)n1 ZINC000737632879 599269374 /nfs/dbraw/zinc/26/93/74/599269374.db2.gz OEDKZWUPKGOYSQ-JTQLQIEISA-N -1 3 364.356 3.539 20 0 FHADHM CCCCN1CCc2ccc(NCc3cc(-c4nnn[n-]4)cs3)cc21 ZINC000821066917 607317962 /nfs/dbraw/zinc/31/79/62/607317962.db2.gz YHULRVHPINQVBG-UHFFFAOYSA-N -1 3 354.483 3.703 20 0 FHADHM CCCCN1CCc2ccc(NCc3cc(-c4nn[n-]n4)cs3)cc21 ZINC000821066917 607317963 /nfs/dbraw/zinc/31/79/63/607317963.db2.gz YHULRVHPINQVBG-UHFFFAOYSA-N -1 3 354.483 3.703 20 0 FHADHM CC(C)C[C@H](C)N(C)C(=O)CSc1ccc(-c2nn[n-]n2)cc1Cl ZINC000824228612 607843741 /nfs/dbraw/zinc/84/37/41/607843741.db2.gz KBFNWBWKJXFRET-NSHDSACASA-N -1 3 367.906 3.505 20 0 FHADHM CC(C)C[C@H](C)N(C)C(=O)CSc1ccc(-c2nnn[n-]2)cc1Cl ZINC000824228612 607843740 /nfs/dbraw/zinc/84/37/40/607843740.db2.gz KBFNWBWKJXFRET-NSHDSACASA-N -1 3 367.906 3.505 20 0 FHADHM C[C@H]1CCCN(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)CC1 ZINC000820709481 599289384 /nfs/dbraw/zinc/28/93/84/599289384.db2.gz JLNWVRMMTYOQHZ-JTQLQIEISA-N -1 3 368.363 3.539 20 0 FHADHM C[C@H]1CCCN(C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)CC1 ZINC000820709481 599289386 /nfs/dbraw/zinc/28/93/86/599289386.db2.gz JLNWVRMMTYOQHZ-JTQLQIEISA-N -1 3 368.363 3.539 20 0 FHADHM C[C@H]1CC[C@H](NC(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)CC1 ZINC000822004103 599290381 /nfs/dbraw/zinc/29/03/81/599290381.db2.gz AENOIMBRRNLSPB-MGCOHNPYSA-N -1 3 368.363 3.586 20 0 FHADHM C[C@H]1CC[C@H](NC(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)CC1 ZINC000822004103 599290383 /nfs/dbraw/zinc/29/03/83/599290383.db2.gz AENOIMBRRNLSPB-MGCOHNPYSA-N -1 3 368.363 3.586 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)C1CCCC1 ZINC000820372868 599291103 /nfs/dbraw/zinc/29/11/03/599291103.db2.gz CPWXSQCCRIUITG-SECBINFHSA-N -1 3 368.363 3.586 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)C1CCCC1 ZINC000820372868 599291105 /nfs/dbraw/zinc/29/11/05/599291105.db2.gz CPWXSQCCRIUITG-SECBINFHSA-N -1 3 368.363 3.586 20 0 FHADHM Cc1cn(Cc2csc(Cc3ccc(Cl)cc3)n2)cc1-c1nnn[n-]1 ZINC000822389527 607329810 /nfs/dbraw/zinc/32/98/10/607329810.db2.gz ZOFJJNSLTLKPHX-UHFFFAOYSA-N -1 3 370.869 3.726 20 0 FHADHM Cc1cn(Cc2csc(Cc3ccc(Cl)cc3)n2)cc1-c1nn[n-]n1 ZINC000822389527 607329811 /nfs/dbraw/zinc/32/98/11/607329811.db2.gz ZOFJJNSLTLKPHX-UHFFFAOYSA-N -1 3 370.869 3.726 20 0 FHADHM CC[C@@H](C)C(=O)Nc1cccc(CNc2ccc(-c3nn[n-]n3)cc2F)c1 ZINC000736320300 598239426 /nfs/dbraw/zinc/23/94/26/598239426.db2.gz SPKDYUOUGYMBCJ-GFCCVEGCSA-N -1 3 368.416 3.603 20 0 FHADHM Cc1cc(Sc2ccc(O)cc2)n2c3ccccc3nc2c1-c1nnn[n-]1 ZINC000737282607 598239596 /nfs/dbraw/zinc/23/95/96/598239596.db2.gz GXKPOYIKOHZAEO-UHFFFAOYSA-N -1 3 374.429 3.833 20 0 FHADHM Cc1cc(Sc2ccc(O)cc2)n2c3ccccc3nc2c1-c1nn[n-]n1 ZINC000737282607 598239598 /nfs/dbraw/zinc/23/95/98/598239598.db2.gz GXKPOYIKOHZAEO-UHFFFAOYSA-N -1 3 374.429 3.833 20 0 FHADHM CCc1cnc(CCNc2ccc(C(F)(F)F)c(-c3nnn[n-]3)c2)s1 ZINC000821497710 607348146 /nfs/dbraw/zinc/34/81/46/607348146.db2.gz XRHOJQLBXMTJFL-UHFFFAOYSA-N -1 3 368.388 3.559 20 0 FHADHM CCc1cnc(CCNc2ccc(C(F)(F)F)c(-c3nn[n-]n3)c2)s1 ZINC000821497710 607348148 /nfs/dbraw/zinc/34/81/48/607348148.db2.gz XRHOJQLBXMTJFL-UHFFFAOYSA-N -1 3 368.388 3.559 20 0 FHADHM C[C@@H]1CCC[C@@H]1NC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736263794 598242416 /nfs/dbraw/zinc/24/24/16/598242416.db2.gz SKRLKKYPSPZIPP-ACJLOTCBSA-N -1 3 363.421 3.577 20 0 FHADHM C[C@@H]1CCC[C@@H]1NC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736263794 598242417 /nfs/dbraw/zinc/24/24/17/598242417.db2.gz SKRLKKYPSPZIPP-ACJLOTCBSA-N -1 3 363.421 3.577 20 0 FHADHM C[C@@H]1CCC[C@H]1NC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736263795 598242665 /nfs/dbraw/zinc/24/26/65/598242665.db2.gz SKRLKKYPSPZIPP-FZKQIMNGSA-N -1 3 363.421 3.577 20 0 FHADHM C[C@@H]1CCC[C@H]1NC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736263795 598242666 /nfs/dbraw/zinc/24/26/66/598242666.db2.gz SKRLKKYPSPZIPP-FZKQIMNGSA-N -1 3 363.421 3.577 20 0 FHADHM CN(CCCc1cc(-c2ccccc2)no1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736797865 598247031 /nfs/dbraw/zinc/24/70/31/598247031.db2.gz NMXDTXBJVSYAJG-UHFFFAOYSA-N -1 3 360.421 3.591 20 0 FHADHM Cc1ccc(-c2nc(CCNc3cccc(F)c3-c3nnn[n-]3)co2)cc1 ZINC000737287083 598248659 /nfs/dbraw/zinc/24/86/59/598248659.db2.gz CHRFFRIELIGCSZ-UHFFFAOYSA-N -1 3 364.384 3.624 20 0 FHADHM Cc1ccc(-c2nc(CCNc3cccc(F)c3-c3nn[n-]n3)co2)cc1 ZINC000737287083 598248660 /nfs/dbraw/zinc/24/86/60/598248660.db2.gz CHRFFRIELIGCSZ-UHFFFAOYSA-N -1 3 364.384 3.624 20 0 FHADHM Cc1cccc2c1CC[C@H]2NC(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000737407597 598264323 /nfs/dbraw/zinc/26/43/23/598264323.db2.gz DARNGRJGDLFSBV-MRXNPFEDSA-N -1 3 368.828 3.638 20 0 FHADHM Cc1cccc2c1CC[C@H]2NC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000737407597 598264325 /nfs/dbraw/zinc/26/43/25/598264325.db2.gz DARNGRJGDLFSBV-MRXNPFEDSA-N -1 3 368.828 3.638 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N[C@H](c1ccco1)c1ccccc1 ZINC000737292156 598265721 /nfs/dbraw/zinc/26/57/21/598265721.db2.gz SMRGVWYNDAKVAL-SFHVURJKSA-N -1 3 374.404 3.679 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N[C@H](c1ccco1)c1ccccc1 ZINC000737292156 598265722 /nfs/dbraw/zinc/26/57/22/598265722.db2.gz SMRGVWYNDAKVAL-SFHVURJKSA-N -1 3 374.404 3.679 20 0 FHADHM CC(C)(C)CNC(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000735619037 598266490 /nfs/dbraw/zinc/26/64/90/598266490.db2.gz RAISCRMSOHIFPI-UHFFFAOYSA-N -1 3 366.425 3.827 20 0 FHADHM CC(C)(C)CNC(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735619037 598266491 /nfs/dbraw/zinc/26/64/91/598266491.db2.gz RAISCRMSOHIFPI-UHFFFAOYSA-N -1 3 366.425 3.827 20 0 FHADHM CC[C@@H](C)NC(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736324816 598267419 /nfs/dbraw/zinc/26/74/19/598267419.db2.gz ILNUUFNMHPVOMV-GFCCVEGCSA-N -1 3 352.398 3.579 20 0 FHADHM CC[C@@H](C)NC(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736324816 598267420 /nfs/dbraw/zinc/26/74/20/598267420.db2.gz ILNUUFNMHPVOMV-GFCCVEGCSA-N -1 3 352.398 3.579 20 0 FHADHM C[C@H](CCc1ccco1)Nc1ccc(-c2nn[n-]n2)cc1C(F)(F)F ZINC000735992800 598274897 /nfs/dbraw/zinc/27/48/97/598274897.db2.gz NEJVERWQPSGOLC-SNVBAGLBSA-N -1 3 351.332 3.912 20 0 FHADHM FC(F)(F)c1cc(-c2nn[n-]n2)ccc1N1CCc2sccc2C1 ZINC000737625646 598276060 /nfs/dbraw/zinc/27/60/60/598276060.db2.gz CWNLCEZSHUDBQG-UHFFFAOYSA-N -1 3 351.357 3.510 20 0 FHADHM CCN(C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C)C1CCCCC1 ZINC000736506442 598280071 /nfs/dbraw/zinc/28/00/71/598280071.db2.gz YJHJDTGITNALFG-UHFFFAOYSA-N -1 3 359.478 3.610 20 0 FHADHM CCN(C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C)C1CCCCC1 ZINC000736506442 598280073 /nfs/dbraw/zinc/28/00/73/598280073.db2.gz YJHJDTGITNALFG-UHFFFAOYSA-N -1 3 359.478 3.610 20 0 FHADHM CCCOc1ccccc1NCCCOc1ccc(-c2nn[n-]n2)cc1 ZINC000736492289 598282640 /nfs/dbraw/zinc/28/26/40/598282640.db2.gz IMEPNRBYVJFXFM-UHFFFAOYSA-N -1 3 353.426 3.537 20 0 FHADHM CC(C)(C)OCc1cccc(CNc2cccc(F)c2-c2nnn[n-]2)c1 ZINC000735640005 598298297 /nfs/dbraw/zinc/29/82/97/598298297.db2.gz UKMDFZWQZZTTCI-UHFFFAOYSA-N -1 3 355.417 3.933 20 0 FHADHM CC(C)(C)OCc1cccc(CNc2cccc(F)c2-c2nn[n-]n2)c1 ZINC000735640005 598298299 /nfs/dbraw/zinc/29/82/99/598298299.db2.gz UKMDFZWQZZTTCI-UHFFFAOYSA-N -1 3 355.417 3.933 20 0 FHADHM CN(C(=O)c1cc2c(s1)CCCCC2)c1ccc(-c2nnn[n-]2)cc1F ZINC000736750488 598310169 /nfs/dbraw/zinc/31/01/69/598310169.db2.gz ZAONPOJXOSSTRV-UHFFFAOYSA-N -1 3 371.441 3.613 20 0 FHADHM CN(C(=O)c1cc2c(s1)CCCCC2)c1ccc(-c2nn[n-]n2)cc1F ZINC000736750488 598310172 /nfs/dbraw/zinc/31/01/72/598310172.db2.gz ZAONPOJXOSSTRV-UHFFFAOYSA-N -1 3 371.441 3.613 20 0 FHADHM CN(C(=O)c1ccc(-c2ccccc2)cc1)c1ccc(-c2nnn[n-]2)cc1F ZINC000736748865 598311842 /nfs/dbraw/zinc/31/18/42/598311842.db2.gz LPWLKYMPMIWFHS-UHFFFAOYSA-N -1 3 373.391 3.949 20 0 FHADHM CN(C(=O)c1ccc(-c2ccccc2)cc1)c1ccc(-c2nn[n-]n2)cc1F ZINC000736748865 598311843 /nfs/dbraw/zinc/31/18/43/598311843.db2.gz LPWLKYMPMIWFHS-UHFFFAOYSA-N -1 3 373.391 3.949 20 0 FHADHM C[C@H]1CN(C(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c2ccccc21 ZINC000736288366 598320362 /nfs/dbraw/zinc/32/03/62/598320362.db2.gz AZYYEVOCKMWDLV-JTQLQIEISA-N -1 3 370.869 3.841 20 0 FHADHM C[C@H]1CN(C(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c2ccccc21 ZINC000736288366 598320364 /nfs/dbraw/zinc/32/03/64/598320364.db2.gz AZYYEVOCKMWDLV-JTQLQIEISA-N -1 3 370.869 3.841 20 0 FHADHM COc1cc(C)ccc1NC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000737041490 598322583 /nfs/dbraw/zinc/32/25/83/598322583.db2.gz VAPAAVMXRCCABY-UHFFFAOYSA-N -1 3 374.857 3.646 20 0 FHADHM COc1cc(C)ccc1NC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000737041490 598322584 /nfs/dbraw/zinc/32/25/84/598322584.db2.gz VAPAAVMXRCCABY-UHFFFAOYSA-N -1 3 374.857 3.646 20 0 FHADHM CC[C@@H](NC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccccc1 ZINC000736370060 598323997 /nfs/dbraw/zinc/32/39/97/598323997.db2.gz KQAGFPJYUIVCHT-OAHLLOKOSA-N -1 3 372.885 3.958 20 0 FHADHM CC[C@@H](NC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccccc1 ZINC000736370060 598323999 /nfs/dbraw/zinc/32/39/99/598323999.db2.gz KQAGFPJYUIVCHT-OAHLLOKOSA-N -1 3 372.885 3.958 20 0 FHADHM Cc1cccc(N(C(=S)Nc2ccccc2-c2nnn[n-]2)C(C)C)c1 ZINC000737396996 598324324 /nfs/dbraw/zinc/32/43/24/598324324.db2.gz PUOQTASACVBKLF-UHFFFAOYSA-N -1 3 352.467 3.787 20 0 FHADHM Cc1cccc(N(C(=S)Nc2ccccc2-c2nn[n-]n2)C(C)C)c1 ZINC000737396996 598324325 /nfs/dbraw/zinc/32/43/25/598324325.db2.gz PUOQTASACVBKLF-UHFFFAOYSA-N -1 3 352.467 3.787 20 0 FHADHM CC(C)CCN(C(=O)NCc1ccc(-c2nnn[n-]2)cc1F)C1CCCC1 ZINC000735798110 598327727 /nfs/dbraw/zinc/32/77/27/598327727.db2.gz VBSBLBDJIZNQBI-UHFFFAOYSA-N -1 3 374.464 3.506 20 0 FHADHM CC(C)CCN(C(=O)NCc1ccc(-c2nn[n-]n2)cc1F)C1CCCC1 ZINC000735798110 598327730 /nfs/dbraw/zinc/32/77/30/598327730.db2.gz VBSBLBDJIZNQBI-UHFFFAOYSA-N -1 3 374.464 3.506 20 0 FHADHM CC[C@@H](Oc1ccccc1C(C)C)C(=O)Nc1ccccc1-c1nnn[n-]1 ZINC000736392886 598358589 /nfs/dbraw/zinc/35/85/89/598358589.db2.gz UGAIZARJLAOHIQ-QGZVFWFLSA-N -1 3 365.437 3.786 20 0 FHADHM CC[C@@H](Oc1ccccc1C(C)C)C(=O)Nc1ccccc1-c1nn[n-]n1 ZINC000736392886 598358590 /nfs/dbraw/zinc/35/85/90/598358590.db2.gz UGAIZARJLAOHIQ-QGZVFWFLSA-N -1 3 365.437 3.786 20 0 FHADHM Cc1cccc(Oc2ccccc2CNc2ncccc2-c2nnn[n-]2)c1 ZINC000737410302 598386330 /nfs/dbraw/zinc/38/63/30/598386330.db2.gz GZXHOUBOYYGQRT-UHFFFAOYSA-N -1 3 358.405 3.975 20 0 FHADHM Cc1cccc(Oc2ccccc2CNc2ncccc2-c2nn[n-]n2)c1 ZINC000737410302 598386332 /nfs/dbraw/zinc/38/63/32/598386332.db2.gz GZXHOUBOYYGQRT-UHFFFAOYSA-N -1 3 358.405 3.975 20 0 FHADHM Clc1ccc(SCCNc2ncc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000737573547 598387051 /nfs/dbraw/zinc/38/70/51/598387051.db2.gz MGGNOAQPWDYYSL-UHFFFAOYSA-N -1 3 367.265 3.773 20 0 FHADHM Clc1ccc(SCCNc2ncc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000737573547 598387053 /nfs/dbraw/zinc/38/70/53/598387053.db2.gz MGGNOAQPWDYYSL-UHFFFAOYSA-N -1 3 367.265 3.773 20 0 FHADHM Cc1ccc(C)c(CS[C@@H](C)C(=O)Nc2ccccc2-c2nnn[n-]2)c1 ZINC000737323208 598393303 /nfs/dbraw/zinc/39/33/03/598393303.db2.gz QJPRTNLWTYVHHT-AWEZNQCLSA-N -1 3 367.478 3.744 20 0 FHADHM Cc1ccc(C)c(CS[C@@H](C)C(=O)Nc2ccccc2-c2nn[n-]n2)c1 ZINC000737323208 598393305 /nfs/dbraw/zinc/39/33/05/598393305.db2.gz QJPRTNLWTYVHHT-AWEZNQCLSA-N -1 3 367.478 3.744 20 0 FHADHM Cc1ccc(-c2nc(COc3ccc(-c4nn[n-]n4)cc3C)cs2)o1 ZINC000737287703 598395211 /nfs/dbraw/zinc/39/52/11/598395211.db2.gz IKDWLWSPDBHRFE-UHFFFAOYSA-N -1 3 353.407 3.779 20 0 FHADHM Cc1cccc(C(C)C)c1NC(=O)COc1ccc(-c2nn[n-]n2)cc1C ZINC000737222139 598395713 /nfs/dbraw/zinc/39/57/13/598395713.db2.gz SRORXXOWKNSORM-UHFFFAOYSA-N -1 3 365.437 3.624 20 0 FHADHM Cc1cc(C)cc([C@H](C)NC(=S)Nc2ccccc2-c2nnn[n-]2)c1 ZINC000737253747 598418263 /nfs/dbraw/zinc/41/82/63/598418263.db2.gz SKIMNFZSODJDJD-ZDUSSCGKSA-N -1 3 352.467 3.531 20 0 FHADHM Cc1cc(C)cc([C@H](C)NC(=S)Nc2ccccc2-c2nn[n-]n2)c1 ZINC000737253747 598418264 /nfs/dbraw/zinc/41/82/64/598418264.db2.gz SKIMNFZSODJDJD-ZDUSSCGKSA-N -1 3 352.467 3.531 20 0 FHADHM COc1ccc(-c2nc(CNc3cccc(-c4nnn[n-]4)c3)cs2)cc1 ZINC000737058438 598419733 /nfs/dbraw/zinc/41/97/33/598419733.db2.gz XTENABLRDLSDQW-UHFFFAOYSA-N -1 3 364.434 3.611 20 0 FHADHM COc1ccc(-c2nc(CNc3cccc(-c4nn[n-]n4)c3)cs2)cc1 ZINC000737058438 598419735 /nfs/dbraw/zinc/41/97/35/598419735.db2.gz XTENABLRDLSDQW-UHFFFAOYSA-N -1 3 364.434 3.611 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NC(=O)N[C@@H](C)c1ccccc1 ZINC000735906764 598430905 /nfs/dbraw/zinc/43/09/05/598430905.db2.gz WHFTURCKHHBZJQ-ZDUSSCGKSA-N -1 3 366.425 3.537 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NC(=O)N[C@@H](C)c1ccccc1 ZINC000735906764 598430907 /nfs/dbraw/zinc/43/09/07/598430907.db2.gz WHFTURCKHHBZJQ-ZDUSSCGKSA-N -1 3 366.425 3.537 20 0 FHADHM Cc1cccc(Oc2ccccc2NC(=O)c2ccc(-c3nnn[n-]3)cn2)c1 ZINC000737411740 598437140 /nfs/dbraw/zinc/43/71/40/598437140.db2.gz OQKBRCQPDAAOGP-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1cccc(Oc2ccccc2NC(=O)c2ccc(-c3nn[n-]n3)cn2)c1 ZINC000737411740 598437142 /nfs/dbraw/zinc/43/71/42/598437142.db2.gz OQKBRCQPDAAOGP-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM CCS[C@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCC2)C(C)C ZINC000736664090 598441234 /nfs/dbraw/zinc/44/12/34/598441234.db2.gz IMWJUNMXKCIDGN-ZDUSSCGKSA-N -1 3 365.528 3.523 20 0 FHADHM CCS[C@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCC2)C(C)C ZINC000736664090 598441237 /nfs/dbraw/zinc/44/12/37/598441237.db2.gz IMWJUNMXKCIDGN-ZDUSSCGKSA-N -1 3 365.528 3.523 20 0 FHADHM O=C(Nc1ccccc1SC1CCCC1)c1ccc(-c2nnn[n-]2)cn1 ZINC000738192376 598444070 /nfs/dbraw/zinc/44/40/70/598444070.db2.gz ZSZCXNCNEHGIKH-UHFFFAOYSA-N -1 3 366.450 3.549 20 0 FHADHM O=C(Nc1ccccc1SC1CCCC1)c1ccc(-c2nn[n-]n2)cn1 ZINC000738192376 598444071 /nfs/dbraw/zinc/44/40/71/598444071.db2.gz ZSZCXNCNEHGIKH-UHFFFAOYSA-N -1 3 366.450 3.549 20 0 FHADHM CCN(C(=O)CSCc1ccc(-c2nnn[n-]2)cc1)[C@@H]1CCCC[C@@H]1C ZINC000736506196 598445509 /nfs/dbraw/zinc/44/55/09/598445509.db2.gz XQACSMNLKSZXBD-WMLDXEAASA-N -1 3 373.526 3.527 20 0 FHADHM CCN(C(=O)CSCc1ccc(-c2nn[n-]n2)cc1)[C@@H]1CCCC[C@@H]1C ZINC000736506196 598445511 /nfs/dbraw/zinc/44/55/11/598445511.db2.gz XQACSMNLKSZXBD-WMLDXEAASA-N -1 3 373.526 3.527 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)Nc1cccc(SC(F)F)c1 ZINC000737803691 598450747 /nfs/dbraw/zinc/45/07/47/598450747.db2.gz VPILFPPSEHOYIA-CMDGGOBGSA-N -1 3 373.388 3.833 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)Nc1cccc(SC(F)F)c1 ZINC000737803691 598450749 /nfs/dbraw/zinc/45/07/49/598450749.db2.gz VPILFPPSEHOYIA-CMDGGOBGSA-N -1 3 373.388 3.833 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1N1CCC[C@H](c2ccccc2)CC1 ZINC000737565648 598458855 /nfs/dbraw/zinc/45/88/55/598458855.db2.gz VKKBQKRTQOGEQQ-AWEZNQCLSA-N -1 3 354.845 3.689 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1N1CCC[C@H](c2ccccc2)CC1 ZINC000737565648 598458857 /nfs/dbraw/zinc/45/88/57/598458857.db2.gz VKKBQKRTQOGEQQ-AWEZNQCLSA-N -1 3 354.845 3.689 20 0 FHADHM Clc1ccc(-c2cnc(COc3cccc(-c4nnn[n-]4)c3)o2)cc1 ZINC000737563745 598465722 /nfs/dbraw/zinc/46/57/22/598465722.db2.gz FKWRPCOXLBUSMR-UHFFFAOYSA-N -1 3 353.769 3.754 20 0 FHADHM Clc1ccc(-c2cnc(COc3cccc(-c4nn[n-]n4)c3)o2)cc1 ZINC000737563745 598465724 /nfs/dbraw/zinc/46/57/24/598465724.db2.gz FKWRPCOXLBUSMR-UHFFFAOYSA-N -1 3 353.769 3.754 20 0 FHADHM C[C@@H](OC(=O)c1csc(C(C)(C)C)n1)c1cccc(-c2nnn[n-]2)c1 ZINC000736163083 598483054 /nfs/dbraw/zinc/48/30/54/598483054.db2.gz LWYXKQHLJVBEIP-SNVBAGLBSA-N -1 3 357.439 3.539 20 0 FHADHM C[C@@H](OC(=O)c1csc(C(C)(C)C)n1)c1cccc(-c2nn[n-]n2)c1 ZINC000736163083 598483056 /nfs/dbraw/zinc/48/30/56/598483056.db2.gz LWYXKQHLJVBEIP-SNVBAGLBSA-N -1 3 357.439 3.539 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccc(Cl)s1)c1cccc(-c2nnn[n-]2)c1 ZINC000736150077 598487287 /nfs/dbraw/zinc/48/72/87/598487287.db2.gz ILDPDEOJWJVMBK-BJPMOSCESA-N -1 3 360.826 3.899 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccc(Cl)s1)c1cccc(-c2nn[n-]n2)c1 ZINC000736150077 598487290 /nfs/dbraw/zinc/48/72/90/598487290.db2.gz ILDPDEOJWJVMBK-BJPMOSCESA-N -1 3 360.826 3.899 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)CCc1cccc(Cl)c1 ZINC000735661543 598488048 /nfs/dbraw/zinc/48/80/48/598488048.db2.gz UJJXDOQLJYLYJY-UHFFFAOYSA-N -1 3 372.860 3.648 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)CCc1cccc(Cl)c1 ZINC000735661543 598488049 /nfs/dbraw/zinc/48/80/49/598488049.db2.gz UJJXDOQLJYLYJY-UHFFFAOYSA-N -1 3 372.860 3.648 20 0 FHADHM C[C@@H](NC(=O)C[C@H]1CCCc2ccccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000736102030 598493021 /nfs/dbraw/zinc/49/30/21/598493021.db2.gz QBXRTIKZZNJDJP-RDTXWAMCSA-N -1 3 361.449 3.554 20 0 FHADHM C[C@@H](NC(=O)C[C@H]1CCCc2ccccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000736102030 598493022 /nfs/dbraw/zinc/49/30/22/598493022.db2.gz QBXRTIKZZNJDJP-RDTXWAMCSA-N -1 3 361.449 3.554 20 0 FHADHM C[C@H](NC(=O)C[C@H]1CCCc2ccccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000736102027 598493240 /nfs/dbraw/zinc/49/32/40/598493240.db2.gz QBXRTIKZZNJDJP-KBXCAEBGSA-N -1 3 361.449 3.554 20 0 FHADHM C[C@H](NC(=O)C[C@H]1CCCc2ccccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000736102027 598493241 /nfs/dbraw/zinc/49/32/41/598493241.db2.gz QBXRTIKZZNJDJP-KBXCAEBGSA-N -1 3 361.449 3.554 20 0 FHADHM Cc1ncccc1C(=O)Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000737503644 598493484 /nfs/dbraw/zinc/49/34/84/598493484.db2.gz WLWJFCJYWDHCOM-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ncccc1C(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000737503644 598493487 /nfs/dbraw/zinc/49/34/87/598493487.db2.gz WLWJFCJYWDHCOM-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM CCc1c(C)sc(NC(=O)C=Cc2ccccc2F)c1-c1nnn[n-]1 ZINC000736669361 598518547 /nfs/dbraw/zinc/51/85/47/598518547.db2.gz FUQYXLIRKDQGTM-HJWRWDBZSA-N -1 3 357.414 3.590 20 0 FHADHM CCc1c(C)sc(NC(=O)C=Cc2ccccc2F)c1-c1nn[n-]n1 ZINC000736669361 598518548 /nfs/dbraw/zinc/51/85/48/598518548.db2.gz FUQYXLIRKDQGTM-HJWRWDBZSA-N -1 3 357.414 3.590 20 0 FHADHM CCc1c(C)sc(NC(=O)CSc2ccccc2C)c1-c1nnn[n-]1 ZINC000736676273 598519205 /nfs/dbraw/zinc/51/92/05/598519205.db2.gz QFPGSSJQWLBZLT-UHFFFAOYSA-N -1 3 373.507 3.838 20 0 FHADHM CCc1c(C)sc(NC(=O)CSc2ccccc2C)c1-c1nn[n-]n1 ZINC000736676273 598519206 /nfs/dbraw/zinc/51/92/06/598519206.db2.gz QFPGSSJQWLBZLT-UHFFFAOYSA-N -1 3 373.507 3.838 20 0 FHADHM Clc1cc(Nc2ccc(-c3nnn[n-]3)cn2)ccc1N1CCCCC1 ZINC000737563762 598523642 /nfs/dbraw/zinc/52/36/42/598523642.db2.gz FRFAZWPZHYZSBH-UHFFFAOYSA-N -1 3 355.833 3.649 20 0 FHADHM Clc1cc(Nc2ccc(-c3nn[n-]n3)cn2)ccc1N1CCCCC1 ZINC000737563762 598523644 /nfs/dbraw/zinc/52/36/44/598523644.db2.gz FRFAZWPZHYZSBH-UHFFFAOYSA-N -1 3 355.833 3.649 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@H]1NC(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1 ZINC000735798550 598528260 /nfs/dbraw/zinc/52/82/60/598528260.db2.gz XPYPFMIKZIXGQF-FUHWJXTLSA-N -1 3 370.501 3.613 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@H]1NC(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1 ZINC000735798550 598528261 /nfs/dbraw/zinc/52/82/61/598528261.db2.gz XPYPFMIKZIXGQF-FUHWJXTLSA-N -1 3 370.501 3.613 20 0 FHADHM CC(C)CC[C@H]1CCC[C@H]1NC(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1 ZINC000735798553 598528662 /nfs/dbraw/zinc/52/86/62/598528662.db2.gz XPYPFMIKZIXGQF-SJLPKXTDSA-N -1 3 370.501 3.613 20 0 FHADHM CC(C)CC[C@H]1CCC[C@H]1NC(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1 ZINC000735798553 598528664 /nfs/dbraw/zinc/52/86/64/598528664.db2.gz XPYPFMIKZIXGQF-SJLPKXTDSA-N -1 3 370.501 3.613 20 0 FHADHM COc1ccc2cc([C@H](C)C(=O)Nc3ccc(-c4nnn[n-]4)cc3)ccc2c1 ZINC000130078538 598530578 /nfs/dbraw/zinc/53/05/78/598530578.db2.gz ONZKRRZLNIIZBZ-ZDUSSCGKSA-N -1 3 373.416 3.771 20 0 FHADHM COc1ccc2cc([C@H](C)C(=O)Nc3ccc(-c4nn[n-]n4)cc3)ccc2c1 ZINC000130078538 598530579 /nfs/dbraw/zinc/53/05/79/598530579.db2.gz ONZKRRZLNIIZBZ-ZDUSSCGKSA-N -1 3 373.416 3.771 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)[C@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000738161621 598533641 /nfs/dbraw/zinc/53/36/41/598533641.db2.gz HAHMFIROLGFFPE-SJORKVTESA-N -1 3 373.391 3.901 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)[C@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000738161621 598533643 /nfs/dbraw/zinc/53/36/43/598533643.db2.gz HAHMFIROLGFFPE-SJORKVTESA-N -1 3 373.391 3.901 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)[C@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000738161620 598533944 /nfs/dbraw/zinc/53/39/44/598533944.db2.gz HAHMFIROLGFFPE-IRXDYDNUSA-N -1 3 373.391 3.901 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)[C@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000738161620 598533945 /nfs/dbraw/zinc/53/39/45/598533945.db2.gz HAHMFIROLGFFPE-IRXDYDNUSA-N -1 3 373.391 3.901 20 0 FHADHM C/C=C\C(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)c(Cl)c1 ZINC000736301362 598541559 /nfs/dbraw/zinc/54/15/59/598541559.db2.gz AGIODGJNMLLLMI-RQOWECAXSA-N -1 3 369.812 3.614 20 0 FHADHM C/C=C\C(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)c(Cl)c1 ZINC000736301362 598541561 /nfs/dbraw/zinc/54/15/61/598541561.db2.gz AGIODGJNMLLLMI-RQOWECAXSA-N -1 3 369.812 3.614 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1cc(Cl)ccc1F ZINC000738151396 598550878 /nfs/dbraw/zinc/55/08/78/598550878.db2.gz HWHKHJOBQZOSAR-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1cc(Cl)ccc1F ZINC000738151396 598550880 /nfs/dbraw/zinc/55/08/80/598550880.db2.gz HWHKHJOBQZOSAR-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM CCN(CC)C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736530143 598563178 /nfs/dbraw/zinc/56/31/78/598563178.db2.gz YZFBXUGOPFPRRY-UHFFFAOYSA-N -1 3 352.398 3.533 20 0 FHADHM CCN(CC)C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736530143 598563180 /nfs/dbraw/zinc/56/31/80/598563180.db2.gz YZFBXUGOPFPRRY-UHFFFAOYSA-N -1 3 352.398 3.533 20 0 FHADHM CC(C)[C@@H](C)NC(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000735709134 598564761 /nfs/dbraw/zinc/56/47/61/598564761.db2.gz PNBOOBZYEGIJKI-CYBMUJFWSA-N -1 3 366.425 3.825 20 0 FHADHM CC(C)[C@@H](C)NC(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000735709134 598564762 /nfs/dbraw/zinc/56/47/62/598564762.db2.gz PNBOOBZYEGIJKI-CYBMUJFWSA-N -1 3 366.425 3.825 20 0 FHADHM CC[C@@H](C)NC(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736323961 598564972 /nfs/dbraw/zinc/56/49/72/598564972.db2.gz FVCXPZHFGZVOMF-GFCCVEGCSA-N -1 3 352.398 3.579 20 0 FHADHM CC[C@@H](C)NC(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736323961 598564973 /nfs/dbraw/zinc/56/49/73/598564973.db2.gz FVCXPZHFGZVOMF-GFCCVEGCSA-N -1 3 352.398 3.579 20 0 FHADHM C[C@H]1CCN(C(=O)Nc2ccc(Oc3cccc(-c4nnn[n-]4)c3)cc2)C1 ZINC000736276442 598565122 /nfs/dbraw/zinc/56/51/22/598565122.db2.gz HUJTVFVTJZXYAA-ZDUSSCGKSA-N -1 3 364.409 3.533 20 0 FHADHM C[C@H]1CCN(C(=O)Nc2ccc(Oc3cccc(-c4nn[n-]n4)c3)cc2)C1 ZINC000736276442 598565123 /nfs/dbraw/zinc/56/51/23/598565123.db2.gz HUJTVFVTJZXYAA-ZDUSSCGKSA-N -1 3 364.409 3.533 20 0 FHADHM CCCN(C)C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736472876 598565388 /nfs/dbraw/zinc/56/53/88/598565388.db2.gz VHFFSYHASYBCNU-UHFFFAOYSA-N -1 3 352.398 3.533 20 0 FHADHM CCCN(C)C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736472876 598565389 /nfs/dbraw/zinc/56/53/89/598565389.db2.gz VHFFSYHASYBCNU-UHFFFAOYSA-N -1 3 352.398 3.533 20 0 FHADHM COCc1cccc(CNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)c1 ZINC000737016681 598575181 /nfs/dbraw/zinc/57/51/81/598575181.db2.gz FJZKBRRIBJERAQ-UHFFFAOYSA-N -1 3 363.343 3.644 20 0 FHADHM COCc1cccc(CNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)c1 ZINC000737016681 598575182 /nfs/dbraw/zinc/57/51/82/598575182.db2.gz FJZKBRRIBJERAQ-UHFFFAOYSA-N -1 3 363.343 3.644 20 0 FHADHM CCc1nc(CN(C)c2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)cs1 ZINC000736705249 598577150 /nfs/dbraw/zinc/57/71/50/598577150.db2.gz ZZVLBROJJIKVBQ-UHFFFAOYSA-N -1 3 368.388 3.541 20 0 FHADHM CCc1nc(CN(C)c2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)cs1 ZINC000736705249 598577152 /nfs/dbraw/zinc/57/71/52/598577152.db2.gz ZZVLBROJJIKVBQ-UHFFFAOYSA-N -1 3 368.388 3.541 20 0 FHADHM FC(F)(F)c1cc(N2CC3C[C@@H]4CC2C[C@H](C3)C4)ccc1-c1nnn[n-]1 ZINC000737633614 598577851 /nfs/dbraw/zinc/57/78/51/598577851.db2.gz SNNSTZFUGIBMPI-KCXRBIIJSA-N -1 3 363.387 3.900 20 0 FHADHM FC(F)(F)c1cc(N2CC3C[C@@H]4CC2C[C@H](C3)C4)ccc1-c1nn[n-]n1 ZINC000737633614 598577854 /nfs/dbraw/zinc/57/78/54/598577854.db2.gz SNNSTZFUGIBMPI-KCXRBIIJSA-N -1 3 363.387 3.900 20 0 FHADHM CC(C)c1ccc(OCCC(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)cc1 ZINC000735928330 598583493 /nfs/dbraw/zinc/58/34/93/598583493.db2.gz IYODZPDKDVIXPG-UHFFFAOYSA-N -1 3 369.400 3.537 20 0 FHADHM CC(C)c1ccc(OCCC(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)cc1 ZINC000735928330 598583495 /nfs/dbraw/zinc/58/34/95/598583495.db2.gz IYODZPDKDVIXPG-UHFFFAOYSA-N -1 3 369.400 3.537 20 0 FHADHM O=C(CCCCCc1cccs1)OCc1cc(-c2nnn[n-]2)ccc1F ZINC000737827169 598584105 /nfs/dbraw/zinc/58/41/05/598584105.db2.gz XHLVWHQATVXMJJ-UHFFFAOYSA-N -1 3 374.441 3.914 20 0 FHADHM O=C(CCCCCc1cccs1)OCc1cc(-c2nn[n-]n2)ccc1F ZINC000737827169 598584107 /nfs/dbraw/zinc/58/41/07/598584107.db2.gz XHLVWHQATVXMJJ-UHFFFAOYSA-N -1 3 374.441 3.914 20 0 FHADHM Cc1cc(-c2noc([C@H](C)Oc3ccc(-c4nn[n-]n4)cc3)n2)ccc1F ZINC000737225905 598611204 /nfs/dbraw/zinc/61/12/04/598611204.db2.gz KVGIYFRCGMZKLP-NSHDSACASA-N -1 3 366.356 3.504 20 0 FHADHM c1ccc2c(c1)cccc2-c1noc(COc2cccc(-c3nnn[n-]3)c2)n1 ZINC000738417786 598613239 /nfs/dbraw/zinc/61/32/39/598613239.db2.gz CEIXTYDWHPLFDQ-UHFFFAOYSA-N -1 3 370.372 3.649 20 0 FHADHM c1ccc2c(c1)cccc2-c1noc(COc2cccc(-c3nn[n-]n3)c2)n1 ZINC000738417786 598613240 /nfs/dbraw/zinc/61/32/40/598613240.db2.gz CEIXTYDWHPLFDQ-UHFFFAOYSA-N -1 3 370.372 3.649 20 0 FHADHM CC1(C)CN(C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)[C@H]1c1ccccc1 ZINC000736212615 598624526 /nfs/dbraw/zinc/62/45/26/598624526.db2.gz BSSCAXDLVGBORK-INIZCTEOSA-N -1 3 366.400 3.621 20 0 FHADHM CC1(C)CN(C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)[C@H]1c1ccccc1 ZINC000736212615 598624529 /nfs/dbraw/zinc/62/45/29/598624529.db2.gz BSSCAXDLVGBORK-INIZCTEOSA-N -1 3 366.400 3.621 20 0 FHADHM Fc1ccc(N2CCC(c3c[nH]c4ccccc43)CC2)c(-c2nnn[n-]2)c1 ZINC000737658633 598632317 /nfs/dbraw/zinc/63/23/17/598632317.db2.gz FKJVBBXWTOKOHQ-UHFFFAOYSA-N -1 3 362.412 3.871 20 0 FHADHM Fc1ccc(N2CCC(c3c[nH]c4ccccc43)CC2)c(-c2nn[n-]n2)c1 ZINC000737658633 598632319 /nfs/dbraw/zinc/63/23/19/598632319.db2.gz FKJVBBXWTOKOHQ-UHFFFAOYSA-N -1 3 362.412 3.871 20 0 FHADHM CN(Cc1ccc(Br)o1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000736816693 598632755 /nfs/dbraw/zinc/63/27/55/598632755.db2.gz OAWXEEZPXHIXEU-UHFFFAOYSA-N -1 3 368.622 3.512 20 0 FHADHM CN(Cc1ccc(Br)o1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000736816693 598632756 /nfs/dbraw/zinc/63/27/56/598632756.db2.gz OAWXEEZPXHIXEU-UHFFFAOYSA-N -1 3 368.622 3.512 20 0 FHADHM Clc1cc(NCc2ccc(Br)s2)ccc1-c1nnn[n-]1 ZINC000737563068 598639737 /nfs/dbraw/zinc/63/97/37/598639737.db2.gz FHZDHUJPZPAHEI-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM Clc1cc(NCc2ccc(Br)s2)ccc1-c1nn[n-]n1 ZINC000737563068 598639739 /nfs/dbraw/zinc/63/97/39/598639739.db2.gz FHZDHUJPZPAHEI-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM C[C@H](SCCCc1ccccc1)C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000736187958 598642920 /nfs/dbraw/zinc/64/29/20/598642920.db2.gz FARMDPBZVIAPMU-AWEZNQCLSA-N -1 3 367.478 3.560 20 0 FHADHM C[C@H](SCCCc1ccccc1)C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000736187958 598642922 /nfs/dbraw/zinc/64/29/22/598642922.db2.gz FARMDPBZVIAPMU-AWEZNQCLSA-N -1 3 367.478 3.560 20 0 FHADHM Cc1ccc(C)c(OC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)c1 ZINC000737325210 598645150 /nfs/dbraw/zinc/64/51/50/598645150.db2.gz BCKVVJKSLURGKQ-UHFFFAOYSA-N -1 3 366.421 3.638 20 0 FHADHM Cc1ccc(C)c(OC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)c1 ZINC000737325210 598645152 /nfs/dbraw/zinc/64/51/52/598645152.db2.gz BCKVVJKSLURGKQ-UHFFFAOYSA-N -1 3 366.421 3.638 20 0 FHADHM O=C(CCCCOc1cccc(-c2nnn[n-]2)c1)Oc1ccc(Cl)cc1 ZINC000737842820 598645742 /nfs/dbraw/zinc/64/57/42/598645742.db2.gz WYBOEAODIASLIM-UHFFFAOYSA-N -1 3 372.812 3.675 20 0 FHADHM O=C(CCCCOc1cccc(-c2nn[n-]n2)c1)Oc1ccc(Cl)cc1 ZINC000737842820 598645744 /nfs/dbraw/zinc/64/57/44/598645744.db2.gz WYBOEAODIASLIM-UHFFFAOYSA-N -1 3 372.812 3.675 20 0 FHADHM Cc1ccc(Cl)cc1NC(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000737343953 598647998 /nfs/dbraw/zinc/64/79/98/598647998.db2.gz ZVMYSQHDIYLQCR-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1ccc(Cl)cc1NC(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000737343953 598647999 /nfs/dbraw/zinc/64/79/99/598647999.db2.gz ZVMYSQHDIYLQCR-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM CC(C)(C)[C@H]1CCCC[C@H]1NC(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000735597660 598651463 /nfs/dbraw/zinc/65/14/63/598651463.db2.gz RNOZMXQKPPUPTE-JKSUJKDBSA-N -1 3 373.526 3.680 20 0 FHADHM CC(C)(C)[C@H]1CCCC[C@H]1NC(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000735597660 598651465 /nfs/dbraw/zinc/65/14/65/598651465.db2.gz RNOZMXQKPPUPTE-JKSUJKDBSA-N -1 3 373.526 3.680 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@H](C)CSc1ccccc1 ZINC000737290433 598656035 /nfs/dbraw/zinc/65/60/35/598656035.db2.gz VTXUIPXMGQZUDD-CYBMUJFWSA-N -1 3 353.451 3.542 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@H](C)CSc1ccccc1 ZINC000737290433 598656036 /nfs/dbraw/zinc/65/60/36/598656036.db2.gz VTXUIPXMGQZUDD-CYBMUJFWSA-N -1 3 353.451 3.542 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)C[C@H](c1ccccc1)C(C)C ZINC000737060026 598657151 /nfs/dbraw/zinc/65/71/51/598657151.db2.gz ZEQNHAVABFRFPJ-INIZCTEOSA-N -1 3 365.437 3.644 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)C[C@H](c1ccccc1)C(C)C ZINC000737060026 598657153 /nfs/dbraw/zinc/65/71/53/598657153.db2.gz ZEQNHAVABFRFPJ-INIZCTEOSA-N -1 3 365.437 3.644 20 0 FHADHM CC(C)N(C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)C(C)C ZINC000735856094 598664298 /nfs/dbraw/zinc/66/42/98/598664298.db2.gz BQRZOBOAJDQSGP-UHFFFAOYSA-N -1 3 365.437 3.918 20 0 FHADHM CC(C)N(C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)C(C)C ZINC000735856094 598664299 /nfs/dbraw/zinc/66/42/99/598664299.db2.gz BQRZOBOAJDQSGP-UHFFFAOYSA-N -1 3 365.437 3.918 20 0 FHADHM Clc1cc(NCCCc2nc3c(s2)CCCC3)ccc1-c1nnn[n-]1 ZINC000737565659 598671468 /nfs/dbraw/zinc/67/14/68/598671468.db2.gz NXGGQDFIIOVKDP-UHFFFAOYSA-N -1 3 374.901 3.900 20 0 FHADHM Clc1cc(NCCCc2nc3c(s2)CCCC3)ccc1-c1nn[n-]n1 ZINC000737565659 598671470 /nfs/dbraw/zinc/67/14/70/598671470.db2.gz NXGGQDFIIOVKDP-UHFFFAOYSA-N -1 3 374.901 3.900 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)N1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000738152422 598716633 /nfs/dbraw/zinc/71/66/33/598716633.db2.gz SNSKIVVTJDQNHV-AWEZNQCLSA-N -1 3 368.828 3.542 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)N1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000738152422 598716635 /nfs/dbraw/zinc/71/66/35/598716635.db2.gz SNSKIVVTJDQNHV-AWEZNQCLSA-N -1 3 368.828 3.542 20 0 FHADHM C[C@H](Nc1cccc(F)c1-c1nn[n-]n1)c1nc2cc(Cl)ccc2[nH]1 ZINC000736138176 598747130 /nfs/dbraw/zinc/74/71/30/598747130.db2.gz OQLSJGYJAYCGSF-QMMMGPOBSA-N -1 3 357.780 3.709 20 0 FHADHM Cc1ccccc1[C@H](NC(=O)C=Cc1ccccc1-c1nnn[n-]1)C(C)C ZINC000737419169 598754945 /nfs/dbraw/zinc/75/49/45/598754945.db2.gz DDWFTCGCLBCFBV-GHYICZDASA-N -1 3 361.449 3.702 20 0 FHADHM Cc1ccccc1[C@H](NC(=O)C=Cc1ccccc1-c1nn[n-]n1)C(C)C ZINC000737419169 598754947 /nfs/dbraw/zinc/75/49/47/598754947.db2.gz DDWFTCGCLBCFBV-GHYICZDASA-N -1 3 361.449 3.702 20 0 FHADHM CC(C)(C)CN(Cc1ccccc1)C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000735617810 598768831 /nfs/dbraw/zinc/76/88/31/598768831.db2.gz AJMAEUWECKGQMB-UHFFFAOYSA-N -1 3 364.453 3.947 20 0 FHADHM CC(C)(C)CN(Cc1ccccc1)C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000735617810 598768833 /nfs/dbraw/zinc/76/88/33/598768833.db2.gz AJMAEUWECKGQMB-UHFFFAOYSA-N -1 3 364.453 3.947 20 0 FHADHM Fc1cc(F)c2ncc(-c3nnn[n-]3)c(NCc3ccc(Cl)cc3)c2c1 ZINC000737654252 598769528 /nfs/dbraw/zinc/76/95/28/598769528.db2.gz YXNLXEQCRZNWKV-UHFFFAOYSA-N -1 3 372.766 3.959 20 0 FHADHM Fc1cc(F)c2ncc(-c3nn[n-]n3)c(NCc3ccc(Cl)cc3)c2c1 ZINC000737654252 598769530 /nfs/dbraw/zinc/76/95/30/598769530.db2.gz YXNLXEQCRZNWKV-UHFFFAOYSA-N -1 3 372.766 3.959 20 0 FHADHM CC[C@H](CC(=O)OCc1ccc(F)cc1-c1nnn[n-]1)c1ccccc1 ZINC000736336025 598780722 /nfs/dbraw/zinc/78/07/22/598780722.db2.gz YLTPFWJYNQEZCJ-CYBMUJFWSA-N -1 3 354.385 3.633 20 0 FHADHM CC[C@H](CC(=O)OCc1ccc(F)cc1-c1nn[n-]n1)c1ccccc1 ZINC000736336025 598780723 /nfs/dbraw/zinc/78/07/23/598780723.db2.gz YLTPFWJYNQEZCJ-CYBMUJFWSA-N -1 3 354.385 3.633 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N[C@H](c1ccccc1C)C1CC1 ZINC000737290168 598782759 /nfs/dbraw/zinc/78/27/59/598782759.db2.gz CJQKQBLUOCWDTK-SFHVURJKSA-N -1 3 362.437 3.756 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N[C@H](c1ccccc1C)C1CC1 ZINC000737290168 598782760 /nfs/dbraw/zinc/78/27/60/598782760.db2.gz CJQKQBLUOCWDTK-SFHVURJKSA-N -1 3 362.437 3.756 20 0 FHADHM C[C@@H](OC(=O)c1cnc(-c2ccco2)s1)c1cccc(-c2nnn[n-]2)c1 ZINC000736164446 598785951 /nfs/dbraw/zinc/78/59/51/598785951.db2.gz WNGSJUCBKWPBCI-SNVBAGLBSA-N -1 3 367.390 3.501 20 0 FHADHM C[C@@H](OC(=O)c1cnc(-c2ccco2)s1)c1cccc(-c2nn[n-]n2)c1 ZINC000736164446 598785952 /nfs/dbraw/zinc/78/59/52/598785952.db2.gz WNGSJUCBKWPBCI-SNVBAGLBSA-N -1 3 367.390 3.501 20 0 FHADHM CC(C)[C@@H](c1ccccc1)N(C)C(=O)C=Cc1ccccc1-c1nnn[n-]1 ZINC000735736381 598790921 /nfs/dbraw/zinc/79/09/21/598790921.db2.gz UBCGIWIUHCNZTL-ODLZTCLXSA-N -1 3 361.449 3.736 20 0 FHADHM CC(C)[C@@H](c1ccccc1)N(C)C(=O)C=Cc1ccccc1-c1nn[n-]n1 ZINC000735736381 598790923 /nfs/dbraw/zinc/79/09/23/598790923.db2.gz UBCGIWIUHCNZTL-ODLZTCLXSA-N -1 3 361.449 3.736 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cc3nc(C)ccc3o2)c1-c1nnn[n-]1 ZINC000736675115 598791247 /nfs/dbraw/zinc/79/12/47/598791247.db2.gz FGPNVLUCDPMQNM-UHFFFAOYSA-N -1 3 368.422 3.501 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cc3nc(C)ccc3o2)c1-c1nn[n-]n1 ZINC000736675115 598791249 /nfs/dbraw/zinc/79/12/49/598791249.db2.gz FGPNVLUCDPMQNM-UHFFFAOYSA-N -1 3 368.422 3.501 20 0 FHADHM Clc1ccc(NCc2ccnc(N3CCCCC3)c2)c(-c2nnn[n-]2)c1 ZINC000737576155 598793572 /nfs/dbraw/zinc/79/35/72/598793572.db2.gz WMCWAFWHEWJVBY-UHFFFAOYSA-N -1 3 369.860 3.518 20 0 FHADHM Clc1ccc(NCc2ccnc(N3CCCCC3)c2)c(-c2nn[n-]n2)c1 ZINC000737576155 598793573 /nfs/dbraw/zinc/79/35/73/598793573.db2.gz WMCWAFWHEWJVBY-UHFFFAOYSA-N -1 3 369.860 3.518 20 0 FHADHM Fc1ccccc1CN(Cc1ccccc1)c1ncccc1-c1nnn[n-]1 ZINC000737670316 598817032 /nfs/dbraw/zinc/81/70/32/598817032.db2.gz VBVBEJIJSHQXKZ-UHFFFAOYSA-N -1 3 360.396 3.608 20 0 FHADHM Fc1ccccc1CN(Cc1ccccc1)c1ncccc1-c1nn[n-]n1 ZINC000737670316 598817034 /nfs/dbraw/zinc/81/70/34/598817034.db2.gz VBVBEJIJSHQXKZ-UHFFFAOYSA-N -1 3 360.396 3.608 20 0 FHADHM Cc1ccccc1CN(Cc1ccccc1)c1ncccc1-c1nnn[n-]1 ZINC000737427874 598817185 /nfs/dbraw/zinc/81/71/85/598817185.db2.gz IAPWHNSCKVQMNZ-UHFFFAOYSA-N -1 3 356.433 3.777 20 0 FHADHM Cc1ccccc1CN(Cc1ccccc1)c1ncccc1-c1nn[n-]n1 ZINC000737427874 598817187 /nfs/dbraw/zinc/81/71/87/598817187.db2.gz IAPWHNSCKVQMNZ-UHFFFAOYSA-N -1 3 356.433 3.777 20 0 FHADHM CCC[C@@H](CC1CCCC1)C(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000736421560 598821500 /nfs/dbraw/zinc/82/15/00/598821500.db2.gz BUTIQGKBYVAUPU-SFHVURJKSA-N -1 3 355.486 3.822 20 0 FHADHM CCC[C@@H](CC1CCCC1)C(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000736421560 598821501 /nfs/dbraw/zinc/82/15/01/598821501.db2.gz BUTIQGKBYVAUPU-SFHVURJKSA-N -1 3 355.486 3.822 20 0 FHADHM O=C(C[C@@H]1C=CCC1)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737814372 598821816 /nfs/dbraw/zinc/82/18/16/598821816.db2.gz NMMJPDDISMOAGB-CQSZACIVSA-N -1 3 361.405 3.954 20 0 FHADHM O=C(C[C@@H]1C=CCC1)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737814372 598821817 /nfs/dbraw/zinc/82/18/17/598821817.db2.gz NMMJPDDISMOAGB-CQSZACIVSA-N -1 3 361.405 3.954 20 0 FHADHM CC(C)[C@@H](c1ccccc1Cl)N(C)C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000735733958 598823064 /nfs/dbraw/zinc/82/30/64/598823064.db2.gz DHMLZDPIBGFPTE-KRWDZBQOSA-N -1 3 369.856 3.989 20 0 FHADHM CC(C)[C@@H](c1ccccc1Cl)N(C)C(=O)c1cccc(-c2nn[n-]n2)c1 ZINC000735733958 598823065 /nfs/dbraw/zinc/82/30/65/598823065.db2.gz DHMLZDPIBGFPTE-KRWDZBQOSA-N -1 3 369.856 3.989 20 0 FHADHM CC[C@H]1CCCN(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)C1 ZINC000820981793 599293556 /nfs/dbraw/zinc/29/35/56/599293556.db2.gz XCQLMELOUIAHQC-JTQLQIEISA-N -1 3 368.363 3.539 20 0 FHADHM CN(C(=O)c1cc2c(s1)CCCCCC2)c1ccc(-c2nnn[n-]2)cc1 ZINC000736746726 599305498 /nfs/dbraw/zinc/30/54/98/599305498.db2.gz AWTBRTAWVBZDMR-UHFFFAOYSA-N -1 3 367.478 3.864 20 0 FHADHM CN(C(=O)c1cc2c(s1)CCCCCC2)c1ccc(-c2nn[n-]n2)cc1 ZINC000736746726 599305500 /nfs/dbraw/zinc/30/55/00/599305500.db2.gz AWTBRTAWVBZDMR-UHFFFAOYSA-N -1 3 367.478 3.864 20 0 FHADHM CCN(C(=O)[C@H](C)SCc1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736502988 599309540 /nfs/dbraw/zinc/30/95/40/599309540.db2.gz RQBQTRAWPBJVSG-AWEZNQCLSA-N -1 3 367.478 3.542 20 0 FHADHM CCN(C(=O)[C@H](C)SCc1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736502988 599309543 /nfs/dbraw/zinc/30/95/43/599309543.db2.gz RQBQTRAWPBJVSG-AWEZNQCLSA-N -1 3 367.478 3.542 20 0 FHADHM C[C@H](N[C@H](c1nccs1)c1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736131162 599311283 /nfs/dbraw/zinc/31/12/83/599311283.db2.gz JNMOOIPNWRTCEE-GUYCJALGSA-N -1 3 362.462 3.763 20 0 FHADHM C[C@H](N[C@H](c1nccs1)c1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736131162 599311286 /nfs/dbraw/zinc/31/12/86/599311286.db2.gz JNMOOIPNWRTCEE-GUYCJALGSA-N -1 3 362.462 3.763 20 0 FHADHM Cc1nn(-c2ccccc2)c(C)c1N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000737504361 599324833 /nfs/dbraw/zinc/32/48/33/599324833.db2.gz VKKSITQRXRORKZ-ZDUSSCGKSA-N -1 3 359.437 3.842 20 0 FHADHM Cc1nn(-c2ccccc2)c(C)c1N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000737504361 599324836 /nfs/dbraw/zinc/32/48/36/599324836.db2.gz VKKSITQRXRORKZ-ZDUSSCGKSA-N -1 3 359.437 3.842 20 0 FHADHM c1cc2c3c(ccc(NCCOc4cccc(-c5nnn[n-]5)c4)c3c1)CC2 ZINC000738417812 599327066 /nfs/dbraw/zinc/32/70/66/599327066.db2.gz DIECRGKIJOIGPQ-UHFFFAOYSA-N -1 3 357.417 3.609 20 0 FHADHM c1cc2c3c(ccc(NCCOc4cccc(-c5nn[n-]n5)c4)c3c1)CC2 ZINC000738417812 599327068 /nfs/dbraw/zinc/32/70/68/599327068.db2.gz DIECRGKIJOIGPQ-UHFFFAOYSA-N -1 3 357.417 3.609 20 0 FHADHM C[C@H](SCC(=O)NCCC1=CCCCC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736191090 599328325 /nfs/dbraw/zinc/32/83/25/599328325.db2.gz VUGTYCJPKXQJDG-AWEZNQCLSA-N -1 3 371.510 3.668 20 0 FHADHM C[C@H](SCC(=O)NCCC1=CCCCC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736191090 599328328 /nfs/dbraw/zinc/32/83/28/599328328.db2.gz VUGTYCJPKXQJDG-AWEZNQCLSA-N -1 3 371.510 3.668 20 0 FHADHM Cc1cccc(NC(=O)[C@H](C)S[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737398639 599329920 /nfs/dbraw/zinc/32/99/20/599329920.db2.gz JANGOWSKAHZASS-KBPBESRZSA-N -1 3 367.478 3.997 20 0 FHADHM Cc1cccc(NC(=O)[C@H](C)S[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737398639 599329922 /nfs/dbraw/zinc/32/99/22/599329922.db2.gz JANGOWSKAHZASS-KBPBESRZSA-N -1 3 367.478 3.997 20 0 FHADHM C[C@H](SCC(=O)Nc1ccc(Cl)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736192468 599331234 /nfs/dbraw/zinc/33/12/34/599331234.db2.gz ZDDCZQIKSOSHIC-NSHDSACASA-N -1 3 373.869 3.953 20 0 FHADHM C[C@H](SCC(=O)Nc1ccc(Cl)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736192468 599331237 /nfs/dbraw/zinc/33/12/37/599331237.db2.gz ZDDCZQIKSOSHIC-NSHDSACASA-N -1 3 373.869 3.953 20 0 FHADHM CCN(C(=O)CS[C@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000736505029 599331549 /nfs/dbraw/zinc/33/15/49/599331549.db2.gz KPSAUEYDGZJUII-CQSZACIVSA-N -1 3 367.478 3.714 20 0 FHADHM CCN(C(=O)CS[C@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000736505029 599331553 /nfs/dbraw/zinc/33/15/53/599331553.db2.gz KPSAUEYDGZJUII-CQSZACIVSA-N -1 3 367.478 3.714 20 0 FHADHM CCCCOc1cccc(NCc2cc(-c3nnn[n-]3)ccc2OC)c1 ZINC000821077339 607370368 /nfs/dbraw/zinc/37/03/68/607370368.db2.gz BEFLRLAVCAMEDF-UHFFFAOYSA-N -1 3 353.426 3.666 20 0 FHADHM CCCCOc1cccc(NCc2cc(-c3nn[n-]n3)ccc2OC)c1 ZINC000821077339 607370370 /nfs/dbraw/zinc/37/03/70/607370370.db2.gz BEFLRLAVCAMEDF-UHFFFAOYSA-N -1 3 353.426 3.666 20 0 FHADHM C[C@H](Nc1ncnc2c3ccccc3oc21)c1cccc(-c2nnn[n-]2)c1 ZINC000820462288 599355724 /nfs/dbraw/zinc/35/57/24/599355724.db2.gz XACMZVXPBWOXHN-NSHDSACASA-N -1 3 357.377 3.729 20 0 FHADHM C[C@H](Nc1ncnc2c3ccccc3oc21)c1cccc(-c2nn[n-]n2)c1 ZINC000820462288 599355727 /nfs/dbraw/zinc/35/57/27/599355727.db2.gz XACMZVXPBWOXHN-NSHDSACASA-N -1 3 357.377 3.729 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000821333825 599367154 /nfs/dbraw/zinc/36/71/54/599367154.db2.gz AMAQHBBHXDRCHU-LBPRGKRZSA-N -1 3 352.398 3.608 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000821333825 599367157 /nfs/dbraw/zinc/36/71/57/599367157.db2.gz AMAQHBBHXDRCHU-LBPRGKRZSA-N -1 3 352.398 3.608 20 0 FHADHM CC(C)(C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1)c1cccc(F)c1 ZINC000735580327 599371655 /nfs/dbraw/zinc/37/16/55/599371655.db2.gz BOTVLGJULXAACZ-UHFFFAOYSA-N -1 3 359.792 3.576 20 0 FHADHM CC(C)(C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1)c1cccc(F)c1 ZINC000735580327 599371656 /nfs/dbraw/zinc/37/16/56/599371656.db2.gz BOTVLGJULXAACZ-UHFFFAOYSA-N -1 3 359.792 3.576 20 0 FHADHM CSCCCC(=O)N(Cc1ccccc1)c1ccccc1-c1nnn[n-]1 ZINC000737182071 599372438 /nfs/dbraw/zinc/37/24/38/599372438.db2.gz PIYQBDQATVCVPV-UHFFFAOYSA-N -1 3 367.478 3.543 20 0 FHADHM CSCCCC(=O)N(Cc1ccccc1)c1ccccc1-c1nn[n-]n1 ZINC000737182071 599372440 /nfs/dbraw/zinc/37/24/40/599372440.db2.gz PIYQBDQATVCVPV-UHFFFAOYSA-N -1 3 367.478 3.543 20 0 FHADHM C[C@@H](Nc1ccc(OC2CCCC2)nc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820455335 599373400 /nfs/dbraw/zinc/37/34/00/599373400.db2.gz HGSGGONYCLXBRJ-CYBMUJFWSA-N -1 3 350.426 3.756 20 0 FHADHM C[C@@H](Nc1ccc(OC2CCCC2)nc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820455335 599373402 /nfs/dbraw/zinc/37/34/02/599373402.db2.gz HGSGGONYCLXBRJ-CYBMUJFWSA-N -1 3 350.426 3.756 20 0 FHADHM C[C@@H](N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ncc(-c2ccccc2)o1 ZINC000820410073 599391100 /nfs/dbraw/zinc/39/11/00/599391100.db2.gz CQBBJUCARLFYCY-UONOGXRCSA-N -1 3 360.421 3.934 20 0 FHADHM CCC(CC)n1ccc(CNc2ccc(OC(C)C)c(-c3nnn[n-]3)c2)n1 ZINC000820897394 607373000 /nfs/dbraw/zinc/37/30/00/607373000.db2.gz CRYIOUKTSJWTMC-UHFFFAOYSA-N -1 3 369.473 3.824 20 0 FHADHM CCC(CC)n1ccc(CNc2ccc(OC(C)C)c(-c3nn[n-]n3)c2)n1 ZINC000820897394 607373003 /nfs/dbraw/zinc/37/30/03/607373003.db2.gz CRYIOUKTSJWTMC-UHFFFAOYSA-N -1 3 369.473 3.824 20 0 FHADHM C[C@H](NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1cccc(Cl)c1 ZINC000820352313 599398402 /nfs/dbraw/zinc/39/84/02/599398402.db2.gz UFGPSGDAUXYXGQ-RYUDHWBXSA-N -1 3 370.844 3.642 20 0 FHADHM C[C@H](NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1cccc(Cl)c1 ZINC000820352313 599398404 /nfs/dbraw/zinc/39/84/04/599398404.db2.gz UFGPSGDAUXYXGQ-RYUDHWBXSA-N -1 3 370.844 3.642 20 0 FHADHM CCc1ccc([C@H](C)NC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000821483080 599399255 /nfs/dbraw/zinc/39/92/55/599399255.db2.gz WZYNFJJXXMATNS-UONOGXRCSA-N -1 3 364.453 3.551 20 0 FHADHM CCc1ccc([C@H](C)NC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000821483080 599399256 /nfs/dbraw/zinc/39/92/56/599399256.db2.gz WZYNFJJXXMATNS-UONOGXRCSA-N -1 3 364.453 3.551 20 0 FHADHM CCOCc1ccccc1CNc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000736626456 599404092 /nfs/dbraw/zinc/40/40/92/599404092.db2.gz NWMUNBFHRYZJCN-UHFFFAOYSA-N -1 3 360.421 3.564 20 0 FHADHM CCOCc1ccccc1CNc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000736626456 599404093 /nfs/dbraw/zinc/40/40/93/599404093.db2.gz NWMUNBFHRYZJCN-UHFFFAOYSA-N -1 3 360.421 3.564 20 0 FHADHM CC(C)CCOc1ccc([C@H](C)NCc2ccc(-c3nnn[n-]3)o2)cc1 ZINC000820076695 599421768 /nfs/dbraw/zinc/42/17/68/599421768.db2.gz RMDSPOXJVNRHED-AWEZNQCLSA-N -1 3 355.442 3.735 20 0 FHADHM CCC[C@@H]1CCCC[C@H]1NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821039810 599434062 /nfs/dbraw/zinc/43/40/62/599434062.db2.gz HHRAHRCMYPRPPC-JJRVBVJISA-N -1 3 356.474 3.586 20 0 FHADHM CCC[C@@H]1CCCC[C@H]1NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821039810 599434064 /nfs/dbraw/zinc/43/40/64/599434064.db2.gz HHRAHRCMYPRPPC-JJRVBVJISA-N -1 3 356.474 3.586 20 0 FHADHM Cc1cc(C)cc([C@@H](C)NC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000822196554 599440010 /nfs/dbraw/zinc/44/00/10/599440010.db2.gz NFNJXBBKMPLPDO-LSDHHAIUSA-N -1 3 364.453 3.605 20 0 FHADHM Cc1cc(C)cc([C@@H](C)NC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000822196554 599440013 /nfs/dbraw/zinc/44/00/13/599440013.db2.gz NFNJXBBKMPLPDO-LSDHHAIUSA-N -1 3 364.453 3.605 20 0 FHADHM CCCCc1noc([C@H](C)SCc2ccc(-c3nnn[n-]3)cc2F)n1 ZINC000736466480 599451036 /nfs/dbraw/zinc/45/10/36/599451036.db2.gz KKDHBZSRMZKMKN-JTQLQIEISA-N -1 3 362.434 3.726 20 0 FHADHM CCCCc1noc([C@H](C)SCc2ccc(-c3nn[n-]n3)cc2F)n1 ZINC000736466480 599451038 /nfs/dbraw/zinc/45/10/38/599451038.db2.gz KKDHBZSRMZKMKN-JTQLQIEISA-N -1 3 362.434 3.726 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CNCc1cccc(Cl)c1Cl ZINC000822761335 599456838 /nfs/dbraw/zinc/45/68/38/599456838.db2.gz IYQRZWOHKZGGHN-UHFFFAOYSA-N -1 3 352.200 3.602 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1Nc1ccc(N2CCCCC2)nc1 ZINC000822586413 599468358 /nfs/dbraw/zinc/46/83/58/599468358.db2.gz XVSSONFTBQVRBZ-UHFFFAOYSA-N -1 3 355.833 3.649 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1Nc1ccc(N2CCCCC2)nc1 ZINC000822586413 599468359 /nfs/dbraw/zinc/46/83/59/599468359.db2.gz XVSSONFTBQVRBZ-UHFFFAOYSA-N -1 3 355.833 3.649 20 0 FHADHM C[C@@H](Nc1ccc(F)cc1-c1nnn[n-]1)c1ccc(NC(=O)C2CC2)cc1 ZINC000820455496 599469050 /nfs/dbraw/zinc/46/90/50/599469050.db2.gz IZLNCSWTXOZRDA-LLVKDONJSA-N -1 3 366.400 3.527 20 0 FHADHM C[C@@H](Nc1ccc(F)cc1-c1nn[n-]n1)c1ccc(NC(=O)C2CC2)cc1 ZINC000820455496 599469052 /nfs/dbraw/zinc/46/90/52/599469052.db2.gz IZLNCSWTXOZRDA-LLVKDONJSA-N -1 3 366.400 3.527 20 0 FHADHM C[C@H](NC(=O)N1CCC[C@@H]1c1ccsc1)c1cccc(-c2nnn[n-]2)c1 ZINC000820348177 599477919 /nfs/dbraw/zinc/47/79/19/599477919.db2.gz ASFSNKQBYXXOLP-BLLLJJGKSA-N -1 3 368.466 3.536 20 0 FHADHM C[C@H](NC(=O)N1CCC[C@@H]1c1ccsc1)c1cccc(-c2nn[n-]n2)c1 ZINC000820348177 599477920 /nfs/dbraw/zinc/47/79/20/599477920.db2.gz ASFSNKQBYXXOLP-BLLLJJGKSA-N -1 3 368.466 3.536 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1NCCCCOCCc1ccccc1 ZINC000822582781 599486207 /nfs/dbraw/zinc/48/62/07/599486207.db2.gz WLKJKGXBILBHNW-UHFFFAOYSA-N -1 3 371.872 3.972 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1NCCCCOCCc1ccccc1 ZINC000822582781 599486208 /nfs/dbraw/zinc/48/62/08/599486208.db2.gz WLKJKGXBILBHNW-UHFFFAOYSA-N -1 3 371.872 3.972 20 0 FHADHM C[C@@H](Cc1ccc(Cl)cc1)N(C)C(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000736056202 599492408 /nfs/dbraw/zinc/49/24/08/599492408.db2.gz LAQRXNOKLCGGAU-LBPRGKRZSA-N -1 3 370.844 3.615 20 0 FHADHM C[C@@H](Cc1ccc(Cl)cc1)N(C)C(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000736056202 599492410 /nfs/dbraw/zinc/49/24/10/599492410.db2.gz LAQRXNOKLCGGAU-LBPRGKRZSA-N -1 3 370.844 3.615 20 0 FHADHM Fc1ccc(NC[C@H]2CCCO[C@H]2c2ccccc2)c(-c2nnn[n-]2)c1 ZINC000822778953 599497135 /nfs/dbraw/zinc/49/71/35/599497135.db2.gz PKFHNKLLPGQLGQ-KDOFPFPSSA-N -1 3 353.401 3.586 20 0 FHADHM Fc1ccc(NC[C@H]2CCCO[C@H]2c2ccccc2)c(-c2nn[n-]n2)c1 ZINC000822778953 599497138 /nfs/dbraw/zinc/49/71/38/599497138.db2.gz PKFHNKLLPGQLGQ-KDOFPFPSSA-N -1 3 353.401 3.586 20 0 FHADHM O=C(Cc1ccc(-c2nnn[n-]2)cc1)OCCCc1cccc2ccccc21 ZINC000737956454 599497896 /nfs/dbraw/zinc/49/78/96/599497896.db2.gz ZCONCPYYFJWTKZ-UHFFFAOYSA-N -1 3 372.428 3.738 20 0 FHADHM O=C(Cc1ccc(-c2nn[n-]n2)cc1)OCCCc1cccc2ccccc21 ZINC000737956454 599497899 /nfs/dbraw/zinc/49/78/99/599497899.db2.gz ZCONCPYYFJWTKZ-UHFFFAOYSA-N -1 3 372.428 3.738 20 0 FHADHM Cc1cccc2c1ncc(-c1nnn[n-]1)c2N1CC[C@H](c2ccccc2)C1 ZINC000822332046 599503524 /nfs/dbraw/zinc/50/35/24/599503524.db2.gz LEXYCHOIHVNACS-INIZCTEOSA-N -1 3 356.433 3.717 20 0 FHADHM Cc1cccc2c1ncc(-c1nn[n-]n1)c2N1CC[C@H](c2ccccc2)C1 ZINC000822332046 599503526 /nfs/dbraw/zinc/50/35/26/599503526.db2.gz LEXYCHOIHVNACS-INIZCTEOSA-N -1 3 356.433 3.717 20 0 FHADHM Fc1ccc2c(CCNc3c(Cl)cccc3-c3nnn[n-]3)c[nH]c2c1 ZINC000822782925 599507412 /nfs/dbraw/zinc/50/74/12/599507412.db2.gz MDLAANOOZAZRQB-UHFFFAOYSA-N -1 3 356.792 3.795 20 0 FHADHM Fc1ccc2c(CCNc3c(Cl)cccc3-c3nn[n-]n3)c[nH]c2c1 ZINC000822782925 599507414 /nfs/dbraw/zinc/50/74/14/599507414.db2.gz MDLAANOOZAZRQB-UHFFFAOYSA-N -1 3 356.792 3.795 20 0 FHADHM Cc1c2cccc(F)c2oc1C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000822020946 599507959 /nfs/dbraw/zinc/50/79/59/599507959.db2.gz ORWFQLISUOTOLE-LLVKDONJSA-N -1 3 365.368 3.551 20 0 FHADHM Cc1c2cccc(F)c2oc1C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000822020946 599507961 /nfs/dbraw/zinc/50/79/61/599507961.db2.gz ORWFQLISUOTOLE-LLVKDONJSA-N -1 3 365.368 3.551 20 0 FHADHM CN(C[C@@H]1CCCO[C@H]1c1ccccc1)c1ccc(F)cc1-c1nnn[n-]1 ZINC000821596807 599508115 /nfs/dbraw/zinc/50/81/15/599508115.db2.gz VRKVLYHBIOAXPY-KXBFYZLASA-N -1 3 367.428 3.610 20 0 FHADHM CN(C[C@@H]1CCCO[C@H]1c1ccccc1)c1ccc(F)cc1-c1nn[n-]n1 ZINC000821596807 599508116 /nfs/dbraw/zinc/50/81/16/599508116.db2.gz VRKVLYHBIOAXPY-KXBFYZLASA-N -1 3 367.428 3.610 20 0 FHADHM Cc1nc([C@H]2CCCN(c3ccc(-c4nnn[n-]4)c(Cl)c3)C2)sc1C ZINC000822436800 599509450 /nfs/dbraw/zinc/50/94/50/599509450.db2.gz RCXJFUWOKGAHJP-LBPRGKRZSA-N -1 3 374.901 3.977 20 0 FHADHM Cc1nc([C@H]2CCCN(c3ccc(-c4nn[n-]n4)c(Cl)c3)C2)sc1C ZINC000822436800 599509451 /nfs/dbraw/zinc/50/94/51/599509451.db2.gz RCXJFUWOKGAHJP-LBPRGKRZSA-N -1 3 374.901 3.977 20 0 FHADHM C[C@@H](C[C@H](O)c1ccc(F)cc1)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820235625 607381891 /nfs/dbraw/zinc/38/18/91/607381891.db2.gz TXKCIGNPGMSSPU-QFYYESIMSA-N -1 3 361.808 3.583 20 0 FHADHM C[C@@H](C[C@H](O)c1ccc(F)cc1)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820235625 607381893 /nfs/dbraw/zinc/38/18/93/607381893.db2.gz TXKCIGNPGMSSPU-QFYYESIMSA-N -1 3 361.808 3.583 20 0 FHADHM C[C@H](OC(=O)CCc1cc(Cl)cs1)c1cccc(-c2nnn[n-]2)c1 ZINC000736153712 599516118 /nfs/dbraw/zinc/51/61/18/599516118.db2.gz YVQROJQYCPJBNJ-JTQLQIEISA-N -1 3 362.842 3.819 20 0 FHADHM C[C@H](OC(=O)CCc1cc(Cl)cs1)c1cccc(-c2nn[n-]n2)c1 ZINC000736153712 599516120 /nfs/dbraw/zinc/51/61/20/599516120.db2.gz YVQROJQYCPJBNJ-JTQLQIEISA-N -1 3 362.842 3.819 20 0 FHADHM CC[C@H](Sc1nc(C)nc(C)c1-c1nnn[n-]1)c1ccc(F)cc1F ZINC000736390589 599520326 /nfs/dbraw/zinc/52/03/26/599520326.db2.gz IEPZXKHYQHSKHM-ZDUSSCGKSA-N -1 3 362.409 3.795 20 0 FHADHM Fc1ccc(CNc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)c(F)c1 ZINC000737650431 599523150 /nfs/dbraw/zinc/52/31/50/599523150.db2.gz RGXHTIGPUWMEFG-UHFFFAOYSA-N -1 3 355.270 3.776 20 0 FHADHM C[C@H](NC(=O)[C@H]1C[C@H]1c1cccc(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820321772 599526315 /nfs/dbraw/zinc/52/63/15/599526315.db2.gz MGWLCLONKTTWFC-GOPGUHFVSA-N -1 3 367.840 3.501 20 0 FHADHM C[C@H](NC(=O)[C@H]1C[C@H]1c1cccc(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820321772 599526318 /nfs/dbraw/zinc/52/63/18/599526318.db2.gz MGWLCLONKTTWFC-GOPGUHFVSA-N -1 3 367.840 3.501 20 0 FHADHM CC[C@H](Nc1c(F)cc(-c2nnn[n-]2)cc1F)c1ccc(F)cc1F ZINC000736371898 599528450 /nfs/dbraw/zinc/52/84/50/599528450.db2.gz ZNCWMRBPJDDKEE-AWEZNQCLSA-N -1 3 351.307 3.986 20 0 FHADHM CC[C@H](Nc1c(F)cc(-c2nn[n-]n2)cc1F)c1ccc(F)cc1F ZINC000736371898 599528452 /nfs/dbraw/zinc/52/84/52/599528452.db2.gz ZNCWMRBPJDDKEE-AWEZNQCLSA-N -1 3 351.307 3.986 20 0 FHADHM Cc1ccccc1[C@H]1C[C@@H](C)N(c2ncc(-c3nnn[n-]3)cc2Cl)C1 ZINC000737420229 599529373 /nfs/dbraw/zinc/52/93/73/599529373.db2.gz DLGCFQUUPFKDEC-OCCSQVGLSA-N -1 3 354.845 3.606 20 0 FHADHM Cc1ccccc1[C@H]1C[C@@H](C)N(c2ncc(-c3nn[n-]n3)cc2Cl)C1 ZINC000737420229 599529375 /nfs/dbraw/zinc/52/93/75/599529375.db2.gz DLGCFQUUPFKDEC-OCCSQVGLSA-N -1 3 354.845 3.606 20 0 FHADHM COc1ccccc1[C@@H]1CCN(c2cc(Cl)ccc2-c2nnn[n-]2)C1 ZINC000737146167 599536841 /nfs/dbraw/zinc/53/68/41/599536841.db2.gz HBCFMJUTJOKIBL-GFCCVEGCSA-N -1 3 355.829 3.523 20 0 FHADHM COc1ccccc1[C@@H]1CCN(c2cc(Cl)ccc2-c2nn[n-]n2)C1 ZINC000737146167 599536843 /nfs/dbraw/zinc/53/68/43/599536843.db2.gz HBCFMJUTJOKIBL-GFCCVEGCSA-N -1 3 355.829 3.523 20 0 FHADHM Cc1sc(NC(=O)[C@H](C)Cc2ccccc2F)c(-c2nnn[n-]2)c1C ZINC000737561538 599540434 /nfs/dbraw/zinc/54/04/34/599540434.db2.gz ISWCCISGXAZYHE-SECBINFHSA-N -1 3 359.430 3.501 20 0 FHADHM Cc1sc(NC(=O)[C@H](C)Cc2ccccc2F)c(-c2nn[n-]n2)c1C ZINC000737561538 599540435 /nfs/dbraw/zinc/54/04/35/599540435.db2.gz ISWCCISGXAZYHE-SECBINFHSA-N -1 3 359.430 3.501 20 0 FHADHM CCN(C(=O)[C@H](C)c1cccs1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736502381 599542496 /nfs/dbraw/zinc/54/24/96/599542496.db2.gz MDOUUTSQNZRAIE-OLZOCXBDSA-N -1 3 355.467 3.641 20 0 FHADHM CCN(C(=O)[C@H](C)c1cccs1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736502381 599542498 /nfs/dbraw/zinc/54/24/98/599542498.db2.gz MDOUUTSQNZRAIE-OLZOCXBDSA-N -1 3 355.467 3.641 20 0 FHADHM CC[C@@H](CC(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccc(C)cc1 ZINC000736331296 599542549 /nfs/dbraw/zinc/54/25/49/599542549.db2.gz IWAUMVCHTQJMCO-HOTGVXAUSA-N -1 3 363.465 3.936 20 0 FHADHM CC[C@@H](CC(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccc(C)cc1 ZINC000736331296 599542552 /nfs/dbraw/zinc/54/25/52/599542552.db2.gz IWAUMVCHTQJMCO-HOTGVXAUSA-N -1 3 363.465 3.936 20 0 FHADHM Cc1ccc([C@H]2C[C@H](C)CCN2C(=O)Nc2ccc(-c3nnn[n-]3)cc2)o1 ZINC000822232880 599555500 /nfs/dbraw/zinc/55/55/00/599555500.db2.gz CTRSZTAVWFOAGZ-MLGOLLRUSA-N -1 3 366.425 3.773 20 0 FHADHM Cc1ccc([C@H]2C[C@H](C)CCN2C(=O)Nc2ccc(-c3nn[n-]n3)cc2)o1 ZINC000822232880 599555504 /nfs/dbraw/zinc/55/55/04/599555504.db2.gz CTRSZTAVWFOAGZ-MLGOLLRUSA-N -1 3 366.425 3.773 20 0 FHADHM C[C@H](CCc1cccc(F)c1)C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000820253991 599556667 /nfs/dbraw/zinc/55/66/67/599556667.db2.gz LNHHOXIGQYVSGT-LLVKDONJSA-N -1 3 373.819 3.867 20 0 FHADHM C[C@H](CCc1cccc(F)c1)C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000820253991 599556670 /nfs/dbraw/zinc/55/66/70/599556670.db2.gz LNHHOXIGQYVSGT-LLVKDONJSA-N -1 3 373.819 3.867 20 0 FHADHM CCC[C@@H](C)N(C)C(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736425707 599564613 /nfs/dbraw/zinc/56/46/13/599564613.db2.gz XJKDXUIONKEINW-CQSZACIVSA-N -1 3 364.453 3.871 20 0 FHADHM CC[C@@H](C)[C@H](C)NC(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736335541 599564709 /nfs/dbraw/zinc/56/47/09/599564709.db2.gz YSOJPDZBMJHCTP-KGLIPLIRSA-N -1 3 364.453 3.775 20 0 FHADHM COc1ccccc1[C@H]1CCN(c2c(Cl)cccc2-c2nnn[n-]2)C1 ZINC000821891277 599566714 /nfs/dbraw/zinc/56/67/14/599566714.db2.gz ZHAXZXAIFGMKGX-LBPRGKRZSA-N -1 3 355.829 3.523 20 0 FHADHM COc1ccccc1[C@H]1CCN(c2c(Cl)cccc2-c2nn[n-]n2)C1 ZINC000821891277 599566716 /nfs/dbraw/zinc/56/67/16/599566716.db2.gz ZHAXZXAIFGMKGX-LBPRGKRZSA-N -1 3 355.829 3.523 20 0 FHADHM CN(CC(C)(C)C)C(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736788747 599567317 /nfs/dbraw/zinc/56/73/17/599567317.db2.gz NHTBOYXGULPDCE-UHFFFAOYSA-N -1 3 364.453 3.728 20 0 FHADHM Cc1ccncc1NC(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737442867 599568267 /nfs/dbraw/zinc/56/82/67/599568267.db2.gz IDDCRXKAXHCHLL-UHFFFAOYSA-N -1 3 371.404 3.566 20 0 FHADHM CC[C@H](C)[C@@H]1CCCCN1C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736335671 599608384 /nfs/dbraw/zinc/60/83/84/599608384.db2.gz ZIMTYRDSRFRHGM-ZQIUZPCESA-N -1 3 356.474 3.538 20 0 FHADHM CC[C@H](C)[C@@H]1CCCCN1C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736335671 599608385 /nfs/dbraw/zinc/60/83/85/599608385.db2.gz ZIMTYRDSRFRHGM-ZQIUZPCESA-N -1 3 356.474 3.538 20 0 FHADHM C[C@@H](OC(=O)[C@@H](C)c1cccc(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820481320 599621355 /nfs/dbraw/zinc/62/13/55/599621355.db2.gz URTMIFSWAZGGFM-NWDGAFQWSA-N -1 3 356.813 3.928 20 0 FHADHM C[C@@H](OC(=O)[C@@H](C)c1cccc(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820481320 599621356 /nfs/dbraw/zinc/62/13/56/599621356.db2.gz URTMIFSWAZGGFM-NWDGAFQWSA-N -1 3 356.813 3.928 20 0 FHADHM C[C@H](OC(=O)[C@@H]1C[C@@H]1c1cccc(F)c1F)c1cccc(-c2nnn[n-]2)c1 ZINC000820488449 599621409 /nfs/dbraw/zinc/62/14/09/599621409.db2.gz OFVJHTCBJRSIBY-COLVAYQJSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@@H]1C[C@@H]1c1cccc(F)c1F)c1cccc(-c2nn[n-]n2)c1 ZINC000820488449 599621410 /nfs/dbraw/zinc/62/14/10/599621410.db2.gz OFVJHTCBJRSIBY-COLVAYQJSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@H]1C[C@@H]1c1cc(F)ccc1F)c1cccc(-c2nnn[n-]2)c1 ZINC000820488769 599622130 /nfs/dbraw/zinc/62/21/30/599622130.db2.gz UBEZPHWBCIVJJG-JJMVLAAESA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@H]1C[C@@H]1c1cc(F)ccc1F)c1cccc(-c2nn[n-]n2)c1 ZINC000820488769 599622131 /nfs/dbraw/zinc/62/21/31/599622131.db2.gz UBEZPHWBCIVJJG-JJMVLAAESA-N -1 3 370.359 3.553 20 0 FHADHM Cc1nc(C2CCCC2)sc1C(=O)Nc1sccc1-c1nnn[n-]1 ZINC000822432086 599629834 /nfs/dbraw/zinc/62/98/34/599629834.db2.gz WCWMHXHVOCYLRC-UHFFFAOYSA-N -1 3 360.468 3.603 20 0 FHADHM Cc1nc(C2CCCC2)sc1C(=O)Nc1sccc1-c1nn[n-]n1 ZINC000822432086 599629835 /nfs/dbraw/zinc/62/98/35/599629835.db2.gz WCWMHXHVOCYLRC-UHFFFAOYSA-N -1 3 360.468 3.603 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@H](c1ccccc1)C(C)C ZINC000821400218 599630594 /nfs/dbraw/zinc/63/05/94/599630594.db2.gz HFLDOMIRRHHPII-SFHVURJKSA-N -1 3 365.437 3.644 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@H](c1ccccc1)C(C)C ZINC000821400218 599630595 /nfs/dbraw/zinc/63/05/95/599630595.db2.gz HFLDOMIRRHHPII-SFHVURJKSA-N -1 3 365.437 3.644 20 0 FHADHM CCS[C@@H](C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)C(C)C ZINC000821449551 599632961 /nfs/dbraw/zinc/63/29/61/599632961.db2.gz VAXQJWRXPZWDTI-GFCCVEGCSA-N -1 3 373.404 3.602 20 0 FHADHM CCS[C@@H](C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)C(C)C ZINC000821449551 599632962 /nfs/dbraw/zinc/63/29/62/599632962.db2.gz VAXQJWRXPZWDTI-GFCCVEGCSA-N -1 3 373.404 3.602 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)c1ccc(Cl)cc1 ZINC000823303361 599633279 /nfs/dbraw/zinc/63/32/79/599633279.db2.gz GZBSMQVDLJAKPY-UHFFFAOYSA-N -1 3 367.718 3.791 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)c1ccc(Cl)cc1 ZINC000823303361 599633280 /nfs/dbraw/zinc/63/32/80/599633280.db2.gz GZBSMQVDLJAKPY-UHFFFAOYSA-N -1 3 367.718 3.791 20 0 FHADHM CCc1ccsc1C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000821496107 599634592 /nfs/dbraw/zinc/63/45/92/599634592.db2.gz CFMADTSUCVNCBY-UHFFFAOYSA-N -1 3 367.356 3.762 20 0 FHADHM CCc1ccsc1C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000821496107 599634593 /nfs/dbraw/zinc/63/45/93/599634593.db2.gz CFMADTSUCVNCBY-UHFFFAOYSA-N -1 3 367.356 3.762 20 0 FHADHM O=C(CCc1ccsc1)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000822983917 599634863 /nfs/dbraw/zinc/63/48/63/599634863.db2.gz XOUPLZLBHXNTCF-UHFFFAOYSA-N -1 3 367.356 3.518 20 0 FHADHM O=C(CCc1ccsc1)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000822983917 599634864 /nfs/dbraw/zinc/63/48/64/599634864.db2.gz XOUPLZLBHXNTCF-UHFFFAOYSA-N -1 3 367.356 3.518 20 0 FHADHM C[C@H](C(=O)OCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1)c1ccco1 ZINC000819883822 599662908 /nfs/dbraw/zinc/66/29/08/599662908.db2.gz OIDVHNRXJNKRHW-AWEZNQCLSA-N -1 3 374.400 3.974 20 0 FHADHM C[C@H](C(=O)OCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1)c1ccco1 ZINC000819883822 599662909 /nfs/dbraw/zinc/66/29/09/599662909.db2.gz OIDVHNRXJNKRHW-AWEZNQCLSA-N -1 3 374.400 3.974 20 0 FHADHM C[C@H](NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1)C1CCCCC1 ZINC000820339648 599675410 /nfs/dbraw/zinc/67/54/10/599675410.db2.gz FSJQMPIZRPESGF-AWEZNQCLSA-N -1 3 368.485 3.510 20 0 FHADHM C[C@H](NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1)C1CCCCC1 ZINC000820339648 599675411 /nfs/dbraw/zinc/67/54/11/599675411.db2.gz FSJQMPIZRPESGF-AWEZNQCLSA-N -1 3 368.485 3.510 20 0 FHADHM Fc1cccc(NCc2cc(Cl)ccc2OC(F)F)c1-c1nnn[n-]1 ZINC000822791335 599689543 /nfs/dbraw/zinc/68/95/43/599689543.db2.gz HKUGFWAWQDSDMN-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM Fc1cccc(NCc2cc(Cl)ccc2OC(F)F)c1-c1nn[n-]n1 ZINC000822791335 599689544 /nfs/dbraw/zinc/68/95/44/599689544.db2.gz HKUGFWAWQDSDMN-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM S=C(Nc1cc(Cl)cc(Cl)c1)Nc1ccccc1-c1nnn[n-]1 ZINC000823732654 599691944 /nfs/dbraw/zinc/69/19/44/599691944.db2.gz NKPJWLXLHYVUJL-UHFFFAOYSA-N -1 3 365.249 3.982 20 0 FHADHM S=C(Nc1cc(Cl)cc(Cl)c1)Nc1ccccc1-c1nn[n-]n1 ZINC000823732654 599691945 /nfs/dbraw/zinc/69/19/45/599691945.db2.gz NKPJWLXLHYVUJL-UHFFFAOYSA-N -1 3 365.249 3.982 20 0 FHADHM CC(C)C[C@@H]1CCN(C(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(C)C)C1 ZINC000820068823 599692514 /nfs/dbraw/zinc/69/25/14/599692514.db2.gz UHJRFISCDCABBM-AWEZNQCLSA-N -1 3 372.473 3.554 20 0 FHADHM CC(C)C[C@@H]1CCN(C(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(C)C)C1 ZINC000820068823 599692515 /nfs/dbraw/zinc/69/25/15/599692515.db2.gz UHJRFISCDCABBM-AWEZNQCLSA-N -1 3 372.473 3.554 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)c1ccc2c(c1)-c1ccccc1C2 ZINC000746133270 599693994 /nfs/dbraw/zinc/69/39/94/599693994.db2.gz BOIVKANLYGNVSI-UHFFFAOYSA-N -1 3 353.385 3.690 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)c1ccc2c(c1)-c1ccccc1C2 ZINC000746133270 599693995 /nfs/dbraw/zinc/69/39/95/599693995.db2.gz BOIVKANLYGNVSI-UHFFFAOYSA-N -1 3 353.385 3.690 20 0 FHADHM Cc1ccc(C(=O)[O-])cc1NC(=O)[C@H](C)N1CC[C@H](c2ccccc2C)C1 ZINC000738518631 599717042 /nfs/dbraw/zinc/71/70/42/599717042.db2.gz MCDLMAWICUHUGV-WMZOPIPTSA-N -1 3 366.461 3.818 20 0 FHADHM Cc1[nH]c(C(=O)[C@@H](C)N2CC[C@H](c3ccccc3C)C2)c(C)c1C(=O)[O-] ZINC000738768671 599717896 /nfs/dbraw/zinc/71/78/96/599717896.db2.gz MSTHZEQGOZJWOK-CVEARBPZSA-N -1 3 354.450 3.699 20 0 FHADHM O=C([O-])[C@H](NCc1ccc(C(=O)Nc2ccccc2)cc1)c1ccccc1 ZINC000739487713 599760227 /nfs/dbraw/zinc/76/02/27/599760227.db2.gz DHCRBMMBOUDSTK-HXUWFJFHSA-N -1 3 360.413 3.854 20 0 FHADHM O=C([O-])CCc1ccc(NC(=O)c2cccc(CN3CCCC3)c2)cc1 ZINC000739763184 599771431 /nfs/dbraw/zinc/77/14/31/599771431.db2.gz JQQWRVJOYCSVHZ-UHFFFAOYSA-N -1 3 352.434 3.552 20 0 FHADHM COc1ccc(CN[C@H](C(=O)[O-])c2ccc(Br)cc2)cc1F ZINC000426799683 599790144 /nfs/dbraw/zinc/79/01/44/599790144.db2.gz JFISCSFFTAKSAM-HNNXBMFYSA-N -1 3 368.202 3.512 20 0 FHADHM COc1ccc(CN[C@H](C(=O)[O-])c2ccccc2C(F)(F)F)cc1F ZINC000738008122 599791618 /nfs/dbraw/zinc/79/16/18/599791618.db2.gz DXSSWEDGLDGWCW-HNNXBMFYSA-N -1 3 357.303 3.769 20 0 FHADHM O=C([O-])c1ccc(NC(=O)CN[C@H](c2ccc(F)cc2)C2CCC2)cc1 ZINC000739305835 599793155 /nfs/dbraw/zinc/79/31/55/599793155.db2.gz AAWIIBWLBXSMLD-IBGZPJMESA-N -1 3 356.397 3.593 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1COC(=O)[C@H](C)c1cccc(Cl)c1 ZINC000826252882 607402746 /nfs/dbraw/zinc/40/27/46/607402746.db2.gz WTZGEJPDAWYTQD-GFCCVEGCSA-N -1 3 356.813 3.675 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1COC(=O)[C@H](C)c1cccc(Cl)c1 ZINC000826252882 607402747 /nfs/dbraw/zinc/40/27/47/607402747.db2.gz WTZGEJPDAWYTQD-GFCCVEGCSA-N -1 3 356.813 3.675 20 0 FHADHM COc1cc2c(cc1CN[C@@H](CCC(=O)[O-])c1ccccc1)O[C@@H](C)C2 ZINC000580292794 599992756 /nfs/dbraw/zinc/99/27/56/599992756.db2.gz MJSISJQIABVUAQ-KSSFIOAISA-N -1 3 355.434 3.714 20 0 FHADHM C[C@@H](NC(=O)OC(C)(C)C)C1CCN([C@@H](C)c2ccc(C(=O)[O-])o2)CC1 ZINC000736651658 600092402 /nfs/dbraw/zinc/09/24/02/600092402.db2.gz ZWZXGEQTDRUEPT-OLZOCXBDSA-N -1 3 366.458 3.664 20 0 FHADHM C[C@H]1CCCC[C@]1(CNC(=O)OC(C)(C)C)NCc1occc1C(=O)[O-] ZINC000736779608 600147353 /nfs/dbraw/zinc/14/73/53/600147353.db2.gz JCFZIDGOBFGILY-ORAYPTAESA-N -1 3 366.458 3.541 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@H]1C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000826316550 607428952 /nfs/dbraw/zinc/42/89/52/607428952.db2.gz ROSYBGPBMIOCEZ-VXGBXAGGSA-N -1 3 359.842 3.632 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@H]1C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000826316550 607428953 /nfs/dbraw/zinc/42/89/53/607428953.db2.gz ROSYBGPBMIOCEZ-VXGBXAGGSA-N -1 3 359.842 3.632 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1CCCc2c(Cl)ccc(F)c21 ZINC000826245011 607432420 /nfs/dbraw/zinc/43/24/20/607432420.db2.gz KXJKFJVQPNCWBH-UHFFFAOYSA-N -1 3 371.803 3.561 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1CCCc2c(Cl)ccc(F)c21 ZINC000826245011 607432422 /nfs/dbraw/zinc/43/24/22/607432422.db2.gz KXJKFJVQPNCWBH-UHFFFAOYSA-N -1 3 371.803 3.561 20 0 FHADHM CC[C@@](NCc1cc(=O)oc2c(C)c(C)ccc12)(C(=O)[O-])c1ccccc1 ZINC000736915058 600305778 /nfs/dbraw/zinc/30/57/78/600305778.db2.gz BXACIYGFWJUBSZ-QFIPXVFZSA-N -1 3 365.429 3.890 20 0 FHADHM CN(C(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825812430 607439900 /nfs/dbraw/zinc/43/99/00/607439900.db2.gz KRKMGJRHNIQRDC-VQTJNVASSA-N -1 3 369.428 3.786 20 0 FHADHM CN(C(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825812430 607439901 /nfs/dbraw/zinc/43/99/01/607439901.db2.gz KRKMGJRHNIQRDC-VQTJNVASSA-N -1 3 369.428 3.786 20 0 FHADHM Cc1c2cc(F)ccc2sc1C(=O)N(C)c1ccc(-c2nnn[n-]2)cc1 ZINC000826234358 607440725 /nfs/dbraw/zinc/44/07/25/607440725.db2.gz SCWHXHDOBJOSNL-UHFFFAOYSA-N -1 3 367.409 3.806 20 0 FHADHM Cc1c2cc(F)ccc2sc1C(=O)N(C)c1ccc(-c2nn[n-]n2)cc1 ZINC000826234358 607440727 /nfs/dbraw/zinc/44/07/27/607440727.db2.gz SCWHXHDOBJOSNL-UHFFFAOYSA-N -1 3 367.409 3.806 20 0 FHADHM Cc1cc(CCCC(=O)N(C)c2ccc(-c3nnn[n-]3)cc2)c(C)s1 ZINC000826266331 607442721 /nfs/dbraw/zinc/44/27/21/607442721.db2.gz LIYZEYUAGKUJRU-UHFFFAOYSA-N -1 3 355.467 3.531 20 0 FHADHM Cc1cc(CCCC(=O)N(C)c2ccc(-c3nn[n-]n3)cc2)c(C)s1 ZINC000826266331 607442723 /nfs/dbraw/zinc/44/27/23/607442723.db2.gz LIYZEYUAGKUJRU-UHFFFAOYSA-N -1 3 355.467 3.531 20 0 FHADHM O=C([O-])[C@@H](NCc1cccc(OCC(F)(F)F)c1)c1ccc(F)cc1 ZINC000426763460 600423575 /nfs/dbraw/zinc/42/35/75/600423575.db2.gz BVOICXMRCJSXEF-HNNXBMFYSA-N -1 3 357.303 3.682 20 0 FHADHM O=C([O-])[C@H](NCc1cccc(NC(=O)C2CCCC2)c1)c1ccc(F)cc1 ZINC000739483339 600426997 /nfs/dbraw/zinc/42/69/97/600426997.db2.gz DYCJIEUXEOFFCG-LJQANCHMSA-N -1 3 370.424 3.870 20 0 FHADHM O=C([O-])[C@@H](N[C@@H]1CCc2c1cccc2Br)c1ccc(F)cc1 ZINC000739509967 600433572 /nfs/dbraw/zinc/43/35/72/600433572.db2.gz WMCIFWOKBBWVCN-CVEARBPZSA-N -1 3 364.214 3.991 20 0 FHADHM Cc1ccc(C(=O)[O-])cc1NC(=O)[C@H](C)N1CCC[C@@]2(CC=CCC2)C1 ZINC000738518672 600450083 /nfs/dbraw/zinc/45/00/83/600450083.db2.gz MPAJSEOISUTNFZ-KKSFZXQISA-N -1 3 356.466 3.843 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@H]1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000826316785 607444864 /nfs/dbraw/zinc/44/48/64/607444864.db2.gz YPLOPNPLMZQIRF-GHMZBOCLSA-N -1 3 359.842 3.632 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@H]1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000826316785 607444865 /nfs/dbraw/zinc/44/48/65/607444865.db2.gz YPLOPNPLMZQIRF-GHMZBOCLSA-N -1 3 359.842 3.632 20 0 FHADHM CN1CCC(N(C(=O)c2cccc(NC(=O)[O-])c2)c2ccccc2)CC1 ZINC000737509793 600478059 /nfs/dbraw/zinc/47/80/59/600478059.db2.gz WIZHYWBEUMDLKQ-UHFFFAOYSA-N -1 3 353.422 3.518 20 0 FHADHM CC(C)[C@H](N[C@@H]1CCN(c2sccc2C(=O)[O-])C1=O)c1ccccc1 ZINC000826715719 600818611 /nfs/dbraw/zinc/81/86/11/600818611.db2.gz FYFCOKDGAPDVSD-CVEARBPZSA-N -1 3 358.463 3.539 20 0 FHADHM CC(C)N(CCC(=O)[O-])Cc1ncc(-c2cccc(Br)c2)o1 ZINC000652478447 600829265 /nfs/dbraw/zinc/82/92/65/600829265.db2.gz DCACIMKWRSRCOC-UHFFFAOYSA-N -1 3 367.243 3.789 20 0 FHADHM COc1c(Br)cccc1CN(C)[C@H](C(=O)[O-])c1ccccc1 ZINC000737840256 600974552 /nfs/dbraw/zinc/97/45/52/600974552.db2.gz WEQSQZSDHNSOBT-HNNXBMFYSA-N -1 3 364.239 3.715 20 0 FHADHM C[C@H](c1ccc(Cl)cc1Cl)N(C)Cc1ccnc(-c2nnn[n-]2)c1 ZINC000824762832 607479020 /nfs/dbraw/zinc/47/90/20/607479020.db2.gz IWTQVTDMLRXNPP-SNVBAGLBSA-N -1 3 363.252 3.762 20 0 FHADHM C[C@H](c1ccc(Cl)cc1Cl)N(C)Cc1ccnc(-c2nn[n-]n2)c1 ZINC000824762832 607479021 /nfs/dbraw/zinc/47/90/21/607479021.db2.gz IWTQVTDMLRXNPP-SNVBAGLBSA-N -1 3 363.252 3.762 20 0 FHADHM O=C([O-])[C@@H](c1ccc(Cl)cc1Cl)N1CCC[C@@H](c2cc[nH]n2)C1 ZINC000833171066 600990334 /nfs/dbraw/zinc/99/03/34/600990334.db2.gz LQWXIONZAJFLTP-MEBBXXQBSA-N -1 3 354.237 3.722 20 0 FHADHM Cn1cc([C@H]2CCCN([C@H](C(=O)[O-])c3ccc(Cl)cc3Cl)C2)cn1 ZINC000833042863 600995053 /nfs/dbraw/zinc/99/50/53/600995053.db2.gz CEZIQCXHXWDBLS-ZBEGNZNMSA-N -1 3 368.264 3.732 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1CNc1ccc2nc(C3CC3)oc2c1 ZINC000822743857 607490802 /nfs/dbraw/zinc/49/08/02/607490802.db2.gz GWSWCXDCDFIADS-UHFFFAOYSA-N -1 3 350.357 3.637 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CNc1ccc2nc(C3CC3)oc2c1 ZINC000822743857 607490804 /nfs/dbraw/zinc/49/08/04/607490804.db2.gz GWSWCXDCDFIADS-UHFFFAOYSA-N -1 3 350.357 3.637 20 0 FHADHM Cc1nc(-c2ccc(NCc3ccc(-c4nnn[n-]4)cc3F)cc2)oc1C ZINC000822418717 607489286 /nfs/dbraw/zinc/48/92/86/607489286.db2.gz FJXYEYVTGRPDRI-UHFFFAOYSA-N -1 3 364.384 3.890 20 0 FHADHM Cc1nc(-c2ccc(NCc3ccc(-c4nn[n-]n4)cc3F)cc2)oc1C ZINC000822418717 607489288 /nfs/dbraw/zinc/48/92/88/607489288.db2.gz FJXYEYVTGRPDRI-UHFFFAOYSA-N -1 3 364.384 3.890 20 0 FHADHM Fc1ccccc1CN(Cc1ccccc1)Cc1ccnc(-c2nnn[n-]2)c1 ZINC000826378315 607491925 /nfs/dbraw/zinc/49/19/25/607491925.db2.gz DNHBHKSBJCFXQQ-UHFFFAOYSA-N -1 3 374.423 3.603 20 0 FHADHM Fc1ccccc1CN(Cc1ccccc1)Cc1ccnc(-c2nn[n-]n2)c1 ZINC000826378315 607491927 /nfs/dbraw/zinc/49/19/27/607491927.db2.gz DNHBHKSBJCFXQQ-UHFFFAOYSA-N -1 3 374.423 3.603 20 0 FHADHM COc1ccc([C@H](NCc2ccc(Br)c(F)c2)C(=O)[O-])cc1 ZINC000832253220 601166300 /nfs/dbraw/zinc/16/63/00/601166300.db2.gz WQFXTRSGVQJCLB-HNNXBMFYSA-N -1 3 368.202 3.512 20 0 FHADHM Cc1c(Cl)cccc1NC(=O)CN[C@@H](c1ccccc1)[C@H](C)C(=O)[O-] ZINC000832854276 601202195 /nfs/dbraw/zinc/20/21/95/601202195.db2.gz CPDYUIVGXMQORR-SCLBCKFNSA-N -1 3 360.841 3.639 20 0 FHADHM Cc1ccc(NC(=O)CN[C@H](c2ccccc2)[C@@H](C)C(=O)[O-])cc1Cl ZINC000832943565 601205622 /nfs/dbraw/zinc/20/56/22/601205622.db2.gz GVFXOOSGJGFPJR-ACJLOTCBSA-N -1 3 360.841 3.639 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1c(F)cc(F)cc1F ZINC000820488462 607498034 /nfs/dbraw/zinc/49/80/34/607498034.db2.gz OIYMKXDJNZLLMT-GFVADAIESA-N -1 3 374.322 3.602 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1c(F)cc(F)cc1F ZINC000820488462 607498036 /nfs/dbraw/zinc/49/80/36/607498036.db2.gz OIYMKXDJNZLLMT-GFVADAIESA-N -1 3 374.322 3.602 20 0 FHADHM CC(C)CN(C(=O)c1cnc(C(C)C)s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820081701 607498176 /nfs/dbraw/zinc/49/81/76/607498176.db2.gz ROPYYXMHIAVCPE-UHFFFAOYSA-N -1 3 370.482 3.749 20 0 FHADHM CC(C)CN(C(=O)c1cnc(C(C)C)s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820081701 607498178 /nfs/dbraw/zinc/49/81/78/607498178.db2.gz ROPYYXMHIAVCPE-UHFFFAOYSA-N -1 3 370.482 3.749 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1c(F)cc(F)cc1F ZINC000820488463 607498296 /nfs/dbraw/zinc/49/82/96/607498296.db2.gz OIYMKXDJNZLLMT-JYESYGNLSA-N -1 3 374.322 3.602 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1c(F)cc(F)cc1F ZINC000820488463 607498297 /nfs/dbraw/zinc/49/82/97/607498297.db2.gz OIYMKXDJNZLLMT-JYESYGNLSA-N -1 3 374.322 3.602 20 0 FHADHM C[C@H](CSCc1ccccc1)C(=O)Nc1ccc(F)cc1-c1nnn[n-]1 ZINC000820291960 607501679 /nfs/dbraw/zinc/50/16/79/607501679.db2.gz BBXCQBTUBJDWCF-GFCCVEGCSA-N -1 3 371.441 3.514 20 0 FHADHM C[C@H](CSCc1ccccc1)C(=O)Nc1ccc(F)cc1-c1nn[n-]n1 ZINC000820291960 607501681 /nfs/dbraw/zinc/50/16/81/607501681.db2.gz BBXCQBTUBJDWCF-GFCCVEGCSA-N -1 3 371.441 3.514 20 0 FHADHM CC[C@@](NCc1cccc(SC(=O)N(C)C)c1)(C(=O)[O-])c1ccccc1 ZINC000828989368 601531817 /nfs/dbraw/zinc/53/18/17/601531817.db2.gz YKBJICYIBBZUEL-FQEVSTJZSA-N -1 3 372.490 3.940 20 0 FHADHM O=C([O-])c1ccc(CN2CCC(c3nc4ccccc4[nH]3)CC2)cc1F ZINC000833313303 601634951 /nfs/dbraw/zinc/63/49/51/601634951.db2.gz SPRVRMRYFVBFMA-UHFFFAOYSA-N -1 3 353.397 3.780 20 0 FHADHM Cc1ccc(Cl)cc1NC(=O)CN[C@@H](c1ccccc1)[C@H](C)C(=O)[O-] ZINC000832934323 601658527 /nfs/dbraw/zinc/65/85/27/601658527.db2.gz CNRWMRIPAXOCRG-SCLBCKFNSA-N -1 3 360.841 3.639 20 0 FHADHM CC(C)(C)OC(=O)Nc1cccc(COc2ccccc2-c2nnn[n-]2)c1 ZINC000824114508 607522298 /nfs/dbraw/zinc/52/22/98/607522298.db2.gz VIGIBXFTSZFJJD-UHFFFAOYSA-N -1 3 367.409 3.793 20 0 FHADHM CC(C)(C)OC(=O)Nc1cccc(COc2ccccc2-c2nn[n-]n2)c1 ZINC000824114508 607522300 /nfs/dbraw/zinc/52/23/00/607522300.db2.gz VIGIBXFTSZFJJD-UHFFFAOYSA-N -1 3 367.409 3.793 20 0 FHADHM C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCCCN1Cc1ccsc1C(=O)[O-] ZINC000827688307 601811246 /nfs/dbraw/zinc/81/12/46/601811246.db2.gz UTKBDDNBPSANLK-JSGCOSHPSA-N -1 3 368.499 3.714 20 0 FHADHM CCC[C@H](NC(=O)[C@@H](C)N1CCC(CCC(=O)[O-])CC1)c1ccccc1 ZINC000662218873 601840535 /nfs/dbraw/zinc/84/05/35/601840535.db2.gz VTLSLXAMQCBJCM-APWZRJJASA-N -1 3 360.498 3.609 20 0 FHADHM CCC(CC)n1ccc(CSCc2ccc(OC)c(-c3nnn[n-]3)c2)n1 ZINC000825115273 607535389 /nfs/dbraw/zinc/53/53/89/607535389.db2.gz VZSWQVXXFIDJRP-UHFFFAOYSA-N -1 3 372.498 3.866 20 0 FHADHM CCC(CC)n1ccc(CSCc2ccc(OC)c(-c3nn[n-]n3)c2)n1 ZINC000825115273 607535391 /nfs/dbraw/zinc/53/53/91/607535391.db2.gz VZSWQVXXFIDJRP-UHFFFAOYSA-N -1 3 372.498 3.866 20 0 FHADHM O=C([O-])NCCc1ccc(CNCc2ccc(C(F)(F)F)cc2)cc1 ZINC000740672426 602003905 /nfs/dbraw/zinc/00/39/05/602003905.db2.gz CPZKKQVPNXSQCL-UHFFFAOYSA-N -1 3 352.356 3.805 20 0 FHADHM O=C([O-])[C@H](c1cc(Cl)cc(Cl)c1)N1CCC(c2ncc[nH]2)CC1 ZINC000833169457 602044155 /nfs/dbraw/zinc/04/41/55/602044155.db2.gz BOBRXEGPOGQOGP-AWEZNQCLSA-N -1 3 354.237 3.722 20 0 FHADHM COCCCCSc1nc2c(c(-c3ccco3)c1-c1nnn[n-]1)CCC2 ZINC000826155745 607542231 /nfs/dbraw/zinc/54/22/31/607542231.db2.gz AFKCOIQRQLTUAZ-UHFFFAOYSA-N -1 3 371.466 3.529 20 0 FHADHM COc1cc(OC)cc([C@H](NCc2csc3ccccc23)C(=O)[O-])c1 ZINC000832058130 602167913 /nfs/dbraw/zinc/16/79/13/602167913.db2.gz WOKRUOLZGZEUIK-SFHVURJKSA-N -1 3 357.431 3.834 20 0 FHADHM C[C@@H](c1nnc(-c2ccc(Cl)c(Cl)c2)o1)N1C[C@@H](C)[C@H](C(=O)[O-])C1 ZINC000828425362 602222654 /nfs/dbraw/zinc/22/26/54/602222654.db2.gz ZIXRIMZEOHBPIT-WCABBAIRSA-N -1 3 370.236 3.757 20 0 FHADHM CCOc1ccc(-c2nc(CNC(C)(C)CC(=O)[O-])cs2)cc1OC ZINC000830054035 602260157 /nfs/dbraw/zinc/26/01/57/602260157.db2.gz JKNSFJYNVDQRGK-UHFFFAOYSA-N -1 3 364.467 3.560 20 0 FHADHM C[C@H](NC(=O)[O-])C1CCN(Cc2ccccc2Oc2cccnc2)CC1 ZINC000739017108 602446932 /nfs/dbraw/zinc/44/69/32/602446932.db2.gz YSHSUSOYHHYEHW-HNNXBMFYSA-N -1 3 355.438 3.742 20 0 FHADHM O=C([O-])Nc1ccc(NC(=O)N2CCN(CC3CCCCC3)CC2)cc1 ZINC000740710276 602601132 /nfs/dbraw/zinc/60/11/32/602601132.db2.gz MKMLQPCUPAFTLS-UHFFFAOYSA-N -1 3 360.458 3.506 20 0 FHADHM C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2ccc(NC(=O)[O-])cc2)C1 ZINC000739056257 602604211 /nfs/dbraw/zinc/60/42/11/602604211.db2.gz CWARDSDQRZZRJV-RDTXWAMCSA-N -1 3 368.437 3.734 20 0 FHADHM CN(CCC1CC1)C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000825918471 607602001 /nfs/dbraw/zinc/60/20/01/607602001.db2.gz FTWSYHUZRPRFON-UHFFFAOYSA-N -1 3 363.421 3.531 20 0 FHADHM CN(CCC1CC1)C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000825918471 607602002 /nfs/dbraw/zinc/60/20/02/607602002.db2.gz FTWSYHUZRPRFON-UHFFFAOYSA-N -1 3 363.421 3.531 20 0 FHADHM CN(C)Cc1c2ccccc2oc1C(=O)Nc1cccc(CNC(=O)[O-])c1 ZINC000739610052 603140526 /nfs/dbraw/zinc/14/05/26/603140526.db2.gz JPMVAODIZDSWMB-UHFFFAOYSA-N -1 3 367.405 3.514 20 0 FHADHM C[C@H]1CCN(C(=O)c2cccc(NC(=O)[O-])c2)CCN1Cc1ccccc1 ZINC000825945185 603228060 /nfs/dbraw/zinc/22/80/60/603228060.db2.gz URHPZKKWRVNCLE-INIZCTEOSA-N -1 3 367.449 3.513 20 0 FHADHM C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cccc(NC(=O)[O-])c1 ZINC000736813621 603259451 /nfs/dbraw/zinc/25/94/51/603259451.db2.gz FOSHXZQRBSAJLI-INIZCTEOSA-N -1 3 367.449 3.513 20 0 FHADHM Cc1ccc(C(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1NC(=O)[O-] ZINC000830204253 603292983 /nfs/dbraw/zinc/29/29/83/603292983.db2.gz FEZOLPVUHYCUKZ-LJQANCHMSA-N -1 3 367.449 3.652 20 0 FHADHM CC(C)(NCc1ccc(NC(=O)[O-])nc1)c1ccc(Br)cc1 ZINC000824034676 603537310 /nfs/dbraw/zinc/53/73/10/603537310.db2.gz HGIFEKDCJIGIMO-UHFFFAOYSA-N -1 3 364.243 3.959 20 0 FHADHM Fc1cccc(CN(Cc2ccc(-c3nn[n-]n3)cc2)Cc2cccnc2)c1 ZINC000826376882 607643678 /nfs/dbraw/zinc/64/36/78/607643678.db2.gz WVTGARLHMSTDDI-UHFFFAOYSA-N -1 3 374.423 3.603 20 0 FHADHM COc1cccc(Nc2nc(-c3cccc(-c4nnn[n-]4)c3)cs2)c1 ZINC000826217608 607644225 /nfs/dbraw/zinc/64/42/25/607644225.db2.gz VAQXSFCBJFOUPH-UHFFFAOYSA-N -1 3 350.407 3.742 20 0 FHADHM COc1cccc(Nc2nc(-c3cccc(-c4nn[n-]n4)c3)cs2)c1 ZINC000826217608 607644226 /nfs/dbraw/zinc/64/42/26/607644226.db2.gz VAQXSFCBJFOUPH-UHFFFAOYSA-N -1 3 350.407 3.742 20 0 FHADHM Fc1ccc(CNc2nc(-c3cccc(-c4nnn[n-]4)c3)cs2)cc1 ZINC000826374948 607645201 /nfs/dbraw/zinc/64/52/01/607645201.db2.gz SYFUJSRVMDRMRN-UHFFFAOYSA-N -1 3 352.398 3.741 20 0 FHADHM Fc1ccc(CNc2nc(-c3cccc(-c4nn[n-]n4)c3)cs2)cc1 ZINC000826374948 607645204 /nfs/dbraw/zinc/64/52/04/607645204.db2.gz SYFUJSRVMDRMRN-UHFFFAOYSA-N -1 3 352.398 3.741 20 0 FHADHM COc1ccc(C(C)(C)C)cc1NC(=O)c1ccc(-c2nnn[n-]2)cc1C ZINC000826187680 607647417 /nfs/dbraw/zinc/64/74/17/607647417.db2.gz BJNLAPZRWMNCFW-UHFFFAOYSA-N -1 3 365.437 3.734 20 0 FHADHM COc1ccc(C(C)(C)C)cc1NC(=O)c1ccc(-c2nn[n-]n2)cc1C ZINC000826187680 607647418 /nfs/dbraw/zinc/64/74/18/607647418.db2.gz BJNLAPZRWMNCFW-UHFFFAOYSA-N -1 3 365.437 3.734 20 0 FHADHM CCN(c1ccc(NC(=O)c2ccc(-c3nnn[n-]3)cc2C)cc1)C(C)C ZINC000825444987 607654552 /nfs/dbraw/zinc/65/45/52/607654552.db2.gz UGSUBIHOOVCDOS-UHFFFAOYSA-N -1 3 364.453 3.662 20 0 FHADHM CCN(c1ccc(NC(=O)c2ccc(-c3nn[n-]n3)cc2C)cc1)C(C)C ZINC000825444987 607654554 /nfs/dbraw/zinc/65/45/54/607654554.db2.gz UGSUBIHOOVCDOS-UHFFFAOYSA-N -1 3 364.453 3.662 20 0 FHADHM O=C(CSc1cccc(C(F)(F)F)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000826421054 607655767 /nfs/dbraw/zinc/65/57/67/607655767.db2.gz PMNNIWHQFMYPEZ-UHFFFAOYSA-N -1 3 364.352 3.861 20 0 FHADHM O=C(CSc1cccc(C(F)(F)F)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000826421054 607655769 /nfs/dbraw/zinc/65/57/69/607655769.db2.gz PMNNIWHQFMYPEZ-UHFFFAOYSA-N -1 3 364.352 3.861 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N(C)[C@@H](C)c1cc2ccccc2o1 ZINC000826243549 607658126 /nfs/dbraw/zinc/65/81/26/607658126.db2.gz MEWATLOYHUFUGP-ZDUSSCGKSA-N -1 3 361.405 3.755 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N(C)[C@@H](C)c1cc2ccccc2o1 ZINC000826243549 607658128 /nfs/dbraw/zinc/65/81/28/607658128.db2.gz MEWATLOYHUFUGP-ZDUSSCGKSA-N -1 3 361.405 3.755 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N[C@@H](CC(C)C)c1cccs1 ZINC000826247288 607668644 /nfs/dbraw/zinc/66/86/44/607668644.db2.gz YOXMLMMOAVGDOD-HNNXBMFYSA-N -1 3 355.467 3.754 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N[C@@H](CC(C)C)c1cccs1 ZINC000826247288 607668646 /nfs/dbraw/zinc/66/86/46/607668646.db2.gz YOXMLMMOAVGDOD-HNNXBMFYSA-N -1 3 355.467 3.754 20 0 FHADHM Cc1cc(C)c(-c2nnn[n-]2)c(NCc2cccc(-c3ccccn3)c2)n1 ZINC000826263249 607679142 /nfs/dbraw/zinc/67/91/42/607679142.db2.gz RGGDVEFPWIJLIP-UHFFFAOYSA-N -1 3 357.421 3.553 20 0 FHADHM Cc1cc(C)c(-c2nn[n-]n2)c(NCc2cccc(-c3ccccn3)c2)n1 ZINC000826263249 607679143 /nfs/dbraw/zinc/67/91/43/607679143.db2.gz RGGDVEFPWIJLIP-UHFFFAOYSA-N -1 3 357.421 3.553 20 0 FHADHM CC[C@](NCc1ccc(OCC(F)(F)F)nc1)(C(=O)[O-])c1ccccc1 ZINC000828989133 604471883 /nfs/dbraw/zinc/47/18/83/604471883.db2.gz QLUMNGLYYNRWFJ-QGZVFWFLSA-N -1 3 368.355 3.502 20 0 FHADHM CCc1ccc([C@H]2CCCCN2C(=O)c2ccc(-c3nnn[n-]3)cc2C)o1 ZINC000825705152 607694514 /nfs/dbraw/zinc/69/45/14/607694514.db2.gz XDCLRBQKNGPJBG-QGZVFWFLSA-N -1 3 365.437 3.698 20 0 FHADHM CCc1ccc([C@H]2CCCCN2C(=O)c2ccc(-c3nn[n-]n3)cc2C)o1 ZINC000825705152 607694516 /nfs/dbraw/zinc/69/45/16/607694516.db2.gz XDCLRBQKNGPJBG-QGZVFWFLSA-N -1 3 365.437 3.698 20 0 FHADHM Cc1cccc([C@@H]2CCCN2C(=O)c2ccc(-c3nnn[n-]3)cc2C)c1C ZINC000826244828 607694761 /nfs/dbraw/zinc/69/47/61/607694761.db2.gz DYPHCNCYSKCNLS-IBGZPJMESA-N -1 3 361.449 3.769 20 0 FHADHM Cc1cccc([C@@H]2CCCN2C(=O)c2ccc(-c3nn[n-]n3)cc2C)c1C ZINC000826244828 607694762 /nfs/dbraw/zinc/69/47/62/607694762.db2.gz DYPHCNCYSKCNLS-IBGZPJMESA-N -1 3 361.449 3.769 20 0 FHADHM O=C([O-])[C@H](c1ccc(Cl)cc1Cl)N1CC[C@@]2(O)CCCC[C@@H]2C1 ZINC000833170964 604499539 /nfs/dbraw/zinc/49/95/39/604499539.db2.gz KWMSQKKLODLDAH-PJQXDXOGSA-N -1 3 358.265 3.746 20 0 FHADHM C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1cc(C(=O)[O-])cs1 ZINC000828461666 604509376 /nfs/dbraw/zinc/50/93/76/604509376.db2.gz BFGQRMWLNIUDMF-CQSZACIVSA-N -1 3 373.478 3.575 20 0 FHADHM C[C@H](Oc1ccc(CN2CCC[C@@H](Oc3ccccc3)C2)cc1)C(=O)[O-] ZINC000833537968 604587086 /nfs/dbraw/zinc/58/70/86/604587086.db2.gz AHKQNHFMZNSZMV-OXJNMPFZSA-N -1 3 355.434 3.582 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1cnccc1-c1cccc(F)c1 ZINC000826250758 607703551 /nfs/dbraw/zinc/70/35/51/607703551.db2.gz QRFLJIMBSPBQRQ-UHFFFAOYSA-N -1 3 374.379 3.629 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1cnccc1-c1cccc(F)c1 ZINC000826250758 607703552 /nfs/dbraw/zinc/70/35/52/607703552.db2.gz QRFLJIMBSPBQRQ-UHFFFAOYSA-N -1 3 374.379 3.629 20 0 FHADHM FC(F)(F)c1csc(COc2ccc(-c3nnn[n-]3)cc2Cl)n1 ZINC000826368914 607710802 /nfs/dbraw/zinc/71/08/02/607710802.db2.gz GCPUQCWKCPNXOZ-UHFFFAOYSA-N -1 3 361.736 3.574 20 0 FHADHM FC(F)(F)c1csc(COc2ccc(-c3nn[n-]n3)cc2Cl)n1 ZINC000826368914 607710803 /nfs/dbraw/zinc/71/08/03/607710803.db2.gz GCPUQCWKCPNXOZ-UHFFFAOYSA-N -1 3 361.736 3.574 20 0 FHADHM CCc1nc(C)c([C@H](C)NC[C@H](NC(=O)[O-])c2ccccc2OC)s1 ZINC000827626511 604758896 /nfs/dbraw/zinc/75/88/96/604758896.db2.gz MDBFUBCWUJTARB-FZMZJTMJSA-N -1 3 363.483 3.682 20 0 FHADHM CCc1nc(C)c([C@H](C)NC[C@@H](NC(=O)[O-])c2ccccc2OC)s1 ZINC000827626514 604759134 /nfs/dbraw/zinc/75/91/34/604759134.db2.gz MDBFUBCWUJTARB-SMDDNHRTSA-N -1 3 363.483 3.682 20 0 FHADHM CCc1nc(C)c([C@@H](C)NC[C@@H](NC(=O)[O-])c2ccccc2OC)s1 ZINC000827626509 604759219 /nfs/dbraw/zinc/75/92/19/604759219.db2.gz MDBFUBCWUJTARB-BXUZGUMPSA-N -1 3 363.483 3.682 20 0 FHADHM O=C([O-])CCCN(Cc1ccccc1)Cc1cc(F)cc2c1OCOC2 ZINC000833226888 604784782 /nfs/dbraw/zinc/78/47/82/604784782.db2.gz QHOHGQKVFOZGMV-UHFFFAOYSA-N -1 3 359.397 3.559 20 0 FHADHM CC(C)(C(=O)[O-])[C@@H]1CCCN(Cc2ccc(F)cc2Br)C1 ZINC000135031087 604932585 /nfs/dbraw/zinc/93/25/85/604932585.db2.gz QZECNBSMZPCOHV-GFCCVEGCSA-N -1 3 358.251 3.911 20 0 FHADHM CCc1nc2ccccc2n1C1CCN(Cc2occc2C(=O)[O-])CC1 ZINC000833677130 604966099 /nfs/dbraw/zinc/96/60/99/604966099.db2.gz DXWMDIICRYVZIZ-UHFFFAOYSA-N -1 3 353.422 3.727 20 0 FHADHM O=C([O-])[C@H](NCc1ccc(COCc2ccccc2)cc1)c1cccnc1 ZINC000833165582 604993664 /nfs/dbraw/zinc/99/36/64/604993664.db2.gz KQIXLGPEDVNNOA-OAQYLSRUSA-N -1 3 362.429 3.714 20 0 FHADHM CC(C)(C)SCCCC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000824124281 607830321 /nfs/dbraw/zinc/83/03/21/607830321.db2.gz SFFSHXVAFOVRHH-UHFFFAOYSA-N -1 3 353.879 3.771 20 0 FHADHM CC(C)(C)SCCCC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000824124281 607830322 /nfs/dbraw/zinc/83/03/22/607830322.db2.gz SFFSHXVAFOVRHH-UHFFFAOYSA-N -1 3 353.879 3.771 20 0 FHADHM CC(C)(CNCc1csc(-c2cccc(Br)c2)n1)C(=O)[O-] ZINC000426715238 605111586 /nfs/dbraw/zinc/11/15/86/605111586.db2.gz QIDOWSNHBGUGOQ-UHFFFAOYSA-N -1 3 369.284 3.773 20 0 FHADHM CC1=C(C(=O)[O-])C[C@H](CN[C@H](Cc2ccc(Cl)cc2)c2ccccn2)O1 ZINC000833579721 605270010 /nfs/dbraw/zinc/27/00/10/605270010.db2.gz OPMIIGYDJKPSPE-VQIMIIECSA-N -1 3 372.852 3.756 20 0 FHADHM CC[C@H](CSc1ccccc1)NC(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000825128430 607757407 /nfs/dbraw/zinc/75/74/07/607757407.db2.gz UEIIQAMOABUEPH-CQSZACIVSA-N -1 3 368.466 3.559 20 0 FHADHM CC[C@H](CSc1ccccc1)NC(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000825128430 607757408 /nfs/dbraw/zinc/75/74/08/607757408.db2.gz UEIIQAMOABUEPH-CQSZACIVSA-N -1 3 368.466 3.559 20 0 FHADHM O=C([O-])N1CCC[C@@H]1[C@@H]1CCCCN1Cc1cnc(-c2ccncc2)s1 ZINC000834111124 605562418 /nfs/dbraw/zinc/56/24/18/605562418.db2.gz ZOSLJKJFNKIODC-DLBZAZTESA-N -1 3 372.494 3.702 20 0 FHADHM Cc1cc(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)ccc1NC(=O)[O-] ZINC000829939426 605594281 /nfs/dbraw/zinc/59/42/81/605594281.db2.gz DYKCVTBOAIXBAR-IBGZPJMESA-N -1 3 367.449 3.652 20 0 FHADHM C[C@H](NC(=O)[O-])[C@H]1CCCN(Cc2ccc(-c3ccncc3)cc2F)C1 ZINC000833811552 605596115 /nfs/dbraw/zinc/59/61/15/605596115.db2.gz CPHNOKRDEYGQHH-YOEHRIQHSA-N -1 3 357.429 3.756 20 0 FHADHM C[C@H](NC(=O)[O-])[C@H]1CCCN(Cc2ccccc2OCc2ccccn2)C1 ZINC000833812047 605599859 /nfs/dbraw/zinc/59/98/59/605599859.db2.gz GRTQWKIDVZLETO-IRXDYDNUSA-N -1 3 369.465 3.529 20 0 FHADHM CCOc1cc(CN[C@@H]2CCc3cc(NC(=O)[O-])ccc32)ccc1OC ZINC000833862178 605611394 /nfs/dbraw/zinc/61/13/94/605611394.db2.gz RXEMFBVIEGLMPH-QGZVFWFLSA-N -1 3 356.422 3.961 20 0 FHADHM O=C([O-])N1CCC[C@@H](CN[C@H](c2cc3ccccc3o2)c2cccnc2)C1 ZINC000834100008 605673018 /nfs/dbraw/zinc/67/30/18/605673018.db2.gz RAZNFQDCOKLTOC-YWZLYKJASA-N -1 3 365.433 3.897 20 0 FHADHM C[C@@H](C(=O)Nc1nc(-c2cccc(-c3nnn[n-]3)c2)cs1)C1CCCC1 ZINC000824044950 607770110 /nfs/dbraw/zinc/77/01/10/607770110.db2.gz BRZBQAYVEIEBOF-LLVKDONJSA-N -1 3 368.466 3.755 20 0 FHADHM C[C@@H](C(=O)Nc1nc(-c2cccc(-c3nn[n-]n3)c2)cs1)C1CCCC1 ZINC000824044950 607770111 /nfs/dbraw/zinc/77/01/11/607770111.db2.gz BRZBQAYVEIEBOF-LLVKDONJSA-N -1 3 368.466 3.755 20 0 FHADHM O=C([O-])N[C@H]1C[C@H](NCc2ccnc(N3CCCCC3)c2)c2ccccc21 ZINC000834156479 605791968 /nfs/dbraw/zinc/79/19/68/605791968.db2.gz APWGTYWWDSOXSP-OALUTQOASA-N -1 3 366.465 3.615 20 0 FHADHM Cc1cc(C(=O)NC[C@H](c2cccs2)N2CCCC2)ccc1NC(=O)[O-] ZINC000829945069 605873705 /nfs/dbraw/zinc/87/37/05/605873705.db2.gz HFGWBBKOICASDH-MRXNPFEDSA-N -1 3 373.478 3.713 20 0 FHADHM O=C([O-])N1CCC([C@H](NCc2cccc(CO)c2)c2ccc(F)cc2)CC1 ZINC000834074286 605982987 /nfs/dbraw/zinc/98/29/87/605982987.db2.gz MEJTVYWNBPXUOA-HXUWFJFHSA-N -1 3 372.440 3.539 20 0 FHADHM CCOc1cccc2cc([C@@H](C)Nc3ccc(-c4nnn[n-]4)nc3)oc21 ZINC000821430656 606030127 /nfs/dbraw/zinc/03/01/27/606030127.db2.gz BPNMHHBFSXBJSU-LLVKDONJSA-N -1 3 350.382 3.580 20 0 FHADHM CCOc1cccc2cc([C@@H](C)Nc3ccc(-c4nn[n-]n4)nc3)oc21 ZINC000821430656 606030131 /nfs/dbraw/zinc/03/01/31/606030131.db2.gz BPNMHHBFSXBJSU-LLVKDONJSA-N -1 3 350.382 3.580 20 0 FHADHM Cc1ccc(C(F)(F)F)cc1NC(=O)C=Cc1ccccc1-c1nnn[n-]1 ZINC000822231115 606031657 /nfs/dbraw/zinc/03/16/57/606031657.db2.gz ZWBBSLJJVTYXQN-VQHVLOKHSA-N -1 3 373.338 3.846 20 0 FHADHM Cc1ccc(C(F)(F)F)cc1NC(=O)C=Cc1ccccc1-c1nn[n-]n1 ZINC000822231115 606031661 /nfs/dbraw/zinc/03/16/61/606031661.db2.gz ZWBBSLJJVTYXQN-VQHVLOKHSA-N -1 3 373.338 3.846 20 0 FHADHM CC[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2Cl)CC[C@@H]1c1ccccc1 ZINC000820995456 606038899 /nfs/dbraw/zinc/03/88/99/606038899.db2.gz ROKAIUYJZLVQBL-CJNGLKHVSA-N -1 3 368.872 3.935 20 0 FHADHM CC[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2Cl)CC[C@@H]1c1ccccc1 ZINC000820995456 606038901 /nfs/dbraw/zinc/03/89/01/606038901.db2.gz ROKAIUYJZLVQBL-CJNGLKHVSA-N -1 3 368.872 3.935 20 0 FHADHM O=C([O-])N1CCC[C@@H](N[C@@H](c2cccc(Cl)c2)c2ccccn2)CC1 ZINC000834100068 606044550 /nfs/dbraw/zinc/04/45/50/606044550.db2.gz RUGHVGGYZZEFSJ-AEFFLSMTSA-N -1 3 359.857 3.947 20 0 FHADHM C[C@H](Nc1nc2ccccc2cc1-c1nnn[n-]1)c1c(F)cccc1F ZINC000820461095 606050811 /nfs/dbraw/zinc/05/08/11/606050811.db2.gz FEQGERDVINEYDP-JTQLQIEISA-N -1 3 352.348 3.866 20 0 FHADHM C[C@H](Nc1nc2ccccc2cc1-c1nn[n-]n1)c1c(F)cccc1F ZINC000820461095 606050816 /nfs/dbraw/zinc/05/08/16/606050816.db2.gz FEQGERDVINEYDP-JTQLQIEISA-N -1 3 352.348 3.866 20 0 FHADHM CC1(C)C(C(=O)N(Cc2ccco2)c2ccccc2-c2nnn[n-]2)C1(C)C ZINC000820584967 606052547 /nfs/dbraw/zinc/05/25/47/606052547.db2.gz LVWMOYUTHQHGNT-UHFFFAOYSA-N -1 3 365.437 3.675 20 0 FHADHM CC1(C)C(C(=O)N(Cc2ccco2)c2ccccc2-c2nn[n-]n2)C1(C)C ZINC000820584967 606052553 /nfs/dbraw/zinc/05/25/53/606052553.db2.gz LVWMOYUTHQHGNT-UHFFFAOYSA-N -1 3 365.437 3.675 20 0 FHADHM CSc1ccc(F)cc1CNc1nc2ccccc2cc1-c1nnn[n-]1 ZINC000821984072 606097525 /nfs/dbraw/zinc/09/75/25/606097525.db2.gz LWTSJVBDLLJYPX-UHFFFAOYSA-N -1 3 366.425 3.888 20 0 FHADHM CSc1ccc(F)cc1CNc1nc2ccccc2cc1-c1nn[n-]n1 ZINC000821984072 606097526 /nfs/dbraw/zinc/09/75/26/606097526.db2.gz LWTSJVBDLLJYPX-UHFFFAOYSA-N -1 3 366.425 3.888 20 0 FHADHM CC[C@H](C)[C@@H](C)N(C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)C1CC1 ZINC000820859349 606116792 /nfs/dbraw/zinc/11/67/92/606116792.db2.gz DIXQNXOEKQFXIX-BFHYXJOUSA-N -1 3 356.474 3.536 20 0 FHADHM CC[C@H](C)[C@@H](C)N(C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)C1CC1 ZINC000820859349 606116794 /nfs/dbraw/zinc/11/67/94/606116794.db2.gz DIXQNXOEKQFXIX-BFHYXJOUSA-N -1 3 356.474 3.536 20 0 FHADHM C[C@@H]1CCc2c(sc(NC(=O)[C@H]3CC34CCCC4)c2-c2nnn[n-]2)C1 ZINC000820727463 606145892 /nfs/dbraw/zinc/14/58/92/606145892.db2.gz MBVZUXKBDDKYFS-ZYHUDNBSSA-N -1 3 357.483 3.572 20 0 FHADHM C[C@@H]1CCc2c(sc(NC(=O)[C@H]3CC34CCCC4)c2-c2nn[n-]n2)C1 ZINC000820727463 606145894 /nfs/dbraw/zinc/14/58/94/606145894.db2.gz MBVZUXKBDDKYFS-ZYHUDNBSSA-N -1 3 357.483 3.572 20 0 FHADHM C[C@H](c1ccc(Cl)cc1)[C@@H](C)N(C)C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000820563589 606149369 /nfs/dbraw/zinc/14/93/69/606149369.db2.gz RWCOTHFLQVVPIC-QWHCGFSZSA-N -1 3 369.856 3.784 20 0 FHADHM C[C@H](c1ccc(Cl)cc1)[C@@H](C)N(C)C(=O)c1cccc(-c2nn[n-]n2)c1 ZINC000820563589 606149371 /nfs/dbraw/zinc/14/93/71/606149371.db2.gz RWCOTHFLQVVPIC-QWHCGFSZSA-N -1 3 369.856 3.784 20 0 FHADHM CO[C@@H](C)c1nc(CN(CC(C)C)c2ccc(-c3nn[n-]n3)cc2)cs1 ZINC000821675732 606178296 /nfs/dbraw/zinc/17/82/96/606178296.db2.gz RZUWPWDYOFPOKO-ZDUSSCGKSA-N -1 3 372.498 3.693 20 0 FHADHM CC[C@H](Oc1cccc(C)c1)C(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820939465 606180161 /nfs/dbraw/zinc/18/01/61/606180161.db2.gz VCHNBEPVFHLQDD-KDOFPFPSSA-N -1 3 366.421 3.637 20 0 FHADHM CC[C@H](Oc1cccc(C)c1)C(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820939465 606180164 /nfs/dbraw/zinc/18/01/64/606180164.db2.gz VCHNBEPVFHLQDD-KDOFPFPSSA-N -1 3 366.421 3.637 20 0 FHADHM O=[S@](Cc1ccc(-c2nnn[n-]2)cc1)Cc1ccc(-c2ccccc2)cc1 ZINC000823606854 606180378 /nfs/dbraw/zinc/18/03/78/606180378.db2.gz OCCAYVOAULUZSR-MHZLTWQESA-N -1 3 374.469 3.983 20 0 FHADHM O=[S@](Cc1ccc(-c2nn[n-]n2)cc1)Cc1ccc(-c2ccccc2)cc1 ZINC000823606854 606180379 /nfs/dbraw/zinc/18/03/79/606180379.db2.gz OCCAYVOAULUZSR-MHZLTWQESA-N -1 3 374.469 3.983 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)ccc1OC(=O)CCCc1ccc(C)s1 ZINC000821388996 606184282 /nfs/dbraw/zinc/18/42/82/606184282.db2.gz DWVDBHMVUDWBQG-UHFFFAOYSA-N -1 3 372.450 3.564 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)ccc1OC(=O)CCCc1ccc(C)s1 ZINC000821388996 606184283 /nfs/dbraw/zinc/18/42/83/606184283.db2.gz DWVDBHMVUDWBQG-UHFFFAOYSA-N -1 3 372.450 3.564 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)Nc1ccc2nc(C3CC3)oc2c1 ZINC000822935751 606190582 /nfs/dbraw/zinc/19/05/82/606190582.db2.gz MYVLSAYAJRRORR-JXMROGBWSA-N -1 3 372.388 3.537 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)Nc1ccc2nc(C3CC3)oc2c1 ZINC000822935751 606190584 /nfs/dbraw/zinc/19/05/84/606190584.db2.gz MYVLSAYAJRRORR-JXMROGBWSA-N -1 3 372.388 3.537 20 0 FHADHM CC(C)CC(=O)Nc1ccc(NCc2cc(-c3nnn[n-]3)cs2)cc1 ZINC000820051049 606212531 /nfs/dbraw/zinc/21/25/31/606212531.db2.gz JWVSKNMCZVJKDS-UHFFFAOYSA-N -1 3 356.455 3.525 20 0 FHADHM CC(C)CC(=O)Nc1ccc(NCc2cc(-c3nn[n-]n3)cs2)cc1 ZINC000820051049 606212534 /nfs/dbraw/zinc/21/25/34/606212534.db2.gz JWVSKNMCZVJKDS-UHFFFAOYSA-N -1 3 356.455 3.525 20 0 FHADHM Cc1nc(-c2ccc([C@@H](C)Nc3ccc(-c4nnn[n-]4)nc3)cc2)cs1 ZINC000822419382 606213843 /nfs/dbraw/zinc/21/38/43/606213843.db2.gz QLIUUUYTNVOSOG-LLVKDONJSA-N -1 3 363.450 3.867 20 0 FHADHM Cc1nc(-c2ccc([C@@H](C)Nc3ccc(-c4nn[n-]n4)nc3)cc2)cs1 ZINC000822419382 606213845 /nfs/dbraw/zinc/21/38/45/606213845.db2.gz QLIUUUYTNVOSOG-LLVKDONJSA-N -1 3 363.450 3.867 20 0 FHADHM C[C@H](c1ccccc1)N(C(=O)c1cc(-c2nnn[n-]2)cn1C)c1ccccc1 ZINC000820563113 606234078 /nfs/dbraw/zinc/23/40/78/606234078.db2.gz OCBAGZKFSGAVCE-OAHLLOKOSA-N -1 3 372.432 3.613 20 0 FHADHM C[C@H](c1ccccc1)N(C(=O)c1cc(-c2nn[n-]n2)cn1C)c1ccccc1 ZINC000820563113 606234079 /nfs/dbraw/zinc/23/40/79/606234079.db2.gz OCBAGZKFSGAVCE-OAHLLOKOSA-N -1 3 372.432 3.613 20 0 FHADHM O=C(c1ccc(Sc2ccccc2-c2nnn[n-]2)cc1)N1CCCCC1 ZINC000823488421 606246141 /nfs/dbraw/zinc/24/61/41/606246141.db2.gz MBBDZAZCNYWCIX-UHFFFAOYSA-N -1 3 365.462 3.644 20 0 FHADHM O=C(c1ccc(Sc2ccccc2-c2nn[n-]n2)cc1)N1CCCCC1 ZINC000823488421 606246143 /nfs/dbraw/zinc/24/61/43/606246143.db2.gz MBBDZAZCNYWCIX-UHFFFAOYSA-N -1 3 365.462 3.644 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)c1cc2c(s1)CCCCC2 ZINC000823343809 606265648 /nfs/dbraw/zinc/26/56/48/606265648.db2.gz HYZMSHSVKJIKHS-UHFFFAOYSA-N -1 3 357.414 3.589 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)c1cc2c(s1)CCCCC2 ZINC000823343809 606265650 /nfs/dbraw/zinc/26/56/50/606265650.db2.gz HYZMSHSVKJIKHS-UHFFFAOYSA-N -1 3 357.414 3.589 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)[C@@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000823344353 606270964 /nfs/dbraw/zinc/27/09/64/606270964.db2.gz WGQFTNBILDXUCO-DLBZAZTESA-N -1 3 373.391 3.901 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)[C@@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000823344353 606270965 /nfs/dbraw/zinc/27/09/65/606270965.db2.gz WGQFTNBILDXUCO-DLBZAZTESA-N -1 3 373.391 3.901 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)c1ccc(SC(F)F)cc1 ZINC000823346766 606272250 /nfs/dbraw/zinc/27/22/50/606272250.db2.gz QOQPHUOFIRHLGY-UHFFFAOYSA-N -1 3 365.340 3.573 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)c1ccc(SC(F)F)cc1 ZINC000823346766 606272252 /nfs/dbraw/zinc/27/22/52/606272252.db2.gz QOQPHUOFIRHLGY-UHFFFAOYSA-N -1 3 365.340 3.573 20 0 FHADHM C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC000820555303 606287261 /nfs/dbraw/zinc/28/72/61/606287261.db2.gz IRMJSZINTBAJBV-AWEZNQCLSA-N -1 3 372.432 3.695 20 0 FHADHM C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC000820555303 606287263 /nfs/dbraw/zinc/28/72/63/606287263.db2.gz IRMJSZINTBAJBV-AWEZNQCLSA-N -1 3 372.432 3.695 20 0 FHADHM CCc1ccc(NC(=O)[C@H](C)Sc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000821486287 606325649 /nfs/dbraw/zinc/32/56/49/606325649.db2.gz BLUCCZZTUAKRMU-LBPRGKRZSA-N -1 3 353.451 3.548 20 0 FHADHM CCc1ccc(NC(=O)[C@H](C)Sc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000821486287 606325652 /nfs/dbraw/zinc/32/56/52/606325652.db2.gz BLUCCZZTUAKRMU-LBPRGKRZSA-N -1 3 353.451 3.548 20 0 FHADHM Cc1ccc(NC(=O)CSc2cccc(-c3nnn[n-]3)c2)c(Cl)c1 ZINC000822248693 606325985 /nfs/dbraw/zinc/32/59/85/606325985.db2.gz IXXXVQNGLAOTFH-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1ccc(NC(=O)CSc2cccc(-c3nn[n-]n3)c2)c(Cl)c1 ZINC000822248693 606325986 /nfs/dbraw/zinc/32/59/86/606325986.db2.gz IXXXVQNGLAOTFH-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM C[C@@H](OC(=O)C/C=C\c1ccc(F)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820489070 606342519 /nfs/dbraw/zinc/34/25/19/606342519.db2.gz ZAMJNHQCEMTHNX-XQJDBVBESA-N -1 3 352.369 3.714 20 0 FHADHM C[C@@H](OC(=O)C/C=C\c1ccc(F)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820489070 606342521 /nfs/dbraw/zinc/34/25/21/606342521.db2.gz ZAMJNHQCEMTHNX-XQJDBVBESA-N -1 3 352.369 3.714 20 0 FHADHM C[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820678623 606342590 /nfs/dbraw/zinc/34/25/90/606342590.db2.gz WKOKPLBXFZHSDD-ZETOZRRWSA-N -1 3 360.849 3.705 20 0 FHADHM C[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820678623 606342591 /nfs/dbraw/zinc/34/25/91/606342591.db2.gz WKOKPLBXFZHSDD-ZETOZRRWSA-N -1 3 360.849 3.705 20 0 FHADHM Cc1[nH]c2ccccc2c1CC(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000822010058 606343547 /nfs/dbraw/zinc/34/35/47/606343547.db2.gz LNZNPQKESXIPNE-ZDUSSCGKSA-N -1 3 361.405 3.503 20 0 FHADHM Cc1[nH]c2ccccc2c1CC(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000822010058 606343549 /nfs/dbraw/zinc/34/35/49/606343549.db2.gz LNZNPQKESXIPNE-ZDUSSCGKSA-N -1 3 361.405 3.503 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CC[C@H](c2ccccc2)[C@@H]1C ZINC000822218196 606345299 /nfs/dbraw/zinc/34/52/99/606345299.db2.gz ZNDQFJRMTNYJJL-YOEHRIQHSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CC[C@H](c2ccccc2)[C@@H]1C ZINC000822218196 606345300 /nfs/dbraw/zinc/34/53/00/606345300.db2.gz ZNDQFJRMTNYJJL-YOEHRIQHSA-N -1 3 362.437 3.585 20 0 FHADHM COc1cccc2cc(C(=O)O[C@@H](C)c3ccc(-c4nnn[n-]4)cc3)oc21 ZINC000821877790 606345507 /nfs/dbraw/zinc/34/55/07/606345507.db2.gz VPWOTMFZNLJDNG-NSHDSACASA-N -1 3 364.361 3.540 20 0 FHADHM COc1cccc2cc(C(=O)O[C@@H](C)c3ccc(-c4nn[n-]n4)cc3)oc21 ZINC000821877790 606345508 /nfs/dbraw/zinc/34/55/08/606345508.db2.gz VPWOTMFZNLJDNG-NSHDSACASA-N -1 3 364.361 3.540 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)N1CCCCC[C@@H]1c1ccco1 ZINC000823343772 606353210 /nfs/dbraw/zinc/35/32/10/606353210.db2.gz GRVFVGWBEHMHEM-OAHLLOKOSA-N -1 3 370.388 3.748 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)N1CCCCC[C@@H]1c1ccco1 ZINC000823343772 606353211 /nfs/dbraw/zinc/35/32/11/606353211.db2.gz GRVFVGWBEHMHEM-OAHLLOKOSA-N -1 3 370.388 3.748 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccnc2ccccc12)c1ccc(-c2nnn[n-]2)cc1 ZINC000820487426 606354109 /nfs/dbraw/zinc/35/41/09/606354109.db2.gz GQRCMAVXAFJICQ-IWMPZKFUSA-N -1 3 371.400 3.733 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccnc2ccccc12)c1ccc(-c2nn[n-]n2)cc1 ZINC000820487426 606354110 /nfs/dbraw/zinc/35/41/10/606354110.db2.gz GQRCMAVXAFJICQ-IWMPZKFUSA-N -1 3 371.400 3.733 20 0 FHADHM Cc1ccccc1OCCCC(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000822366333 606356893 /nfs/dbraw/zinc/35/68/93/606356893.db2.gz IBNWWOBJRCGECV-HNNXBMFYSA-N -1 3 366.421 3.639 20 0 FHADHM Cc1ccccc1OCCCC(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000822366333 606356895 /nfs/dbraw/zinc/35/68/95/606356895.db2.gz IBNWWOBJRCGECV-HNNXBMFYSA-N -1 3 366.421 3.639 20 0 FHADHM CCOc1ccc(CCC(=O)O[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000821416613 606359861 /nfs/dbraw/zinc/35/98/61/606359861.db2.gz BMBBVJIYVUWKPO-CQSZACIVSA-N -1 3 366.421 3.502 20 0 FHADHM CCOc1ccc(CCC(=O)O[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000821416613 606359862 /nfs/dbraw/zinc/35/98/62/606359862.db2.gz BMBBVJIYVUWKPO-CQSZACIVSA-N -1 3 366.421 3.502 20 0 FHADHM CC(C)C[C@@H](C)N(C)C(=O)CS[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820057355 606371344 /nfs/dbraw/zinc/37/13/44/606371344.db2.gz YXCUBIXFFYYJQL-KGLIPLIRSA-N -1 3 361.515 3.554 20 0 FHADHM CC(C)C[C@@H](C)N(C)C(=O)CS[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820057355 606371346 /nfs/dbraw/zinc/37/13/46/606371346.db2.gz YXCUBIXFFYYJQL-KGLIPLIRSA-N -1 3 361.515 3.554 20 0 FHADHM CCCC[C@H](CCC)NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000821042506 606385798 /nfs/dbraw/zinc/38/57/98/606385798.db2.gz CXZDOOBIWRLBSA-KRWDZBQOSA-N -1 3 370.501 3.900 20 0 FHADHM CCCC[C@H](CCC)NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000821042506 606385801 /nfs/dbraw/zinc/38/58/01/606385801.db2.gz CXZDOOBIWRLBSA-KRWDZBQOSA-N -1 3 370.501 3.900 20 0 FHADHM c1ccc(COCc2ccc(Nc3ncccc3-c3nnn[n-]3)cc2)cc1 ZINC000823787040 606433032 /nfs/dbraw/zinc/43/30/32/606433032.db2.gz IIMPHOOQJPCJDX-UHFFFAOYSA-N -1 3 358.405 3.722 20 0 FHADHM c1ccc(COCc2ccc(Nc3ncccc3-c3nn[n-]n3)cc2)cc1 ZINC000823787040 606433034 /nfs/dbraw/zinc/43/30/34/606433034.db2.gz IIMPHOOQJPCJDX-UHFFFAOYSA-N -1 3 358.405 3.722 20 0 FHADHM C[C@@H](NC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1c(F)cccc1Cl ZINC000820321940 606444228 /nfs/dbraw/zinc/44/42/28/606444228.db2.gz OMRLNNXAFBSTRI-DWOQACPDSA-N -1 3 371.803 3.550 20 0 FHADHM C[C@@H](NC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1c(F)cccc1Cl ZINC000820321940 606444230 /nfs/dbraw/zinc/44/42/30/606444230.db2.gz OMRLNNXAFBSTRI-DWOQACPDSA-N -1 3 371.803 3.550 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)cc1CNc1ccc(F)c(C(F)(F)F)c1 ZINC000822761273 606452455 /nfs/dbraw/zinc/45/24/55/606452455.db2.gz GJOBPMSTHKVQGS-UHFFFAOYSA-N -1 3 355.270 3.776 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CNc1ccc(F)c(C(F)(F)F)c1 ZINC000822761273 606452457 /nfs/dbraw/zinc/45/24/57/606452457.db2.gz GJOBPMSTHKVQGS-UHFFFAOYSA-N -1 3 355.270 3.776 20 0 FHADHM Cc1cc(C)c2ncc(-c3nnn[n-]3)c(N3CCC[C@H]3c3ccccn3)c2c1 ZINC000822195052 606458738 /nfs/dbraw/zinc/45/87/38/606458738.db2.gz FLIBRMZWICYRLU-SFHVURJKSA-N -1 3 371.448 3.768 20 0 FHADHM Cc1cc(C)c2ncc(-c3nn[n-]n3)c(N3CCC[C@H]3c3ccccn3)c2c1 ZINC000822195052 606458739 /nfs/dbraw/zinc/45/87/39/606458739.db2.gz FLIBRMZWICYRLU-SFHVURJKSA-N -1 3 371.448 3.768 20 0 FHADHM Fc1ccc(SCC(F)F)c(NCc2cccc(-c3nnn[n-]3)c2)c1 ZINC000822783150 606461519 /nfs/dbraw/zinc/46/15/19/606461519.db2.gz XKBYAPHLIMCXKB-UHFFFAOYSA-N -1 3 365.384 3.975 20 0 FHADHM Fc1ccc(SCC(F)F)c(NCc2cccc(-c3nn[n-]n3)c2)c1 ZINC000822783150 606461520 /nfs/dbraw/zinc/46/15/20/606461520.db2.gz XKBYAPHLIMCXKB-UHFFFAOYSA-N -1 3 365.384 3.975 20 0 FHADHM O=C(OC1c2ccccc2-c2ccccc21)c1cc(-c2nnn[n-]2)cs1 ZINC000823396037 606463603 /nfs/dbraw/zinc/46/36/03/606463603.db2.gz DDODTBLBRGSPPT-UHFFFAOYSA-N -1 3 360.398 3.855 20 0 FHADHM O=C(OC1c2ccccc2-c2ccccc21)c1cc(-c2nn[n-]n2)cs1 ZINC000823396037 606463604 /nfs/dbraw/zinc/46/36/04/606463604.db2.gz DDODTBLBRGSPPT-UHFFFAOYSA-N -1 3 360.398 3.855 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1N1CCCC[C@@H]1Cc1ccccc1 ZINC000822562550 606476090 /nfs/dbraw/zinc/47/60/90/606476090.db2.gz AYTGMDAPMZMBNH-OAHLLOKOSA-N -1 3 354.845 3.517 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1N1CCCC[C@@H]1Cc1ccccc1 ZINC000822562550 606476092 /nfs/dbraw/zinc/47/60/92/606476092.db2.gz AYTGMDAPMZMBNH-OAHLLOKOSA-N -1 3 354.845 3.517 20 0 FHADHM Cc1ccc([C@@H]2CCCCN2c2ncc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000822233738 606476382 /nfs/dbraw/zinc/47/63/82/606476382.db2.gz UJHGCZIDNIQSPX-INIZCTEOSA-N -1 3 354.845 3.955 20 0 FHADHM Cc1ccc([C@@H]2CCCCN2c2ncc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000822233738 606476383 /nfs/dbraw/zinc/47/63/83/606476383.db2.gz UJHGCZIDNIQSPX-INIZCTEOSA-N -1 3 354.845 3.955 20 0 FHADHM C[C@@H](c1cc2ccccc2o1)N(C)C(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000820555043 606488175 /nfs/dbraw/zinc/48/81/75/606488175.db2.gz FCQFTLXKOSUVRK-JTQLQIEISA-N -1 3 353.407 3.508 20 0 FHADHM C[C@@H](c1cc2ccccc2o1)N(C)C(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000820555043 606488177 /nfs/dbraw/zinc/48/81/77/606488177.db2.gz FCQFTLXKOSUVRK-JTQLQIEISA-N -1 3 353.407 3.508 20 0 FHADHM Cc1ccc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CC[C@@H](C)C3)c(F)c1 ZINC000822227247 606489440 /nfs/dbraw/zinc/48/94/40/606489440.db2.gz AXRGBCDWBOGJEY-SNVBAGLBSA-N -1 3 371.441 3.753 20 0 FHADHM Cc1ccc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CC[C@@H](C)C3)c(F)c1 ZINC000822227247 606489441 /nfs/dbraw/zinc/48/94/41/606489441.db2.gz AXRGBCDWBOGJEY-SNVBAGLBSA-N -1 3 371.441 3.753 20 0 FHADHM C[C@H](c1ccccc1Cl)N(C(=O)c1cc(-c2nnn[n-]2)cs1)C1CC1 ZINC000820570286 606490035 /nfs/dbraw/zinc/49/00/35/606490035.db2.gz GIWGJXDZSCKPSC-SNVBAGLBSA-N -1 3 373.869 3.947 20 0 FHADHM C[C@H](c1ccccc1Cl)N(C(=O)c1cc(-c2nn[n-]n2)cs1)C1CC1 ZINC000820570286 606490037 /nfs/dbraw/zinc/49/00/37/606490037.db2.gz GIWGJXDZSCKPSC-SNVBAGLBSA-N -1 3 373.869 3.947 20 0 FHADHM O=C(c1cc(-c2nnn[n-]2)cs1)N1CCC[C@H]1c1ccc(Cl)cc1 ZINC000823472334 606491547 /nfs/dbraw/zinc/49/15/47/606491547.db2.gz INBHNKRHQHMBTB-ZDUSSCGKSA-N -1 3 359.842 3.559 20 0 FHADHM O=C(c1cc(-c2nn[n-]n2)cs1)N1CCC[C@H]1c1ccc(Cl)cc1 ZINC000823472334 606491549 /nfs/dbraw/zinc/49/15/49/606491549.db2.gz INBHNKRHQHMBTB-ZDUSSCGKSA-N -1 3 359.842 3.559 20 0 FHADHM O=C(c1cc(-c2nnn[n-]2)cs1)N1CCCCC[C@@H]1c1ccccc1 ZINC000823472483 606496854 /nfs/dbraw/zinc/49/68/54/606496854.db2.gz OCVCOMNKHHJLIF-OAHLLOKOSA-N -1 3 353.451 3.686 20 0 FHADHM O=C(c1cc(-c2nn[n-]n2)cs1)N1CCCCC[C@@H]1c1ccccc1 ZINC000823472483 606496855 /nfs/dbraw/zinc/49/68/55/606496855.db2.gz OCVCOMNKHHJLIF-OAHLLOKOSA-N -1 3 353.451 3.686 20 0 FHADHM Fc1ccc(CN(Cc2cccs2)CC(F)(F)F)c(-c2nnn[n-]2)c1 ZINC000822766365 606506720 /nfs/dbraw/zinc/50/67/20/606506720.db2.gz IFJWYRWVBGNWNK-UHFFFAOYSA-N -1 3 371.363 3.632 20 0 FHADHM Fc1ccc(CN(Cc2cccs2)CC(F)(F)F)c(-c2nn[n-]n2)c1 ZINC000822766365 606506721 /nfs/dbraw/zinc/50/67/21/606506721.db2.gz IFJWYRWVBGNWNK-UHFFFAOYSA-N -1 3 371.363 3.632 20 0 FHADHM O=C(CCC1CCC1)N(Cc1ccco1)c1ccccc1-c1nnn[n-]1 ZINC000822950215 606507408 /nfs/dbraw/zinc/50/74/08/606507408.db2.gz FTSWFIZZFQQMCQ-UHFFFAOYSA-N -1 3 351.410 3.573 20 0 FHADHM O=C(CCC1CCC1)N(Cc1ccco1)c1ccccc1-c1nn[n-]n1 ZINC000822950215 606507410 /nfs/dbraw/zinc/50/74/10/606507410.db2.gz FTSWFIZZFQQMCQ-UHFFFAOYSA-N -1 3 351.410 3.573 20 0 FHADHM CCN(C(=O)Cc1cccc(-c2nnn[n-]2)c1)c1cccc2ccccc21 ZINC000821154095 606508185 /nfs/dbraw/zinc/50/81/85/606508185.db2.gz JGVBMEXNCKOYHA-UHFFFAOYSA-N -1 3 357.417 3.616 20 0 FHADHM CCN(C(=O)Cc1cccc(-c2nn[n-]n2)c1)c1cccc2ccccc21 ZINC000821154095 606508187 /nfs/dbraw/zinc/50/81/87/606508187.db2.gz JGVBMEXNCKOYHA-UHFFFAOYSA-N -1 3 357.417 3.616 20 0 FHADHM Cc1cccc([C@@H]2CCCCN2C(=O)c2cc(-c3nnn[n-]3)cs2)c1C ZINC000822299345 606521890 /nfs/dbraw/zinc/52/18/90/606521890.db2.gz GEMWLYFMSXANJH-INIZCTEOSA-N -1 3 367.478 3.912 20 0 FHADHM Cc1cccc([C@@H]2CCCCN2C(=O)c2cc(-c3nn[n-]n3)cs2)c1C ZINC000822299345 606521892 /nfs/dbraw/zinc/52/18/92/606521892.db2.gz GEMWLYFMSXANJH-INIZCTEOSA-N -1 3 367.478 3.912 20 0 FHADHM O=C(c1cc(-c2nnn[n-]2)cs1)N1CCC[C@@H]1c1ccccc1Cl ZINC000823472138 606539214 /nfs/dbraw/zinc/53/92/14/606539214.db2.gz BGKSGPKPKXZCID-CYBMUJFWSA-N -1 3 359.842 3.559 20 0 FHADHM O=C(c1cc(-c2nn[n-]n2)cs1)N1CCC[C@@H]1c1ccccc1Cl ZINC000823472138 606539216 /nfs/dbraw/zinc/53/92/16/606539216.db2.gz BGKSGPKPKXZCID-CYBMUJFWSA-N -1 3 359.842 3.559 20 0 FHADHM FC(F)Oc1cc(-c2nnn[n-]2)ccc1CSc1ccc(Cl)cn1 ZINC000822732039 606589987 /nfs/dbraw/zinc/58/99/87/606589987.db2.gz HJUCTEZUIZVVBS-UHFFFAOYSA-N -1 3 369.784 3.809 20 0 FHADHM FC(F)Oc1cc(-c2nn[n-]n2)ccc1CSc1ccc(Cl)cn1 ZINC000822732039 606589990 /nfs/dbraw/zinc/58/99/90/606589990.db2.gz HJUCTEZUIZVVBS-UHFFFAOYSA-N -1 3 369.784 3.809 20 0 FHADHM Cc1nc(SCc2ccc(-c3nnn[n-]3)cc2OC(F)F)sc1C ZINC000822454569 606591031 /nfs/dbraw/zinc/59/10/31/606591031.db2.gz YFQCWVIGFYHWQV-UHFFFAOYSA-N -1 3 369.422 3.834 20 0 FHADHM Cc1nc(SCc2ccc(-c3nn[n-]n3)cc2OC(F)F)sc1C ZINC000822454569 606591033 /nfs/dbraw/zinc/59/10/33/606591033.db2.gz YFQCWVIGFYHWQV-UHFFFAOYSA-N -1 3 369.422 3.834 20 0 FHADHM Cc1cccn2cc(CS[C@H](C)c3ccc(-c4nnn[n-]4)cc3)nc12 ZINC000822366143 606598775 /nfs/dbraw/zinc/59/87/75/606598775.db2.gz DIZLDRZHZOVZAP-CYBMUJFWSA-N -1 3 350.451 3.817 20 0 FHADHM Cc1cccn2cc(CS[C@H](C)c3ccc(-c4nn[n-]n4)cc3)nc12 ZINC000822366143 606598776 /nfs/dbraw/zinc/59/87/76/606598776.db2.gz DIZLDRZHZOVZAP-CYBMUJFWSA-N -1 3 350.451 3.817 20 0 FHADHM Cc1cc(CCCC(=O)Nc2cc(-c3nnn[n-]3)ccc2C)c(C)s1 ZINC000822200045 606602922 /nfs/dbraw/zinc/60/29/22/606602922.db2.gz RXQJOWPUBUQQQS-UHFFFAOYSA-N -1 3 355.467 3.815 20 0 FHADHM Cc1cc(CCCC(=O)Nc2cc(-c3nn[n-]n3)ccc2C)c(C)s1 ZINC000822200045 606602923 /nfs/dbraw/zinc/60/29/23/606602923.db2.gz RXQJOWPUBUQQQS-UHFFFAOYSA-N -1 3 355.467 3.815 20 0 FHADHM COc1cccc([C@H](C)CC(=O)O[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000821859361 606613132 /nfs/dbraw/zinc/61/31/32/606613132.db2.gz NNIOMBGPHXHERI-KGLIPLIRSA-N -1 3 366.421 3.673 20 0 FHADHM COc1cccc([C@H](C)CC(=O)O[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000821859361 606613133 /nfs/dbraw/zinc/61/31/33/606613133.db2.gz NNIOMBGPHXHERI-KGLIPLIRSA-N -1 3 366.421 3.673 20 0 FHADHM COc1ccc([C@@H](C)CC(=O)Nc2ccc(Cl)c(-c3nnn[n-]3)c2)cc1 ZINC000821777979 606624988 /nfs/dbraw/zinc/62/49/88/606624988.db2.gz QSKLYTBMNSXIQE-NSHDSACASA-N -1 3 371.828 3.661 20 0 FHADHM COc1ccc([C@@H](C)CC(=O)Nc2ccc(Cl)c(-c3nn[n-]n3)c2)cc1 ZINC000821777979 606624990 /nfs/dbraw/zinc/62/49/90/606624990.db2.gz QSKLYTBMNSXIQE-NSHDSACASA-N -1 3 371.828 3.661 20 0 FHADHM CC(=CC(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1cccc(Cl)c1 ZINC000819766036 606626011 /nfs/dbraw/zinc/62/60/11/606626011.db2.gz UOBTWLZGJQDAEO-XSNHNAGMSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=CC(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1cccc(Cl)c1 ZINC000819766036 606626013 /nfs/dbraw/zinc/62/60/13/606626013.db2.gz UOBTWLZGJQDAEO-XSNHNAGMSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=CC(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1)c1cccc(Cl)c1 ZINC000819766132 606626275 /nfs/dbraw/zinc/62/62/75/606626275.db2.gz VNFPCTWWXYNFGZ-UKTHLTGXSA-N -1 3 367.840 3.582 20 0 FHADHM CC(=CC(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1)c1cccc(Cl)c1 ZINC000819766132 606626276 /nfs/dbraw/zinc/62/62/76/606626276.db2.gz VNFPCTWWXYNFGZ-UKTHLTGXSA-N -1 3 367.840 3.582 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NCc1csc(C2CCCCC2)n1 ZINC000821765557 606656418 /nfs/dbraw/zinc/65/64/18/606656418.db2.gz FZBMFFQPIYEHMB-UHFFFAOYSA-N -1 3 370.482 3.992 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NCc1csc(C2CCCCC2)n1 ZINC000821765557 606656419 /nfs/dbraw/zinc/65/64/19/606656419.db2.gz FZBMFFQPIYEHMB-UHFFFAOYSA-N -1 3 370.482 3.992 20 0 FHADHM CCCc1nc(CNc2cc(-c3nnn[n-]3)ccc2OC(C)C)cs1 ZINC000821143050 606656569 /nfs/dbraw/zinc/65/65/69/606656569.db2.gz PRLJKGORTZYKKD-UHFFFAOYSA-N -1 3 358.471 3.675 20 0 FHADHM CCCc1nc(CNc2cc(-c3nn[n-]n3)ccc2OC(C)C)cs1 ZINC000821143050 606656570 /nfs/dbraw/zinc/65/65/70/606656570.db2.gz PRLJKGORTZYKKD-UHFFFAOYSA-N -1 3 358.471 3.675 20 0 FHADHM c1sc(CCc2ccccc2)nc1CNc1cccc(-c2nnn[n-]2)c1 ZINC000823779343 606657220 /nfs/dbraw/zinc/65/72/20/606657220.db2.gz AROYRMDZBQOKBE-UHFFFAOYSA-N -1 3 362.462 3.721 20 0 FHADHM c1sc(CCc2ccccc2)nc1CNc1cccc(-c2nn[n-]n2)c1 ZINC000823779343 606657221 /nfs/dbraw/zinc/65/72/21/606657221.db2.gz AROYRMDZBQOKBE-UHFFFAOYSA-N -1 3 362.462 3.721 20 0 FHADHM CCCCN(C(=O)c1c(F)cc(-c2nnn[n-]2)cc1F)c1ccccc1 ZINC000821061576 606665243 /nfs/dbraw/zinc/66/52/43/606665243.db2.gz QZPAIFGHTVQELL-UHFFFAOYSA-N -1 3 357.364 3.592 20 0 FHADHM CCCCN(C(=O)c1c(F)cc(-c2nn[n-]n2)cc1F)c1ccccc1 ZINC000821061576 606665244 /nfs/dbraw/zinc/66/52/44/606665244.db2.gz QZPAIFGHTVQELL-UHFFFAOYSA-N -1 3 357.364 3.592 20 0 FHADHM Cc1ccc(C)c(N(C(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)C(C)C)c1 ZINC000822232273 606676924 /nfs/dbraw/zinc/67/69/24/606676924.db2.gz ZIIICWZMFJZGQU-UHFFFAOYSA-N -1 3 371.391 3.817 20 0 FHADHM Cc1ccc(C)c(N(C(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)C(C)C)c1 ZINC000822232273 606676925 /nfs/dbraw/zinc/67/69/25/606676925.db2.gz ZIIICWZMFJZGQU-UHFFFAOYSA-N -1 3 371.391 3.817 20 0 FHADHM CC(C)[C@@H]1CCN(C(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)C1 ZINC000820037766 606689167 /nfs/dbraw/zinc/68/91/67/606689167.db2.gz HNOCFPBLYDOLEH-OAHLLOKOSA-N -1 3 361.449 3.652 20 0 FHADHM CC(C)[C@@H]1CCN(C(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)C1 ZINC000820037766 606689168 /nfs/dbraw/zinc/68/91/68/606689168.db2.gz HNOCFPBLYDOLEH-OAHLLOKOSA-N -1 3 361.449 3.652 20 0 FHADHM C[C@@H]1CN(C(=S)Nc2ccccc2-c2nnn[n-]2)c2ccccc2S1 ZINC000820742875 606694822 /nfs/dbraw/zinc/69/48/22/606694822.db2.gz NEGJHMQFVUHRJD-LLVKDONJSA-N -1 3 368.491 3.564 20 0 FHADHM C[C@@H]1CN(C(=S)Nc2ccccc2-c2nn[n-]n2)c2ccccc2S1 ZINC000820742875 606694823 /nfs/dbraw/zinc/69/48/23/606694823.db2.gz NEGJHMQFVUHRJD-LLVKDONJSA-N -1 3 368.491 3.564 20 0 FHADHM Cc1nc(CSCCCOc2ccc(-c3nn[n-]n3)cc2)sc1C ZINC000822444125 606695416 /nfs/dbraw/zinc/69/54/16/606695416.db2.gz CEDYUBGNNRLSOM-UHFFFAOYSA-N -1 3 361.496 3.642 20 0 FHADHM Cc1cc(O)c(C(C)C)cc1NC(=O)CCc1ccc(-c2nnn[n-]2)cc1 ZINC000822210706 606702557 /nfs/dbraw/zinc/70/25/57/606702557.db2.gz OAAIDXSIJCCRLZ-UHFFFAOYSA-N -1 3 365.437 3.575 20 0 FHADHM Cc1cc(O)c(C(C)C)cc1NC(=O)CCc1ccc(-c2nn[n-]n2)cc1 ZINC000822210706 606702558 /nfs/dbraw/zinc/70/25/58/606702558.db2.gz OAAIDXSIJCCRLZ-UHFFFAOYSA-N -1 3 365.437 3.575 20 0 FHADHM COCC[C@H](C)Sc1nc2c(c(-c3ccco3)c1-c1nnn[n-]1)CCC2 ZINC000821685505 606703968 /nfs/dbraw/zinc/70/39/68/606703968.db2.gz GGPMZTUOADVHRA-NSHDSACASA-N -1 3 371.466 3.528 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)ccc1OCc1nc(C(C)(C)C)cs1 ZINC000821395305 606704220 /nfs/dbraw/zinc/70/42/20/606704220.db2.gz VSXLCSUPZPCOOI-UHFFFAOYSA-N -1 3 359.455 3.598 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)ccc1OCc1nc(C(C)(C)C)cs1 ZINC000821395305 606704222 /nfs/dbraw/zinc/70/42/22/606704222.db2.gz VSXLCSUPZPCOOI-UHFFFAOYSA-N -1 3 359.455 3.598 20 0 FHADHM FC(F)(F)c1cc(NCCc2ccc(Cl)nc2)ccc1-c1nnn[n-]1 ZINC000822723702 606721858 /nfs/dbraw/zinc/72/18/58/606721858.db2.gz LFPNYUFFEAYPSV-UHFFFAOYSA-N -1 3 368.750 3.589 20 0 FHADHM FC(F)(F)c1cc(NCCc2ccc(Cl)nc2)ccc1-c1nn[n-]n1 ZINC000822723702 606721860 /nfs/dbraw/zinc/72/18/60/606721860.db2.gz LFPNYUFFEAYPSV-UHFFFAOYSA-N -1 3 368.750 3.589 20 0 FHADHM Cc1nc(C)c(-c2nnn[n-]2)c(S[C@@H](C)CCSc2ccccc2)n1 ZINC000822427810 606769260 /nfs/dbraw/zinc/76/92/60/606769260.db2.gz VQQVBINABXELNL-NSHDSACASA-N -1 3 372.523 3.937 20 0 FHADHM Cc1nc(C)c(-c2nn[n-]n2)c(S[C@@H](C)CCSc2ccccc2)n1 ZINC000822427810 606769261 /nfs/dbraw/zinc/76/92/61/606769261.db2.gz VQQVBINABXELNL-NSHDSACASA-N -1 3 372.523 3.937 20 0 FHADHM Fc1cc2cccnc2c(COc2cc(Cl)ccc2-c2nnn[n-]2)c1 ZINC000822748084 606781417 /nfs/dbraw/zinc/78/14/17/606781417.db2.gz GTVZGSRQGTWXGF-UHFFFAOYSA-N -1 3 355.760 3.786 20 0 FHADHM Fc1cc2cccnc2c(COc2cc(Cl)ccc2-c2nn[n-]n2)c1 ZINC000822748084 606781418 /nfs/dbraw/zinc/78/14/18/606781418.db2.gz GTVZGSRQGTWXGF-UHFFFAOYSA-N -1 3 355.760 3.786 20 0 FHADHM CCC1(C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)CC(C)C)CCCC1 ZINC000820944351 606848157 /nfs/dbraw/zinc/84/81/57/606848157.db2.gz LMXSMMGAOPMPET-UHFFFAOYSA-N -1 3 355.486 3.822 20 0 FHADHM CCC1(C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)CC(C)C)CCCC1 ZINC000820944351 606848159 /nfs/dbraw/zinc/84/81/59/606848159.db2.gz LMXSMMGAOPMPET-UHFFFAOYSA-N -1 3 355.486 3.822 20 0 FHADHM CC(C)N(C(=O)[C@H](C)Sc1ccc(-c2nnn[n-]2)cc1Cl)C(C)C ZINC000820549524 606852948 /nfs/dbraw/zinc/85/29/48/606852948.db2.gz OMHIAATWFHVTGQ-NSHDSACASA-N -1 3 367.906 3.646 20 0 FHADHM CC(C)N(C(=O)[C@H](C)Sc1ccc(-c2nn[n-]n2)cc1Cl)C(C)C ZINC000820549524 606852949 /nfs/dbraw/zinc/85/29/49/606852949.db2.gz OMHIAATWFHVTGQ-NSHDSACASA-N -1 3 367.906 3.646 20 0 FHADHM O[C@@H](CSc1ccc(Cl)c(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000823697025 606863321 /nfs/dbraw/zinc/86/33/21/606863321.db2.gz IBQVKJSPIKBOIM-AWEZNQCLSA-N -1 3 367.261 3.999 20 0 FHADHM O[C@@H](CSc1ccc(Cl)c(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000823697025 606863322 /nfs/dbraw/zinc/86/33/22/606863322.db2.gz IBQVKJSPIKBOIM-AWEZNQCLSA-N -1 3 367.261 3.999 20 0 FHADHM Fc1cc(Cl)cc(NCc2ccc(-c3nnn[n-]3)cc2OC(F)F)c1 ZINC000822748015 606866340 /nfs/dbraw/zinc/86/63/40/606866340.db2.gz CRKYSIZSNNRUMO-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM Fc1cc(Cl)cc(NCc2ccc(-c3nn[n-]n3)cc2OC(F)F)c1 ZINC000822748015 606866342 /nfs/dbraw/zinc/86/63/42/606866342.db2.gz CRKYSIZSNNRUMO-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM CC[C@H](Sc1ccc(-c2nnn[n-]2)cn1)C(=O)c1ccc(Cl)cc1 ZINC000820939069 606866558 /nfs/dbraw/zinc/86/65/58/606866558.db2.gz PTQJBOPPNHIVRZ-ZDUSSCGKSA-N -1 3 359.842 3.669 20 0 FHADHM CC[C@H](Sc1ccc(-c2nn[n-]n2)cn1)C(=O)c1ccc(Cl)cc1 ZINC000820939069 606866559 /nfs/dbraw/zinc/86/65/59/606866559.db2.gz PTQJBOPPNHIVRZ-ZDUSSCGKSA-N -1 3 359.842 3.669 20 0 FHADHM CCN(C(=O)c1cccc(Cl)c1F)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821161018 606871849 /nfs/dbraw/zinc/87/18/49/606871849.db2.gz TURWQKPVUIECMY-LLVKDONJSA-N -1 3 373.819 3.883 20 0 FHADHM CCN(C(=O)c1cccc(Cl)c1F)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821161018 606871850 /nfs/dbraw/zinc/87/18/50/606871850.db2.gz TURWQKPVUIECMY-LLVKDONJSA-N -1 3 373.819 3.883 20 0 FHADHM O[C@@H](CNc1c(Cl)cccc1-c1nnn[n-]1)c1cc2ccccc2s1 ZINC000823690774 606878094 /nfs/dbraw/zinc/87/80/94/606878094.db2.gz UCZHHYXWZMTMMR-ZDUSSCGKSA-N -1 3 371.853 3.880 20 0 FHADHM O[C@@H](CNc1c(Cl)cccc1-c1nn[n-]n1)c1cc2ccccc2s1 ZINC000823690774 606878095 /nfs/dbraw/zinc/87/80/95/606878095.db2.gz UCZHHYXWZMTMMR-ZDUSSCGKSA-N -1 3 371.853 3.880 20 0 FHADHM O[C@@H](CNc1c(F)cc(-c2nnn[n-]2)cc1F)c1cc2ccccc2s1 ZINC000823689664 606878356 /nfs/dbraw/zinc/87/83/56/606878356.db2.gz IJXGARQRLNPBOZ-ZDUSSCGKSA-N -1 3 373.388 3.505 20 0 FHADHM O[C@@H](CNc1c(F)cc(-c2nn[n-]n2)cc1F)c1cc2ccccc2s1 ZINC000823689664 606878358 /nfs/dbraw/zinc/87/83/58/606878358.db2.gz IJXGARQRLNPBOZ-ZDUSSCGKSA-N -1 3 373.388 3.505 20 0 FHADHM Fc1ccc(N[C@@H]2CC3(CCC3)Oc3ccccc32)c(-c2nnn[n-]2)c1 ZINC000822778044 606879878 /nfs/dbraw/zinc/87/98/78/606879878.db2.gz BCPXVFIAHIYYMF-MRXNPFEDSA-N -1 3 351.385 3.864 20 0 FHADHM Fc1ccc(N[C@@H]2CC3(CCC3)Oc3ccccc32)c(-c2nn[n-]n2)c1 ZINC000822778044 606879880 /nfs/dbraw/zinc/87/98/80/606879880.db2.gz BCPXVFIAHIYYMF-MRXNPFEDSA-N -1 3 351.385 3.864 20 0 FHADHM FC(F)(F)c1ccccc1C1=CCN(c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC000822728962 606880809 /nfs/dbraw/zinc/88/08/09/606880809.db2.gz OYJKSZDJVDGMOA-UHFFFAOYSA-N -1 3 372.354 3.574 20 0 FHADHM FC(F)(F)c1ccccc1C1=CCN(c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC000822728962 606880810 /nfs/dbraw/zinc/88/08/10/606880810.db2.gz OYJKSZDJVDGMOA-UHFFFAOYSA-N -1 3 372.354 3.574 20 0 FHADHM CC(C)N(Cc1ccn(C2CCCC2)n1)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000820121212 606889535 /nfs/dbraw/zinc/88/95/35/606889535.db2.gz NBDPTMFJXLQQQD-UHFFFAOYSA-N -1 3 365.485 3.589 20 0 FHADHM Cc1ccc(NCc2ccc(F)c(-c3nnn[n-]3)c2)cc1Br ZINC000822258700 606928371 /nfs/dbraw/zinc/92/83/71/606928371.db2.gz ANLNDRZRMBFZBB-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Cc1ccc(NCc2ccc(F)c(-c3nn[n-]n3)c2)cc1Br ZINC000822258700 606928373 /nfs/dbraw/zinc/92/83/73/606928373.db2.gz ANLNDRZRMBFZBB-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Cc1c(C)c(C)c(C[S@@](=O)Cc2ccc(-c3nnn[n-]3)cc2)c(C)c1C ZINC000822020367 606978994 /nfs/dbraw/zinc/97/89/94/606978994.db2.gz AMNXDJJSKKACHC-SANMLTNESA-N -1 3 368.506 3.858 20 0 FHADHM Cc1c(C)c(C)c(C[S@@](=O)Cc2ccc(-c3nn[n-]n3)cc2)c(C)c1C ZINC000822020367 606978995 /nfs/dbraw/zinc/97/89/95/606978995.db2.gz AMNXDJJSKKACHC-SANMLTNESA-N -1 3 368.506 3.858 20 0 FHADHM C[C@H](C(=O)OCc1ccc(F)c(-c2nnn[n-]2)c1)c1ccc(Cl)s1 ZINC000819884429 607001226 /nfs/dbraw/zinc/00/12/26/607001226.db2.gz WRTYIOZQGMJJLU-QMMMGPOBSA-N -1 3 366.805 3.568 20 0 FHADHM C[C@H](C(=O)OCc1ccc(F)c(-c2nn[n-]n2)c1)c1ccc(Cl)s1 ZINC000819884429 607001228 /nfs/dbraw/zinc/00/12/28/607001228.db2.gz WRTYIOZQGMJJLU-QMMMGPOBSA-N -1 3 366.805 3.568 20 0 FHADHM Cc1cc(Cl)ccc1C(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(C)C ZINC000822202055 607001408 /nfs/dbraw/zinc/00/14/08/607001408.db2.gz JGECLRWPYNMAPQ-UHFFFAOYSA-N -1 3 371.828 3.868 20 0 FHADHM Cc1cc(Cl)ccc1C(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(C)C ZINC000822202055 607001410 /nfs/dbraw/zinc/00/14/10/607001410.db2.gz JGECLRWPYNMAPQ-UHFFFAOYSA-N -1 3 371.828 3.868 20 0 FHADHM Cc1ccsc1-c1nnc(SCc2ccc(F)c(-c3nnn[n-]3)c2)o1 ZINC000822379124 607008821 /nfs/dbraw/zinc/00/88/21/607008821.db2.gz KQNJWCIWZQZQSK-UHFFFAOYSA-N -1 3 374.426 3.718 20 0 FHADHM Cc1ccsc1-c1nnc(SCc2ccc(F)c(-c3nn[n-]n3)c2)o1 ZINC000822379124 607008822 /nfs/dbraw/zinc/00/88/22/607008822.db2.gz KQNJWCIWZQZQSK-UHFFFAOYSA-N -1 3 374.426 3.718 20 0 FHADHM CC1CCC(N(C(=O)CSc2cccc(-c3nnn[n-]3)c2)C2CC2)CC1 ZINC000820690527 607010035 /nfs/dbraw/zinc/01/00/35/607010035.db2.gz NJAWZNWVKKQDOV-UHFFFAOYSA-N -1 3 371.510 3.529 20 0 FHADHM CC1CCC(N(C(=O)CSc2cccc(-c3nn[n-]n3)c2)C2CC2)CC1 ZINC000820690527 607010036 /nfs/dbraw/zinc/01/00/36/607010036.db2.gz NJAWZNWVKKQDOV-UHFFFAOYSA-N -1 3 371.510 3.529 20 0 FHADHM Cc1cc(C)c(NC(=O)CSc2cccc(-c3nnn[n-]3)c2)c(Cl)c1 ZINC000822194247 607010239 /nfs/dbraw/zinc/01/02/39/607010239.db2.gz OYFREEOAGLFBLB-UHFFFAOYSA-N -1 3 373.869 3.868 20 0 FHADHM Cc1cc(C)c(NC(=O)CSc2cccc(-c3nn[n-]n3)c2)c(Cl)c1 ZINC000822194247 607010242 /nfs/dbraw/zinc/01/02/42/607010242.db2.gz OYFREEOAGLFBLB-UHFFFAOYSA-N -1 3 373.869 3.868 20 0 FHADHM O=C(CSc1cccc(-c2nnn[n-]2)c1)c1cccc(C(F)(F)F)c1 ZINC000823070589 607012741 /nfs/dbraw/zinc/01/27/41/607012741.db2.gz GHLCNIQTWXUBJW-UHFFFAOYSA-N -1 3 364.352 3.861 20 0 FHADHM O=C(CSc1cccc(-c2nn[n-]n2)c1)c1cccc(C(F)(F)F)c1 ZINC000823070589 607012742 /nfs/dbraw/zinc/01/27/42/607012742.db2.gz GHLCNIQTWXUBJW-UHFFFAOYSA-N -1 3 364.352 3.861 20 0 FHADHM c1csc(-c2noc(CCCSc3cccc(-c4nnn[n-]4)c3)n2)c1 ZINC000823761961 607012935 /nfs/dbraw/zinc/01/29/35/607012935.db2.gz BXLMSNUWJAXODN-UHFFFAOYSA-N -1 3 370.463 3.703 20 0 FHADHM c1csc(-c2noc(CCCSc3cccc(-c4nn[n-]n4)c3)n2)c1 ZINC000823761961 607012937 /nfs/dbraw/zinc/01/29/37/607012937.db2.gz BXLMSNUWJAXODN-UHFFFAOYSA-N -1 3 370.463 3.703 20 0 FHADHM Cc1ccc(CS[C@H](C)C(=O)Nc2ccccc2-c2nnn[n-]2)cc1C ZINC000822239844 607017728 /nfs/dbraw/zinc/01/77/28/607017728.db2.gz HCXHWHVDBVVHFH-CQSZACIVSA-N -1 3 367.478 3.744 20 0 FHADHM Cc1ccc(CS[C@H](C)C(=O)Nc2ccccc2-c2nn[n-]n2)cc1C ZINC000822239844 607017730 /nfs/dbraw/zinc/01/77/30/607017730.db2.gz HCXHWHVDBVVHFH-CQSZACIVSA-N -1 3 367.478 3.744 20 0 FHADHM CCC(=CC(=O)Nc1ncc(Cc2ccc(-c3nnn[n-]3)cc2)s1)CC ZINC000820833574 607027451 /nfs/dbraw/zinc/02/74/51/607027451.db2.gz ZCVUYXPEFOPONI-UHFFFAOYSA-N -1 3 368.466 3.599 20 0 FHADHM CCC(=CC(=O)Nc1ncc(Cc2ccc(-c3nn[n-]n3)cc2)s1)CC ZINC000820833574 607027453 /nfs/dbraw/zinc/02/74/53/607027453.db2.gz ZCVUYXPEFOPONI-UHFFFAOYSA-N -1 3 368.466 3.599 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1OCc1ccc(SC(=O)N(C)C)cc1 ZINC000822221636 607030352 /nfs/dbraw/zinc/03/03/52/607030352.db2.gz YJQLRPYRPKJIMQ-UHFFFAOYSA-N -1 3 369.450 3.528 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1OCc1ccc(SC(=O)N(C)C)cc1 ZINC000822221636 607030354 /nfs/dbraw/zinc/03/03/54/607030354.db2.gz YJQLRPYRPKJIMQ-UHFFFAOYSA-N -1 3 369.450 3.528 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1OCC(=O)Nc1c(C)cccc1C(C)C ZINC000822221388 607031329 /nfs/dbraw/zinc/03/13/29/607031329.db2.gz MSGUMXWDCXVZFG-UHFFFAOYSA-N -1 3 365.437 3.624 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1OCC(=O)Nc1c(C)cccc1C(C)C ZINC000822221388 607031331 /nfs/dbraw/zinc/03/13/31/607031331.db2.gz MSGUMXWDCXVZFG-UHFFFAOYSA-N -1 3 365.437 3.624 20 0 FHADHM Cc1cccc([C@@H]2CCCN2c2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)n1 ZINC000822299580 607032647 /nfs/dbraw/zinc/03/26/47/607032647.db2.gz NPJQUZZWZDQAOC-INIZCTEOSA-N -1 3 374.370 3.930 20 0 FHADHM Cc1cccc([C@@H]2CCCN2c2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)n1 ZINC000822299580 607032649 /nfs/dbraw/zinc/03/26/49/607032649.db2.gz NPJQUZZWZDQAOC-INIZCTEOSA-N -1 3 374.370 3.930 20 0 FHADHM Cc1ccc(-c2nnc(SCc3cc(F)ccc3-c3nnn[n-]3)o2)cc1 ZINC000822214859 607037928 /nfs/dbraw/zinc/03/79/28/607037928.db2.gz AUUQKURGWHELMK-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM Cc1ccc(-c2nnc(SCc3cc(F)ccc3-c3nn[n-]n3)o2)cc1 ZINC000822214859 607037930 /nfs/dbraw/zinc/03/79/30/607037930.db2.gz AUUQKURGWHELMK-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM O=C(Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1)[C@@H]1CC12CCC2 ZINC000823350266 607123301 /nfs/dbraw/zinc/12/33/01/607123301.db2.gz GONMCCBDCUAURH-KRWDZBQOSA-N -1 3 361.405 3.788 20 0 FHADHM O=C(Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1)[C@@H]1CC12CCC2 ZINC000823350266 607123302 /nfs/dbraw/zinc/12/33/02/607123302.db2.gz GONMCCBDCUAURH-KRWDZBQOSA-N -1 3 361.405 3.788 20 0 FHADHM O=C(Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1)[C@H]1CC12CCC2 ZINC000823383025 607144646 /nfs/dbraw/zinc/14/46/46/607144646.db2.gz JRMMSISYBIFXNA-CYBMUJFWSA-N -1 3 351.435 3.724 20 0 FHADHM O=C(Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1)[C@H]1CC12CCC2 ZINC000823383025 607144648 /nfs/dbraw/zinc/14/46/48/607144648.db2.gz JRMMSISYBIFXNA-CYBMUJFWSA-N -1 3 351.435 3.724 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1ccc(F)c(Cl)c1 ZINC000821104407 607145281 /nfs/dbraw/zinc/14/52/81/607145281.db2.gz BTIDBBKJYOWABB-UHFFFAOYSA-N -1 3 373.819 3.712 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1ccc(F)c(Cl)c1 ZINC000821104407 607145283 /nfs/dbraw/zinc/14/52/83/607145283.db2.gz BTIDBBKJYOWABB-UHFFFAOYSA-N -1 3 373.819 3.712 20 0 FHADHM CC[C@@H](OC1CCCCC1)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820939477 607150232 /nfs/dbraw/zinc/15/02/32/607150232.db2.gz VNBOUSJWJCTFGR-OAHLLOKOSA-N -1 3 363.849 3.587 20 0 FHADHM CC[C@@H](OC1CCCCC1)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820939477 607150233 /nfs/dbraw/zinc/15/02/33/607150233.db2.gz VNBOUSJWJCTFGR-OAHLLOKOSA-N -1 3 363.849 3.587 20 0 FHADHM Cc1ccccc1-c1nc(CSCc2ccc(-c3nnn[n-]3)cc2)no1 ZINC000822346000 607151078 /nfs/dbraw/zinc/15/10/78/607151078.db2.gz ZFVKFXJDDMSDEB-UHFFFAOYSA-N -1 3 364.434 3.659 20 0 FHADHM Cc1ccccc1-c1nc(CSCc2ccc(-c3nn[n-]n3)cc2)no1 ZINC000822346000 607151080 /nfs/dbraw/zinc/15/10/80/607151080.db2.gz ZFVKFXJDDMSDEB-UHFFFAOYSA-N -1 3 364.434 3.659 20 0 FHADHM O=C(Nc1sc2c(c1-c1nnn[n-]1)CCC2)c1ccc2sccc2c1 ZINC000823387550 607151386 /nfs/dbraw/zinc/15/13/86/607151386.db2.gz OMZMDSLVNHPHGY-UHFFFAOYSA-N -1 3 367.459 3.884 20 0 FHADHM O=C(Nc1sc2c(c1-c1nn[n-]n1)CCC2)c1ccc2sccc2c1 ZINC000823387550 607151387 /nfs/dbraw/zinc/15/13/87/607151387.db2.gz OMZMDSLVNHPHGY-UHFFFAOYSA-N -1 3 367.459 3.884 20 0 FHADHM Cc1sc(NC(=O)[C@H](C)OC2CCCCCC2)c(-c2nnn[n-]2)c1C ZINC000822556940 607151703 /nfs/dbraw/zinc/15/17/03/607151703.db2.gz DJYNBVCSESDPGG-NSHDSACASA-N -1 3 363.487 3.611 20 0 FHADHM Cc1sc(NC(=O)[C@H](C)OC2CCCCCC2)c(-c2nn[n-]n2)c1C ZINC000822556940 607151704 /nfs/dbraw/zinc/15/17/04/607151704.db2.gz DJYNBVCSESDPGG-NSHDSACASA-N -1 3 363.487 3.611 20 0 FHADHM C[C@H](Sc1cc(-c2nnn[n-]2)ccn1)c1cccc(Br)c1 ZINC000820549250 607160945 /nfs/dbraw/zinc/16/09/45/607160945.db2.gz LFCOCANYNPVIIP-VIFPVBQESA-N -1 3 362.256 3.878 20 0 FHADHM C[C@H](Sc1cc(-c2nn[n-]n2)ccn1)c1cccc(Br)c1 ZINC000820549250 607160947 /nfs/dbraw/zinc/16/09/47/607160947.db2.gz LFCOCANYNPVIIP-VIFPVBQESA-N -1 3 362.256 3.878 20 0 FHADHM C[C@@H](CC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccccc1F ZINC000820225460 607189804 /nfs/dbraw/zinc/18/98/04/607189804.db2.gz JKWJEGQJZSWLDB-JTQLQIEISA-N -1 3 359.792 3.792 20 0 FHADHM C[C@@H](CC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccccc1F ZINC000820225460 607189805 /nfs/dbraw/zinc/18/98/05/607189805.db2.gz JKWJEGQJZSWLDB-JTQLQIEISA-N -1 3 359.792 3.792 20 0 FHADHM C[C@@H](SCc1ccccc1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820550536 607191590 /nfs/dbraw/zinc/19/15/90/607191590.db2.gz WRRNLWLHWQBBAA-LLVKDONJSA-N -1 3 373.869 3.781 20 0 FHADHM C[C@@H](SCc1ccccc1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820550536 607191591 /nfs/dbraw/zinc/19/15/91/607191591.db2.gz WRRNLWLHWQBBAA-LLVKDONJSA-N -1 3 373.869 3.781 20 0 FHADHM O=C(C[C@@H]1CCCc2ccccc21)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822945645 607192107 /nfs/dbraw/zinc/19/21/07/607192107.db2.gz MKEWQVXBTGUZFE-ZDUSSCGKSA-N -1 3 367.840 3.969 20 0 FHADHM O=C(C[C@@H]1CCCc2ccccc21)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822945645 607192108 /nfs/dbraw/zinc/19/21/08/607192108.db2.gz MKEWQVXBTGUZFE-ZDUSSCGKSA-N -1 3 367.840 3.969 20 0 FHADHM CCc1cc(C(=O)N(CC(C)C)c2ccc(-c3nnn[n-]3)cc2)oc1CC ZINC000821470456 607192556 /nfs/dbraw/zinc/19/25/56/607192556.db2.gz PLACICQSIBHTTK-UHFFFAOYSA-N -1 3 367.453 3.887 20 0 FHADHM CCc1cc(C(=O)N(CC(C)C)c2ccc(-c3nn[n-]n3)cc2)oc1CC ZINC000821470456 607192557 /nfs/dbraw/zinc/19/25/57/607192557.db2.gz PLACICQSIBHTTK-UHFFFAOYSA-N -1 3 367.453 3.887 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N1CCC[C@@H]1c1cccs1 ZINC000823315539 607197867 /nfs/dbraw/zinc/19/78/67/607197867.db2.gz ZDRMWWOWQFNGQU-CYBMUJFWSA-N -1 3 374.857 3.951 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N1CCC[C@@H]1c1cccs1 ZINC000823315539 607197868 /nfs/dbraw/zinc/19/78/68/607197868.db2.gz ZDRMWWOWQFNGQU-CYBMUJFWSA-N -1 3 374.857 3.951 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N1CCC2(C1)CCCCC2 ZINC000823313855 607201279 /nfs/dbraw/zinc/20/12/79/607201279.db2.gz KENFOJSDOHHASV-UHFFFAOYSA-N -1 3 360.849 3.708 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N1CCC2(C1)CCCCC2 ZINC000823313855 607201280 /nfs/dbraw/zinc/20/12/80/607201280.db2.gz KENFOJSDOHHASV-UHFFFAOYSA-N -1 3 360.849 3.708 20 0 FHADHM CCN(C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)[C@H](C)c1cccnc1 ZINC000821155315 607204369 /nfs/dbraw/zinc/20/43/69/607204369.db2.gz YBKSRUKWQBGBNB-LLVKDONJSA-N -1 3 371.832 3.530 20 0 FHADHM CCN(C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)[C@H](C)c1cccnc1 ZINC000821155315 607204370 /nfs/dbraw/zinc/20/43/70/607204370.db2.gz YBKSRUKWQBGBNB-LLVKDONJSA-N -1 3 371.832 3.530 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)cc1N1CCc2sccc2C1 ZINC000822723677 607227042 /nfs/dbraw/zinc/22/70/42/607227042.db2.gz KJPTXCKTDCOSLY-UHFFFAOYSA-N -1 3 351.357 3.510 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)cc1N1CCc2sccc2C1 ZINC000822723677 607227043 /nfs/dbraw/zinc/22/70/43/607227043.db2.gz KJPTXCKTDCOSLY-UHFFFAOYSA-N -1 3 351.357 3.510 20 0 FHADHM O=C(C=Cc1ccccc1Cl)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822934722 607240875 /nfs/dbraw/zinc/24/08/75/607240875.db2.gz CZFCXBFUVCQSPD-VURMDHGXSA-N -1 3 360.204 3.825 20 0 FHADHM O=C(C=Cc1ccccc1Cl)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822934722 607240876 /nfs/dbraw/zinc/24/08/76/607240876.db2.gz CZFCXBFUVCQSPD-VURMDHGXSA-N -1 3 360.204 3.825 20 0 FHADHM Cc1nc(C(C)C)sc1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822423685 607241596 /nfs/dbraw/zinc/24/15/96/607241596.db2.gz MMINFRLPSJAZEZ-UHFFFAOYSA-N -1 3 362.846 3.661 20 0 FHADHM Cc1nc(C(C)C)sc1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822423685 607241597 /nfs/dbraw/zinc/24/15/97/607241597.db2.gz MMINFRLPSJAZEZ-UHFFFAOYSA-N -1 3 362.846 3.661 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccc(OC2CCC2)cc1 ZINC000823319333 607241841 /nfs/dbraw/zinc/24/18/41/607241841.db2.gz SJFCYYNZVWAMTM-UHFFFAOYSA-N -1 3 369.812 3.704 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccc(OC2CCC2)cc1 ZINC000823319333 607241842 /nfs/dbraw/zinc/24/18/42/607241842.db2.gz SJFCYYNZVWAMTM-UHFFFAOYSA-N -1 3 369.812 3.704 20 0 FHADHM CC(C)(C)Oc1ccc(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000819951320 607243121 /nfs/dbraw/zinc/24/31/21/607243121.db2.gz SDOLLKMKDFYRJY-UHFFFAOYSA-N -1 3 371.828 3.950 20 0 FHADHM CC(C)(C)Oc1ccc(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000819951320 607243122 /nfs/dbraw/zinc/24/31/22/607243122.db2.gz SDOLLKMKDFYRJY-UHFFFAOYSA-N -1 3 371.828 3.950 20 0 FHADHM C[C@H](CSc1ccccc1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820293794 607243584 /nfs/dbraw/zinc/24/35/84/607243584.db2.gz OFQMZERAGNKOBA-LLVKDONJSA-N -1 3 373.869 3.887 20 0 FHADHM C[C@H](CSc1ccccc1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820293794 607243585 /nfs/dbraw/zinc/24/35/85/607243585.db2.gz OFQMZERAGNKOBA-LLVKDONJSA-N -1 3 373.869 3.887 20 0 FHADHM CC[C@@H](NC(=S)Nc1cccc(-c2nnn[n-]2)c1C)c1cccs1 ZINC000820919709 607251682 /nfs/dbraw/zinc/25/16/82/607251682.db2.gz FYBJZZSSASUXNJ-GFCCVEGCSA-N -1 3 358.496 3.674 20 0 FHADHM CC[C@@H](NC(=S)Nc1cccc(-c2nn[n-]n2)c1C)c1cccs1 ZINC000820919709 607251683 /nfs/dbraw/zinc/25/16/83/607251683.db2.gz FYBJZZSSASUXNJ-GFCCVEGCSA-N -1 3 358.496 3.674 20 0 FHADHM C[C@@H](C(=O)N(C)c1ccccc1-c1nnn[n-]1)c1ccc2ccccc2c1 ZINC000824041031 607787817 /nfs/dbraw/zinc/78/78/17/607787817.db2.gz XFXDJHBABVXJSD-CQSZACIVSA-N -1 3 357.417 3.786 20 0 FHADHM C[C@@H](C(=O)N(C)c1ccccc1-c1nn[n-]n1)c1ccc2ccccc2c1 ZINC000824041031 607787818 /nfs/dbraw/zinc/78/78/18/607787818.db2.gz XFXDJHBABVXJSD-CQSZACIVSA-N -1 3 357.417 3.786 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@@H]2C(=O)N(C)c2ccccc2-c2nnn[n-]2)cc1 ZINC000824347833 607787910 /nfs/dbraw/zinc/78/79/10/607787910.db2.gz PCCMTZNSIBJVLD-ROUUACIJSA-N -1 3 361.449 3.757 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@@H]2C(=O)N(C)c2ccccc2-c2nn[n-]n2)cc1 ZINC000824347833 607787911 /nfs/dbraw/zinc/78/79/11/607787911.db2.gz PCCMTZNSIBJVLD-ROUUACIJSA-N -1 3 361.449 3.757 20 0 FHADHM CN(C(=O)CCCCCc1cccs1)c1ccccc1-c1nnn[n-]1 ZINC000825817837 607790012 /nfs/dbraw/zinc/79/00/12/607790012.db2.gz QCOWQRMEVDRSMF-UHFFFAOYSA-N -1 3 355.467 3.694 20 0 FHADHM CN(C(=O)CCCCCc1cccs1)c1ccccc1-c1nn[n-]n1 ZINC000825817837 607790013 /nfs/dbraw/zinc/79/00/13/607790013.db2.gz QCOWQRMEVDRSMF-UHFFFAOYSA-N -1 3 355.467 3.694 20 0 FHADHM CCN(C(=O)C[C@H](C)c1ccccc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000825367986 607796499 /nfs/dbraw/zinc/79/64/99/607796499.db2.gz YYXJNNZHWUMAME-ZDUSSCGKSA-N -1 3 353.401 3.553 20 0 FHADHM CCN(C(=O)C[C@H](C)c1ccccc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000825367986 607796500 /nfs/dbraw/zinc/79/65/00/607796500.db2.gz YYXJNNZHWUMAME-ZDUSSCGKSA-N -1 3 353.401 3.553 20 0 FHADHM CCN(C(=O)c1cc2c(s1)CCCCC2)c1ccc(-c2nnn[n-]2)cc1 ZINC000825380983 607798297 /nfs/dbraw/zinc/79/82/97/607798297.db2.gz XXUCSUUABGTFBU-UHFFFAOYSA-N -1 3 367.478 3.864 20 0 FHADHM CCN(C(=O)c1cc2c(s1)CCCCC2)c1ccc(-c2nn[n-]n2)cc1 ZINC000825380983 607798298 /nfs/dbraw/zinc/79/82/98/607798298.db2.gz XXUCSUUABGTFBU-UHFFFAOYSA-N -1 3 367.478 3.864 20 0 FHADHM CCN(C(=O)c1csc2c1CC[C@@H](C)C2)c1ccc(-c2nnn[n-]2)cc1 ZINC000825391091 607799607 /nfs/dbraw/zinc/79/96/07/607799607.db2.gz UVTJGUYOWJIXDS-GFCCVEGCSA-N -1 3 367.478 3.720 20 0 FHADHM CCN(C(=O)c1csc2c1CC[C@@H](C)C2)c1ccc(-c2nn[n-]n2)cc1 ZINC000825391091 607799608 /nfs/dbraw/zinc/79/96/08/607799608.db2.gz UVTJGUYOWJIXDS-GFCCVEGCSA-N -1 3 367.478 3.720 20 0 FHADHM CCN(C(=O)[C@H]1C[C@]12CCCc1ccccc12)c1ccc(-c2nnn[n-]2)cc1 ZINC000825367361 607799737 /nfs/dbraw/zinc/79/97/37/607799737.db2.gz OEHZDUMEAAGOMG-KNQAVFIVSA-N -1 3 373.460 3.514 20 0 FHADHM CCN(C(=O)[C@H]1C[C@]12CCCc1ccccc12)c1ccc(-c2nn[n-]n2)cc1 ZINC000825367361 607799738 /nfs/dbraw/zinc/79/97/38/607799738.db2.gz OEHZDUMEAAGOMG-KNQAVFIVSA-N -1 3 373.460 3.514 20 0 FHADHM CCN(C(=O)C[C@@H](C)c1ccc(F)cc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000825367917 607799863 /nfs/dbraw/zinc/79/98/63/607799863.db2.gz XPIMPDDDZIBFMZ-GFCCVEGCSA-N -1 3 371.391 3.692 20 0 FHADHM CCN(C(=O)C[C@@H](C)c1ccc(F)cc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000825367917 607799864 /nfs/dbraw/zinc/79/98/64/607799864.db2.gz XPIMPDDDZIBFMZ-GFCCVEGCSA-N -1 3 371.391 3.692 20 0 FHADHM C[C@H](NC(=O)c1c(Cl)cc(-c2nnn[n-]2)cc1Cl)c1ccccc1 ZINC000824507441 607831909 /nfs/dbraw/zinc/83/19/09/607831909.db2.gz XLEPQIZTVDBYQZ-VIFPVBQESA-N -1 3 362.220 3.665 20 0 FHADHM C[C@H](NC(=O)c1c(Cl)cc(-c2nn[n-]n2)cc1Cl)c1ccccc1 ZINC000824507441 607831910 /nfs/dbraw/zinc/83/19/10/607831910.db2.gz XLEPQIZTVDBYQZ-VIFPVBQESA-N -1 3 362.220 3.665 20 0 FHADHM O=C(Nc1ccc(F)cc1)c1c(Cl)cc(-c2nnn[n-]2)cc1Cl ZINC000826453812 607832965 /nfs/dbraw/zinc/83/29/65/607832965.db2.gz AOTAJASKQJIJMI-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(F)cc1)c1c(Cl)cc(-c2nn[n-]n2)cc1Cl ZINC000826453812 607832966 /nfs/dbraw/zinc/83/29/66/607832966.db2.gz AOTAJASKQJIJMI-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM Cc1ccc([C@@H](C)NC(=O)c2c(Cl)cc(-c3nnn[n-]3)cc2Cl)o1 ZINC000826283387 607833369 /nfs/dbraw/zinc/83/33/69/607833369.db2.gz PPNSBIUAMYYGET-MRVPVSSYSA-N -1 3 366.208 3.566 20 0 FHADHM Cc1ccc([C@@H](C)NC(=O)c2c(Cl)cc(-c3nn[n-]n3)cc2Cl)o1 ZINC000826283387 607833370 /nfs/dbraw/zinc/83/33/70/607833370.db2.gz PPNSBIUAMYYGET-MRVPVSSYSA-N -1 3 366.208 3.566 20 0 FHADHM Cc1cc(F)ccc1[C@H](O)CSc1ccc(-c2nnn[n-]2)cc1Cl ZINC000826269032 607843056 /nfs/dbraw/zinc/84/30/56/607843056.db2.gz YCIOCQULUBFXAI-CQSZACIVSA-N -1 3 364.833 3.793 20 0 FHADHM Cc1cc(F)ccc1[C@H](O)CSc1ccc(-c2nn[n-]n2)cc1Cl ZINC000826269032 607843057 /nfs/dbraw/zinc/84/30/57/607843057.db2.gz YCIOCQULUBFXAI-CQSZACIVSA-N -1 3 364.833 3.793 20 0 FHADHM O[C@H](CSc1ccc(-c2nnn[n-]2)cc1Cl)c1cccc(Cl)c1 ZINC000826504905 607843201 /nfs/dbraw/zinc/84/32/01/607843201.db2.gz HTGAKCZGSBAWAB-CYBMUJFWSA-N -1 3 367.261 3.999 20 0 FHADHM O[C@H](CSc1ccc(-c2nn[n-]n2)cc1Cl)c1cccc(Cl)c1 ZINC000826504905 607843202 /nfs/dbraw/zinc/84/32/02/607843202.db2.gz HTGAKCZGSBAWAB-CYBMUJFWSA-N -1 3 367.261 3.999 20 0 FHADHM COc1ccc(C(=O)CSc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000826187333 607843796 /nfs/dbraw/zinc/84/37/96/607843796.db2.gz LPRVLDVGBSLEIY-UHFFFAOYSA-N -1 3 360.826 3.504 20 0 FHADHM COc1ccc(C(=O)CSc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000826187333 607843797 /nfs/dbraw/zinc/84/37/97/607843797.db2.gz LPRVLDVGBSLEIY-UHFFFAOYSA-N -1 3 360.826 3.504 20 0 FHADHM CC[C@@H](C)NC(=O)[C@H](Sc1ccc(-c2nnn[n-]2)cc1Cl)C(C)C ZINC000825069314 607844396 /nfs/dbraw/zinc/84/43/96/607844396.db2.gz ZYPKZIUUEJHDRK-QMTHXVAHSA-N -1 3 367.906 3.552 20 0 FHADHM CC[C@@H](C)NC(=O)[C@H](Sc1ccc(-c2nn[n-]n2)cc1Cl)C(C)C ZINC000825069314 607844397 /nfs/dbraw/zinc/84/43/97/607844397.db2.gz ZYPKZIUUEJHDRK-QMTHXVAHSA-N -1 3 367.906 3.552 20 0 FHADHM COC(=O)[C@H](Sc1ccc(-c2nnn[n-]2)cc1Cl)c1ccccc1 ZINC000826118174 607844654 /nfs/dbraw/zinc/84/46/54/607844654.db2.gz YECNMDNNJRZYAH-CQSZACIVSA-N -1 3 360.826 3.527 20 0 FHADHM COC(=O)[C@H](Sc1ccc(-c2nn[n-]n2)cc1Cl)c1ccccc1 ZINC000826118174 607844655 /nfs/dbraw/zinc/84/46/55/607844655.db2.gz YECNMDNNJRZYAH-CQSZACIVSA-N -1 3 360.826 3.527 20 0 FHADHM CC1(C)CCC[C@H](C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)C1 ZINC000824803334 607880979 /nfs/dbraw/zinc/88/09/79/607880979.db2.gz TYCJWWXXQSNMMH-INIZCTEOSA-N -1 3 353.470 3.574 20 0 FHADHM CC1(C)CCC[C@H](C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)C1 ZINC000824803334 607880980 /nfs/dbraw/zinc/88/09/80/607880980.db2.gz TYCJWWXXQSNMMH-INIZCTEOSA-N -1 3 353.470 3.574 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)C(C)=Cc1ccccc1Cl ZINC000826185606 607889516 /nfs/dbraw/zinc/88/95/16/607889516.db2.gz OPPPUVXBJHUOGT-LUAWRHEFSA-N -1 3 369.812 3.571 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)C(C)=Cc1ccccc1Cl ZINC000826185606 607889517 /nfs/dbraw/zinc/88/95/17/607889517.db2.gz OPPPUVXBJHUOGT-LUAWRHEFSA-N -1 3 369.812 3.571 20 0 FHADHM Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000826323496 607913131 /nfs/dbraw/zinc/91/31/31/607913131.db2.gz GUHNJMNRBWQGNB-GFCCVEGCSA-N -1 3 370.482 3.588 20 0 FHADHM Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC000826323496 607913132 /nfs/dbraw/zinc/91/31/32/607913132.db2.gz GUHNJMNRBWQGNB-GFCCVEGCSA-N -1 3 370.482 3.588 20 0 FHADHM C[C@H](Cc1cccc(Cl)c1)C(=O)N(C)c1ccc(-c2nnn[n-]2)cc1F ZINC000824457407 607925873 /nfs/dbraw/zinc/92/58/73/607925873.db2.gz LKTIBDMGKBYOOK-LLVKDONJSA-N -1 3 373.819 3.501 20 0 FHADHM C[C@H](Cc1cccc(Cl)c1)C(=O)N(C)c1ccc(-c2nn[n-]n2)cc1F ZINC000824457407 607925874 /nfs/dbraw/zinc/92/58/74/607925874.db2.gz LKTIBDMGKBYOOK-LLVKDONJSA-N -1 3 373.819 3.501 20 0 FHADHM CCNc1nc(SCc2cccc(-c3nnn[n-]3)c2)nc2ccccc21 ZINC000825480618 607928263 /nfs/dbraw/zinc/92/82/63/607928263.db2.gz CYQVPRNXZWMCCK-UHFFFAOYSA-N -1 3 363.450 3.534 20 0 FHADHM CCNc1nc(SCc2cccc(-c3nn[n-]n3)c2)nc2ccccc21 ZINC000825480618 607928264 /nfs/dbraw/zinc/92/82/64/607928264.db2.gz CYQVPRNXZWMCCK-UHFFFAOYSA-N -1 3 363.450 3.534 20 0 FHADHM CCC(=O)c1cc(C(=O)Nc2ccc(Cl)c(-c3nnn[n-]3)c2)ccc1F ZINC000825034384 607930976 /nfs/dbraw/zinc/93/09/76/607930976.db2.gz JFZGECCBRUNRQI-UHFFFAOYSA-N -1 3 373.775 3.504 20 0 FHADHM CCC(=O)c1cc(C(=O)Nc2ccc(Cl)c(-c3nn[n-]n3)c2)ccc1F ZINC000825034384 607930977 /nfs/dbraw/zinc/93/09/77/607930977.db2.gz JFZGECCBRUNRQI-UHFFFAOYSA-N -1 3 373.775 3.504 20 0 FHADHM CC(C)[C@H](CC(=O)N1CCc2ccc(-c3nnn[n-]3)cc21)c1ccccc1 ZINC000824192720 607946997 /nfs/dbraw/zinc/94/69/97/607946997.db2.gz LOKPUDAFNIBHLS-SFHVURJKSA-N -1 3 361.449 3.586 20 0 FHADHM CC(C)[C@H](CC(=O)N1CCc2ccc(-c3nn[n-]n3)cc21)c1ccccc1 ZINC000824192720 607946998 /nfs/dbraw/zinc/94/69/98/607946998.db2.gz LOKPUDAFNIBHLS-SFHVURJKSA-N -1 3 361.449 3.586 20 0 FHADHM O=C(CCCCCc1cccs1)N1CCc2ccc(-c3nnn[n-]3)cc21 ZINC000826406010 607953472 /nfs/dbraw/zinc/95/34/72/607953472.db2.gz DKRWAQJCTFFLPI-UHFFFAOYSA-N -1 3 367.478 3.620 20 0 FHADHM O=C(CCCCCc1cccs1)N1CCc2ccc(-c3nn[n-]n3)cc21 ZINC000826406010 607953473 /nfs/dbraw/zinc/95/34/73/607953473.db2.gz DKRWAQJCTFFLPI-UHFFFAOYSA-N -1 3 367.478 3.620 20 0 FHADHM CCC(=O)c1cc(C(=O)O[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)ccc1F ZINC000825034336 607963060 /nfs/dbraw/zinc/96/30/60/607963060.db2.gz HMJBSSIDBZRWTO-NSHDSACASA-N -1 3 368.368 3.517 20 0 FHADHM CCC(=O)c1cc(C(=O)O[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)ccc1F ZINC000825034336 607963061 /nfs/dbraw/zinc/96/30/61/607963061.db2.gz HMJBSSIDBZRWTO-NSHDSACASA-N -1 3 368.368 3.517 20 0 FHADHM CCn1c2ccc(-c3nnn[n-]3)cc2nc1-c1cnc(C2CCC2)s1 ZINC000825782557 607975915 /nfs/dbraw/zinc/97/59/15/607975915.db2.gz GXPASJFVAMUKLZ-UHFFFAOYSA-N -1 3 351.439 3.627 20 0 FHADHM CCn1c2ccc(-c3nn[n-]n3)cc2nc1-c1cnc(C2CCC2)s1 ZINC000825782557 607975916 /nfs/dbraw/zinc/97/59/16/607975916.db2.gz GXPASJFVAMUKLZ-UHFFFAOYSA-N -1 3 351.439 3.627 20 0 FHADHM Cc1ccc2cc(C(=O)O[C@@H](C)c3cccc(-c4nnn[n-]4)c3)ccc2n1 ZINC000826295004 607989973 /nfs/dbraw/zinc/98/99/73/607989973.db2.gz MVZBAQYTMXCURG-ZDUSSCGKSA-N -1 3 359.389 3.641 20 0 FHADHM Cc1ccc2cc(C(=O)O[C@@H](C)c3cccc(-c4nn[n-]n4)c3)ccc2n1 ZINC000826295004 607989974 /nfs/dbraw/zinc/98/99/74/607989974.db2.gz MVZBAQYTMXCURG-ZDUSSCGKSA-N -1 3 359.389 3.641 20 0 FHADHM FC(F)(F)c1cc(NCc2cnc(Cl)s2)ccc1-c1nn[n-]n1 ZINC000826368646 608019100 /nfs/dbraw/zinc/01/91/00/608019100.db2.gz XOAOTCUYVIQBLQ-UHFFFAOYSA-N -1 3 360.752 3.608 20 0 FHADHM FC(F)(F)c1cc(NCc2cnc(Cl)s2)ccc1-c1nnn[n-]1 ZINC000826368646 608019099 /nfs/dbraw/zinc/01/90/99/608019099.db2.gz XOAOTCUYVIQBLQ-UHFFFAOYSA-N -1 3 360.752 3.608 20 0 FHADHM CC(C)[C@H]1CCc2ccccc2N1C(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000824222834 608029394 /nfs/dbraw/zinc/02/93/94/608029394.db2.gz CQTCVCPYXSUCJH-CQSZACIVSA-N -1 3 353.451 3.546 20 0 FHADHM CC(C)[C@H]1CCc2ccccc2N1C(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000824222834 608029395 /nfs/dbraw/zinc/02/93/95/608029395.db2.gz CQTCVCPYXSUCJH-CQSZACIVSA-N -1 3 353.451 3.546 20 0 FHADHM FC1(F)CCC(Nc2ccc(-c3nn[n-]n3)cc2Br)CC1 ZINC000826370417 608053260 /nfs/dbraw/zinc/05/32/60/608053260.db2.gz RRMLGBAUPCDZMP-UHFFFAOYSA-N -1 3 358.190 3.619 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1OCCCSCc1ccccc1 ZINC000826175699 608054822 /nfs/dbraw/zinc/05/48/22/608054822.db2.gz NDNHRFFMCCPWIK-UHFFFAOYSA-N -1 3 356.451 3.578 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1OCCCSCc1ccccc1 ZINC000826175699 608054823 /nfs/dbraw/zinc/05/48/23/608054823.db2.gz NDNHRFFMCCPWIK-UHFFFAOYSA-N -1 3 356.451 3.578 20 0 FHADHM CCCCNc1ccccc1C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825290982 608115323 /nfs/dbraw/zinc/11/53/23/608115323.db2.gz KZGCLQDHSATROO-AWEZNQCLSA-N -1 3 364.453 3.570 20 0 FHADHM CCCCNc1ccccc1C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825290982 608115324 /nfs/dbraw/zinc/11/53/24/608115324.db2.gz KZGCLQDHSATROO-AWEZNQCLSA-N -1 3 364.453 3.570 20 0 FHADHM CCSc1cccc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCC3)c1 ZINC000825674418 608122806 /nfs/dbraw/zinc/12/28/06/608122806.db2.gz LNEFYHJXGRGSIM-UHFFFAOYSA-N -1 3 371.491 3.781 20 0 FHADHM CCSc1cccc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCC3)c1 ZINC000825674418 608122807 /nfs/dbraw/zinc/12/28/07/608122807.db2.gz LNEFYHJXGRGSIM-UHFFFAOYSA-N -1 3 371.491 3.781 20 0 FHADHM Cc1cn(C2CCCCC2)nc1NCc1ccc(-c2nnn[n-]2)cc1F ZINC000826317197 608134892 /nfs/dbraw/zinc/13/48/92/608134892.db2.gz RTGHURNVKRABRB-UHFFFAOYSA-N -1 3 355.421 3.628 20 0 FHADHM Cc1cn(C2CCCCC2)nc1NCc1ccc(-c2nn[n-]n2)cc1F ZINC000826317197 608134893 /nfs/dbraw/zinc/13/48/93/608134893.db2.gz RTGHURNVKRABRB-UHFFFAOYSA-N -1 3 355.421 3.628 20 0 FHADHM O=C(Nc1ccccc1)c1cccc(OCc2cccc(-c3nnn[n-]3)c2)c1 ZINC000826456857 608152792 /nfs/dbraw/zinc/15/27/92/608152792.db2.gz BEVFULHPCMKOCU-UHFFFAOYSA-N -1 3 371.400 3.698 20 0 FHADHM O=C(Nc1ccccc1)c1cccc(OCc2cccc(-c3nn[n-]n3)c2)c1 ZINC000826456857 608152794 /nfs/dbraw/zinc/15/27/94/608152794.db2.gz BEVFULHPCMKOCU-UHFFFAOYSA-N -1 3 371.400 3.698 20 0 FHADHM COc1ccc(CNCc2cc(Cl)sc2Cl)cc1-c1nnn[n-]1 ZINC000826202938 608161516 /nfs/dbraw/zinc/16/15/16/608161516.db2.gz SXWLCHQUVGTESR-UHFFFAOYSA-N -1 3 370.265 3.533 20 0 FHADHM COc1ccc(CNCc2cc(Cl)sc2Cl)cc1-c1nn[n-]n1 ZINC000826202938 608161518 /nfs/dbraw/zinc/16/15/18/608161518.db2.gz SXWLCHQUVGTESR-UHFFFAOYSA-N -1 3 370.265 3.533 20 0 FHADHM CC[C@H](Oc1cccc(C)c1)C(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000825159154 608182617 /nfs/dbraw/zinc/18/26/17/608182617.db2.gz KDWKXEFCXLHLMV-KDOFPFPSSA-N -1 3 366.421 3.637 20 0 FHADHM CC[C@H](Oc1cccc(C)c1)C(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000825159154 608182619 /nfs/dbraw/zinc/18/26/19/608182619.db2.gz KDWKXEFCXLHLMV-KDOFPFPSSA-N -1 3 366.421 3.637 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)c1ccccc1NCc1ccccc1 ZINC000826456729 608214982 /nfs/dbraw/zinc/21/49/82/608214982.db2.gz UFHZUAGKCZJWHP-UHFFFAOYSA-N -1 3 370.416 3.731 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)c1ccccc1NCc1ccccc1 ZINC000826456729 608214984 /nfs/dbraw/zinc/21/49/84/608214984.db2.gz UFHZUAGKCZJWHP-UHFFFAOYSA-N -1 3 370.416 3.731 20 0 FHADHM Cc1cc(C(F)(F)F)c(-c2nnn[n-]2)c(SCc2ncccc2C)n1 ZINC000826261975 608218657 /nfs/dbraw/zinc/21/86/57/608218657.db2.gz AJWCJHMOWYGBGR-UHFFFAOYSA-N -1 3 366.372 3.585 20 0 FHADHM C[C@@H](Nc1ccc2cc(-c3nnn[n-]3)ccc2n1)c1c(F)cccc1F ZINC000824655350 608222989 /nfs/dbraw/zinc/22/29/89/608222989.db2.gz CIADYBSEVWXSLN-SNVBAGLBSA-N -1 3 352.348 3.866 20 0 FHADHM C[C@@H](Nc1ccc2cc(-c3nn[n-]n3)ccc2n1)c1c(F)cccc1F ZINC000824655350 608222990 /nfs/dbraw/zinc/22/29/90/608222990.db2.gz CIADYBSEVWXSLN-SNVBAGLBSA-N -1 3 352.348 3.866 20 0 FHADHM Cc1cccc2c1OCC[C@H]2Nc1ccc2cc(-c3nnn[n-]3)ccc2n1 ZINC000826305161 608225436 /nfs/dbraw/zinc/22/54/36/608225436.db2.gz NABDHJNEYLTRMO-QGZVFWFLSA-N -1 3 358.405 3.659 20 0 FHADHM Cc1cccc2c1OCC[C@H]2Nc1ccc2cc(-c3nn[n-]n3)ccc2n1 ZINC000826305161 608225438 /nfs/dbraw/zinc/22/54/38/608225438.db2.gz NABDHJNEYLTRMO-QGZVFWFLSA-N -1 3 358.405 3.659 20 0 FHADHM Fc1cccc([C@H]2CCN(c3ccc4cc(-c5nnn[n-]5)ccc4n3)C2)c1 ZINC000826376870 608227192 /nfs/dbraw/zinc/22/71/92/608227192.db2.gz WLTUEWHSTKCMEU-INIZCTEOSA-N -1 3 360.396 3.548 20 0 FHADHM Fc1cccc([C@H]2CCN(c3ccc4cc(-c5nn[n-]n5)ccc4n3)C2)c1 ZINC000826376870 608227194 /nfs/dbraw/zinc/22/71/94/608227194.db2.gz WLTUEWHSTKCMEU-INIZCTEOSA-N -1 3 360.396 3.548 20 0 FHADHM c1ccc(Oc2ccc(CSc3cccc(-c4nnn[n-]4)c3)nn2)cc1 ZINC000826522864 608231677 /nfs/dbraw/zinc/23/16/77/608231677.db2.gz RLSVYUGOYQKTNE-UHFFFAOYSA-N -1 3 362.418 3.741 20 0 FHADHM c1ccc(Oc2ccc(CSc3cccc(-c4nn[n-]n4)c3)nn2)cc1 ZINC000826522864 608231678 /nfs/dbraw/zinc/23/16/78/608231678.db2.gz RLSVYUGOYQKTNE-UHFFFAOYSA-N -1 3 362.418 3.741 20 0 FHADHM c1ccc([C@H]2CN(c3ccc4cc(-c5nnn[n-]5)ccc4n3)CCS2)cc1 ZINC000826520261 608234126 /nfs/dbraw/zinc/23/41/26/608234126.db2.gz DPONEJSPNAMKII-GOSISDBHSA-N -1 3 374.473 3.709 20 0 FHADHM c1ccc([C@H]2CN(c3ccc4cc(-c5nn[n-]n5)ccc4n3)CCS2)cc1 ZINC000826520261 608234128 /nfs/dbraw/zinc/23/41/28/608234128.db2.gz DPONEJSPNAMKII-GOSISDBHSA-N -1 3 374.473 3.709 20 0 FHADHM CCc1nc2ccccc2n1C1CCN(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000825750251 608240968 /nfs/dbraw/zinc/24/09/68/608240968.db2.gz OBXSKLRLDROFRB-UHFFFAOYSA-N -1 3 373.464 3.620 20 0 FHADHM CC(C)[C@H]1C[C@H](Nc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)CCO1 ZINC000824213315 608242485 /nfs/dbraw/zinc/24/24/85/608242485.db2.gz ABGRSIJQFRGLOL-BXUZGUMPSA-N -1 3 355.364 3.501 20 0 FHADHM C[C@H]1CCC[C@@H](OCCCCCC(=O)Nc2ccc(-c3nnn[n-]3)cc2)C1 ZINC000162236627 608262111 /nfs/dbraw/zinc/26/21/11/608262111.db2.gz OVXUIMXTLYDIRZ-MAUKXSAKSA-N -1 3 371.485 3.961 20 0 FHADHM C[C@H]1CCC[C@@H](OCCCCCC(=O)Nc2ccc(-c3nn[n-]n3)cc2)C1 ZINC000162236627 608262113 /nfs/dbraw/zinc/26/21/13/608262113.db2.gz OVXUIMXTLYDIRZ-MAUKXSAKSA-N -1 3 371.485 3.961 20 0 FHADHM Cc1sc(NC(=O)c2ccc(Cl)c(F)c2)c(-c2nnn[n-]2)c1C ZINC000826349873 608265127 /nfs/dbraw/zinc/26/51/27/608265127.db2.gz XZUZRIFEDIQTJI-UHFFFAOYSA-N -1 3 351.794 3.590 20 0 FHADHM Cc1sc(NC(=O)c2ccc(Cl)c(F)c2)c(-c2nn[n-]n2)c1C ZINC000826349873 608265128 /nfs/dbraw/zinc/26/51/28/608265128.db2.gz XZUZRIFEDIQTJI-UHFFFAOYSA-N -1 3 351.794 3.590 20 0 FHADHM O=C(C=Cc1ccc2[nH]ccc2c1)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000826400547 608266296 /nfs/dbraw/zinc/26/62/96/608266296.db2.gz BDJGUMLVDLBITR-QHHAFSJGSA-N -1 3 364.796 3.653 20 0 FHADHM O=C(C=Cc1ccc2[nH]ccc2c1)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000826400547 608266298 /nfs/dbraw/zinc/26/62/98/608266298.db2.gz BDJGUMLVDLBITR-QHHAFSJGSA-N -1 3 364.796 3.653 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CNc1ccc(OC2CCC2)c(F)c1 ZINC000826170657 608320591 /nfs/dbraw/zinc/32/05/91/608320591.db2.gz JYSWVBPSFBQGSN-UHFFFAOYSA-N -1 3 369.400 3.558 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CNc1ccc(OC2CCC2)c(F)c1 ZINC000826170657 608320593 /nfs/dbraw/zinc/32/05/93/608320593.db2.gz JYSWVBPSFBQGSN-UHFFFAOYSA-N -1 3 369.400 3.558 20 0 FHADHM Fc1c(CSCc2noc(C3CCCCC3)n2)cccc1-c1nnn[n-]1 ZINC000826370721 608404676 /nfs/dbraw/zinc/40/46/76/608404676.db2.gz FQIVJSMXRJRTEZ-UHFFFAOYSA-N -1 3 374.445 3.870 20 0 FHADHM Fc1c(CSCc2noc(C3CCCCC3)n2)cccc1-c1nn[n-]n1 ZINC000826370721 608404678 /nfs/dbraw/zinc/40/46/78/608404678.db2.gz FQIVJSMXRJRTEZ-UHFFFAOYSA-N -1 3 374.445 3.870 20 0 FHADHM C[C@@H](NCc1ncc(-c2ccccc2F)o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824633192 608462456 /nfs/dbraw/zinc/46/24/56/608462456.db2.gz HOKNBIVTPHFQEY-GFCCVEGCSA-N -1 3 364.384 3.512 20 0 FHADHM C[C@@H](NCc1ncc(-c2ccccc2F)o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824633192 608462457 /nfs/dbraw/zinc/46/24/57/608462457.db2.gz HOKNBIVTPHFQEY-GFCCVEGCSA-N -1 3 364.384 3.512 20 0 FHADHM C[C@H](CC(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1)c1ccccc1 ZINC000824385407 608478070 /nfs/dbraw/zinc/47/80/70/608478070.db2.gz SEYVUWBQOPJUGI-MRXNPFEDSA-N -1 3 373.460 3.676 20 0 FHADHM C[C@H](CC(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1)c1ccccc1 ZINC000824385407 608478072 /nfs/dbraw/zinc/47/80/72/608478072.db2.gz SEYVUWBQOPJUGI-MRXNPFEDSA-N -1 3 373.460 3.676 20 0 FHADHM C[C@H](NC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccccc1Cl ZINC000736115896 608478743 /nfs/dbraw/zinc/47/87/43/608478743.db2.gz KULKKCQPBKDEEY-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM C[C@H](NC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccccc1Cl ZINC000736115896 608478744 /nfs/dbraw/zinc/47/87/44/608478744.db2.gz KULKKCQPBKDEEY-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM Cc1oc(-c2ccsc2)nc1CN[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000826340886 608481203 /nfs/dbraw/zinc/48/12/03/608481203.db2.gz OGPOYPNVKUWYES-NSHDSACASA-N -1 3 366.450 3.742 20 0 FHADHM CC(=CC(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1)c1ccccc1 ZINC000823943753 608484375 /nfs/dbraw/zinc/48/43/75/608484375.db2.gz SHZJFUUMWFYNRQ-NXVVXOECSA-N -1 3 371.444 3.586 20 0 FHADHM CC(=CC(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1)c1ccccc1 ZINC000823943753 608484376 /nfs/dbraw/zinc/48/43/76/608484376.db2.gz SHZJFUUMWFYNRQ-NXVVXOECSA-N -1 3 371.444 3.586 20 0 FHADHM C[C@H]1C[C@@H]1c1ccc(CN(Cc2cc(-c3nnn[n-]3)cs2)C2CC2)o1 ZINC000824897814 608518409 /nfs/dbraw/zinc/51/84/09/608518409.db2.gz BHMRZSHWBRMUPN-ZBEGNZNMSA-N -1 3 355.467 3.809 20 0 FHADHM C[C@H]1C[C@@H]1c1ccc(CN(Cc2cc(-c3nn[n-]n3)cs2)C2CC2)o1 ZINC000824897814 608518410 /nfs/dbraw/zinc/51/84/10/608518410.db2.gz BHMRZSHWBRMUPN-ZBEGNZNMSA-N -1 3 355.467 3.809 20 0 FHADHM Clc1ccc2[nH]c3c(c2c1)CN(Cc1ccc(-c2nnn[n-]2)s1)CC3 ZINC000826352547 608599080 /nfs/dbraw/zinc/59/90/80/608599080.db2.gz FSKCPTGJEBANNI-UHFFFAOYSA-N -1 3 370.869 3.621 20 0 FHADHM C[C@@H]1CC[C@@H](C)N(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)C1 ZINC000824909783 608604717 /nfs/dbraw/zinc/60/47/17/608604717.db2.gz UTACEAFEHCSWTC-NXEZZACHSA-N -1 3 368.363 3.538 20 0 FHADHM C[C@@H]1CC[C@@H](C)N(C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)C1 ZINC000824909783 608604718 /nfs/dbraw/zinc/60/47/18/608604718.db2.gz UTACEAFEHCSWTC-NXEZZACHSA-N -1 3 368.363 3.538 20 0 FHADHM CCn1c2ccccc2nc1SCc1cccc(-c2nnn[n-]2)c1F ZINC000825796974 608668902 /nfs/dbraw/zinc/66/89/02/608668902.db2.gz RXXPVOJUQHFYEU-UHFFFAOYSA-N -1 3 354.414 3.668 20 0 FHADHM CCn1c2ccccc2nc1SCc1cccc(-c2nn[n-]n2)c1F ZINC000825796974 608668903 /nfs/dbraw/zinc/66/89/03/608668903.db2.gz RXXPVOJUQHFYEU-UHFFFAOYSA-N -1 3 354.414 3.668 20 0 FHADHM Cc1ccc(C)c([C@H]2CN(Cc3cc(-c4nnn[n-]4)cs3)[C@H](C)CO2)c1 ZINC000826284978 608729107 /nfs/dbraw/zinc/72/91/07/608729107.db2.gz MKTCKUXHVAYNKS-RDTXWAMCSA-N -1 3 369.494 3.507 20 0 FHADHM Cc1ccc(C)c([C@H]2CN(Cc3cc(-c4nn[n-]n4)cs3)[C@H](C)CO2)c1 ZINC000826284978 608729109 /nfs/dbraw/zinc/72/91/09/608729109.db2.gz MKTCKUXHVAYNKS-RDTXWAMCSA-N -1 3 369.494 3.507 20 0 FHADHM CCc1ccc(NC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1C ZINC000825711398 608819976 /nfs/dbraw/zinc/81/99/76/608819976.db2.gz ARODSZRCEFIWLV-ZDUSSCGKSA-N -1 3 350.426 3.620 20 0 FHADHM CCc1ccc(NC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1C ZINC000825711398 608819978 /nfs/dbraw/zinc/81/99/78/608819978.db2.gz ARODSZRCEFIWLV-ZDUSSCGKSA-N -1 3 350.426 3.620 20 0 FHADHM CSc1ccc(Cl)cc1NCc1cnc2ccc(-c3nnn[n-]3)cn12 ZINC000826230732 608860325 /nfs/dbraw/zinc/86/03/25/608860325.db2.gz HTSZDGQQMDQVON-UHFFFAOYSA-N -1 3 371.857 3.502 20 0 FHADHM CSc1ccc(Cl)cc1NCc1cnc2ccc(-c3nn[n-]n3)cn12 ZINC000826230732 608860327 /nfs/dbraw/zinc/86/03/27/608860327.db2.gz HTSZDGQQMDQVON-UHFFFAOYSA-N -1 3 371.857 3.502 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1ccc2cccc(Cl)c2n1 ZINC000826249947 609140108 /nfs/dbraw/zinc/14/01/08/609140108.db2.gz CMBDJEPJPIWFBY-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1ccc2cccc(Cl)c2n1 ZINC000826249947 609140110 /nfs/dbraw/zinc/14/01/10/609140110.db2.gz CMBDJEPJPIWFBY-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM COc1cccc(F)c1[C@H](C)N[C@H](C)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000826216484 609146348 /nfs/dbraw/zinc/14/63/48/609146348.db2.gz ASJNQAHIQNTGIF-MNOVXSKESA-N -1 3 359.380 3.565 20 0 FHADHM COc1cccc(F)c1[C@H](C)N[C@H](C)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000826216484 609146349 /nfs/dbraw/zinc/14/63/49/609146349.db2.gz ASJNQAHIQNTGIF-MNOVXSKESA-N -1 3 359.380 3.565 20 0 FHADHM Cc1ccc2c(c1)[C@@H](NC(=O)Nc1cc(-c3nnn[n-]3)ccc1C)[C@@H](C)C2 ZINC000826294633 609157335 /nfs/dbraw/zinc/15/73/35/609157335.db2.gz XSWVJCLLDJDCET-UGSOOPFHSA-N -1 3 362.437 3.539 20 0 FHADHM Cc1ccc2c(c1)[C@@H](NC(=O)Nc1cc(-c3nn[n-]n3)ccc1C)[C@@H](C)C2 ZINC000826294633 609157337 /nfs/dbraw/zinc/15/73/37/609157337.db2.gz XSWVJCLLDJDCET-UGSOOPFHSA-N -1 3 362.437 3.539 20 0 FHADHM CC(C)C(=O)Nc1cccc(N[C@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)c1 ZINC000824184965 609164115 /nfs/dbraw/zinc/16/41/15/609164115.db2.gz OUYRWZCVEIYQQZ-GFCCVEGCSA-N -1 3 368.416 3.773 20 0 FHADHM CC(C)C(=O)Nc1cccc(N[C@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)c1 ZINC000824184965 609164117 /nfs/dbraw/zinc/16/41/17/609164117.db2.gz OUYRWZCVEIYQQZ-GFCCVEGCSA-N -1 3 368.416 3.773 20 0 FHADHM CC(=O)Nc1ccc(N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1Cl ZINC000824000164 609164135 /nfs/dbraw/zinc/16/41/35/609164135.db2.gz XNWJCJOOYWWIOY-JTQLQIEISA-N -1 3 356.817 3.652 20 0 FHADHM CC(=O)Nc1ccc(N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1Cl ZINC000824000164 609164136 /nfs/dbraw/zinc/16/41/36/609164136.db2.gz XNWJCJOOYWWIOY-JTQLQIEISA-N -1 3 356.817 3.652 20 0 FHADHM C[C@@H]1CCN(c2cc(-c3nnn[n-]3)c3ccccc3n2)[C@@H](c2ccco2)C1 ZINC000824961891 609164492 /nfs/dbraw/zinc/16/44/92/609164492.db2.gz KPFOABVCODHSGT-CXAGYDPISA-N -1 3 360.421 3.986 20 0 FHADHM C[C@@H]1CCN(c2cc(-c3nn[n-]n3)c3ccccc3n2)[C@@H](c2ccco2)C1 ZINC000824961891 609164493 /nfs/dbraw/zinc/16/44/93/609164493.db2.gz KPFOABVCODHSGT-CXAGYDPISA-N -1 3 360.421 3.986 20 0 FHADHM OCc1cccc(NCc2ccc(-c3ccccc3-c3nnn[n-]3)cc2)c1 ZINC000826510271 609176995 /nfs/dbraw/zinc/17/69/95/609176995.db2.gz HWJBFQUTGRLWMW-UHFFFAOYSA-N -1 3 357.417 3.638 20 0 FHADHM OCc1cccc(NCc2ccc(-c3ccccc3-c3nn[n-]n3)cc2)c1 ZINC000826510271 609176997 /nfs/dbraw/zinc/17/69/97/609176997.db2.gz HWJBFQUTGRLWMW-UHFFFAOYSA-N -1 3 357.417 3.638 20 0 FHADHM CCc1c(N[C@H]2CCCc3cc(-c4nnn[n-]4)ccc32)cnn1CC(C)C ZINC000825693960 609253310 /nfs/dbraw/zinc/25/33/10/609253310.db2.gz ILIPMJHONZIADJ-KRWDZBQOSA-N -1 3 365.485 3.771 20 0 FHADHM CCc1c(N[C@H]2CCCc3cc(-c4nn[n-]n4)ccc32)cnn1CC(C)C ZINC000825693960 609253312 /nfs/dbraw/zinc/25/33/12/609253312.db2.gz ILIPMJHONZIADJ-KRWDZBQOSA-N -1 3 365.485 3.771 20 0 FHADHM Clc1cc2c(cc1N[C@@H]1CCCc3cc(-c4nnn[n-]4)ccc31)OCO2 ZINC000826351252 609255195 /nfs/dbraw/zinc/25/51/95/609255195.db2.gz FMHQQURIPHSVTH-CQSZACIVSA-N -1 3 369.812 3.738 20 0 FHADHM Clc1cc2c(cc1N[C@@H]1CCCc3cc(-c4nn[n-]n4)ccc31)OCO2 ZINC000826351252 609255196 /nfs/dbraw/zinc/25/51/96/609255196.db2.gz FMHQQURIPHSVTH-CQSZACIVSA-N -1 3 369.812 3.738 20 0 FHADHM C[C@@H](Nc1ccccc1OCC(F)(F)F)c1cccc(-c2nnn[n-]2)c1 ZINC000824663036 609273225 /nfs/dbraw/zinc/27/32/25/609273225.db2.gz VDARABLOLMHMAT-LLVKDONJSA-N -1 3 363.343 3.981 20 0 FHADHM C[C@@H](Nc1ccccc1OCC(F)(F)F)c1cccc(-c2nn[n-]n2)c1 ZINC000824663036 609273226 /nfs/dbraw/zinc/27/32/26/609273226.db2.gz VDARABLOLMHMAT-LLVKDONJSA-N -1 3 363.343 3.981 20 0 FHADHM C[C@H](Nc1cccc(C(=O)NC(C)(C)C)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824662567 609273251 /nfs/dbraw/zinc/27/32/51/609273251.db2.gz NFMUUWQJWJNAQC-ZDUSSCGKSA-N -1 3 364.453 3.568 20 0 FHADHM C[C@H](Nc1cccc(C(=O)NC(C)(C)C)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824662567 609273252 /nfs/dbraw/zinc/27/32/52/609273252.db2.gz NFMUUWQJWJNAQC-ZDUSSCGKSA-N -1 3 364.453 3.568 20 0 FHADHM C[C@H](Nc1ccccc1OCC(F)(F)F)c1cccc(-c2nnn[n-]2)c1 ZINC000824663038 609273371 /nfs/dbraw/zinc/27/33/71/609273371.db2.gz VDARABLOLMHMAT-NSHDSACASA-N -1 3 363.343 3.981 20 0 FHADHM C[C@H](Nc1ccccc1OCC(F)(F)F)c1cccc(-c2nn[n-]n2)c1 ZINC000824663038 609273372 /nfs/dbraw/zinc/27/33/72/609273372.db2.gz VDARABLOLMHMAT-NSHDSACASA-N -1 3 363.343 3.981 20 0 FHADHM CN1CCCc2cc(N[C@H]3CCCc4cc(-c5nnn[n-]5)ccc43)ccc21 ZINC000826033933 609276817 /nfs/dbraw/zinc/27/68/17/609276817.db2.gz LIMXMWOPKWBRPG-IBGZPJMESA-N -1 3 360.465 3.739 20 0 FHADHM CN1CCCc2cc(N[C@H]3CCCc4cc(-c5nn[n-]n5)ccc43)ccc21 ZINC000826033933 609276818 /nfs/dbraw/zinc/27/68/18/609276818.db2.gz LIMXMWOPKWBRPG-IBGZPJMESA-N -1 3 360.465 3.739 20 0 FHADHM C[C@H](Nc1ccc(-n2cccn2)c(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824657898 609277719 /nfs/dbraw/zinc/27/77/19/609277719.db2.gz SHZLESHDKZHBSZ-LBPRGKRZSA-N -1 3 365.828 3.879 20 0 FHADHM C[C@H](Nc1ccc(-n2cccn2)c(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824657898 609277721 /nfs/dbraw/zinc/27/77/21/609277721.db2.gz SHZLESHDKZHBSZ-LBPRGKRZSA-N -1 3 365.828 3.879 20 0 FHADHM CCOc1ccc(OC)cc1N[C@H](C)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000825643922 609277981 /nfs/dbraw/zinc/27/79/81/609277981.db2.gz WLWBTNUNBAJQMQ-LLVKDONJSA-N -1 3 357.389 3.586 20 0 FHADHM CCOc1ccc(OC)cc1N[C@H](C)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000825643922 609277983 /nfs/dbraw/zinc/27/79/83/609277983.db2.gz WLWBTNUNBAJQMQ-LLVKDONJSA-N -1 3 357.389 3.586 20 0 FHADHM C[C@H](Nc1ccc(N2CCSCC2)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000824656479 609279263 /nfs/dbraw/zinc/27/92/63/609279263.db2.gz KKDSUEUJCNSZJF-AWEZNQCLSA-N -1 3 366.494 3.593 20 0 FHADHM C[C@H](Nc1ccc(N2CCSCC2)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000824656479 609279264 /nfs/dbraw/zinc/27/92/64/609279264.db2.gz KKDSUEUJCNSZJF-AWEZNQCLSA-N -1 3 366.494 3.593 20 0 FHADHM C[C@@H](Nc1ccc(N2CCSCC2)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824658335 609279284 /nfs/dbraw/zinc/27/92/84/609279284.db2.gz WBDMIEYCEATIDN-CQSZACIVSA-N -1 3 366.494 3.593 20 0 FHADHM C[C@@H](Nc1ccc(N2CCSCC2)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824658335 609279286 /nfs/dbraw/zinc/27/92/86/609279286.db2.gz WBDMIEYCEATIDN-CQSZACIVSA-N -1 3 366.494 3.593 20 0 FHADHM Cc1cc(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)nn1-c1ccc(C)cc1 ZINC000826281180 609281629 /nfs/dbraw/zinc/28/16/29/609281629.db2.gz HOTIAEJJEYROTN-OAHLLOKOSA-N -1 3 359.437 3.842 20 0 FHADHM Cc1cc(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)nn1-c1ccc(C)cc1 ZINC000826281180 609281631 /nfs/dbraw/zinc/28/16/31/609281631.db2.gz HOTIAEJJEYROTN-OAHLLOKOSA-N -1 3 359.437 3.842 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1nc(C2CC2)cs1 ZINC000824712951 609283217 /nfs/dbraw/zinc/28/32/17/609283217.db2.gz FQNRUGZWOJSOCX-IQQGHNRFSA-N -1 3 367.434 3.518 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1nc(C2CC2)cs1 ZINC000824712951 609283218 /nfs/dbraw/zinc/28/32/18/609283218.db2.gz FQNRUGZWOJSOCX-IQQGHNRFSA-N -1 3 367.434 3.518 20 0 FHADHM Cc1ccnc(NC(=O)c2ccccc2Oc2ccccc2-c2nnn[n-]2)c1 ZINC000826311855 609308132 /nfs/dbraw/zinc/30/81/32/609308132.db2.gz PTLATKWHTNEUGE-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccnc(NC(=O)c2ccccc2Oc2ccccc2-c2nn[n-]n2)c1 ZINC000826311855 609308135 /nfs/dbraw/zinc/30/81/35/609308135.db2.gz PTLATKWHTNEUGE-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM CC[C@H](C)CN(C)C(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000825059420 609317440 /nfs/dbraw/zinc/31/74/40/609317440.db2.gz FIOPLEQHLVHEBN-AWEZNQCLSA-N -1 3 365.437 3.777 20 0 FHADHM CC[C@H](C)CN(C)C(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000825059420 609317442 /nfs/dbraw/zinc/31/74/42/609317442.db2.gz FIOPLEQHLVHEBN-AWEZNQCLSA-N -1 3 365.437 3.777 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1NCc1ccccc1N1CCCCC1 ZINC000826351142 609320913 /nfs/dbraw/zinc/32/09/13/609320913.db2.gz YXSAALCLKNYWBD-UHFFFAOYSA-N -1 3 369.860 3.518 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1NCc1ccccc1N1CCCCC1 ZINC000826351142 609320915 /nfs/dbraw/zinc/32/09/15/609320915.db2.gz YXSAALCLKNYWBD-UHFFFAOYSA-N -1 3 369.860 3.518 20 0 FHADHM Fc1cccc(NCc2ccccc2N2CCCCC2)c1-c1nnn[n-]1 ZINC000826377381 609321118 /nfs/dbraw/zinc/32/11/18/609321118.db2.gz PCOSNGLVJWQLGH-UHFFFAOYSA-N -1 3 352.417 3.608 20 0 FHADHM Fc1cccc(NCc2ccccc2N2CCCCC2)c1-c1nn[n-]n1 ZINC000826377381 609321119 /nfs/dbraw/zinc/32/11/19/609321119.db2.gz PCOSNGLVJWQLGH-UHFFFAOYSA-N -1 3 352.417 3.608 20 0 FHADHM CCC(CC)[C@H]1C[C@@H](Nc2cc(-c3nnn[n-]3)c3ccccc3n2)CCO1 ZINC000825107520 609322449 /nfs/dbraw/zinc/32/24/49/609322449.db2.gz PRXKCCXKIORCRY-KBXCAEBGSA-N -1 3 366.469 3.811 20 0 FHADHM CCC(CC)[C@H]1C[C@@H](Nc2cc(-c3nn[n-]n3)c3ccccc3n2)CCO1 ZINC000825107520 609322451 /nfs/dbraw/zinc/32/24/51/609322451.db2.gz PRXKCCXKIORCRY-KBXCAEBGSA-N -1 3 366.469 3.811 20 0 FHADHM C[C@H](N[C@@H](c1ccccc1)c1ccccn1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824539313 609323164 /nfs/dbraw/zinc/32/31/64/609323164.db2.gz MSKQTECMVYCXQE-XOBRGWDASA-N -1 3 374.423 3.841 20 0 FHADHM C[C@H](N[C@@H](c1ccccc1)c1ccccn1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824539313 609323166 /nfs/dbraw/zinc/32/31/66/609323166.db2.gz MSKQTECMVYCXQE-XOBRGWDASA-N -1 3 374.423 3.841 20 0 FHADHM C[C@H](Nc1ccc(N(C)C)c(Cl)c1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824658549 609348836 /nfs/dbraw/zinc/34/88/36/609348836.db2.gz YAUAGWPSQZBAOT-JTQLQIEISA-N -1 3 360.824 3.898 20 0 FHADHM C[C@H](Nc1ccc(N(C)C)c(Cl)c1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824658549 609348838 /nfs/dbraw/zinc/34/88/38/609348838.db2.gz YAUAGWPSQZBAOT-JTQLQIEISA-N -1 3 360.824 3.898 20 0 FHADHM C[C@@H](Nc1ccc(Br)cc1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824657549 609348987 /nfs/dbraw/zinc/34/89/87/609348987.db2.gz QWXNONWJUZHZCT-SECBINFHSA-N -1 3 362.206 3.941 20 0 FHADHM C[C@@H](Nc1ccc(Br)cc1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824657549 609348988 /nfs/dbraw/zinc/34/89/88/609348988.db2.gz QWXNONWJUZHZCT-SECBINFHSA-N -1 3 362.206 3.941 20 0 FHADHM CC(C)S[C@@H]1CCCC[C@H]1OC(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000824337550 609364774 /nfs/dbraw/zinc/36/47/74/609364774.db2.gz AFTHHQCSUHKTTK-VXGBXAGGSA-N -1 3 352.485 3.538 20 0 FHADHM CC(C)S[C@@H]1CCCC[C@H]1OC(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000824337550 609364777 /nfs/dbraw/zinc/36/47/77/609364777.db2.gz AFTHHQCSUHKTTK-VXGBXAGGSA-N -1 3 352.485 3.538 20 0 FHADHM CC1(C)CC[C@H](C(=O)N(Cc2ccco2)c2ccccc2-c2nnn[n-]2)C1 ZINC000824796022 609377454 /nfs/dbraw/zinc/37/74/54/609377454.db2.gz LNTBDCDTIKAYIG-AWEZNQCLSA-N -1 3 365.437 3.819 20 0 FHADHM CC1(C)CC[C@H](C(=O)N(Cc2ccco2)c2ccccc2-c2nn[n-]n2)C1 ZINC000824796022 609377458 /nfs/dbraw/zinc/37/74/58/609377458.db2.gz LNTBDCDTIKAYIG-AWEZNQCLSA-N -1 3 365.437 3.819 20 0 FHADHM CCC[C@H]1C[C@H]1NC(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000825251578 609385190 /nfs/dbraw/zinc/38/51/90/609385190.db2.gz CNOZBZSUMSLCHJ-XJKSGUPXSA-N -1 3 363.421 3.577 20 0 FHADHM CCC[C@H]1C[C@H]1NC(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000825251578 609385192 /nfs/dbraw/zinc/38/51/92/609385192.db2.gz CNOZBZSUMSLCHJ-XJKSGUPXSA-N -1 3 363.421 3.577 20 0 FHADHM CCC[C@H]1C[C@@H]1NC(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000825251571 609385640 /nfs/dbraw/zinc/38/56/40/609385640.db2.gz CNOZBZSUMSLCHJ-BBRMVZONSA-N -1 3 363.421 3.577 20 0 FHADHM CCC[C@H]1C[C@@H]1NC(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000825251571 609385643 /nfs/dbraw/zinc/38/56/43/609385643.db2.gz CNOZBZSUMSLCHJ-BBRMVZONSA-N -1 3 363.421 3.577 20 0 FHADHM O=C(OCc1ccoc1)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000826467186 609387286 /nfs/dbraw/zinc/38/72/86/609387286.db2.gz KTNDVLIAUILYBX-UHFFFAOYSA-N -1 3 362.345 3.609 20 0 FHADHM O=C(OCc1ccoc1)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000826467186 609387289 /nfs/dbraw/zinc/38/72/89/609387289.db2.gz KTNDVLIAUILYBX-UHFFFAOYSA-N -1 3 362.345 3.609 20 0 FHADHM CC1(C)CC[C@@H](C(=O)Nc2nc(-c3cccc(-c4nnn[n-]4)c3)cs2)C1 ZINC000824795690 609396115 /nfs/dbraw/zinc/39/61/15/609396115.db2.gz CAKUYGAHFHZPBV-CYBMUJFWSA-N -1 3 368.466 3.755 20 0 FHADHM CC1(C)CC[C@@H](C(=O)Nc2nc(-c3cccc(-c4nn[n-]n4)c3)cs2)C1 ZINC000824795690 609396117 /nfs/dbraw/zinc/39/61/17/609396117.db2.gz CAKUYGAHFHZPBV-CYBMUJFWSA-N -1 3 368.466 3.755 20 0 FHADHM C[C@H]1CC[C@@]2(CCN(C(=O)Nc3ccc(-c4nnn[n-]4)cc3Cl)C2)C1 ZINC000824919675 609405458 /nfs/dbraw/zinc/40/54/58/609405458.db2.gz WTOIJPDIKLLQPR-APPDUMDISA-N -1 3 360.849 3.564 20 0 FHADHM C[C@H]1CC[C@@]2(CCN(C(=O)Nc3ccc(-c4nn[n-]n4)cc3Cl)C2)C1 ZINC000824919675 609405460 /nfs/dbraw/zinc/40/54/60/609405460.db2.gz WTOIJPDIKLLQPR-APPDUMDISA-N -1 3 360.849 3.564 20 0 FHADHM OCc1ccc(CNc2cccc(Oc3ccc(-c4nnn[n-]4)cc3)c2)cc1 ZINC000826510594 609438649 /nfs/dbraw/zinc/43/86/49/609438649.db2.gz ZRZZJIFRTOSLMJ-UHFFFAOYSA-N -1 3 373.416 3.763 20 0 FHADHM OCc1ccc(CNc2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)cc1 ZINC000826510594 609438652 /nfs/dbraw/zinc/43/86/52/609438652.db2.gz ZRZZJIFRTOSLMJ-UHFFFAOYSA-N -1 3 373.416 3.763 20 0 FHADHM COc1cc(NCc2cc(-c3nnn[n-]3)cs2)cc(OC)c1C(C)C ZINC000826180689 609445640 /nfs/dbraw/zinc/44/56/40/609445640.db2.gz SHHBJTXQQLONPZ-UHFFFAOYSA-N -1 3 359.455 3.681 20 0 FHADHM COc1cc(NCc2cc(-c3nn[n-]n3)cs2)cc(OC)c1C(C)C ZINC000826180689 609445642 /nfs/dbraw/zinc/44/56/42/609445642.db2.gz SHHBJTXQQLONPZ-UHFFFAOYSA-N -1 3 359.455 3.681 20 0 FHADHM Fc1cc(NCc2cccc(-c3nnn[n-]3)c2)cc(F)c1N1CCCCC1 ZINC000826372760 609446720 /nfs/dbraw/zinc/44/67/20/609446720.db2.gz KQXUFMLRBCBDEN-UHFFFAOYSA-N -1 3 370.407 3.747 20 0 FHADHM Fc1cc(NCc2cccc(-c3nn[n-]n3)c2)cc(F)c1N1CCCCC1 ZINC000826372760 609446721 /nfs/dbraw/zinc/44/67/21/609446721.db2.gz KQXUFMLRBCBDEN-UHFFFAOYSA-N -1 3 370.407 3.747 20 0 FHADHM CC(C)c1noc(CSc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)n1 ZINC000824371873 609449709 /nfs/dbraw/zinc/44/97/09/609449709.db2.gz WVBLNPAUMAZOAL-UHFFFAOYSA-N -1 3 370.360 3.684 20 0 FHADHM CC(C)c1noc(CSc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)n1 ZINC000824371873 609449711 /nfs/dbraw/zinc/44/97/11/609449711.db2.gz WVBLNPAUMAZOAL-UHFFFAOYSA-N -1 3 370.360 3.684 20 0 FHADHM Cc1nccn1CCCSc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000826331345 609451502 /nfs/dbraw/zinc/45/15/02/609451502.db2.gz DLSJTKDDVLAYON-UHFFFAOYSA-N -1 3 368.388 3.573 20 0 FHADHM C[C@@H](Nc1ccc(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)cc1)c1ccccc1 ZINC000824658398 609452518 /nfs/dbraw/zinc/45/25/18/609452518.db2.gz WTTCQEOFPCUWRT-CYBMUJFWSA-N -1 3 373.420 3.620 20 0 FHADHM C[C@@H](Nc1ccc(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)cc1)c1ccccc1 ZINC000824658398 609452519 /nfs/dbraw/zinc/45/25/19/609452519.db2.gz WTTCQEOFPCUWRT-CYBMUJFWSA-N -1 3 373.420 3.620 20 0 FHADHM Cc1cc(CNc2cc(-c3nn[n-]n3)ccc2OC(C)C)cnc1Cl ZINC000826267111 609478106 /nfs/dbraw/zinc/47/81/06/609478106.db2.gz QQXYNCKOSPCHAM-UHFFFAOYSA-N -1 3 358.833 3.623 20 0 FHADHM Fc1cc(NCc2cccc(-c3nnn[n-]3)c2F)ccc1OC1CCC1 ZINC000826372967 609479108 /nfs/dbraw/zinc/47/91/08/609479108.db2.gz UHIKHTQQDOXRPM-UHFFFAOYSA-N -1 3 357.364 3.688 20 0 FHADHM Fc1cc(NCc2cccc(-c3nn[n-]n3)c2F)ccc1OC1CCC1 ZINC000826372967 609479109 /nfs/dbraw/zinc/47/91/09/609479109.db2.gz UHIKHTQQDOXRPM-UHFFFAOYSA-N -1 3 357.364 3.688 20 0 FHADHM CCc1nnc(CSc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)s1 ZINC000825767468 609490333 /nfs/dbraw/zinc/49/03/33/609490333.db2.gz KTOXTSPXCFXOMW-UHFFFAOYSA-N -1 3 372.401 3.592 20 0 FHADHM CCc1nnc(CSc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)s1 ZINC000825767468 609490334 /nfs/dbraw/zinc/49/03/34/609490334.db2.gz KTOXTSPXCFXOMW-UHFFFAOYSA-N -1 3 372.401 3.592 20 0 FHADHM CC(C)c1nc([C@H]2CCCCCN2c2cccc(F)c2-c2nnn[n-]2)no1 ZINC000824358186 609494055 /nfs/dbraw/zinc/49/40/55/609494055.db2.gz BEQSQCIDEPQLGU-CQSZACIVSA-N -1 3 371.420 3.634 20 0 FHADHM CC(C)c1nc([C@H]2CCCCCN2c2cccc(F)c2-c2nn[n-]n2)no1 ZINC000824358186 609494056 /nfs/dbraw/zinc/49/40/56/609494056.db2.gz BEQSQCIDEPQLGU-CQSZACIVSA-N -1 3 371.420 3.634 20 0 FHADHM CC[C@H](Nc1ncc(Cl)c(C)c1-c1nnn[n-]1)c1ccc(OC)cc1 ZINC000825149120 609521932 /nfs/dbraw/zinc/52/19/32/609521932.db2.gz VIDGMORNASLPPM-AWEZNQCLSA-N -1 3 358.833 3.795 20 0 FHADHM CC[C@H](Nc1ncc(Cl)c(C)c1-c1nn[n-]n1)c1ccc(OC)cc1 ZINC000825149120 609521935 /nfs/dbraw/zinc/52/19/35/609521935.db2.gz VIDGMORNASLPPM-AWEZNQCLSA-N -1 3 358.833 3.795 20 0 FHADHM Cc1ccnc(N[C@H](C)c2ccc(OC(F)(F)F)cc2)c1-c1nnn[n-]1 ZINC000826311880 609531907 /nfs/dbraw/zinc/53/19/07/609531907.db2.gz QDKVKSTWESQVON-SNVBAGLBSA-N -1 3 364.331 3.642 20 0 FHADHM Cc1ccnc(N[C@H](C)c2ccc(OC(F)(F)F)cc2)c1-c1nn[n-]n1 ZINC000826311880 609531910 /nfs/dbraw/zinc/53/19/10/609531910.db2.gz QDKVKSTWESQVON-SNVBAGLBSA-N -1 3 364.331 3.642 20 0 FHADHM Cc1ccnc(N[C@H](C)c2cccc(Br)c2)c1-c1nnn[n-]1 ZINC000826311777 609532200 /nfs/dbraw/zinc/53/22/00/609532200.db2.gz MZYRKWWDSAOWCJ-SNVBAGLBSA-N -1 3 359.231 3.506 20 0 FHADHM Cc1ccnc(N[C@H](C)c2cccc(Br)c2)c1-c1nn[n-]n1 ZINC000826311777 609532203 /nfs/dbraw/zinc/53/22/03/609532203.db2.gz MZYRKWWDSAOWCJ-SNVBAGLBSA-N -1 3 359.231 3.506 20 0 FHADHM Cc1c(Cl)cnc(NCCCCOCc2ccccc2)c1-c1nnn[n-]1 ZINC000826239618 609542106 /nfs/dbraw/zinc/54/21/06/609542106.db2.gz LSHIFXAMVXERLY-UHFFFAOYSA-N -1 3 372.860 3.632 20 0 FHADHM Cc1c(Cl)cnc(NCCCCOCc2ccccc2)c1-c1nn[n-]n1 ZINC000826239618 609542107 /nfs/dbraw/zinc/54/21/07/609542107.db2.gz LSHIFXAMVXERLY-UHFFFAOYSA-N -1 3 372.860 3.632 20 0 FHADHM CCc1ccc([C@@H]2CCCN2c2ncc(Cl)c(C)c2-c2nnn[n-]2)o1 ZINC000825705212 609556763 /nfs/dbraw/zinc/55/67/63/609556763.db2.gz YVXLLCDCBDQWSQ-ZDUSSCGKSA-N -1 3 358.833 3.720 20 0 FHADHM CCc1ccc([C@@H]2CCCN2c2ncc(Cl)c(C)c2-c2nn[n-]n2)o1 ZINC000825705212 609556766 /nfs/dbraw/zinc/55/67/66/609556766.db2.gz YVXLLCDCBDQWSQ-ZDUSSCGKSA-N -1 3 358.833 3.720 20 0 FHADHM Cc1cnc([C@@H](Nc2ncc(Cl)c(C)c2-c2nnn[n-]2)C2CC2)s1 ZINC000826317753 609560398 /nfs/dbraw/zinc/56/03/98/609560398.db2.gz MOIURYTZZPKKFE-LBPRGKRZSA-N -1 3 361.862 3.552 20 0 FHADHM Cc1cnc([C@@H](Nc2ncc(Cl)c(C)c2-c2nn[n-]n2)C2CC2)s1 ZINC000826317753 609560400 /nfs/dbraw/zinc/56/04/00/609560400.db2.gz MOIURYTZZPKKFE-LBPRGKRZSA-N -1 3 361.862 3.552 20 0 FHADHM COc1cccc(F)c1[C@H](C)Nc1ncc(Cl)c(C)c1-c1nnn[n-]1 ZINC000826216604 609561324 /nfs/dbraw/zinc/56/13/24/609561324.db2.gz GULYDRYDHUWBPE-VIFPVBQESA-N -1 3 362.796 3.544 20 0 FHADHM COc1cccc(F)c1[C@H](C)Nc1ncc(Cl)c(C)c1-c1nn[n-]n1 ZINC000826216604 609561326 /nfs/dbraw/zinc/56/13/26/609561326.db2.gz GULYDRYDHUWBPE-VIFPVBQESA-N -1 3 362.796 3.544 20 0 FHADHM CCC(CC)[C@@H]1C[C@@H](Nc2ncc(Cl)c(C)c2-c2nnn[n-]2)CCO1 ZINC000825106662 609585218 /nfs/dbraw/zinc/58/52/18/609585218.db2.gz HTBZJTSMCISGRY-JSGCOSHPSA-N -1 3 364.881 3.619 20 0 FHADHM CCC(CC)[C@@H]1C[C@@H](Nc2ncc(Cl)c(C)c2-c2nn[n-]n2)CCO1 ZINC000825106662 609585221 /nfs/dbraw/zinc/58/52/21/609585221.db2.gz HTBZJTSMCISGRY-JSGCOSHPSA-N -1 3 364.881 3.619 20 0 FHADHM Cc1nc(-c2ccccc2)sc1NC(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000826322924 609589341 /nfs/dbraw/zinc/58/93/41/609589341.db2.gz HPYJMFWYZOOJHF-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM Cc1nc(-c2ccccc2)sc1NC(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000826322924 609589342 /nfs/dbraw/zinc/58/93/42/609589342.db2.gz HPYJMFWYZOOJHF-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM C[C@@H]1C[C@@H](CCNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)CCO1 ZINC000824886107 609596470 /nfs/dbraw/zinc/59/64/70/609596470.db2.gz VUAQOTMISQANTL-MNOVXSKESA-N -1 3 355.364 3.503 20 0 FHADHM C[C@@H]1C[C@@H](CCNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)CCO1 ZINC000824886107 609596472 /nfs/dbraw/zinc/59/64/72/609596472.db2.gz VUAQOTMISQANTL-MNOVXSKESA-N -1 3 355.364 3.503 20 0 FHADHM C[C@H]1CC(C)(C)c2ccccc2N1C(=O)c1sccc1-c1nnn[n-]1 ZINC000824875929 609622709 /nfs/dbraw/zinc/62/27/09/609622709.db2.gz POGUYVMFNCXZDT-NSHDSACASA-N -1 3 353.451 3.645 20 0 FHADHM C[C@H]1CC(C)(C)c2ccccc2N1C(=O)c1sccc1-c1nn[n-]n1 ZINC000824875929 609622710 /nfs/dbraw/zinc/62/27/10/609622710.db2.gz POGUYVMFNCXZDT-NSHDSACASA-N -1 3 353.451 3.645 20 0 FHADHM CCc1nc(C)c([C@@H](C)N(C)C(=O)c2cc(NC(C)=O)ccc2[O-])s1 ZINC000122754350 937093339 /nfs/dbraw/zinc/09/33/39/937093339.db2.gz OKOBPDSMTIBSSI-LLVKDONJSA-N -1 3 361.467 3.511 20 0 FHADHM CN(C(=O)c1cc(=O)[n-]c(C2CC2)n1)[C@H]1CCCC[C@@H]1c1ccccc1 ZINC000616327726 927233122 /nfs/dbraw/zinc/23/31/22/927233122.db2.gz AXKMFBOQCVKPSN-AEFFLSMTSA-N -1 3 351.450 3.858 20 0 FHADHM O=C(Nc1cccc(CNCc2c(F)ccc([O-])c2F)c1)c1ccccn1 ZINC000510036028 927246481 /nfs/dbraw/zinc/24/64/81/927246481.db2.gz UFKMERWXEBYCDL-UHFFFAOYSA-N -1 3 369.371 3.608 20 0 FHADHM CC[C@@H](CSC)[N-]S(=O)(=O)c1cc(Cl)ccc1C(F)(F)F ZINC000510039533 927330473 /nfs/dbraw/zinc/33/04/73/927330473.db2.gz FLHOEQXWUZJGSF-VIFPVBQESA-N -1 3 361.838 3.779 20 0 FHADHM C[C@@H]([N-]S(=O)(=O)c1c(F)cccc1F)c1ccc(OC(F)F)cc1 ZINC000044782523 927347550 /nfs/dbraw/zinc/34/75/50/927347550.db2.gz JIVMBQQKQIPOTE-SECBINFHSA-N -1 3 363.332 3.606 20 0 FHADHM CCCOc1ccc(NC(=O)NCc2ncccc2[O-])cc1OCCC ZINC000471122989 927567703 /nfs/dbraw/zinc/56/77/03/927567703.db2.gz CZTBLKFALUKDRX-UHFFFAOYSA-N -1 3 359.426 3.687 20 0 FHADHM O=C(c1cc(=O)[n-]c(C2CC2)n1)N1CCCC[C@H]1c1ccc(F)cc1F ZINC000654929008 927594718 /nfs/dbraw/zinc/59/47/18/927594718.db2.gz VCKKNNDVWIXOIB-INIZCTEOSA-N -1 3 359.376 3.705 20 0 FHADHM O=C(N=c1[nH][n-]cc1Br)[C@H]1CC[C@H]1c1ccc(Cl)cc1F ZINC000579807116 927650346 /nfs/dbraw/zinc/65/03/46/927650346.db2.gz XKEMTWYAWWTYHE-WPRPVWTQSA-N -1 3 372.625 3.519 20 0 FHADHM Cc1c2cc(F)ccc2oc1S(=O)(=O)[N-]CCC1C[C@@H](C)O[C@H](C)C1 ZINC000583156033 937182777 /nfs/dbraw/zinc/18/27/77/937182777.db2.gz DFVWDLOSLBPFMT-VXGBXAGGSA-N -1 3 369.458 3.752 20 0 FHADHM O=C([O-])[C@H](CNCc1csc(-c2ccsc2)n1)Cc1ccccc1 ZINC000683170745 927735889 /nfs/dbraw/zinc/73/58/89/927735889.db2.gz BVGXHMPTJBCLNA-HNNXBMFYSA-N -1 3 358.488 3.905 20 0 FHADHM COc1ccc([C@H](CC(=O)[O-])NCc2cc(Br)cs2)cc1 ZINC000683172078 927745121 /nfs/dbraw/zinc/74/51/21/927745121.db2.gz VNSNXIODXXNOTR-AWEZNQCLSA-N -1 3 370.268 3.825 20 0 FHADHM O=C([O-])[C@H](CNCc1csc(-c2ccccc2)n1)Cc1ccccc1 ZINC000683171348 927746273 /nfs/dbraw/zinc/74/62/73/927746273.db2.gz KHPSCNNURMVRAZ-KRWDZBQOSA-N -1 3 352.459 3.843 20 0 FHADHM Cc1cc(S(=O)(=O)[N-][C@H](c2ccccc2)[C@H]2CCOC2)sc1Cl ZINC000530491360 927829933 /nfs/dbraw/zinc/82/99/33/927829933.db2.gz GEJSBZROMCHTEC-DZGCQCFKSA-N -1 3 371.911 3.766 20 0 FHADHM O=C(c1ccccc1[O-])N1CCC[C@H]1C(=O)N1CCCC2(CCCCC2)C1 ZINC000111660054 927866810 /nfs/dbraw/zinc/86/68/10/927866810.db2.gz ZNLXGXYLMYIQKQ-SFHVURJKSA-N -1 3 370.493 3.570 20 0 FHADHM CCCCc1nc(NC(=O)c2ccc3nc(C)oc3c2)c(C(=O)OCC)[n-]1 ZINC000471147492 927952815 /nfs/dbraw/zinc/95/28/15/927952815.db2.gz LRVTYHULVGYUMU-UHFFFAOYSA-N -1 3 370.409 3.631 20 0 FHADHM C[C@@H](Oc1ccccc1NC(=O)c1cc(=O)[n-]c(C2CC2)n1)C(F)(F)F ZINC000655082339 928074277 /nfs/dbraw/zinc/07/42/77/928074277.db2.gz GQGWLRKJKSNLOQ-SECBINFHSA-N -1 3 367.327 3.642 20 0 FHADHM O=C(NCc1ccc([O-])c(F)c1)N1CCCC[C@H]1c1nc2ccccc2[nH]1 ZINC000458428078 937236784 /nfs/dbraw/zinc/23/67/84/937236784.db2.gz UXMDULIBCQRRRQ-KRWDZBQOSA-N -1 3 368.412 3.844 20 0 FHADHM COc1cc2c(cc1OC)[C@H](CC(=O)[O-])N(Cc1ccccc1C)CC2 ZINC000579842572 928384315 /nfs/dbraw/zinc/38/43/15/928384315.db2.gz KOMXVAAKBDQZML-SFHVURJKSA-N -1 3 355.434 3.586 20 0 FHADHM Cc1cccc([O-])c1C(=O)N1CCC(N2c3ccccc3C[C@@H]2C)CC1 ZINC000624745155 928482443 /nfs/dbraw/zinc/48/24/43/928482443.db2.gz IQFSEZDJTHPUPC-INIZCTEOSA-N -1 3 350.462 3.756 20 0 FHADHM O=C(Cc1ccc([O-])c(F)c1)NC1(c2cccc(OC(F)(F)F)c2)CC1 ZINC000655324288 928704869 /nfs/dbraw/zinc/70/48/69/928704869.db2.gz WJHBDRVVUPVUEA-UHFFFAOYSA-N -1 3 369.314 3.778 20 0 FHADHM COc1cc(C(=O)NCc2oc3ccc(F)cc3c2C)cc(OC)c1[O-] ZINC000179625602 928877027 /nfs/dbraw/zinc/87/70/27/928877027.db2.gz SAIIZNUKTSLHDQ-UHFFFAOYSA-N -1 3 359.353 3.533 20 0 FHADHM Cc1cc(S(=O)(=O)[N-]C(C)(C)c2nc(C)c(C)s2)sc1Cl ZINC000187990347 929032787 /nfs/dbraw/zinc/03/27/87/929032787.db2.gz SAQYAWGSVOHWCE-UHFFFAOYSA-N -1 3 364.945 3.997 20 0 FHADHM CN(CCOc1ccc(C(F)(F)F)cc1)Cc1ccc(C(=O)[O-])s1 ZINC000583269088 937301203 /nfs/dbraw/zinc/30/12/03/937301203.db2.gz WWTMKMOKPHNNMU-UHFFFAOYSA-N -1 3 359.369 3.976 20 0 FHADHM Cc1ccc(S(=O)(=O)[N-][C@H](c2cccc(Cl)c2)c2ccccn2)o1 ZINC000538013056 929061116 /nfs/dbraw/zinc/06/11/16/929061116.db2.gz LNCBCWHFGXMPMD-QGZVFWFLSA-N -1 3 362.838 3.704 20 0 FHADHM O=C(Nc1ccc(Br)cc1[O-])C1(c2ccccc2F)CC1 ZINC000134596767 929094309 /nfs/dbraw/zinc/09/43/09/929094309.db2.gz LJGHHMZJQPDLKZ-UHFFFAOYSA-N -1 3 350.187 3.964 20 0 FHADHM O=C(c1cc(=O)[n-]c(C2CC2)n1)N1CCC([C@@H](F)c2ccccc2F)CC1 ZINC000583272554 937303418 /nfs/dbraw/zinc/30/34/18/937303418.db2.gz OHIWUKRYRIOKSW-GOSISDBHSA-N -1 3 373.403 3.762 20 0 FHADHM CC(C)[C@@H](CNC(=O)c1cc([O-])cc(C(F)(F)F)c1)c1cccnc1 ZINC000646900156 929396344 /nfs/dbraw/zinc/39/63/44/929396344.db2.gz AECYIWAVSZAZGJ-MRXNPFEDSA-N -1 3 352.356 3.976 20 0 FHADHM CCc1ccc([O-])c(C(=O)N2CC[C@H]3CC[C@@H](C2)N3C(=O)OC(C)(C)C)c1 ZINC000078245202 929471903 /nfs/dbraw/zinc/47/19/03/929471903.db2.gz IXWNEUNHYUKJTA-CVEARBPZSA-N -1 3 374.481 3.569 20 0 FHADHM Cc1ccc(F)c([N-]S(=O)(=O)c2ccc(F)cc2Br)c1 ZINC000037408668 929505173 /nfs/dbraw/zinc/50/51/73/929505173.db2.gz ZRRUAVCJFUEFLD-UHFFFAOYSA-N -1 3 362.195 3.837 20 0 FHADHM Cc1ccccc1Oc1cc(F)cc(F)c1[N-]C(=O)c1ccc[n+]([O-])c1 ZINC001167317998 929745155 /nfs/dbraw/zinc/74/51/55/929745155.db2.gz NWXGIGVKWMUVRW-UHFFFAOYSA-N -1 3 356.328 3.951 20 0 FHADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CC[C@H](O)C12CCCC2 ZINC000579992439 929786917 /nfs/dbraw/zinc/78/69/17/929786917.db2.gz WHXZTDOWIXUNEQ-FQEVSTJZSA-N -1 3 351.446 3.503 20 0 FHADHM Cc1cc(=O)[n-]c(-c2cccc(NC(=O)Cc3c(F)cccc3Cl)c2)n1 ZINC000047318190 929867409 /nfs/dbraw/zinc/86/74/09/929867409.db2.gz UKPHTCLYZFSRJL-UHFFFAOYSA-N -1 3 371.799 3.719 20 0 FHADHM C[C@@H](C(=O)OC(C)(C)C)N(C(=O)CCCc1ccc([O-])c(F)c1)C1CC1 ZINC000412506564 929924132 /nfs/dbraw/zinc/92/41/32/929924132.db2.gz LTVIQGQDFFZDCU-ZDUSSCGKSA-N -1 3 365.445 3.575 20 0 FHADHM COc1cccc(-n2cc(C(=O)[N-]c3cc(Cl)ccc3SC)nn2)c1 ZINC001125404089 930003516 /nfs/dbraw/zinc/00/35/16/930003516.db2.gz LRXXXVKWTGRIRP-UHFFFAOYSA-N -1 3 374.853 3.904 20 0 FHADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CC[C@@]2(O)CCCC[C@H]2C1 ZINC000092759378 937388634 /nfs/dbraw/zinc/38/86/34/937388634.db2.gz GEVOQMLGTBFYMO-CVDCTZTESA-N -1 3 365.473 3.750 20 0 FHADHM O=C(CSCc1cc(=O)[n-]c(C2CC2)n1)Nc1ccc(F)cc1Cl ZINC000580301333 930451851 /nfs/dbraw/zinc/45/18/51/930451851.db2.gz DHAZPSSQBFNKKR-UHFFFAOYSA-N -1 3 367.833 3.724 20 0 FHADHM O=C(Nc1cccc(C(=O)c2ccccc2)c1)c1cc(=O)[n-]c(C2CC2)n1 ZINC000580303656 930454217 /nfs/dbraw/zinc/45/42/17/930454217.db2.gz KRETYGDZPXBNDL-UHFFFAOYSA-N -1 3 359.385 3.543 20 0 FHADHM CC[C@@H](Oc1ccccc1C(C)C)C(=O)NC(C)(C)c1nc(C)cc(=O)[n-]1 ZINC000622739121 930521147 /nfs/dbraw/zinc/52/11/47/930521147.db2.gz VDPNZYDSVMNHNC-MRXNPFEDSA-N -1 3 371.481 3.823 20 0 FHADHM COc1cc(C)c(S(=O)(=O)[N-]c2cc(O)c(C)cc2C)cc1Cl ZINC000683926088 930630253 /nfs/dbraw/zinc/63/02/53/930630253.db2.gz IBEQIBODSARUOL-UHFFFAOYSA-N -1 3 355.843 3.780 20 0 FHADHM CC(C)c1nccn1Cc1cccc(NC([O-])=NO[C@@H]2CCCCO2)c1 ZINC000155773689 930804873 /nfs/dbraw/zinc/80/48/73/930804873.db2.gz LVGXSUCBQNZYRY-QGZVFWFLSA-N -1 3 358.442 3.635 20 0 FHADHM CC(C)c1nccn1Cc1cccc(NC(=O)[N-]O[C@@H]2CCCCO2)c1 ZINC000155773689 930804878 /nfs/dbraw/zinc/80/48/78/930804878.db2.gz LVGXSUCBQNZYRY-QGZVFWFLSA-N -1 3 358.442 3.635 20 0 FHADHM 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Cc1ccc(CC(=O)[N-]O[C@H](C)c2nc(-c3ccc(C)c(F)c3)no2)cc1 ZINC000178160005 940727003 /nfs/dbraw/zinc/72/70/03/940727003.db2.gz DATLQSPRADKHPD-CQSZACIVSA-N -1 3 369.396 3.844 20 0 FHADHM CCCCCn1nc(C(=O)Nc2cc(F)ccc2[O-])c2ccccc2c1=O ZINC000174872295 940782040 /nfs/dbraw/zinc/78/20/40/940782040.db2.gz WRMOUEFOYAWDQV-UHFFFAOYSA-N -1 3 369.396 3.684 20 0 FHADHM CC[C@]1(C(=O)Nc2cccc([O-])c2F)CCCN1C(=O)OC(C)(C)C ZINC000180246990 940872533 /nfs/dbraw/zinc/87/25/33/940872533.db2.gz UVUZGDVHZLKVHI-GOSISDBHSA-N -1 3 352.406 3.650 20 0 FHADHM Cc1cnc([C@@H](C)[N-]S(=O)(=O)c2cc(Cl)ccc2Cl)s1 ZINC000175627243 940896632 /nfs/dbraw/zinc/89/66/32/940896632.db2.gz GIGYPWKNXGPACB-MRVPVSSYSA-N -1 3 351.280 3.798 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@H]3CC(=O)c4ccccc43)c2)n1 ZINC000376402979 940925028 /nfs/dbraw/zinc/92/50/28/940925028.db2.gz WWTHPAYSBXSFQR-SFHVURJKSA-N -1 3 373.412 3.720 20 0 FHADHM O=S(=O)([N-]CCC[C@H]1CCCCO1)c1cc(Cl)ccc1Cl ZINC000186160661 940954137 /nfs/dbraw/zinc/95/41/37/940954137.db2.gz SJALLSKDOFSBDU-GFCCVEGCSA-N -1 3 352.283 3.621 20 0 FHADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)[C@@H](c3ccccc3)C3CC3)c2)n1 ZINC000162372844 941025847 /nfs/dbraw/zinc/02/58/47/941025847.db2.gz NAJYWEFJZQTMOE-FQEVSTJZSA-N -1 3 360.413 3.845 20 0 FHADHM CCOc1cc(C(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)cc(Cl)c1[O-] ZINC000186970767 941071255 /nfs/dbraw/zinc/07/12/55/941071255.db2.gz UCMMHHAIRPCEPF-FUHWJXTLSA-N -1 3 374.868 3.620 20 0 FHADHM CCc1noc(-c2ccc(C)c(NC(=O)c3cc(OC)ccc3[O-])c2)n1 ZINC000176756392 941073557 /nfs/dbraw/zinc/07/35/57/941073557.db2.gz RNMXHLVIXXODQY-UHFFFAOYSA-N -1 3 353.378 3.574 20 0 FHADHM CCc1c([N-]S(=O)(=O)[C@@H]2C[C@H]2c2ccccc2)cnn1CCC(C)C ZINC000414381096 941073744 /nfs/dbraw/zinc/07/37/44/941073744.db2.gz KVQNPHGKNAXEBY-QFBILLFUSA-N -1 3 361.511 3.789 20 0 FHADHM CS(=O)(=O)[N-]c1ccccc1NC(=O)c1cc2ccc(F)cc2s1 ZINC000024888918 941074464 /nfs/dbraw/zinc/07/44/64/941074464.db2.gz MEJFLLSFHMFSMT-UHFFFAOYSA-N -1 3 364.423 3.664 20 0 FHADHM CCCCOCCOCc1cccc(NC(=O)c2cccc3n[n-]nc32)c1 ZINC000187604102 941107710 /nfs/dbraw/zinc/10/77/10/941107710.db2.gz KBITZBYUCNYISS-UHFFFAOYSA-N -1 3 368.437 3.544 20 0 FHADHM Cc1csc(C2(NC(=O)c3cc([O-])cc(C(F)(F)F)c3)CCC2)n1 ZINC000623019604 941162086 /nfs/dbraw/zinc/16/20/86/941162086.db2.gz ZUHUQRIVSQZKGS-UHFFFAOYSA-N -1 3 356.369 3.985 20 0 FHADHM O=S(=O)([N-][C@@H]1CCC(F)(F)C1)c1ccc(Br)cc1Cl ZINC000311703225 941298044 /nfs/dbraw/zinc/29/80/44/941298044.db2.gz MJZQNCIDIZOPTK-MRVPVSSYSA-N -1 3 374.634 3.569 20 0 FHADHM COc1cc(-c2nc3ccc(F)cc3n2C)cc(Br)c1[O-] ZINC000178976282 941328602 /nfs/dbraw/zinc/32/86/02/941328602.db2.gz PHCNHCGNLOJADQ-UHFFFAOYSA-N -1 3 351.175 3.856 20 0 FHADHM Cc1n[nH]cc1C(=O)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000179934635 941350473 /nfs/dbraw/zinc/35/04/73/941350473.db2.gz NDFLMTMNZJUKHS-UHFFFAOYSA-N -1 3 350.403 3.953 20 0 FHADHM Cc1noc(C)c1C(C)(C)[N-]C(=O)C(F)(F)c1cnc(Cl)c(C)c1 ZINC000935963586 941375633 /nfs/dbraw/zinc/37/56/33/941375633.db2.gz QHWHVRAMDRWLRJ-UHFFFAOYSA-N -1 3 357.788 3.792 20 0 FHADHM Cc1c(Cl)cccc1NC(=O)[C@@H]1CCCN1C(=O)c1ccccc1[O-] ZINC000181765723 941382336 /nfs/dbraw/zinc/38/23/36/941382336.db2.gz FGCVKWWDEKAOMG-INIZCTEOSA-N -1 3 358.825 3.597 20 0 FHADHM Cc1cc(C)c2ncc(C(=O)[O-])c(N3CCC(c4ccon4)CC3)c2c1 ZINC000659788237 941395380 /nfs/dbraw/zinc/39/53/80/941395380.db2.gz ZZSTWJQGBRPSRP-UHFFFAOYSA-N -1 3 351.406 3.922 20 0 FHADHM O=C([O-])c1ccc(CN2CC[C@H](c3ccccc3)[C@H](CO)C2)cc1Cl ZINC000659797078 941401347 /nfs/dbraw/zinc/40/13/47/941401347.db2.gz BPMIBIBRSAUIIY-DLBZAZTESA-N -1 3 359.853 3.636 20 0 FHADHM CCn1c2ccc(C(=O)[O-])cc2nc1CN(C)C[C@H]1CCc2ccccc21 ZINC000659804482 941406308 /nfs/dbraw/zinc/40/63/08/941406308.db2.gz XWIDTHHGSLIKLS-QGZVFWFLSA-N -1 3 363.461 3.916 20 0 FHADHM O=C(c1ccc(O)cc1[O-])N1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000182311735 941415652 /nfs/dbraw/zinc/41/56/52/941415652.db2.gz QFILFNFVZGWPGZ-MRXNPFEDSA-N -1 3 368.216 3.618 20 0 FHADHM Cc1ccc(N2CCc3c(cccc3NCc3cc([O-])cc(F)c3)C2)nn1 ZINC000376881604 941457654 /nfs/dbraw/zinc/45/76/54/941457654.db2.gz GLJJHZMRXIEONP-UHFFFAOYSA-N -1 3 364.424 3.805 20 0 FHADHM O=C(C[C@H](NC(=O)c1ccc([O-])cc1)c1ccccc1)NC1CCCCC1 ZINC000182874276 941466013 /nfs/dbraw/zinc/46/60/13/941466013.db2.gz RWGCNFHPDWYNOG-FQEVSTJZSA-N -1 3 366.461 3.702 20 0 FHADHM CCN(C(=O)C[C@H](NC(=O)c1ccc([O-])cc1)c1ccccc1)C(C)C ZINC000183331011 941502399 /nfs/dbraw/zinc/50/23/99/941502399.db2.gz JXDZWHCWDSGEQH-IBGZPJMESA-N -1 3 354.450 3.510 20 0 FHADHM O=C(OC[C@H]1CC[C@@H](C(F)(F)F)O1)c1cccc2[n-]c(C(F)F)nc21 ZINC000924085590 941531664 /nfs/dbraw/zinc/53/16/64/941531664.db2.gz LWCRNAYKYMXBPR-XCBNKYQSSA-N -1 3 364.270 3.767 20 0 FHADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)c3ccccc3OC3CC3)cc2)n1 ZINC000377300997 941627789 /nfs/dbraw/zinc/62/77/89/941627789.db2.gz PBMBHIRFNOTHJK-UHFFFAOYSA-N -1 3 361.401 3.539 20 0 FHADHM O=C(c1c[n-]c2cc(F)c(F)cc2c1=O)N1CCC[C@H]1C1CCCCC1 ZINC000892914512 941679344 /nfs/dbraw/zinc/67/93/44/941679344.db2.gz SFHLNALDHQNLKV-SFHVURJKSA-N -1 3 360.404 3.991 20 0 FHADHM CCOc1ccc(Oc2ccc(Cl)cc2[N-]S(=O)(=O)N(C)C)cc1 ZINC000460451451 941752540 /nfs/dbraw/zinc/75/25/40/941752540.db2.gz PTKGGDPCNCGRLI-UHFFFAOYSA-N -1 3 370.858 3.749 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N3CC[C@H](CC(F)(F)F)C3)nc2)n1 ZINC000433810758 941906168 /nfs/dbraw/zinc/90/61/68/941906168.db2.gz GJPPVUGCCMXGAT-LLVKDONJSA-N -1 3 352.360 3.585 20 0 FHADHM CC1(C)C[C@@H](N(Cc2ccccc2)C(=O)NCc2ccc([O-])c(F)c2)CO1 ZINC000664189877 941941698 /nfs/dbraw/zinc/94/16/98/941941698.db2.gz APQZBVLSIRWYON-QGZVFWFLSA-N -1 3 372.440 3.811 20 0 FHADHM CC(C)[C@@H](NC(=O)c1ccc(Cl)s1)C(=O)Nc1cc(F)ccc1[O-] ZINC000513627507 942053035 /nfs/dbraw/zinc/05/30/35/942053035.db2.gz SUEQODGCVUSUIZ-CQSZACIVSA-N -1 3 370.833 3.639 20 0 FHADHM O=C(NCc1nc(-c2ccc(Cl)cc2)no1)c1cc([O-])ccc1Cl ZINC000377958414 942092756 /nfs/dbraw/zinc/09/27/56/942092756.db2.gz NONOZBWQDWGENY-UHFFFAOYSA-N -1 3 364.188 3.679 20 0 FHADHM Cc1cc(S(=O)(=O)[N-]C[C@H]2CC23CCSCC3)sc1Cl ZINC000420711022 942170456 /nfs/dbraw/zinc/17/04/56/942170456.db2.gz WXJVNPROUSFYPO-SNVBAGLBSA-N -1 3 351.946 3.522 20 0 FHADHM COC(=O)c1[n-]c(=N[C@@H]2C[C@@H]2c2ccccc2C(F)(F)F)sc1C ZINC000434095917 942174345 /nfs/dbraw/zinc/17/43/45/942174345.db2.gz NEORDLRCBSVKSB-ZYHUDNBSSA-N -1 3 356.369 3.647 20 0 FHADHM CC[C@H]1C[C@H]([N-]S(=O)(=O)c2oc3ccc(Cl)cc3c2C)CCO1 ZINC000420727567 942177710 /nfs/dbraw/zinc/17/77/10/942177710.db2.gz ORZUSEGTGDPOAX-OLZOCXBDSA-N -1 3 357.859 3.631 20 0 FHADHM Cc1c(NC(=O)c2cc3c(cc2[O-])CCCC3)cccc1NC(=O)N(C)C ZINC000280497997 942190848 /nfs/dbraw/zinc/19/08/48/942190848.db2.gz HMMFBIDMVJJNBN-UHFFFAOYSA-N -1 3 367.449 3.925 20 0 FHADHM C[C@H](NC(=O)c1cc([O-])ccc1Cl)c1ccc(-c2cncnc2)cc1 ZINC000378038119 942208299 /nfs/dbraw/zinc/20/82/99/942208299.db2.gz JQXSTHGOGPHWRY-LBPRGKRZSA-N -1 3 353.809 3.994 20 0 FHADHM O=C([N-]c1nc(-c2cccs2)ns1)c1cc(OCC(F)F)ccn1 ZINC000182132187 942210926 /nfs/dbraw/zinc/21/09/26/942210926.db2.gz LBWYNVTTWMJYRW-UHFFFAOYSA-N -1 3 368.390 3.558 20 0 FHADHM Cc1n[nH]c([N-]S(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Br ZINC000414472522 942212177 /nfs/dbraw/zinc/21/21/77/942212177.db2.gz SGKQPUMHFWVLIS-UHFFFAOYSA-N -1 3 372.288 3.579 20 0 FHADHM CC(C)(C)n1cc(C(=O)[N-]c2cc(F)ccc2SCC(F)F)nn1 ZINC000187853700 942231275 /nfs/dbraw/zinc/23/12/75/942231275.db2.gz GSBXAPVGMKZNOY-UHFFFAOYSA-N -1 3 358.389 3.782 20 0 FHADHM O=C([N-]c1c(F)cc(Br)cc1F)c1cn2ccnc2s1 ZINC000187965034 942278765 /nfs/dbraw/zinc/27/87/65/942278765.db2.gz XYKYRWYOPJNJEE-UHFFFAOYSA-N -1 3 358.167 3.689 20 0 FHADHM O=C(CCSCc1cc(=O)[n-]c(-c2ccccc2)n1)NC1CCCC1 ZINC000419598213 942327030 /nfs/dbraw/zinc/32/70/30/942327030.db2.gz CEPIQADQADNFKI-UHFFFAOYSA-N -1 3 357.479 3.531 20 0 FHADHM CCOc1ccc(NC(=O)[C@@H](C)SCc2cc(=O)[n-]c(C3CC3)n2)cc1 ZINC000419609194 942334091 /nfs/dbraw/zinc/33/40/91/942334091.db2.gz WLDOQCZZSDUGJJ-GFCCVEGCSA-N -1 3 373.478 3.719 20 0 FHADHM Cc1c([N+](=O)[O-])cc(C(=O)[N-]c2c(F)cc(Cl)cc2F)cc1[N+](=O)[O-] ZINC000180347750 942355800 /nfs/dbraw/zinc/35/58/00/942355800.db2.gz MPBFAWJIBBANJJ-UHFFFAOYSA-N -1 3 371.683 3.995 20 0 FHADHM CCOC(=O)c1ncc(NC(=O)C2(c3cccc(Cl)c3)CCCC2)[n-]1 ZINC000617874072 942376627 /nfs/dbraw/zinc/37/66/27/942376627.db2.gz XZKPYUXNXMXAKK-UHFFFAOYSA-N -1 3 361.829 3.690 20 0 FHADHM CCOC(=O)c1nc(NC(=O)C2(c3cccc(Cl)c3)CCCC2)c[n-]1 ZINC000617874072 942376634 /nfs/dbraw/zinc/37/66/34/942376634.db2.gz XZKPYUXNXMXAKK-UHFFFAOYSA-N -1 3 361.829 3.690 20 0 FHADHM COc1cc([N-]S(=O)(=O)C[C@H](CC(C)C)OC)cc(OC)c1C(C)C ZINC000421148680 942384249 /nfs/dbraw/zinc/38/42/49/942384249.db2.gz HAWCPCQJPOSAJN-HNNXBMFYSA-N -1 3 373.515 3.630 20 0 FHADHM Cn1[n-]c(CN[C@@H](c2cccc(C(F)(F)F)c2)C2CCCCC2)nc1=O ZINC000549402031 942393943 /nfs/dbraw/zinc/39/39/43/942393943.db2.gz BTRINQFPGHPSEM-MRXNPFEDSA-N -1 3 368.403 3.538 20 0 FHADHM Cn1[n-]c(CN[C@H](c2cccc(C(F)(F)F)c2)C2CCCCC2)nc1=O ZINC000549402030 942394447 /nfs/dbraw/zinc/39/44/47/942394447.db2.gz BTRINQFPGHPSEM-INIZCTEOSA-N -1 3 368.403 3.538 20 0 FHADHM Cn1ccnc1[C@H]1CCN(C(=O)c2cc(Oc3ccccc3)ccc2[O-])C1 ZINC000378264192 942488319 /nfs/dbraw/zinc/48/83/19/942488319.db2.gz QNOUYSGFIVISMW-HNNXBMFYSA-N -1 3 363.417 3.548 20 0 FHADHM CC(=O)c1ccc(C(=O)N2CCC[C@H]2Cc2cc(F)ccc2F)cc1[O-] ZINC000420111230 942526131 /nfs/dbraw/zinc/52/61/31/942526131.db2.gz GFVFBTCMPDZEHE-INIZCTEOSA-N -1 3 359.372 3.720 20 0 FHADHM CCCCc1nc(NC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)c(C(=O)OCC)[n-]1 ZINC001269124910 942529049 /nfs/dbraw/zinc/52/90/49/942529049.db2.gz YFZXEZWKRJBNKD-LSDHHAIUSA-N -1 3 373.428 3.810 20 0 FHADHM CCCCc1nc(NC(=O)c2cc(C)cc(Cl)n2)c(C(=O)OCC)[n-]1 ZINC001269128155 942541125 /nfs/dbraw/zinc/54/11/25/942541125.db2.gz BNDBASVLYPREBE-UHFFFAOYSA-N -1 3 364.833 3.538 20 0 FHADHM O=C(N[C@H]1CCSc2ccc(Cl)cc21)c1cc(F)cc2n[n-]nc21 ZINC000501556073 942546781 /nfs/dbraw/zinc/54/67/81/942546781.db2.gz ZNCALQSSARBUNX-LBPRGKRZSA-N -1 3 362.817 3.717 20 0 FHADHM CC(C)(c1ccc(C(=O)N2CCCc3c(=O)[n-]cnc32)cc1)C(F)(F)F ZINC000893207295 942604437 /nfs/dbraw/zinc/60/44/37/942604437.db2.gz NWNOJSZRMHHANB-UHFFFAOYSA-N -1 3 365.355 3.615 20 0 FHADHM C[C@H](Sc1nnc([N-]c2ccccc2F)s1)C(=O)N1CCCCC1 ZINC000010078159 942648514 /nfs/dbraw/zinc/64/85/14/942648514.db2.gz RARJTKARXDYATE-NSHDSACASA-N -1 3 366.487 3.914 20 0 FHADHM COc1ccc(C2([N-]C(=O)C(F)(F)c3cc(F)cc(F)c3)CC2)cc1 ZINC001125875304 942648577 /nfs/dbraw/zinc/64/85/77/942648577.db2.gz MFPHZKKNYYTFKZ-UHFFFAOYSA-N -1 3 353.315 3.871 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)NC[C@H]3C(C)(C)C3(F)F)cc2)cc(=O)[n-]1 ZINC000664423197 942718590 /nfs/dbraw/zinc/71/85/90/942718590.db2.gz SNJBCPKURFEFDC-AWEZNQCLSA-N -1 3 362.380 3.570 20 0 FHADHM O=C(Cc1ccc(-n2cccn2)cc1)Nc1ccc(Br)cc1[O-] ZINC000613705472 942749396 /nfs/dbraw/zinc/74/93/96/942749396.db2.gz IOEFHGMEUMSNHV-UHFFFAOYSA-N -1 3 372.222 3.522 20 0 FHADHM Cc1csc([C@@H]([N-]S(=O)(=O)c2c(C)cccc2Cl)C2CC2)n1 ZINC000416406782 942790779 /nfs/dbraw/zinc/79/07/79/942790779.db2.gz GKYKEDXNPSPQSV-ZDUSSCGKSA-N -1 3 356.900 3.843 20 0 FHADHM C[C@@H](O)COc1cccc(-c2nc3sc(C(F)(F)F)cc3c(=O)[n-]2)c1 ZINC000416413951 942799125 /nfs/dbraw/zinc/79/91/25/942799125.db2.gz QLKBLOQGNKMYGM-MRVPVSSYSA-N -1 3 370.352 3.842 20 0 FHADHM C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)Nc1nnc(C(F)(F)F)[n-]1 ZINC000104861935 942814153 /nfs/dbraw/zinc/81/41/53/942814153.db2.gz FTVSJTVUVJVESL-YFKPBYRVSA-N -1 3 369.130 3.536 20 0 FHADHM C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)Nc1nc(C(F)(F)F)n[n-]1 ZINC000104861935 942814158 /nfs/dbraw/zinc/81/41/58/942814158.db2.gz FTVSJTVUVJVESL-YFKPBYRVSA-N -1 3 369.130 3.536 20 0 FHADHM Cc1ccc2oc(C(=O)[N-]c3nnc(Cc4ccccc4F)s3)cc2n1 ZINC000170971955 942823047 /nfs/dbraw/zinc/82/30/47/942823047.db2.gz OSSKQOWTXWFJSW-UHFFFAOYSA-N -1 3 368.393 3.970 20 0 FHADHM Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)N1CCC[C@@H](CC(F)(F)F)C1 ZINC000421950893 942903415 /nfs/dbraw/zinc/90/34/15/942903415.db2.gz CAAYUAZOWDIOBU-NSHDSACASA-N -1 3 359.392 3.593 20 0 FHADHM COc1ccc(Cl)cc1-c1cc(=NC(=O)[C@H]2CCC[C@H](F)C2)[nH][n-]1 ZINC000425161702 942911617 /nfs/dbraw/zinc/91/16/17/942911617.db2.gz YJSNLYVEMWLZEF-JQWIXIFHSA-N -1 3 351.809 3.627 20 0 FHADHM O=C(c1cc(F)cc2n[n-]nc21)N1CCc2c1cccc2-c1ccccc1 ZINC000503060193 942943509 /nfs/dbraw/zinc/94/35/09/942943509.db2.gz KSZLGOJKYHCRCM-UHFFFAOYSA-N -1 3 358.376 3.967 20 0 FHADHM Cc1nc(C)c(CCC(=O)N2CC=C(c3cccc4ccccc43)C2)c(=O)[n-]1 ZINC000378605849 942950365 /nfs/dbraw/zinc/95/03/65/942950365.db2.gz KCJMSAUKEJSUEW-UHFFFAOYSA-N -1 3 373.456 3.811 20 0 FHADHM Cc1nc(-c2ccccc2)sc1NC(=O)c1nnc2ccccc2c1[O-] ZINC000184503442 943017602 /nfs/dbraw/zinc/01/76/02/943017602.db2.gz OMHMODCFYRFIPE-UHFFFAOYSA-N -1 3 362.414 3.607 20 0 FHADHM CO[C@H]1C[C@@H](CC(=O)[O-])N(Cc2ccc(Oc3ccccc3)c(F)c2)C1 ZINC000582068622 943019122 /nfs/dbraw/zinc/01/91/22/943019122.db2.gz VNVOJJAGRIKEIL-RDJZCZTQSA-N -1 3 359.397 3.682 20 0 FHADHM CC(C)(C)OC(=O)NCCc1noc(-c2cc3ccccc3cc2[O-])n1 ZINC000273742654 943026797 /nfs/dbraw/zinc/02/67/97/943026797.db2.gz QJQVUMGZMDOBJK-UHFFFAOYSA-N -1 3 355.394 3.663 20 0 FHADHM CC(C)(C)c1nc2cc(NC(=O)c3cc(F)cc4n[n-]nc43)ccc2o1 ZINC000431896173 943041478 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ZINC000436483130 944368726 /nfs/dbraw/zinc/36/87/26/944368726.db2.gz CSRWHQXGWAPBRP-MRXNPFEDSA-N -1 3 366.442 3.850 20 0 FHADHM CCOC(=O)c1ccc(NC(=O)C2(Cc3ccc(F)cc3)CC2)c([O-])c1 ZINC000438160943 944373745 /nfs/dbraw/zinc/37/37/45/944373745.db2.gz PHRMQXZYWFVAIB-UHFFFAOYSA-N -1 3 357.381 3.669 20 0 FHADHM O=C(Nc1n[n-]c(-c2cc3ccccc3o2)n1)c1ccnn1-c1ccccc1 ZINC000473774194 944413141 /nfs/dbraw/zinc/41/31/41/944413141.db2.gz HAZFZYHLPBNOEC-UHFFFAOYSA-N -1 3 370.372 3.656 20 0 FHADHM CNC(=O)c1ccc(NC(=O)c2cc3c(cc2[O-])CCCC3)cc1Cl ZINC000436555098 944413766 /nfs/dbraw/zinc/41/37/66/944413766.db2.gz JKFFOFPRZBCTAV-UHFFFAOYSA-N -1 3 358.825 3.536 20 0 FHADHM Cc1ccc(C(N)=O)cc1NC(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436537278 944415374 /nfs/dbraw/zinc/41/53/74/944415374.db2.gz DPCNQAFEIVKSGF-UHFFFAOYSA-N -1 3 362.385 3.844 20 0 FHADHM Cc1nc(C(C)(C)NC(=O)c2cc(Oc3ccccc3)ccc2[O-])no1 ZINC000436542541 944420043 /nfs/dbraw/zinc/42/00/43/944420043.db2.gz CZHQGKNXDPVDGB-UHFFFAOYSA-N -1 3 353.378 3.541 20 0 FHADHM Cc1nc([C@H](NC(=O)c2ccc(C(C)C)cc2[O-])c2ccccc2F)no1 ZINC000436542765 944420247 /nfs/dbraw/zinc/42/02/47/944420247.db2.gz BKSVBLZCFFPOLT-GOSISDBHSA-N -1 3 369.396 3.866 20 0 FHADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CCc2ccc(O)cc2C1 ZINC000436577703 944425693 /nfs/dbraw/zinc/42/56/93/944425693.db2.gz PBZZHKJVGOOIHR-UHFFFAOYSA-N -1 3 359.425 3.887 20 0 FHADHM COc1ccc(C[C@@H]2CCCN(C(=O)c3ccc(OC)cc3[O-])C2)cc1 ZINC000436592362 944439127 /nfs/dbraw/zinc/43/91/27/944439127.db2.gz UMPWPDSKRDEDGY-INIZCTEOSA-N -1 3 355.434 3.504 20 0 FHADHM Cc1cc(C[C@@H](C)NC(=O)c2cc(CCc3ccccc3)ccc2[O-])[nH]n1 ZINC000436598323 944442832 /nfs/dbraw/zinc/44/28/32/944442832.db2.gz YLYJGZQDIUSRHC-OAHLLOKOSA-N -1 3 363.461 3.570 20 0 FHADHM [O-]c1cc2ccccc2cc1-c1nc(CCn2nnc3ccccc32)no1 ZINC000436578539 944443461 /nfs/dbraw/zinc/44/34/61/944443461.db2.gz ACMVXMRJGYOQJI-UHFFFAOYSA-N -1 3 357.373 3.583 20 0 FHADHM CN(Cc1ccc(Br)cc1Cl)C(=O)c1ccc(O)cc1[O-] ZINC000436580398 944444481 /nfs/dbraw/zinc/44/44/81/944444481.db2.gz CLKSEPLKSCFPQY-UHFFFAOYSA-N -1 3 370.630 3.786 20 0 FHADHM NC(=O)c1ccc(NC(=O)c2cc(CCc3ccccc3)ccc2[O-])cc1 ZINC000436581860 944445622 /nfs/dbraw/zinc/44/56/22/944445622.db2.gz GINMYTUIYQVYMO-UHFFFAOYSA-N -1 3 360.413 3.529 20 0 FHADHM O=S(=O)([N-]CCCC(F)(F)F)c1cc(C(F)(F)F)ccc1Cl ZINC000439234280 944447918 /nfs/dbraw/zinc/44/79/18/944447918.db2.gz HJOWAYYJEMNMBW-UHFFFAOYSA-N -1 3 369.714 3.980 20 0 FHADHM O=C(CCn1ccnc1)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000436602206 944453997 /nfs/dbraw/zinc/45/39/97/944453997.db2.gz FGHXKPFUFAEPGO-UHFFFAOYSA-N -1 3 364.430 3.894 20 0 FHADHM CC(=O)c1ccc(C(=O)Nc2ccc(-n3nc(C)cc3C)c(F)c2)cc1[O-] ZINC000436606919 944456554 /nfs/dbraw/zinc/45/65/54/944456554.db2.gz RIBWMSLEYDBIKT-UHFFFAOYSA-N -1 3 367.380 3.789 20 0 FHADHM CCN(Cc1cnn(C)c1)C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436610926 944460324 /nfs/dbraw/zinc/46/03/24/944460324.db2.gz KNLMCLVXCLAQFA-UHFFFAOYSA-N -1 3 363.461 3.573 20 0 FHADHM CC[C@@H]1CN(C(=O)c2cc(Oc3ccccc3)ccc2[O-])C[C@@H](C)[S@@]1=O ZINC000436624560 944466120 /nfs/dbraw/zinc/46/61/20/944466120.db2.gz JWIISJLFONWXEL-DOPPQHETSA-N -1 3 373.474 3.556 20 0 FHADHM CC(C)CCC1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2[O-])CC1 ZINC000436631771 944471932 /nfs/dbraw/zinc/47/19/32/944471932.db2.gz WTFHAJPEHKJLQW-LJQANCHMSA-N -1 3 372.509 3.672 20 0 FHADHM CC1CCN([C@@H](CNC(=O)c2cc(F)c([O-])c(F)c2)c2ccccc2)CC1 ZINC000436634874 944473725 /nfs/dbraw/zinc/47/37/25/944473725.db2.gz NDBCYKQOPSSSEY-IBGZPJMESA-N -1 3 374.431 3.873 20 0 FHADHM CCOc1cccc2[nH]cc(CC(=O)N=c3cc(-c4ccccc4C)[n-][nH]3)c21 ZINC000438281030 944475513 /nfs/dbraw/zinc/47/55/13/944475513.db2.gz SEWADLFMPWSLLK-UHFFFAOYSA-N -1 3 374.444 3.868 20 0 FHADHM COc1ccc([C@@H](NC(=O)c2cc(OC)c([O-])c(OC)c2)C(C)C)cc1 ZINC000436638491 944477510 /nfs/dbraw/zinc/47/75/10/944477510.db2.gz FFWWADCMDFMKQV-SFHVURJKSA-N -1 3 359.422 3.545 20 0 FHADHM COc1ccccc1[C@@H](CNC(=O)c1ccc(C(C)C)cc1[O-])N(C)C ZINC000436621748 944479075 /nfs/dbraw/zinc/47/90/75/944479075.db2.gz DNGIMEDKXOEPQL-GOSISDBHSA-N -1 3 356.466 3.557 20 0 FHADHM O=C(C[C@@H]1CCCCCN1C(=O)c1ccc(O)cc1[O-])c1ccccc1 ZINC000436623140 944479611 /nfs/dbraw/zinc/47/96/11/944479611.db2.gz FZKIPHYPECPTSN-INIZCTEOSA-N -1 3 353.418 3.756 20 0 FHADHM COc1ccc(NC(=O)c2ccc(C)c(C)c2[O-])cc1N1CCCCC1=O ZINC000436642096 944490402 /nfs/dbraw/zinc/49/04/02/944490402.db2.gz QHRZBOJACINUHT-UHFFFAOYSA-N -1 3 368.433 3.787 20 0 FHADHM O=C(Nc1cccc(COCC(F)(F)C(F)F)c1)c1c([O-])cccc1O ZINC000436648792 944496945 /nfs/dbraw/zinc/49/69/45/944496945.db2.gz RPVMUYNFKWRJCZ-UHFFFAOYSA-N -1 3 373.302 3.767 20 0 FHADHM CCCCOc1ccc([C@H](C)NC(=O)c2c([O-])cccc2O)cc1OC ZINC000436647280 944497057 /nfs/dbraw/zinc/49/70/57/944497057.db2.gz LFHSRMFXAFAULQ-ZDUSSCGKSA-N -1 3 359.422 3.776 20 0 FHADHM CC[C@@H](C)Oc1cccc(NC(=O)CCNC(=O)c2ccc(C)cc2[O-])c1 ZINC000436665094 944498947 /nfs/dbraw/zinc/49/89/47/944498947.db2.gz LLZSMZOMPILTOG-OAHLLOKOSA-N -1 3 370.449 3.637 20 0 FHADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1CC[C@@H](COC(F)F)C1 ZINC000436665100 944498956 /nfs/dbraw/zinc/49/89/56/944498956.db2.gz LNOQZFNLSGARDV-CYBMUJFWSA-N -1 3 363.360 3.886 20 0 FHADHM CCOc1ccc(Cl)cc1CCNC(=O)c1ccc(C(C)=O)c([O-])c1 ZINC000436666583 944500347 /nfs/dbraw/zinc/50/03/47/944500347.db2.gz RCGCRMQILGPBEG-UHFFFAOYSA-N -1 3 361.825 3.619 20 0 FHADHM Cc1n[nH]cc1CCCNC(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436666578 944500585 /nfs/dbraw/zinc/50/05/85/944500585.db2.gz RATBWEROZVEDIW-UHFFFAOYSA-N -1 3 363.461 3.572 20 0 FHADHM CCC(=O)c1ccc([O-])c(NC(=O)c2cn[nH]c2-c2ccc(F)cc2)c1 ZINC000436659122 944509369 /nfs/dbraw/zinc/50/93/69/944509369.db2.gz QALIYRQYYFBUFK-UHFFFAOYSA-N -1 3 353.353 3.766 20 0 FHADHM O=C(c1ccc([O-])cc1)N1CCN(C/C=C/c2ccc(Cl)cc2)CC1 ZINC000436694725 944534650 /nfs/dbraw/zinc/53/46/50/944534650.db2.gz IMEHMCSORMWZQJ-OWOJBTEDSA-N -1 3 356.853 3.517 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N2CCC[C@H]2c2ccc(C)c(C)c2)c1 ZINC000121982291 944545541 /nfs/dbraw/zinc/54/55/41/944545541.db2.gz MXTHDBLAFXPDDH-IBGZPJMESA-N -1 3 352.434 3.945 20 0 FHADHM Cc1noc(C(C)(C)NC(=O)c2cc(Oc3ccccc3)ccc2[O-])n1 ZINC000436726190 944547892 /nfs/dbraw/zinc/54/78/92/944547892.db2.gz WZHFKAPNHYBUNT-UHFFFAOYSA-N -1 3 353.378 3.541 20 0 FHADHM CC[C@@H](C)N[C@@H](CNC(=O)c1cc(F)c([O-])c(Cl)c1)c1ccco1 ZINC000436713938 944552654 /nfs/dbraw/zinc/55/26/54/944552654.db2.gz DMPXAZGXADNSBU-YGRLFVJLSA-N -1 3 354.809 3.637 20 0 FHADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CCC[C@H]1[C@@H]1CCCO1 ZINC000436715794 944554178 /nfs/dbraw/zinc/55/41/78/944554178.db2.gz QVQZYAXEBIHIHJ-FPOVZHCZSA-N -1 3 351.446 3.767 20 0 FHADHM CCOc1ccccc1[C@@H](CC)NC(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000505870677 944557892 /nfs/dbraw/zinc/55/78/92/944557892.db2.gz AFWFTWROTQDTLY-MRXNPFEDSA-N -1 3 350.418 3.808 20 0 FHADHM Cc1[nH]nc2nc(C)cc(C(=O)Nc3ccc([O-])c(C(F)(F)F)c3)c12 ZINC000436721788 944561061 /nfs/dbraw/zinc/56/10/61/944561061.db2.gz KMVGJDMMVKMZPZ-UHFFFAOYSA-N -1 3 350.300 3.551 20 0 FHADHM CC[C@@H](c1ccccc1OC)N(C)C(=O)c1cc(NC(C)=O)ccc1[O-] ZINC000436740689 944569789 /nfs/dbraw/zinc/56/97/89/944569789.db2.gz RANYJVBMTGJOIO-KRWDZBQOSA-N -1 3 356.422 3.583 20 0 FHADHM CC[C@H](c1ccccc1OC)N(C)C(=O)c1cc(NC(C)=O)ccc1[O-] ZINC000436740690 944569827 /nfs/dbraw/zinc/56/98/27/944569827.db2.gz RANYJVBMTGJOIO-QGZVFWFLSA-N -1 3 356.422 3.583 20 0 FHADHM Cc1ncsc1C[N-]C(=O)C(F)(F)c1cccc(Br)c1 ZINC001125941125 944570281 /nfs/dbraw/zinc/57/02/81/944570281.db2.gz DDLVOGBHGOZOQZ-UHFFFAOYSA-N -1 3 361.211 3.622 20 0 FHADHM COc1cccc(N2CC[C@H](CNC(=O)c3ccc(C(C)C)cc3[O-])C2)c1 ZINC000436727325 944574712 /nfs/dbraw/zinc/57/47/12/944574712.db2.gz YUDUSWAIVHPAIC-MRXNPFEDSA-N -1 3 368.477 3.781 20 0 FHADHM COc1cccc(C(=O)Nc2ccc(Oc3ccccc3F)nc2)c1[O-] ZINC000436728418 944575374 /nfs/dbraw/zinc/57/53/74/944575374.db2.gz LLCKPQSCDLCHPR-UHFFFAOYSA-N -1 3 354.337 3.980 20 0 FHADHM CN1CCN(C(=O)c2ccc3ccccc3c2[O-])C[C@@H]1Cc1ccccc1 ZINC000436731632 944578095 /nfs/dbraw/zinc/57/80/95/944578095.db2.gz MWZOPIGUKZETRV-IBGZPJMESA-N -1 3 360.457 3.544 20 0 FHADHM COc1ccc(NC(=O)c2cc(C)ccc2[O-])cc1OCC(F)(F)F ZINC000436759719 944582409 /nfs/dbraw/zinc/58/24/09/944582409.db2.gz FELUBGYWHAMVQS-UHFFFAOYSA-N -1 3 355.312 3.903 20 0 FHADHM CCN(CC)C(=O)COc1cccc(NC(=O)c2ccc(C)c(C)c2[O-])c1 ZINC000436761359 944583802 /nfs/dbraw/zinc/58/38/02/944583802.db2.gz YORDCDWEZOUHNB-UHFFFAOYSA-N -1 3 370.449 3.509 20 0 FHADHM CC[C@@](C)([N-]S(=O)(=O)c1cc(F)c(C)cc1F)c1nc(C)cs1 ZINC000122322636 944587387 /nfs/dbraw/zinc/58/73/87/944587387.db2.gz OSQLGCIDHDJVOZ-OAHLLOKOSA-N -1 3 360.451 3.642 20 0 FHADHM Cc1nn(C)c(C)c1CCNC(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436754124 944594505 /nfs/dbraw/zinc/59/45/05/944594505.db2.gz HMFRDEVVZMZRQJ-UHFFFAOYSA-N -1 3 365.433 3.507 20 0 FHADHM COc1ccc(C(=O)NCCc2nc3cc(Cl)ccc3s2)c([O-])c1 ZINC000436756126 944597064 /nfs/dbraw/zinc/59/70/64/944597064.db2.gz PGTFJLJDLWKXBS-UHFFFAOYSA-N -1 3 362.838 3.636 20 0 FHADHM Cc1ccc(C(=O)NCCC(=O)Nc2ccccc2NC(C)(C)C)c([O-])c1 ZINC000436774303 944605145 /nfs/dbraw/zinc/60/51/45/944605145.db2.gz MPAXHVGTKXYZSV-UHFFFAOYSA-N -1 3 369.465 3.670 20 0 FHADHM Cc1cc(C)cc(-c2nnc([N-]C(=O)c3csc(NC4CC4)n3)s2)c1 ZINC000426383822 944620819 /nfs/dbraw/zinc/62/08/19/944620819.db2.gz WPTFKMHFAYAMFB-UHFFFAOYSA-N -1 3 371.491 3.527 20 0 FHADHM CCc1nc(C(=O)Nc2cc(F)ccc2[O-])nn1-c1ccccc1Cl ZINC000436800074 944623599 /nfs/dbraw/zinc/62/35/99/944623599.db2.gz HNJRFGRQDTWONO-UHFFFAOYSA-N -1 3 360.776 3.580 20 0 FHADHM CCN(CC)C(=O)c1ccc(CNC(=O)c2ccc(C(C)C)cc2[O-])cc1 ZINC000436783648 944629173 /nfs/dbraw/zinc/62/91/73/944629173.db2.gz NCECNLRCOWJWOQ-UHFFFAOYSA-N -1 3 368.477 3.928 20 0 FHADHM COC(=O)c1ccc(-c2nc(-c3ccc(C(F)(F)F)c(F)c3)no2)[n-]1 ZINC000426390741 944631613 /nfs/dbraw/zinc/63/16/13/944631613.db2.gz LXIZPYITBPONDR-UHFFFAOYSA-N -1 3 355.247 3.676 20 0 FHADHM CC(C)Cn1ccc2c1cccc2C(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000446090768 944633580 /nfs/dbraw/zinc/63/35/80/944633580.db2.gz MTCGVPREYDLRPS-UHFFFAOYSA-N -1 3 360.421 3.730 20 0 FHADHM CC(C)Cn1ccc2c1cccc2C(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000446090768 944633581 /nfs/dbraw/zinc/63/35/81/944633581.db2.gz MTCGVPREYDLRPS-UHFFFAOYSA-N -1 3 360.421 3.730 20 0 FHADHM CCc1ccc(C(=O)Nc2cccc(C)c2C(=O)N2CCCC2)c([O-])c1 ZINC000436820198 944655364 /nfs/dbraw/zinc/65/53/64/944655364.db2.gz PXXKEFRQSFESIE-UHFFFAOYSA-N -1 3 352.434 3.751 20 0 FHADHM CCc1ccc(C(=O)N2CCC[C@H]2c2ccc(OC)cc2OC)c([O-])c1 ZINC000436802671 944657653 /nfs/dbraw/zinc/65/76/53/944657653.db2.gz JYHUNJLLVCSKEN-SFHVURJKSA-N -1 3 355.434 3.949 20 0 FHADHM CCc1ccc(C(=O)N(Cc2nc3ccccc3c(=O)[nH]2)C(C)C)c([O-])c1 ZINC000436805425 944661740 /nfs/dbraw/zinc/66/17/40/944661740.db2.gz DSKGPRPWNAKFMH-UHFFFAOYSA-N -1 3 365.433 3.654 20 0 FHADHM O=C(N=c1cc([C@@H]2CCCO2)[n-][nH]1)c1cccc(-c2c(F)cccc2F)c1 ZINC000473846010 944667299 /nfs/dbraw/zinc/66/72/99/944667299.db2.gz HKFOSIWIZFMECR-KRWDZBQOSA-N -1 3 369.371 3.881 20 0 FHADHM CC(C)c1ccc(C(=O)N[C@H](C)c2noc(Cc3ccccc3)n2)c([O-])c1 ZINC000436811873 944667603 /nfs/dbraw/zinc/66/76/03/944667603.db2.gz VVMSHUANWDOVIR-CQSZACIVSA-N -1 3 365.433 3.980 20 0 FHADHM Cc1cccc(CN(CCN(C)C)C(=O)c2cc(F)cc(Cl)c2[O-])c1 ZINC000436810539 944667827 /nfs/dbraw/zinc/66/78/27/944667827.db2.gz SDVRTTQDVQCIJE-UHFFFAOYSA-N -1 3 364.848 3.697 20 0 FHADHM COCCN(Cc1cc(Br)cs1)C(=O)c1ccccc1[O-] ZINC000436813060 944668405 /nfs/dbraw/zinc/66/84/05/944668405.db2.gz CPLNMOYOMUCKGE-UHFFFAOYSA-N -1 3 370.268 3.505 20 0 FHADHM CN(C(=O)C[C@H](NC(=O)c1ccc([O-])cc1)c1ccccc1)[C@@H]1CC1(C)C ZINC000436815931 944673004 /nfs/dbraw/zinc/67/30/04/944673004.db2.gz QJFHWNNVYVIYFQ-RBUKOAKNSA-N -1 3 366.461 3.510 20 0 FHADHM CC[C@H](C(=O)N=c1cc([C@H]2CCCO2)[n-][nH]1)c1cccc(C(F)(F)F)c1 ZINC000473848726 944681067 /nfs/dbraw/zinc/68/10/67/944681067.db2.gz SXBPAOQDPCBRNE-DZGCQCFKSA-N -1 3 367.371 3.834 20 0 FHADHM CCc1ccc([O-])c(C(=O)N2CCCN(c3ccccc3Cl)CC2)c1 ZINC000514098147 944684462 /nfs/dbraw/zinc/68/44/62/944684462.db2.gz DPEBUCOCHAHMBY-UHFFFAOYSA-N -1 3 358.869 3.961 20 0 FHADHM O=C([O-])COc1ccc(CCNCc2ncc(-c3ccccc3)s2)cc1 ZINC000426686794 944686883 /nfs/dbraw/zinc/68/68/83/944686883.db2.gz HKKWXJNQUVYYAO-UHFFFAOYSA-N -1 3 368.458 3.606 20 0 FHADHM CCc1ccc(C(=O)Nc2ccccc2CN2C[C@@H](C)O[C@H](C)C2)c([O-])c1 ZINC000436820858 944689312 /nfs/dbraw/zinc/68/93/12/944689312.db2.gz SZCLGRYCPBMINV-HZPDHXFCSA-N -1 3 368.477 3.816 20 0 FHADHM CCCCOc1ccc(C(=O)N2CCc3cccc(OC)c3CC2)c([O-])c1 ZINC000436823240 944691672 /nfs/dbraw/zinc/69/16/72/944691672.db2.gz TVOLMFAEUUXBBE-UHFFFAOYSA-N -1 3 369.461 3.821 20 0 FHADHM CN(Cc1cc(Br)ccc1Cl)C(=O)c1c([O-])cccc1O ZINC000436823184 944692019 /nfs/dbraw/zinc/69/20/19/944692019.db2.gz SOFYKOAGYUWNDU-UHFFFAOYSA-N -1 3 370.630 3.786 20 0 FHADHM CCc1ccc(C(=O)Nc2ccc(-c3nnc4n3CCCC4)cc2)c([O-])c1 ZINC000436823737 944692919 /nfs/dbraw/zinc/69/29/19/944692919.db2.gz WUSFRGIACPGRJE-UHFFFAOYSA-N -1 3 362.433 3.802 20 0 FHADHM CCc1ccc(C(=O)N(Cc2cccc(OC)c2)C[C@H]2CCCO2)c([O-])c1 ZINC000436828123 944699679 /nfs/dbraw/zinc/69/96/79/944699679.db2.gz 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3.621 20 0 FHADHM CCc1ccc(-c2nc(-c3ccc4oc(N(C)C)nc4c3)no2)c([O-])c1 ZINC000436867733 944733781 /nfs/dbraw/zinc/73/37/81/944733781.db2.gz FFYYZUVGXHJCEA-UHFFFAOYSA-N -1 3 350.378 3.879 20 0 FHADHM C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1[O-])[C@@H](C)C1CCCCC1 ZINC000436868662 944734771 /nfs/dbraw/zinc/73/47/71/944734771.db2.gz HUONPICKSULINZ-JTDSTZFVSA-N -1 3 372.509 3.718 20 0 FHADHM COc1cc2c(c(CN[C@@H](C(=O)[O-])c3cccc(C)c3C)c1)O[C@@H](C)C2 ZINC000426740614 944753980 /nfs/dbraw/zinc/75/39/80/944753980.db2.gz BQMFVYKQWCELLS-ORAYPTAESA-N -1 3 355.434 3.551 20 0 FHADHM O=C([O-])[C@@H](NCc1ccc(OCC(F)F)cc1)c1cccc(Cl)c1 ZINC000426726669 944761391 /nfs/dbraw/zinc/76/13/91/944761391.db2.gz LCXSFCOEVKBZKX-INIZCTEOSA-N -1 3 355.768 3.899 20 0 FHADHM Cc1cc(C)cc([C@@H](NCc2cc(Cl)c3c(c2)OCCO3)C(=O)[O-])c1 ZINC000426748783 944767482 /nfs/dbraw/zinc/76/74/82/944767482.db2.gz AABGPYRQOVAHSQ-QGZVFWFLSA-N -1 3 361.825 3.644 20 0 FHADHM O=C([O-])[C@@H](Cc1ccc(F)cc1)NCc1csc(-c2cccs2)n1 ZINC000426748311 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/nfs/dbraw/zinc/80/19/75/944801975.db2.gz BPUFBUXZJYDTHP-CYBMUJFWSA-N -1 3 359.731 3.528 20 0 FHADHM Cc1nn(-c2ccc(Cl)cc2)cc1CN[C@@H](C(=O)[O-])c1ccccc1 ZINC000426768033 944805430 /nfs/dbraw/zinc/80/54/30/944805430.db2.gz UBFDJCLPILFGNT-GOSISDBHSA-N -1 3 355.825 3.750 20 0 FHADHM CCC[C@H](CC)NC(=O)C[C@@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436930095 944815777 /nfs/dbraw/zinc/81/57/77/944815777.db2.gz FHRCWMIUSBGJSA-AZUAARDMSA-N -1 3 368.477 3.948 20 0 FHADHM CC(C)C[C@@H](CO)N(C)C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436949539 944816919 /nfs/dbraw/zinc/81/69/19/944816919.db2.gz SIWAQNQROJITFR-IBGZPJMESA-N -1 3 355.478 3.656 20 0 FHADHM COc1cc(C)c(CN[C@@H](CC(=O)[O-])c2cccc(Cl)c2)cc1OC ZINC000426797345 944820159 /nfs/dbraw/zinc/82/01/59/944820159.db2.gz AVRPJACLVOLBLH-INIZCTEOSA-N -1 3 363.841 3.971 20 0 FHADHM CCCOc1ccc(C(C)(C)NC(=O)c2cc(NC(C)=O)ccc2[O-])cc1 ZINC000436934302 944820222 /nfs/dbraw/zinc/82/02/22/944820222.db2.gz XDTPCMVQDWLIEO-UHFFFAOYSA-N -1 3 370.449 3.805 20 0 FHADHM CC(C)[C@@H](CC(=O)[O-])NCc1csc(COc2ccc(Cl)cc2)n1 ZINC000426829719 944827226 /nfs/dbraw/zinc/82/72/26/944827226.db2.gz RDNWNCTZOLBUAL-OAHLLOKOSA-N -1 3 368.886 3.964 20 0 FHADHM CCOc1c(OC)cc(CN[C@H](C(=O)[O-])c2ccc(CC)cc2)cc1OC ZINC000426809162 944828240 /nfs/dbraw/zinc/82/82/40/944828240.db2.gz CHOIRGNCIARMGT-IBGZPJMESA-N -1 3 373.449 3.580 20 0 FHADHM O=C([O-])[C@@H](NCc1ccc(F)c(Br)c1)c1cccc(F)c1 ZINC000426809917 944830528 /nfs/dbraw/zinc/83/05/28/944830528.db2.gz GSASEDJMWABLRE-AWEZNQCLSA-N -1 3 356.166 3.643 20 0 FHADHM CCCN(Cc1ccccc1Br)C(=O)c1ccc(O)cc1[O-] ZINC000436944600 944832338 /nfs/dbraw/zinc/83/23/38/944832338.db2.gz QVLHGXATRKHRQJ-UHFFFAOYSA-N -1 3 364.239 3.913 20 0 FHADHM O=S(=O)([N-][C@@H]1CCc2cc(F)ccc21)c1csc(-c2ccccc2)n1 ZINC000500415125 944833309 /nfs/dbraw/zinc/83/33/09/944833309.db2.gz JTUJCBPINDLABK-MRXNPFEDSA-N -1 3 374.462 3.915 20 0 FHADHM CCCOc1ccc(CN[C@@H](C(=O)[O-])c2ccc(CC)cc2)cc1OC ZINC000426816167 944836854 /nfs/dbraw/zinc/83/68/54/944836854.db2.gz JAKIEYNPEKNSOH-HXUWFJFHSA-N -1 3 357.450 3.962 20 0 FHADHM CCCOc1cc(C)ccc1NC(=O)CCNC(=O)c1ccc(C)cc1[O-] ZINC000436962011 944839440 /nfs/dbraw/zinc/83/94/40/944839440.db2.gz WINNOLIXASHKLV-UHFFFAOYSA-N -1 3 370.449 3.556 20 0 FHADHM COc1ccc(CN[C@H](C(=O)[O-])c2ccc(F)cc2)cc1OCC(C)C ZINC000426817963 944840868 /nfs/dbraw/zinc/84/08/68/944840868.db2.gz QNLBGPISNPBUJJ-IBGZPJMESA-N -1 3 361.413 3.785 20 0 FHADHM COc1ccc(CN[C@H](CC(=O)[O-])c2cccc(Br)c2)cc1 ZINC000426818365 944842111 /nfs/dbraw/zinc/84/21/11/944842111.db2.gz FCZLRLIYUKKAFW-MRXNPFEDSA-N -1 3 364.239 3.763 20 0 FHADHM O=C(NCCCOC[C@H]1CCCO1)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436951954 944847558 /nfs/dbraw/zinc/84/75/58/944847558.db2.gz HOQGFYLKMPGZSK-GOSISDBHSA-N -1 3 371.433 3.500 20 0 FHADHM CC[C@H](c1ccc(Cl)cc1)N1CCN(C(=O)c2ccc([O-])cc2)CC1 ZINC000436952642 944849281 /nfs/dbraw/zinc/84/92/81/944849281.db2.gz XMLCQTKCIAQJRY-LJQANCHMSA-N -1 3 358.869 3.955 20 0 FHADHM COc1ccc(CNC(=O)c2cc(Oc3ccccc3)ccc2[O-])cn1 ZINC000436954852 944850396 /nfs/dbraw/zinc/85/03/96/944850396.db2.gz YFVFSMZBNMUQFF-UHFFFAOYSA-N -1 3 350.374 3.518 20 0 FHADHM COc1ccc([C@@H](NCc2cc3c(ccc(C)c3C)[nH]2)C(=O)[O-])cc1F ZINC000426826992 944851489 /nfs/dbraw/zinc/85/14/89/944851489.db2.gz VCCHXCJRZYLYHX-LJQANCHMSA-N -1 3 356.397 3.848 20 0 FHADHM CCCCOc1ccc(C(=O)N[C@@H](C)c2nc(C(C)(C)C)no2)c([O-])c1 ZINC000436984401 944857482 /nfs/dbraw/zinc/85/74/82/944857482.db2.gz FCFLSCVBKOOGSR-LBPRGKRZSA-N -1 3 361.442 3.743 20 0 FHADHM CCCCOc1ccc(C(=O)N(C)Cc2cc(OC)cc(OC)c2)c([O-])c1 ZINC000436971927 944859897 /nfs/dbraw/zinc/85/98/97/944859897.db2.gz MMQPWKGSDNFDEF-UHFFFAOYSA-N -1 3 373.449 3.861 20 0 FHADHM Cc1ccc(C(=O)N(C)[C@H]2c3cc(Cl)cc(Cl)c3C[C@H]2O)c([O-])c1 ZINC000436984144 944866111 /nfs/dbraw/zinc/86/61/11/944866111.db2.gz YQTDOHCHWWOVEN-SJORKVTESA-N -1 3 366.244 3.738 20 0 FHADHM C[C@H](Cc1cccs1)[N-]S(=O)(=O)c1csc(-c2ccccc2)n1 ZINC000500424428 944869187 /nfs/dbraw/zinc/86/91/87/944869187.db2.gz VIZKKEAITFWPLM-GFCCVEGCSA-N -1 3 364.517 3.781 20 0 FHADHM CO[C@@H](C)c1cccc([N-]S(=O)(=O)Cc2cc(C(C)(C)C)on2)c1 ZINC000506645674 944871720 /nfs/dbraw/zinc/87/17/20/944871720.db2.gz KJRGYMYJSBVIHG-LBPRGKRZSA-N -1 3 352.456 3.621 20 0 FHADHM O=S(=O)([N-][C@@H]1CCc2ccccc21)c1csc(-c2ccccc2)n1 ZINC000500425781 944873886 /nfs/dbraw/zinc/87/38/86/944873886.db2.gz FHJPGUCJAQHJNI-MRXNPFEDSA-N -1 3 356.472 3.776 20 0 FHADHM CC(C)(CC(=O)N1CCN(C(=O)c2ccc([O-])cc2)CC1)C1CCCCC1 ZINC000436987845 944881395 /nfs/dbraw/zinc/88/13/95/944881395.db2.gz NEYZWGFMLPXUSX-UHFFFAOYSA-N -1 3 372.509 3.673 20 0 FHADHM COC(=O)c1ccc(-c2nc(-c3ccc(Br)c(C)c3)no2)[n-]1 ZINC000426464969 944882019 /nfs/dbraw/zinc/88/20/19/944882019.db2.gz ZLHNJFBCKXAUFC-UHFFFAOYSA-N -1 3 362.183 3.589 20 0 FHADHM CC1(CCNC(=O)C[C@@H](NC(=O)c2ccc([O-])cc2)c2ccccc2)CC1 ZINC000436988504 944882036 /nfs/dbraw/zinc/88/20/36/944882036.db2.gz LKHKIJFRLRAJKA-LJQANCHMSA-N -1 3 366.461 3.560 20 0 FHADHM CCc1ccc([O-])c(C(=O)N2CCN(Cc3cccc(Cl)c3)CC2)c1 ZINC000500429090 944892197 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COC(=O)[C@H](Sc1ccccc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000736901021 944909548 /nfs/dbraw/zinc/90/95/48/944909548.db2.gz HLXNTCQBCNBDBC-CQSZACIVSA-N -1 3 360.826 3.527 20 0 FHADHM COC(=O)[C@H](Sc1ccccc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000736901021 944909555 /nfs/dbraw/zinc/90/95/55/944909555.db2.gz HLXNTCQBCNBDBC-CQSZACIVSA-N -1 3 360.826 3.527 20 0 FHADHM COC(=O)[C@H](C)N(C(=O)c1cc(Cc2ccccc2)ccc1[O-])C1CCC1 ZINC000437001196 944917797 /nfs/dbraw/zinc/91/77/97/944917797.db2.gz KCMOOFYBYSTACG-HNNXBMFYSA-N -1 3 367.445 3.539 20 0 FHADHM Cc1cccnc1C(F)(F)C(=O)[N-][C@@H](C)c1nc2cc(Cl)ccc2[nH]1 ZINC000783420591 944924079 /nfs/dbraw/zinc/92/40/79/944924079.db2.gz CEXNNDQFENSSKQ-JTQLQIEISA-N -1 3 364.783 3.889 20 0 FHADHM Cc1cc(S(=O)(=O)[N-]C[C@H]2CCOc3ccccc32)sc1Cl ZINC000473851720 944931936 /nfs/dbraw/zinc/93/19/36/944931936.db2.gz HHQNATNFJZKXGT-LLVKDONJSA-N -1 3 357.884 3.555 20 0 FHADHM COc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)C1CCCCCCC1 ZINC000737027196 944935728 /nfs/dbraw/zinc/93/57/28/944935728.db2.gz 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356.474 3.538 20 0 FHADHM Cc1cccc(C(=O)Nc2ccc(Cc3nnc4ccccn43)cc2)c1[O-] ZINC000110510569 945649672 /nfs/dbraw/zinc/64/96/72/945649672.db2.gz LNOXFWMUDDFQSS-UHFFFAOYSA-N -1 3 358.401 3.586 20 0 FHADHM Cc1cc(Br)cc2c(C(=O)NCc3ncccc3[O-])coc21 ZINC000473635198 945653683 /nfs/dbraw/zinc/65/36/83/945653683.db2.gz GRGQDLPOWNHVID-UHFFFAOYSA-N -1 3 361.195 3.534 20 0 FHADHM CCc1ccccc1O[C@@H](C(=O)NCc1ncccc1[O-])c1ccccc1 ZINC000473636396 945655801 /nfs/dbraw/zinc/65/58/01/945655801.db2.gz FIFYCVUZYYSYRB-OAQYLSRUSA-N -1 3 362.429 3.786 20 0 FHADHM O=C(NCc1ncccc1[O-])c1cn(Cc2ccccc2)c2ccccc12 ZINC000473640386 945676124 /nfs/dbraw/zinc/67/61/24/945676124.db2.gz ROIJPTOVMNTSLL-UHFFFAOYSA-N -1 3 357.413 3.720 20 0 FHADHM CC[C@@H](CNC(=O)c1cc(=O)c2ccccc2[n-]1)Oc1cccc(Cl)c1 ZINC000440637093 945731186 /nfs/dbraw/zinc/73/11/86/945731186.db2.gz NCVPLXIPSDDMKT-AWEZNQCLSA-N -1 3 370.836 3.769 20 0 FHADHM Cc1ccc(NC(=O)[C@@H](C)SCc2cc(=O)[n-]c(C3CC3)n2)cc1C ZINC000519755305 945737371 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Cc1cc(F)cc2c1ncc(-c1nnn[n-]1)c2N1CCC[C@@H]1c1ccco1 ZINC000822204695 945990431 /nfs/dbraw/zinc/99/04/31/945990431.db2.gz XQUZAQAOENPTTH-OAHLLOKOSA-N -1 3 364.384 3.797 20 0 FHADHM Cc1cc(F)cc2c1ncc(-c1nn[n-]n1)c2N1CCC[C@@H]1c1ccco1 ZINC000822204695 945990438 /nfs/dbraw/zinc/99/04/38/945990438.db2.gz XQUZAQAOENPTTH-OAHLLOKOSA-N -1 3 364.384 3.797 20 0 FHADHM CC(C)(C)Oc1ccc(CN=c2ncnc3[nH][n-]cc2-3)c(C(F)(F)F)c1 ZINC000608094843 946010542 /nfs/dbraw/zinc/01/05/42/946010542.db2.gz ZPYBTHOETKLNCG-UHFFFAOYSA-N -1 3 365.359 3.535 20 0 FHADHM O=C(N=c1cc(-c2ccccc2)[n-][nH]1)c1occc1COc1ccccc1 ZINC000519998261 946020347 /nfs/dbraw/zinc/02/03/47/946020347.db2.gz RGHHXDUPYQTPCU-UHFFFAOYSA-N -1 3 359.385 3.923 20 0 FHADHM Cc1ccc([N-]S(=O)(=O)c2cc3c(c(Cl)c2)O[C@@H](C)C3)c(C)c1O ZINC000522880414 946044766 /nfs/dbraw/zinc/04/47/66/946044766.db2.gz DABFUCOMZYHQQY-JTQLQIEISA-N -1 3 367.854 3.787 20 0 FHADHM COc1ccc(CC[C@H](C)[N-]S(=O)(=O)c2cccc(Cl)c2F)cc1 ZINC000520073462 946079417 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CSc1ccc([O-])c(C(=O)N(C)Cc2ccccc2N2CCCC2)c1 ZINC000665589844 946401102 /nfs/dbraw/zinc/40/11/02/946401102.db2.gz IQYRAQSIWUHFQX-UHFFFAOYSA-N -1 3 356.491 3.987 20 0 FHADHM O=C(NC[C@@H](c1cccs1)N1CCCC1)c1cc(F)c([O-])c(Cl)c1 ZINC000184198251 946405087 /nfs/dbraw/zinc/40/50/87/946405087.db2.gz QWKNTMGMVGLCEH-AWEZNQCLSA-N -1 3 368.861 3.813 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nnn[n-]2)c1)c1ccc(OC2CCC2)cc1 ZINC000823332589 946410367 /nfs/dbraw/zinc/41/03/67/946410367.db2.gz OZBDQUWWVNEVAE-UHFFFAOYSA-N -1 3 369.812 3.704 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nn[n-]n2)c1)c1ccc(OC2CCC2)cc1 ZINC000823332589 946410382 /nfs/dbraw/zinc/41/03/82/946410382.db2.gz OZBDQUWWVNEVAE-UHFFFAOYSA-N -1 3 369.812 3.704 20 0 FHADHM C[C@H]1CC[C@@H](N(C)C(=O)c2c[n-]c3ccc(Br)cc3c2=O)C1 ZINC000444402520 946460023 /nfs/dbraw/zinc/46/00/23/946460023.db2.gz JJQLQFULOBUHSH-CMPLNLGQSA-N -1 3 363.255 3.551 20 0 FHADHM C[C@H]1CC[C@H](N(C)C(=O)c2c[n-]c3ccc(Br)cc3c2=O)C1 ZINC000444402522 946460283 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CC(C)CN(C(=O)CCCc1ccsc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824249793 946633691 /nfs/dbraw/zinc/63/36/91/946633691.db2.gz UNGXTTPPTLXWKF-UHFFFAOYSA-N -1 3 369.494 3.940 20 0 FHADHM Brc1ccc(-c2nnn[n-]2)c(N2CC[C@H](C3CCCC3)C2)c1 ZINC001573279294 946636983 /nfs/dbraw/zinc/63/69/83/946636983.db2.gz FQJLHRNVLQMSPU-LBPRGKRZSA-N -1 3 362.275 3.646 20 0 FHADHM Brc1ccc(-c2nn[n-]n2)c(N2CC[C@H](C3CCCC3)C2)c1 ZINC001573279294 946636991 /nfs/dbraw/zinc/63/69/91/946636991.db2.gz FQJLHRNVLQMSPU-LBPRGKRZSA-N -1 3 362.275 3.646 20 0 FHADHM CC(C)c1noc([C@@H](C)Sc2cccc(Cl)c2-c2nnn[n-]2)n1 ZINC000824371411 946672570 /nfs/dbraw/zinc/67/25/70/946672570.db2.gz DSOHBUIVPRGDMX-MRVPVSSYSA-N -1 3 350.835 3.880 20 0 FHADHM CC(C)c1noc([C@@H](C)Sc2cccc(Cl)c2-c2nn[n-]n2)n1 ZINC000824371411 946672579 /nfs/dbraw/zinc/67/25/79/946672579.db2.gz DSOHBUIVPRGDMX-MRVPVSSYSA-N -1 3 350.835 3.880 20 0 FHADHM C[C@H](CCCc1ccccc1)C(=O)N(C)c1ccc(-c2nnn[n-]2)cc1F ZINC000824400304 946679828 /nfs/dbraw/zinc/67/98/28/946679828.db2.gz 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20 0 FHADHM Cc1cc(S(=O)(=O)[N-]CC(=O)c2ccccc2Cl)sc1Cl ZINC000473950567 946858453 /nfs/dbraw/zinc/85/84/53/946858453.db2.gz LAPWZCPKAOYRMT-UHFFFAOYSA-N -1 3 364.275 3.525 20 0 FHADHM CN(C)Cc1c2ccccc2oc1C(=O)Nc1cccc(CCC(=O)[O-])c1 ZINC000473956596 946881731 /nfs/dbraw/zinc/88/17/31/946881731.db2.gz DIVCOKJWZMCRRN-UHFFFAOYSA-N -1 3 366.417 3.764 20 0 FHADHM C[C@@H]1CC[C@@H](NC(=O)C[C@H](NC(=O)c2ccc([O-])cc2)c2ccccc2)C1 ZINC000444467580 946889888 /nfs/dbraw/zinc/88/98/88/946889888.db2.gz OCSVUADHWFLBCT-ZTNFWEORSA-N -1 3 366.461 3.558 20 0 FHADHM CC(=O)c1ccc2ccccc2c1NC(=O)c1cc(-c2nnn[n-]2)cs1 ZINC001573555734 946914267 /nfs/dbraw/zinc/91/42/67/946914267.db2.gz PGYGNYDEHYSYET-UHFFFAOYSA-N -1 3 363.402 3.536 20 0 FHADHM CC(=O)c1ccc2ccccc2c1NC(=O)c1cc(-c2nn[n-]n2)cs1 ZINC001573555734 946914274 /nfs/dbraw/zinc/91/42/74/946914274.db2.gz PGYGNYDEHYSYET-UHFFFAOYSA-N -1 3 363.402 3.536 20 0 FHADHM CS(=O)(=O)[N-]c1ccccc1NC(=O)c1ccc(-c2ccc(F)cc2)o1 ZINC000028021311 946915208 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HBMBELQPJZZQML-MRXNPFEDSA-N -1 3 374.444 3.792 20 0 FHADHM Cc1nc(C)c(CC(=O)N2CCCC[C@H]2c2cccc(Cl)c2)c(=O)[n-]1 ZINC000444666766 947093084 /nfs/dbraw/zinc/09/30/84/947093084.db2.gz SAFKMJFBMMWMBP-KRWDZBQOSA-N -1 3 359.857 3.749 20 0 FHADHM Cc1nc(C)c(CC(=O)N2CCCC[C@@H]2c2cccc(Cl)c2)c(=O)[n-]1 ZINC000444666767 947093277 /nfs/dbraw/zinc/09/32/77/947093277.db2.gz SAFKMJFBMMWMBP-QGZVFWFLSA-N -1 3 359.857 3.749 20 0 FHADHM C[C@@H]1CC2(CN1Cc1csc(-c3cccc(C(=O)[O-])c3)n1)CCOCC2 ZINC000652449665 947160135 /nfs/dbraw/zinc/16/01/35/947160135.db2.gz JMAQZPPVJDYFBN-CQSZACIVSA-N -1 3 372.490 3.899 20 0 FHADHM C[C@@H](CN(Cc1ccccc1)Cc1ncccc1C(F)(F)F)C(=O)[O-] ZINC000652456439 947172560 /nfs/dbraw/zinc/17/25/60/947172560.db2.gz FJXWICFMSAWALR-ZDUSSCGKSA-N -1 3 352.356 3.823 20 0 FHADHM CCN(Cc1nc2c(s1)CCCC2)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825443819 947192637 /nfs/dbraw/zinc/19/26/37/947192637.db2.gz GRRCLWHVQVQJTA-CYBMUJFWSA-N -1 3 368.510 3.785 20 0 FHADHM CCCCS(=O)(=O)[N-]Cc1nc(-c2ccc(-c3ccccc3)cc2)no1 ZINC000536303262 947197712 /nfs/dbraw/zinc/19/77/12/947197712.db2.gz XOLFCAKYMYYLMH-UHFFFAOYSA-N -1 3 371.462 3.623 20 0 FHADHM CCNc1ccc(Cl)cc1NC(=O)C=Cc1ccccc1-c1nnn[n-]1 ZINC000825480755 947199644 /nfs/dbraw/zinc/19/96/44/947199644.db2.gz JHHQBQFNSIJVJW-YFHOEESVSA-N -1 3 368.828 3.604 20 0 FHADHM CCNc1ccc(Cl)cc1NC(=O)C=Cc1ccccc1-c1nn[n-]n1 ZINC000825480755 947199648 /nfs/dbraw/zinc/19/96/48/947199648.db2.gz JHHQBQFNSIJVJW-YFHOEESVSA-N -1 3 368.828 3.604 20 0 FHADHM CCOC(=O)[C@H](Sc1cccc(Cl)c1-c1nnn[n-]1)c1ccccc1 ZINC000825494584 947205379 /nfs/dbraw/zinc/20/53/79/947205379.db2.gz YQRIQONZPFTANT-OAHLLOKOSA-N -1 3 374.853 3.917 20 0 FHADHM CCOC(=O)[C@H](Sc1cccc(Cl)c1-c1nn[n-]n1)c1ccccc1 ZINC000825494584 947205391 /nfs/dbraw/zinc/20/53/91/947205391.db2.gz YQRIQONZPFTANT-OAHLLOKOSA-N -1 3 374.853 3.917 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NCCn3c(C)nc4ccccc43)nc2)n1 ZINC000301162371 947210181 /nfs/dbraw/zinc/21/01/81/947210181.db2.gz GGJCUGQYSLTGSG-UHFFFAOYSA-N -1 3 374.448 3.577 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)CCc2ccc3[nH]ccc3c2)s1 ZINC000825693727 947288069 /nfs/dbraw/zinc/28/80/69/947288069.db2.gz BMIIKTQFIVUWIU-UHFFFAOYSA-N -1 3 366.450 3.543 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)CCc2ccc3[nH]ccc3c2)s1 ZINC000825693727 947288084 /nfs/dbraw/zinc/28/80/84/947288084.db2.gz BMIIKTQFIVUWIU-UHFFFAOYSA-N -1 3 366.450 3.543 20 0 FHADHM COc1ccccc1C1(CNC(=O)NCc2ccc([O-])c(F)c2)CCCC1 ZINC000523474549 947293539 /nfs/dbraw/zinc/29/35/39/947293539.db2.gz GYOFFYICUMVIDL-UHFFFAOYSA-N -1 3 372.440 3.851 20 0 FHADHM COC(=O)[C@H](Sc1cccc(Cl)c1-c1nnn[n-]1)c1ccccc1 ZINC000826117881 947438612 /nfs/dbraw/zinc/43/86/12/947438612.db2.gz UGXNUGGDEKENBM-CQSZACIVSA-N -1 3 360.826 3.527 20 0 FHADHM COC(=O)[C@H](Sc1cccc(Cl)c1-c1nn[n-]n1)c1ccccc1 ZINC000826117881 947438614 /nfs/dbraw/zinc/43/86/14/947438614.db2.gz UGXNUGGDEKENBM-CQSZACIVSA-N -1 3 360.826 3.527 20 0 FHADHM O=C([O-])C[C@@H]1CCCN(Cc2oc3ccccc3c2Br)C1 ZINC000662201738 947516497 /nfs/dbraw/zinc/51/64/97/947516497.db2.gz UCMLFZGIUGMZPT-NSHDSACASA-N -1 3 352.228 3.882 20 0 FHADHM C[C@H]1CC[C@H](C(=O)[O-])CN1Cc1oc2ccccc2c1Br ZINC000662210902 947544563 /nfs/dbraw/zinc/54/45/63/947544563.db2.gz AYWUXQVIOSVULM-QWRGUYRKSA-N -1 3 352.228 3.880 20 0 FHADHM O=C(Nc1cc(F)ccc1[O-])c1ccc(C(=O)c2cccc(O)c2)cc1 ZINC000188924656 947552022 /nfs/dbraw/zinc/55/20/22/947552022.db2.gz TWMKXGZTAFOLNZ-UHFFFAOYSA-N -1 3 351.333 3.720 20 0 FHADHM O=C(c1ccc(C(=O)N2CCCc3cccc([O-])c32)cc1)c1cccc(O)c1 ZINC000188967815 947568746 /nfs/dbraw/zinc/56/87/46/947568746.db2.gz ANPDVHGKNKJFNB-UHFFFAOYSA-N -1 3 373.408 3.922 20 0 FHADHM CCOc1c(Cl)cccc1CNC[C@H](CCC(=O)[O-])C(F)(F)F ZINC000663261540 947584322 /nfs/dbraw/zinc/58/43/22/947584322.db2.gz KOQITKDPOPBRGH-NSHDSACASA-N -1 3 353.768 3.872 20 0 FHADHM O=C([O-])CC[C@@H](CNCc1ccc(Br)cc1F)C(F)(F)F ZINC000663261853 947584684 /nfs/dbraw/zinc/58/46/84/947584684.db2.gz NHLPURXWHWOACN-VIFPVBQESA-N -1 3 372.156 3.721 20 0 FHADHM CSc1ccc(C)c(NC(=O)N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000826230239 947674535 /nfs/dbraw/zinc/67/45/35/947674535.db2.gz KSSHANYNHFQAJY-LBPRGKRZSA-N -1 3 368.466 3.780 20 0 FHADHM CSc1ccc(C)c(NC(=O)N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000826230239 947674538 /nfs/dbraw/zinc/67/45/38/947674538.db2.gz KSSHANYNHFQAJY-LBPRGKRZSA-N -1 3 368.466 3.780 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCC2)c1ccccc1 ZINC000826232006 947679513 /nfs/dbraw/zinc/67/95/13/947679513.db2.gz CTNOYDYHJRTKIV-NSHDSACASA-N -1 3 353.451 3.549 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCC2)c1ccccc1 ZINC000826232006 947679518 /nfs/dbraw/zinc/67/95/18/947679518.db2.gz CTNOYDYHJRTKIV-NSHDSACASA-N -1 3 353.451 3.549 20 0 FHADHM CC(=CC(=O)N(C)Cc1cc(-c2nnn[n-]2)cs1)c1ccccc1Cl ZINC001573359214 947680771 /nfs/dbraw/zinc/68/07/71/947680771.db2.gz XFOHZAOSKHJAPY-XFFZJAGNSA-N -1 3 373.869 3.644 20 0 FHADHM CC(=CC(=O)N(C)Cc1cc(-c2nn[n-]n2)cs1)c1ccccc1Cl ZINC001573359214 947680776 /nfs/dbraw/zinc/68/07/76/947680776.db2.gz XFOHZAOSKHJAPY-XFFZJAGNSA-N -1 3 373.869 3.644 20 0 FHADHM COc1cc(C(=O)N[C@@H]2CC[C@@H](Cc3ccccc3)C2)cc(OC)c1[O-] ZINC000189338860 947693227 /nfs/dbraw/zinc/69/32/27/947693227.db2.gz YGSGRIQJXHAFIH-DOTOQJQBSA-N -1 3 355.434 3.551 20 0 FHADHM C/C(=C/C1CCC(C)CC1)C(=O)NC1(c2cccc(-c3nnn[n-]3)c2)CC1 ZINC001573364595 947722096 /nfs/dbraw/zinc/72/20/96/947722096.db2.gz HTIKBCFLNSHHFO-QINSGFPZSA-N -1 3 365.481 3.745 20 0 FHADHM C/C(=C/C1CCC(C)CC1)C(=O)NC1(c2cccc(-c3nn[n-]n3)c2)CC1 ZINC001573364595 947722104 /nfs/dbraw/zinc/72/21/04/947722104.db2.gz HTIKBCFLNSHHFO-QINSGFPZSA-N -1 3 365.481 3.745 20 0 FHADHM CC(=CC(=O)Nc1cccc(-c2nnn[n-]2)c1C)c1cccc(Cl)c1 ZINC001573364575 947723236 /nfs/dbraw/zinc/72/32/36/947723236.db2.gz QWPCJTVVWYTSRS-LUAWRHEFSA-N -1 3 353.813 3.871 20 0 FHADHM CC(=CC(=O)Nc1cccc(-c2nn[n-]n2)c1C)c1cccc(Cl)c1 ZINC001573364575 947723240 /nfs/dbraw/zinc/72/32/40/947723240.db2.gz QWPCJTVVWYTSRS-LUAWRHEFSA-N -1 3 353.813 3.871 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1COC(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000826253581 947730962 /nfs/dbraw/zinc/73/09/62/947730962.db2.gz VRNHOADZLQJPSG-TZMCWYRMSA-N -1 3 368.359 3.587 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1COC(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000826253581 947730964 /nfs/dbraw/zinc/73/09/64/947730964.db2.gz VRNHOADZLQJPSG-TZMCWYRMSA-N -1 3 368.359 3.587 20 0 FHADHM O=S(=O)([N-]c1cccnc1Cl)c1ccc(C(F)(F)F)cc1F ZINC000780365507 947803683 /nfs/dbraw/zinc/80/36/83/947803683.db2.gz LYSYDBRIQGGWFN-UHFFFAOYSA-N -1 3 354.712 3.694 20 0 FHADHM Cc1ccc(C(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c(Cl)c1C ZINC000826281688 947807203 /nfs/dbraw/zinc/80/72/03/947807203.db2.gz FZTWYTKWNMFHTN-GFCCVEGCSA-N -1 3 355.829 3.628 20 0 FHADHM Cc1ccc(C(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c(Cl)c1C ZINC000826281688 947807209 /nfs/dbraw/zinc/80/72/09/947807209.db2.gz FZTWYTKWNMFHTN-GFCCVEGCSA-N -1 3 355.829 3.628 20 0 FHADHM Cc1cccc([C@H]2CCN(c3ccc4cc(-c5nnn[n-]5)ccc4n3)C2)c1 ZINC000826298024 947863619 /nfs/dbraw/zinc/86/36/19/947863619.db2.gz ZPAOAYMUYIBWIW-SFHVURJKSA-N -1 3 356.433 3.717 20 0 FHADHM Cc1cccc([C@H]2CCN(c3ccc4cc(-c5nn[n-]n5)ccc4n3)C2)c1 ZINC000826298024 947863626 /nfs/dbraw/zinc/86/36/26/947863626.db2.gz ZPAOAYMUYIBWIW-SFHVURJKSA-N -1 3 356.433 3.717 20 0 FHADHM Cc1cccc(NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)c1F ZINC000826299510 947866651 /nfs/dbraw/zinc/86/66/51/947866651.db2.gz IMJRLRNGHPUOKK-UHFFFAOYSA-N -1 3 366.400 3.511 20 0 FHADHM Cc1cccc(NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)c1F ZINC000826299510 947866656 /nfs/dbraw/zinc/86/66/56/947866656.db2.gz IMJRLRNGHPUOKK-UHFFFAOYSA-N -1 3 366.400 3.511 20 0 FHADHM CC(C)(C)CC(=O)N1CCC[C@@H]1C(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000129979058 947895673 /nfs/dbraw/zinc/89/56/73/947895673.db2.gz PWLUDFXAGGHMTR-CYBMUJFWSA-N -1 3 372.387 3.777 20 0 FHADHM Cc1ccnc(N[C@@H]2CCCOc3c(Cl)cccc32)c1-c1nnn[n-]1 ZINC000826313228 947909266 /nfs/dbraw/zinc/90/92/66/947909266.db2.gz YROMUKMXQGUZFT-CYBMUJFWSA-N -1 3 356.817 3.549 20 0 FHADHM Cc1ccnc(N[C@@H]2CCCOc3c(Cl)cccc32)c1-c1nn[n-]n1 ZINC000826313228 947909274 /nfs/dbraw/zinc/90/92/74/947909274.db2.gz YROMUKMXQGUZFT-CYBMUJFWSA-N -1 3 356.817 3.549 20 0 FHADHM O=c1[nH]c(-c2ccc([O-])cc2Cl)nc2ccc(Br)cc12 ZINC000190097437 947919644 /nfs/dbraw/zinc/91/96/44/947919644.db2.gz PFQVZHOALRXLJU-UHFFFAOYSA-N -1 3 351.587 3.712 20 0 FHADHM Cc1cn(CCOC(c2ccccc2)c2ccccc2)cc1-c1nnn[n-]1 ZINC000826317237 947924804 /nfs/dbraw/zinc/92/48/04/947924804.db2.gz UHIMNRHOXHKHDE-UHFFFAOYSA-N -1 3 359.433 3.783 20 0 FHADHM Cc1cn(CCOC(c2ccccc2)c2ccccc2)cc1-c1nn[n-]n1 ZINC000826317237 947924812 /nfs/dbraw/zinc/92/48/12/947924812.db2.gz UHIMNRHOXHKHDE-UHFFFAOYSA-N -1 3 359.433 3.783 20 0 FHADHM CC(C)(N)c1cc(C(=O)[N-]c2cc(F)ccc2SCC(F)F)on1 ZINC000662614505 947930940 /nfs/dbraw/zinc/93/09/40/947930940.db2.gz RKWXLHBWBLMXNV-UHFFFAOYSA-N -1 3 359.373 3.617 20 0 FHADHM CCOC(=O)c1csc([C@@H]2CCCN2C(=O)c2cc(CC)ccc2[O-])n1 ZINC000190241305 947951108 /nfs/dbraw/zinc/95/11/08/947951108.db2.gz HROYXYWAKMKHER-HNNXBMFYSA-N -1 3 374.462 3.565 20 0 FHADHM Cc1nccc(N[C@H](C)c2ccc(-c3cccc(-c4nnn[n-]4)c3)cc2)n1 ZINC000826330086 947961292 /nfs/dbraw/zinc/96/12/92/947961292.db2.gz DSQYDJHEKKWANO-CYBMUJFWSA-N -1 3 357.421 3.805 20 0 FHADHM Cc1nccc(N[C@H](C)c2ccc(-c3cccc(-c4nn[n-]n4)c3)cc2)n1 ZINC000826330086 947961298 /nfs/dbraw/zinc/96/12/98/947961298.db2.gz DSQYDJHEKKWANO-CYBMUJFWSA-N -1 3 357.421 3.805 20 0 FHADHM CN(CCOc1ccccc1C(=O)[O-])Cc1cccc(Br)c1 ZINC000314856224 948040379 /nfs/dbraw/zinc/04/03/79/948040379.db2.gz YAJCQWVHBPMDKO-UHFFFAOYSA-N -1 3 364.239 3.658 20 0 FHADHM CCS(=O)(=O)[N-]c1ccc(NC(=O)C2(C)CCCCCC2)cc1OC ZINC000180597815 948101935 /nfs/dbraw/zinc/10/19/35/948101935.db2.gz BAMPGEUYVDHOCG-UHFFFAOYSA-N -1 3 368.499 3.756 20 0 FHADHM COc1ccc(CN2CCC[C@H](C(C)(C)C(=O)[O-])C2)cc1Br ZINC000317270167 948146549 /nfs/dbraw/zinc/14/65/49/948146549.db2.gz NNVWUINUCANCEB-ZDUSSCGKSA-N -1 3 370.287 3.781 20 0 FHADHM FC(F)(F)c1cc(Sc2ccnc(C3CC3)n2)ccc1-c1nnn[n-]1 ZINC000826368562 948148815 /nfs/dbraw/zinc/14/88/15/948148815.db2.gz UTUUZGXGKGVCMU-UHFFFAOYSA-N -1 3 364.356 3.704 20 0 FHADHM FC(F)(F)c1cc(Sc2ccnc(C3CC3)n2)ccc1-c1nn[n-]n1 ZINC000826368562 948148822 /nfs/dbraw/zinc/14/88/22/948148822.db2.gz UTUUZGXGKGVCMU-UHFFFAOYSA-N -1 3 364.356 3.704 20 0 FHADHM FC(F)(F)Cn1ccnc1CSc1cccc(Cl)c1-c1nnn[n-]1 ZINC000826368355 948149195 /nfs/dbraw/zinc/14/91/95/948149195.db2.gz MGUFKXOJYLAHDV-UHFFFAOYSA-N -1 3 374.779 3.571 20 0 FHADHM FC(F)(F)Cn1ccnc1CSc1cccc(Cl)c1-c1nn[n-]n1 ZINC000826368355 948149202 /nfs/dbraw/zinc/14/92/02/948149202.db2.gz MGUFKXOJYLAHDV-UHFFFAOYSA-N -1 3 374.779 3.571 20 0 FHADHM COc1ccc(CCC(=O)[N-]OCc2ccccc2)cc1Br ZINC000029009326 948198140 /nfs/dbraw/zinc/19/81/40/948198140.db2.gz XVZIQVWPHOEPQE-UHFFFAOYSA-N -1 3 364.239 3.638 20 0 FHADHM O=C([N-]c1nnc(Cc2ccc(F)cc2)s1)c1ccnc(Cl)c1F ZINC000163032526 948252301 /nfs/dbraw/zinc/25/23/01/948252301.db2.gz PKZRQCLQNFUFOJ-UHFFFAOYSA-N -1 3 366.780 3.708 20 0 FHADHM O=C(c1cc2c(cc1[O-])OCO2)N1Cc2ccccc2[C@@H](c2ccccc2)C1 ZINC000729517768 948405171 /nfs/dbraw/zinc/40/51/71/948405171.db2.gz KUOHZUJPWJNZGW-LJQANCHMSA-N -1 3 373.408 3.909 20 0 FHADHM O=C(Nc1cc(-c2nnn[n-]2)ccc1F)c1cc2ccccc2cc1F ZINC001129733209 948473198 /nfs/dbraw/zinc/47/31/98/948473198.db2.gz SLYCEERBNXKJMJ-UHFFFAOYSA-N -1 3 351.316 3.550 20 0 FHADHM O=C(Nc1cc(-c2nn[n-]n2)ccc1F)c1cc2ccccc2cc1F ZINC001129733209 948473207 /nfs/dbraw/zinc/47/32/07/948473207.db2.gz SLYCEERBNXKJMJ-UHFFFAOYSA-N -1 3 351.316 3.550 20 0 FHADHM CC(C)(C(=O)Nc1cccc(-c2nnn[n-]2)c1)c1cccc(Cl)c1F ZINC001540585292 948550271 /nfs/dbraw/zinc/55/02/71/948550271.db2.gz FFCDOPSVHDXWPQ-UHFFFAOYSA-N -1 3 359.792 3.576 20 0 FHADHM CC(C)(C(=O)Nc1cccc(-c2nn[n-]n2)c1)c1cccc(Cl)c1F ZINC001540585292 948550274 /nfs/dbraw/zinc/55/02/74/948550274.db2.gz FFCDOPSVHDXWPQ-UHFFFAOYSA-N -1 3 359.792 3.576 20 0 FHADHM COc1ccccc1NC(=S)N[N-]C(=O)c1cc(Cl)ccc1Cl ZINC000006571600 948569267 /nfs/dbraw/zinc/56/92/67/948569267.db2.gz MMRJUZJWFKQXHF-UHFFFAOYSA-N -1 3 370.261 3.633 20 0 FHADHM CCOC(=O)c1nnc([C@H](CC(C)C)NCc2cccc(Cl)c2)[n-]1 ZINC000895104695 948582633 /nfs/dbraw/zinc/58/26/33/948582633.db2.gz LPWNMAHODIWYRU-AWEZNQCLSA-N -1 3 350.850 3.512 20 0 FHADHM COc1cc(NC(=O)NCc2ccc([O-])c(Br)c2)ccc1F ZINC000187040621 948763334 /nfs/dbraw/zinc/76/33/34/948763334.db2.gz MDPKZGVFAYUJFR-UHFFFAOYSA-N -1 3 369.190 3.624 20 0 FHADHM CC(C)c1ccccc1C(=O)Nc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC001574419366 948784815 /nfs/dbraw/zinc/78/48/15/948784815.db2.gz CZQWPMQRDHEHAD-UHFFFAOYSA-N -1 3 358.405 3.791 20 0 FHADHM CC(C)c1ccccc1C(=O)Nc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC001574419366 948784825 /nfs/dbraw/zinc/78/48/25/948784825.db2.gz CZQWPMQRDHEHAD-UHFFFAOYSA-N -1 3 358.405 3.791 20 0 FHADHM O=S(=O)([N-]Cc1ccccc1OC1CCC1)c1cc(F)ccc1Cl ZINC000524020180 948789716 /nfs/dbraw/zinc/78/97/16/948789716.db2.gz LKYLBWYJLMZLGK-UHFFFAOYSA-N -1 3 369.845 3.889 20 0 FHADHM Cc1nn(Cc2ccc(F)cc2)c2sc(C(=O)[N-]c3nncs3)cc12 ZINC000021213138 948797944 /nfs/dbraw/zinc/79/79/44/948797944.db2.gz SIXSMYMNVAEURX-UHFFFAOYSA-N -1 3 373.438 3.697 20 0 FHADHM CCN(Cc1ccccc1[N-]S(=O)(=O)c1c(C)cc(C)cc1C)C(C)=O ZINC000032626968 208033414 /nfs/dbraw/zinc/03/34/14/208033414.db2.gz XQBAHUHEIMJJNN-UHFFFAOYSA-N -1 3 374.506 3.781 20 0 FHADHM O=C(COc1ccccc1C(F)(F)F)N=c1cc(-c2ccncc2)[n-][nH]1 ZINC000502987264 514868491 /nfs/dbraw/zinc/86/84/91/514868491.db2.gz TWWXDMVHUNCGRX-UHFFFAOYSA-N -1 3 362.311 3.508 20 0 FHADHM Cn1[n-]c(=NC(=O)[C@H](OC(C)(C)C)c2ccccc2)cc1OC(F)F ZINC000490989643 515350342 /nfs/dbraw/zinc/35/03/42/515350342.db2.gz PRBAHTAMKNTLAH-CQSZACIVSA-N -1 3 353.369 3.516 20 0 FHADHM Cc1cc(C)cc(-c2cc(=NC(=O)[C@@H](C)NC(=O)c3cccs3)[nH][n-]2)c1 ZINC000512545667 516303206 /nfs/dbraw/zinc/30/32/06/516303206.db2.gz PULVFTNCOVZQJM-CYBMUJFWSA-N -1 3 368.462 3.512 20 0 FHADHM CCC(CC)c1n[n-]c(=NC(=O)N2CC[C@@H](N3CCCCC3)C2)s1 ZINC000518626380 516726561 /nfs/dbraw/zinc/72/65/61/516726561.db2.gz VCJJQODEWBYBHI-CQSZACIVSA-N -1 3 351.520 3.534 20 0 FHADHM O=C(N=c1cc([C@H]2CCCO2)[n-][nH]1)c1ccnc(SCC(F)(F)F)c1 ZINC000526959616 517411479 /nfs/dbraw/zinc/41/14/79/517411479.db2.gz OLCAAOBQWLKVDN-LLVKDONJSA-N -1 3 372.372 3.563 20 0 FHADHM O=C(N=c1cc([C@@H]2CCCO2)[n-][nH]1)c1cc(Br)c(F)cc1F ZINC000526959858 517412164 /nfs/dbraw/zinc/41/21/64/517412164.db2.gz MBUOBBCJOCQZBS-LBPRGKRZSA-N -1 3 372.169 3.554 20 0 FHADHM O=C(N=c1cc([C@@H]2CCCO2)[n-][nH]1)c1csc(Cc2ccccc2)n1 ZINC000527208339 517562462 /nfs/dbraw/zinc/56/24/62/517562462.db2.gz BFSIBIBTUKPISN-HNNXBMFYSA-N -1 3 354.435 3.561 20 0 FHADHM CCN=c1[n-]c(C(=O)N2CCC[C@H]2Cn2c(C)nc3ccccc32)cs1 ZINC000533802622 517618788 /nfs/dbraw/zinc/61/87/88/517618788.db2.gz PLBQDMVJROPVSL-AWEZNQCLSA-N -1 3 369.494 3.538 20 0 FHADHM Cc1ncoc1C(=O)N=c1cc(-c2cc(F)cc(Br)c2)[n-][nH]1 ZINC000530951297 518064623 /nfs/dbraw/zinc/06/46/23/518064623.db2.gz QVSVANRDSLLMQO-UHFFFAOYSA-N -1 3 365.162 3.527 20 0 FHADHM O=C(N=c1cc(-c2cccnc2)[n-][nH]1)c1ccn(-c2ccc(Cl)cc2)n1 ZINC000535304498 518173976 /nfs/dbraw/zinc/17/39/76/518173976.db2.gz SUWFUTXPNRUHST-UHFFFAOYSA-N -1 3 364.796 3.563 20 0 FHADHM Cc1[n-][nH]c(=NC(=O)c2ccc3c(c2)nnn3C)c1-c1cccc(Cl)c1 ZINC000608469287 519992442 /nfs/dbraw/zinc/99/24/42/519992442.db2.gz JHJBICGAIOEMSH-UHFFFAOYSA-N -1 3 366.812 3.573 20 0 FHADHM COC(=O)Cc1occ(C)c1C(=O)N=c1[nH][n-]c(C)c1-c1ccc(C)cc1 ZINC000600834752 520493927 /nfs/dbraw/zinc/49/39/27/520493927.db2.gz YOBHUIKCKWIHAH-UHFFFAOYSA-N -1 3 367.405 3.563 20 0 FHADHM O=C(N=c1cc(-c2cccc(Cl)c2)[n-][nH]1)c1cccc(-n2cccn2)n1 ZINC000605882876 520961593 /nfs/dbraw/zinc/96/15/93/520961593.db2.gz QGTSPHMYGDQPKN-UHFFFAOYSA-N -1 3 364.796 3.563 20 0 FHADHM Cc1[n-][nH]c(=NC(=O)[C@@H](C)NC(=O)C2CCCCC2)c1-c1ccccc1F ZINC000634423018 523395066 /nfs/dbraw/zinc/39/50/66/523395066.db2.gz XTBGUTJZHCYJLF-CYBMUJFWSA-N -1 3 372.444 3.548 20 0 FHADHM CC(C)(C)n1cc(C(=O)C(=O)N=c2cc(-c3cccc(Cl)c3)[n-][nH]2)cn1 ZINC000622891433 523532191 /nfs/dbraw/zinc/53/21/91/523532191.db2.gz YRKBNHVXBWPUJQ-UHFFFAOYSA-N -1 3 371.828 3.503 20 0 FHADHM CC(C)C(=O)N1CCC(C(=O)N=c2cc(-c3cccc(Cl)c3)[n-][nH]2)CC1 ZINC000622892214 523533923 /nfs/dbraw/zinc/53/39/23/523533923.db2.gz GDXZFRSCXVHVGT-UHFFFAOYSA-N -1 3 374.872 3.563 20 0 FHADHM COc1cccc(C(=O)Nc2cccc3c2CN(CC(F)(F)F)C3)c1[O-] ZINC000186724885 567975642 /nfs/dbraw/zinc/97/56/42/567975642.db2.gz GCEVLGRIESWJGU-UHFFFAOYSA-N -1 3 366.339 3.531 20 0 FHADHM CCc1nc(CNC(=O)c2ccc(C(=O)c3cccc([O-])c3)cc2)cs1 ZINC000186738960 567978164 /nfs/dbraw/zinc/97/81/64/567978164.db2.gz VPTQSQZVIJUCPL-UHFFFAOYSA-N -1 3 366.442 3.572 20 0 FHADHM CC(C)(C)[S@@](=O)Cc1cccc(NC(=O)c2cc(C(F)F)[n-]n2)c1 ZINC000602878073 568003361 /nfs/dbraw/zinc/00/33/61/568003361.db2.gz UACYLVFUKKXRRQ-DEOSSOPVSA-N -1 3 355.410 3.647 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)CO[C@H]3CCC[C@H](C)C3)c2)n1 ZINC000602661264 568012210 /nfs/dbraw/zinc/01/22/10/568012210.db2.gz KTKNHJMSXRDGFR-KSSFIOAISA-N -1 3 369.465 3.945 20 0 FHADHM O=C(NCC1CCCCC1)c1cc(=O)c2cc(Br)ccc2[n-]1 ZINC000602736238 568026051 /nfs/dbraw/zinc/02/60/51/568026051.db2.gz OFFIOFPXBYUNGC-UHFFFAOYSA-N -1 3 363.255 3.601 20 0 FHADHM CSc1ccccc1S(=O)(=O)[N-]c1c(F)cccc1N1CCCC1 ZINC000186981889 568035263 /nfs/dbraw/zinc/03/52/63/568035263.db2.gz WYDQFIAYTPDWAF-UHFFFAOYSA-N -1 3 366.483 3.949 20 0 FHADHM CCc1ccc([O-])c(C(=O)N[C@@H](C)c2ccc(NC(=O)C3CC3)cc2)c1 ZINC000522759381 568059528 /nfs/dbraw/zinc/05/95/28/568059528.db2.gz DBRXYEQUAOBBFC-ZDUSSCGKSA-N -1 3 352.434 3.794 20 0 FHADHM C[C@H]1CO[C@H](c2cccc(C(F)(F)F)c2)CN1Cc1ncccc1[O-] ZINC000644836052 568060904 /nfs/dbraw/zinc/06/09/04/568060904.db2.gz BMTATDLBVKHOJQ-SJCJKPOMSA-N -1 3 352.356 3.768 20 0 FHADHM O=S(=O)([N-]C[C@@H]1OCCc2ccccc21)c1cccc(Cl)c1Cl ZINC000603506880 568109846 /nfs/dbraw/zinc/10/98/46/568109846.db2.gz XJSSYVKEBODSIJ-AWEZNQCLSA-N -1 3 372.273 3.586 20 0 FHADHM O=S(=O)(Cc1ccccc1C(F)(F)F)[N-]Cc1ccc(Cl)o1 ZINC000603499993 568112656 /nfs/dbraw/zinc/11/26/56/568112656.db2.gz QPZUDHDAPDXMAF-UHFFFAOYSA-N -1 3 353.749 3.571 20 0 FHADHM COc1ccccc1-c1cc(=NC(=O)[C@H]2C[C@H]2c2ccc(F)cc2F)[nH][n-]1 ZINC000603547009 568117993 /nfs/dbraw/zinc/11/79/93/568117993.db2.gz FUNBZACRLORZAA-GJZGRUSLSA-N -1 3 369.371 3.528 20 0 FHADHM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2ccc3c(c2)NC(=O)[C@@H](C)O3)cc1 ZINC000007729301 568229353 /nfs/dbraw/zinc/22/93/53/568229353.db2.gz COKFAGCCEROVSZ-CHWSQXEVSA-N -1 3 374.462 3.720 20 0 FHADHM CCc1ccc([O-])c(C(=O)Nc2ccc(Cc3nnc4ccccn43)cc2)c1 ZINC000604266121 568237380 /nfs/dbraw/zinc/23/73/80/568237380.db2.gz OWSPCCOWXQVJBM-UHFFFAOYSA-N -1 3 372.428 3.840 20 0 FHADHM CC(C)[C@@H](CC1CCCCC1)C(=O)NCc1ccc(-c2nnn[n-]2)cc1 ZINC000604329405 568250523 /nfs/dbraw/zinc/25/05/23/568250523.db2.gz ZHQYDQXOURFNJE-GOSISDBHSA-N -1 3 355.486 3.726 20 0 FHADHM CC(C)[C@@H](CC1CCCCC1)C(=O)NCc1ccc(-c2nn[n-]n2)cc1 ZINC000604329405 568250524 /nfs/dbraw/zinc/25/05/24/568250524.db2.gz ZHQYDQXOURFNJE-GOSISDBHSA-N -1 3 355.486 3.726 20 0 FHADHM O=C([O-])[C@@H]1CN(Cc2csc(-c3ccoc3)n2)C[C@H]1c1ccccc1 ZINC000563125996 568259422 /nfs/dbraw/zinc/25/94/22/568259422.db2.gz QJIILUGHMNSJIO-DLBZAZTESA-N -1 3 354.431 3.703 20 0 FHADHM CC(=O)Nc1ccc(S(=O)(=O)[N-][C@@H](CCC(C)C)C(C)(C)C)c(F)c1 ZINC000604410563 568271706 /nfs/dbraw/zinc/27/17/06/568271706.db2.gz DWWGBQLRUSFSRB-KRWDZBQOSA-N -1 3 372.506 3.913 20 0 FHADHM COc1ccc(Cl)c(S(=O)(=O)[N-]Cc2oc3ccccc3c2C)c1 ZINC000604405501 568274468 /nfs/dbraw/zinc/27/44/68/568274468.db2.gz GWMGPYYLRAYPCX-UHFFFAOYSA-N -1 3 365.838 3.882 20 0 FHADHM c1[n-][nH]c2ncnc(=Nc3cccc(Oc4ccnc5ccccc54)c3)c1-2 ZINC000604379575 568286139 /nfs/dbraw/zinc/28/61/39/568286139.db2.gz TUUOCGPOLWHIEV-UHFFFAOYSA-N -1 3 354.373 3.811 20 0 FHADHM COc1ccc(-c2nc(C(=O)[N-]c3nnc(C4CC4)s3)cs2)cc1 ZINC000071804410 568301681 /nfs/dbraw/zinc/30/16/81/568301681.db2.gz VYVVUYMIDLMVNF-UHFFFAOYSA-N -1 3 358.448 3.800 20 0 FHADHM Cc1cc(C)cc(-c2cc(=NC(=O)Cc3c[nH]c4ccc(F)cc34)[nH][n-]2)c1 ZINC000604601300 568323453 /nfs/dbraw/zinc/32/34/53/568323453.db2.gz BDKJYMCMGZKLTN-UHFFFAOYSA-N -1 3 362.408 3.917 20 0 FHADHM O=C(C[C@H]1OCCc2ccccc21)N=c1cc(-c2cccc(Cl)c2)[n-][nH]1 ZINC000604601601 568323514 /nfs/dbraw/zinc/32/35/14/568323514.db2.gz WUSVYCWSTZOGIZ-GOSISDBHSA-N -1 3 367.836 3.795 20 0 FHADHM Cc1cc(Cl)cc(NC(=O)c2ccc(OCC(F)(F)F)nc2)c1[O-] ZINC000604901856 568385005 /nfs/dbraw/zinc/38/50/05/568385005.db2.gz WXWKSACICBIJFV-UHFFFAOYSA-N -1 3 360.719 3.942 20 0 FHADHM COc1cc(CC(=O)Nc2cc(Cl)cc(C)c2[O-])cc(OC)c1OC ZINC000604901718 568385027 /nfs/dbraw/zinc/38/50/27/568385027.db2.gz AEZOOSVAFLAEGK-UHFFFAOYSA-N -1 3 365.813 3.561 20 0 FHADHM Cc1cc(Cl)cc(NC(=O)CSc2ccc3c(c2)OCCO3)c1[O-] ZINC000604901933 568385039 /nfs/dbraw/zinc/38/50/39/568385039.db2.gz GUUCYHMJTHDJCK-UHFFFAOYSA-N -1 3 365.838 3.856 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2ccc(Oc3cccnc3)cc2)cc1 ZINC000005579133 568391138 /nfs/dbraw/zinc/39/11/38/568391138.db2.gz WXSOSFMYUNCQKZ-UHFFFAOYSA-N -1 3 356.403 3.683 20 0 FHADHM Fc1ccc(-c2cc(CSc3n[n-]c(-c4ccccn4)n3)on2)cc1 ZINC000604932546 568395087 /nfs/dbraw/zinc/39/50/87/568395087.db2.gz RCZWYXLTRZNDPN-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM CC(C)[C@@H](Sc1n[n-]c(-c2ccccn2)n1)C(=O)N(C)C1CCCCC1 ZINC000604932698 568395172 /nfs/dbraw/zinc/39/51/72/568395172.db2.gz CBKSNNKUWNTMHB-MRXNPFEDSA-N -1 3 373.526 3.775 20 0 FHADHM CS(=O)(=O)c1ccc(C(=O)[N-]c2nc(/C=C\c3ccccc3)cs2)o1 ZINC000604962489 568428038 /nfs/dbraw/zinc/42/80/38/568428038.db2.gz FLSVGITWSLFEKU-FPLPWBNLSA-N -1 3 374.443 3.562 20 0 FHADHM CN(C(=O)c1cc([O-])c2ccccc2c1)C1CCN(c2ccccn2)CC1 ZINC000365319540 568497709 /nfs/dbraw/zinc/49/77/09/568497709.db2.gz PYDAISPNJSMDQK-UHFFFAOYSA-N -1 3 361.445 3.681 20 0 FHADHM O=C(CCCc1ccc(Br)s1)NCc1ccc([O-])c(F)c1 ZINC000133066915 568503783 /nfs/dbraw/zinc/50/37/83/568503783.db2.gz HXBZNDKIQHBMNX-UHFFFAOYSA-N -1 3 372.259 3.994 20 0 FHADHM O=S(=O)([N-]CC1Cc2ccccc2C1)c1cccc(Cl)c1Cl ZINC000605004996 568519282 /nfs/dbraw/zinc/51/92/82/568519282.db2.gz YSQZPLATLRIUDO-UHFFFAOYSA-N -1 3 356.274 3.687 20 0 FHADHM COc1ccc(Cl)cc1-c1cc(=NC(=O)C2(c3ccccc3)CC2)[nH][n-]1 ZINC000605021965 568525407 /nfs/dbraw/zinc/52/54/07/568525407.db2.gz GILSRJCVFOTVET-UHFFFAOYSA-N -1 3 367.836 3.831 20 0 FHADHM O=S(=O)([N-][C@H]1CSc2ccccc21)c1csc(-c2ccccc2)n1 ZINC000605163953 568592552 /nfs/dbraw/zinc/59/25/52/568592552.db2.gz AYVXAHWGBFMLDI-AWEZNQCLSA-N -1 3 374.512 3.935 20 0 FHADHM CS[C@H](C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1)c1ccccc1 ZINC000737171780 598830106 /nfs/dbraw/zinc/83/01/06/598830106.db2.gz PRVPTRWWGZIJML-AWEZNQCLSA-N -1 3 359.842 3.563 20 0 FHADHM CS[C@H](C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1)c1ccccc1 ZINC000737171780 598830108 /nfs/dbraw/zinc/83/01/08/598830108.db2.gz PRVPTRWWGZIJML-AWEZNQCLSA-N -1 3 359.842 3.563 20 0 FHADHM CCN(C(=O)[C@H](C)c1cccc(C)c1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736502442 598830335 /nfs/dbraw/zinc/83/03/35/598830335.db2.gz MWRNASORVJTDMQ-CVEARBPZSA-N -1 3 363.465 3.888 20 0 FHADHM CCN(C(=O)[C@H](C)c1cccc(C)c1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736502442 598830337 /nfs/dbraw/zinc/83/03/37/598830337.db2.gz MWRNASORVJTDMQ-CVEARBPZSA-N -1 3 363.465 3.888 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H]1CC[C@@H](C)C[C@H]1C ZINC000736478746 598840241 /nfs/dbraw/zinc/84/02/41/598840241.db2.gz BHNWHEFQBNELOU-IIDMSEBBSA-N -1 3 370.501 3.613 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H]1CC[C@@H](C)C[C@H]1C ZINC000736478746 598840242 /nfs/dbraw/zinc/84/02/42/598840242.db2.gz BHNWHEFQBNELOU-IIDMSEBBSA-N -1 3 370.501 3.613 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H]1CC[C@@H](C)C[C@H]1C ZINC000736242954 598853805 /nfs/dbraw/zinc/85/38/05/598853805.db2.gz SRLUTOGLKQQDHI-IIDMSEBBSA-N -1 3 370.501 3.611 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H]1CC[C@@H](C)C[C@H]1C ZINC000736242954 598853806 /nfs/dbraw/zinc/85/38/06/598853806.db2.gz SRLUTOGLKQQDHI-IIDMSEBBSA-N -1 3 370.501 3.611 20 0 FHADHM CC1CCN(c2cccc(Nc3ncc(-c4nnn[n-]4)cc3Cl)c2)CC1 ZINC000736279109 598855332 /nfs/dbraw/zinc/85/53/32/598855332.db2.gz KPXDMIWACKHQJU-UHFFFAOYSA-N -1 3 369.860 3.895 20 0 FHADHM CC1CCN(c2cccc(Nc3ncc(-c4nn[n-]n4)cc3Cl)c2)CC1 ZINC000736279109 598855334 /nfs/dbraw/zinc/85/53/34/598855334.db2.gz KPXDMIWACKHQJU-UHFFFAOYSA-N -1 3 369.860 3.895 20 0 FHADHM CCSc1cccc(NC(=O)N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736666534 598879630 /nfs/dbraw/zinc/87/96/30/598879630.db2.gz KTKLYOUKUZARMB-GFCCVEGCSA-N -1 3 368.466 3.861 20 0 FHADHM CCSc1cccc(NC(=O)N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736666534 598879631 /nfs/dbraw/zinc/87/96/31/598879631.db2.gz KTKLYOUKUZARMB-GFCCVEGCSA-N -1 3 368.466 3.861 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)NCCCC(C)(C)C ZINC000736480034 598890706 /nfs/dbraw/zinc/89/07/06/598890706.db2.gz IVLCCIVSYHKMLE-UHFFFAOYSA-N -1 3 358.490 3.615 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)NCCCC(C)(C)C ZINC000736480034 598890708 /nfs/dbraw/zinc/89/07/08/598890708.db2.gz IVLCCIVSYHKMLE-UHFFFAOYSA-N -1 3 358.490 3.615 20 0 FHADHM CC[C@@H]1c2ccccc2CCN1C(=S)Nc1ccccc1-c1nnn[n-]1 ZINC000736406921 598901538 /nfs/dbraw/zinc/90/15/38/598901538.db2.gz NHBXEFLPRIQXOJ-QGZVFWFLSA-N -1 3 364.478 3.573 20 0 FHADHM CC[C@@H]1c2ccccc2CCN1C(=S)Nc1ccccc1-c1nn[n-]n1 ZINC000736406921 598901540 /nfs/dbraw/zinc/90/15/40/598901540.db2.gz NHBXEFLPRIQXOJ-QGZVFWFLSA-N -1 3 364.478 3.573 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@H](C)CC1CCCC1 ZINC000735905197 598904000 /nfs/dbraw/zinc/90/40/00/598904000.db2.gz YGQAHGRDVSIJCE-CYBMUJFWSA-N -1 3 357.458 3.809 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@H](C)CC1CCCC1 ZINC000735905197 598904001 /nfs/dbraw/zinc/90/40/01/598904001.db2.gz YGQAHGRDVSIJCE-CYBMUJFWSA-N -1 3 357.458 3.809 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NCc1cc(-c2ccccc2)no1 ZINC000736635513 598915425 /nfs/dbraw/zinc/91/54/25/598915425.db2.gz VUWRVMLUVINJOF-UHFFFAOYSA-N -1 3 362.393 3.533 20 0 FHADHM Cc1ccc([C@@H]2CCC[C@H]2OC(=O)Cc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000737328160 598925476 /nfs/dbraw/zinc/92/54/76/598925476.db2.gz DIWKWEMMHNELPF-RBUKOAKNSA-N -1 3 362.433 3.597 20 0 FHADHM Cc1ccc([C@@H]2CCC[C@H]2OC(=O)Cc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000737328160 598925477 /nfs/dbraw/zinc/92/54/77/598925477.db2.gz DIWKWEMMHNELPF-RBUKOAKNSA-N -1 3 362.433 3.597 20 0 FHADHM CCN(C(=O)C=C1CCC(C)CC1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736501307 598926558 /nfs/dbraw/zinc/92/65/58/598926558.db2.gz CJJXKSVASFEIIM-LOACHALJSA-N -1 3 353.470 3.913 20 0 FHADHM CCN(C(=O)C=C1CCC(C)CC1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736501307 598926559 /nfs/dbraw/zinc/92/65/59/598926559.db2.gz CJJXKSVASFEIIM-LOACHALJSA-N -1 3 353.470 3.913 20 0 FHADHM Fc1cc(Br)ccc1Oc1ncc(-c2nnn[n-]2)cc1Cl ZINC000737643131 598935526 /nfs/dbraw/zinc/93/55/26/598935526.db2.gz BFHXKNKDYDTPEC-UHFFFAOYSA-N -1 3 370.569 3.609 20 0 FHADHM Fc1cc(Br)ccc1Oc1ncc(-c2nn[n-]n2)cc1Cl ZINC000737643131 598935530 /nfs/dbraw/zinc/93/55/30/598935530.db2.gz BFHXKNKDYDTPEC-UHFFFAOYSA-N -1 3 370.569 3.609 20 0 FHADHM CC(C)C[C@H](C(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000735757066 598939429 /nfs/dbraw/zinc/93/94/29/598939429.db2.gz SIVZEBWYONTFCY-IBGZPJMESA-N -1 3 363.465 3.655 20 0 FHADHM CC(C)C[C@H](C(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000735757066 598939430 /nfs/dbraw/zinc/93/94/30/598939430.db2.gz SIVZEBWYONTFCY-IBGZPJMESA-N -1 3 363.465 3.655 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@@H](CC(C)C)c1ccccc1 ZINC000737056920 598940958 /nfs/dbraw/zinc/94/09/58/598940958.db2.gz DSCXIMJOIMCUMU-INIZCTEOSA-N -1 3 365.437 3.644 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@@H](CC(C)C)c1ccccc1 ZINC000737056920 598940959 /nfs/dbraw/zinc/94/09/59/598940959.db2.gz DSCXIMJOIMCUMU-INIZCTEOSA-N -1 3 365.437 3.644 20 0 FHADHM Cc1c(NCc2csc(Br)c2)cccc1-c1nnn[n-]1 ZINC000822121936 607256744 /nfs/dbraw/zinc/25/67/44/607256744.db2.gz INASAINLTUSHIP-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM Cc1c(NCc2csc(Br)c2)cccc1-c1nn[n-]n1 ZINC000822121936 607256745 /nfs/dbraw/zinc/25/67/45/607256745.db2.gz INASAINLTUSHIP-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM CC(C)[C@H](NC(=O)c1ccc(-c2nnn[n-]2)cc1)c1ccccc1Cl ZINC000735722301 599006865 /nfs/dbraw/zinc/00/68/65/599006865.db2.gz UQERPZJSFVBMFE-INIZCTEOSA-N -1 3 355.829 3.647 20 0 FHADHM CC(C)[C@H](NC(=O)c1ccc(-c2nn[n-]n2)cc1)c1ccccc1Cl ZINC000735722301 599006867 /nfs/dbraw/zinc/00/68/67/599006867.db2.gz UQERPZJSFVBMFE-INIZCTEOSA-N -1 3 355.829 3.647 20 0 FHADHM C[C@H](S[C@@H](C(N)=O)c1ccc(-c2nnn[n-]2)cc1)c1ccc(Cl)cc1 ZINC000736192494 599012646 /nfs/dbraw/zinc/01/26/46/599012646.db2.gz ZOUUQLNKKBWJRZ-ZUZCIYMTSA-N -1 3 373.869 3.541 20 0 FHADHM C[C@H](S[C@@H](C(N)=O)c1ccc(-c2nn[n-]n2)cc1)c1ccc(Cl)cc1 ZINC000736192494 599012648 /nfs/dbraw/zinc/01/26/48/599012648.db2.gz ZOUUQLNKKBWJRZ-ZUZCIYMTSA-N -1 3 373.869 3.541 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)C[C@H]2CCc3ccccc32)s1 ZINC000736679475 599015753 /nfs/dbraw/zinc/01/57/53/599015753.db2.gz UQLVHCWGBYVKNV-GFCCVEGCSA-N -1 3 353.451 3.549 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)C[C@H]2CCc3ccccc32)s1 ZINC000736679475 599015755 /nfs/dbraw/zinc/01/57/55/599015755.db2.gz UQLVHCWGBYVKNV-GFCCVEGCSA-N -1 3 353.451 3.549 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@@H]2C(=O)OCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000735922123 599016476 /nfs/dbraw/zinc/01/64/76/599016476.db2.gz CVOVCMRKFBNBCD-MOPGFXCFSA-N -1 3 362.433 3.837 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@@H]2C(=O)OCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000735922123 599016478 /nfs/dbraw/zinc/01/64/78/599016478.db2.gz CVOVCMRKFBNBCD-MOPGFXCFSA-N -1 3 362.433 3.837 20 0 FHADHM CC(C)C[C@@H]1CCCCCN1C(=O)NCc1ccc(-c2nnn[n-]2)cc1F ZINC000735795126 599023079 /nfs/dbraw/zinc/02/30/79/599023079.db2.gz LEGBGWZAEVNNFV-INIZCTEOSA-N -1 3 374.464 3.506 20 0 FHADHM CC(C)C[C@@H]1CCCCCN1C(=O)NCc1ccc(-c2nn[n-]n2)cc1F ZINC000735795126 599023080 /nfs/dbraw/zinc/02/30/80/599023080.db2.gz LEGBGWZAEVNNFV-INIZCTEOSA-N -1 3 374.464 3.506 20 0 FHADHM Cc1ccc2cccc(C(=O)Nc3ccc(-c4nnn[n-]4)c(Cl)c3)c2n1 ZINC000737379374 599035596 /nfs/dbraw/zinc/03/55/96/599035596.db2.gz WDLVRNGJILQWGE-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1ccc2cccc(C(=O)Nc3ccc(-c4nn[n-]n4)c(Cl)c3)c2n1 ZINC000737379374 599035599 /nfs/dbraw/zinc/03/55/99/599035599.db2.gz WDLVRNGJILQWGE-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM C[C@H](c1ccc(F)cc1)N(C)c1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000736197688 599040984 /nfs/dbraw/zinc/04/09/84/599040984.db2.gz CKHAQWPWGMEXBK-SECBINFHSA-N -1 3 366.322 3.617 20 0 FHADHM C[C@H](c1ccc(F)cc1)N(C)c1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000736197688 599040986 /nfs/dbraw/zinc/04/09/86/599040986.db2.gz CKHAQWPWGMEXBK-SECBINFHSA-N -1 3 366.322 3.617 20 0 FHADHM CC1(c2ccccc2)CC(Nc2nc(C(F)(F)F)ccc2-c2nnn[n-]2)C1 ZINC000736223680 599053510 /nfs/dbraw/zinc/05/35/10/599053510.db2.gz OZIBNLCQRVGILZ-UHFFFAOYSA-N -1 3 374.370 3.813 20 0 FHADHM CC1(c2ccccc2)CC(Nc2nc(C(F)(F)F)ccc2-c2nn[n-]n2)C1 ZINC000736223680 599053513 /nfs/dbraw/zinc/05/35/13/599053513.db2.gz OZIBNLCQRVGILZ-UHFFFAOYSA-N -1 3 374.370 3.813 20 0 FHADHM C[C@@H](CCc1cccn1C)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000820254701 599054656 /nfs/dbraw/zinc/05/46/56/599054656.db2.gz VDMLEVAENUYVDB-NSHDSACASA-N -1 3 364.375 3.657 20 0 FHADHM C[C@@H](CCc1cccn1C)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000820254701 599054659 /nfs/dbraw/zinc/05/46/59/599054659.db2.gz VDMLEVAENUYVDB-NSHDSACASA-N -1 3 364.375 3.657 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N[C@@H]2CC[C@@H]3CCC[C@H]3C2)n1 ZINC000822723868 599055183 /nfs/dbraw/zinc/05/51/83/599055183.db2.gz RPWNDTREHNDGJE-GARJFASQSA-N -1 3 352.364 3.661 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N[C@@H]2CC[C@@H]3CCC[C@H]3C2)n1 ZINC000822723868 599055185 /nfs/dbraw/zinc/05/51/85/599055185.db2.gz RPWNDTREHNDGJE-GARJFASQSA-N -1 3 352.364 3.661 20 0 FHADHM C[C@@H]1Cc2ccccc2[C@H]1Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000736296467 599056771 /nfs/dbraw/zinc/05/67/71/599056771.db2.gz HKXLJSHEBBHODD-OTYXRUKQSA-N -1 3 360.343 3.626 20 0 FHADHM C[C@@H]1Cc2ccccc2[C@H]1Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000736296467 599056774 /nfs/dbraw/zinc/05/67/74/599056774.db2.gz HKXLJSHEBBHODD-OTYXRUKQSA-N -1 3 360.343 3.626 20 0 FHADHM C[C@H]1C[C@@H](c2ccccc2)CN1c1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000736234792 599060741 /nfs/dbraw/zinc/06/07/41/599060741.db2.gz KPKFMTYKAZDZRB-WCQYABFASA-N -1 3 374.370 3.663 20 0 FHADHM C[C@H]1C[C@@H](c2ccccc2)CN1c1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000736234792 599060745 /nfs/dbraw/zinc/06/07/45/599060745.db2.gz KPKFMTYKAZDZRB-WCQYABFASA-N -1 3 374.370 3.663 20 0 FHADHM O=C(OCCCF)c1ccccc1SCc1ccc(-c2nnn[n-]2)cc1 ZINC000738220280 599062948 /nfs/dbraw/zinc/06/29/48/599062948.db2.gz FNSYGNFLPGLRSS-UHFFFAOYSA-N -1 3 372.425 3.675 20 0 FHADHM O=C(OCCCF)c1ccccc1SCc1ccc(-c2nn[n-]n2)cc1 ZINC000738220280 599062951 /nfs/dbraw/zinc/06/29/51/599062951.db2.gz FNSYGNFLPGLRSS-UHFFFAOYSA-N -1 3 372.425 3.675 20 0 FHADHM CC(C)(C)Oc1ccccc1NCCOc1ccc(-c2nn[n-]n2)cc1 ZINC000735642466 599064687 /nfs/dbraw/zinc/06/46/87/599064687.db2.gz AUDFLIVCWUIFSY-UHFFFAOYSA-N -1 3 353.426 3.535 20 0 FHADHM Cc1cccc(F)c1CNc1c(-c2nnn[n-]2)cnc2c(F)cc(F)cc21 ZINC000822309225 599068794 /nfs/dbraw/zinc/06/87/94/599068794.db2.gz QFYMNHLAABZGHA-UHFFFAOYSA-N -1 3 370.338 3.753 20 0 FHADHM Cc1cccc(F)c1CNc1c(-c2nn[n-]n2)cnc2c(F)cc(F)cc21 ZINC000822309225 599068796 /nfs/dbraw/zinc/06/87/96/599068796.db2.gz QFYMNHLAABZGHA-UHFFFAOYSA-N -1 3 370.338 3.753 20 0 FHADHM Cc1ccc([C@@H]2CCCCN2C(=O)C=Cc2ccccc2-c2nnn[n-]2)cc1 ZINC000737329804 599082483 /nfs/dbraw/zinc/08/24/83/599082483.db2.gz LDVAPCHWMUOLIO-AIGDTVQASA-N -1 3 373.460 3.942 20 0 FHADHM Cc1ccc([C@@H]2CCCCN2C(=O)C=Cc2ccccc2-c2nn[n-]n2)cc1 ZINC000737329804 599082486 /nfs/dbraw/zinc/08/24/86/599082486.db2.gz LDVAPCHWMUOLIO-AIGDTVQASA-N -1 3 373.460 3.942 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)Nc1ccc(CC(F)(F)F)cc1 ZINC000737801151 599083588 /nfs/dbraw/zinc/08/35/88/599083588.db2.gz MAKHVBPWCYDGKR-JXMROGBWSA-N -1 3 373.338 3.623 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)Nc1ccc(CC(F)(F)F)cc1 ZINC000737801151 599083591 /nfs/dbraw/zinc/08/35/91/599083591.db2.gz MAKHVBPWCYDGKR-JXMROGBWSA-N -1 3 373.338 3.623 20 0 FHADHM Cc1cc(F)cc2c1ncc(-c1nnn[n-]1)c2N(C)CCc1cccs1 ZINC000822203143 599088152 /nfs/dbraw/zinc/08/81/52/599088152.db2.gz GSBHBINCVNDTSZ-UHFFFAOYSA-N -1 3 368.441 3.603 20 0 FHADHM Cc1cc(F)cc2c1ncc(-c1nn[n-]n1)c2N(C)CCc1cccs1 ZINC000822203143 599088154 /nfs/dbraw/zinc/08/81/54/599088154.db2.gz GSBHBINCVNDTSZ-UHFFFAOYSA-N -1 3 368.441 3.603 20 0 FHADHM Clc1ccc2ncc(-c3nnn[n-]3)c(N3CCC4(CCCC4)C3)c2c1 ZINC000822581701 599093594 /nfs/dbraw/zinc/09/35/94/599093594.db2.gz KZMNLIVSABECMG-UHFFFAOYSA-N -1 3 354.845 3.839 20 0 FHADHM Clc1ccc2ncc(-c3nn[n-]n3)c(N3CCC4(CCCC4)C3)c2c1 ZINC000822581701 599093598 /nfs/dbraw/zinc/09/35/98/599093598.db2.gz KZMNLIVSABECMG-UHFFFAOYSA-N -1 3 354.845 3.839 20 0 FHADHM CCO[C@@H]1C[C@@H](Nc2cc(-c3nnn[n-]3)c3ccccc3n2)C12CCCC2 ZINC000821359194 599100799 /nfs/dbraw/zinc/10/07/99/599100799.db2.gz MNCLRXGWULCFNY-IAGOWNOFSA-N -1 3 364.453 3.565 20 0 FHADHM CCO[C@@H]1C[C@@H](Nc2cc(-c3nn[n-]n3)c3ccccc3n2)C12CCCC2 ZINC000821359194 599100802 /nfs/dbraw/zinc/10/08/02/599100802.db2.gz MNCLRXGWULCFNY-IAGOWNOFSA-N -1 3 364.453 3.565 20 0 FHADHM C[C@H](CCC1CCCCC1)NC(=O)NCc1ccc(-c2nnn[n-]2)cc1F ZINC000735987460 599105867 /nfs/dbraw/zinc/10/58/67/599105867.db2.gz ZDXXRKUMAYKHDY-CYBMUJFWSA-N -1 3 374.464 3.554 20 0 FHADHM C[C@H](CCC1CCCCC1)NC(=O)NCc1ccc(-c2nn[n-]n2)cc1F ZINC000735987460 599105868 /nfs/dbraw/zinc/10/58/68/599105868.db2.gz ZDXXRKUMAYKHDY-CYBMUJFWSA-N -1 3 374.464 3.554 20 0 FHADHM C[C@@H](CCC1CCCCC1)NC(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000735984317 599106237 /nfs/dbraw/zinc/10/62/37/599106237.db2.gz CHODZOCGGYOXEY-HNNXBMFYSA-N -1 3 370.501 3.757 20 0 FHADHM C[C@@H](CCC1CCCCC1)NC(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000735984317 599106239 /nfs/dbraw/zinc/10/62/39/599106239.db2.gz CHODZOCGGYOXEY-HNNXBMFYSA-N -1 3 370.501 3.757 20 0 FHADHM C[C@H](Sc1ccccc1-c1nnn[n-]1)c1nnc(-c2ccccc2)o1 ZINC000736190322 599109322 /nfs/dbraw/zinc/10/93/22/599109322.db2.gz CUDDZDIVBASCLR-NSHDSACASA-N -1 3 350.407 3.770 20 0 FHADHM C[C@H](Sc1ccccc1-c1nn[n-]n1)c1nnc(-c2ccccc2)o1 ZINC000736190322 599109325 /nfs/dbraw/zinc/10/93/25/599109325.db2.gz CUDDZDIVBASCLR-NSHDSACASA-N -1 3 350.407 3.770 20 0 FHADHM C[C@@H](Sc1ccccc1-c1nnn[n-]1)c1nnc(-c2ccccc2)o1 ZINC000736190320 599109470 /nfs/dbraw/zinc/10/94/70/599109470.db2.gz CUDDZDIVBASCLR-LLVKDONJSA-N -1 3 350.407 3.770 20 0 FHADHM C[C@@H](Sc1ccccc1-c1nn[n-]n1)c1nnc(-c2ccccc2)o1 ZINC000736190320 599109473 /nfs/dbraw/zinc/10/94/73/599109473.db2.gz CUDDZDIVBASCLR-LLVKDONJSA-N -1 3 350.407 3.770 20 0 FHADHM Cc1cccc2oc(CCNc3c(Cl)cccc3-c3nnn[n-]3)nc21 ZINC000822340766 599111663 /nfs/dbraw/zinc/11/16/63/599111663.db2.gz GPQIHSURKRVDCL-UHFFFAOYSA-N -1 3 354.801 3.624 20 0 FHADHM Cc1cccc2oc(CCNc3c(Cl)cccc3-c3nn[n-]n3)nc21 ZINC000822340766 599111665 /nfs/dbraw/zinc/11/16/65/599111665.db2.gz GPQIHSURKRVDCL-UHFFFAOYSA-N -1 3 354.801 3.624 20 0 FHADHM CCO[C@@H]1C[C@H](Nc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)C12CCC2 ZINC000736614954 599120023 /nfs/dbraw/zinc/12/00/23/599120023.db2.gz WHSFOCLSFKMPBZ-UONOGXRCSA-N -1 3 367.375 3.645 20 0 FHADHM Cc1cccc2c1ncc(-c1nnn[n-]1)c2N(C)Cc1ccc(F)cc1F ZINC000737411452 599122795 /nfs/dbraw/zinc/12/27/95/599122795.db2.gz YMEYPDPIJSDXHV-UHFFFAOYSA-N -1 3 366.375 3.638 20 0 FHADHM Cc1cccc2c1ncc(-c1nn[n-]n1)c2N(C)Cc1ccc(F)cc1F ZINC000737411452 599122796 /nfs/dbraw/zinc/12/27/96/599122796.db2.gz YMEYPDPIJSDXHV-UHFFFAOYSA-N -1 3 366.375 3.638 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)c1cc(C2CC2)nc2ccc(F)cc21 ZINC000463612207 599133436 /nfs/dbraw/zinc/13/34/36/599133436.db2.gz MXLVFAWMKAVYLO-UHFFFAOYSA-N -1 3 374.379 3.684 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)c1cc(C2CC2)nc2ccc(F)cc21 ZINC000463612207 599133440 /nfs/dbraw/zinc/13/34/40/599133440.db2.gz MXLVFAWMKAVYLO-UHFFFAOYSA-N -1 3 374.379 3.684 20 0 FHADHM Cc1nc(-c2cccc(C(=O)Nc3ccc(-c4nnn[n-]4)cc3)c2)cs1 ZINC000463614202 599133980 /nfs/dbraw/zinc/13/39/80/599133980.db2.gz MYMTUQHEQMRFAO-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1nc(-c2cccc(C(=O)Nc3ccc(-c4nn[n-]n4)cc3)c2)cs1 ZINC000463614202 599133982 /nfs/dbraw/zinc/13/39/82/599133982.db2.gz MYMTUQHEQMRFAO-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM CCc1nc(C)c([C@@H](C)N(C)Cc2cc(-c3nn[n-]n3)ccc2F)s1 ZINC000736700535 599135952 /nfs/dbraw/zinc/13/59/52/599135952.db2.gz VBVWIIHETCSTEM-LLVKDONJSA-N -1 3 360.462 3.526 20 0 FHADHM COc1ccc(C=C(Cl)c2nc3ccccc3o2)cc1-c1nnn[n-]1 ZINC000737083879 599153234 /nfs/dbraw/zinc/15/32/34/599153234.db2.gz PYBMTCAAOVARRS-FMIVXFBMSA-N -1 3 353.769 3.753 20 0 FHADHM COc1ccc(C=C(Cl)c2nc3ccccc3o2)cc1-c1nn[n-]n1 ZINC000737083879 599153237 /nfs/dbraw/zinc/15/32/37/599153237.db2.gz PYBMTCAAOVARRS-FMIVXFBMSA-N -1 3 353.769 3.753 20 0 FHADHM Clc1ccccc1SCc1nnc(-c2cccc(-c3nnn[n-]3)c2)o1 ZINC000737583369 599160410 /nfs/dbraw/zinc/16/04/10/599160410.db2.gz JLDVWNDCKOAMBP-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1ccccc1SCc1nnc(-c2cccc(-c3nn[n-]n3)c2)o1 ZINC000737583369 599160412 /nfs/dbraw/zinc/16/04/12/599160412.db2.gz JLDVWNDCKOAMBP-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Cc1ccccc1[C@H](C)CC(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000737420793 599161456 /nfs/dbraw/zinc/16/14/56/599161456.db2.gz JPKOGWCJNRPPEE-GFCCVEGCSA-N -1 3 355.829 3.961 20 0 FHADHM Cc1ccccc1[C@H](C)CC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000737420793 599161458 /nfs/dbraw/zinc/16/14/58/599161458.db2.gz JPKOGWCJNRPPEE-GFCCVEGCSA-N -1 3 355.829 3.961 20 0 FHADHM CC(C)(C)[C@H]1CCCN(C(=O)CSc2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000735598391 599162130 /nfs/dbraw/zinc/16/21/30/599162130.db2.gz ZHKXEVIMMHOYGP-HNNXBMFYSA-N -1 3 373.526 3.634 20 0 FHADHM CC(C)(C)[C@H]1CCCN(C(=O)CSc2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000735598391 599162131 /nfs/dbraw/zinc/16/21/31/599162131.db2.gz ZHKXEVIMMHOYGP-HNNXBMFYSA-N -1 3 373.526 3.634 20 0 FHADHM Cc1ccc([C@@H]2CCC[C@H]2N(C)C(=O)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000822232972 599162282 /nfs/dbraw/zinc/16/22/82/599162282.db2.gz FPPUSWJBCZKRGB-RBUKOAKNSA-N -1 3 361.449 3.583 20 0 FHADHM Cc1ccc([C@@H]2CCC[C@H]2N(C)C(=O)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000822232972 599162285 /nfs/dbraw/zinc/16/22/85/599162285.db2.gz FPPUSWJBCZKRGB-RBUKOAKNSA-N -1 3 361.449 3.583 20 0 FHADHM CC(C)(C)[C@H]1CCCN(C(=O)C=Cc2ccccc2-c2nnn[n-]2)CC1 ZINC000735597960 599162498 /nfs/dbraw/zinc/16/24/98/599162498.db2.gz UYDCHZZWALTZLQ-OFAQMXQXSA-N -1 3 353.470 3.555 20 0 FHADHM CC(C)(C)[C@H]1CCCN(C(=O)C=Cc2ccccc2-c2nn[n-]n2)CC1 ZINC000735597960 599162499 /nfs/dbraw/zinc/16/24/99/599162499.db2.gz UYDCHZZWALTZLQ-OFAQMXQXSA-N -1 3 353.470 3.555 20 0 FHADHM Cc1ccccc1-c1cnc(CSc2ccc(-c3nnn[n-]3)cn2)o1 ZINC000737417307 599164765 /nfs/dbraw/zinc/16/47/65/599164765.db2.gz IVKOLTOQJZWVQA-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM Cc1ccccc1-c1cnc(CSc2ccc(-c3nn[n-]n3)cn2)o1 ZINC000737417307 599164768 /nfs/dbraw/zinc/16/47/68/599164768.db2.gz IVKOLTOQJZWVQA-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM CCCCC1CCC(C(=O)NCc2cc(-c3nnn[n-]3)ccc2F)CC1 ZINC000821043459 599168571 /nfs/dbraw/zinc/16/85/71/599168571.db2.gz QCPQGYFILDKBCT-UHFFFAOYSA-N -1 3 359.449 3.619 20 0 FHADHM CCCCC1CCC(C(=O)NCc2cc(-c3nn[n-]n3)ccc2F)CC1 ZINC000821043459 599168574 /nfs/dbraw/zinc/16/85/74/599168574.db2.gz QCPQGYFILDKBCT-UHFFFAOYSA-N -1 3 359.449 3.619 20 0 FHADHM Cc1ccc([C@@H]2CSCCN2Cc2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000737329655 599174386 /nfs/dbraw/zinc/17/43/86/599174386.db2.gz HGYQWCDGLKIVIH-SFHVURJKSA-N -1 3 369.469 3.604 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nnn[n-]2)c1)[C@@H]1CCSc2ccccc21 ZINC000738163289 599181026 /nfs/dbraw/zinc/18/10/26/599181026.db2.gz LCCVCMYJPMJTST-GFCCVEGCSA-N -1 3 371.853 3.738 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nn[n-]n2)c1)[C@@H]1CCSc2ccccc21 ZINC000738163289 599181028 /nfs/dbraw/zinc/18/10/28/599181028.db2.gz LCCVCMYJPMJTST-GFCCVEGCSA-N -1 3 371.853 3.738 20 0 FHADHM C[C@H](NC(=O)[C@@H](C)c1cccc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736094914 599181809 /nfs/dbraw/zinc/18/18/09/599181809.db2.gz AXMLJFHJMKGNAU-RYUDHWBXSA-N -1 3 355.829 3.501 20 0 FHADHM C[C@H](NC(=O)[C@@H](C)c1cccc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736094914 599181815 /nfs/dbraw/zinc/18/18/15/599181815.db2.gz AXMLJFHJMKGNAU-RYUDHWBXSA-N -1 3 355.829 3.501 20 0 FHADHM CC[C@H](C)NC(=O)c1cccc(Oc2ccc(Cl)cc2-c2nnn[n-]2)c1 ZINC000736328401 599193080 /nfs/dbraw/zinc/19/30/80/599193080.db2.gz WSVNISCRVWCIBW-NSHDSACASA-N -1 3 371.828 3.841 20 0 FHADHM CC[C@H](C)NC(=O)c1cccc(Oc2ccc(Cl)cc2-c2nn[n-]n2)c1 ZINC000736328401 599193083 /nfs/dbraw/zinc/19/30/83/599193083.db2.gz WSVNISCRVWCIBW-NSHDSACASA-N -1 3 371.828 3.841 20 0 FHADHM CC(C)N(C)C(=O)c1cccc(Oc2cccc(Cl)c2-c2nnn[n-]2)c1 ZINC000735857242 599194956 /nfs/dbraw/zinc/19/49/56/599194956.db2.gz QENNJJSAZJYEQA-UHFFFAOYSA-N -1 3 371.828 3.793 20 0 FHADHM CC(C)(C)c1ccc(NC(=O)NCc2cc(-c3nnn[n-]3)ccc2F)cc1 ZINC000819958417 599234793 /nfs/dbraw/zinc/23/47/93/599234793.db2.gz KFWPMPZBIJHLDE-UHFFFAOYSA-N -1 3 368.416 3.625 20 0 FHADHM CC(C)(C)c1ccc(NC(=O)NCc2cc(-c3nn[n-]n3)ccc2F)cc1 ZINC000819958417 599234795 /nfs/dbraw/zinc/23/47/95/599234795.db2.gz KFWPMPZBIJHLDE-UHFFFAOYSA-N -1 3 368.416 3.625 20 0 FHADHM Cc1cc(Cl)ccc1NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000822202401 599236002 /nfs/dbraw/zinc/23/60/02/599236002.db2.gz YNELCWPHUBAWQC-LLVKDONJSA-N -1 3 356.817 3.711 20 0 FHADHM Cc1cc(Cl)ccc1NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000822202401 599236005 /nfs/dbraw/zinc/23/60/05/599236005.db2.gz YNELCWPHUBAWQC-LLVKDONJSA-N -1 3 356.817 3.711 20 0 FHADHM Cc1c(NC(=O)[C@H](C)CSc2ccccc2)cccc1-c1nnn[n-]1 ZINC000822061524 607267115 /nfs/dbraw/zinc/26/71/15/607267115.db2.gz OXPDBGIMPJRNLQ-GFCCVEGCSA-N -1 3 353.451 3.542 20 0 FHADHM Cc1c(NC(=O)[C@H](C)CSc2ccccc2)cccc1-c1nn[n-]n1 ZINC000822061524 607267116 /nfs/dbraw/zinc/26/71/16/607267116.db2.gz OXPDBGIMPJRNLQ-GFCCVEGCSA-N -1 3 353.451 3.542 20 0 FHADHM CC[C@@H](NC(=S)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1cccs1 ZINC000820920319 599238839 /nfs/dbraw/zinc/23/88/39/599238839.db2.gz OWYZWJAGLGDPSE-SMDDNHRTSA-N -1 3 372.523 3.605 20 0 FHADHM CC[C@@H](NC(=S)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1cccs1 ZINC000820920319 599238840 /nfs/dbraw/zinc/23/88/40/599238840.db2.gz OWYZWJAGLGDPSE-SMDDNHRTSA-N -1 3 372.523 3.605 20 0 FHADHM Cc1c(NC(=O)c2cc3ccc(F)cc3s2)cccc1-c1nnn[n-]1 ZINC000822107703 607269930 /nfs/dbraw/zinc/26/99/30/607269930.db2.gz BMSADBBOCFVLOD-UHFFFAOYSA-N -1 3 353.382 3.781 20 0 FHADHM Cc1c(NC(=O)c2cc3ccc(F)cc3s2)cccc1-c1nn[n-]n1 ZINC000822107703 607269931 /nfs/dbraw/zinc/26/99/31/607269931.db2.gz BMSADBBOCFVLOD-UHFFFAOYSA-N -1 3 353.382 3.781 20 0 FHADHM Cc1ccc2c(CC(=O)Nc3cccc(-c4nnn[n-]4)c3C)coc2c1C ZINC000822275397 607271669 /nfs/dbraw/zinc/27/16/69/607271669.db2.gz TWBDPCONYIESDN-UHFFFAOYSA-N -1 3 361.405 3.719 20 0 FHADHM Cc1ccc2c(CC(=O)Nc3cccc(-c4nn[n-]n4)c3C)coc2c1C ZINC000822275397 607271670 /nfs/dbraw/zinc/27/16/70/607271670.db2.gz TWBDPCONYIESDN-UHFFFAOYSA-N -1 3 361.405 3.719 20 0 FHADHM C[C@H]1C[C@@H](c2ccccc2F)N(C(=O)Nc2cccc(-c3nnn[n-]3)c2)C1 ZINC000820669164 599245666 /nfs/dbraw/zinc/24/56/66/599245666.db2.gz ZGOQJVSTYIJBNO-SJCJKPOMSA-N -1 3 366.400 3.621 20 0 FHADHM C[C@H]1C[C@@H](c2ccccc2F)N(C(=O)Nc2cccc(-c3nn[n-]n3)c2)C1 ZINC000820669164 599245668 /nfs/dbraw/zinc/24/56/68/599245668.db2.gz ZGOQJVSTYIJBNO-SJCJKPOMSA-N -1 3 366.400 3.621 20 0 FHADHM C[C@H]1C[C@@H](c2cccc(F)c2)N(C(=O)Nc2cccc(-c3nnn[n-]3)c2)C1 ZINC000820668585 599247389 /nfs/dbraw/zinc/24/73/89/599247389.db2.gz VBIUGGQLZMXCDS-SJCJKPOMSA-N -1 3 366.400 3.621 20 0 FHADHM C[C@H]1C[C@@H](c2cccc(F)c2)N(C(=O)Nc2cccc(-c3nn[n-]n3)c2)C1 ZINC000820668585 599247390 /nfs/dbraw/zinc/24/73/90/599247390.db2.gz VBIUGGQLZMXCDS-SJCJKPOMSA-N -1 3 366.400 3.621 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)N[C@@H]1CC[C@@H]2CCC[C@H]2C1 ZINC000823308467 599251734 /nfs/dbraw/zinc/25/17/34/599251734.db2.gz BDYKAQNHOWRFAW-SDDRHHMPSA-N -1 3 360.849 3.610 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)N[C@@H]1CC[C@@H]2CCC[C@H]2C1 ZINC000823308467 599251737 /nfs/dbraw/zinc/25/17/37/599251737.db2.gz BDYKAQNHOWRFAW-SDDRHHMPSA-N -1 3 360.849 3.610 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@@H]2C2CCCCC2)cccc1-c1nnn[n-]1 ZINC000822084980 607287434 /nfs/dbraw/zinc/28/74/34/607287434.db2.gz UTLXSSRNMQNPAC-QGZVFWFLSA-N -1 3 354.458 3.752 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@@H]2C2CCCCC2)cccc1-c1nn[n-]n1 ZINC000822084980 607287435 /nfs/dbraw/zinc/28/74/35/607287435.db2.gz UTLXSSRNMQNPAC-QGZVFWFLSA-N -1 3 354.458 3.752 20 0 FHADHM Cc1cc(F)cc2c1ncc(-c1nnn[n-]1)c2N(C)Cc1cccs1 ZINC000737263638 599255399 /nfs/dbraw/zinc/25/53/99/599255399.db2.gz MZYIOCVCIMXTLF-UHFFFAOYSA-N -1 3 354.414 3.560 20 0 FHADHM Cc1cc(F)cc2c1ncc(-c1nn[n-]n1)c2N(C)Cc1cccs1 ZINC000737263638 599255401 /nfs/dbraw/zinc/25/54/01/599255401.db2.gz MZYIOCVCIMXTLF-UHFFFAOYSA-N -1 3 354.414 3.560 20 0 FHADHM Cc1c(NC(=O)N[C@@H](C)c2ccc(Cl)s2)cccc1-c1nnn[n-]1 ZINC000822090171 607289227 /nfs/dbraw/zinc/28/92/27/607289227.db2.gz JARDIDIEWFPDBG-VIFPVBQESA-N -1 3 362.846 3.773 20 0 FHADHM Cc1c(NC(=O)N[C@@H](C)c2ccc(Cl)s2)cccc1-c1nn[n-]n1 ZINC000822090171 607289228 /nfs/dbraw/zinc/28/92/28/607289228.db2.gz JARDIDIEWFPDBG-VIFPVBQESA-N -1 3 362.846 3.773 20 0 FHADHM CN(Cc1cccc(Cl)c1)c1c(-c2nnn[n-]2)cnc2ccccc21 ZINC000736828792 599255682 /nfs/dbraw/zinc/25/56/82/599255682.db2.gz SFTSLSWHYPBOBB-UHFFFAOYSA-N -1 3 350.813 3.705 20 0 FHADHM CN(Cc1cccc(Cl)c1)c1c(-c2nn[n-]n2)cnc2ccccc21 ZINC000736828792 599255683 /nfs/dbraw/zinc/25/56/83/599255683.db2.gz SFTSLSWHYPBOBB-UHFFFAOYSA-N -1 3 350.813 3.705 20 0 FHADHM Cc1c(NC(=O)N(CCC(C)C)C2CCCC2)cccc1-c1nnn[n-]1 ZINC000822075305 607285605 /nfs/dbraw/zinc/28/56/05/607285605.db2.gz BFTRTPMXPVPWNX-UHFFFAOYSA-N -1 3 356.474 3.998 20 0 FHADHM Cc1c(NC(=O)N(CCC(C)C)C2CCCC2)cccc1-c1nn[n-]n1 ZINC000822075305 607285606 /nfs/dbraw/zinc/28/56/06/607285606.db2.gz BFTRTPMXPVPWNX-UHFFFAOYSA-N -1 3 356.474 3.998 20 0 FHADHM Fc1ccc(C2=CCN(c3c(-c4nnn[n-]4)cnc4ccccc43)CC2)cc1 ZINC000737652667 599261972 /nfs/dbraw/zinc/26/19/72/599261972.db2.gz XNSQUZQKRIRFCV-UHFFFAOYSA-N -1 3 372.407 3.848 20 0 FHADHM Fc1ccc(C2=CCN(c3c(-c4nn[n-]n4)cnc4ccccc43)CC2)cc1 ZINC000737652667 599261975 /nfs/dbraw/zinc/26/19/75/599261975.db2.gz XNSQUZQKRIRFCV-UHFFFAOYSA-N -1 3 372.407 3.848 20 0 FHADHM Cc1c(NC(=O)C(c2ccccc2)c2ccccc2)cccc1-c1nnn[n-]1 ZINC000822061845 607295008 /nfs/dbraw/zinc/29/50/08/607295008.db2.gz ZOJSOCWHNMSNLR-UHFFFAOYSA-N -1 3 369.428 3.946 20 0 FHADHM Cc1c(NC(=O)C(c2ccccc2)c2ccccc2)cccc1-c1nn[n-]n1 ZINC000822061845 607295009 /nfs/dbraw/zinc/29/50/09/607295009.db2.gz ZOJSOCWHNMSNLR-UHFFFAOYSA-N -1 3 369.428 3.946 20 0 FHADHM Cc1c(NC(=O)c2cc(Cl)ccc2OC(C)C)cccc1-c1nnn[n-]1 ZINC000822108450 607296094 /nfs/dbraw/zinc/29/60/94/607296094.db2.gz JRMGLNCHSFNYPB-UHFFFAOYSA-N -1 3 371.828 3.868 20 0 FHADHM Cc1c(NC(=O)c2cc(Cl)ccc2OC(C)C)cccc1-c1nn[n-]n1 ZINC000822108450 607296095 /nfs/dbraw/zinc/29/60/95/607296095.db2.gz JRMGLNCHSFNYPB-UHFFFAOYSA-N -1 3 371.828 3.868 20 0 FHADHM Cc1cc(F)cc(NC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)c1 ZINC000822203380 607308413 /nfs/dbraw/zinc/30/84/13/607308413.db2.gz QMNVXQXDYPEFJI-UHFFFAOYSA-N -1 3 369.400 3.502 20 0 FHADHM Cc1cc(F)cc(NC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)c1 ZINC000822203380 607308414 /nfs/dbraw/zinc/30/84/14/607308414.db2.gz QMNVXQXDYPEFJI-UHFFFAOYSA-N -1 3 369.400 3.502 20 0 FHADHM c1sc(CNc2cccc(OCc3cccnc3)c2)cc1-c1nnn[n-]1 ZINC000823816090 607309681 /nfs/dbraw/zinc/30/96/81/607309681.db2.gz PPYGJZSEGAFUJC-UHFFFAOYSA-N -1 3 364.434 3.514 20 0 FHADHM c1sc(CNc2cccc(OCc3cccnc3)c2)cc1-c1nn[n-]n1 ZINC000823816090 607309682 /nfs/dbraw/zinc/30/96/82/607309682.db2.gz PPYGJZSEGAFUJC-UHFFFAOYSA-N -1 3 364.434 3.514 20 0 FHADHM CCC[C@@H]1[C@@H](C)CCCN1C(=O)Nc1cc(-c2nnn[n-]2)ccc1OCC ZINC000821034406 599266509 /nfs/dbraw/zinc/26/65/09/599266509.db2.gz LVNCDYYIWJAQMP-XJKSGUPXSA-N -1 3 372.473 3.698 20 0 FHADHM CCC[C@@H]1[C@@H](C)CCCN1C(=O)Nc1cc(-c2nn[n-]n2)ccc1OCC ZINC000821034406 599266511 /nfs/dbraw/zinc/26/65/11/599266511.db2.gz LVNCDYYIWJAQMP-XJKSGUPXSA-N -1 3 372.473 3.698 20 0 FHADHM CCCCOc1ccc(OC)cc1NCc1cc(-c2nnn[n-]2)cs1 ZINC000821077324 607312069 /nfs/dbraw/zinc/31/20/69/607312069.db2.gz ALVTXCWSLSKQLE-UHFFFAOYSA-N -1 3 359.455 3.728 20 0 FHADHM CCCCOc1ccc(OC)cc1NCc1cc(-c2nn[n-]n2)cs1 ZINC000821077324 607312070 /nfs/dbraw/zinc/31/20/70/607312070.db2.gz ALVTXCWSLSKQLE-UHFFFAOYSA-N -1 3 359.455 3.728 20 0 FHADHM COc1ccc(NCc2ccc(-c3nnn[n-]3)s2)cc1OC1CCCC1 ZINC000821835808 607313489 /nfs/dbraw/zinc/31/34/89/607313489.db2.gz RYYGMLXPXPSIHB-UHFFFAOYSA-N -1 3 371.466 3.870 20 0 FHADHM CCC[C@]1(C)CCCN(C(=O)Nc2cc(-c3nnn[n-]3)ccc2OCC)C1 ZINC000821026843 599264908 /nfs/dbraw/zinc/26/49/08/599264908.db2.gz DVVBMQQMSMBBCW-LJQANCHMSA-N -1 3 372.473 3.700 20 0 FHADHM CCC[C@]1(C)CCCN(C(=O)Nc2cc(-c3nn[n-]n3)ccc2OCC)C1 ZINC000821026843 599264910 /nfs/dbraw/zinc/26/49/10/599264910.db2.gz DVVBMQQMSMBBCW-LJQANCHMSA-N -1 3 372.473 3.700 20 0 FHADHM FC(F)Oc1ccc(NCc2cc(-c3nnn[n-]3)cs2)c2cccnc12 ZINC000822732987 607314766 /nfs/dbraw/zinc/31/47/66/607314766.db2.gz PUQMNDJAQDEYTI-UHFFFAOYSA-N -1 3 374.376 3.690 20 0 FHADHM FC(F)Oc1ccc(NCc2cc(-c3nn[n-]n3)cs2)c2cccnc12 ZINC000822732987 607314767 /nfs/dbraw/zinc/31/47/67/607314767.db2.gz PUQMNDJAQDEYTI-UHFFFAOYSA-N -1 3 374.376 3.690 20 0 FHADHM Clc1cc(NCc2ccc(-c3nnn[n-]3)s2)ccc1N1CCCC1 ZINC000822568494 607315179 /nfs/dbraw/zinc/31/51/79/607315179.db2.gz SSYOIASNKRPDOB-UHFFFAOYSA-N -1 3 360.874 3.794 20 0 FHADHM C[C@H](NC(=O)Nc1cccc(C(F)F)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820380210 599273772 /nfs/dbraw/zinc/27/37/72/599273772.db2.gz NKLMCQHRUQOWDL-JTQLQIEISA-N -1 3 358.352 3.687 20 0 FHADHM C[C@H](NC(=O)Nc1cccc(C(F)F)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820380210 599273774 /nfs/dbraw/zinc/27/37/74/599273774.db2.gz NKLMCQHRUQOWDL-JTQLQIEISA-N -1 3 358.352 3.687 20 0 FHADHM CCCCS[C@@H](C)C(=O)Nc1cc(-c2nn[n-]n2)ccc1NCCC ZINC000736463968 599275874 /nfs/dbraw/zinc/27/58/74/599275874.db2.gz TYFDNFJDVSNFQB-LBPRGKRZSA-N -1 3 362.503 3.549 20 0 FHADHM COc1ccc(CNc2ccc3nc(C4CC4)oc3c2)cc1-c1nnn[n-]1 ZINC000821821827 607318536 /nfs/dbraw/zinc/31/85/36/607318536.db2.gz ZBIQXCITARWDOW-UHFFFAOYSA-N -1 3 362.393 3.506 20 0 FHADHM COc1ccc(CNc2ccc3nc(C4CC4)oc3c2)cc1-c1nn[n-]n1 ZINC000821821827 607318537 /nfs/dbraw/zinc/31/85/37/607318537.db2.gz ZBIQXCITARWDOW-UHFFFAOYSA-N -1 3 362.393 3.506 20 0 FHADHM CCc1ccc([C@@H]2CCCN2C(=O)Nc2cc(-c3nnn[n-]3)ccc2C)o1 ZINC000736684439 599280109 /nfs/dbraw/zinc/28/01/09/599280109.db2.gz HFOOXAJCUXVNIG-INIZCTEOSA-N -1 3 366.425 3.700 20 0 FHADHM CCc1ccc([C@@H]2CCCN2C(=O)Nc2cc(-c3nn[n-]n3)ccc2C)o1 ZINC000736684439 599280112 /nfs/dbraw/zinc/28/01/12/599280112.db2.gz HFOOXAJCUXVNIG-INIZCTEOSA-N -1 3 366.425 3.700 20 0 FHADHM Cc1ccc([C@H](C)OC(=O)CSCc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000822270947 607320540 /nfs/dbraw/zinc/32/05/40/607320540.db2.gz FHLIOXFWQKXZSJ-AWEZNQCLSA-N -1 3 368.462 3.713 20 0 FHADHM Cc1ccc([C@H](C)OC(=O)CSCc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000822270947 607320541 /nfs/dbraw/zinc/32/05/41/607320541.db2.gz FHLIOXFWQKXZSJ-AWEZNQCLSA-N -1 3 368.462 3.713 20 0 FHADHM C[C@@H](Sc1ccc2c(c1)OCCCO2)c1ccc(-c2nnn[n-]2)cc1 ZINC000736194147 599285113 /nfs/dbraw/zinc/28/51/13/599285113.db2.gz WOYURQFJAJUZAW-GFCCVEGCSA-N -1 3 354.435 3.881 20 0 FHADHM C[C@@H](Sc1ccc2c(c1)OCCCO2)c1ccc(-c2nn[n-]n2)cc1 ZINC000736194147 599285114 /nfs/dbraw/zinc/28/51/14/599285114.db2.gz WOYURQFJAJUZAW-GFCCVEGCSA-N -1 3 354.435 3.881 20 0 FHADHM CCn1c(S[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)nnc1-c1ccco1 ZINC000736713693 599286127 /nfs/dbraw/zinc/28/61/27/599286127.db2.gz LMOLAVFLYPVWBP-NSHDSACASA-N -1 3 367.438 3.591 20 0 FHADHM CCn1c(S[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)nnc1-c1ccco1 ZINC000736713693 599286128 /nfs/dbraw/zinc/28/61/28/599286128.db2.gz LMOLAVFLYPVWBP-NSHDSACASA-N -1 3 367.438 3.591 20 0 FHADHM C[C@H]1CCC[C@H](NC(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)C1 ZINC000820697917 599288375 /nfs/dbraw/zinc/28/83/75/599288375.db2.gz NXVSKBAMNHZYOB-UWVGGRQHSA-N -1 3 368.363 3.586 20 0 FHADHM C[C@H]1CCC[C@H](NC(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)C1 ZINC000820697917 599288376 /nfs/dbraw/zinc/28/83/76/599288376.db2.gz NXVSKBAMNHZYOB-UWVGGRQHSA-N -1 3 368.363 3.586 20 0 FHADHM C[C@@H]1CCCN(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)CC1 ZINC000820709483 599289462 /nfs/dbraw/zinc/28/94/62/599289462.db2.gz JLNWVRMMTYOQHZ-SNVBAGLBSA-N -1 3 368.363 3.539 20 0 FHADHM C[C@@H]1CCCN(C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)CC1 ZINC000820709483 599289465 /nfs/dbraw/zinc/28/94/65/599289465.db2.gz JLNWVRMMTYOQHZ-SNVBAGLBSA-N -1 3 368.363 3.539 20 0 FHADHM CCC(CC)n1ccc(CSCc2cc(F)ccc2-c2nnn[n-]2)n1 ZINC000820898180 607325592 /nfs/dbraw/zinc/32/55/92/607325592.db2.gz WBTFCZSJPJFAIU-UHFFFAOYSA-N -1 3 360.462 3.997 20 0 FHADHM CCC(CC)n1ccc(CSCc2cc(F)ccc2-c2nn[n-]n2)n1 ZINC000820898180 607325593 /nfs/dbraw/zinc/32/55/93/607325593.db2.gz WBTFCZSJPJFAIU-UHFFFAOYSA-N -1 3 360.462 3.997 20 0 FHADHM CCC(=O)c1cccc(NCc2ccc(-c3nnn[n-]3)cc2OC(F)F)c1 ZINC000820841811 607333308 /nfs/dbraw/zinc/33/33/08/607333308.db2.gz FJONSMJLBQHIMT-UHFFFAOYSA-N -1 3 373.363 3.673 20 0 FHADHM CCC(=O)c1cccc(NCc2ccc(-c3nn[n-]n3)cc2OC(F)F)c1 ZINC000820841811 607333309 /nfs/dbraw/zinc/33/33/09/607333309.db2.gz FJONSMJLBQHIMT-UHFFFAOYSA-N -1 3 373.363 3.673 20 0 FHADHM C[C@@H](NCc1cccc(C(=O)[O-])c1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000263494220 598191986 /nfs/dbraw/zinc/19/19/86/598191986.db2.gz SESUVZSNTPGLFL-CYBMUJFWSA-N -1 3 353.422 3.520 20 0 FHADHM CCSc1ccc(Cl)cc1NC(=O)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000736668466 598234488 /nfs/dbraw/zinc/23/44/88/598234488.db2.gz YELAGFXYBQIEQJ-UHFFFAOYSA-N -1 3 373.869 3.813 20 0 FHADHM CCSc1ccc(Cl)cc1NC(=O)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000736668466 598234490 /nfs/dbraw/zinc/23/44/90/598234490.db2.gz YELAGFXYBQIEQJ-UHFFFAOYSA-N -1 3 373.869 3.813 20 0 FHADHM Fc1cccc(Sc2nc3ccccc3n2C(F)F)c1-c1nnn[n-]1 ZINC000737666552 598236071 /nfs/dbraw/zinc/23/60/71/598236071.db2.gz ZPWWQRUGOMMHFL-UHFFFAOYSA-N -1 3 362.340 3.902 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1N1CCC(c2c[nH]c3ccccc32)CC1 ZINC000737639889 598236340 /nfs/dbraw/zinc/23/63/40/598236340.db2.gz HILHHASUNXDSLR-UHFFFAOYSA-N -1 3 362.412 3.871 20 0 FHADHM COc1cc([C@@H](C)Nc2ccc(-c3nn[n-]n3)cc2F)ccc1OC(C)C ZINC000737040086 598238606 /nfs/dbraw/zinc/23/86/06/598238606.db2.gz DKLDHKQFNWOIRI-GFCCVEGCSA-N -1 3 371.416 3.975 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)N[C@@H](c1ccc(F)cc1)C1CCC1 ZINC000738179640 598254828 /nfs/dbraw/zinc/25/48/28/598254828.db2.gz ZIGCLXNMXWIGCR-QGZVFWFLSA-N -1 3 366.400 3.669 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)N[C@@H](c1ccc(F)cc1)C1CCC1 ZINC000738179640 598254830 /nfs/dbraw/zinc/25/48/30/598254830.db2.gz ZIGCLXNMXWIGCR-QGZVFWFLSA-N -1 3 366.400 3.669 20 0 FHADHM CC[C@@H](C)N(C)C(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736322255 598267183 /nfs/dbraw/zinc/26/71/83/598267183.db2.gz JOCXAFSJJGNDJG-CYBMUJFWSA-N -1 3 366.425 3.921 20 0 FHADHM CC[C@@H](C)N(C)C(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736322255 598267185 /nfs/dbraw/zinc/26/71/85/598267185.db2.gz JOCXAFSJJGNDJG-CYBMUJFWSA-N -1 3 366.425 3.921 20 0 FHADHM CC[C@H](SCC(=O)Nc1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000736393535 598272918 /nfs/dbraw/zinc/27/29/18/598272918.db2.gz ZJZUOLZWTGAWAM-INIZCTEOSA-N -1 3 353.451 3.690 20 0 FHADHM CC[C@H](SCC(=O)Nc1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000736393535 598272920 /nfs/dbraw/zinc/27/29/20/598272920.db2.gz ZJZUOLZWTGAWAM-INIZCTEOSA-N -1 3 353.451 3.690 20 0 FHADHM COc1cccc(CN(C)c2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)c1 ZINC000737132429 598274153 /nfs/dbraw/zinc/27/41/53/598274153.db2.gz XJBOQSQHHINLST-UHFFFAOYSA-N -1 3 363.343 3.531 20 0 FHADHM COc1cccc(CN(C)c2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)c1 ZINC000737132429 598274154 /nfs/dbraw/zinc/27/41/54/598274154.db2.gz XJBOQSQHHINLST-UHFFFAOYSA-N -1 3 363.343 3.531 20 0 FHADHM COc1ccc(CCNc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)cc1 ZINC000737090969 598274300 /nfs/dbraw/zinc/27/43/00/598274300.db2.gz YECQYTXRIYPCJP-UHFFFAOYSA-N -1 3 363.343 3.549 20 0 FHADHM Cc1noc(C)c1CNc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737537197 598283641 /nfs/dbraw/zinc/28/36/41/598283641.db2.gz LNVRVGXCWFSQQA-UHFFFAOYSA-N -1 3 362.393 3.876 20 0 FHADHM Cc1noc(C)c1CNc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737537197 598283642 /nfs/dbraw/zinc/28/36/42/598283642.db2.gz LNVRVGXCWFSQQA-UHFFFAOYSA-N -1 3 362.393 3.876 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)C1CCCCCC1 ZINC000736627131 598295579 /nfs/dbraw/zinc/29/55/79/598295579.db2.gz LTGAUECHJJOCIV-UHFFFAOYSA-N -1 3 364.833 3.795 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)C1CCCCCC1 ZINC000736627131 598295581 /nfs/dbraw/zinc/29/55/81/598295581.db2.gz LTGAUECHJJOCIV-UHFFFAOYSA-N -1 3 364.833 3.795 20 0 FHADHM CC[C@H](C)Oc1ccccc1C=CC(=O)Nc1sccc1-c1nnn[n-]1 ZINC000736328074 598297545 /nfs/dbraw/zinc/29/75/45/598297545.db2.gz NRYGZQDPUOAHOQ-BCPZQOPPSA-N -1 3 369.450 3.757 20 0 FHADHM CC[C@H](C)Oc1ccccc1C=CC(=O)Nc1sccc1-c1nn[n-]n1 ZINC000736328074 598297546 /nfs/dbraw/zinc/29/75/46/598297546.db2.gz NRYGZQDPUOAHOQ-BCPZQOPPSA-N -1 3 369.450 3.757 20 0 FHADHM Cc1nc(CSCc2ccc(-c3ccccc3-c3nnn[n-]3)cc2)no1 ZINC000737478767 598313764 /nfs/dbraw/zinc/31/37/64/598313764.db2.gz YYQRHLJMTDUIOW-UHFFFAOYSA-N -1 3 364.434 3.659 20 0 FHADHM Cc1nc(CSCc2ccc(-c3ccccc3-c3nn[n-]n3)cc2)no1 ZINC000737478767 598313766 /nfs/dbraw/zinc/31/37/66/598313766.db2.gz YYQRHLJMTDUIOW-UHFFFAOYSA-N -1 3 364.434 3.659 20 0 FHADHM C[C@@H](c1ccccc1)N(C)C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736203402 598318467 /nfs/dbraw/zinc/31/84/67/598318467.db2.gz NJOIPNLDPWVFMC-NSHDSACASA-N -1 3 372.885 3.910 20 0 FHADHM C[C@@H](c1ccccc1)N(C)C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736203402 598318469 /nfs/dbraw/zinc/31/84/69/598318469.db2.gz NJOIPNLDPWVFMC-NSHDSACASA-N -1 3 372.885 3.910 20 0 FHADHM C[C@H]1CCCC[C@H]1N(C)C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736270060 598318511 /nfs/dbraw/zinc/31/85/11/598318511.db2.gz IUAGKSCDPVHOGB-IINYFYTJSA-N -1 3 364.906 3.727 20 0 FHADHM C[C@H]1CCCC[C@H]1N(C)C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736270060 598318513 /nfs/dbraw/zinc/31/85/13/598318513.db2.gz IUAGKSCDPVHOGB-IINYFYTJSA-N -1 3 364.906 3.727 20 0 FHADHM CN(C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)C1CCCCCC1 ZINC000736740868 598318757 /nfs/dbraw/zinc/31/87/57/598318757.db2.gz IAKPXXVOEBZZGH-UHFFFAOYSA-N -1 3 364.906 3.872 20 0 FHADHM CN(C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)C1CCCCCC1 ZINC000736740868 598318759 /nfs/dbraw/zinc/31/87/59/598318759.db2.gz IAKPXXVOEBZZGH-UHFFFAOYSA-N -1 3 364.906 3.872 20 0 FHADHM Cc1cccc(C(C)C)c1NC(=O)NCc1ccc(-c2nnn[n-]2)cc1F ZINC000737388840 598322289 /nfs/dbraw/zinc/32/22/89/598322289.db2.gz MGMKGNFMUGRRFJ-UHFFFAOYSA-N -1 3 368.416 3.759 20 0 FHADHM Cc1cccc(C(C)C)c1NC(=O)NCc1ccc(-c2nn[n-]n2)cc1F ZINC000737388840 598322290 /nfs/dbraw/zinc/32/22/90/598322290.db2.gz MGMKGNFMUGRRFJ-UHFFFAOYSA-N -1 3 368.416 3.759 20 0 FHADHM COc1cc(-c2nnn[n-]2)cc(Cl)c1OCc1ccc(OC(C)C)cc1 ZINC000737024357 598354252 /nfs/dbraw/zinc/35/42/52/598354252.db2.gz HCNYAMACXJBANJ-UHFFFAOYSA-N -1 3 374.828 3.895 20 0 FHADHM COc1cc(-c2nn[n-]n2)cc(Cl)c1OCc1ccc(OC(C)C)cc1 ZINC000737024357 598354254 /nfs/dbraw/zinc/35/42/54/598354254.db2.gz HCNYAMACXJBANJ-UHFFFAOYSA-N -1 3 374.828 3.895 20 0 FHADHM C[C@@H](NC(=O)N1CCC2(CCCCC2)CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736113445 598357759 /nfs/dbraw/zinc/35/77/59/598357759.db2.gz NXSGHVSVKDWTAK-OAHLLOKOSA-N -1 3 368.485 3.684 20 0 FHADHM C[C@@H](NC(=O)N1CCC2(CCCCC2)CC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736113445 598357760 /nfs/dbraw/zinc/35/77/60/598357760.db2.gz NXSGHVSVKDWTAK-OAHLLOKOSA-N -1 3 368.485 3.684 20 0 FHADHM Fc1ccc(CSc2nnc(-c3ccccc3)s2)c(-c2nnn[n-]2)c1 ZINC000737647366 598359159 /nfs/dbraw/zinc/35/91/59/598359159.db2.gz CSJYTLWYAGOZKW-UHFFFAOYSA-N -1 3 370.438 3.817 20 0 FHADHM Fc1ccc(CSc2nnc(-c3ccccc3)s2)c(-c2nn[n-]n2)c1 ZINC000737647366 598359160 /nfs/dbraw/zinc/35/91/60/598359160.db2.gz CSJYTLWYAGOZKW-UHFFFAOYSA-N -1 3 370.438 3.817 20 0 FHADHM C[C@@H](NC(=O)Cc1ccc(-c2nnn[n-]2)cc1)c1csc2ccccc21 ZINC000736113091 598359993 /nfs/dbraw/zinc/35/99/93/598359993.db2.gz WSOOUMVSHHOVTM-GFCCVEGCSA-N -1 3 363.446 3.501 20 0 FHADHM C[C@@H](NC(=O)Cc1ccc(-c2nn[n-]n2)cc1)c1csc2ccccc21 ZINC000736113091 598359995 /nfs/dbraw/zinc/35/99/95/598359995.db2.gz WSOOUMVSHHOVTM-GFCCVEGCSA-N -1 3 363.446 3.501 20 0 FHADHM Cc1oc(-c2ccsc2)nc1CN(C)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000737546839 598369756 /nfs/dbraw/zinc/36/97/56/598369756.db2.gz IBUNDXSFYUFFIA-UHFFFAOYSA-N -1 3 366.450 3.524 20 0 FHADHM Cc1oc(-c2ccsc2)nc1CN(C)Cc1cccc(-c2nn[n-]n2)c1 ZINC000737549454 598369802 /nfs/dbraw/zinc/36/98/02/598369802.db2.gz XHYHRUYQVZNZNJ-UHFFFAOYSA-N -1 3 366.450 3.524 20 0 FHADHM COc1ccc(C(=O)CSc2ccc(-c3nnn[n-]3)cc2)cc1Cl ZINC000737066419 598378908 /nfs/dbraw/zinc/37/89/08/598378908.db2.gz NXHIHZWJASXDHD-UHFFFAOYSA-N -1 3 360.826 3.504 20 0 FHADHM COc1ccc(C(=O)CSc2ccc(-c3nn[n-]n3)cc2)cc1Cl ZINC000737066419 598378909 /nfs/dbraw/zinc/37/89/09/598378909.db2.gz NXHIHZWJASXDHD-UHFFFAOYSA-N -1 3 360.826 3.504 20 0 FHADHM Cc1sc(NC(=O)C2(c3ccccc3C)CC2)c(-c2nnn[n-]2)c1C ZINC000737422896 598380695 /nfs/dbraw/zinc/38/06/95/598380695.db2.gz SOZMEHAFDAYLRS-UHFFFAOYSA-N -1 3 353.451 3.524 20 0 FHADHM Cc1sc(NC(=O)C2(c3ccccc3C)CC2)c(-c2nn[n-]n2)c1C ZINC000737422896 598380696 /nfs/dbraw/zinc/38/06/96/598380696.db2.gz SOZMEHAFDAYLRS-UHFFFAOYSA-N -1 3 353.451 3.524 20 0 FHADHM Clc1cccc(Cl)c1CNc1ncc(-c2nnn[n-]2)cc1Cl ZINC000737559466 598392685 /nfs/dbraw/zinc/39/26/85/598392685.db2.gz YOLQKOSDTQQZCZ-UHFFFAOYSA-N -1 3 355.616 3.834 20 0 FHADHM Clc1cccc(Cl)c1CNc1ncc(-c2nn[n-]n2)cc1Cl ZINC000737559466 598392687 /nfs/dbraw/zinc/39/26/87/598392687.db2.gz YOLQKOSDTQQZCZ-UHFFFAOYSA-N -1 3 355.616 3.834 20 0 FHADHM c1cc2c(ncnc2Nc2ccc(Oc3ccc(-c4nn[n-]n4)cc3)cc2)[nH]1 ZINC000738451195 598392972 /nfs/dbraw/zinc/39/29/72/598392972.db2.gz DTFKSVZXMYLJOB-UHFFFAOYSA-N -1 3 370.376 3.674 20 0 FHADHM CC(C)[C@H](Sc1ccccc1)C(=O)Oc1ccc(-c2nnn[n-]2)cc1 ZINC000735735246 598414027 /nfs/dbraw/zinc/41/40/27/598414027.db2.gz MVWPHLUEZLCQAC-INIZCTEOSA-N -1 3 354.435 3.589 20 0 FHADHM CC(C)[C@H](Sc1ccccc1)C(=O)Oc1ccc(-c2nn[n-]n2)cc1 ZINC000735735246 598414030 /nfs/dbraw/zinc/41/40/30/598414030.db2.gz MVWPHLUEZLCQAC-INIZCTEOSA-N -1 3 354.435 3.589 20 0 FHADHM Cc1ccc(NC(=O)[C@H](C)Sc2ccc(-c3nnn[n-]3)cc2)cc1C ZINC000737357523 598414691 /nfs/dbraw/zinc/41/46/91/598414691.db2.gz ZPEBQRKVAZVYTR-ZDUSSCGKSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1ccc(NC(=O)[C@H](C)Sc2ccc(-c3nn[n-]n3)cc2)cc1C ZINC000737357523 598414692 /nfs/dbraw/zinc/41/46/92/598414692.db2.gz ZPEBQRKVAZVYTR-ZDUSSCGKSA-N -1 3 353.451 3.603 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1ccc(F)cc1Cl ZINC000737196284 598416584 /nfs/dbraw/zinc/41/65/84/598416584.db2.gz DDJSHMZDJAJBHZ-LAHYYIKRSA-N -1 3 372.787 3.977 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1ccc(F)cc1Cl ZINC000737196284 598416586 /nfs/dbraw/zinc/41/65/86/598416586.db2.gz DDJSHMZDJAJBHZ-LAHYYIKRSA-N -1 3 372.787 3.977 20 0 FHADHM Cc1ccccc1[C@H](C)NC(=O)[C@H](C)Sc1ccc(-c2nnn[n-]2)cc1 ZINC000737419922 598417521 /nfs/dbraw/zinc/41/75/21/598417521.db2.gz GMHUZQDILRGQCE-KBPBESRZSA-N -1 3 367.478 3.533 20 0 FHADHM Cc1ccccc1[C@H](C)NC(=O)[C@H](C)Sc1ccc(-c2nn[n-]n2)cc1 ZINC000737419922 598417523 /nfs/dbraw/zinc/41/75/23/598417523.db2.gz GMHUZQDILRGQCE-KBPBESRZSA-N -1 3 367.478 3.533 20 0 FHADHM Cc1cc(C)cc([C@@H](C)NC(=S)Nc2ccccc2-c2nnn[n-]2)c1 ZINC000737253744 598418200 /nfs/dbraw/zinc/41/82/00/598418200.db2.gz SKIMNFZSODJDJD-CYBMUJFWSA-N -1 3 352.467 3.531 20 0 FHADHM Cc1cc(C)cc([C@@H](C)NC(=S)Nc2ccccc2-c2nn[n-]n2)c1 ZINC000737253744 598418201 /nfs/dbraw/zinc/41/82/01/598418201.db2.gz SKIMNFZSODJDJD-CYBMUJFWSA-N -1 3 352.467 3.531 20 0 FHADHM COc1ccc(NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c(C)c1 ZINC000737102766 598418653 /nfs/dbraw/zinc/41/86/53/598418653.db2.gz CSFAEURUQHEUDW-UHFFFAOYSA-N -1 3 374.857 3.646 20 0 FHADHM COc1ccc(NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c(C)c1 ZINC000737102766 598418654 /nfs/dbraw/zinc/41/86/54/598418654.db2.gz CSFAEURUQHEUDW-UHFFFAOYSA-N -1 3 374.857 3.646 20 0 FHADHM CCN(C(=O)c1sccc1SC)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736509663 598420489 /nfs/dbraw/zinc/42/04/89/598420489.db2.gz ZGBODPPCDJUQLA-NSHDSACASA-N -1 3 373.507 3.873 20 0 FHADHM CCN(C(=O)c1sccc1SC)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736509663 598420492 /nfs/dbraw/zinc/42/04/92/598420492.db2.gz ZGBODPPCDJUQLA-NSHDSACASA-N -1 3 373.507 3.873 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc(-c2nnn[n-]2)cc1)c1cc2ccccc2s1 ZINC000736119328 598428878 /nfs/dbraw/zinc/42/88/78/598428878.db2.gz XOVHWFBVDFEXFE-LLVKDONJSA-N -1 3 364.434 3.964 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc(-c2nn[n-]n2)cc1)c1cc2ccccc2s1 ZINC000736119328 598428879 /nfs/dbraw/zinc/42/88/79/598428879.db2.gz XOVHWFBVDFEXFE-LLVKDONJSA-N -1 3 364.434 3.964 20 0 FHADHM CCC1CCC(N(C)C(=O)N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000736397734 598429988 /nfs/dbraw/zinc/42/99/88/598429988.db2.gz XACPEPRYIJQYBD-TUBUQKNSSA-N -1 3 356.474 3.538 20 0 FHADHM CCC1CCC(N(C)C(=O)N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000736397734 598429990 /nfs/dbraw/zinc/42/99/90/598429990.db2.gz XACPEPRYIJQYBD-TUBUQKNSSA-N -1 3 356.474 3.538 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)[C@H]1C[C@H]1c1cccc2ccccc21 ZINC000107542727 598434941 /nfs/dbraw/zinc/43/49/41/598434941.db2.gz FKHVVGCUUVTSIL-OALUTQOASA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)[C@H]1C[C@H]1c1cccc2ccccc21 ZINC000107542727 598434943 /nfs/dbraw/zinc/43/49/43/598434943.db2.gz FKHVVGCUUVTSIL-OALUTQOASA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1ccccc1-c1nnn[n-]1)[C@@H]1C[C@H]1c1cccc2ccccc21 ZINC000738190198 598436062 /nfs/dbraw/zinc/43/60/62/598436062.db2.gz AZXJMYCHUKPJFQ-ZWKOTPCHSA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1ccccc1-c1nn[n-]n1)[C@@H]1C[C@H]1c1cccc2ccccc21 ZINC000738190198 598436063 /nfs/dbraw/zinc/43/60/63/598436063.db2.gz AZXJMYCHUKPJFQ-ZWKOTPCHSA-N -1 3 355.401 3.762 20 0 FHADHM C[C@H](NC(=O)C[C@@H]1C[C@@H](C)CC(C)(C)C1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736229480 598442155 /nfs/dbraw/zinc/44/21/55/598442155.db2.gz QZDUASJHZMOFHW-ILXRZTDVSA-N -1 3 355.486 3.896 20 0 FHADHM C[C@H](NC(=O)C[C@@H]1C[C@@H](C)CC(C)(C)C1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736229480 598442156 /nfs/dbraw/zinc/44/21/56/598442156.db2.gz QZDUASJHZMOFHW-ILXRZTDVSA-N -1 3 355.486 3.896 20 0 FHADHM CC(C)(NC(=O)CCc1ccc(-c2nnn[n-]2)cc1)c1ccc(Cl)cc1 ZINC000735671902 598450179 /nfs/dbraw/zinc/45/01/79/598450179.db2.gz SBQXBIWFDRCRFJ-UHFFFAOYSA-N -1 3 369.856 3.504 20 0 FHADHM CC(C)(NC(=O)CCc1ccc(-c2nn[n-]n2)cc1)c1ccc(Cl)cc1 ZINC000735671902 598450181 /nfs/dbraw/zinc/45/01/81/598450181.db2.gz SBQXBIWFDRCRFJ-UHFFFAOYSA-N -1 3 369.856 3.504 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H](C)c2ccc(OC)cc2)c1-c1nnn[n-]1 ZINC000736669322 598452354 /nfs/dbraw/zinc/45/23/54/598452354.db2.gz DKVQCXOAZLOCAX-SNVBAGLBSA-N -1 3 371.466 3.550 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H](C)c2ccc(OC)cc2)c1-c1nn[n-]n1 ZINC000736669322 598452356 /nfs/dbraw/zinc/45/23/56/598452356.db2.gz DKVQCXOAZLOCAX-SNVBAGLBSA-N -1 3 371.466 3.550 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)N1CCC[C@H](c2ccccc2)CC1 ZINC000737801741 598456400 /nfs/dbraw/zinc/45/64/00/598456400.db2.gz TXWZXARNRMKWPQ-SQVRQVGWSA-N -1 3 373.460 3.676 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)N1CCC[C@H](c2ccccc2)CC1 ZINC000737801741 598456402 /nfs/dbraw/zinc/45/64/02/598456402.db2.gz TXWZXARNRMKWPQ-SQVRQVGWSA-N -1 3 373.460 3.676 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1COc1ccccc1OCC(F)(F)F ZINC000737641152 598459277 /nfs/dbraw/zinc/45/92/77/598459277.db2.gz TUUGAWQMRZIZIM-UHFFFAOYSA-N -1 3 368.290 3.526 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1COc1ccccc1OCC(F)(F)F ZINC000737641152 598459278 /nfs/dbraw/zinc/45/92/78/598459278.db2.gz TUUGAWQMRZIZIM-UHFFFAOYSA-N -1 3 368.290 3.526 20 0 FHADHM CC(C)c1ccc(COC(=O)c2ccc(-c3nnn[n-]3)cn2)c(C(C)C)c1 ZINC000735929444 598479027 /nfs/dbraw/zinc/47/90/27/598479027.db2.gz ZGLKDUQEJADGMD-UHFFFAOYSA-N -1 3 365.437 3.866 20 0 FHADHM CC(C)c1ccc(COC(=O)c2ccc(-c3nn[n-]n3)cn2)c(C(C)C)c1 ZINC000735929444 598479030 /nfs/dbraw/zinc/47/90/30/598479030.db2.gz ZGLKDUQEJADGMD-UHFFFAOYSA-N -1 3 365.437 3.866 20 0 FHADHM CC(C)Oc1ccccc1CC(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000735914440 598482356 /nfs/dbraw/zinc/48/23/56/598482356.db2.gz SSGDUYIYCLPJEY-CQSZACIVSA-N -1 3 366.421 3.501 20 0 FHADHM CC(C)Oc1ccccc1CC(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000735914440 598482358 /nfs/dbraw/zinc/48/23/58/598482358.db2.gz SSGDUYIYCLPJEY-CQSZACIVSA-N -1 3 366.421 3.501 20 0 FHADHM CC[C@](C)(NC(=O)Nc1cc(-c2nnn[n-]2)ccc1C)c1ccccc1 ZINC000736316365 598483779 /nfs/dbraw/zinc/48/37/79/598483779.db2.gz WLKXZYRJFOIISL-IBGZPJMESA-N -1 3 350.426 3.622 20 0 FHADHM CC[C@](C)(NC(=O)Nc1cc(-c2nn[n-]n2)ccc1C)c1ccccc1 ZINC000736316365 598483781 /nfs/dbraw/zinc/48/37/81/598483781.db2.gz WLKXZYRJFOIISL-IBGZPJMESA-N -1 3 350.426 3.622 20 0 FHADHM C[C@H](OC(=O)CCOc1ccccc1Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000736153726 598485702 /nfs/dbraw/zinc/48/57/02/598485702.db2.gz ZADIPLVIYTWJOK-LBPRGKRZSA-N -1 3 372.812 3.593 20 0 FHADHM C[C@H](OC(=O)CCOc1ccccc1Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000736153726 598485703 /nfs/dbraw/zinc/48/57/03/598485703.db2.gz ZADIPLVIYTWJOK-LBPRGKRZSA-N -1 3 372.812 3.593 20 0 FHADHM Cc1cccc(OCCC(=O)O[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1C ZINC000737401260 598486926 /nfs/dbraw/zinc/48/69/26/598486926.db2.gz MEDVZRNHQPNSLH-HNNXBMFYSA-N -1 3 366.421 3.557 20 0 FHADHM Cc1cccc(OCCC(=O)O[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1C ZINC000737401260 598486927 /nfs/dbraw/zinc/48/69/27/598486927.db2.gz MEDVZRNHQPNSLH-HNNXBMFYSA-N -1 3 366.421 3.557 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)C=Cc1ccccc1Cl ZINC000735655455 598487567 /nfs/dbraw/zinc/48/75/67/598487567.db2.gz POSDIYAEQIEVDZ-CMDGGOBGSA-N -1 3 370.844 3.729 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)C=Cc1ccccc1Cl ZINC000735655455 598487569 /nfs/dbraw/zinc/48/75/69/598487569.db2.gz POSDIYAEQIEVDZ-CMDGGOBGSA-N -1 3 370.844 3.729 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)CC(C)(C)c1ccccc1 ZINC000735665107 598488247 /nfs/dbraw/zinc/48/82/47/598488247.db2.gz RUVCIOCBNFMFCP-UHFFFAOYSA-N -1 3 366.469 3.730 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)CC(C)(C)c1ccccc1 ZINC000735665107 598488249 /nfs/dbraw/zinc/48/82/49/598488249.db2.gz RUVCIOCBNFMFCP-UHFFFAOYSA-N -1 3 366.469 3.730 20 0 FHADHM CC(=O)c1ccc(Cl)c(Cl)c1OCc1cccc(-c2nnn[n-]2)c1 ZINC000735495833 598494266 /nfs/dbraw/zinc/49/42/66/598494266.db2.gz PENBHHAXVWOABC-UHFFFAOYSA-N -1 3 363.204 3.955 20 0 FHADHM CC(=O)c1ccc(Cl)c(Cl)c1OCc1cccc(-c2nn[n-]n2)c1 ZINC000735495833 598494268 /nfs/dbraw/zinc/49/42/68/598494268.db2.gz PENBHHAXVWOABC-UHFFFAOYSA-N -1 3 363.204 3.955 20 0 FHADHM O=C(Cc1cccc(Cl)c1)Nc1sc2c(c1-c1nnn[n-]1)CCCC2 ZINC000737968568 598495189 /nfs/dbraw/zinc/49/51/89/598495189.db2.gz JSGXVQUALYHESN-UHFFFAOYSA-N -1 3 373.869 3.642 20 0 FHADHM O=C(Cc1cccc(Cl)c1)Nc1sc2c(c1-c1nn[n-]n1)CCCC2 ZINC000737968568 598495190 /nfs/dbraw/zinc/49/51/90/598495190.db2.gz JSGXVQUALYHESN-UHFFFAOYSA-N -1 3 373.869 3.642 20 0 FHADHM Fc1cccc(Oc2ccccc2CNc2ccc(-c3nnn[n-]3)cn2)c1 ZINC000737666594 598504443 /nfs/dbraw/zinc/50/44/43/598504443.db2.gz ZZOOPJLJYGEKTC-UHFFFAOYSA-N -1 3 362.368 3.805 20 0 FHADHM Fc1cccc(Oc2ccccc2CNc2ccc(-c3nn[n-]n3)cn2)c1 ZINC000737666594 598504444 /nfs/dbraw/zinc/50/44/44/598504444.db2.gz ZZOOPJLJYGEKTC-UHFFFAOYSA-N -1 3 362.368 3.805 20 0 FHADHM COc1ccc([C@H]2CCCN2c2ccc(Cl)cc2-c2nnn[n-]2)cc1 ZINC000737074427 598506687 /nfs/dbraw/zinc/50/66/87/598506687.db2.gz FXWYVCPGIASEQA-MRXNPFEDSA-N -1 3 355.829 3.870 20 0 FHADHM COc1ccc([C@H]2CCCN2c2ccc(Cl)cc2-c2nn[n-]n2)cc1 ZINC000737074427 598506689 /nfs/dbraw/zinc/50/66/89/598506689.db2.gz FXWYVCPGIASEQA-MRXNPFEDSA-N -1 3 355.829 3.870 20 0 FHADHM Clc1cc(-c2nnn[n-]2)ccc1Oc1ccnc(-c2ccccc2)n1 ZINC000737560886 598508466 /nfs/dbraw/zinc/50/84/66/598508466.db2.gz DPXDPNZITUIXSS-UHFFFAOYSA-N -1 3 350.769 3.769 20 0 FHADHM Clc1cc(-c2nn[n-]n2)ccc1Oc1ccnc(-c2ccccc2)n1 ZINC000737560886 598508468 /nfs/dbraw/zinc/50/84/68/598508468.db2.gz DPXDPNZITUIXSS-UHFFFAOYSA-N -1 3 350.769 3.769 20 0 FHADHM CCSc1ccc(C(=O)Nc2sc(C)c(CC)c2-c2nnn[n-]2)cn1 ZINC000736665430 598514184 /nfs/dbraw/zinc/51/41/84/598514184.db2.gz HXUZEBHHBYQXHG-UHFFFAOYSA-N -1 3 374.495 3.558 20 0 FHADHM CCSc1ccc(C(=O)Nc2sc(C)c(CC)c2-c2nn[n-]n2)cn1 ZINC000736665430 598514185 /nfs/dbraw/zinc/51/41/85/598514185.db2.gz HXUZEBHHBYQXHG-UHFFFAOYSA-N -1 3 374.495 3.558 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H]2CCCc3ccccc32)c1-c1nnn[n-]1 ZINC000736669230 598516257 /nfs/dbraw/zinc/51/62/57/598516257.db2.gz ABTBZMRYMBWPKW-OAHLLOKOSA-N -1 3 367.478 3.858 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H]2CCCc3ccccc32)c1-c1nn[n-]n1 ZINC000736669230 598516259 /nfs/dbraw/zinc/51/62/59/598516259.db2.gz ABTBZMRYMBWPKW-OAHLLOKOSA-N -1 3 367.478 3.858 20 0 FHADHM CCc1c(C)sc(NC(=O)CCSc2ccccc2)c1-c1nnn[n-]1 ZINC000736671172 598516799 /nfs/dbraw/zinc/51/67/99/598516799.db2.gz SWIYUPGLRXRECD-UHFFFAOYSA-N -1 3 373.507 3.920 20 0 FHADHM CCc1c(C)sc(NC(=O)CCSc2ccccc2)c1-c1nn[n-]n1 ZINC000736671172 598516800 /nfs/dbraw/zinc/51/68/00/598516800.db2.gz SWIYUPGLRXRECD-UHFFFAOYSA-N -1 3 373.507 3.920 20 0 FHADHM CN(C(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1)c1cccc(-c2nnn[n-]2)c1 ZINC000736733483 598533535 /nfs/dbraw/zinc/53/35/35/598533535.db2.gz VXWDQFUYCTZNNZ-UXHICEINSA-N -1 3 369.428 3.786 20 0 FHADHM CN(C(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1)c1cccc(-c2nn[n-]n2)c1 ZINC000736733483 598533537 /nfs/dbraw/zinc/53/35/37/598533537.db2.gz VXWDQFUYCTZNNZ-UXHICEINSA-N -1 3 369.428 3.786 20 0 FHADHM C[C@H](NC(=O)N(CC1CC1)C1CCCCC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736110623 598533739 /nfs/dbraw/zinc/53/37/39/598533739.db2.gz ILCZULRTSBKLND-AWEZNQCLSA-N -1 3 368.485 3.682 20 0 FHADHM C[C@H](NC(=O)N(CC1CC1)C1CCCCC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736110623 598533740 /nfs/dbraw/zinc/53/37/40/598533740.db2.gz ILCZULRTSBKLND-AWEZNQCLSA-N -1 3 368.485 3.682 20 0 FHADHM O=C(Oc1ccc(-c2nnn[n-]2)cc1)[C@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000738250175 598533833 /nfs/dbraw/zinc/53/38/33/598533833.db2.gz DNJRJQYIDFXUSM-MOPGFXCFSA-N -1 3 356.385 3.729 20 0 FHADHM O=C(Oc1ccc(-c2nn[n-]n2)cc1)[C@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000738250175 598533835 /nfs/dbraw/zinc/53/38/35/598533835.db2.gz DNJRJQYIDFXUSM-MOPGFXCFSA-N -1 3 356.385 3.729 20 0 FHADHM O=C(CCc1ccc(-c2nnn[n-]2)cc1)N(c1ccccc1)C1CCCC1 ZINC000737854337 598535393 /nfs/dbraw/zinc/53/53/93/598535393.db2.gz XSFWBMUVWGJIQW-UHFFFAOYSA-N -1 3 361.449 3.775 20 0 FHADHM O=C(CCc1ccc(-c2nn[n-]n2)cc1)N(c1ccccc1)C1CCCC1 ZINC000737854337 598535394 /nfs/dbraw/zinc/53/53/94/598535394.db2.gz XSFWBMUVWGJIQW-UHFFFAOYSA-N -1 3 361.449 3.775 20 0 FHADHM O=C(OCc1cccc(-c2nnn[n-]2)c1)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000738233164 598544475 /nfs/dbraw/zinc/54/44/75/598544475.db2.gz QNKCXOKOOLAHIC-WOJBJXKFSA-N -1 3 370.412 3.867 20 0 FHADHM O=C(OCc1cccc(-c2nn[n-]n2)c1)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000738233164 598544476 /nfs/dbraw/zinc/54/44/76/598544476.db2.gz QNKCXOKOOLAHIC-WOJBJXKFSA-N -1 3 370.412 3.867 20 0 FHADHM Fc1cc(OCc2cccc(OCC(F)(F)F)c2)ccc1-c1nnn[n-]1 ZINC000737648556 598548077 /nfs/dbraw/zinc/54/80/77/598548077.db2.gz ARRYWMABNYTVIG-UHFFFAOYSA-N -1 3 368.290 3.526 20 0 FHADHM Fc1cc(OCc2cccc(OCC(F)(F)F)c2)ccc1-c1nn[n-]n1 ZINC000737648556 598548079 /nfs/dbraw/zinc/54/80/79/598548079.db2.gz ARRYWMABNYTVIG-UHFFFAOYSA-N -1 3 368.290 3.526 20 0 FHADHM Fc1cc(OCc2csc(Cc3ccccc3)n2)ccc1-c1nnn[n-]1 ZINC000737648600 598549235 /nfs/dbraw/zinc/54/92/35/598549235.db2.gz BASVIBZOLDVXLZ-UHFFFAOYSA-N -1 3 367.409 3.632 20 0 FHADHM Fc1cc(OCc2csc(Cc3ccccc3)n2)ccc1-c1nn[n-]n1 ZINC000737648600 598549236 /nfs/dbraw/zinc/54/92/36/598549236.db2.gz BASVIBZOLDVXLZ-UHFFFAOYSA-N -1 3 367.409 3.632 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@H](C)c1ccccc1F ZINC000735511288 598550980 /nfs/dbraw/zinc/55/09/80/598550980.db2.gz FVNPVVWVYXYGAB-CQSZACIVSA-N -1 3 367.428 3.547 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@H](C)c1ccccc1F ZINC000735511288 598550981 /nfs/dbraw/zinc/55/09/81/598550981.db2.gz FVNPVVWVYXYGAB-CQSZACIVSA-N -1 3 367.428 3.547 20 0 FHADHM CSC[C@@H](C)C(=O)Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000737178944 598553289 /nfs/dbraw/zinc/55/32/89/598553289.db2.gz GHUAWLNZXWJBDK-GFCCVEGCSA-N -1 3 369.450 3.597 20 0 FHADHM CSC[C@@H](C)C(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000737178944 598553290 /nfs/dbraw/zinc/55/32/90/598553290.db2.gz GHUAWLNZXWJBDK-GFCCVEGCSA-N -1 3 369.450 3.597 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N[C@H](C)C(C)(C)c1ccccc1 ZINC000737292624 598559193 /nfs/dbraw/zinc/55/91/93/598559193.db2.gz WRCQEVDGDQKAFY-CQSZACIVSA-N -1 3 364.453 3.663 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N[C@H](C)C(C)(C)c1ccccc1 ZINC000737292624 598559194 /nfs/dbraw/zinc/55/91/94/598559194.db2.gz WRCQEVDGDQKAFY-CQSZACIVSA-N -1 3 364.453 3.663 20 0 FHADHM CC(C)(C)CNC(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000735617826 598564764 /nfs/dbraw/zinc/56/47/64/598564764.db2.gz AUWJBKRYZOHZAS-UHFFFAOYSA-N -1 3 366.425 3.827 20 0 FHADHM CC(C)(C)CNC(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000735617826 598564765 /nfs/dbraw/zinc/56/47/65/598564765.db2.gz AUWJBKRYZOHZAS-UHFFFAOYSA-N -1 3 366.425 3.827 20 0 FHADHM CC(C)CCNC(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000735811386 598564817 /nfs/dbraw/zinc/56/48/17/598564817.db2.gz ITZOJWLJBNAPCE-UHFFFAOYSA-N -1 3 366.425 3.827 20 0 FHADHM CC(C)CCNC(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000735811386 598564818 /nfs/dbraw/zinc/56/48/18/598564818.db2.gz ITZOJWLJBNAPCE-UHFFFAOYSA-N -1 3 366.425 3.827 20 0 FHADHM FC(F)(F)c1ccccc1Cn1ccc(-c2ccc(-c3nnn[n-]3)cc2)n1 ZINC000737636425 598567772 /nfs/dbraw/zinc/56/77/72/598567772.db2.gz ROMPTHAJXOABJM-UHFFFAOYSA-N -1 3 370.338 3.797 20 0 FHADHM FC(F)(F)c1ccccc1Cn1ccc(-c2ccc(-c3nn[n-]n3)cc2)n1 ZINC000737636425 598567773 /nfs/dbraw/zinc/56/77/73/598567773.db2.gz ROMPTHAJXOABJM-UHFFFAOYSA-N -1 3 370.338 3.797 20 0 FHADHM COc1ccc(CCCCCC(=O)Nc2ccccc2-c2nnn[n-]2)cc1 ZINC000737089678 598571693 /nfs/dbraw/zinc/57/16/93/598571693.db2.gz UMSLJJKMDYJNFO-UHFFFAOYSA-N -1 3 365.437 3.617 20 0 FHADHM COc1ccc(CCCCCC(=O)Nc2ccccc2-c2nn[n-]n2)cc1 ZINC000737089678 598571695 /nfs/dbraw/zinc/57/16/95/598571695.db2.gz UMSLJJKMDYJNFO-UHFFFAOYSA-N -1 3 365.437 3.617 20 0 FHADHM C[C@@H](Cc1ccsc1)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000736066523 598575967 /nfs/dbraw/zinc/57/59/67/598575967.db2.gz NWJBGLKAKNMVIO-VIFPVBQESA-N -1 3 353.373 3.990 20 0 FHADHM C[C@@H](Cc1ccsc1)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000736066523 598575969 /nfs/dbraw/zinc/57/59/69/598575969.db2.gz NWJBGLKAKNMVIO-VIFPVBQESA-N -1 3 353.373 3.990 20 0 FHADHM FC(F)(F)c1cc(N2CCCc3sccc3C2)ccc1-c1nnn[n-]1 ZINC000737633719 598580764 /nfs/dbraw/zinc/58/07/64/598580764.db2.gz VIKHGDPNBBWTOQ-UHFFFAOYSA-N -1 3 365.384 3.900 20 0 FHADHM FC(F)(F)c1cc(N2CCCc3sccc3C2)ccc1-c1nn[n-]n1 ZINC000737633719 598580766 /nfs/dbraw/zinc/58/07/66/598580766.db2.gz VIKHGDPNBBWTOQ-UHFFFAOYSA-N -1 3 365.384 3.900 20 0 FHADHM C[C@H](OC(=O)[C@@H]1C[C@H]1c1ccc(F)c(F)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000736149483 598582989 /nfs/dbraw/zinc/58/29/89/598582989.db2.gz GNOLEDMSDQVLIZ-NZVBXONLSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@@H]1C[C@H]1c1ccc(F)c(F)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000736149483 598582990 /nfs/dbraw/zinc/58/29/90/598582990.db2.gz GNOLEDMSDQVLIZ-NZVBXONLSA-N -1 3 370.359 3.553 20 0 FHADHM CC[C@H](OC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1ccc(OC)cc1 ZINC000736379796 598584603 /nfs/dbraw/zinc/58/46/03/598584603.db2.gz DMYQKFKEPSNHNW-GFBZKKKVSA-N -1 3 364.405 3.583 20 0 FHADHM CC[C@H](OC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1ccc(OC)cc1 ZINC000736379796 598584605 /nfs/dbraw/zinc/58/46/05/598584605.db2.gz DMYQKFKEPSNHNW-GFBZKKKVSA-N -1 3 364.405 3.583 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)c1cc(Cl)sc1Cl ZINC000738168220 598589728 /nfs/dbraw/zinc/58/97/28/598589728.db2.gz WFOHSDQRPJOIAL-UHFFFAOYSA-N -1 3 358.185 3.626 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)c1cc(Cl)sc1Cl ZINC000738168220 598589730 /nfs/dbraw/zinc/58/97/30/598589730.db2.gz WFOHSDQRPJOIAL-UHFFFAOYSA-N -1 3 358.185 3.626 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)C1(c2ccccc2F)CCCC1 ZINC000738162214 598592477 /nfs/dbraw/zinc/59/24/77/598592477.db2.gz KLLVPGDPSFRLOO-UHFFFAOYSA-N -1 3 369.375 3.595 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)C1(c2ccccc2F)CCCC1 ZINC000738162214 598592478 /nfs/dbraw/zinc/59/24/78/598592478.db2.gz KLLVPGDPSFRLOO-UHFFFAOYSA-N -1 3 369.375 3.595 20 0 FHADHM CSCc1cccc(NC(=O)N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737187764 598601428 /nfs/dbraw/zinc/60/14/28/598601428.db2.gz UEWWQKCJUUKGMF-LBPRGKRZSA-N -1 3 368.466 3.612 20 0 FHADHM CSCc1cccc(NC(=O)N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737187764 598601430 /nfs/dbraw/zinc/60/14/30/598601430.db2.gz UEWWQKCJUUKGMF-LBPRGKRZSA-N -1 3 368.466 3.612 20 0 FHADHM CC[C@@H](OC(=O)c1ccc(-c2nnn[n-]2)cn1)c1ccc(C(C)(C)C)cc1 ZINC000736382593 598606591 /nfs/dbraw/zinc/60/65/91/598606591.db2.gz MNZSCOIYVHVSAY-QGZVFWFLSA-N -1 3 365.437 3.867 20 0 FHADHM CC[C@@H](OC(=O)c1ccc(-c2nn[n-]n2)cn1)c1ccc(C(C)(C)C)cc1 ZINC000736382593 598606594 /nfs/dbraw/zinc/60/65/94/598606594.db2.gz MNZSCOIYVHVSAY-QGZVFWFLSA-N -1 3 365.437 3.867 20 0 FHADHM C(=Cc1ccccc1-c1nnn[n-]1)c1nc(CCCc2ccccc2)no1 ZINC000735399134 598610657 /nfs/dbraw/zinc/61/06/57/598610657.db2.gz IWYIOCKFRNOYIR-BUHFOSPRSA-N -1 3 358.405 3.595 20 0 FHADHM C(=Cc1ccccc1-c1nn[n-]n1)c1nc(CCCc2ccccc2)no1 ZINC000735399134 598610660 /nfs/dbraw/zinc/61/06/60/598610660.db2.gz IWYIOCKFRNOYIR-BUHFOSPRSA-N -1 3 358.405 3.595 20 0 FHADHM Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)c1 ZINC000737389702 598626136 /nfs/dbraw/zinc/62/61/36/598626136.db2.gz NNCZPDNHEXRLIZ-KRWDZBQOSA-N -1 3 366.400 3.683 20 0 FHADHM Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)c1 ZINC000737389702 598626137 /nfs/dbraw/zinc/62/61/37/598626137.db2.gz NNCZPDNHEXRLIZ-KRWDZBQOSA-N -1 3 366.400 3.683 20 0 FHADHM CC(C)CN(Cc1ccccc1)C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000735830859 598627497 /nfs/dbraw/zinc/62/74/97/598627497.db2.gz KLBGOLMBBAWKOM-UHFFFAOYSA-N -1 3 368.416 3.696 20 0 FHADHM CC(C)CN(Cc1ccccc1)C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000735830859 598627499 /nfs/dbraw/zinc/62/74/99/598627499.db2.gz KLBGOLMBBAWKOM-UHFFFAOYSA-N -1 3 368.416 3.696 20 0 FHADHM C[C@@H](c1cccc(Cl)c1)N(C)C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000736201983 598628732 /nfs/dbraw/zinc/62/87/32/598628732.db2.gz YRUFIJOZRGMVOC-JTQLQIEISA-N -1 3 374.807 3.884 20 0 FHADHM C[C@@H](c1cccc(Cl)c1)N(C)C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000736201983 598628733 /nfs/dbraw/zinc/62/87/33/598628733.db2.gz YRUFIJOZRGMVOC-JTQLQIEISA-N -1 3 374.807 3.884 20 0 FHADHM FC(F)Oc1ccccc1CNc1cc(Cl)ccc1-c1nnn[n-]1 ZINC000737639076 598632444 /nfs/dbraw/zinc/63/24/44/598632444.db2.gz MVFULQGKQZJBQX-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM FC(F)Oc1ccccc1CNc1cc(Cl)ccc1-c1nn[n-]n1 ZINC000737639076 598632446 /nfs/dbraw/zinc/63/24/46/598632446.db2.gz MVFULQGKQZJBQX-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM FC(F)Oc1ccc(CCNc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1 ZINC000737639756 598637859 /nfs/dbraw/zinc/63/78/59/598637859.db2.gz WLDQKYXYCWTKHE-UHFFFAOYSA-N -1 3 365.771 3.776 20 0 FHADHM FC(F)Oc1ccc(CCNc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1 ZINC000737639756 598637860 /nfs/dbraw/zinc/63/78/60/598637860.db2.gz WLDQKYXYCWTKHE-UHFFFAOYSA-N -1 3 365.771 3.776 20 0 FHADHM CCC(=O)c1cc(Cl)ccc1OCc1ccc(F)cc1-c1nnn[n-]1 ZINC000736308223 598642546 /nfs/dbraw/zinc/64/25/46/598642546.db2.gz BBRPKGISVWTZDL-UHFFFAOYSA-N -1 3 360.776 3.831 20 0 FHADHM CCC(=O)c1cc(Cl)ccc1OCc1ccc(F)cc1-c1nn[n-]n1 ZINC000736308223 598642548 /nfs/dbraw/zinc/64/25/48/598642548.db2.gz BBRPKGISVWTZDL-UHFFFAOYSA-N -1 3 360.776 3.831 20 0 FHADHM C[C@@H](SCCCc1ccccc1)C(=O)Nc1ccccc1-c1nnn[n-]1 ZINC000736187494 598643319 /nfs/dbraw/zinc/64/33/19/598643319.db2.gz BGDQBYSHJIGGMX-CQSZACIVSA-N -1 3 367.478 3.560 20 0 FHADHM C[C@@H](SCCCc1ccccc1)C(=O)Nc1ccccc1-c1nn[n-]n1 ZINC000736187494 598643321 /nfs/dbraw/zinc/64/33/21/598643321.db2.gz BGDQBYSHJIGGMX-CQSZACIVSA-N -1 3 367.478 3.560 20 0 FHADHM Cc1ccc(F)cc1NC(=O)CCCCOc1cccc(-c2nnn[n-]2)c1 ZINC000737346105 598644960 /nfs/dbraw/zinc/64/49/60/598644960.db2.gz DOIVYOYACADRJN-UHFFFAOYSA-N -1 3 369.400 3.502 20 0 FHADHM Cc1ccc(F)cc1NC(=O)CCCCOc1cccc(-c2nn[n-]n2)c1 ZINC000737346105 598644962 /nfs/dbraw/zinc/64/49/62/598644962.db2.gz DOIVYOYACADRJN-UHFFFAOYSA-N -1 3 369.400 3.502 20 0 FHADHM CCCc1ccc(NC(=O)CSc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000736496605 598648284 /nfs/dbraw/zinc/64/82/84/598648284.db2.gz HRIOVZVPNGOYJN-UHFFFAOYSA-N -1 3 353.451 3.550 20 0 FHADHM CCCc1ccc(NC(=O)CSc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000736496605 598648286 /nfs/dbraw/zinc/64/82/86/598648286.db2.gz HRIOVZVPNGOYJN-UHFFFAOYSA-N -1 3 353.451 3.550 20 0 FHADHM O=C(CCCCOc1cccc(-c2nnn[n-]2)c1)NCCCC1CCCC1 ZINC000737831759 598648691 /nfs/dbraw/zinc/64/86/91/598648691.db2.gz DLAOSJQPJWEXSZ-UHFFFAOYSA-N -1 3 371.485 3.502 20 0 FHADHM O=C(CCCCOc1cccc(-c2nn[n-]n2)c1)NCCCC1CCCC1 ZINC000737831759 598648693 /nfs/dbraw/zinc/64/86/93/598648693.db2.gz DLAOSJQPJWEXSZ-UHFFFAOYSA-N -1 3 371.485 3.502 20 0 FHADHM CC(C)c1ccccc1OC(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000735932404 598648751 /nfs/dbraw/zinc/64/87/51/598648751.db2.gz KHLRZOKYGPSGAT-UHFFFAOYSA-N -1 3 354.435 3.688 20 0 FHADHM CC(C)c1ccccc1OC(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000735932404 598648753 /nfs/dbraw/zinc/64/87/53/598648753.db2.gz KHLRZOKYGPSGAT-UHFFFAOYSA-N -1 3 354.435 3.688 20 0 FHADHM CC(C)[C@H](CC(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000735706996 598651355 /nfs/dbraw/zinc/65/13/55/598651355.db2.gz FKHUAPJOLNOENO-IBGZPJMESA-N -1 3 363.465 3.655 20 0 FHADHM CC(C)[C@H](CC(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000735706996 598651357 /nfs/dbraw/zinc/65/13/57/598651357.db2.gz FKHUAPJOLNOENO-IBGZPJMESA-N -1 3 363.465 3.655 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@H](C)CSc2ccccc2)s1 ZINC000736679000 598654720 /nfs/dbraw/zinc/65/47/20/598654720.db2.gz IKGZNSVONIAXKG-LLVKDONJSA-N -1 3 373.507 3.858 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@H](C)CSc2ccccc2)s1 ZINC000736679000 598654721 /nfs/dbraw/zinc/65/47/21/598654721.db2.gz IKGZNSVONIAXKG-LLVKDONJSA-N -1 3 373.507 3.858 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)C[C@H](C)c2ccccc2OC)s1 ZINC000736679072 598655193 /nfs/dbraw/zinc/65/51/93/598655193.db2.gz JVFMPEIDTIFSSS-NSHDSACASA-N -1 3 371.466 3.632 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)C[C@H](C)c2ccccc2OC)s1 ZINC000736679072 598655195 /nfs/dbraw/zinc/65/51/95/598655195.db2.gz JVFMPEIDTIFSSS-NSHDSACASA-N -1 3 371.466 3.632 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cn1)c1sc2cc(F)ccc2c1Cl ZINC000738149760 598661012 /nfs/dbraw/zinc/66/10/12/598661012.db2.gz GWLAYZCKQHOHJC-UHFFFAOYSA-N -1 3 374.788 3.521 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cn1)c1sc2cc(F)ccc2c1Cl ZINC000738149760 598661011 /nfs/dbraw/zinc/66/10/11/598661011.db2.gz GWLAYZCKQHOHJC-UHFFFAOYSA-N -1 3 374.788 3.521 20 0 FHADHM Clc1cc(NCc2cccc(Br)c2)ccc1-c1nnn[n-]1 ZINC000737567093 598667030 /nfs/dbraw/zinc/66/70/30/598667030.db2.gz XKHYRFRDBLMLPX-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM Clc1cc(NCc2cccc(Br)c2)ccc1-c1nn[n-]n1 ZINC000737567093 598667032 /nfs/dbraw/zinc/66/70/32/598667032.db2.gz XKHYRFRDBLMLPX-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM COc1ccc(CNc2ccc(-c3nn[n-]n3)cc2)cc1OC1CCCC1 ZINC000737095674 598674765 /nfs/dbraw/zinc/67/47/65/598674765.db2.gz MXHGGPOSXMLSAD-UHFFFAOYSA-N -1 3 365.437 3.809 20 0 FHADHM Fc1ccc(CN(Cc2ccco2)Cc2cccs2)c(-c2nnn[n-]2)c1 ZINC000737650490 598678948 /nfs/dbraw/zinc/67/89/48/598678948.db2.gz PECATIUWNJDNOF-UHFFFAOYSA-N -1 3 369.425 3.863 20 0 FHADHM Fc1ccc(CN(Cc2ccco2)Cc2cccs2)c(-c2nn[n-]n2)c1 ZINC000737650490 598678949 /nfs/dbraw/zinc/67/89/49/598678949.db2.gz PECATIUWNJDNOF-UHFFFAOYSA-N -1 3 369.425 3.863 20 0 FHADHM CC(C)[C@H](CC(=O)OCc1ccc(-c2nnn[n-]2)cc1F)c1ccccc1 ZINC000735711982 598712346 /nfs/dbraw/zinc/71/23/46/598712346.db2.gz ZOWVQDFJOSZYDM-KRWDZBQOSA-N -1 3 368.412 3.879 20 0 FHADHM CC(C)[C@H](CC(=O)OCc1ccc(-c2nn[n-]n2)cc1F)c1ccccc1 ZINC000735711982 598712349 /nfs/dbraw/zinc/71/23/49/598712349.db2.gz ZOWVQDFJOSZYDM-KRWDZBQOSA-N -1 3 368.412 3.879 20 0 FHADHM Cc1ccccc1OCCCn1ccc(-c2ccc(-c3nnn[n-]3)cc2)n1 ZINC000737430974 598723240 /nfs/dbraw/zinc/72/32/40/598723240.db2.gz BKOIBHSLWFJRJO-UHFFFAOYSA-N -1 3 360.421 3.508 20 0 FHADHM Cc1ccccc1OCCCn1ccc(-c2ccc(-c3nn[n-]n3)cc2)n1 ZINC000737430974 598723241 /nfs/dbraw/zinc/72/32/41/598723241.db2.gz BKOIBHSLWFJRJO-UHFFFAOYSA-N -1 3 360.421 3.508 20 0 FHADHM CCC(=CC(=O)Nc1sc(CC)cc1-c1nnn[n-]1)c1ccccc1 ZINC000736301770 598735752 /nfs/dbraw/zinc/73/57/52/598735752.db2.gz ATSDECYXCOUHMV-BENRWUELSA-N -1 3 353.451 3.923 20 0 FHADHM CCC(=CC(=O)Nc1sc(CC)cc1-c1nn[n-]n1)c1ccccc1 ZINC000736301770 598735753 /nfs/dbraw/zinc/73/57/53/598735753.db2.gz ATSDECYXCOUHMV-BENRWUELSA-N -1 3 353.451 3.923 20 0 FHADHM Clc1cc(NCc2ccccc2N2CCCC2)ccc1-c1nnn[n-]1 ZINC000737562918 598744973 /nfs/dbraw/zinc/74/49/73/598744973.db2.gz AIYMZAXWXUTSJD-UHFFFAOYSA-N -1 3 354.845 3.732 20 0 FHADHM Clc1cc(NCc2ccccc2N2CCCC2)ccc1-c1nn[n-]n1 ZINC000737562918 598744975 /nfs/dbraw/zinc/74/49/75/598744975.db2.gz AIYMZAXWXUTSJD-UHFFFAOYSA-N -1 3 354.845 3.732 20 0 FHADHM CC(NC(=O)c1cccc(-c2nnn[n-]2)c1)(c1ccccc1)c1ccccc1 ZINC000736122649 598748479 /nfs/dbraw/zinc/74/84/79/598748479.db2.gz LHUQEMCEAKJQBM-UHFFFAOYSA-N -1 3 369.428 3.560 20 0 FHADHM CC(NC(=O)c1cccc(-c2nn[n-]n2)c1)(c1ccccc1)c1ccccc1 ZINC000736122649 598748481 /nfs/dbraw/zinc/74/84/81/598748481.db2.gz LHUQEMCEAKJQBM-UHFFFAOYSA-N -1 3 369.428 3.560 20 0 FHADHM Cc1ccccc1[C@@H](NC(=O)C=Cc1ccccc1-c1nnn[n-]1)C(C)C ZINC000737419170 598754934 /nfs/dbraw/zinc/75/49/34/598754934.db2.gz DDWFTCGCLBCFBV-SJFMBGHLSA-N -1 3 361.449 3.702 20 0 FHADHM Cc1ccccc1[C@@H](NC(=O)C=Cc1ccccc1-c1nn[n-]n1)C(C)C ZINC000737419170 598754936 /nfs/dbraw/zinc/75/49/36/598754936.db2.gz DDWFTCGCLBCFBV-SJFMBGHLSA-N -1 3 361.449 3.702 20 0 FHADHM Cc1ccc(CN(C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)C(C)C)s1 ZINC000737337426 598782489 /nfs/dbraw/zinc/78/24/89/598782489.db2.gz MPWNVYJVOKFIMA-UHFFFAOYSA-N -1 3 374.445 3.818 20 0 FHADHM Cc1ccc(CN(C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)C(C)C)s1 ZINC000737337426 598782490 /nfs/dbraw/zinc/78/24/90/598782490.db2.gz MPWNVYJVOKFIMA-UHFFFAOYSA-N -1 3 374.445 3.818 20 0 FHADHM Cc1cccc2[nH]cc(CC(=O)O[C@@H](C)c3cccc(-c4nnn[n-]4)c3)c21 ZINC000737409722 598786598 /nfs/dbraw/zinc/78/65/98/598786598.db2.gz ROOPDWISBYATIM-ZDUSSCGKSA-N -1 3 361.405 3.503 20 0 FHADHM Cc1cccc2[nH]cc(CC(=O)O[C@@H](C)c3cccc(-c4nn[n-]n4)c3)c21 ZINC000737409722 598786600 /nfs/dbraw/zinc/78/66/00/598786600.db2.gz ROOPDWISBYATIM-ZDUSSCGKSA-N -1 3 361.405 3.503 20 0 FHADHM Clc1ccc(NCc2ccnc(OC3CCCC3)c2)c(-c2nnn[n-]2)c1 ZINC000737575438 598793768 /nfs/dbraw/zinc/79/37/68/598793768.db2.gz UVNALPSGINCTEO-UHFFFAOYSA-N -1 3 370.844 3.849 20 0 FHADHM Clc1ccc(NCc2ccnc(OC3CCCC3)c2)c(-c2nn[n-]n2)c1 ZINC000737575438 598793770 /nfs/dbraw/zinc/79/37/70/598793770.db2.gz UVNALPSGINCTEO-UHFFFAOYSA-N -1 3 370.844 3.849 20 0 FHADHM Clc1ccc(NCCc2ccc3ccccc3n2)c(-c2nnn[n-]2)c1 ZINC000737574654 598794823 /nfs/dbraw/zinc/79/48/23/598794823.db2.gz NNXLYJFNYHINTG-UHFFFAOYSA-N -1 3 350.813 3.723 20 0 FHADHM Clc1ccc(NCCc2ccc3ccccc3n2)c(-c2nn[n-]n2)c1 ZINC000737574654 598794824 /nfs/dbraw/zinc/79/48/24/598794824.db2.gz NNXLYJFNYHINTG-UHFFFAOYSA-N -1 3 350.813 3.723 20 0 FHADHM Fc1ccc([C@@H]2CCCN2Cc2cc(-c3nn[n-]n3)ccc2F)cc1F ZINC000737652614 598797580 /nfs/dbraw/zinc/79/75/80/598797580.db2.gz VPVHBCHIGPKGLO-KRWDZBQOSA-N -1 3 359.355 3.621 20 0 FHADHM CC[C@H](OC1CCCC1)C(=O)N(CC(C)C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736379664 598804343 /nfs/dbraw/zinc/80/43/43/598804343.db2.gz VIMJXEZHBNPRTR-SFHVURJKSA-N -1 3 371.485 3.594 20 0 FHADHM CC[C@H](OC1CCCC1)C(=O)N(CC(C)C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736379664 598804344 /nfs/dbraw/zinc/80/43/44/598804344.db2.gz VIMJXEZHBNPRTR-SFHVURJKSA-N -1 3 371.485 3.594 20 0 FHADHM CCC[C@H](CC1CCCC1)C(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1 ZINC000736421528 598821337 /nfs/dbraw/zinc/82/13/37/598821337.db2.gz BPLYELFDCPMXOT-GOSISDBHSA-N -1 3 355.486 3.822 20 0 FHADHM CCC[C@H](CC1CCCC1)C(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1 ZINC000736421528 598821339 /nfs/dbraw/zinc/82/13/39/598821339.db2.gz BPLYELFDCPMXOT-GOSISDBHSA-N -1 3 355.486 3.822 20 0 FHADHM CC(C)CN(C(=O)c1coc2ccccc12)c1ccc(-c2nnn[n-]2)cc1 ZINC000735827166 598822251 /nfs/dbraw/zinc/82/22/51/598822251.db2.gz HRHDUYCNFHPLNS-UHFFFAOYSA-N -1 3 361.405 3.916 20 0 FHADHM CC(C)CN(C(=O)c1coc2ccccc12)c1ccc(-c2nn[n-]n2)cc1 ZINC000735827166 598822252 /nfs/dbraw/zinc/82/22/52/598822252.db2.gz HRHDUYCNFHPLNS-UHFFFAOYSA-N -1 3 361.405 3.916 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)NC1CCCCCC1 ZINC000823302898 599292931 /nfs/dbraw/zinc/29/29/31/599292931.db2.gz AAWXFKCSGLCLLZ-UHFFFAOYSA-N -1 3 368.363 3.730 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)NC1CCCCCC1 ZINC000823302898 599292933 /nfs/dbraw/zinc/29/29/33/599292933.db2.gz AAWXFKCSGLCLLZ-UHFFFAOYSA-N -1 3 368.363 3.730 20 0 FHADHM COc1ccc(OC(C)C)c(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737109451 599326649 /nfs/dbraw/zinc/32/66/49/599326649.db2.gz RCVGDWRQPNCOMD-CYBMUJFWSA-N -1 3 353.426 3.836 20 0 FHADHM COc1ccc(OC(C)C)c(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737109451 599326651 /nfs/dbraw/zinc/32/66/51/599326651.db2.gz RCVGDWRQPNCOMD-CYBMUJFWSA-N -1 3 353.426 3.836 20 0 FHADHM C[C@H](SCCC(=O)Nc1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736188513 599327850 /nfs/dbraw/zinc/32/78/50/599327850.db2.gz KNKITXVMIAQNJT-ZDUSSCGKSA-N -1 3 353.451 3.690 20 0 FHADHM C[C@H](SCCC(=O)Nc1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736188513 599327853 /nfs/dbraw/zinc/32/78/53/599327853.db2.gz KNKITXVMIAQNJT-ZDUSSCGKSA-N -1 3 353.451 3.690 20 0 FHADHM CCCCC[C@H](C)NC(=O)CS[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736440519 599328578 /nfs/dbraw/zinc/32/85/78/599328578.db2.gz CQBZUUXHOVJTBO-UONOGXRCSA-N -1 3 361.515 3.746 20 0 FHADHM CCCCC[C@H](C)NC(=O)CS[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736440519 599328581 /nfs/dbraw/zinc/32/85/81/599328581.db2.gz CQBZUUXHOVJTBO-UONOGXRCSA-N -1 3 361.515 3.746 20 0 FHADHM C[C@@H](S[C@H](C)c1ccc(-c2nnn[n-]2)cc1)C(=O)N(C)C1CCCCC1 ZINC000736188267 599332621 /nfs/dbraw/zinc/33/26/21/599332621.db2.gz JZQYDRSSVWUEJT-ZIAGYGMSSA-N -1 3 373.526 3.841 20 0 FHADHM C[C@@H](S[C@H](C)c1ccc(-c2nn[n-]n2)cc1)C(=O)N(C)C1CCCCC1 ZINC000736188267 599332623 /nfs/dbraw/zinc/33/26/23/599332623.db2.gz JZQYDRSSVWUEJT-ZIAGYGMSSA-N -1 3 373.526 3.841 20 0 FHADHM C[C@@H](SCC(=O)Nc1ccccc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000736189330 599332819 /nfs/dbraw/zinc/33/28/19/599332819.db2.gz PAEKJBCXUKWSGL-LLVKDONJSA-N -1 3 373.869 3.953 20 0 FHADHM C[C@@H](SCC(=O)Nc1ccccc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000736189330 599332822 /nfs/dbraw/zinc/33/28/22/599332822.db2.gz PAEKJBCXUKWSGL-LLVKDONJSA-N -1 3 373.869 3.953 20 0 FHADHM C[C@@H](S[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)C(=O)N(C)C1CCCCC1 ZINC000736188265 599333026 /nfs/dbraw/zinc/33/30/26/599333026.db2.gz JZQYDRSSVWUEJT-UONOGXRCSA-N -1 3 373.526 3.841 20 0 FHADHM C[C@@H](S[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)C(=O)N(C)C1CCCCC1 ZINC000736188265 599333029 /nfs/dbraw/zinc/33/30/29/599333029.db2.gz JZQYDRSSVWUEJT-UONOGXRCSA-N -1 3 373.526 3.841 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1CNc1ccc(Br)c(C)c1 ZINC000821737376 607370172 /nfs/dbraw/zinc/37/01/72/607370172.db2.gz WCKHKXPWVACUTM-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CNc1ccc(Br)c(C)c1 ZINC000821737376 607370174 /nfs/dbraw/zinc/37/01/74/607370174.db2.gz WCKHKXPWVACUTM-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM Fc1cccc(-c2nc(CSc3ccccc3-c3nnn[n-]3)co2)c1 ZINC000822786241 599345230 /nfs/dbraw/zinc/34/52/30/599345230.db2.gz FXVXSGUCWCRCFC-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM Fc1cccc(-c2nc(CSc3ccccc3-c3nn[n-]n3)co2)c1 ZINC000822786241 599345233 /nfs/dbraw/zinc/34/52/33/599345233.db2.gz FXVXSGUCWCRCFC-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM Cc1ccccc1[C@@H](C)NC(=O)[C@H](C)Sc1ccccc1-c1nnn[n-]1 ZINC000822345928 599348086 /nfs/dbraw/zinc/34/80/86/599348086.db2.gz WWDJMTVQYHBCEV-KGLIPLIRSA-N -1 3 367.478 3.533 20 0 FHADHM Cc1ccccc1[C@@H](C)NC(=O)[C@H](C)Sc1ccccc1-c1nn[n-]n1 ZINC000822345928 599348088 /nfs/dbraw/zinc/34/80/88/599348088.db2.gz WWDJMTVQYHBCEV-KGLIPLIRSA-N -1 3 367.478 3.533 20 0 FHADHM CCN(C(=O)Nc1ccc(F)c(F)c1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736505711 599351784 /nfs/dbraw/zinc/35/17/84/599351784.db2.gz KXZWQCKDTISIBO-LLVKDONJSA-N -1 3 372.379 3.760 20 0 FHADHM CCN(C(=O)Nc1ccc(F)c(F)c1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736505711 599351785 /nfs/dbraw/zinc/35/17/85/599351785.db2.gz KXZWQCKDTISIBO-LLVKDONJSA-N -1 3 372.379 3.760 20 0 FHADHM C[C@H](Nc1c(F)cc(-c2nnn[n-]2)cc1F)c1ccc(-n2cccn2)cc1 ZINC000820449736 599357326 /nfs/dbraw/zinc/35/73/26/599357326.db2.gz BJSHCUUELCLQOT-NSHDSACASA-N -1 3 367.363 3.504 20 0 FHADHM C[C@H](Nc1c(F)cc(-c2nn[n-]n2)cc1F)c1ccc(-n2cccn2)cc1 ZINC000820449736 599357328 /nfs/dbraw/zinc/35/73/28/599357328.db2.gz BJSHCUUELCLQOT-NSHDSACASA-N -1 3 367.363 3.504 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1CNc1cccc(OCC(C)C)c1 ZINC000821736738 607371165 /nfs/dbraw/zinc/37/11/65/607371165.db2.gz NIRIFBFCWFFGCR-UHFFFAOYSA-N -1 3 353.426 3.522 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CNc1cccc(OCC(C)C)c1 ZINC000821736738 607371167 /nfs/dbraw/zinc/37/11/67/607371167.db2.gz NIRIFBFCWFFGCR-UHFFFAOYSA-N -1 3 353.426 3.522 20 0 FHADHM CC(C)(C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1cccc(F)c1 ZINC000735581456 599368698 /nfs/dbraw/zinc/36/86/98/599368698.db2.gz UHAHTNKCWPRGPZ-UHFFFAOYSA-N -1 3 359.792 3.576 20 0 FHADHM CC(C)(C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1cccc(F)c1 ZINC000735581456 599368700 /nfs/dbraw/zinc/36/87/00/599368700.db2.gz UHAHTNKCWPRGPZ-UHFFFAOYSA-N -1 3 359.792 3.576 20 0 FHADHM C[C@H](Nc1ccc(N2CCCC2)c(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820454992 599369095 /nfs/dbraw/zinc/36/90/95/599369095.db2.gz AODFLCPZNPHWDN-ZDUSSCGKSA-N -1 3 352.417 3.779 20 0 FHADHM C[C@H](Nc1ccc(N2CCCC2)c(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820454992 599369097 /nfs/dbraw/zinc/36/90/97/599369097.db2.gz AODFLCPZNPHWDN-ZDUSSCGKSA-N -1 3 352.417 3.779 20 0 FHADHM Cc1ccc(Oc2ccc(N[C@H](C)c3ccc(-c4nnn[n-]4)cc3)cc2)nn1 ZINC000822267314 599381163 /nfs/dbraw/zinc/38/11/63/599381163.db2.gz SBNZLOPZICNOMT-CQSZACIVSA-N -1 3 373.420 3.931 20 0 FHADHM Cc1ccc(Oc2ccc(N[C@H](C)c3ccc(-c4nn[n-]n4)cc3)cc2)nn1 ZINC000822267314 599381165 /nfs/dbraw/zinc/38/11/65/599381165.db2.gz SBNZLOPZICNOMT-CQSZACIVSA-N -1 3 373.420 3.931 20 0 FHADHM CC(C)(C)OC(=O)Nc1ccc(OCc2ccccc2-c2nnn[n-]2)cc1 ZINC000819946508 599385589 /nfs/dbraw/zinc/38/55/89/599385589.db2.gz MQFHMODCXQKJHM-UHFFFAOYSA-N -1 3 367.409 3.793 20 0 FHADHM CC(C)(C)OC(=O)Nc1ccc(OCc2ccccc2-c2nn[n-]n2)cc1 ZINC000819946508 599385591 /nfs/dbraw/zinc/38/55/91/599385591.db2.gz MQFHMODCXQKJHM-UHFFFAOYSA-N -1 3 367.409 3.793 20 0 FHADHM COc1ccc(OCc2ccc(-c3nnn[n-]3)cc2F)c2ccccc12 ZINC000821845515 599388954 /nfs/dbraw/zinc/38/89/54/599388954.db2.gz HIUNCYOGOMZRMH-UHFFFAOYSA-N -1 3 350.353 3.747 20 0 FHADHM COc1ccc(OCc2ccc(-c3nn[n-]n3)cc2F)c2ccccc12 ZINC000821845515 599388957 /nfs/dbraw/zinc/38/89/57/599388957.db2.gz HIUNCYOGOMZRMH-UHFFFAOYSA-N -1 3 350.353 3.747 20 0 FHADHM COc1ccc(C)cc1[C@@H](C)Nc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000737073541 599397947 /nfs/dbraw/zinc/39/79/47/599397947.db2.gz DJFLPBIARPETLN-CYBMUJFWSA-N -1 3 360.421 3.905 20 0 FHADHM COc1ccc(C)cc1[C@@H](C)Nc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000737073541 599397953 /nfs/dbraw/zinc/39/79/53/599397953.db2.gz DJFLPBIARPETLN-CYBMUJFWSA-N -1 3 360.421 3.905 20 0 FHADHM Oc1ccc(C2=CCN(c3cc(Cl)ccc3-c3nnn[n-]3)CC2)cc1 ZINC000738398015 599400689 /nfs/dbraw/zinc/40/06/89/599400689.db2.gz SAEIONRHKUVXRH-UHFFFAOYSA-N -1 3 353.813 3.519 20 0 FHADHM Oc1ccc(C2=CCN(c3cc(Cl)ccc3-c3nn[n-]n3)CC2)cc1 ZINC000738398015 599400692 /nfs/dbraw/zinc/40/06/92/599400692.db2.gz SAEIONRHKUVXRH-UHFFFAOYSA-N -1 3 353.813 3.519 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(NCCc2cccc3cccnc32)c1 ZINC000737571284 599402961 /nfs/dbraw/zinc/40/29/61/599402961.db2.gz ZOFNNQBBEXRBFB-UHFFFAOYSA-N -1 3 350.813 3.723 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(NCCc2cccc3cccnc32)c1 ZINC000737571284 599402963 /nfs/dbraw/zinc/40/29/63/599402963.db2.gz ZOFNNQBBEXRBFB-UHFFFAOYSA-N -1 3 350.813 3.723 20 0 FHADHM CCC[C@@H](NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000821021918 599404438 /nfs/dbraw/zinc/40/44/38/599404438.db2.gz PVGLEUTTYJRMJD-RDTXWAMCSA-N -1 3 364.453 3.768 20 0 FHADHM CCC[C@@H](NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000821021918 599404441 /nfs/dbraw/zinc/40/44/41/599404441.db2.gz PVGLEUTTYJRMJD-RDTXWAMCSA-N -1 3 364.453 3.768 20 0 FHADHM Cc1cc([C@H](C)NC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c(C)s1 ZINC000822191342 599407342 /nfs/dbraw/zinc/40/73/42/599407342.db2.gz IUPUYKTUNVJJLL-NEPJUHHUSA-N -1 3 370.482 3.666 20 0 FHADHM Cc1cc([C@H](C)NC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c(C)s1 ZINC000822191342 599407345 /nfs/dbraw/zinc/40/73/45/599407345.db2.gz IUPUYKTUNVJJLL-NEPJUHHUSA-N -1 3 370.482 3.666 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(NCCCCOCCc2ccccc2)c1 ZINC000737570953 599414691 /nfs/dbraw/zinc/41/46/91/599414691.db2.gz MXJHUHIFARGBHU-UHFFFAOYSA-N -1 3 371.872 3.972 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(NCCCCOCCc2ccccc2)c1 ZINC000737570953 599414694 /nfs/dbraw/zinc/41/46/94/599414694.db2.gz MXJHUHIFARGBHU-UHFFFAOYSA-N -1 3 371.872 3.972 20 0 FHADHM O=C(NCc1cccc(-c2nnn[n-]2)c1)N1CCCC2(C1)CCCCCC2 ZINC000823257680 599416613 /nfs/dbraw/zinc/41/66/13/599416613.db2.gz SCDKRUKDTSJMKY-UHFFFAOYSA-N -1 3 368.485 3.513 20 0 FHADHM O=C(NCc1cccc(-c2nn[n-]n2)c1)N1CCCC2(C1)CCCCCC2 ZINC000823257680 599416614 /nfs/dbraw/zinc/41/66/14/599416614.db2.gz SCDKRUKDTSJMKY-UHFFFAOYSA-N -1 3 368.485 3.513 20 0 FHADHM COc1ccc2c(c1)CCC[C@@H]2Nc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000737114253 599419884 /nfs/dbraw/zinc/41/98/84/599419884.db2.gz IYWSPGCDVYENLY-SFHVURJKSA-N -1 3 372.432 3.913 20 0 FHADHM COc1ccc2c(c1)CCC[C@@H]2Nc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000737114253 599419885 /nfs/dbraw/zinc/41/98/85/599419885.db2.gz IYWSPGCDVYENLY-SFHVURJKSA-N -1 3 372.432 3.913 20 0 FHADHM CC(C)c1ccc(CNC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000820191929 599421254 /nfs/dbraw/zinc/42/12/54/599421254.db2.gz AXNLXGYFRBRKIU-AWEZNQCLSA-N -1 3 364.453 3.551 20 0 FHADHM CC(C)c1ccc(CNC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000820191929 599421256 /nfs/dbraw/zinc/42/12/56/599421256.db2.gz AXNLXGYFRBRKIU-AWEZNQCLSA-N -1 3 364.453 3.551 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1C ZINC000822228899 599426313 /nfs/dbraw/zinc/42/63/13/599426313.db2.gz ILBSAERXMHVNGB-CABCVRRESA-N -1 3 364.453 3.605 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1C ZINC000822228899 599426317 /nfs/dbraw/zinc/42/63/17/599426317.db2.gz ILBSAERXMHVNGB-CABCVRRESA-N -1 3 364.453 3.605 20 0 FHADHM CSCC[C@@H](C)Nc1cc(C)c(-c2nnn[n-]2)c2nc3ccccc3n21 ZINC000737184309 599445919 /nfs/dbraw/zinc/44/59/19/599445919.db2.gz XSJJFJYKCJLQMT-GFCCVEGCSA-N -1 3 367.482 3.530 20 0 FHADHM CSCC[C@@H](C)Nc1cc(C)c(-c2nn[n-]n2)c2nc3ccccc3n21 ZINC000737184309 599445921 /nfs/dbraw/zinc/44/59/21/599445921.db2.gz XSJJFJYKCJLQMT-GFCCVEGCSA-N -1 3 367.482 3.530 20 0 FHADHM Fc1ccccc1[C@H](Cc1ccccc1)NCc1ccc(-c2nnn[n-]2)o1 ZINC000822792517 599446784 /nfs/dbraw/zinc/44/67/84/599446784.db2.gz ZILVFUSDSLGDDQ-SFHVURJKSA-N -1 3 363.396 3.672 20 0 FHADHM Fc1ccccc1[C@H](Cc1ccccc1)NCc1ccc(-c2nn[n-]n2)o1 ZINC000822792517 599446787 /nfs/dbraw/zinc/44/67/87/599446787.db2.gz ZILVFUSDSLGDDQ-SFHVURJKSA-N -1 3 363.396 3.672 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)N1CCCCC[C@@H]1c1ccco1 ZINC000737801811 599468905 /nfs/dbraw/zinc/46/89/05/599468905.db2.gz UPJAOQKIPIFFAA-FMQWLBJXSA-N -1 3 363.421 3.617 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)N1CCCCC[C@@H]1c1ccco1 ZINC000737801811 599468907 /nfs/dbraw/zinc/46/89/07/599468907.db2.gz UPJAOQKIPIFFAA-FMQWLBJXSA-N -1 3 363.421 3.617 20 0 FHADHM Cc1ccc2[nH]c3c(c2c1)CN(c1c(Cl)cccc1-c1nnn[n-]1)CC3 ZINC000822275400 599471671 /nfs/dbraw/zinc/47/16/71/599471671.db2.gz UBFGGASWSBTQHB-UHFFFAOYSA-N -1 3 364.840 3.873 20 0 FHADHM Cc1ccc2[nH]c3c(c2c1)CN(c1c(Cl)cccc1-c1nn[n-]n1)CC3 ZINC000822275400 599471674 /nfs/dbraw/zinc/47/16/74/599471674.db2.gz UBFGGASWSBTQHB-UHFFFAOYSA-N -1 3 364.840 3.873 20 0 FHADHM Cc1ccccc1[C@@H](C)N(C)C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000822345458 599479299 /nfs/dbraw/zinc/47/92/99/599479299.db2.gz JQEMGKMUXAHNEC-LSDHHAIUSA-N -1 3 364.453 3.639 20 0 FHADHM Cc1ccccc1[C@@H](C)N(C)C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000822345458 599479302 /nfs/dbraw/zinc/47/93/02/599479302.db2.gz JQEMGKMUXAHNEC-LSDHHAIUSA-N -1 3 364.453 3.639 20 0 FHADHM CCCC(=O)Nc1ccc(CNc2c(Cl)cccc2-c2nnn[n-]2)cc1 ZINC000821009529 599479528 /nfs/dbraw/zinc/47/95/28/599479528.db2.gz UVIWXXZGYDNLAQ-UHFFFAOYSA-N -1 3 370.844 3.871 20 0 FHADHM CCCC(=O)Nc1ccc(CNc2c(Cl)cccc2-c2nn[n-]n2)cc1 ZINC000821009529 599479531 /nfs/dbraw/zinc/47/95/31/599479531.db2.gz UVIWXXZGYDNLAQ-UHFFFAOYSA-N -1 3 370.844 3.871 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1NCc1cc(Br)cs1 ZINC000822586010 599483700 /nfs/dbraw/zinc/48/37/00/599483700.db2.gz QKVRWFPJRUSORX-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1NCc1cc(Br)cs1 ZINC000822586010 599483701 /nfs/dbraw/zinc/48/37/01/599483701.db2.gz QKVRWFPJRUSORX-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM C[C@H](C[C@@H](O)c1ccc(F)cc1)Nc1ccc(Cl)cc1-c1nnn[n-]1 ZINC000820232150 607381281 /nfs/dbraw/zinc/38/12/81/607381281.db2.gz FCOBGOFULKQQFF-QLJPJBMISA-N -1 3 361.808 3.583 20 0 FHADHM C[C@H](C[C@@H](O)c1ccc(F)cc1)Nc1ccc(Cl)cc1-c1nn[n-]n1 ZINC000820232150 607381283 /nfs/dbraw/zinc/38/12/83/607381283.db2.gz FCOBGOFULKQQFF-QLJPJBMISA-N -1 3 361.808 3.583 20 0 FHADHM Cc1ccc(N2CCCN(c3c(Cl)cccc3-c3nnn[n-]3)CC2)cc1 ZINC000822242205 599488346 /nfs/dbraw/zinc/48/83/46/599488346.db2.gz DSAVFHGSFOGHIW-UHFFFAOYSA-N -1 3 368.872 3.545 20 0 FHADHM Cc1ccc(N2CCCN(c3c(Cl)cccc3-c3nn[n-]n3)CC2)cc1 ZINC000822242205 599488349 /nfs/dbraw/zinc/48/83/49/599488349.db2.gz DSAVFHGSFOGHIW-UHFFFAOYSA-N -1 3 368.872 3.545 20 0 FHADHM CCCCOc1ncccc1CNc1c(Cl)cccc1-c1nnn[n-]1 ZINC000821077315 599495067 /nfs/dbraw/zinc/49/50/67/599495067.db2.gz AENHIQOPERAXQH-UHFFFAOYSA-N -1 3 358.833 3.706 20 0 FHADHM CCCCOc1ncccc1CNc1c(Cl)cccc1-c1nn[n-]n1 ZINC000821077315 599495069 /nfs/dbraw/zinc/49/50/69/599495069.db2.gz AENHIQOPERAXQH-UHFFFAOYSA-N -1 3 358.833 3.706 20 0 FHADHM CC(C)Sc1ccccc1C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820183798 599497844 /nfs/dbraw/zinc/49/78/44/599497844.db2.gz LQQGHLGTKCEEFZ-ZDUSSCGKSA-N -1 3 367.478 3.858 20 0 FHADHM CC(C)Sc1ccccc1C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820183798 599497845 /nfs/dbraw/zinc/49/78/45/599497845.db2.gz LQQGHLGTKCEEFZ-ZDUSSCGKSA-N -1 3 367.478 3.858 20 0 FHADHM Cc1ccc(N[C@@H](C)C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c(C)c1 ZINC000737361057 599504190 /nfs/dbraw/zinc/50/41/90/599504190.db2.gz RETIPYQWSSUARA-LBPRGKRZSA-N -1 3 370.844 3.576 20 0 FHADHM Cc1ccc(N[C@@H](C)C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c(C)c1 ZINC000737361057 599504192 /nfs/dbraw/zinc/50/41/92/599504192.db2.gz RETIPYQWSSUARA-LBPRGKRZSA-N -1 3 370.844 3.576 20 0 FHADHM CSc1ccc(Cl)c(C(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000821984028 599513262 /nfs/dbraw/zinc/51/32/62/599513262.db2.gz LLYXXWFEVGZQEK-JTQLQIEISA-N -1 3 373.869 3.733 20 0 FHADHM CSc1ccc(Cl)c(C(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000821984028 599513265 /nfs/dbraw/zinc/51/32/65/599513265.db2.gz LLYXXWFEVGZQEK-JTQLQIEISA-N -1 3 373.869 3.733 20 0 FHADHM C[C@@H](OC(=O)CCc1cc(Cl)cs1)c1cccc(-c2nnn[n-]2)c1 ZINC000736153715 599515563 /nfs/dbraw/zinc/51/55/63/599515563.db2.gz YVQROJQYCPJBNJ-SNVBAGLBSA-N -1 3 362.842 3.819 20 0 FHADHM C[C@@H](OC(=O)CCc1cc(Cl)cs1)c1cccc(-c2nn[n-]n2)c1 ZINC000736153715 599515565 /nfs/dbraw/zinc/51/55/65/599515565.db2.gz YVQROJQYCPJBNJ-SNVBAGLBSA-N -1 3 362.842 3.819 20 0 FHADHM C[C@H](C[C@@H](O)c1ccc(F)cc1)Nc1cc(Cl)ccc1-c1nnn[n-]1 ZINC000820233082 607382058 /nfs/dbraw/zinc/38/20/58/607382058.db2.gz ISNLEXPAKVPVAS-QLJPJBMISA-N -1 3 361.808 3.583 20 0 FHADHM C[C@H](C[C@@H](O)c1ccc(F)cc1)Nc1cc(Cl)ccc1-c1nn[n-]n1 ZINC000820233082 607382061 /nfs/dbraw/zinc/38/20/61/607382061.db2.gz ISNLEXPAKVPVAS-QLJPJBMISA-N -1 3 361.808 3.583 20 0 FHADHM Fc1ccccc1OCCNc1ccc(-c2nn[n-]n2)cc1C(F)(F)F ZINC000737670673 599519600 /nfs/dbraw/zinc/51/96/00/599519600.db2.gz WDDRGUVBFYPQKK-UHFFFAOYSA-N -1 3 367.306 3.516 20 0 FHADHM C[C@H](S[C@H]1CCN(c2ccc(-c3nnn[n-]3)cc2)C1=O)c1cccs1 ZINC000736188866 599524251 /nfs/dbraw/zinc/52/42/51/599524251.db2.gz MATZTVWVLOQNQO-NHYWBVRUSA-N -1 3 371.491 3.528 20 0 FHADHM C[C@H](S[C@H]1CCN(c2ccc(-c3nn[n-]n3)cc2)C1=O)c1cccs1 ZINC000736188866 599524253 /nfs/dbraw/zinc/52/42/53/599524253.db2.gz MATZTVWVLOQNQO-NHYWBVRUSA-N -1 3 371.491 3.528 20 0 FHADHM C[C@@H](NC(=O)c1ccc(Cl)c(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820397816 599525926 /nfs/dbraw/zinc/52/59/26/599525926.db2.gz UUXPQWCSLNVQRE-SECBINFHSA-N -1 3 362.220 3.665 20 0 FHADHM C[C@@H](NC(=O)c1ccc(Cl)c(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820397816 599525929 /nfs/dbraw/zinc/52/59/29/599525929.db2.gz UUXPQWCSLNVQRE-SECBINFHSA-N -1 3 362.220 3.665 20 0 FHADHM C[C@@H](NC(=O)c1cc2c(s1)CCCCC2)c1cccc(-c2nnn[n-]2)c1 ZINC000820389998 599526024 /nfs/dbraw/zinc/52/60/24/599526024.db2.gz CXEOPJTWLVWRON-GFCCVEGCSA-N -1 3 367.478 3.688 20 0 FHADHM C[C@@H](NC(=O)c1cc2c(s1)CCCCC2)c1cccc(-c2nn[n-]n2)c1 ZINC000820389998 599526026 /nfs/dbraw/zinc/52/60/26/599526026.db2.gz CXEOPJTWLVWRON-GFCCVEGCSA-N -1 3 367.478 3.688 20 0 FHADHM CC(C)C[C@@H](C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000820051797 599527511 /nfs/dbraw/zinc/52/75/11/599527511.db2.gz WNEVSLJLGWPKGB-HNAYVOBHSA-N -1 3 363.465 3.874 20 0 FHADHM CC(C)C[C@@H](C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000820051797 599527513 /nfs/dbraw/zinc/52/75/13/599527513.db2.gz WNEVSLJLGWPKGB-HNAYVOBHSA-N -1 3 363.465 3.874 20 0 FHADHM Cc1ccc(C[C@@H](C)Nc2nc(C(F)(F)F)ccc2-c2nnn[n-]2)s1 ZINC000737335112 599529422 /nfs/dbraw/zinc/52/94/22/599529422.db2.gz QCYCYGMHBFLGFE-MRVPVSSYSA-N -1 3 368.388 3.694 20 0 FHADHM Cc1ccc(C[C@@H](C)Nc2nc(C(F)(F)F)ccc2-c2nn[n-]n2)s1 ZINC000737335112 599529424 /nfs/dbraw/zinc/52/94/24/599529424.db2.gz QCYCYGMHBFLGFE-MRVPVSSYSA-N -1 3 368.388 3.694 20 0 FHADHM O=C(CC/C=C/c1ccccc1)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000737823891 599543066 /nfs/dbraw/zinc/54/30/66/599543066.db2.gz CSFOEHISJDSUKA-XBXARRHUSA-N -1 3 353.813 3.952 20 0 FHADHM O=C(CC/C=C/c1ccccc1)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000737823891 599543069 /nfs/dbraw/zinc/54/30/69/599543069.db2.gz CSFOEHISJDSUKA-XBXARRHUSA-N -1 3 353.813 3.952 20 0 FHADHM CN(Cc1ccc(F)cc1Cl)c1c(-c2nnn[n-]2)cnc2ccccc21 ZINC000821611087 599544595 /nfs/dbraw/zinc/54/45/95/599544595.db2.gz QBLYSOKDWDKXSB-UHFFFAOYSA-N -1 3 368.803 3.844 20 0 FHADHM CN(Cc1ccc(F)cc1Cl)c1c(-c2nn[n-]n2)cnc2ccccc21 ZINC000821611087 599544597 /nfs/dbraw/zinc/54/45/97/599544597.db2.gz QBLYSOKDWDKXSB-UHFFFAOYSA-N -1 3 368.803 3.844 20 0 FHADHM Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)Nc2ccc(-c3nnn[n-]3)cc2)o1 ZINC000822232881 599555517 /nfs/dbraw/zinc/55/55/17/599555517.db2.gz CTRSZTAVWFOAGZ-WBMJQRKESA-N -1 3 366.425 3.773 20 0 FHADHM Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)Nc2ccc(-c3nn[n-]n3)cc2)o1 ZINC000822232881 599555518 /nfs/dbraw/zinc/55/55/18/599555518.db2.gz CTRSZTAVWFOAGZ-WBMJQRKESA-N -1 3 366.425 3.773 20 0 FHADHM Cc1ccc([C@@H]2[C@@H](C)CCCN2C(=O)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000737330373 599558047 /nfs/dbraw/zinc/55/80/47/599558047.db2.gz NJJASKYQYZEOOL-KXBFYZLASA-N -1 3 361.449 3.789 20 0 FHADHM Cc1ccc([C@@H]2[C@@H](C)CCCN2C(=O)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000737330373 599558048 /nfs/dbraw/zinc/55/80/48/599558048.db2.gz NJJASKYQYZEOOL-KXBFYZLASA-N -1 3 361.449 3.789 20 0 FHADHM CC[C@H](C)[C@@H](C)NC(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736335542 599564479 /nfs/dbraw/zinc/56/44/79/599564479.db2.gz YSOJPDZBMJHCTP-UONOGXRCSA-N -1 3 364.453 3.775 20 0 FHADHM CC[C@@H](SCC(=O)Nc1ccc(-c2nnn[n-]2)cc1)c1ccc(F)cc1 ZINC000736390572 599599042 /nfs/dbraw/zinc/59/90/42/599599042.db2.gz IBXSLSZTTULZHL-MRXNPFEDSA-N -1 3 371.441 3.829 20 0 FHADHM CC[C@@H](SCC(=O)Nc1ccc(-c2nn[n-]n2)cc1)c1ccc(F)cc1 ZINC000736390572 599599043 /nfs/dbraw/zinc/59/90/43/599599043.db2.gz IBXSLSZTTULZHL-MRXNPFEDSA-N -1 3 371.441 3.829 20 0 FHADHM CC[C@H](C)[C@H]1CCCCN1C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736335667 599608747 /nfs/dbraw/zinc/60/87/47/599608747.db2.gz ZIMTYRDSRFRHGM-JJRVBVJISA-N -1 3 356.474 3.538 20 0 FHADHM CC[C@H](C)[C@H]1CCCCN1C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736335667 599608749 /nfs/dbraw/zinc/60/87/49/599608749.db2.gz ZIMTYRDSRFRHGM-JJRVBVJISA-N -1 3 356.474 3.538 20 0 FHADHM C[C@H](OC(=O)[C@@H]1C[C@H]1c1cccc(F)c1F)c1cccc(-c2nnn[n-]2)c1 ZINC000820488451 599621316 /nfs/dbraw/zinc/62/13/16/599621316.db2.gz OFVJHTCBJRSIBY-NZVBXONLSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@@H]1C[C@H]1c1cccc(F)c1F)c1cccc(-c2nn[n-]n2)c1 ZINC000820488451 599621317 /nfs/dbraw/zinc/62/13/17/599621317.db2.gz OFVJHTCBJRSIBY-NZVBXONLSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@H]1C[C@H]1c1cccc(F)c1F)c1cccc(-c2nnn[n-]2)c1 ZINC000820488450 599621322 /nfs/dbraw/zinc/62/13/22/599621322.db2.gz OFVJHTCBJRSIBY-LKTVYLICSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@H]1C[C@H]1c1cccc(F)c1F)c1cccc(-c2nn[n-]n2)c1 ZINC000820488450 599621323 /nfs/dbraw/zinc/62/13/23/599621323.db2.gz OFVJHTCBJRSIBY-LKTVYLICSA-N -1 3 370.359 3.553 20 0 FHADHM COc1ccc(OC(=O)C=Cc2ccccc2-c2nnn[n-]2)c2ccccc12 ZINC000821838094 599627046 /nfs/dbraw/zinc/62/70/46/599627046.db2.gz KGUQCXZVKLXHRH-JLHYYAGUSA-N -1 3 372.384 3.647 20 0 FHADHM COc1ccc(OC(=O)C=Cc2ccccc2-c2nn[n-]n2)c2ccccc12 ZINC000821838094 599627047 /nfs/dbraw/zinc/62/70/47/599627047.db2.gz KGUQCXZVKLXHRH-JLHYYAGUSA-N -1 3 372.384 3.647 20 0 FHADHM Cc1nc(C2CCCC2)sc1C(=O)Nc1ccccc1-c1nnn[n-]1 ZINC000822431786 599628857 /nfs/dbraw/zinc/62/88/57/599628857.db2.gz JRTGQALVDFKVJZ-UHFFFAOYSA-N -1 3 354.439 3.542 20 0 FHADHM Cc1nc(C2CCCC2)sc1C(=O)Nc1ccccc1-c1nn[n-]n1 ZINC000822431786 599628858 /nfs/dbraw/zinc/62/88/58/599628858.db2.gz JRTGQALVDFKVJZ-UHFFFAOYSA-N -1 3 354.439 3.542 20 0 FHADHM CCC(CC)(C(=O)Nc1cc(-c2nnn[n-]2)ccc1OC)c1ccccc1 ZINC000820882269 599630274 /nfs/dbraw/zinc/63/02/74/599630274.db2.gz NTRLUDGSGXDDAI-UHFFFAOYSA-N -1 3 365.437 3.572 20 0 FHADHM CCC(CC)(C(=O)Nc1cc(-c2nn[n-]n2)ccc1OC)c1ccccc1 ZINC000820882269 599630275 /nfs/dbraw/zinc/63/02/75/599630275.db2.gz NTRLUDGSGXDDAI-UHFFFAOYSA-N -1 3 365.437 3.572 20 0 FHADHM Cc1cncc(C(=O)Nc2sc(-c3ccccc3)cc2-c2nnn[n-]2)c1 ZINC000822399990 599630732 /nfs/dbraw/zinc/63/07/32/599630732.db2.gz RVZFMWUXQUVDGC-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1cncc(C(=O)Nc2sc(-c3ccccc3)cc2-c2nn[n-]n2)c1 ZINC000822399990 599630733 /nfs/dbraw/zinc/63/07/33/599630733.db2.gz RVZFMWUXQUVDGC-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1ccc(C)c(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)c1 ZINC000822231002 599634929 /nfs/dbraw/zinc/63/49/29/599634929.db2.gz XKYKFPIBMSAZBE-UHFFFAOYSA-N -1 3 361.327 3.755 20 0 FHADHM Cc1ccc(C)c(C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)c1 ZINC000822231002 599634930 /nfs/dbraw/zinc/63/49/30/599634930.db2.gz XKYKFPIBMSAZBE-UHFFFAOYSA-N -1 3 361.327 3.755 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)c1cccc(Cl)c1 ZINC000823302949 599635173 /nfs/dbraw/zinc/63/51/73/599635173.db2.gz BDCFGMZAARWAKJ-UHFFFAOYSA-N -1 3 367.718 3.791 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)c1cccc(Cl)c1 ZINC000823302949 599635174 /nfs/dbraw/zinc/63/51/74/599635174.db2.gz BDCFGMZAARWAKJ-UHFFFAOYSA-N -1 3 367.718 3.791 20 0 FHADHM CC[C@H](NCc1cccc(-c2nn[n-]n2)c1)c1nc(C(F)(F)F)cs1 ZINC000820925348 599647068 /nfs/dbraw/zinc/64/70/68/599647068.db2.gz HQKRHASFWORFMO-NSHDSACASA-N -1 3 368.388 3.583 20 0 FHADHM CSCCCOC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000821970169 599660401 /nfs/dbraw/zinc/66/04/01/599660401.db2.gz JWUCMBSOFBBVGN-UHFFFAOYSA-N -1 3 370.434 3.569 20 0 FHADHM CSCCCOC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000821970169 599660402 /nfs/dbraw/zinc/66/04/02/599660402.db2.gz JWUCMBSOFBBVGN-UHFFFAOYSA-N -1 3 370.434 3.569 20 0 FHADHM CCCC1CCC(NC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)CC1 ZINC000821040986 599672865 /nfs/dbraw/zinc/67/28/65/599672865.db2.gz WOSIJEFJCNDJAK-TUBUQKNSSA-N -1 3 356.474 3.586 20 0 FHADHM CCCC1CCC(NC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)CC1 ZINC000821040986 599672866 /nfs/dbraw/zinc/67/28/66/599672866.db2.gz WOSIJEFJCNDJAK-TUBUQKNSSA-N -1 3 356.474 3.586 20 0 FHADHM CCC(=CC(=O)Nc1ccccc1-c1nnn[n-]1)c1cccc(Cl)c1 ZINC000820832525 599689720 /nfs/dbraw/zinc/68/97/20/599689720.db2.gz KPRUENAIEQFXSR-VAWYXSNFSA-N -1 3 353.813 3.952 20 0 FHADHM CCC(=CC(=O)Nc1ccccc1-c1nn[n-]n1)c1cccc(Cl)c1 ZINC000820832525 599689721 /nfs/dbraw/zinc/68/97/21/599689721.db2.gz KPRUENAIEQFXSR-VAWYXSNFSA-N -1 3 353.813 3.952 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)CC(C)(C)CC ZINC000821389351 599689883 /nfs/dbraw/zinc/68/98/83/599689883.db2.gz JTMXSBGBEIGDPT-UHFFFAOYSA-N -1 3 352.822 3.651 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)CC(C)(C)CC ZINC000821389351 599689884 /nfs/dbraw/zinc/68/98/84/599689884.db2.gz JTMXSBGBEIGDPT-UHFFFAOYSA-N -1 3 352.822 3.651 20 0 FHADHM COc1ccc(OC2CCN([C@@H](C(=O)[O-])c3ccc(F)cc3)CC2)cc1 ZINC000738047997 599710961 /nfs/dbraw/zinc/71/09/61/599710961.db2.gz NSOVSFNJJBLOTN-LJQANCHMSA-N -1 3 359.397 3.503 20 0 FHADHM O=C([O-])Nc1ccc(C(=O)N[C@@H](CN2CCCCC2)c2ccccc2)cc1 ZINC000738661987 599742381 /nfs/dbraw/zinc/74/23/81/599742381.db2.gz OHCXGYFHDBXMPQ-IBGZPJMESA-N -1 3 367.449 3.734 20 0 FHADHM COc1cccc(CN(Cc2cc(C(=O)[O-])oc2C)C2CCC(O)CC2)c1 ZINC000738096264 599772223 /nfs/dbraw/zinc/77/22/23/599772223.db2.gz DIWALRHROZISMT-UHFFFAOYSA-N -1 3 373.449 3.601 20 0 FHADHM O=C([O-])c1ccc(NC(=O)CN[C@@H](c2ccc(F)cc2)C2CCC2)cc1 ZINC000739305858 599793435 /nfs/dbraw/zinc/79/34/35/599793435.db2.gz AAWIIBWLBXSMLD-LJQANCHMSA-N -1 3 356.397 3.593 20 0 FHADHM CC(C)Oc1ccc(NC(=O)[C@H](C)c2cccc(F)c2)cc1-c1nnn[n-]1 ZINC000820160010 607399722 /nfs/dbraw/zinc/39/97/22/607399722.db2.gz COMHOLTXLCUDCJ-GFCCVEGCSA-N -1 3 369.400 3.535 20 0 FHADHM CC(C)Oc1ccc(NC(=O)[C@H](C)c2cccc(F)c2)cc1-c1nn[n-]n1 ZINC000820160010 607399724 /nfs/dbraw/zinc/39/97/24/607399724.db2.gz COMHOLTXLCUDCJ-GFCCVEGCSA-N -1 3 369.400 3.535 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)O[C@@H](C)c1nc2ccccc2s1 ZINC000826251491 607399972 /nfs/dbraw/zinc/39/99/72/607399972.db2.gz RFFRDENBGDUJHM-NSHDSACASA-N -1 3 365.418 3.703 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)O[C@@H](C)c1nc2ccccc2s1 ZINC000826251491 607399973 /nfs/dbraw/zinc/39/99/73/607399973.db2.gz RFFRDENBGDUJHM-NSHDSACASA-N -1 3 365.418 3.703 20 0 FHADHM COc1ccc2[nH]cc(C3CCN(Cc4cc(C(=O)[O-])co4)CC3)c2c1 ZINC000568060234 599848957 /nfs/dbraw/zinc/84/89/57/599848957.db2.gz WOSLUVRZROTEHI-UHFFFAOYSA-N -1 3 354.406 3.847 20 0 FHADHM O=C([O-])c1coc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)c1 ZINC000566359431 599849926 /nfs/dbraw/zinc/84/99/26/599849926.db2.gz TVBRWALVSSCHIW-ZDUSSCGKSA-N -1 3 371.368 3.547 20 0 FHADHM Cc1ccsc1CCCC(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000826316574 607401716 /nfs/dbraw/zinc/40/17/16/607401716.db2.gz RXEKOMIFOJQKGB-ZDUSSCGKSA-N -1 3 356.451 3.864 20 0 FHADHM Cc1ccsc1CCCC(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000826316574 607401717 /nfs/dbraw/zinc/40/17/17/607401717.db2.gz RXEKOMIFOJQKGB-ZDUSSCGKSA-N -1 3 356.451 3.864 20 0 FHADHM O=C(Nc1ccc(Sc2ccncc2)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000823355882 607407901 /nfs/dbraw/zinc/40/79/01/607407901.db2.gz FGXFEDHENPNTLW-UHFFFAOYSA-N -1 3 374.429 3.665 20 0 FHADHM O=C(Nc1ccc(Sc2ccncc2)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000823355882 607407902 /nfs/dbraw/zinc/40/79/02/607407902.db2.gz FGXFEDHENPNTLW-UHFFFAOYSA-N -1 3 374.429 3.665 20 0 FHADHM COc1cc2c(cc1OC)[C@@H](CC(=O)[O-])N(Cc1cc(C)cc(C)c1)CC2 ZINC000737905589 599985323 /nfs/dbraw/zinc/98/53/23/599985323.db2.gz MYQFQYYOEVCMTI-LJQANCHMSA-N -1 3 369.461 3.895 20 0 FHADHM C[C@H](NCc1ccc(-c2ccc(C(=O)[O-])cc2)o1)[C@@H](O)c1ccccc1 ZINC000020875542 600038010 /nfs/dbraw/zinc/03/80/10/600038010.db2.gz GTZDQPHUJRUZKY-VBKZILBWSA-N -1 3 351.402 3.857 20 0 FHADHM Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)c(C(=O)[O-])c1 ZINC000738614874 600073577 /nfs/dbraw/zinc/07/35/77/600073577.db2.gz GCBJDHXRNDVWTB-MRXNPFEDSA-N -1 3 370.424 3.683 20 0 FHADHM C[C@@H](NC(=O)OC(C)(C)C)C1CCN([C@H](C)c2ccc(C(=O)[O-])o2)CC1 ZINC000736651657 600092461 /nfs/dbraw/zinc/09/24/61/600092461.db2.gz ZWZXGEQTDRUEPT-CHWSQXEVSA-N -1 3 366.458 3.664 20 0 FHADHM Cc1cc2cc(C(=O)NC3(c4cccc(-c5nnn[n-]5)c4)CC3)oc2cc1C ZINC000826273020 607419311 /nfs/dbraw/zinc/41/93/11/607419311.db2.gz MBHHUASUVKRKEO-UHFFFAOYSA-N -1 3 373.416 3.649 20 0 FHADHM Cc1cc2cc(C(=O)NC3(c4cccc(-c5nn[n-]n5)c4)CC3)oc2cc1C ZINC000826273020 607419313 /nfs/dbraw/zinc/41/93/13/607419313.db2.gz MBHHUASUVKRKEO-UHFFFAOYSA-N -1 3 373.416 3.649 20 0 FHADHM Cc1ccc(C(=O)[O-])cc1NC(=O)[C@@H](C)N(C)C[C@H](C)c1ccccc1 ZINC000738521056 600144450 /nfs/dbraw/zinc/14/44/50/600144450.db2.gz XTEAOBUJYXMWRC-JKSUJKDBSA-N -1 3 354.450 3.756 20 0 FHADHM Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000826316122 607430892 /nfs/dbraw/zinc/43/08/92/607430892.db2.gz DGOYQIMEVIFXGL-STQMWFEESA-N -1 3 370.482 3.535 20 0 FHADHM Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000826316122 607430894 /nfs/dbraw/zinc/43/08/94/607430894.db2.gz DGOYQIMEVIFXGL-STQMWFEESA-N -1 3 370.482 3.535 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1ccc(F)cc1C(F)(F)F ZINC000826250407 607431975 /nfs/dbraw/zinc/43/19/75/607431975.db2.gz ZNYVIONCCISCCQ-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1ccc(F)cc1C(F)(F)F ZINC000826250407 607431977 /nfs/dbraw/zinc/43/19/77/607431977.db2.gz ZNYVIONCCISCCQ-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N(c1ccc(Cl)cc1)C(C)C ZINC000826244466 607432078 /nfs/dbraw/zinc/43/20/78/607432078.db2.gz UAPIGIPVTDVNSZ-UHFFFAOYSA-N -1 3 355.829 3.884 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N(c1ccc(Cl)cc1)C(C)C ZINC000826244466 607432079 /nfs/dbraw/zinc/43/20/79/607432079.db2.gz UAPIGIPVTDVNSZ-UHFFFAOYSA-N -1 3 355.829 3.884 20 0 FHADHM Cc1ccc(OCc2nc(CNC3(C(=O)[O-])CCCCC3)cs2)cc1 ZINC000556321972 600318508 /nfs/dbraw/zinc/31/85/08/600318508.db2.gz SQFYAWCTFKYADV-UHFFFAOYSA-N -1 3 360.479 3.908 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@H]2C(=O)N(C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000824347794 607438196 /nfs/dbraw/zinc/43/81/96/607438196.db2.gz NXQRPRBYWXPFRL-RBUKOAKNSA-N -1 3 361.449 3.757 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@H]2C(=O)N(C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000824347794 607438197 /nfs/dbraw/zinc/43/81/97/607438197.db2.gz NXQRPRBYWXPFRL-RBUKOAKNSA-N -1 3 361.449 3.757 20 0 FHADHM Cc1ccc(C(=O)[O-])cc1NC(=O)c1oc2ccccc2c1CN(C)C ZINC000738535701 600383071 /nfs/dbraw/zinc/38/30/71/600383071.db2.gz OHLJRVSXKWJSOG-UHFFFAOYSA-N -1 3 352.390 3.753 20 0 FHADHM CCc1ccc([C@@H](CNC(=O)Nc2ccc(C(=O)[O-])cc2F)N(C)C)cc1 ZINC000737259129 600397202 /nfs/dbraw/zinc/39/72/02/600397202.db2.gz NNDYQVXBKASOTE-GOSISDBHSA-N -1 3 373.428 3.511 20 0 FHADHM O=C([O-])[C@H](N[C@@H]1CCc2c1cccc2Br)c1ccc(F)cc1 ZINC000739509971 600433749 /nfs/dbraw/zinc/43/37/49/600433749.db2.gz WMCIFWOKBBWVCN-HZPDHXFCSA-N -1 3 364.214 3.991 20 0 FHADHM O=C([O-])[C@H](N[C@H]1CCc2c1cccc2Br)c1ccc(F)cc1 ZINC000739509977 600433797 /nfs/dbraw/zinc/43/37/97/600433797.db2.gz WMCIFWOKBBWVCN-JKSUJKDBSA-N -1 3 364.214 3.991 20 0 FHADHM O=C([O-])[C@@H](NCc1cccc(OCC(F)F)c1)c1cccc(Cl)c1 ZINC000739501165 600433867 /nfs/dbraw/zinc/43/38/67/600433867.db2.gz SSEBMSMCJFRGFH-INIZCTEOSA-N -1 3 355.768 3.899 20 0 FHADHM COc1ccc(CN[C@H](C(=O)[O-])c2ccccc2)cc1OC1CCCC1 ZINC000738009001 600434719 /nfs/dbraw/zinc/43/47/19/600434719.db2.gz WGSPGDHCFTWNEX-FQEVSTJZSA-N -1 3 355.434 3.932 20 0 FHADHM Clc1ccc(SC2CCN(c3ccc(-c4nnn[n-]4)cn3)CC2)cc1 ZINC000822578496 607469840 /nfs/dbraw/zinc/46/98/40/607469840.db2.gz JSDQENMQTAECSQ-UHFFFAOYSA-N -1 3 372.885 3.676 20 0 FHADHM Clc1ccc(SC2CCN(c3ccc(-c4nn[n-]n4)cn3)CC2)cc1 ZINC000822578496 607469842 /nfs/dbraw/zinc/46/98/42/607469842.db2.gz JSDQENMQTAECSQ-UHFFFAOYSA-N -1 3 372.885 3.676 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1CNc1cccc(N2CCCCC2)c1 ZINC000822744388 607475517 /nfs/dbraw/zinc/47/55/17/607475517.db2.gz RIKGLVLTKKLFBN-UHFFFAOYSA-N -1 3 352.417 3.608 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CNc1cccc(N2CCCCC2)c1 ZINC000822744388 607475520 /nfs/dbraw/zinc/47/55/20/607475520.db2.gz RIKGLVLTKKLFBN-UHFFFAOYSA-N -1 3 352.417 3.608 20 0 FHADHM CCc1ccc([C@@H]2CCCCN2C[C@@H](O)COc2ccc(C(=O)[O-])cc2)o1 ZINC000519613518 600968254 /nfs/dbraw/zinc/96/82/54/600968254.db2.gz YIRKZYRYPYVBPP-APWZRJJASA-N -1 3 373.449 3.507 20 0 FHADHM Cc1cccc(C2(O)CCN(Cc3ccc(F)cc3C(=O)[O-])CC2)c1C ZINC000738687460 600975135 /nfs/dbraw/zinc/97/51/35/600975135.db2.gz MPEALFDVEGGBSF-UHFFFAOYSA-N -1 3 357.425 3.624 20 0 FHADHM COc1ccc(OC2CCN([C@@H](C(=O)[O-])c3ccccc3F)CC2)cc1 ZINC000832439270 600988584 /nfs/dbraw/zinc/98/85/84/600988584.db2.gz ONDNOGOTFXIPTK-LJQANCHMSA-N -1 3 359.397 3.503 20 0 FHADHM CN(Cc1ccccc1OCC(F)(F)F)[C@@H](C(=O)[O-])c1ccccc1 ZINC000830859218 601014144 /nfs/dbraw/zinc/01/41/44/601014144.db2.gz AKPKJNCDNLJUHN-MRXNPFEDSA-N -1 3 353.340 3.885 20 0 FHADHM CC[C@@H](C)Oc1cc(C)ccc1CNCc1ccc(-c2nn[n-]n2)cc1F ZINC000820875866 607486619 /nfs/dbraw/zinc/48/66/19/607486619.db2.gz HQOYTQCOYFSUKS-CQSZACIVSA-N -1 3 369.444 3.781 20 0 FHADHM CC[C@H](C)Oc1cc(C)ccc1CNCc1ccc(-c2nn[n-]n2)cc1F ZINC000820875865 607486788 /nfs/dbraw/zinc/48/67/88/607486788.db2.gz HQOYTQCOYFSUKS-AWEZNQCLSA-N -1 3 369.444 3.781 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1CNc1ccc2c(c1)OC1(CCCC1)O2 ZINC000822743615 607489325 /nfs/dbraw/zinc/48/93/25/607489325.db2.gz ABXLLDFQFFGBKP-UHFFFAOYSA-N -1 3 367.384 3.659 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CNc1ccc2c(c1)OC1(CCCC1)O2 ZINC000822743615 607489328 /nfs/dbraw/zinc/48/93/28/607489328.db2.gz ABXLLDFQFFGBKP-UHFFFAOYSA-N -1 3 367.384 3.659 20 0 FHADHM Cc1cc(Sc2ccncc2)n2c3ccccc3nc2c1-c1nnn[n-]1 ZINC000822212851 607494614 /nfs/dbraw/zinc/49/46/14/607494614.db2.gz JZSGPCNSOXHHSM-UHFFFAOYSA-N -1 3 359.418 3.522 20 0 FHADHM Cc1cc(Sc2ccncc2)n2c3ccccc3nc2c1-c1nn[n-]n1 ZINC000822212851 607494615 /nfs/dbraw/zinc/49/46/15/607494615.db2.gz JZSGPCNSOXHHSM-UHFFFAOYSA-N -1 3 359.418 3.522 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)CN[C@H](c2ccccc2)[C@@H](C)C(=O)[O-])cc1C ZINC000832920476 601203555 /nfs/dbraw/zinc/20/35/55/601203555.db2.gz AZCLDKPCLJOHOK-WWMYMODYSA-N -1 3 368.477 3.532 20 0 FHADHM C[C@H](C(=O)[O-])[C@H](NCC(=O)Nc1cccc2ccccc21)c1ccccc1 ZINC000826054319 601203789 /nfs/dbraw/zinc/20/37/89/601203789.db2.gz LZZURIAYOXHJRK-BTYIYWSLSA-N -1 3 362.429 3.830 20 0 FHADHM Cc1ccc2cc(C(=O)Nc3ccc(Cl)c(-c4nnn[n-]4)c3)ccc2n1 ZINC000822280862 607497196 /nfs/dbraw/zinc/49/71/96/607497196.db2.gz ZLKBKEDWKWLHLE-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1ccc2cc(C(=O)Nc3ccc(Cl)c(-c4nn[n-]n4)c3)ccc2n1 ZINC000822280862 607497197 /nfs/dbraw/zinc/49/71/97/607497197.db2.gz ZLKBKEDWKWLHLE-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM C[C@H](CSCc1ccccc1)C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000820294132 607500241 /nfs/dbraw/zinc/50/02/41/607500241.db2.gz RDEDFCKIKAZWCI-GFCCVEGCSA-N -1 3 371.441 3.514 20 0 FHADHM C[C@H](CSCc1ccccc1)C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000820294132 607500243 /nfs/dbraw/zinc/50/02/43/607500243.db2.gz RDEDFCKIKAZWCI-GFCCVEGCSA-N -1 3 371.441 3.514 20 0 FHADHM Cc1c(NC(=O)[C@@H](C)CSCc2ccccc2)cccc1-c1nnn[n-]1 ZINC000822061425 607500928 /nfs/dbraw/zinc/50/09/28/607500928.db2.gz NNLFZRGFMQUHBR-ZDUSSCGKSA-N -1 3 367.478 3.683 20 0 FHADHM Cc1c(NC(=O)[C@@H](C)CSCc2ccccc2)cccc1-c1nn[n-]n1 ZINC000822061425 607500930 /nfs/dbraw/zinc/50/09/30/607500930.db2.gz NNLFZRGFMQUHBR-ZDUSSCGKSA-N -1 3 367.478 3.683 20 0 FHADHM O=C([O-])C[C@@H]1CCCCN1Cc1cc(Br)cc2cccnc21 ZINC000650506184 601389507 /nfs/dbraw/zinc/38/95/07/601389507.db2.gz BNOLKRTVZSLWEN-HNNXBMFYSA-N -1 3 363.255 3.827 20 0 FHADHM CCc1oc(C(=O)[O-])cc1CN1CCC([C@H](O)c2ccc(F)cc2)CC1 ZINC000830363255 601417778 /nfs/dbraw/zinc/41/77/78/601417778.db2.gz PKVXJZZFUYRSQP-LJQANCHMSA-N -1 3 361.413 3.625 20 0 FHADHM C[C@H]1CN(Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)C[C@H]1C(=O)[O-] ZINC000828465981 601519107 /nfs/dbraw/zinc/51/91/07/601519107.db2.gz ZVTLPYJYGXHUBH-IINYFYTJSA-N -1 3 370.396 3.981 20 0 FHADHM CSc1ccc2cc(CN3C[C@H](C)[C@H](C(=O)[O-])C3)c(Cl)nc2c1 ZINC000832785275 601528977 /nfs/dbraw/zinc/52/89/77/601528977.db2.gz JYYCQLNQDYYIPU-IINYFYTJSA-N -1 3 350.871 3.763 20 0 FHADHM C[C@@H]1CN([C@H](C(=O)c2c[nH]c3ccccc23)c2ccccc2)C[C@@H]1C(=O)[O-] ZINC000828410605 601533887 /nfs/dbraw/zinc/53/38/87/601533887.db2.gz BLLKXJCSFPKVLR-WNYOCNMUSA-N -1 3 362.429 3.744 20 0 FHADHM O=C([O-])[C@@H]1c2ccccc2CCN1Cc1cnc(-c2ccccc2)s1 ZINC000833195895 601542478 /nfs/dbraw/zinc/54/24/78/601542478.db2.gz TXYNSYOPTIGISD-SFHVURJKSA-N -1 3 350.443 3.994 20 0 FHADHM O=C([O-])c1occc1CN(Cc1ccccc1)C[C@@H](O)c1cccs1 ZINC000833347008 601549085 /nfs/dbraw/zinc/54/90/85/601549085.db2.gz ZJZLEYWVYACURU-MRXNPFEDSA-N -1 3 357.431 3.775 20 0 FHADHM C[C@H](C(=O)[O-])[C@@H](NCC(=O)Nc1ccccc1C(C)(C)C)c1ccccc1 ZINC000826052603 601650107 /nfs/dbraw/zinc/65/01/07/601650107.db2.gz GXGGENYOAXFYKC-MGPUTAFESA-N -1 3 368.477 3.974 20 0 FHADHM CC(C)c1ccccc1NC(=O)CN[C@H](c1ccccc1)[C@@H](C)C(=O)[O-] ZINC000827134097 601650565 /nfs/dbraw/zinc/65/05/65/601650565.db2.gz CYIIAHJZWZMMPQ-QRWLVFNGSA-N -1 3 354.450 3.800 20 0 FHADHM CC(C)[C@H](NC(=O)CN[C@@H](c1ccccc1)[C@@H](C)C(=O)[O-])c1ccccc1 ZINC000826693261 601650684 /nfs/dbraw/zinc/65/06/84/601650684.db2.gz FMIHNVNFWMUFKD-TYCQWZJGSA-N -1 3 368.477 3.552 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)ccc1OC(=O)CC[C@@H](C)c1ccccc1 ZINC000825608934 607530655 /nfs/dbraw/zinc/53/06/55/607530655.db2.gz FKCGDONWUXCZME-CQSZACIVSA-N -1 3 366.421 3.755 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)ccc1OC(=O)CC[C@@H](C)c1ccccc1 ZINC000825608934 607530656 /nfs/dbraw/zinc/53/06/56/607530656.db2.gz FKCGDONWUXCZME-CQSZACIVSA-N -1 3 366.421 3.755 20 0 FHADHM COc1ccc(CSCc2nc3ccccc3s2)cc1-c1nnn[n-]1 ZINC000826207886 607532636 /nfs/dbraw/zinc/53/26/36/607532636.db2.gz JGRYDBCCLHNTRV-UHFFFAOYSA-N -1 3 369.475 3.918 20 0 FHADHM COc1ccc(CSCc2nc3ccccc3s2)cc1-c1nn[n-]n1 ZINC000826207886 607532637 /nfs/dbraw/zinc/53/26/37/607532637.db2.gz JGRYDBCCLHNTRV-UHFFFAOYSA-N -1 3 369.475 3.918 20 0 FHADHM C[C@@]1(C(=O)[O-])CCN([C@H](C(=O)c2c[nH]c3ccccc23)c2ccccc2)C1 ZINC000263571872 601921418 /nfs/dbraw/zinc/92/14/18/601921418.db2.gz KAHRSHUUIQYWCV-SIKLNZKXSA-N -1 3 362.429 3.889 20 0 FHADHM COc1ccc2ccccc2c1CNCc1ccc(CCNC(=O)[O-])cc1 ZINC000739939269 602003732 /nfs/dbraw/zinc/00/37/32/602003732.db2.gz BLPTWHOOUFBCMY-UHFFFAOYSA-N -1 3 364.445 3.948 20 0 FHADHM O=C([O-])[C@H](c1cc(Cl)cc(Cl)c1)N1CCC[C@H](c2ncc[nH]2)C1 ZINC000833169387 602044667 /nfs/dbraw/zinc/04/46/67/602044667.db2.gz BBBIXHSUHYACGJ-HZMBPMFUSA-N -1 3 354.237 3.722 20 0 FHADHM COc1cc(OC)cc([C@@H](N[C@H]2CCc3cc(Cl)ccc32)C(=O)[O-])c1 ZINC000832051528 602168231 /nfs/dbraw/zinc/16/82/31/602168231.db2.gz WETZLYMYMQRGDG-ZWKOTPCHSA-N -1 3 361.825 3.760 20 0 FHADHM COc1ccc2c(c1)CCC[C@@H]2N[C@@H](C(=O)[O-])c1cc(OC)cc(OC)c1 ZINC000832051952 602169422 /nfs/dbraw/zinc/16/94/22/602169422.db2.gz YHWZKZIMLBNQSC-VQTJNVASSA-N -1 3 371.433 3.505 20 0 FHADHM O=C([O-])c1cccc(-c2nc(CNC3(CCO)CCCCC3)cs2)c1 ZINC000833326397 602318417 /nfs/dbraw/zinc/31/84/17/602318417.db2.gz MPBBUVOOPAULOS-UHFFFAOYSA-N -1 3 360.479 3.683 20 0 FHADHM Fc1cc(NCc2cccc(-c3nn[n-]n3)c2)c(F)cc1Br ZINC000826372936 607808311 /nfs/dbraw/zinc/80/83/11/607808311.db2.gz SHVDNDCVHXLKGR-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM CC(C)c1ccc([C@H](CNCc2cnc3ccccn23)NC(=O)[O-])cc1 ZINC000738883199 602335327 /nfs/dbraw/zinc/33/53/27/602335327.db2.gz PBSTZUZPXSPDCX-SFHVURJKSA-N -1 3 352.438 3.556 20 0 FHADHM O=C([O-])Nc1ccc(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1 ZINC000740710740 602602983 /nfs/dbraw/zinc/60/29/83/602602983.db2.gz YLAXJXRNVWKJBP-SFHVURJKSA-N -1 3 368.437 3.735 20 0 FHADHM C[C@@H](NCC[C@H]1CCCN(C(=O)[O-])C1)c1nc2ccccc2n1C(F)F ZINC000739037688 602650123 /nfs/dbraw/zinc/65/01/23/602650123.db2.gz YBIVOYOBSZUKIF-CHWSQXEVSA-N -1 3 366.412 3.862 20 0 FHADHM C[C@H](CCNCc1csc(-c2ccc(C(F)(F)F)cc2)n1)NC(=O)[O-] ZINC000738902218 602875868 /nfs/dbraw/zinc/87/58/68/602875868.db2.gz BAEVYMQAASSCNW-SNVBAGLBSA-N -1 3 373.400 3.965 20 0 FHADHM O=C([O-])Nc1ccc(OC(=O)[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000738667540 602961448 /nfs/dbraw/zinc/96/14/48/602961448.db2.gz RIZZDEBMEKVHCO-INIZCTEOSA-N -1 3 354.406 3.594 20 0 FHADHM Cc1ccc(NC(=O)CC[C@H](NC(=O)[O-])c2ccccc2)c(CN(C)C)c1 ZINC000740138411 603031881 /nfs/dbraw/zinc/03/18/81/603031881.db2.gz LXTFVAICPOOILL-SFHVURJKSA-N -1 3 369.465 3.784 20 0 FHADHM O=C([O-])NC[C@H]1CCCC[C@H]1NCc1csc(-c2ccsc2)n1 ZINC000832512577 603172550 /nfs/dbraw/zinc/17/25/50/603172550.db2.gz FYAQFDMQOZHDEM-BXUZGUMPSA-N -1 3 351.497 3.788 20 0 FHADHM C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc(NC(=O)[O-])cc1 ZINC000736814280 603259258 /nfs/dbraw/zinc/25/92/58/603259258.db2.gz JUEOJKZDUPHYGR-MRXNPFEDSA-N -1 3 367.449 3.513 20 0 FHADHM C[C@H](NCc1ccc(NC(=O)[O-])nc1)[C@@H](O)c1c(Cl)cccc1Cl ZINC000825503836 603559823 /nfs/dbraw/zinc/55/98/23/603559823.db2.gz XYFWUKDNHHDDIK-BJOHPYRUSA-N -1 3 370.236 3.690 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N(CCc1ccccc1)CC(C)C ZINC000826244568 607661816 /nfs/dbraw/zinc/66/18/16/607661816.db2.gz XDYROCRVNPWTEP-UHFFFAOYSA-N -1 3 363.465 3.516 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N(CCc1ccccc1)CC(C)C ZINC000826244568 607661818 /nfs/dbraw/zinc/66/18/18/607661818.db2.gz XDYROCRVNPWTEP-UHFFFAOYSA-N -1 3 363.465 3.516 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1ccc(OC(C)C)c(Cl)c1 ZINC000826250036 607662355 /nfs/dbraw/zinc/66/23/55/607662355.db2.gz HIBHPJQBPJAGNN-UHFFFAOYSA-N -1 3 371.828 3.868 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1ccc(OC(C)C)c(Cl)c1 ZINC000826250036 607662357 /nfs/dbraw/zinc/66/23/57/607662357.db2.gz HIBHPJQBPJAGNN-UHFFFAOYSA-N -1 3 371.828 3.868 20 0 FHADHM CCCOc1cc(C)ccc1NC(=O)c1ccc(-c2nnn[n-]2)cc1C ZINC000825339104 607666189 /nfs/dbraw/zinc/66/61/89/607666189.db2.gz NEJKBGFJZXMQAO-UHFFFAOYSA-N -1 3 351.410 3.525 20 0 FHADHM CCCOc1cc(C)ccc1NC(=O)c1ccc(-c2nn[n-]n2)cc1C ZINC000825339104 607666190 /nfs/dbraw/zinc/66/61/90/607666190.db2.gz NEJKBGFJZXMQAO-UHFFFAOYSA-N -1 3 351.410 3.525 20 0 FHADHM CC(C)n1c2ccccc2nc1[C@H]1CCCN1C[C@H]1CCN(C(=O)[O-])C1 ZINC000824515565 604099467 /nfs/dbraw/zinc/09/94/67/604099467.db2.gz QQZWSHCUSDBJQO-CRAIPNDOSA-N -1 3 356.470 3.754 20 0 FHADHM C[C@H](NC(=O)[O-])[C@H]1CCCN(Cc2ccccc2Oc2cccnc2)C1 ZINC000825272460 604257839 /nfs/dbraw/zinc/25/78/39/604257839.db2.gz LDPKCKGCPBTHCW-HOTGVXAUSA-N -1 3 355.438 3.742 20 0 FHADHM C[C@@H](CC(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccc(F)cc1F ZINC000824384651 607692281 /nfs/dbraw/zinc/69/22/81/607692281.db2.gz FSPOCMQHUAUMOU-RYUDHWBXSA-N -1 3 371.391 3.516 20 0 FHADHM C[C@@H](CC(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccc(F)cc1F ZINC000824384651 607692284 /nfs/dbraw/zinc/69/22/84/607692284.db2.gz FSPOCMQHUAUMOU-RYUDHWBXSA-N -1 3 371.391 3.516 20 0 FHADHM CCOC(=O)c1sc2cccc(F)c2c1CNC(C)(C)CC(=O)[O-] ZINC000829901288 604444729 /nfs/dbraw/zinc/44/47/29/604444729.db2.gz MBSJEPUHUMELPS-UHFFFAOYSA-N -1 3 353.415 3.560 20 0 FHADHM CCCn1ccc2ccc(NC(=O)c3ccc(-c4nnn[n-]4)cc3C)cc21 ZINC000825362899 607697781 /nfs/dbraw/zinc/69/77/81/607697781.db2.gz SNUHINVMFAXEKV-UHFFFAOYSA-N -1 3 360.421 3.792 20 0 FHADHM CCCn1ccc2ccc(NC(=O)c3ccc(-c4nn[n-]n4)cc3C)cc21 ZINC000825362899 607697782 /nfs/dbraw/zinc/69/77/82/607697782.db2.gz SNUHINVMFAXEKV-UHFFFAOYSA-N -1 3 360.421 3.792 20 0 FHADHM CC(C)CN(CCC(=O)[O-])Cc1nc2cc(C(F)(F)F)ccc2n1C ZINC000833486928 604578955 /nfs/dbraw/zinc/57/89/55/604578955.db2.gz VEVWPLGLILFLBS-UHFFFAOYSA-N -1 3 357.376 3.525 20 0 FHADHM COc1ccccc1[C@H](CN[C@H](C)c1ccc2ccccc2n1)NC(=O)[O-] ZINC000829599368 604761230 /nfs/dbraw/zinc/76/12/30/604761230.db2.gz USXXZQITHZXXIM-KUHUBIRLSA-N -1 3 365.433 3.903 20 0 FHADHM FC(F)(F)c1csc(COc2cc(Cl)ccc2-c2nnn[n-]2)n1 ZINC000826369274 607713296 /nfs/dbraw/zinc/71/32/96/607713296.db2.gz VCVWMWPCUGQIOV-UHFFFAOYSA-N -1 3 361.736 3.574 20 0 FHADHM FC(F)(F)c1csc(COc2cc(Cl)ccc2-c2nn[n-]n2)n1 ZINC000826369274 607713299 /nfs/dbraw/zinc/71/32/99/607713299.db2.gz VCVWMWPCUGQIOV-UHFFFAOYSA-N -1 3 361.736 3.574 20 0 FHADHM CC(C)(C(=O)[O-])[C@H]1CCCN(Cc2ccc(F)cc2Br)C1 ZINC000135031107 604932713 /nfs/dbraw/zinc/93/27/13/604932713.db2.gz QZECNBSMZPCOHV-LBPRGKRZSA-N -1 3 358.251 3.911 20 0 FHADHM O=C([O-])NCCc1ccc(CN[C@H]2CCSc3ccc(F)cc32)cc1 ZINC000832673328 604943216 /nfs/dbraw/zinc/94/32/16/604943216.db2.gz ZYANHXYJNGOPHK-KRWDZBQOSA-N -1 3 360.454 3.963 20 0 FHADHM CC(C)(C(=O)[O-])[C@@H]1CCCN(Cc2ccc(F)c(Br)c2)C1 ZINC000135037372 604948731 /nfs/dbraw/zinc/94/87/31/604948731.db2.gz JNFFVEUOSIQTKO-GFCCVEGCSA-N -1 3 358.251 3.911 20 0 FHADHM C[C@@H](N[C@H](C(=O)[O-])c1cccnc1)c1ccc(OCc2cccnc2)cc1 ZINC000827716878 604991272 /nfs/dbraw/zinc/99/12/72/604991272.db2.gz BRVFMMABLFAICU-QRWLVFNGSA-N -1 3 363.417 3.532 20 0 FHADHM CCOCCC1(CNc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)CC1 ZINC000825589317 607729210 /nfs/dbraw/zinc/72/92/10/607729210.db2.gz DIRCTZPZSVSLQO-UHFFFAOYSA-N -1 3 355.364 3.504 20 0 FHADHM c1ccc([C@H]2CN(c3c(-c4nnn[n-]4)cnc4ccccc43)CCS2)cc1 ZINC000826521110 607729634 /nfs/dbraw/zinc/72/96/34/607729634.db2.gz ZTFKSTNNMNZKNI-GOSISDBHSA-N -1 3 374.473 3.709 20 0 FHADHM c1ccc([C@H]2CN(c3c(-c4nn[n-]n4)cnc4ccccc43)CCS2)cc1 ZINC000826521110 607729635 /nfs/dbraw/zinc/72/96/35/607729635.db2.gz ZTFKSTNNMNZKNI-GOSISDBHSA-N -1 3 374.473 3.709 20 0 FHADHM C[C@@]1(NCc2coc(-c3c(F)cccc3F)n2)CCCC[C@@H]1C(=O)[O-] ZINC000833568414 605070762 /nfs/dbraw/zinc/07/07/62/605070762.db2.gz FIEJYRSGJPLKTD-KZULUSFZSA-N -1 3 350.365 3.743 20 0 FHADHM C[C@@H](Oc1ccc(CN[C@@H]2CCCc3c2cnn3C(C)(C)C)cc1)C(=O)[O-] ZINC000833540894 605091163 /nfs/dbraw/zinc/09/11/63/605091163.db2.gz NUKLZUPRBPJDLZ-RDTXWAMCSA-N -1 3 371.481 3.657 20 0 FHADHM C[C@H](NCc1ccc([C@H](C)NC(=O)[O-])cc1)c1ccc([S@](C)=O)cc1 ZINC000825502875 605119006 /nfs/dbraw/zinc/11/90/06/605119006.db2.gz LZHVCDQXPKXBHO-DZWULXIXSA-N -1 3 360.479 3.603 20 0 FHADHM C/C(=C\CN1CCC[C@@H](Cc2nc(C3CCCCCC3)no2)C1)C(=O)[O-] ZINC000833381981 605150502 /nfs/dbraw/zinc/15/05/02/605150502.db2.gz GBKNMXLMIDXRRY-KMPOOHAWSA-N -1 3 361.486 3.793 20 0 FHADHM CC(C)(C(=O)[O-])[C@@H](NCC(=O)Nc1cccc(Cl)c1)c1ccccc1 ZINC000833415482 605184409 /nfs/dbraw/zinc/18/44/09/605184409.db2.gz WBBQBFSOCGXKDP-KRWDZBQOSA-N -1 3 360.841 3.720 20 0 FHADHM C[C@@]1(CCCO)CCCN1Cc1csc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000833562819 605193201 /nfs/dbraw/zinc/19/32/01/605193201.db2.gz HLOYOJFSMSIYAT-IBGZPJMESA-N -1 3 360.479 3.635 20 0 FHADHM CCCCN(C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@@H](CC)c1ccccc1 ZINC000825281408 607739838 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CN(C(=O)CN[C@@H](CC1CCC1)c1ccccc1)c1ccccc1C(=O)[O-] ZINC000833686544 605390935 /nfs/dbraw/zinc/39/09/35/605390935.db2.gz YYRZYRVASFMUQI-IBGZPJMESA-N -1 3 366.461 3.869 20 0 FHADHM CCCN(Cc1nc2ccccc2n1C(F)F)C1CCN(C(=O)[O-])CC1 ZINC000826916972 605468995 /nfs/dbraw/zinc/46/89/95/605468995.db2.gz VHLKUYPKLJOOFP-UHFFFAOYSA-N -1 3 366.412 3.786 20 0 FHADHM O=C([O-])Nc1ccc(CN2CCC[C@@H](c3nc4ccccc4o3)C2)cn1 ZINC000834259673 605478791 /nfs/dbraw/zinc/47/87/91/605478791.db2.gz DNPBIWAMKFNXDT-CQSZACIVSA-N -1 3 352.394 3.692 20 0 FHADHM CC(C)N1CC[C@H](NCc2ccc(C(=O)[O-])o2)[C@H]1c1ccc(F)c(F)c1 ZINC000833500062 605489873 /nfs/dbraw/zinc/48/98/73/605489873.db2.gz OBHLTEIHNSJZIT-FUHWJXTLSA-N -1 3 364.392 3.570 20 0 FHADHM CC(C)N1CC[C@H](NCc2ccc(C(=O)[O-])o2)[C@@H]1c1ccc(F)c(F)c1 ZINC000833500075 605491005 /nfs/dbraw/zinc/49/10/05/605491005.db2.gz OBHLTEIHNSJZIT-WMZOPIPTSA-N -1 3 364.392 3.570 20 0 FHADHM O=C([O-])Nc1ccc2c(c1)CC[C@@H]2NCc1ccc(N2CCCC2)nc1 ZINC000834261866 605576744 /nfs/dbraw/zinc/57/67/44/605576744.db2.gz GBNCYYVOQRSRAK-SFHVURJKSA-N -1 3 352.438 3.549 20 0 FHADHM CCOc1cc(CN[C@H]2C[C@H](NC(=O)[O-])c3ccccc32)ccc1OC ZINC000833861027 605799281 /nfs/dbraw/zinc/79/92/81/605799281.db2.gz DZLQKDWYOJFOTE-IRXDYDNUSA-N -1 3 356.422 3.637 20 0 FHADHM O=C([O-])N[C@@H]1C[C@@H](NCc2cccc(OCC(F)F)c2)c2ccccc21 ZINC000834158099 605802386 /nfs/dbraw/zinc/80/23/86/605802386.db2.gz MEIZYQCUDUUWPK-IAGOWNOFSA-N -1 3 362.376 3.874 20 0 FHADHM O=C([O-])N1CCC[C@@H]1[C@H]1CCC[C@@H]1NCc1nc(C(F)(F)F)cs1 ZINC000834103345 605989530 /nfs/dbraw/zinc/98/95/30/605989530.db2.gz AOJVXBBYQAGZEK-GARJFASQSA-N -1 3 363.405 3.563 20 0 FHADHM C[C@@H](CCNc1ncccc1-c1nnn[n-]1)c1cccc(C(F)(F)F)c1 ZINC000820241182 606038251 /nfs/dbraw/zinc/03/82/51/606038251.db2.gz GLHAZKHIHOEWQE-NSHDSACASA-N -1 3 362.359 3.886 20 0 FHADHM C[C@@H](CCNc1ncccc1-c1nn[n-]n1)c1cccc(C(F)(F)F)c1 ZINC000820241182 606038255 /nfs/dbraw/zinc/03/82/55/606038255.db2.gz GLHAZKHIHOEWQE-NSHDSACASA-N -1 3 362.359 3.886 20 0 FHADHM CC(C)Oc1ccccc1CNc1nc2ccccc2cc1-c1nnn[n-]1 ZINC000820177820 606052799 /nfs/dbraw/zinc/05/27/99/606052799.db2.gz BBQJIFIGFDWDEC-UHFFFAOYSA-N -1 3 360.421 3.814 20 0 FHADHM CC(C)Oc1ccccc1CNc1nc2ccccc2cc1-c1nn[n-]n1 ZINC000820177820 606052805 /nfs/dbraw/zinc/05/28/05/606052805.db2.gz BBQJIFIGFDWDEC-UHFFFAOYSA-N -1 3 360.421 3.814 20 0 FHADHM CCS[C@@H]1CCCC[C@H]1Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000821456842 606105340 /nfs/dbraw/zinc/10/53/40/606105340.db2.gz SBIKSVUKZYCZHO-GHMZBOCLSA-N -1 3 372.420 3.757 20 0 FHADHM CCS[C@@H]1CCCC[C@H]1Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000821456842 606105341 /nfs/dbraw/zinc/10/53/41/606105341.db2.gz SBIKSVUKZYCZHO-GHMZBOCLSA-N -1 3 372.420 3.757 20 0 FHADHM CC[C@H](C)[C@H](C)N(C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000820860568 606114965 /nfs/dbraw/zinc/11/49/65/606114965.db2.gz KBRHQELETVAIGK-IHRRRGAJSA-N -1 3 356.474 3.536 20 0 FHADHM CC[C@H](C)[C@H](C)N(C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000820860568 606114966 /nfs/dbraw/zinc/11/49/66/606114966.db2.gz KBRHQELETVAIGK-IHRRRGAJSA-N -1 3 356.474 3.536 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@@H](C)c2ccc(Cl)s2)s1 ZINC000821465459 606125932 /nfs/dbraw/zinc/12/59/32/606125932.db2.gz HZQLBBNACYNKFI-ZETCQYMHSA-N -1 3 367.887 3.948 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@@H](C)c2ccc(Cl)s2)s1 ZINC000821465459 606125933 /nfs/dbraw/zinc/12/59/33/606125933.db2.gz HZQLBBNACYNKFI-ZETCQYMHSA-N -1 3 367.887 3.948 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@H]1CCCC1(C)C ZINC000820086808 606130285 /nfs/dbraw/zinc/13/02/85/606130285.db2.gz FXVJQNBKNVPMAJ-KRWDZBQOSA-N -1 3 370.501 3.613 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@H]1CCCC1(C)C ZINC000820086808 606130286 /nfs/dbraw/zinc/13/02/86/606130286.db2.gz FXVJQNBKNVPMAJ-KRWDZBQOSA-N -1 3 370.501 3.613 20 0 FHADHM C[C@H](OC(=O)Cc1ccc(-c2nnn[n-]2)cc1)c1c(F)cccc1Cl ZINC000820494960 606134153 /nfs/dbraw/zinc/13/41/53/606134153.db2.gz DNURVTBECUGVMU-JTQLQIEISA-N -1 3 360.776 3.506 20 0 FHADHM C[C@H](OC(=O)Cc1ccc(-c2nn[n-]n2)cc1)c1c(F)cccc1Cl ZINC000820494960 606134156 /nfs/dbraw/zinc/13/41/56/606134156.db2.gz DNURVTBECUGVMU-JTQLQIEISA-N -1 3 360.776 3.506 20 0 FHADHM O=C(Nc1nc(-c2ccc(-c3nnn[n-]3)cc2)cs1)[C@H]1CC12CCCC2 ZINC000823375690 606147307 /nfs/dbraw/zinc/14/73/07/606147307.db2.gz FRQHYXRKRHTHNV-CYBMUJFWSA-N -1 3 366.450 3.509 20 0 FHADHM O=C(Nc1nc(-c2ccc(-c3nn[n-]n3)cc2)cs1)[C@H]1CC12CCCC2 ZINC000823375690 606147308 /nfs/dbraw/zinc/14/73/08/606147308.db2.gz FRQHYXRKRHTHNV-CYBMUJFWSA-N -1 3 366.450 3.509 20 0 FHADHM C[C@H]([C@@H](C)c1ccc(Cl)cc1)N(C)C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000820563585 606149394 /nfs/dbraw/zinc/14/93/94/606149394.db2.gz RWCOTHFLQVVPIC-CHWSQXEVSA-N -1 3 369.856 3.784 20 0 FHADHM C[C@H]([C@@H](C)c1ccc(Cl)cc1)N(C)C(=O)c1cccc(-c2nn[n-]n2)c1 ZINC000820563585 606149395 /nfs/dbraw/zinc/14/93/95/606149395.db2.gz RWCOTHFLQVVPIC-CHWSQXEVSA-N -1 3 369.856 3.784 20 0 FHADHM C[C@H]([C@@H](C)c1ccc(Cl)cc1)N(C)C(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000820562695 606149410 /nfs/dbraw/zinc/14/94/10/606149410.db2.gz ILWMCNYQMADADX-CHWSQXEVSA-N -1 3 369.856 3.784 20 0 FHADHM C[C@H]([C@@H](C)c1ccc(Cl)cc1)N(C)C(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC000820562695 606149411 /nfs/dbraw/zinc/14/94/11/606149411.db2.gz ILWMCNYQMADADX-CHWSQXEVSA-N -1 3 369.856 3.784 20 0 FHADHM CC1(C)CCN1C(=O)c1ccccc1Sc1ccccc1-c1nnn[n-]1 ZINC000820601220 606151724 /nfs/dbraw/zinc/15/17/24/606151724.db2.gz FSBKFTHNDKVNCT-UHFFFAOYSA-N -1 3 365.462 3.642 20 0 FHADHM CC1(C)CCN1C(=O)c1ccccc1Sc1ccccc1-c1nn[n-]n1 ZINC000820601220 606151725 /nfs/dbraw/zinc/15/17/25/606151725.db2.gz FSBKFTHNDKVNCT-UHFFFAOYSA-N -1 3 365.462 3.642 20 0 FHADHM Cc1ccccc1[C@H](NC(=O)Cc1cccc(-c2nnn[n-]2)c1)C(C)(C)C ZINC000822350648 606190532 /nfs/dbraw/zinc/19/05/32/606190532.db2.gz FUXCWKLUQQUUDC-IBGZPJMESA-N -1 3 363.465 3.621 20 0 FHADHM Cc1ccccc1[C@H](NC(=O)Cc1cccc(-c2nn[n-]n2)c1)C(C)(C)C ZINC000822350648 606190534 /nfs/dbraw/zinc/19/05/34/606190534.db2.gz FUXCWKLUQQUUDC-IBGZPJMESA-N -1 3 363.465 3.621 20 0 FHADHM C[C@@H](c1ccccc1)N(Cc1ccccc1)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC000820570773 606263019 /nfs/dbraw/zinc/26/30/19/606263019.db2.gz RBDLTMXJKCTYMX-HNNXBMFYSA-N -1 3 372.432 3.598 20 0 FHADHM C[C@@H](c1ccccc1)N(Cc1ccccc1)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC000820570773 606263021 /nfs/dbraw/zinc/26/30/21/606263021.db2.gz RBDLTMXJKCTYMX-HNNXBMFYSA-N -1 3 372.432 3.598 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)c1cc(Cl)cc(Cl)c1 ZINC000823343949 606264064 /nfs/dbraw/zinc/26/40/64/606264064.db2.gz LXAZVZYVQVOUKG-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)c1cc(Cl)cc(Cl)c1 ZINC000823343949 606264066 /nfs/dbraw/zinc/26/40/66/606264066.db2.gz LXAZVZYVQVOUKG-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM CC(C)CCOc1ccc(C(=O)Nc2ccc(F)cc2-c2nnn[n-]2)cc1 ZINC000820076368 606271842 /nfs/dbraw/zinc/27/18/42/606271842.db2.gz ITWDXAKMCLDPQY-UHFFFAOYSA-N -1 3 369.400 3.683 20 0 FHADHM CC(C)CCOc1ccc(C(=O)Nc2ccc(F)cc2-c2nn[n-]n2)cc1 ZINC000820076368 606271843 /nfs/dbraw/zinc/27/18/43/606271843.db2.gz ITWDXAKMCLDPQY-UHFFFAOYSA-N -1 3 369.400 3.683 20 0 FHADHM Cc1ccc(CCCCC(=O)Nc2ccc(F)cc2-c2nnn[n-]2)cc1 ZINC000822236333 606272709 /nfs/dbraw/zinc/27/27/09/606272709.db2.gz USLBUPPWEYSJPD-UHFFFAOYSA-N -1 3 353.401 3.666 20 0 FHADHM Cc1ccc(CCCCC(=O)Nc2ccc(F)cc2-c2nn[n-]n2)cc1 ZINC000822236333 606272711 /nfs/dbraw/zinc/27/27/11/606272711.db2.gz USLBUPPWEYSJPD-UHFFFAOYSA-N -1 3 353.401 3.666 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1coc2ccccc12 ZINC000821123749 606283186 /nfs/dbraw/zinc/28/31/86/606283186.db2.gz XOVOSRIJKIZIPE-UHFFFAOYSA-N -1 3 362.393 3.687 20 0 FHADHM O=C(Cc1coc2cc(F)ccc12)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000823118991 606313600 /nfs/dbraw/zinc/31/36/00/606313600.db2.gz ZEKVUNRZCCNFOD-UHFFFAOYSA-N -1 3 371.759 3.587 20 0 FHADHM O=C(Cc1coc2cc(F)ccc12)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000823118991 606313602 /nfs/dbraw/zinc/31/36/02/606313602.db2.gz ZEKVUNRZCCNFOD-UHFFFAOYSA-N -1 3 371.759 3.587 20 0 FHADHM CC[C@H](Sc1cccc(-c2nnn[n-]2)c1)C(=O)c1ccc(OC)cc1 ZINC000820937931 606327123 /nfs/dbraw/zinc/32/71/23/606327123.db2.gz FJQLAHZCCKAZCW-INIZCTEOSA-N -1 3 354.435 3.629 20 0 FHADHM CC[C@H](Sc1cccc(-c2nn[n-]n2)c1)C(=O)c1ccc(OC)cc1 ZINC000820937931 606327125 /nfs/dbraw/zinc/32/71/25/606327125.db2.gz FJQLAHZCCKAZCW-INIZCTEOSA-N -1 3 354.435 3.629 20 0 FHADHM Cc1cccc(-c2noc(CSc3cccc(-c4nnn[n-]4)c3)n2)c1 ZINC000822284593 606327590 /nfs/dbraw/zinc/32/75/90/606327590.db2.gz WHLDNWONBNNRDV-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM Cc1cccc(-c2noc(CSc3cccc(-c4nn[n-]n4)c3)n2)c1 ZINC000822284593 606327592 /nfs/dbraw/zinc/32/75/92/606327592.db2.gz WHLDNWONBNNRDV-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM CCc1noc(-c2ccc(Sc3ccccc3-c3nnn[n-]3)cc2)n1 ZINC000821554638 606327781 /nfs/dbraw/zinc/32/77/81/606327781.db2.gz PRCKCESYUMRRBW-UHFFFAOYSA-N -1 3 350.407 3.630 20 0 FHADHM CCc1noc(-c2ccc(Sc3ccccc3-c3nn[n-]n3)cc2)n1 ZINC000821554638 606327783 /nfs/dbraw/zinc/32/77/83/606327783.db2.gz PRCKCESYUMRRBW-UHFFFAOYSA-N -1 3 350.407 3.630 20 0 FHADHM Clc1ccc(-c2nc(CSc3cccc(-c4nnn[n-]4)c3)no2)cc1 ZINC000822568461 606327846 /nfs/dbraw/zinc/32/78/46/606327846.db2.gz RMQZWGISZPNBRM-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1ccc(-c2nc(CSc3cccc(-c4nn[n-]n4)c3)no2)cc1 ZINC000822568461 606327848 /nfs/dbraw/zinc/32/78/48/606327848.db2.gz RMQZWGISZPNBRM-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Brc1ccc(CSc2cccc(-c3nnn[n-]3)c2)s1 ZINC000819688330 606328884 /nfs/dbraw/zinc/32/88/84/606328884.db2.gz GUEYRUVMERMHSW-UHFFFAOYSA-N -1 3 353.270 3.983 20 0 FHADHM Brc1ccc(CSc2cccc(-c3nn[n-]n3)c2)s1 ZINC000819688330 606328886 /nfs/dbraw/zinc/32/88/86/606328886.db2.gz GUEYRUVMERMHSW-UHFFFAOYSA-N -1 3 353.270 3.983 20 0 FHADHM C[C@H](OC(=O)C1(c2ccc(Cl)cc2)CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820486713 606340585 /nfs/dbraw/zinc/34/05/85/606340585.db2.gz CKRCCDBSGPIVIJ-LBPRGKRZSA-N -1 3 368.824 3.856 20 0 FHADHM C[C@H](OC(=O)C1(c2ccc(Cl)cc2)CC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820486713 606340586 /nfs/dbraw/zinc/34/05/86/606340586.db2.gz CKRCCDBSGPIVIJ-LBPRGKRZSA-N -1 3 368.824 3.856 20 0 FHADHM CC(C)c1ccccc1OCC(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820197586 606352331 /nfs/dbraw/zinc/35/23/31/606352331.db2.gz MFRNZKHTCWSNEE-AWEZNQCLSA-N -1 3 366.421 3.673 20 0 FHADHM CC(C)c1ccccc1OCC(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820197586 606352332 /nfs/dbraw/zinc/35/23/32/606352332.db2.gz MFRNZKHTCWSNEE-AWEZNQCLSA-N -1 3 366.421 3.673 20 0 FHADHM C[C@H](OC(=O)CCOc1ccccc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000820496693 606352558 /nfs/dbraw/zinc/35/25/58/606352558.db2.gz ODBNUCDOHVSXMV-LBPRGKRZSA-N -1 3 372.812 3.593 20 0 FHADHM C[C@H](OC(=O)CCOc1ccccc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000820496693 606352560 /nfs/dbraw/zinc/35/25/60/606352560.db2.gz ODBNUCDOHVSXMV-LBPRGKRZSA-N -1 3 372.812 3.593 20 0 FHADHM Cc1nc(C(C)(C)C)sc1C(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000822423771 606353342 /nfs/dbraw/zinc/35/33/42/606353342.db2.gz OLBBXFFWADAJQU-LLVKDONJSA-N -1 3 371.466 3.847 20 0 FHADHM Cc1nc(C(C)(C)C)sc1C(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000822423771 606353344 /nfs/dbraw/zinc/35/33/44/606353344.db2.gz OLBBXFFWADAJQU-LLVKDONJSA-N -1 3 371.466 3.847 20 0 FHADHM C[C@@H](OC(=O)[C@H](C)CSc1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820292827 606354163 /nfs/dbraw/zinc/35/41/63/606354163.db2.gz HSAQASXFPOXTLN-ZIAGYGMSSA-N -1 3 368.462 3.899 20 0 FHADHM C[C@@H](OC(=O)[C@H](C)CSc1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820292827 606354164 /nfs/dbraw/zinc/35/41/64/606354164.db2.gz HSAQASXFPOXTLN-ZIAGYGMSSA-N -1 3 368.462 3.899 20 0 FHADHM C[C@H](OC(=O)CCOc1ccc(Cl)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820497450 606356042 /nfs/dbraw/zinc/35/60/42/606356042.db2.gz RSTFKGIHOLZVPQ-LBPRGKRZSA-N -1 3 372.812 3.593 20 0 FHADHM C[C@H](OC(=O)CCOc1ccc(Cl)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820497450 606356043 /nfs/dbraw/zinc/35/60/43/606356043.db2.gz RSTFKGIHOLZVPQ-LBPRGKRZSA-N -1 3 372.812 3.593 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)N1CCC[C@H]1C1CCCCC1 ZINC000823343969 606358324 /nfs/dbraw/zinc/35/83/24/606358324.db2.gz MIXDNVKOMFEKON-INIZCTEOSA-N -1 3 358.421 3.582 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)N1CCC[C@H]1C1CCCCC1 ZINC000823343969 606358326 /nfs/dbraw/zinc/35/83/26/606358326.db2.gz MIXDNVKOMFEKON-INIZCTEOSA-N -1 3 358.421 3.582 20 0 FHADHM C[C@@H](C(=O)Oc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1)C1CC1 ZINC000819883132 606360814 /nfs/dbraw/zinc/36/08/14/606360814.db2.gz FEMFLDMKLBUWQJ-GFCCVEGCSA-N -1 3 350.378 3.611 20 0 FHADHM C[C@@H](C(=O)Oc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1)C1CC1 ZINC000819883132 606360816 /nfs/dbraw/zinc/36/08/16/606360816.db2.gz FEMFLDMKLBUWQJ-GFCCVEGCSA-N -1 3 350.378 3.611 20 0 FHADHM CS/C=C\C(=O)Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1C ZINC000821955935 606360853 /nfs/dbraw/zinc/36/08/53/606360853.db2.gz CLAKJZKXHNPSDT-KTKRTIGZSA-N -1 3 367.434 3.783 20 0 FHADHM CS/C=C\C(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1C ZINC000821955935 606360855 /nfs/dbraw/zinc/36/08/55/606360855.db2.gz CLAKJZKXHNPSDT-KTKRTIGZSA-N -1 3 367.434 3.783 20 0 FHADHM Clc1ccc(-c2nc(COc3ccc(-c4nn[n-]n4)cc3)co2)cc1 ZINC000822568492 606374191 /nfs/dbraw/zinc/37/41/91/606374191.db2.gz SOVCHCJXUDWQCS-UHFFFAOYSA-N -1 3 353.769 3.754 20 0 FHADHM CSc1ccc(C(=O)N(C)c2cc(Cl)ccc2-c2nnn[n-]2)cc1 ZINC000821979717 606413230 /nfs/dbraw/zinc/41/32/30/606413230.db2.gz VKGBTPSPQKYJLK-UHFFFAOYSA-N -1 3 359.842 3.519 20 0 FHADHM CSc1ccc(C(=O)N(C)c2cc(Cl)ccc2-c2nn[n-]n2)cc1 ZINC000821979717 606413232 /nfs/dbraw/zinc/41/32/32/606413232.db2.gz VKGBTPSPQKYJLK-UHFFFAOYSA-N -1 3 359.842 3.519 20 0 FHADHM COc1ccc(OC)c([C@@H](C)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c1 ZINC000821843051 606443369 /nfs/dbraw/zinc/44/33/69/606443369.db2.gz YCQPPYGRSFTUJJ-SNVBAGLBSA-N -1 3 359.817 3.710 20 0 FHADHM COc1ccc(OC)c([C@@H](C)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c1 ZINC000821843051 606443370 /nfs/dbraw/zinc/44/33/70/606443370.db2.gz YCQPPYGRSFTUJJ-SNVBAGLBSA-N -1 3 359.817 3.710 20 0 FHADHM CCCC(=O)Nc1cccc(NCc2cc(-c3nnn[n-]3)ccc2F)c1C ZINC000821007583 606449701 /nfs/dbraw/zinc/44/97/01/606449701.db2.gz BERKEEZTICXNFX-UHFFFAOYSA-N -1 3 368.416 3.665 20 0 FHADHM CCCC(=O)Nc1cccc(NCc2cc(-c3nn[n-]n3)ccc2F)c1C ZINC000821007583 606449703 /nfs/dbraw/zinc/44/97/03/606449703.db2.gz BERKEEZTICXNFX-UHFFFAOYSA-N -1 3 368.416 3.665 20 0 FHADHM O=C(Nc1ccccc1)c1ccc(NCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000823366988 606452713 /nfs/dbraw/zinc/45/27/13/606452713.db2.gz BUYXMBOCQLFDOL-UHFFFAOYSA-N -1 3 370.416 3.731 20 0 FHADHM O=C(Nc1ccccc1)c1ccc(NCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000823366988 606452714 /nfs/dbraw/zinc/45/27/14/606452714.db2.gz BUYXMBOCQLFDOL-UHFFFAOYSA-N -1 3 370.416 3.731 20 0 FHADHM COc1ccc([C@@H](C)OC(=O)c2cc(-c3nnn[n-]3)cs2)cc1Cl ZINC000821777327 606464499 /nfs/dbraw/zinc/46/44/99/606464499.db2.gz DJEXKADUVRDLFS-MRVPVSSYSA-N -1 3 364.814 3.508 20 0 FHADHM COc1ccc([C@@H](C)OC(=O)c2cc(-c3nn[n-]n3)cs2)cc1Cl ZINC000821777327 606464501 /nfs/dbraw/zinc/46/45/01/606464501.db2.gz DJEXKADUVRDLFS-MRVPVSSYSA-N -1 3 364.814 3.508 20 0 FHADHM O=C(Oc1ccccc1SC(F)(F)F)c1cc(-c2nnn[n-]2)cs1 ZINC000823454705 606465823 /nfs/dbraw/zinc/46/58/23/606465823.db2.gz RMIGKMUCXKHSHL-UHFFFAOYSA-N -1 3 372.353 3.759 20 0 FHADHM O=C(Oc1ccccc1SC(F)(F)F)c1cc(-c2nn[n-]n2)cs1 ZINC000823454705 606465824 /nfs/dbraw/zinc/46/58/24/606465824.db2.gz RMIGKMUCXKHSHL-UHFFFAOYSA-N -1 3 372.353 3.759 20 0 FHADHM O=C(Nc1ccccc1-c1cccs1)c1cc(-c2nnn[n-]2)cs1 ZINC000823367024 606486621 /nfs/dbraw/zinc/48/66/21/606486621.db2.gz DPEBIRXUBLACOX-UHFFFAOYSA-N -1 3 353.432 3.909 20 0 FHADHM O=C(Nc1ccccc1-c1cccs1)c1cc(-c2nn[n-]n2)cs1 ZINC000823367024 606486622 /nfs/dbraw/zinc/48/66/22/606486622.db2.gz DPEBIRXUBLACOX-UHFFFAOYSA-N -1 3 353.432 3.909 20 0 FHADHM Cc1ccc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCC3)c(F)c1 ZINC000822227857 606489206 /nfs/dbraw/zinc/48/92/06/606489206.db2.gz YGIUJEVLPWQRRK-UHFFFAOYSA-N -1 3 357.414 3.507 20 0 FHADHM Cc1ccc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCC3)c(F)c1 ZINC000822227857 606489207 /nfs/dbraw/zinc/48/92/07/606489207.db2.gz YGIUJEVLPWQRRK-UHFFFAOYSA-N -1 3 357.414 3.507 20 0 FHADHM C[C@H](NC(=O)c1cc(-c2nnn[n-]2)cs1)c1cc(Cl)ccc1Cl ZINC000820391104 606489889 /nfs/dbraw/zinc/48/98/89/606489889.db2.gz NDBUTJNGFSBHKL-ZETCQYMHSA-N -1 3 368.249 3.726 20 0 FHADHM C[C@H](NC(=O)c1cc(-c2nn[n-]n2)cs1)c1cc(Cl)ccc1Cl ZINC000820391104 606489891 /nfs/dbraw/zinc/48/98/91/606489891.db2.gz NDBUTJNGFSBHKL-ZETCQYMHSA-N -1 3 368.249 3.726 20 0 FHADHM C[C@@H](c1ccc(Cl)cc1)N(C(=O)c1cc(-c2nnn[n-]2)cs1)C1CC1 ZINC000820564113 606490371 /nfs/dbraw/zinc/49/03/71/606490371.db2.gz YQXTXUQJSPBZBL-JTQLQIEISA-N -1 3 373.869 3.947 20 0 FHADHM C[C@@H](c1ccc(Cl)cc1)N(C(=O)c1cc(-c2nn[n-]n2)cs1)C1CC1 ZINC000820564113 606490373 /nfs/dbraw/zinc/49/03/73/606490373.db2.gz YQXTXUQJSPBZBL-JTQLQIEISA-N -1 3 373.869 3.947 20 0 FHADHM O=C(Cc1cccc(-c2nnn[n-]2)c1)Nc1ccc2c(c1)Cc1ccccc1-2 ZINC000823103644 606490973 /nfs/dbraw/zinc/49/09/73/606490973.db2.gz KCKGOGBXNAIPCY-UHFFFAOYSA-N -1 3 367.412 3.619 20 0 FHADHM O=C(Cc1cccc(-c2nn[n-]n2)c1)Nc1ccc2c(c1)Cc1ccccc1-2 ZINC000823103644 606490974 /nfs/dbraw/zinc/49/09/74/606490974.db2.gz KCKGOGBXNAIPCY-UHFFFAOYSA-N -1 3 367.412 3.619 20 0 FHADHM Cc1c(Cl)cc(NC(=O)c2cc(-c3nnn[n-]3)cs2)cc1Cl ZINC000822035618 606499179 /nfs/dbraw/zinc/49/91/79/606499179.db2.gz XRADJIBHFORKJR-UHFFFAOYSA-N -1 3 354.222 3.796 20 0 FHADHM Cc1c(Cl)cc(NC(=O)c2cc(-c3nn[n-]n3)cs2)cc1Cl ZINC000822035618 606499181 /nfs/dbraw/zinc/49/91/81/606499181.db2.gz XRADJIBHFORKJR-UHFFFAOYSA-N -1 3 354.222 3.796 20 0 FHADHM CC1(C)CN(C(=O)c2cc(-c3nnn[n-]3)cs2)c2cccc(Cl)c21 ZINC000820601626 606500462 /nfs/dbraw/zinc/50/04/62/606500462.db2.gz PMPWFUFBPVXGMV-UHFFFAOYSA-N -1 3 359.842 3.520 20 0 FHADHM CC1(C)CN(C(=O)c2cc(-c3nn[n-]n3)cs2)c2cccc(Cl)c21 ZINC000820601626 606500464 /nfs/dbraw/zinc/50/04/64/606500464.db2.gz PMPWFUFBPVXGMV-UHFFFAOYSA-N -1 3 359.842 3.520 20 0 FHADHM C[C@@H](NC(=O)Cc1cccc(-c2nnn[n-]2)c1)c1ccc(C(C)(C)C)cc1 ZINC000820333461 606504885 /nfs/dbraw/zinc/50/48/85/606504885.db2.gz CNPQCSKZBRSVLE-CQSZACIVSA-N -1 3 363.465 3.584 20 0 FHADHM C[C@@H](NC(=O)Cc1cccc(-c2nn[n-]n2)c1)c1ccc(C(C)(C)C)cc1 ZINC000820333461 606504886 /nfs/dbraw/zinc/50/48/86/606504886.db2.gz CNPQCSKZBRSVLE-CQSZACIVSA-N -1 3 363.465 3.584 20 0 FHADHM CC(C)[C@@H](NC(=O)c1cc(-c2nnn[n-]2)cs1)c1ccccc1Cl ZINC000820027879 606511941 /nfs/dbraw/zinc/51/19/41/606511941.db2.gz VCSHGMCTFQZCIO-CQSZACIVSA-N -1 3 361.858 3.709 20 0 FHADHM CC(C)[C@@H](NC(=O)c1cc(-c2nn[n-]n2)cs1)c1ccccc1Cl ZINC000820027879 606511943 /nfs/dbraw/zinc/51/19/43/606511943.db2.gz VCSHGMCTFQZCIO-CQSZACIVSA-N -1 3 361.858 3.709 20 0 FHADHM Cc1ccc([C@@H]2CCCCCN2C(=O)c2cc(-c3nnn[n-]3)cs2)o1 ZINC000822233223 606516105 /nfs/dbraw/zinc/51/61/05/606516105.db2.gz KTFAZFWOMCEICQ-ZDUSSCGKSA-N -1 3 357.439 3.587 20 0 FHADHM Cc1ccc([C@@H]2CCCCCN2C(=O)c2cc(-c3nn[n-]n3)cs2)o1 ZINC000822233223 606516107 /nfs/dbraw/zinc/51/61/07/606516107.db2.gz KTFAZFWOMCEICQ-ZDUSSCGKSA-N -1 3 357.439 3.587 20 0 FHADHM CC(C)(C)Sc1ccc(NC(=O)Cc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000819951600 606545278 /nfs/dbraw/zinc/54/52/78/606545278.db2.gz UPFZNZMNVGWSAU-UHFFFAOYSA-N -1 3 367.478 3.939 20 0 FHADHM CC(C)(C)Sc1ccc(NC(=O)Cc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000819951600 606545280 /nfs/dbraw/zinc/54/52/80/606545280.db2.gz UPFZNZMNVGWSAU-UHFFFAOYSA-N -1 3 367.478 3.939 20 0 FHADHM C[C@@H](OC(=O)c1cc(-c2nnn[n-]2)cs1)c1ncc(-c2ccccc2)o1 ZINC000820508475 606570279 /nfs/dbraw/zinc/57/02/79/606570279.db2.gz PKFUMYDYKNBROQ-SNVBAGLBSA-N -1 3 367.390 3.501 20 0 FHADHM C[C@@H](OC(=O)c1cc(-c2nn[n-]n2)cs1)c1ncc(-c2ccccc2)o1 ZINC000820508475 606570281 /nfs/dbraw/zinc/57/02/81/606570281.db2.gz PKFUMYDYKNBROQ-SNVBAGLBSA-N -1 3 367.390 3.501 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)C[C@@H](C)c2cccc(OC)c2)s1 ZINC000821465417 606602303 /nfs/dbraw/zinc/60/23/03/606602303.db2.gz GLHWLJSDUUSVNP-LLVKDONJSA-N -1 3 371.466 3.632 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)C[C@@H](C)c2cccc(OC)c2)s1 ZINC000821465417 606602304 /nfs/dbraw/zinc/60/23/04/606602304.db2.gz GLHWLJSDUUSVNP-LLVKDONJSA-N -1 3 371.466 3.632 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1OC(=O)[C@@H](C)c1ccc2ccccc2c1 ZINC000821699343 606602604 /nfs/dbraw/zinc/60/26/04/606602604.db2.gz MQVWHPIATPBWJN-ZDUSSCGKSA-N -1 3 374.400 3.738 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1OC(=O)[C@@H](C)c1ccc2ccccc2c1 ZINC000821699343 606602606 /nfs/dbraw/zinc/60/26/06/606602606.db2.gz MQVWHPIATPBWJN-ZDUSSCGKSA-N -1 3 374.400 3.738 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)CCCc1cc(C)sc1C ZINC000821757565 606602806 /nfs/dbraw/zinc/60/28/06/606602806.db2.gz YRDNOWPIHCVMFA-UHFFFAOYSA-N -1 3 371.466 3.515 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)CCCc1cc(C)sc1C ZINC000821757565 606602807 /nfs/dbraw/zinc/60/28/07/606602807.db2.gz YRDNOWPIHCVMFA-UHFFFAOYSA-N -1 3 371.466 3.515 20 0 FHADHM Cc1cc(CCCC(=O)Nc2ccc(F)cc2-c2nnn[n-]2)c(C)s1 ZINC000822199974 606604279 /nfs/dbraw/zinc/60/42/79/606604279.db2.gz PEWHORXAZZOCEY-UHFFFAOYSA-N -1 3 359.430 3.646 20 0 FHADHM Cc1cc(CCCC(=O)Nc2ccc(F)cc2-c2nn[n-]n2)c(C)s1 ZINC000822199974 606604281 /nfs/dbraw/zinc/60/42/81/606604281.db2.gz PEWHORXAZZOCEY-UHFFFAOYSA-N -1 3 359.430 3.646 20 0 FHADHM COc1cccc([C@H](C)CC(=O)O[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000821860032 606604322 /nfs/dbraw/zinc/60/43/22/606604322.db2.gz WLAHILMVHOEPAD-ZIAGYGMSSA-N -1 3 366.421 3.673 20 0 FHADHM COc1cccc([C@H](C)CC(=O)O[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000821860032 606604324 /nfs/dbraw/zinc/60/43/24/606604324.db2.gz WLAHILMVHOEPAD-ZIAGYGMSSA-N -1 3 366.421 3.673 20 0 FHADHM Cc1nnc(Nc2ccc(CCC(F)(F)F)cc2)c(-c2nnn[n-]2)c1C ZINC000822515796 606609815 /nfs/dbraw/zinc/60/98/15/606609815.db2.gz PEILFTKJNQRGMI-UHFFFAOYSA-N -1 3 363.347 3.512 20 0 FHADHM Cc1nnc(Nc2ccc(CCC(F)(F)F)cc2)c(-c2nn[n-]n2)c1C ZINC000822515796 606609817 /nfs/dbraw/zinc/60/98/17/606609817.db2.gz PEILFTKJNQRGMI-UHFFFAOYSA-N -1 3 363.347 3.512 20 0 FHADHM COc1cccc([C@@H](C)CC(=O)O[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000821859364 606613064 /nfs/dbraw/zinc/61/30/64/606613064.db2.gz NNIOMBGPHXHERI-UONOGXRCSA-N -1 3 366.421 3.673 20 0 FHADHM COc1cccc([C@@H](C)CC(=O)O[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000821859364 606613065 /nfs/dbraw/zinc/61/30/65/606613065.db2.gz NNIOMBGPHXHERI-UONOGXRCSA-N -1 3 366.421 3.673 20 0 FHADHM Cc1sc(NC(=O)C/C=C\c2ccc(C)cc2)c(-c2nnn[n-]2)c1C ZINC000822233689 606621396 /nfs/dbraw/zinc/62/13/96/606621396.db2.gz SUFFISMUJRASDB-PLNGDYQASA-N -1 3 353.451 3.895 20 0 FHADHM Cc1sc(NC(=O)C/C=C\c2ccc(C)cc2)c(-c2nn[n-]n2)c1C ZINC000822233689 606621398 /nfs/dbraw/zinc/62/13/98/606621398.db2.gz SUFFISMUJRASDB-PLNGDYQASA-N -1 3 353.451 3.895 20 0 FHADHM O=C(c1ccc(-c2nnn[n-]2)cc1)N1CCCCC[C@@H]1/C=C/c1ccccc1 ZINC000823478792 606626432 /nfs/dbraw/zinc/62/64/32/606626432.db2.gz SPEHDSZVOIKFQQ-XMUSRXTASA-N -1 3 373.460 3.965 20 0 FHADHM O=C(c1ccc(-c2nn[n-]n2)cc1)N1CCCCC[C@@H]1/C=C/c1ccccc1 ZINC000823478792 606626434 /nfs/dbraw/zinc/62/64/34/606626434.db2.gz SPEHDSZVOIKFQQ-XMUSRXTASA-N -1 3 373.460 3.965 20 0 FHADHM COc1cccc(-c2nc(CNc3cccc(-c4nnn[n-]4)c3)cs2)c1 ZINC000821854893 606660025 /nfs/dbraw/zinc/66/00/25/606660025.db2.gz ZVEYLDRNSIRXGN-UHFFFAOYSA-N -1 3 364.434 3.611 20 0 FHADHM COc1cccc(-c2nc(CNc3cccc(-c4nn[n-]n4)c3)cs2)c1 ZINC000821854893 606660026 /nfs/dbraw/zinc/66/00/26/606660026.db2.gz ZVEYLDRNSIRXGN-UHFFFAOYSA-N -1 3 364.434 3.611 20 0 FHADHM CC(C)CCN(C(=O)c1c(F)cc(-c2nnn[n-]2)cc1F)C1CCCC1 ZINC000820072508 606670577 /nfs/dbraw/zinc/67/05/77/606670577.db2.gz IEHAKOWBQXQXMT-UHFFFAOYSA-N -1 3 363.412 3.576 20 0 FHADHM CC(C)CCN(C(=O)c1c(F)cc(-c2nn[n-]n2)cc1F)C1CCCC1 ZINC000820072508 606670578 /nfs/dbraw/zinc/67/05/78/606670578.db2.gz IEHAKOWBQXQXMT-UHFFFAOYSA-N -1 3 363.412 3.576 20 0 FHADHM CCc1c(C)sc(NC(=O)CCO[C@@H](C)CC(C)C)c1-c1nnn[n-]1 ZINC000821465779 606677050 /nfs/dbraw/zinc/67/70/50/606677050.db2.gz OXRWUFAHUJDOPX-NSHDSACASA-N -1 3 365.503 3.579 20 0 FHADHM CCc1c(C)sc(NC(=O)CCO[C@@H](C)CC(C)C)c1-c1nn[n-]n1 ZINC000821465779 606677051 /nfs/dbraw/zinc/67/70/51/606677051.db2.gz OXRWUFAHUJDOPX-NSHDSACASA-N -1 3 365.503 3.579 20 0 FHADHM C[C@H](NC(=O)N(C)C1CCC(C)(C)CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820339239 606696112 /nfs/dbraw/zinc/69/61/12/606696112.db2.gz AJIJDKPKTIEVRT-ZDUSSCGKSA-N -1 3 356.474 3.538 20 0 FHADHM C[C@H](NC(=O)N(C)C1CCC(C)(C)CC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820339239 606696113 /nfs/dbraw/zinc/69/61/13/606696113.db2.gz AJIJDKPKTIEVRT-ZDUSSCGKSA-N -1 3 356.474 3.538 20 0 FHADHM CCOCCC1(CNc2c(F)cc(-c3nnn[n-]3)cc2F)CCCC1 ZINC000821372977 606720609 /nfs/dbraw/zinc/72/06/09/606720609.db2.gz AOTBGWMWRLOXIC-UHFFFAOYSA-N -1 3 351.401 3.544 20 0 FHADHM CCOCCC1(CNc2c(F)cc(-c3nn[n-]n3)cc2F)CCCC1 ZINC000821372977 606720610 /nfs/dbraw/zinc/72/06/10/606720610.db2.gz AOTBGWMWRLOXIC-UHFFFAOYSA-N -1 3 351.401 3.544 20 0 FHADHM COCCC1(CNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)CCC1 ZINC000821687233 606722962 /nfs/dbraw/zinc/72/29/62/606722962.db2.gz VKWNEOMQBKCHGY-UHFFFAOYSA-N -1 3 355.364 3.504 20 0 FHADHM COCCC1(CNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)CCC1 ZINC000821687233 606722964 /nfs/dbraw/zinc/72/29/64/606722964.db2.gz VKWNEOMQBKCHGY-UHFFFAOYSA-N -1 3 355.364 3.504 20 0 FHADHM CSCc1cc(F)ccc1CNc1ncc(-c2nnn[n-]2)cc1Cl ZINC000821970817 606725388 /nfs/dbraw/zinc/72/53/88/606725388.db2.gz SOMAAANIDMQWDL-UHFFFAOYSA-N -1 3 364.837 3.529 20 0 FHADHM CSCc1cc(F)ccc1CNc1ncc(-c2nn[n-]n2)cc1Cl ZINC000821970817 606725390 /nfs/dbraw/zinc/72/53/90/606725390.db2.gz SOMAAANIDMQWDL-UHFFFAOYSA-N -1 3 364.837 3.529 20 0 FHADHM CC[C@@H](OC1CCCCC1)C(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820937915 606736168 /nfs/dbraw/zinc/73/61/68/606736168.db2.gz FHCVMPPQIDYVEA-CXAGYDPISA-N -1 3 358.442 3.599 20 0 FHADHM CC[C@@H](OC1CCCCC1)C(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820937915 606736170 /nfs/dbraw/zinc/73/61/70/606736170.db2.gz FHCVMPPQIDYVEA-CXAGYDPISA-N -1 3 358.442 3.599 20 0 FHADHM CC(C)CC[C@H]1CCCCN1C(=O)CCc1ccc(-c2nnn[n-]2)cc1 ZINC000820072887 606746776 /nfs/dbraw/zinc/74/67/76/606746776.db2.gz MPRAUPHCQMRWSM-GOSISDBHSA-N -1 3 355.486 3.617 20 0 FHADHM CC(C)CC[C@H]1CCCCN1C(=O)CCc1ccc(-c2nn[n-]n2)cc1 ZINC000820072887 606746778 /nfs/dbraw/zinc/74/67/78/606746778.db2.gz MPRAUPHCQMRWSM-GOSISDBHSA-N -1 3 355.486 3.617 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1Oc1ccc(C(=O)N(C)CC(C)C)cc1 ZINC000822135545 606786291 /nfs/dbraw/zinc/78/62/91/606786291.db2.gz DIZXXCJJQXJYCX-UHFFFAOYSA-N -1 3 365.437 3.695 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1Oc1ccc(C(=O)N(C)CC(C)C)cc1 ZINC000822135545 606786294 /nfs/dbraw/zinc/78/62/94/606786294.db2.gz DIZXXCJJQXJYCX-UHFFFAOYSA-N -1 3 365.437 3.695 20 0 FHADHM FC(F)(F)c1ccccc1C1CCN(c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC000822728727 606790597 /nfs/dbraw/zinc/79/05/97/606790597.db2.gz LBROMJBUTCSRFR-UHFFFAOYSA-N -1 3 374.370 3.665 20 0 FHADHM FC(F)(F)c1ccccc1C1CCN(c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC000822728727 606790600 /nfs/dbraw/zinc/79/06/00/606790600.db2.gz LBROMJBUTCSRFR-UHFFFAOYSA-N -1 3 374.370 3.665 20 0 FHADHM CC[C@@H](C)CS[C@@H](C)C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2 ZINC000820870756 606795877 /nfs/dbraw/zinc/79/58/77/606795877.db2.gz YYIMFKQBLVLENP-ZJUUUORDSA-N -1 3 365.528 3.523 20 0 FHADHM CC[C@@H](C)CS[C@@H](C)C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2 ZINC000820870756 606795878 /nfs/dbraw/zinc/79/58/78/606795878.db2.gz YYIMFKQBLVLENP-ZJUUUORDSA-N -1 3 365.528 3.523 20 0 FHADHM CC(C)c1noc([C@@H](C)Sc2ccc(-c3nnn[n-]3)cc2Cl)n1 ZINC000820211477 606850925 /nfs/dbraw/zinc/85/09/25/606850925.db2.gz OMQXWBLJBFMVDD-MRVPVSSYSA-N -1 3 350.835 3.880 20 0 FHADHM CC(C)c1noc([C@@H](C)Sc2ccc(-c3nn[n-]n3)cc2Cl)n1 ZINC000820211477 606850927 /nfs/dbraw/zinc/85/09/27/606850927.db2.gz OMQXWBLJBFMVDD-MRVPVSSYSA-N -1 3 350.835 3.880 20 0 FHADHM CC(C)(C)c1cnc(SCCCOc2cccc(-c3nnn[n-]3)c2)o1 ZINC000819965401 606868025 /nfs/dbraw/zinc/86/80/25/606868025.db2.gz FMGAFBIBZCAYBB-UHFFFAOYSA-N -1 3 359.455 3.713 20 0 FHADHM CC(C)(C)c1cnc(SCCCOc2cccc(-c3nn[n-]n3)c2)o1 ZINC000819965401 606868028 /nfs/dbraw/zinc/86/80/28/606868028.db2.gz FMGAFBIBZCAYBB-UHFFFAOYSA-N -1 3 359.455 3.713 20 0 FHADHM CC(C)C[C@@H]1CCCCN1C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820063227 606870317 /nfs/dbraw/zinc/87/03/17/606870317.db2.gz UMSKVGLMVCVJFM-PBHICJAKSA-N -1 3 356.474 3.538 20 0 FHADHM CC(C)C[C@@H]1CCCCN1C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820063227 606870319 /nfs/dbraw/zinc/87/03/19/606870319.db2.gz UMSKVGLMVCVJFM-PBHICJAKSA-N -1 3 356.474 3.538 20 0 FHADHM CC(C)C[C@@H]1CCCCN1C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000820061740 606870424 /nfs/dbraw/zinc/87/04/24/606870424.db2.gz FLRRAQQVPHAXRN-HNNXBMFYSA-N -1 3 373.505 3.856 20 0 FHADHM CC(C)C[C@@H]1CCCCN1C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000820061740 606870426 /nfs/dbraw/zinc/87/04/26/606870426.db2.gz FLRRAQQVPHAXRN-HNNXBMFYSA-N -1 3 373.505 3.856 20 0 FHADHM CC(C)CN(C(=O)c1cccc(Cl)c1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000820081298 606871068 /nfs/dbraw/zinc/87/10/68/606871068.db2.gz AUYZEKHBIYUEID-UHFFFAOYSA-N -1 3 373.819 3.962 20 0 FHADHM CC(C)CN(C(=O)c1cccc(Cl)c1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000820081298 606871070 /nfs/dbraw/zinc/87/10/70/606871070.db2.gz AUYZEKHBIYUEID-UHFFFAOYSA-N -1 3 373.819 3.962 20 0 FHADHM Clc1cc(N2CCC[C@H](Nc3ccccc3)C2)ccc1-c1nnn[n-]1 ZINC000822567824 606875826 /nfs/dbraw/zinc/87/58/26/606875826.db2.gz HYBXAEUCTHGONR-AWEZNQCLSA-N -1 3 354.845 3.601 20 0 FHADHM Clc1cc(N2CCC[C@H](Nc3ccccc3)C2)ccc1-c1nn[n-]n1 ZINC000822567824 606875827 /nfs/dbraw/zinc/87/58/27/606875827.db2.gz HYBXAEUCTHGONR-AWEZNQCLSA-N -1 3 354.845 3.601 20 0 FHADHM O[C@H](CNc1ccc(-c2nnn[n-]2)c(Cl)c1)c1cc2ccccc2s1 ZINC000823689703 606878023 /nfs/dbraw/zinc/87/80/23/606878023.db2.gz IRXJFGBOPGUTOR-CQSZACIVSA-N -1 3 371.853 3.880 20 0 FHADHM O[C@H](CNc1ccc(-c2nn[n-]n2)c(Cl)c1)c1cc2ccccc2s1 ZINC000823689703 606878024 /nfs/dbraw/zinc/87/80/24/606878024.db2.gz IRXJFGBOPGUTOR-CQSZACIVSA-N -1 3 371.853 3.880 20 0 FHADHM O[C@@H](CNc1ccc(Cl)cc1-c1nnn[n-]1)c1cc2ccccc2s1 ZINC000823690264 606878068 /nfs/dbraw/zinc/87/80/68/606878068.db2.gz MQPGHHOHNQFDGQ-AWEZNQCLSA-N -1 3 371.853 3.880 20 0 FHADHM O[C@@H](CNc1ccc(Cl)cc1-c1nn[n-]n1)c1cc2ccccc2s1 ZINC000823690264 606878069 /nfs/dbraw/zinc/87/80/69/606878069.db2.gz MQPGHHOHNQFDGQ-AWEZNQCLSA-N -1 3 371.853 3.880 20 0 FHADHM Fc1ccc(N[C@H]2CC3(CCC3)Oc3ccccc32)c(-c2nnn[n-]2)c1 ZINC000822778043 606879885 /nfs/dbraw/zinc/87/98/85/606879885.db2.gz BCPXVFIAHIYYMF-INIZCTEOSA-N -1 3 351.385 3.864 20 0 FHADHM Fc1ccc(N[C@H]2CC3(CCC3)Oc3ccccc32)c(-c2nn[n-]n2)c1 ZINC000822778043 606879887 /nfs/dbraw/zinc/87/98/87/606879887.db2.gz BCPXVFIAHIYYMF-INIZCTEOSA-N -1 3 351.385 3.864 20 0 FHADHM FC(F)(F)c1ccc(N2CCC[C@@H](C(F)(F)F)C2)c(-c2nnn[n-]2)c1 ZINC000822723231 606916331 /nfs/dbraw/zinc/91/63/31/606916331.db2.gz ASMOATRDCQUPDB-SECBINFHSA-N -1 3 365.281 3.664 20 0 FHADHM FC(F)(F)c1ccc(N2CCC[C@@H](C(F)(F)F)C2)c(-c2nn[n-]n2)c1 ZINC000822723231 606916333 /nfs/dbraw/zinc/91/63/33/606916333.db2.gz ASMOATRDCQUPDB-SECBINFHSA-N -1 3 365.281 3.664 20 0 FHADHM FC(F)(F)c1ccc(N2CCC[C@@H]2c2cccnc2)c(-c2nnn[n-]2)c1 ZINC000822723455 606918165 /nfs/dbraw/zinc/91/81/65/606918165.db2.gz FNYVOYTUDFJMOV-CQSZACIVSA-N -1 3 360.343 3.622 20 0 FHADHM FC(F)(F)c1ccc(N2CCC[C@@H]2c2cccnc2)c(-c2nn[n-]n2)c1 ZINC000822723455 606918166 /nfs/dbraw/zinc/91/81/66/606918166.db2.gz FNYVOYTUDFJMOV-CQSZACIVSA-N -1 3 360.343 3.622 20 0 FHADHM CCN(C[C@H](O)c1ccc(-c2nnn[n-]2)cc1)c1ccc2ccccc2c1 ZINC000821170821 606922902 /nfs/dbraw/zinc/92/29/02/606922902.db2.gz XDJKLLSDTKQRNT-FQEVSTJZSA-N -1 3 359.433 3.580 20 0 FHADHM CCN(C[C@H](O)c1ccc(-c2nn[n-]n2)cc1)c1ccc2ccccc2c1 ZINC000821170821 606922903 /nfs/dbraw/zinc/92/29/03/606922903.db2.gz XDJKLLSDTKQRNT-FQEVSTJZSA-N -1 3 359.433 3.580 20 0 FHADHM FC(F)(F)c1ccc(NCc2ccc(Cl)nc2)c(-c2nnn[n-]2)c1 ZINC000822729137 606923228 /nfs/dbraw/zinc/92/32/28/606923228.db2.gz UHCRRGGWEHZQAR-UHFFFAOYSA-N -1 3 354.723 3.546 20 0 FHADHM FC(F)(F)c1ccc(NCc2ccc(Cl)nc2)c(-c2nn[n-]n2)c1 ZINC000822729137 606923230 /nfs/dbraw/zinc/92/32/30/606923230.db2.gz UHCRRGGWEHZQAR-UHFFFAOYSA-N -1 3 354.723 3.546 20 0 FHADHM C[C@H](Nc1ccc(C(F)(F)F)cc1-c1nnn[n-]1)c1nc2ccccc2[nH]1 ZINC000820456956 606923958 /nfs/dbraw/zinc/92/39/58/606923958.db2.gz XUQBJKSWGWCTDE-VIFPVBQESA-N -1 3 373.342 3.935 20 0 FHADHM C[C@H](Nc1ccc(C(F)(F)F)cc1-c1nn[n-]n1)c1nc2ccccc2[nH]1 ZINC000820456956 606923959 /nfs/dbraw/zinc/92/39/59/606923959.db2.gz XUQBJKSWGWCTDE-VIFPVBQESA-N -1 3 373.342 3.935 20 0 FHADHM CCC1(CNc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)CCOCC1 ZINC000820962639 606939961 /nfs/dbraw/zinc/93/99/61/606939961.db2.gz WZKSXRJLDHTSET-UHFFFAOYSA-N -1 3 355.364 3.504 20 0 FHADHM CCC1(CNc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)CCOCC1 ZINC000820962639 606939962 /nfs/dbraw/zinc/93/99/62/606939962.db2.gz WZKSXRJLDHTSET-UHFFFAOYSA-N -1 3 355.364 3.504 20 0 FHADHM CC[C@@]1(C)CCN(C(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)C1 ZINC000820950558 606957511 /nfs/dbraw/zinc/95/75/11/606957511.db2.gz PLEOKRGRFMZHCX-NRFANRHFSA-N -1 3 361.449 3.796 20 0 FHADHM CC[C@@]1(C)CCN(C(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)C1 ZINC000820950558 606957512 /nfs/dbraw/zinc/95/75/12/606957512.db2.gz PLEOKRGRFMZHCX-NRFANRHFSA-N -1 3 361.449 3.796 20 0 FHADHM CC[C@]1(C)CCN(C(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)C1 ZINC000820950559 606957699 /nfs/dbraw/zinc/95/76/99/606957699.db2.gz PLEOKRGRFMZHCX-OAQYLSRUSA-N -1 3 361.449 3.796 20 0 FHADHM CC[C@]1(C)CCN(C(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)C1 ZINC000820950559 606957700 /nfs/dbraw/zinc/95/77/00/606957700.db2.gz PLEOKRGRFMZHCX-OAQYLSRUSA-N -1 3 361.449 3.796 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1cccc(Cl)c1F ZINC000823308512 606957723 /nfs/dbraw/zinc/95/77/23/606957723.db2.gz CSJCFUGZNFKVRQ-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1cccc(Cl)c1F ZINC000823308512 606957725 /nfs/dbraw/zinc/95/77/25/606957725.db2.gz CSJCFUGZNFKVRQ-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM C[C@H](SCc1cccc2nsnc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000820548697 606986935 /nfs/dbraw/zinc/98/69/35/606986935.db2.gz FMJBINWISPCULH-JTQLQIEISA-N -1 3 354.464 3.866 20 0 FHADHM C[C@H](SCc1cccc2nsnc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000820548697 606986938 /nfs/dbraw/zinc/98/69/38/606986938.db2.gz FMJBINWISPCULH-JTQLQIEISA-N -1 3 354.464 3.866 20 0 FHADHM Cc1ccccc1[C@H](C)SCC(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000822344888 606989153 /nfs/dbraw/zinc/98/91/53/606989153.db2.gz CMKKBJJEHMKINW-ZDUSSCGKSA-N -1 3 353.451 3.608 20 0 FHADHM Cc1ccccc1[C@H](C)SCC(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000822344888 606989155 /nfs/dbraw/zinc/98/91/55/606989155.db2.gz CMKKBJJEHMKINW-ZDUSSCGKSA-N -1 3 353.451 3.608 20 0 FHADHM Fc1ccc(CSc2nnc(-c3ccccc3)s2)cc1-c1nnn[n-]1 ZINC000822774131 607008824 /nfs/dbraw/zinc/00/88/24/607008824.db2.gz FIXUYQHZGHUMJY-UHFFFAOYSA-N -1 3 370.438 3.817 20 0 FHADHM Fc1ccc(CSc2nnc(-c3ccccc3)s2)cc1-c1nn[n-]n1 ZINC000822774131 607008825 /nfs/dbraw/zinc/00/88/25/607008825.db2.gz FIXUYQHZGHUMJY-UHFFFAOYSA-N -1 3 370.438 3.817 20 0 FHADHM CCc1ccccc1NC(=O)[C@H](C)Sc1cccc(-c2nnn[n-]2)c1 ZINC000821497459 607014947 /nfs/dbraw/zinc/01/49/47/607014947.db2.gz STHNRUQOXSKZCX-LBPRGKRZSA-N -1 3 353.451 3.548 20 0 FHADHM CCc1ccccc1NC(=O)[C@H](C)Sc1cccc(-c2nn[n-]n2)c1 ZINC000821497459 607014949 /nfs/dbraw/zinc/01/49/49/607014949.db2.gz STHNRUQOXSKZCX-LBPRGKRZSA-N -1 3 353.451 3.548 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1OCc1coc(-c2ccc(F)cc2)n1 ZINC000822221108 607029134 /nfs/dbraw/zinc/02/91/34/607029134.db2.gz AFXFEKYYBUFTPL-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1OCc1coc(-c2ccc(F)cc2)n1 ZINC000822221108 607029136 /nfs/dbraw/zinc/02/91/36/607029136.db2.gz AFXFEKYYBUFTPL-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1OCc1csc(Cc2ccccc2)n1 ZINC000822221306 607029496 /nfs/dbraw/zinc/02/94/96/607029496.db2.gz JQGXQZFEPFWGRG-UHFFFAOYSA-N -1 3 363.446 3.801 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1OCc1csc(Cc2ccccc2)n1 ZINC000822221306 607029499 /nfs/dbraw/zinc/02/94/99/607029499.db2.gz JQGXQZFEPFWGRG-UHFFFAOYSA-N -1 3 363.446 3.801 20 0 FHADHM CC(C)(C)OC1CCN(c2ccc(-c3nn[n-]n3)cc2C(F)(F)F)CC1 ZINC000819946503 607043620 /nfs/dbraw/zinc/04/36/20/607043620.db2.gz MKGOUFPYTQZKJO-UHFFFAOYSA-N -1 3 369.391 3.669 20 0 FHADHM Cc1cccc(NC(=O)C(C)(C)Oc2ccc(-c3nnn[n-]3)cc2)c1Cl ZINC000822324066 607053319 /nfs/dbraw/zinc/05/33/19/607053319.db2.gz UCQNRBDCTZDIPM-UHFFFAOYSA-N -1 3 371.828 3.625 20 0 FHADHM Cc1cccc(NC(=O)C(C)(C)Oc2ccc(-c3nn[n-]n3)cc2)c1Cl ZINC000822324066 607053321 /nfs/dbraw/zinc/05/33/21/607053321.db2.gz UCQNRBDCTZDIPM-UHFFFAOYSA-N -1 3 371.828 3.625 20 0 FHADHM O=C(c1cccc(-c2nnn[n-]2)c1)N1CCc2cc(-c3ccccc3)ccc21 ZINC000823493212 607056836 /nfs/dbraw/zinc/05/68/36/607056836.db2.gz IKUNZPPPTXPSSU-UHFFFAOYSA-N -1 3 367.412 3.737 20 0 FHADHM O=C(c1cccc(-c2nn[n-]n2)c1)N1CCc2cc(-c3ccccc3)ccc21 ZINC000823493212 607056837 /nfs/dbraw/zinc/05/68/37/607056837.db2.gz IKUNZPPPTXPSSU-UHFFFAOYSA-N -1 3 367.412 3.737 20 0 FHADHM O=C(CCc1ccc(-c2nnn[n-]2)cc1)O[C@H]1CCc2sc(Cl)cc21 ZINC000822978388 607094117 /nfs/dbraw/zinc/09/41/17/607094117.db2.gz IXRTYHLVFUADBU-ZDUSSCGKSA-N -1 3 374.853 3.745 20 0 FHADHM O=C(CCc1ccc(-c2nn[n-]n2)cc1)O[C@H]1CCc2sc(Cl)cc21 ZINC000822978388 607094119 /nfs/dbraw/zinc/09/41/19/607094119.db2.gz IXRTYHLVFUADBU-ZDUSSCGKSA-N -1 3 374.853 3.745 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1ccc2ccccc2c1 ZINC000821305164 607102375 /nfs/dbraw/zinc/10/23/75/607102375.db2.gz ZUEGPAGSOLJFDA-UHFFFAOYSA-N -1 3 358.405 3.704 20 0 FHADHM C[C@@H](Nc1ccn([C@@H](C)c2ccccc2)n1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820461792 607112387 /nfs/dbraw/zinc/11/23/87/607112387.db2.gz QXWVRPIRYVVTPF-CABCVRRESA-N -1 3 359.437 3.846 20 0 FHADHM C[C@@H](Nc1ccn([C@@H](C)c2ccccc2)n1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820461792 607112388 /nfs/dbraw/zinc/11/23/88/607112388.db2.gz QXWVRPIRYVVTPF-CABCVRRESA-N -1 3 359.437 3.846 20 0 FHADHM C[C@@H]1CN(c2ccc(Cl)cc2-c2nnn[n-]2)C[C@@H](c2ccsc2)O1 ZINC000820776441 607116782 /nfs/dbraw/zinc/11/67/82/607116782.db2.gz MASZWLIGYYBMBN-BMIGLBTASA-N -1 3 361.858 3.548 20 0 FHADHM C[C@@H]1CN(c2ccc(Cl)cc2-c2nn[n-]n2)C[C@@H](c2ccsc2)O1 ZINC000820776441 607116784 /nfs/dbraw/zinc/11/67/84/607116784.db2.gz MASZWLIGYYBMBN-BMIGLBTASA-N -1 3 361.858 3.548 20 0 FHADHM Fc1ccc(-c2cnc(CNc3ccc(-c4nn[n-]n4)cc3Cl)o2)cc1 ZINC000822753267 607124385 /nfs/dbraw/zinc/12/43/85/607124385.db2.gz LBLAUYAVKZYQSC-UHFFFAOYSA-N -1 3 370.775 3.926 20 0 FHADHM Cc1coc(-c2ccc(C)c(NCc3cc(-c4nnn[n-]4)ccc3F)c2)n1 ZINC000822402429 607125371 /nfs/dbraw/zinc/12/53/71/607125371.db2.gz ASHYZPRNIMRONI-UHFFFAOYSA-N -1 3 364.384 3.890 20 0 FHADHM Cc1coc(-c2ccc(C)c(NCc3cc(-c4nn[n-]n4)ccc3F)c2)n1 ZINC000822402429 607125372 /nfs/dbraw/zinc/12/53/72/607125372.db2.gz ASHYZPRNIMRONI-UHFFFAOYSA-N -1 3 364.384 3.890 20 0 FHADHM Cc1ccn(-c2ccccc2CNc2cc(Cl)ccc2-c2nnn[n-]2)n1 ZINC000822369165 607126029 /nfs/dbraw/zinc/12/60/29/607126029.db2.gz CBEXEQCEMBFSJD-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM Cc1ccn(-c2ccccc2CNc2cc(Cl)ccc2-c2nn[n-]n2)n1 ZINC000822369165 607126031 /nfs/dbraw/zinc/12/60/31/607126031.db2.gz CBEXEQCEMBFSJD-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1)[C@H]1CC12CCC2 ZINC000823350139 607128155 /nfs/dbraw/zinc/12/81/55/607128155.db2.gz ALLBZFFFKLRZJG-QGZVFWFLSA-N -1 3 361.405 3.788 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1)[C@H]1CC12CCC2 ZINC000823350139 607128156 /nfs/dbraw/zinc/12/81/56/607128156.db2.gz ALLBZFFFKLRZJG-QGZVFWFLSA-N -1 3 361.405 3.788 20 0 FHADHM FC(F)(F)c1ccc(N[C@@H]2CCOC3(CCCC3)C2)c(-c2nnn[n-]2)c1 ZINC000822724019 607130259 /nfs/dbraw/zinc/13/02/59/607130259.db2.gz WNKUYORFIDDDPE-GFCCVEGCSA-N -1 3 367.375 3.789 20 0 FHADHM FC(F)(F)c1ccc(N[C@@H]2CCOC3(CCCC3)C2)c(-c2nn[n-]n2)c1 ZINC000822724019 607130260 /nfs/dbraw/zinc/13/02/60/607130260.db2.gz WNKUYORFIDDDPE-GFCCVEGCSA-N -1 3 367.375 3.789 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1OCc1cccc(OCC(F)(F)F)c1 ZINC000822748134 607139997 /nfs/dbraw/zinc/13/99/97/607139997.db2.gz JMDGIMHGSDMBSW-UHFFFAOYSA-N -1 3 368.290 3.526 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1OCc1cccc(OCC(F)(F)F)c1 ZINC000822748134 607139999 /nfs/dbraw/zinc/13/99/99/607139999.db2.gz JMDGIMHGSDMBSW-UHFFFAOYSA-N -1 3 368.290 3.526 20 0 FHADHM C[C@@H](Sc1cc(-c2nnn[n-]2)ccn1)c1cccc(Br)c1 ZINC000820549243 607160746 /nfs/dbraw/zinc/16/07/46/607160746.db2.gz LFCOCANYNPVIIP-SECBINFHSA-N -1 3 362.256 3.878 20 0 FHADHM C[C@@H](Sc1cc(-c2nn[n-]n2)ccn1)c1cccc(Br)c1 ZINC000820549243 607160747 /nfs/dbraw/zinc/16/07/47/607160747.db2.gz LFCOCANYNPVIIP-SECBINFHSA-N -1 3 362.256 3.878 20 0 FHADHM Cc1cccc(-c2cncc(C(=O)OCc3ccc(-c4nnn[n-]4)cc3)c2)c1 ZINC000822284610 607179428 /nfs/dbraw/zinc/17/94/28/607179428.db2.gz WVSDUTRDPSDEHB-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM Cc1cccc(-c2cncc(C(=O)OCc3ccc(-c4nn[n-]n4)cc3)c2)c1 ZINC000822284610 607179429 /nfs/dbraw/zinc/17/94/29/607179429.db2.gz WVSDUTRDPSDEHB-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000819764776 607189648 /nfs/dbraw/zinc/18/96/48/607189648.db2.gz KYTXXHLUKIMYSM-CSKARUKUSA-N -1 3 357.776 3.701 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000819764776 607189649 /nfs/dbraw/zinc/18/96/49/607189649.db2.gz KYTXXHLUKIMYSM-CSKARUKUSA-N -1 3 357.776 3.701 20 0 FHADHM C[C@@H](CC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1cccc(F)c1 ZINC000820225970 607191714 /nfs/dbraw/zinc/19/17/14/607191714.db2.gz QYTYBNIHVYNYGL-JTQLQIEISA-N -1 3 359.792 3.792 20 0 FHADHM C[C@@H](CC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1cccc(F)c1 ZINC000820225970 607191715 /nfs/dbraw/zinc/19/17/15/607191715.db2.gz QYTYBNIHVYNYGL-JTQLQIEISA-N -1 3 359.792 3.792 20 0 FHADHM O=C(CCc1ccc(Cl)s1)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822978836 607192139 /nfs/dbraw/zinc/19/21/39/607192139.db2.gz SICHXYCOPUUERR-UHFFFAOYSA-N -1 3 368.249 3.806 20 0 FHADHM O=C(CCc1ccc(Cl)s1)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822978836 607192140 /nfs/dbraw/zinc/19/21/40/607192140.db2.gz SICHXYCOPUUERR-UHFFFAOYSA-N -1 3 368.249 3.806 20 0 FHADHM CCC[C@H](NC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccccn1 ZINC000821022250 607194560 /nfs/dbraw/zinc/19/45/60/607194560.db2.gz QOJHEAUECXFCGU-HNNXBMFYSA-N -1 3 371.832 3.578 20 0 FHADHM CCC[C@H](NC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccccn1 ZINC000821022250 607194561 /nfs/dbraw/zinc/19/45/61/607194561.db2.gz QOJHEAUECXFCGU-HNNXBMFYSA-N -1 3 371.832 3.578 20 0 FHADHM O=C(NCc1ccc(Cl)s1)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000823249489 607196074 /nfs/dbraw/zinc/19/60/74/607196074.db2.gz ANUBXRRXJMSUNM-UHFFFAOYSA-N -1 3 369.237 3.557 20 0 FHADHM O=C(NCc1ccc(Cl)s1)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000823249489 607196075 /nfs/dbraw/zinc/19/60/75/607196075.db2.gz ANUBXRRXJMSUNM-UHFFFAOYSA-N -1 3 369.237 3.557 20 0 FHADHM Cc1ccccc1[C@@H](C)NC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822344924 607198549 /nfs/dbraw/zinc/19/85/49/607198549.db2.gz CYWKASZPQFAZHV-LLVKDONJSA-N -1 3 356.817 3.711 20 0 FHADHM Cc1ccccc1[C@@H](C)NC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822344924 607198550 /nfs/dbraw/zinc/19/85/50/607198550.db2.gz CYWKASZPQFAZHV-LLVKDONJSA-N -1 3 356.817 3.711 20 0 FHADHM CCC[C@@H]1[C@@H](C)CCCN1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000821034806 607199221 /nfs/dbraw/zinc/19/92/21/607199221.db2.gz UIFOYZFAQWGTEP-XHDPSFHLSA-N -1 3 362.865 3.953 20 0 FHADHM CCC[C@@H]1[C@@H](C)CCCN1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000821034806 607199222 /nfs/dbraw/zinc/19/92/22/607199222.db2.gz UIFOYZFAQWGTEP-XHDPSFHLSA-N -1 3 362.865 3.953 20 0 FHADHM C[C@H](NC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)[C@@H](C)c1ccccc1 ZINC000820374850 607204412 /nfs/dbraw/zinc/20/44/12/607204412.db2.gz ROGTVCORMXMVHE-NEPJUHHUSA-N -1 3 370.844 3.834 20 0 FHADHM C[C@H](NC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)[C@@H](C)c1ccccc1 ZINC000820374850 607204413 /nfs/dbraw/zinc/20/44/13/607204413.db2.gz ROGTVCORMXMVHE-NEPJUHHUSA-N -1 3 370.844 3.834 20 0 FHADHM Cc1cccc(-c2cncc(C(=O)Nc3sccc3-c3nnn[n-]3)c2)c1 ZINC000822284430 607235907 /nfs/dbraw/zinc/23/59/07/607235907.db2.gz RSVRDSGOAJZBJK-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1cccc(-c2cncc(C(=O)Nc3sccc3-c3nn[n-]n3)c2)c1 ZINC000822284430 607235908 /nfs/dbraw/zinc/23/59/08/607235908.db2.gz RSVRDSGOAJZBJK-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM c1sc(-c2ccccn2)nc1CSc1ccc(-c2nnn[n-]2)cc1 ZINC000823767534 607237781 /nfs/dbraw/zinc/23/77/81/607237781.db2.gz STCGANCEXPJYFO-UHFFFAOYSA-N -1 3 352.448 3.678 20 0 FHADHM c1sc(-c2ccccn2)nc1CSc1ccc(-c2nn[n-]n2)cc1 ZINC000823767534 607237782 /nfs/dbraw/zinc/23/77/82/607237782.db2.gz STCGANCEXPJYFO-UHFFFAOYSA-N -1 3 352.448 3.678 20 0 FHADHM COc1ccccc1[C@@H](C)CC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000821882984 607241371 /nfs/dbraw/zinc/24/13/71/607241371.db2.gz OXQULUBRSMQJJH-NSHDSACASA-N -1 3 371.828 3.661 20 0 FHADHM COc1ccccc1[C@@H](C)CC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000821882984 607241372 /nfs/dbraw/zinc/24/13/72/607241372.db2.gz OXQULUBRSMQJJH-NSHDSACASA-N -1 3 371.828 3.661 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccc(Cl)s1 ZINC000819868499 607241994 /nfs/dbraw/zinc/24/19/94/607241994.db2.gz ZFGLRLQUQJQALD-SSDOTTSWSA-N -1 3 368.249 3.977 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccc(Cl)s1 ZINC000819868499 607241995 /nfs/dbraw/zinc/24/19/95/607241995.db2.gz ZFGLRLQUQJQALD-SSDOTTSWSA-N -1 3 368.249 3.977 20 0 FHADHM Cc1cccc(C2(C(=O)Nc3ccc(-c4nnn[n-]4)cc3Cl)CCC2)c1 ZINC000822299843 607242372 /nfs/dbraw/zinc/24/23/72/607242372.db2.gz WQWLMYFBZJIDBZ-UHFFFAOYSA-N -1 3 367.840 3.889 20 0 FHADHM Cc1cccc(C2(C(=O)Nc3ccc(-c4nn[n-]n4)cc3Cl)CCC2)c1 ZINC000822299843 607242373 /nfs/dbraw/zinc/24/23/73/607242373.db2.gz WQWLMYFBZJIDBZ-UHFFFAOYSA-N -1 3 367.840 3.889 20 0 FHADHM CC(C)[C@@H](C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccccc1 ZINC000820017299 607243456 /nfs/dbraw/zinc/24/34/56/607243456.db2.gz UZRVKPTZLJMFRV-MRXNPFEDSA-N -1 3 355.829 3.898 20 0 FHADHM CC(C)[C@@H](C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccccc1 ZINC000820017299 607243457 /nfs/dbraw/zinc/24/34/57/607243457.db2.gz UZRVKPTZLJMFRV-MRXNPFEDSA-N -1 3 355.829 3.898 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)C1(Cc2ccccc2)CCC1 ZINC000823313452 607244110 /nfs/dbraw/zinc/24/41/10/607244110.db2.gz BIVJQOJJPAEBPF-UHFFFAOYSA-N -1 3 367.840 3.872 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)C1(Cc2ccccc2)CCC1 ZINC000823313452 607244111 /nfs/dbraw/zinc/24/41/11/607244111.db2.gz BIVJQOJJPAEBPF-UHFFFAOYSA-N -1 3 367.840 3.872 20 0 FHADHM C[C@@H](SCc1nc(C2CCCC2)no1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824755312 607784491 /nfs/dbraw/zinc/78/44/91/607784491.db2.gz LDDUSADZPUZIAM-LLVKDONJSA-N -1 3 356.455 3.902 20 0 FHADHM C[C@@H](SCc1nc(C2CCCC2)no1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824755312 607784492 /nfs/dbraw/zinc/78/44/92/607784492.db2.gz LDDUSADZPUZIAM-LLVKDONJSA-N -1 3 356.455 3.902 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@H]2C(=O)N(C)c2ccccc2-c2nnn[n-]2)cc1 ZINC000824347832 607787898 /nfs/dbraw/zinc/78/78/98/607787898.db2.gz PCCMTZNSIBJVLD-QZTJIDSGSA-N -1 3 361.449 3.757 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@H]2C(=O)N(C)c2ccccc2-c2nn[n-]n2)cc1 ZINC000824347832 607787899 /nfs/dbraw/zinc/78/78/99/607787899.db2.gz PCCMTZNSIBJVLD-QZTJIDSGSA-N -1 3 361.449 3.757 20 0 FHADHM Cc1ccc(Cl)cc1C(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000826288900 607794046 /nfs/dbraw/zinc/79/40/46/607794046.db2.gz BHUMZDDSDZXCKO-UHFFFAOYSA-N -1 3 367.840 3.633 20 0 FHADHM Cc1ccc(Cl)cc1C(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000826288900 607794047 /nfs/dbraw/zinc/79/40/47/607794047.db2.gz BHUMZDDSDZXCKO-UHFFFAOYSA-N -1 3 367.840 3.633 20 0 FHADHM CCN(C(=O)c1cc2ccc(F)cc2s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825380510 607795470 /nfs/dbraw/zinc/79/54/70/607795470.db2.gz PLHFPGGKKJLGKI-UHFFFAOYSA-N -1 3 367.409 3.887 20 0 FHADHM CCN(C(=O)c1cc2ccc(F)cc2s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825380510 607795471 /nfs/dbraw/zinc/79/54/71/607795471.db2.gz PLHFPGGKKJLGKI-UHFFFAOYSA-N -1 3 367.409 3.887 20 0 FHADHM CCN(C(=O)[C@H](C)CCc1ccccc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000825362808 607796409 /nfs/dbraw/zinc/79/64/09/607796409.db2.gz RIRXPPPIMBUSAC-CQSZACIVSA-N -1 3 367.428 3.628 20 0 FHADHM CCN(C(=O)[C@H](C)CCc1ccccc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000825362808 607796410 /nfs/dbraw/zinc/79/64/10/607796410.db2.gz RIRXPPPIMBUSAC-CQSZACIVSA-N -1 3 367.428 3.628 20 0 FHADHM CCN(C(=O)[C@H](C)CCc1cccc(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825362586 607798045 /nfs/dbraw/zinc/79/80/45/607798045.db2.gz POAIDVJWVLQCQW-CQSZACIVSA-N -1 3 367.428 3.628 20 0 FHADHM CCN(C(=O)[C@H](C)CCc1cccc(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825362586 607798046 /nfs/dbraw/zinc/79/80/46/607798046.db2.gz POAIDVJWVLQCQW-CQSZACIVSA-N -1 3 367.428 3.628 20 0 FHADHM CCN(C(=O)[C@H](C)c1cccc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825362820 607798597 /nfs/dbraw/zinc/79/85/97/607798597.db2.gz RMBNARLCJRGUGE-GFCCVEGCSA-N -1 3 355.829 3.677 20 0 FHADHM CCN(C(=O)[C@H](C)c1cccc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825362820 607798598 /nfs/dbraw/zinc/79/85/98/607798598.db2.gz RMBNARLCJRGUGE-GFCCVEGCSA-N -1 3 355.829 3.677 20 0 FHADHM Fc1cc(NCc2cccc(-c3nnn[n-]3)c2)c(F)cc1Br ZINC000826372936 607808310 /nfs/dbraw/zinc/80/83/10/607808310.db2.gz SHVDNDCVHXLKGR-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM O[C@@H](CSc1ccc(-c2nnn[n-]2)cc1Cl)c1cccc(Cl)c1 ZINC000826504906 607843460 /nfs/dbraw/zinc/84/34/60/607843460.db2.gz HTGAKCZGSBAWAB-ZDUSSCGKSA-N -1 3 367.261 3.999 20 0 FHADHM O[C@@H](CSc1ccc(-c2nn[n-]n2)cc1Cl)c1cccc(Cl)c1 ZINC000826504906 607843461 /nfs/dbraw/zinc/84/34/61/607843461.db2.gz HTGAKCZGSBAWAB-ZDUSSCGKSA-N -1 3 367.261 3.999 20 0 FHADHM C[C@@H]1OCC[C@@H]1SCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000825019257 607846056 /nfs/dbraw/zinc/84/60/56/607846056.db2.gz CPSWSMNORIVUIS-UGSOOPFHSA-N -1 3 352.463 3.944 20 0 FHADHM C[C@@H]1OCC[C@@H]1SCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000825019257 607846057 /nfs/dbraw/zinc/84/60/57/607846057.db2.gz CPSWSMNORIVUIS-UGSOOPFHSA-N -1 3 352.463 3.944 20 0 FHADHM Cc1cccc(C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)c1Cl ZINC000826296186 607854873 /nfs/dbraw/zinc/85/48/73/607854873.db2.gz MCRWPNBTKPBCHI-UHFFFAOYSA-N -1 3 367.840 3.633 20 0 FHADHM Cc1cccc(C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)c1Cl ZINC000826296186 607854874 /nfs/dbraw/zinc/85/48/74/607854874.db2.gz MCRWPNBTKPBCHI-UHFFFAOYSA-N -1 3 367.840 3.633 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)Nc1cccnc1-c1ccccc1 ZINC000826402109 607856003 /nfs/dbraw/zinc/85/60/03/607856003.db2.gz NBMHFAOHKRZLSL-SEYXRHQNSA-N -1 3 368.400 3.581 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)Nc1cccnc1-c1ccccc1 ZINC000826402109 607856004 /nfs/dbraw/zinc/85/60/04/607856004.db2.gz NBMHFAOHKRZLSL-SEYXRHQNSA-N -1 3 368.400 3.581 20 0 FHADHM CCc1noc(C)c1NC(=O)c1ccccc1-c1ccccc1-c1nnn[n-]1 ZINC000825776369 607861325 /nfs/dbraw/zinc/86/13/25/607861325.db2.gz HEOGVOYUBWPDMP-UHFFFAOYSA-N -1 3 374.404 3.645 20 0 FHADHM CCc1noc(C)c1NC(=O)c1ccccc1-c1ccccc1-c1nn[n-]n1 ZINC000825776369 607861326 /nfs/dbraw/zinc/86/13/26/607861326.db2.gz HEOGVOYUBWPDMP-UHFFFAOYSA-N -1 3 374.404 3.645 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)C(C)=Cc1ccccc1Cl ZINC000826185607 607889640 /nfs/dbraw/zinc/88/96/40/607889640.db2.gz OPPPUVXBJHUOGT-PKNBQFBNSA-N -1 3 369.812 3.571 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)C(C)=Cc1ccccc1Cl ZINC000826185607 607889641 /nfs/dbraw/zinc/88/96/41/607889641.db2.gz OPPPUVXBJHUOGT-PKNBQFBNSA-N -1 3 369.812 3.571 20 0 FHADHM CCc1ccc([C@@H](C)CC(=O)N2CCc3ccc(-c4nnn[n-]4)cc32)cc1 ZINC000825704594 607946400 /nfs/dbraw/zinc/94/64/00/607946400.db2.gz KCSCFMUATGNHFP-AWEZNQCLSA-N -1 3 361.449 3.512 20 0 FHADHM CCc1ccc([C@@H](C)CC(=O)N2CCc3ccc(-c4nn[n-]n4)cc32)cc1 ZINC000825704594 607946401 /nfs/dbraw/zinc/94/64/01/607946401.db2.gz KCSCFMUATGNHFP-AWEZNQCLSA-N -1 3 361.449 3.512 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000823944209 607969551 /nfs/dbraw/zinc/96/95/51/607969551.db2.gz ZXFFXCJOHKZTTJ-XSNHNAGMSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000823944209 607969552 /nfs/dbraw/zinc/96/95/52/607969552.db2.gz ZXFFXCJOHKZTTJ-XSNHNAGMSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000823943501 607970442 /nfs/dbraw/zinc/97/04/42/607970442.db2.gz PWKYOSVLLHPWJZ-RAXLEYEMSA-N -1 3 367.840 3.582 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000823943501 607970443 /nfs/dbraw/zinc/97/04/43/607970443.db2.gz PWKYOSVLLHPWJZ-RAXLEYEMSA-N -1 3 367.840 3.582 20 0 FHADHM CCCn1c2ccc(-c3nnn[n-]3)cc2nc1-c1coc(-c2ccccc2)n1 ZINC000825352834 607974884 /nfs/dbraw/zinc/97/48/84/607974884.db2.gz QVLLRZZZGUBXLN-UHFFFAOYSA-N -1 3 371.404 3.948 20 0 FHADHM CCCn1c2ccc(-c3nn[n-]n3)cc2nc1-c1coc(-c2ccccc2)n1 ZINC000825352834 607974885 /nfs/dbraw/zinc/97/48/85/607974885.db2.gz QVLLRZZZGUBXLN-UHFFFAOYSA-N -1 3 371.404 3.948 20 0 FHADHM CCn1c2ccc(-c3nnn[n-]3)cc2nc1-c1cc(F)cc2cccnc21 ZINC000825782965 607975908 /nfs/dbraw/zinc/97/59/08/607975908.db2.gz XJIHSDHYRIVBRQ-UHFFFAOYSA-N -1 3 359.368 3.591 20 0 FHADHM CCn1c2ccc(-c3nn[n-]n3)cc2nc1-c1cc(F)cc2cccnc21 ZINC000825782965 607975909 /nfs/dbraw/zinc/97/59/09/607975909.db2.gz XJIHSDHYRIVBRQ-UHFFFAOYSA-N -1 3 359.368 3.591 20 0 FHADHM CCO[C@H](C)c1nccn1Cc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000825575972 608013891 /nfs/dbraw/zinc/01/38/91/608013891.db2.gz AXVSUNFKBKBOOL-OAHLLOKOSA-N -1 3 374.448 3.876 20 0 FHADHM CCO[C@H](C)c1nccn1Cc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000825575972 608013892 /nfs/dbraw/zinc/01/38/92/608013892.db2.gz AXVSUNFKBKBOOL-OAHLLOKOSA-N -1 3 374.448 3.876 20 0 FHADHM CC[C@@H](C)NC(=O)c1ccc(Oc2ccccc2-c2nnn[n-]2)c(Cl)c1 ZINC000825068432 608046256 /nfs/dbraw/zinc/04/62/56/608046256.db2.gz RPSDLEYRLKAXPA-LLVKDONJSA-N -1 3 371.828 3.841 20 0 FHADHM CC[C@@H](C)NC(=O)c1ccc(Oc2ccccc2-c2nn[n-]n2)c(Cl)c1 ZINC000825068432 608046257 /nfs/dbraw/zinc/04/62/57/608046257.db2.gz RPSDLEYRLKAXPA-LLVKDONJSA-N -1 3 371.828 3.841 20 0 FHADHM Cc1ccc([C@H]2CCCN2c2ccc(-c3nn[n-]n3)cc2Br)o1 ZINC000826285794 608050260 /nfs/dbraw/zinc/05/02/60/608050260.db2.gz JWIINKVSHYRRCP-CQSZACIVSA-N -1 3 374.242 3.872 20 0 FHADHM Cc1nc([C@H](C)Nc2ccc(-c3nn[n-]n3)cc2Br)cs1 ZINC000826323840 608050320 /nfs/dbraw/zinc/05/03/20/608050320.db2.gz UIRYHMKRJOGPNL-ZETCQYMHSA-N -1 3 365.260 3.567 20 0 FHADHM Cc1ccc2oc(CN[C@@H](C)c3ccc(-c4nn[n-]n4)cc3F)cc2c1 ZINC000826295579 608136674 /nfs/dbraw/zinc/13/66/74/608136674.db2.gz NRLFIUPVOQCJGX-LBPRGKRZSA-N -1 3 351.385 3.911 20 0 FHADHM CC(C)(C)[C@@H]1C[C@@H](Nc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)CCO1 ZINC000824078600 608149330 /nfs/dbraw/zinc/14/93/30/608149330.db2.gz JIJJKERAWCPQDY-FZMZJTMJSA-N -1 3 369.391 3.891 20 0 FHADHM CC(C)Oc1ccccc1C(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000824333096 608181083 /nfs/dbraw/zinc/18/10/83/608181083.db2.gz DJFAFJAGKVFILR-CYBMUJFWSA-N -1 3 352.394 3.572 20 0 FHADHM CC(C)Oc1ccccc1C(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000824333096 608181084 /nfs/dbraw/zinc/18/10/84/608181084.db2.gz DJFAFJAGKVFILR-CYBMUJFWSA-N -1 3 352.394 3.572 20 0 FHADHM C[C@@H](Oc1ccccc1Cl)C(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000824756108 608183392 /nfs/dbraw/zinc/18/33/92/608183392.db2.gz NTKKAWFCPZUEMB-NWDGAFQWSA-N -1 3 372.812 3.592 20 0 FHADHM C[C@@H](Oc1ccccc1Cl)C(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000824756108 608183394 /nfs/dbraw/zinc/18/33/94/608183394.db2.gz NTKKAWFCPZUEMB-NWDGAFQWSA-N -1 3 372.812 3.592 20 0 FHADHM C[C@H](CC(=O)N(C)c1cccc(-c2nnn[n-]2)c1)Cc1ccc(Cl)cc1 ZINC000824385421 608219257 /nfs/dbraw/zinc/21/92/57/608219257.db2.gz SPNBXVDLGAYZIO-ZDUSSCGKSA-N -1 3 369.856 3.752 20 0 FHADHM C[C@H](CC(=O)N(C)c1cccc(-c2nn[n-]n2)c1)Cc1ccc(Cl)cc1 ZINC000824385421 608219259 /nfs/dbraw/zinc/21/92/59/608219259.db2.gz SPNBXVDLGAYZIO-ZDUSSCGKSA-N -1 3 369.856 3.752 20 0 FHADHM c1cc(N2CCCCC2)ncc1Nc1ccc2cc(-c3nnn[n-]3)ccc2n1 ZINC000826517220 608222424 /nfs/dbraw/zinc/22/24/24/608222424.db2.gz VKPLHFDWUGBPMA-UHFFFAOYSA-N -1 3 372.436 3.544 20 0 FHADHM c1cc(N2CCCCC2)ncc1Nc1ccc2cc(-c3nn[n-]n3)ccc2n1 ZINC000826517220 608222426 /nfs/dbraw/zinc/22/24/26/608222426.db2.gz VKPLHFDWUGBPMA-UHFFFAOYSA-N -1 3 372.436 3.544 20 0 FHADHM c1coc(CN(Cc2ccco2)c2ccc3cc(-c4nnn[n-]4)ccc3n2)c1 ZINC000826525948 608222669 /nfs/dbraw/zinc/22/26/69/608222669.db2.gz FTPJXJGCRNNWGH-UHFFFAOYSA-N -1 3 372.388 3.808 20 0 FHADHM c1coc(CN(Cc2ccco2)c2ccc3cc(-c4nn[n-]n4)ccc3n2)c1 ZINC000826525948 608222670 /nfs/dbraw/zinc/22/26/70/608222670.db2.gz FTPJXJGCRNNWGH-UHFFFAOYSA-N -1 3 372.388 3.808 20 0 FHADHM Fc1ccccc1[C@H]1CCN(c2ccc3cc(-c4nnn[n-]4)ccc3n2)C1 ZINC000826377862 608227037 /nfs/dbraw/zinc/22/70/37/608227037.db2.gz JUULDRFFYQKIEK-HNNXBMFYSA-N -1 3 360.396 3.548 20 0 FHADHM Fc1ccccc1[C@H]1CCN(c2ccc3cc(-c4nn[n-]n4)ccc3n2)C1 ZINC000826377862 608227039 /nfs/dbraw/zinc/22/70/39/608227039.db2.gz JUULDRFFYQKIEK-HNNXBMFYSA-N -1 3 360.396 3.548 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1ccc(Cl)c(F)c1 ZINC000825333361 608244004 /nfs/dbraw/zinc/24/40/04/608244004.db2.gz XBXUNDAZMNMYLO-UHFFFAOYSA-N -1 3 374.807 3.733 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CSc1ccc(C(F)(F)F)cn1 ZINC000826173635 608262361 /nfs/dbraw/zinc/26/23/61/608262361.db2.gz NJKQDNVBOYADBA-UHFFFAOYSA-N -1 3 367.356 3.581 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CSc1ccc(C(F)(F)F)cn1 ZINC000826173635 608262363 /nfs/dbraw/zinc/26/23/63/608262363.db2.gz NJKQDNVBOYADBA-UHFFFAOYSA-N -1 3 367.356 3.581 20 0 FHADHM CC[C@H]1CC[C@@H](C)N1C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000825195352 608264181 /nfs/dbraw/zinc/26/41/81/608264181.db2.gz WHCSSSDKBSMTAX-KOLCDFICSA-N -1 3 368.363 3.680 20 0 FHADHM CC[C@H]1CC[C@@H](C)N1C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000825195352 608264182 /nfs/dbraw/zinc/26/41/82/608264182.db2.gz WHCSSSDKBSMTAX-KOLCDFICSA-N -1 3 368.363 3.680 20 0 FHADHM CCN(C(=O)c1c(F)ccc(C)c1F)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825376666 608269088 /nfs/dbraw/zinc/26/90/88/608269088.db2.gz KROVXDMCWIXNOW-LBPRGKRZSA-N -1 3 371.391 3.677 20 0 FHADHM CCN(C(=O)c1c(F)ccc(C)c1F)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825376666 608269090 /nfs/dbraw/zinc/26/90/90/608269090.db2.gz KROVXDMCWIXNOW-LBPRGKRZSA-N -1 3 371.391 3.677 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)c(N[C@@H](C)c2cccc(Br)c2)n1 ZINC000826275235 608273141 /nfs/dbraw/zinc/27/31/41/608273141.db2.gz SZGLTISROYRFQG-JTQLQIEISA-N -1 3 359.231 3.506 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)c(N[C@@H](C)c2cccc(Br)c2)n1 ZINC000826275235 608273143 /nfs/dbraw/zinc/27/31/43/608273143.db2.gz SZGLTISROYRFQG-JTQLQIEISA-N -1 3 359.231 3.506 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)c(N[C@@H]2C[C@@H]2c2ccccc2C(F)(F)F)n1 ZINC000826275180 608281720 /nfs/dbraw/zinc/28/17/20/608281720.db2.gz RBUXLDOYQBWXDB-TZMCWYRMSA-N -1 3 360.343 3.557 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)c(N[C@@H]2C[C@@H]2c2ccccc2C(F)(F)F)n1 ZINC000826275180 608281722 /nfs/dbraw/zinc/28/17/22/608281722.db2.gz RBUXLDOYQBWXDB-TZMCWYRMSA-N -1 3 360.343 3.557 20 0 FHADHM C[C@H](Nc1ccc(F)cc1OCC(F)F)c1ccc(-c2nnn[n-]2)cc1 ZINC000824655817 608287352 /nfs/dbraw/zinc/28/73/52/608287352.db2.gz FYFOWFMCNZXCJE-JTQLQIEISA-N -1 3 363.343 3.823 20 0 FHADHM C[C@H](Nc1ccc(F)cc1OCC(F)F)c1ccc(-c2nn[n-]n2)cc1 ZINC000824655817 608287353 /nfs/dbraw/zinc/28/73/53/608287353.db2.gz FYFOWFMCNZXCJE-JTQLQIEISA-N -1 3 363.343 3.823 20 0 FHADHM O=C(NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1)Nc1ccccc1 ZINC000826441016 608292500 /nfs/dbraw/zinc/29/25/00/608292500.db2.gz JXMDFTQGDGVMLA-UHFFFAOYSA-N -1 3 370.416 3.855 20 0 FHADHM O=C(NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1)Nc1ccccc1 ZINC000826441016 608292501 /nfs/dbraw/zinc/29/25/01/608292501.db2.gz JXMDFTQGDGVMLA-UHFFFAOYSA-N -1 3 370.416 3.855 20 0 FHADHM CC(C)c1noc(NCc2ccc(-c3ccccc3-c3nnn[n-]3)cc2)n1 ZINC000824371510 608293916 /nfs/dbraw/zinc/29/39/16/608293916.db2.gz IKFLYOCGTKKFOA-UHFFFAOYSA-N -1 3 361.409 3.652 20 0 FHADHM CC(C)c1noc(NCc2ccc(-c3ccccc3-c3nn[n-]n3)cc2)n1 ZINC000824371510 608293918 /nfs/dbraw/zinc/29/39/18/608293918.db2.gz IKFLYOCGTKKFOA-UHFFFAOYSA-N -1 3 361.409 3.652 20 0 FHADHM O=C(NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1)[C@H]1CC=CCC1 ZINC000826440416 608306215 /nfs/dbraw/zinc/30/62/15/608306215.db2.gz LYIYFANEHFORKP-KRWDZBQOSA-N -1 3 359.433 3.506 20 0 FHADHM O=C(NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1)[C@H]1CC=CCC1 ZINC000826440416 608306216 /nfs/dbraw/zinc/30/62/16/608306216.db2.gz LYIYFANEHFORKP-KRWDZBQOSA-N -1 3 359.433 3.506 20 0 FHADHM Cc1cccc(C)c1[C@H](C)OC(=O)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000826296860 608314745 /nfs/dbraw/zinc/31/47/45/608314745.db2.gz LYEINAOLQDBKTL-NSHDSACASA-N -1 3 358.348 3.680 20 0 FHADHM Cc1cccc(C)c1[C@H](C)OC(=O)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000826296860 608314747 /nfs/dbraw/zinc/31/47/47/608314747.db2.gz LYEINAOLQDBKTL-NSHDSACASA-N -1 3 358.348 3.680 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CNc1ccc(C)cc1Br ZINC000826170655 608319444 /nfs/dbraw/zinc/31/94/44/608319444.db2.gz JYKLZEKTUICYKH-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CNc1ccc(C)cc1Br ZINC000826170655 608319447 /nfs/dbraw/zinc/31/94/47/608319447.db2.gz JYKLZEKTUICYKH-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM CCCCOc1cccc(NCc2ccc(-c3nnn[n-]3)cc2OC)c1 ZINC000825296374 608320030 /nfs/dbraw/zinc/32/00/30/608320030.db2.gz GLPQEHXXLXVIIJ-UHFFFAOYSA-N -1 3 353.426 3.666 20 0 FHADHM CCCCOc1cccc(NCc2ccc(-c3nn[n-]n3)cc2OC)c1 ZINC000825296374 608320033 /nfs/dbraw/zinc/32/00/33/608320033.db2.gz GLPQEHXXLXVIIJ-UHFFFAOYSA-N -1 3 353.426 3.666 20 0 FHADHM CS[C@@H](C)CCC(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCCC2 ZINC000826225873 608338973 /nfs/dbraw/zinc/33/89/73/608338973.db2.gz MTMIVPXFDYTEPR-JTQLQIEISA-N -1 3 365.528 3.667 20 0 FHADHM CS[C@@H](C)CCC(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCCC2 ZINC000826225873 608338975 /nfs/dbraw/zinc/33/89/75/608338975.db2.gz MTMIVPXFDYTEPR-JTQLQIEISA-N -1 3 365.528 3.667 20 0 FHADHM CCN(C(=O)CCc1cccc(C)c1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825371928 608341850 /nfs/dbraw/zinc/34/18/50/608341850.db2.gz NJVOZVMEJCIYDD-UHFFFAOYSA-N -1 3 369.856 3.814 20 0 FHADHM CCN(C(=O)CCc1cccc(C)c1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825371928 608341852 /nfs/dbraw/zinc/34/18/52/608341852.db2.gz NJVOZVMEJCIYDD-UHFFFAOYSA-N -1 3 369.856 3.814 20 0 FHADHM CCN(C(=O)[C@H]1CCc2ccccc21)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825367197 608343531 /nfs/dbraw/zinc/34/35/31/608343531.db2.gz KVINCNUVASFPMG-HNNXBMFYSA-N -1 3 367.840 3.603 20 0 FHADHM CCN(C(=O)[C@H]1CCc2ccccc21)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825367197 608343533 /nfs/dbraw/zinc/34/35/33/608343533.db2.gz KVINCNUVASFPMG-HNNXBMFYSA-N -1 3 367.840 3.603 20 0 FHADHM CCN(Cc1ccc(Cl)s1)Cc1ccc(-c2nn[n-]n2)cc1OC ZINC000825434806 608351994 /nfs/dbraw/zinc/35/19/94/608351994.db2.gz FXBSPTKXCCFDPR-UHFFFAOYSA-N -1 3 363.874 3.612 20 0 FHADHM Fc1c(CSCc2ccc(-n3cccn3)cc2)cccc1-c1nnn[n-]1 ZINC000826370670 608404853 /nfs/dbraw/zinc/40/48/53/608404853.db2.gz CWTUZQDUCACHTD-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM Fc1c(CSCc2ccc(-n3cccn3)cc2)cccc1-c1nn[n-]n1 ZINC000826370670 608404855 /nfs/dbraw/zinc/40/48/55/608404855.db2.gz CWTUZQDUCACHTD-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM Cc1nc2ccccc2nc1CSCc1cccc(-c2nnn[n-]2)c1F ZINC000826329347 608405030 /nfs/dbraw/zinc/40/50/30/608405030.db2.gz ZGGLZEJNADEERO-UHFFFAOYSA-N -1 3 366.425 3.691 20 0 FHADHM Cc1nc2ccccc2nc1CSCc1cccc(-c2nn[n-]n2)c1F ZINC000826329347 608405032 /nfs/dbraw/zinc/40/50/32/608405032.db2.gz ZGGLZEJNADEERO-UHFFFAOYSA-N -1 3 366.425 3.691 20 0 FHADHM CSc1cccc(NC(=O)C=Cc2ccccc2-c2nnn[n-]2)c1C ZINC000826230789 608432231 /nfs/dbraw/zinc/43/22/31/608432231.db2.gz KBCFDWOHTNZUOR-KHPPLWFESA-N -1 3 351.435 3.549 20 0 FHADHM CSc1cccc(NC(=O)C=Cc2ccccc2-c2nn[n-]n2)c1C ZINC000826230789 608432233 /nfs/dbraw/zinc/43/22/33/608432233.db2.gz KBCFDWOHTNZUOR-KHPPLWFESA-N -1 3 351.435 3.549 20 0 FHADHM Cc1ccc2oc(N3CC=C(c4ccc(-c5nnn[n-]5)cc4)CC3)nc2c1 ZINC000826295833 608441895 /nfs/dbraw/zinc/44/18/95/608441895.db2.gz ZNSWNCHSPGPNRJ-UHFFFAOYSA-N -1 3 358.405 3.610 20 0 FHADHM Cc1ccc2oc(N3CC=C(c4ccc(-c5nn[n-]n5)cc4)CC3)nc2c1 ZINC000826295833 608441897 /nfs/dbraw/zinc/44/18/97/608441897.db2.gz ZNSWNCHSPGPNRJ-UHFFFAOYSA-N -1 3 358.405 3.610 20 0 FHADHM Cc1ccc(-c2nc(CN[C@@H](C)c3ccc(-c4nn[n-]n4)cc3)cs2)o1 ZINC000826273846 608467091 /nfs/dbraw/zinc/46/70/91/608467091.db2.gz WWPICKVDDTYDEX-LBPRGKRZSA-N -1 3 366.450 3.742 20 0 FHADHM O=C(CCCc1ccccc1)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000826406925 608479038 /nfs/dbraw/zinc/47/90/38/608479038.db2.gz SVHHBWSHKPURAL-UHFFFAOYSA-N -1 3 373.460 3.505 20 0 FHADHM O=C(CCCc1ccccc1)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000826406925 608479041 /nfs/dbraw/zinc/47/90/41/608479041.db2.gz SVHHBWSHKPURAL-UHFFFAOYSA-N -1 3 373.460 3.505 20 0 FHADHM CCCC(CCC)C(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000825241834 608483058 /nfs/dbraw/zinc/48/30/58/608483058.db2.gz BBKUREYMCGZYTO-UHFFFAOYSA-N -1 3 353.470 3.699 20 0 FHADHM CCCC(CCC)C(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000825241834 608483059 /nfs/dbraw/zinc/48/30/59/608483059.db2.gz BBKUREYMCGZYTO-UHFFFAOYSA-N -1 3 353.470 3.699 20 0 FHADHM Cc1ccccc1-c1cnc(CN[C@@H](C)c2cccc(-c3nn[n-]n3)c2)o1 ZINC000826305190 608484313 /nfs/dbraw/zinc/48/43/13/608484313.db2.gz NUWRGBDHAOQYEF-AWEZNQCLSA-N -1 3 360.421 3.681 20 0 FHADHM Cc1ccc(-c2cnc(CN[C@@H](C)c3cccc(-c4nn[n-]n4)c3)o2)cc1 ZINC000826273668 608489988 /nfs/dbraw/zinc/48/99/88/608489988.db2.gz OVCBWDISLLRKAQ-AWEZNQCLSA-N -1 3 360.421 3.681 20 0 FHADHM CC[C@@H](OC(=O)c1sccc1-c1nnn[n-]1)c1ccc(F)cc1F ZINC000825154651 608500074 /nfs/dbraw/zinc/50/00/74/608500074.db2.gz RYIBHIVCIZSUMK-GFCCVEGCSA-N -1 3 350.350 3.515 20 0 FHADHM C[C@@H](c1nc2ccccc2s1)N(C)Cc1ccc(-c2nnn[n-]2)s1 ZINC000824778497 608503842 /nfs/dbraw/zinc/50/38/42/608503842.db2.gz QEJRFLXVOJXDIW-JTQLQIEISA-N -1 3 356.480 3.731 20 0 FHADHM C[C@@H](c1nc2ccccc2s1)N(C)Cc1ccc(-c2nn[n-]n2)s1 ZINC000824778497 608503844 /nfs/dbraw/zinc/50/38/44/608503844.db2.gz QEJRFLXVOJXDIW-JTQLQIEISA-N -1 3 356.480 3.731 20 0 FHADHM Cc1nc(C2CCCCC2)sc1C(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000538270798 608538950 /nfs/dbraw/zinc/53/89/50/608538950.db2.gz FMLSLRSJTVYTSA-UHFFFAOYSA-N -1 3 368.466 3.932 20 0 FHADHM Cc1nc(C2CCCCC2)sc1C(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000538270798 608538951 /nfs/dbraw/zinc/53/89/51/608538951.db2.gz FMLSLRSJTVYTSA-UHFFFAOYSA-N -1 3 368.466 3.932 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)nc1N[C@H](C)c1ccccc1Br ZINC000826280408 608542552 /nfs/dbraw/zinc/54/25/52/608542552.db2.gz APYWWMSJAVZYGR-SNVBAGLBSA-N -1 3 359.231 3.506 20 0 FHADHM C[C@@H](NC(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1)c1ccc(Cl)s1 ZINC000824521294 608574656 /nfs/dbraw/zinc/57/46/56/608574656.db2.gz JRHRPLAKZNDBIL-SSDOTTSWSA-N -1 3 368.249 3.726 20 0 FHADHM C[C@@H](NC(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1)c1ccc(Cl)s1 ZINC000824521294 608574658 /nfs/dbraw/zinc/57/46/58/608574658.db2.gz JRHRPLAKZNDBIL-SSDOTTSWSA-N -1 3 368.249 3.726 20 0 FHADHM C[C@H]1SCCN(Cc2cccc(-c3nnn[n-]3)c2F)[C@@H]1c1ccccc1 ZINC000825019573 608650654 /nfs/dbraw/zinc/65/06/54/608650654.db2.gz FLKAKBSYTKVZGG-ACJLOTCBSA-N -1 3 369.469 3.684 20 0 FHADHM CCc1nc(C)c([C@H](C)N(C)Cc2cccc(-c3nnn[n-]3)c2F)s1 ZINC000825746072 608650758 /nfs/dbraw/zinc/65/07/58/608650758.db2.gz RFPXRHMBJBNUDC-NSHDSACASA-N -1 3 360.462 3.526 20 0 FHADHM CCc1nc(C)c([C@H](C)N(C)Cc2cccc(-c3nn[n-]n3)c2F)s1 ZINC000825746072 608650759 /nfs/dbraw/zinc/65/07/59/608650759.db2.gz RFPXRHMBJBNUDC-NSHDSACASA-N -1 3 360.462 3.526 20 0 FHADHM CN(Cc1ccc(-c2nnn[n-]2)s1)[C@@H](c1ccccc1)C(F)(F)F ZINC000825961134 608677563 /nfs/dbraw/zinc/67/75/63/608677563.db2.gz BBDMEKYWQFNZMJ-ZDUSSCGKSA-N -1 3 353.373 3.664 20 0 FHADHM Cc1nc(-c2ccc([C@H](C)Nc3cnccc3-c3nnn[n-]3)cc2)cs1 ZINC000826322568 608772529 /nfs/dbraw/zinc/77/25/29/608772529.db2.gz RYYPJPZKVIPIQB-NSHDSACASA-N -1 3 363.450 3.867 20 0 FHADHM Cc1nc(-c2ccc([C@H](C)Nc3cnccc3-c3nn[n-]n3)cc2)cs1 ZINC000826322568 608772533 /nfs/dbraw/zinc/77/25/33/608772533.db2.gz RYYPJPZKVIPIQB-NSHDSACASA-N -1 3 363.450 3.867 20 0 FHADHM c1ccc(COCc2ccccc2CNc2cnccc2-c2nnn[n-]2)cc1 ZINC000826521754 608776625 /nfs/dbraw/zinc/77/66/25/608776625.db2.gz XXDBERLWQSZLBI-UHFFFAOYSA-N -1 3 372.432 3.591 20 0 FHADHM c1ccc(COCc2ccccc2CNc2cnccc2-c2nn[n-]n2)cc1 ZINC000826521754 608776628 /nfs/dbraw/zinc/77/66/28/608776628.db2.gz XXDBERLWQSZLBI-UHFFFAOYSA-N -1 3 372.432 3.591 20 0 FHADHM O=C(CCc1ccc(-c2nnn[n-]2)cc1)N1CCC[C@H]1/C=C/c1ccccc1 ZINC000826408548 609138003 /nfs/dbraw/zinc/13/80/03/609138003.db2.gz LIGBAHIENASJKF-HKFHZZIHSA-N -1 3 373.460 3.504 20 0 FHADHM O=C(CCc1ccc(-c2nn[n-]n2)cc1)N1CCC[C@H]1/C=C/c1ccccc1 ZINC000826408548 609138005 /nfs/dbraw/zinc/13/80/05/609138005.db2.gz LIGBAHIENASJKF-HKFHZZIHSA-N -1 3 373.460 3.504 20 0 FHADHM CC(C)COC[C@H](N[C@H](C)c1ccc(-c2nnn[n-]2)c(F)c1)c1ccco1 ZINC000824266071 609139060 /nfs/dbraw/zinc/13/90/60/609139060.db2.gz FAHVCVOMNNIHCI-DYVFJYSZSA-N -1 3 373.432 3.663 20 0 FHADHM CC(C)COC[C@H](N[C@H](C)c1ccc(-c2nn[n-]n2)c(F)c1)c1ccco1 ZINC000824266071 609139062 /nfs/dbraw/zinc/13/90/62/609139062.db2.gz FAHVCVOMNNIHCI-DYVFJYSZSA-N -1 3 373.432 3.663 20 0 FHADHM COc1cc(Cl)ccc1CN[C@@H](C)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000826180098 609141826 /nfs/dbraw/zinc/14/18/26/609141826.db2.gz RWEIUBZEOGCXDI-JTQLQIEISA-N -1 3 361.808 3.519 20 0 FHADHM COc1cc(Cl)ccc1CN[C@H](C)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000826180099 609141960 /nfs/dbraw/zinc/14/19/60/609141960.db2.gz RWEIUBZEOGCXDI-SNVBAGLBSA-N -1 3 361.808 3.519 20 0 FHADHM COc1cc(C)c(N[C@@H]2CCCc3cc(-c4nnn[n-]4)ccc32)cc1OC ZINC000826178421 609158820 /nfs/dbraw/zinc/15/88/20/609158820.db2.gz XKADMLOGWMRTJW-MRXNPFEDSA-N -1 3 365.437 3.682 20 0 FHADHM COc1cc(C)c(N[C@@H]2CCCc3cc(-c4nn[n-]n4)ccc32)cc1OC ZINC000826178421 609158822 /nfs/dbraw/zinc/15/88/22/609158822.db2.gz XKADMLOGWMRTJW-MRXNPFEDSA-N -1 3 365.437 3.682 20 0 FHADHM c1cc2c(cc1N[C@H]1CCCc3cc(-c4nnn[n-]4)ccc31)OCCCO2 ZINC000826518491 609164032 /nfs/dbraw/zinc/16/40/32/609164032.db2.gz PKTBFBYZIFKJFL-KRWDZBQOSA-N -1 3 363.421 3.518 20 0 FHADHM c1cc2c(cc1N[C@H]1CCCc3cc(-c4nn[n-]n4)ccc31)OCCCO2 ZINC000826518491 609164033 /nfs/dbraw/zinc/16/40/33/609164033.db2.gz PKTBFBYZIFKJFL-KRWDZBQOSA-N -1 3 363.421 3.518 20 0 FHADHM C[C@@H]1CCN(c2ccc3cc(-c4nnn[n-]4)ccc3n2)[C@@H](c2ccco2)C1 ZINC000824963029 609164650 /nfs/dbraw/zinc/16/46/50/609164650.db2.gz YUAIWWSZLXLSKX-CXAGYDPISA-N -1 3 360.421 3.986 20 0 FHADHM C[C@@H]1CCN(c2ccc3cc(-c4nn[n-]n4)ccc3n2)[C@@H](c2ccco2)C1 ZINC000824963029 609164651 /nfs/dbraw/zinc/16/46/51/609164651.db2.gz YUAIWWSZLXLSKX-CXAGYDPISA-N -1 3 360.421 3.986 20 0 FHADHM C[C@@H]1CCN(c2cc(-c3nnn[n-]3)c3ccccc3n2)[C@H](c2ccco2)C1 ZINC000824961892 609164763 /nfs/dbraw/zinc/16/47/63/609164763.db2.gz KPFOABVCODHSGT-DYVFJYSZSA-N -1 3 360.421 3.986 20 0 FHADHM C[C@@H]1CCN(c2cc(-c3nn[n-]n3)c3ccccc3n2)[C@H](c2ccco2)C1 ZINC000824961892 609164765 /nfs/dbraw/zinc/16/47/65/609164765.db2.gz KPFOABVCODHSGT-DYVFJYSZSA-N -1 3 360.421 3.986 20 0 FHADHM FC(F)Oc1cccc(N[C@H]2CCCc3cc(-c4nnn[n-]4)ccc32)c1 ZINC000826370091 609164946 /nfs/dbraw/zinc/16/49/46/609164946.db2.gz DFJCBJDUGPVUOM-INIZCTEOSA-N -1 3 357.364 3.958 20 0 FHADHM FC(F)Oc1cccc(N[C@H]2CCCc3cc(-c4nn[n-]n4)ccc32)c1 ZINC000826370091 609164948 /nfs/dbraw/zinc/16/49/48/609164948.db2.gz DFJCBJDUGPVUOM-INIZCTEOSA-N -1 3 357.364 3.958 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NCc1ccc(OC(F)F)cc1 ZINC000825481461 609179587 /nfs/dbraw/zinc/17/95/87/609179587.db2.gz ZWIJQPIGJKIXCS-UHFFFAOYSA-N -1 3 360.368 3.512 20 0 FHADHM CCOC(=O)N(C)c1ccc(N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000825517388 609180202 /nfs/dbraw/zinc/18/02/02/609180202.db2.gz BLEYJPVKKVRTIW-CYBMUJFWSA-N -1 3 366.425 3.633 20 0 FHADHM CCOC(=O)N(C)c1ccc(N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000825517388 609180204 /nfs/dbraw/zinc/18/02/04/609180204.db2.gz BLEYJPVKKVRTIW-CYBMUJFWSA-N -1 3 366.425 3.633 20 0 FHADHM CCCCN(C(=O)c1c[nH]c(-c2nnn[n-]2)c1)[C@@H](CC)c1ccccc1 ZINC000825281571 609212868 /nfs/dbraw/zinc/21/28/68/609212868.db2.gz GFQALAUILCSILH-KRWDZBQOSA-N -1 3 352.442 3.588 20 0 FHADHM CCCCN(C(=O)c1c[nH]c(-c2nn[n-]n2)c1)[C@@H](CC)c1ccccc1 ZINC000825281571 609212869 /nfs/dbraw/zinc/21/28/69/609212869.db2.gz GFQALAUILCSILH-KRWDZBQOSA-N -1 3 352.442 3.588 20 0 FHADHM C[C@H](c1ccc2ccccc2c1)N(C(=O)c1c[nH]c(-c2nnn[n-]2)c1)C1CC1 ZINC000824762638 609218738 /nfs/dbraw/zinc/21/87/38/609218738.db2.gz IBEOHWWWAJHARU-CYBMUJFWSA-N -1 3 372.432 3.714 20 0 FHADHM C[C@H](c1ccc2ccccc2c1)N(C(=O)c1c[nH]c(-c2nn[n-]n2)c1)C1CC1 ZINC000824762638 609218739 /nfs/dbraw/zinc/21/87/39/609218739.db2.gz IBEOHWWWAJHARU-CYBMUJFWSA-N -1 3 372.432 3.714 20 0 FHADHM COc1ccc(N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1Br ZINC000826210277 609235756 /nfs/dbraw/zinc/23/57/56/609235756.db2.gz KZBSJCLIJSUGRB-JTQLQIEISA-N -1 3 374.242 3.811 20 0 FHADHM COc1ccc(N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1Br ZINC000826210277 609235757 /nfs/dbraw/zinc/23/57/57/609235757.db2.gz KZBSJCLIJSUGRB-JTQLQIEISA-N -1 3 374.242 3.811 20 0 FHADHM COc1cc(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)ccc1Br ZINC000826180301 609243715 /nfs/dbraw/zinc/24/37/15/609243715.db2.gz ASDQUYWFYKVGLP-SNVBAGLBSA-N -1 3 374.242 3.811 20 0 FHADHM COc1cc(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)ccc1Br ZINC000826180301 609243716 /nfs/dbraw/zinc/24/37/16/609243716.db2.gz ASDQUYWFYKVGLP-SNVBAGLBSA-N -1 3 374.242 3.811 20 0 FHADHM COc1cc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)ccc1Br ZINC000826180300 609243794 /nfs/dbraw/zinc/24/37/94/609243794.db2.gz ASDQUYWFYKVGLP-JTQLQIEISA-N -1 3 374.242 3.811 20 0 FHADHM COc1cc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)ccc1Br ZINC000826180300 609243796 /nfs/dbraw/zinc/24/37/96/609243796.db2.gz ASDQUYWFYKVGLP-JTQLQIEISA-N -1 3 374.242 3.811 20 0 FHADHM c1nn(Cc2ccccc2)cc1N[C@@H]1CCCc2cc(-c3nnn[n-]3)ccc21 ZINC000826522004 609270451 /nfs/dbraw/zinc/27/04/51/609270451.db2.gz HQKNZVPVKKXYKN-HXUWFJFHSA-N -1 3 371.448 3.601 20 0 FHADHM c1nn(Cc2ccccc2)cc1N[C@@H]1CCCc2cc(-c3nn[n-]n3)ccc21 ZINC000826522004 609270453 /nfs/dbraw/zinc/27/04/53/609270453.db2.gz HQKNZVPVKKXYKN-HXUWFJFHSA-N -1 3 371.448 3.601 20 0 FHADHM CCOc1ccc(OCC)c(N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000825643436 609272108 /nfs/dbraw/zinc/27/21/08/609272108.db2.gz NXCLVDZBNJQVAX-CYBMUJFWSA-N -1 3 353.426 3.837 20 0 FHADHM CCOc1ccc(OCC)c(N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000825643436 609272109 /nfs/dbraw/zinc/27/21/09/609272109.db2.gz NXCLVDZBNJQVAX-CYBMUJFWSA-N -1 3 353.426 3.837 20 0 FHADHM CCOc1cc2c(cc1N[C@H](C)c1cccc(-c3nnn[n-]3)c1)O[C@@H](C)C2 ZINC000825621682 609273750 /nfs/dbraw/zinc/27/37/50/609273750.db2.gz XESWPKYJLVHQFC-QWHCGFSZSA-N -1 3 365.437 3.762 20 0 FHADHM CCOc1cc2c(cc1N[C@H](C)c1cccc(-c3nn[n-]n3)c1)O[C@@H](C)C2 ZINC000825621682 609273752 /nfs/dbraw/zinc/27/37/52/609273752.db2.gz XESWPKYJLVHQFC-QWHCGFSZSA-N -1 3 365.437 3.762 20 0 FHADHM CCOc1cc2c(cc1N[C@@H](C)c1cccc(-c3nnn[n-]3)c1)O[C@H](C)C2 ZINC000825621681 609273847 /nfs/dbraw/zinc/27/38/47/609273847.db2.gz XESWPKYJLVHQFC-OLZOCXBDSA-N -1 3 365.437 3.762 20 0 FHADHM CCOc1cc2c(cc1N[C@@H](C)c1cccc(-c3nn[n-]n3)c1)O[C@H](C)C2 ZINC000825621681 609273848 /nfs/dbraw/zinc/27/38/48/609273848.db2.gz XESWPKYJLVHQFC-OLZOCXBDSA-N -1 3 365.437 3.762 20 0 FHADHM C[C@H](Nc1ccc2c(c1)OC(C)(C)O2)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824656568 609274568 /nfs/dbraw/zinc/27/45/68/609274568.db2.gz LYLPXDHHDRBAPN-JTQLQIEISA-N -1 3 355.373 3.686 20 0 FHADHM C[C@H](Nc1ccc2c(c1)OC(C)(C)O2)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824656568 609274569 /nfs/dbraw/zinc/27/45/69/609274569.db2.gz LYLPXDHHDRBAPN-JTQLQIEISA-N -1 3 355.373 3.686 20 0 FHADHM COc1ccc(N[C@@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)c2cccnc12 ZINC000826209678 609276781 /nfs/dbraw/zinc/27/67/81/609276781.db2.gz LUWAOYXFIRBQGK-NSHDSACASA-N -1 3 364.384 3.736 20 0 FHADHM COc1ccc(N[C@@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)c2cccnc12 ZINC000826209678 609276782 /nfs/dbraw/zinc/27/67/82/609276782.db2.gz LUWAOYXFIRBQGK-NSHDSACASA-N -1 3 364.384 3.736 20 0 FHADHM C[C@H](Nc1ccc(N2CCSCC2)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824658333 609279210 /nfs/dbraw/zinc/27/92/10/609279210.db2.gz WBDMIEYCEATIDN-AWEZNQCLSA-N -1 3 366.494 3.593 20 0 FHADHM C[C@H](Nc1ccc(N2CCSCC2)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824658333 609279212 /nfs/dbraw/zinc/27/92/12/609279212.db2.gz WBDMIEYCEATIDN-AWEZNQCLSA-N -1 3 366.494 3.593 20 0 FHADHM C[C@H](Nc1ccc(N2CCCCC2)nc1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824656447 609279328 /nfs/dbraw/zinc/27/93/28/609279328.db2.gz JZOLLKMULVBCQC-ZDUSSCGKSA-N -1 3 367.432 3.564 20 0 FHADHM C[C@H](Nc1ccc(N2CCCCC2)nc1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824656447 609279329 /nfs/dbraw/zinc/27/93/29/609279329.db2.gz JZOLLKMULVBCQC-ZDUSSCGKSA-N -1 3 367.432 3.564 20 0 FHADHM COc1cc(N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c(OC)cc1Cl ZINC000826180791 609279678 /nfs/dbraw/zinc/27/96/78/609279678.db2.gz XETNYBZVBKDKQR-SNVBAGLBSA-N -1 3 359.817 3.710 20 0 FHADHM COc1cc(N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c(OC)cc1Cl ZINC000826180791 609279679 /nfs/dbraw/zinc/27/96/79/609279679.db2.gz XETNYBZVBKDKQR-SNVBAGLBSA-N -1 3 359.817 3.710 20 0 FHADHM Cc1cc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)nn1-c1ccc(C)cc1 ZINC000826281179 609281668 /nfs/dbraw/zinc/28/16/68/609281668.db2.gz HOTIAEJJEYROTN-HNNXBMFYSA-N -1 3 359.437 3.842 20 0 FHADHM Cc1cc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)nn1-c1ccc(C)cc1 ZINC000826281179 609281670 /nfs/dbraw/zinc/28/16/70/609281670.db2.gz HOTIAEJJEYROTN-HNNXBMFYSA-N -1 3 359.437 3.842 20 0 FHADHM Cc1nnc(SCc2cc(Cl)ccc2Cl)c(-c2nnn[n-]2)c1C ZINC000826337684 609307598 /nfs/dbraw/zinc/30/75/98/609307598.db2.gz XGHTXZPRDNEIJA-UHFFFAOYSA-N -1 3 367.265 3.873 20 0 FHADHM Cc1nnc(SCc2cc(Cl)ccc2Cl)c(-c2nn[n-]n2)c1C ZINC000826337684 609307599 /nfs/dbraw/zinc/30/75/99/609307599.db2.gz XGHTXZPRDNEIJA-UHFFFAOYSA-N -1 3 367.265 3.873 20 0 FHADHM CC(C)(C)C[C@@H](NC(=S)Nc1ccccc1-c1nnn[n-]1)C(F)(F)F ZINC000824086894 609308531 /nfs/dbraw/zinc/30/85/31/609308531.db2.gz PQRFASJAPAXHMH-LLVKDONJSA-N -1 3 372.420 3.520 20 0 FHADHM CC(C)(C)C[C@@H](NC(=S)Nc1ccccc1-c1nn[n-]n1)C(F)(F)F ZINC000824086894 609308533 /nfs/dbraw/zinc/30/85/33/609308533.db2.gz PQRFASJAPAXHMH-LLVKDONJSA-N -1 3 372.420 3.520 20 0 FHADHM Cc1ccc(SCc2ccc(-c3nnn[n-]3)cc2Br)nc1 ZINC000826293259 609308965 /nfs/dbraw/zinc/30/89/65/609308965.db2.gz IKFYMYFMILTGEF-UHFFFAOYSA-N -1 3 362.256 3.625 20 0 FHADHM Cc1ccc(SCc2ccc(-c3nn[n-]n3)cc2Br)nc1 ZINC000826293259 609308968 /nfs/dbraw/zinc/30/89/68/609308968.db2.gz IKFYMYFMILTGEF-UHFFFAOYSA-N -1 3 362.256 3.625 20 0 FHADHM CCC(CC)[C@@H]1C[C@@H](Nc2ccc3cc(-c4nnn[n-]4)ccc3n2)CCO1 ZINC000825108340 609322131 /nfs/dbraw/zinc/32/21/31/609322131.db2.gz VYMBRFKHRDXHSQ-WMZOPIPTSA-N -1 3 366.469 3.811 20 0 FHADHM CCC(CC)[C@@H]1C[C@@H](Nc2ccc3cc(-c4nn[n-]n4)ccc3n2)CCO1 ZINC000825108340 609322133 /nfs/dbraw/zinc/32/21/33/609322133.db2.gz VYMBRFKHRDXHSQ-WMZOPIPTSA-N -1 3 366.469 3.811 20 0 FHADHM CCC1(CNC(=O)c2ccccc2Oc2ccccc2-c2nnn[n-]2)CC1 ZINC000825171696 609327390 /nfs/dbraw/zinc/32/73/90/609327390.db2.gz UFBKPYSHGSHBSM-UHFFFAOYSA-N -1 3 363.421 3.579 20 0 FHADHM CCC1(CNC(=O)c2ccccc2Oc2ccccc2-c2nn[n-]n2)CC1 ZINC000825171696 609327392 /nfs/dbraw/zinc/32/73/92/609327392.db2.gz UFBKPYSHGSHBSM-UHFFFAOYSA-N -1 3 363.421 3.579 20 0 FHADHM C[C@@H](CSCCC(=O)Nc1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000824449879 609329934 /nfs/dbraw/zinc/32/99/34/609329934.db2.gz PWBCXPMVSUTPEF-AWEZNQCLSA-N -1 3 367.478 3.732 20 0 FHADHM C[C@@H](CSCCC(=O)Nc1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000824449879 609329936 /nfs/dbraw/zinc/32/99/36/609329936.db2.gz PWBCXPMVSUTPEF-AWEZNQCLSA-N -1 3 367.478 3.732 20 0 FHADHM C[C@@H](N[C@@H]1CCOc2c(Cl)cccc21)c1ccc(-c2nn[n-]n2)cc1F ZINC000824554323 609330456 /nfs/dbraw/zinc/33/04/56/609330456.db2.gz OTKLZEIDAQZZII-QLJPJBMISA-N -1 3 373.819 3.834 20 0 FHADHM CN(CCC1CC1)C(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000825918737 609331175 /nfs/dbraw/zinc/33/11/75/609331175.db2.gz KZYAYLUXUHRHKV-UHFFFAOYSA-N -1 3 363.421 3.531 20 0 FHADHM CN(CCC1CC1)C(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000825918737 609331178 /nfs/dbraw/zinc/33/11/78/609331178.db2.gz KZYAYLUXUHRHKV-UHFFFAOYSA-N -1 3 363.421 3.531 20 0 FHADHM C[C@@H](NCc1coc(-c2ccccc2)n1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824624585 609337221 /nfs/dbraw/zinc/33/72/21/609337221.db2.gz AJNSEDVXJIWRQB-GFCCVEGCSA-N -1 3 364.384 3.512 20 0 FHADHM C[C@@H](NCc1coc(-c2ccccc2)n1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824624585 609337223 /nfs/dbraw/zinc/33/72/23/609337223.db2.gz AJNSEDVXJIWRQB-GFCCVEGCSA-N -1 3 364.384 3.512 20 0 FHADHM CCc1nc2cc(N[C@H](C)c3ccc(-c4nnn[n-]4)cc3F)ccc2o1 ZINC000825750276 609346015 /nfs/dbraw/zinc/34/60/15/609346015.db2.gz OWQLCNRCTCBIEP-SNVBAGLBSA-N -1 3 352.373 3.883 20 0 FHADHM CCc1nc2cc(N[C@H](C)c3ccc(-c4nn[n-]n4)cc3F)ccc2o1 ZINC000825750276 609346017 /nfs/dbraw/zinc/34/60/17/609346017.db2.gz OWQLCNRCTCBIEP-SNVBAGLBSA-N -1 3 352.373 3.883 20 0 FHADHM C[C@H](Nc1ccc(OCC(F)F)cc1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824656560 609347139 /nfs/dbraw/zinc/34/71/39/609347139.db2.gz LUICXBVSZUSKRQ-JTQLQIEISA-N -1 3 363.343 3.823 20 0 FHADHM C[C@H](Nc1ccc(OCC(F)F)cc1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824656560 609347140 /nfs/dbraw/zinc/34/71/40/609347140.db2.gz LUICXBVSZUSKRQ-JTQLQIEISA-N -1 3 363.343 3.823 20 0 FHADHM CCSCCOC(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000825674696 609351322 /nfs/dbraw/zinc/35/13/22/609351322.db2.gz QOGOVTPXUQWERO-UHFFFAOYSA-N -1 3 370.434 3.569 20 0 FHADHM CCSCCOC(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000825674696 609351325 /nfs/dbraw/zinc/35/13/25/609351325.db2.gz QOGOVTPXUQWERO-UHFFFAOYSA-N -1 3 370.434 3.569 20 0 FHADHM Cc1ccc(-c2ccc(C(=O)Nc3sccc3-c3nnn[n-]3)s2)o1 ZINC000826273804 609371182 /nfs/dbraw/zinc/37/11/82/609371182.db2.gz VBHNSOLMRUECAS-UHFFFAOYSA-N -1 3 357.420 3.810 20 0 FHADHM Cc1ccc(-c2ccc(C(=O)Nc3sccc3-c3nn[n-]n3)s2)o1 ZINC000826273804 609371185 /nfs/dbraw/zinc/37/11/85/609371185.db2.gz VBHNSOLMRUECAS-UHFFFAOYSA-N -1 3 357.420 3.810 20 0 FHADHM CCc1cc(NC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)ccc1C ZINC000825700828 609383626 /nfs/dbraw/zinc/38/36/26/609383626.db2.gz UZQLSKGPLNCEDW-CYBMUJFWSA-N -1 3 350.426 3.620 20 0 FHADHM CCc1cc(NC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)ccc1C ZINC000825700828 609383627 /nfs/dbraw/zinc/38/36/27/609383627.db2.gz UZQLSKGPLNCEDW-CYBMUJFWSA-N -1 3 350.426 3.620 20 0 FHADHM CC(=Cc1ccc(C)cc1)C(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000823943916 609424229 /nfs/dbraw/zinc/42/42/29/609424229.db2.gz VCULDHRKUWQMPV-DTQAZKPQSA-N -1 3 373.460 3.770 20 0 FHADHM CC(=Cc1ccc(C)cc1)C(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000823943916 609424231 /nfs/dbraw/zinc/42/42/31/609424231.db2.gz VCULDHRKUWQMPV-DTQAZKPQSA-N -1 3 373.460 3.770 20 0 FHADHM CCCCNC(=O)N[C@H](C)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000825285064 609443510 /nfs/dbraw/zinc/44/35/10/609443510.db2.gz IGWZIFRKNBCILG-CQSZACIVSA-N -1 3 364.453 3.694 20 0 FHADHM CCCCNC(=O)N[C@H](C)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000825285064 609443513 /nfs/dbraw/zinc/44/35/13/609443513.db2.gz IGWZIFRKNBCILG-CQSZACIVSA-N -1 3 364.453 3.694 20 0 FHADHM Cc1cccc(C)c1Oc1ccccc1NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC000826296640 609445240 /nfs/dbraw/zinc/44/52/40/609445240.db2.gz DQRHIKJZAUNHNO-UHFFFAOYSA-N -1 3 374.404 3.856 20 0 FHADHM Cc1cccc(C)c1Oc1ccccc1NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC000826296640 609445243 /nfs/dbraw/zinc/44/52/43/609445243.db2.gz DQRHIKJZAUNHNO-UHFFFAOYSA-N -1 3 374.404 3.856 20 0 FHADHM Cc1c2ccccc2oc1[C@@H](C)Nc1nc2ccccn2c1-c1nnn[n-]1 ZINC000826235034 609463816 /nfs/dbraw/zinc/46/38/16/609463816.db2.gz ADQFROVNCMJYKG-GFCCVEGCSA-N -1 3 359.393 3.742 20 0 FHADHM Cc1c2ccccc2oc1[C@@H](C)Nc1nc2ccccn2c1-c1nn[n-]n1 ZINC000826235034 609463819 /nfs/dbraw/zinc/46/38/19/609463819.db2.gz ADQFROVNCMJYKG-GFCCVEGCSA-N -1 3 359.393 3.742 20 0 FHADHM CCC(=O)Nc1ccc(Cl)c(NCc2cccc(-c3nnn[n-]3)c2F)c1 ZINC000825034367 609478390 /nfs/dbraw/zinc/47/83/90/609478390.db2.gz IJWUVAWTCCPJPA-UHFFFAOYSA-N -1 3 374.807 3.620 20 0 FHADHM CCC(=O)Nc1ccc(Cl)c(NCc2cccc(-c3nn[n-]n3)c2F)c1 ZINC000825034367 609478392 /nfs/dbraw/zinc/47/83/92/609478392.db2.gz IJWUVAWTCCPJPA-UHFFFAOYSA-N -1 3 374.807 3.620 20 0 FHADHM Cc1c(Br)cccc1NCc1cccc(-c2nnn[n-]2)c1F ZINC000826233930 609479448 /nfs/dbraw/zinc/47/94/48/609479448.db2.gz ADQOICGFZLVAEN-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Cc1c(Br)cccc1NCc1cccc(-c2nn[n-]n2)c1F ZINC000826233930 609479450 /nfs/dbraw/zinc/47/94/50/609479450.db2.gz ADQOICGFZLVAEN-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NCc1ccc(OCc2ccncc2)cc1 ZINC000826278482 609479777 /nfs/dbraw/zinc/47/97/77/609479777.db2.gz FMKZSAXVJWSHFL-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NCc1ccc(OCc2ccncc2)cc1 ZINC000826278482 609479779 /nfs/dbraw/zinc/47/97/79/609479779.db2.gz FMKZSAXVJWSHFL-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM CC(C)(C)OC(=O)CCCSc1cccc(Cl)c1-c1nnn[n-]1 ZINC000824100502 609488978 /nfs/dbraw/zinc/48/89/78/609488978.db2.gz RYWIPSALGLUDSW-UHFFFAOYSA-N -1 3 354.863 3.734 20 0 FHADHM CC(C)(C)OC(=O)CCCSc1cccc(Cl)c1-c1nn[n-]n1 ZINC000824100502 609488979 /nfs/dbraw/zinc/48/89/79/609488979.db2.gz RYWIPSALGLUDSW-UHFFFAOYSA-N -1 3 354.863 3.734 20 0 FHADHM CCOC(=O)Nc1ccc(NCc2cc(C)ccc2C)cc1-c1nnn[n-]1 ZINC000825552588 609490559 /nfs/dbraw/zinc/49/05/59/609490559.db2.gz ALBWPFUFWYVRJW-UHFFFAOYSA-N -1 3 366.425 3.664 20 0 FHADHM CCOC(=O)Nc1ccc(NCc2cc(C)ccc2C)cc1-c1nn[n-]n1 ZINC000825552588 609490561 /nfs/dbraw/zinc/49/05/61/609490561.db2.gz ALBWPFUFWYVRJW-UHFFFAOYSA-N -1 3 366.425 3.664 20 0 FHADHM CCOC(=O)Nc1ccc(NCc2cc(C)cc(C)c2)cc1-c1nnn[n-]1 ZINC000825552602 609490593 /nfs/dbraw/zinc/49/05/93/609490593.db2.gz AUVSIJSWPWCLMK-UHFFFAOYSA-N -1 3 366.425 3.664 20 0 FHADHM CCOC(=O)Nc1ccc(NCc2cc(C)cc(C)c2)cc1-c1nn[n-]n1 ZINC000825552602 609490595 /nfs/dbraw/zinc/49/05/95/609490595.db2.gz AUVSIJSWPWCLMK-UHFFFAOYSA-N -1 3 366.425 3.664 20 0 FHADHM CC(C)Oc1ccc(NCC2=Cc3ccccc3OC2)cc1-c1nnn[n-]1 ZINC000824329125 609492462 /nfs/dbraw/zinc/49/24/62/609492462.db2.gz IZNKNQAXBGYWLZ-UHFFFAOYSA-N -1 3 363.421 3.542 20 0 FHADHM CC(C)Oc1ccc(NCC2=Cc3ccccc3OC2)cc1-c1nn[n-]n1 ZINC000824329125 609492464 /nfs/dbraw/zinc/49/24/64/609492464.db2.gz IZNKNQAXBGYWLZ-UHFFFAOYSA-N -1 3 363.421 3.542 20 0 FHADHM CCN(C(=O)[C@@H](C)c1ccccc1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825376875 609509626 /nfs/dbraw/zinc/50/96/26/609509626.db2.gz OSDKEHAAJUJYQC-LBPRGKRZSA-N -1 3 355.829 3.677 20 0 FHADHM CCN(C(=O)[C@@H](C)c1ccccc1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825376875 609509627 /nfs/dbraw/zinc/50/96/27/609509627.db2.gz OSDKEHAAJUJYQC-LBPRGKRZSA-N -1 3 355.829 3.677 20 0 FHADHM CC[C@@H](C)[C@@H](C)C(=O)Nc1ncc(Cc2ccc(-c3nnn[n-]3)cc2)s1 ZINC000825052146 609516843 /nfs/dbraw/zinc/51/68/43/609516843.db2.gz VANAKBVDOHVJMJ-VXGBXAGGSA-N -1 3 370.482 3.535 20 0 FHADHM CC[C@@H](C)[C@@H](C)C(=O)Nc1ncc(Cc2ccc(-c3nn[n-]n3)cc2)s1 ZINC000825052146 609516844 /nfs/dbraw/zinc/51/68/44/609516844.db2.gz VANAKBVDOHVJMJ-VXGBXAGGSA-N -1 3 370.482 3.535 20 0 FHADHM CC/C(C)=C(\C)C(=O)Nc1ncc(Cc2ccc(-c3nnn[n-]3)cc2)s1 ZINC000825050673 609517341 /nfs/dbraw/zinc/51/73/41/609517341.db2.gz KVKURANGENUXIE-VAWYXSNFSA-N -1 3 368.466 3.599 20 0 FHADHM CC/C(C)=C(\C)C(=O)Nc1ncc(Cc2ccc(-c3nn[n-]n3)cc2)s1 ZINC000825050673 609517343 /nfs/dbraw/zinc/51/73/43/609517343.db2.gz KVKURANGENUXIE-VAWYXSNFSA-N -1 3 368.466 3.599 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@H]1C[C@H](C)C[C@H](C)C1 ZINC000824875766 609520992 /nfs/dbraw/zinc/52/09/92/609520992.db2.gz OTAIXKFWSJCRIC-HWWDLCQESA-N -1 3 355.486 3.676 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@H]1C[C@H](C)C[C@H](C)C1 ZINC000824875766 609520993 /nfs/dbraw/zinc/52/09/93/609520993.db2.gz OTAIXKFWSJCRIC-HWWDLCQESA-N -1 3 355.486 3.676 20 0 FHADHM COc1ccc([C@@H](Nc2nccc(C)c2-c2nnn[n-]2)c2ccccc2)cc1 ZINC000826188640 609521714 /nfs/dbraw/zinc/52/17/14/609521714.db2.gz BWYIGTRHJNTMTF-IBGZPJMESA-N -1 3 372.432 3.780 20 0 FHADHM COc1ccc([C@@H](Nc2nccc(C)c2-c2nn[n-]n2)c2ccccc2)cc1 ZINC000826188640 609521715 /nfs/dbraw/zinc/52/17/15/609521715.db2.gz BWYIGTRHJNTMTF-IBGZPJMESA-N -1 3 372.432 3.780 20 0 FHADHM Cc1ccnc(N[C@@H]2CCCc3cc(OC(F)F)ccc32)c1-c1nnn[n-]1 ZINC000826312454 609543193 /nfs/dbraw/zinc/54/31/93/609543193.db2.gz DZALPRYFVYVRQQ-CQSZACIVSA-N -1 3 372.379 3.661 20 0 FHADHM Cc1ccnc(N[C@@H]2CCCc3cc(OC(F)F)ccc32)c1-c1nn[n-]n1 ZINC000826312454 609543194 /nfs/dbraw/zinc/54/31/94/609543194.db2.gz DZALPRYFVYVRQQ-CQSZACIVSA-N -1 3 372.379 3.661 20 0 FHADHM COc1cccc(F)c1[C@@H](C)Nc1ncc(Cl)c(C)c1-c1nnn[n-]1 ZINC000826216603 609561343 /nfs/dbraw/zinc/56/13/43/609561343.db2.gz GULYDRYDHUWBPE-SECBINFHSA-N -1 3 362.796 3.544 20 0 FHADHM COc1cccc(F)c1[C@@H](C)Nc1ncc(Cl)c(C)c1-c1nn[n-]n1 ZINC000826216603 609561344 /nfs/dbraw/zinc/56/13/44/609561344.db2.gz GULYDRYDHUWBPE-SECBINFHSA-N -1 3 362.796 3.544 20 0 FHADHM Cc1nc(N[C@H](C)c2cccc(-c3nnn[n-]3)c2)ccc1Br ZINC000826326827 609564889 /nfs/dbraw/zinc/56/48/89/609564889.db2.gz GOBYRXJWVRYGLA-SECBINFHSA-N -1 3 359.231 3.506 20 0 FHADHM Cc1nc(N[C@H](C)c2cccc(-c3nn[n-]n3)c2)ccc1Br ZINC000826326827 609564890 /nfs/dbraw/zinc/56/48/90/609564890.db2.gz GOBYRXJWVRYGLA-SECBINFHSA-N -1 3 359.231 3.506 20 0 FHADHM Cc1ccnc(N2CCCC[C@H]2c2cc3ccccc3[nH]2)c1-c1nnn[n-]1 ZINC000826310778 609577032 /nfs/dbraw/zinc/57/70/32/609577032.db2.gz IANZKOFNEDDACJ-KRWDZBQOSA-N -1 3 359.437 3.783 20 0 FHADHM Cc1ccnc(N2CCCC[C@H]2c2cc3ccccc3[nH]2)c1-c1nn[n-]n1 ZINC000826310778 609577034 /nfs/dbraw/zinc/57/70/34/609577034.db2.gz IANZKOFNEDDACJ-KRWDZBQOSA-N -1 3 359.437 3.783 20 0 FHADHM C[C@@H]1C[C@H](CCNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)CCO1 ZINC000824886105 609596455 /nfs/dbraw/zinc/59/64/55/609596455.db2.gz VUAQOTMISQANTL-GHMZBOCLSA-N -1 3 355.364 3.503 20 0 FHADHM C[C@@H]1C[C@H](CCNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)CCO1 ZINC000824886105 609596458 /nfs/dbraw/zinc/59/64/58/609596458.db2.gz VUAQOTMISQANTL-GHMZBOCLSA-N -1 3 355.364 3.503 20 0 FHADHM CS[C@H](C(=O)OCc1ccc(Cl)cc1-c1nnn[n-]1)c1ccccc1 ZINC000826224408 609612791 /nfs/dbraw/zinc/61/27/91/609612791.db2.gz CLBPMNYJGXJETQ-HNNXBMFYSA-N -1 3 374.853 3.668 20 0 FHADHM CS[C@H](C(=O)OCc1ccc(Cl)cc1-c1nn[n-]n1)c1ccccc1 ZINC000826224408 609612792 /nfs/dbraw/zinc/61/27/92/609612792.db2.gz CLBPMNYJGXJETQ-HNNXBMFYSA-N -1 3 374.853 3.668 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)NCCC3CC(F)(F)C3)cc2)cc(=O)[n-]1 ZINC000582947180 936312777 /nfs/dbraw/zinc/31/27/77/936312777.db2.gz BNMQERZLBSTHKM-UHFFFAOYSA-N -1 3 362.380 3.715 20 0 FHADHM CCc1oc(C(=O)[O-])cc1CN1CC[C@@H](OCCCc2ccccc2)C1 ZINC000583030183 936379773 /nfs/dbraw/zinc/37/97/73/936379773.db2.gz KKTPRJUVCJNZMY-GOSISDBHSA-N -1 3 357.450 3.764 20 0 FHADHM C[C@@H](NC(=O)NN=c1ccc(Cl)n[n-]1)c1cc(Cl)ccc1Cl ZINC000188072277 937083187 /nfs/dbraw/zinc/08/31/87/937083187.db2.gz LWKQXBHKQXNOIX-SSDOTTSWSA-N -1 3 360.632 3.824 20 0 FHADHM Cc1ccc(C2(c3noc(Cc4ccc([O-])c(F)c4)n3)CCOCC2)cc1 ZINC000583066584 937091166 /nfs/dbraw/zinc/09/11/66/937091166.db2.gz UKCNZFLSUDWCAT-UHFFFAOYSA-N -1 3 368.408 3.910 20 0 FHADHM Cc1nc(COC(C)(C)C)oc1C(=O)N=c1cc(-c2ccccc2C)[n-][nH]1 ZINC000583088724 937109597 /nfs/dbraw/zinc/10/95/97/937109597.db2.gz UHGMJBAXFLUGLF-UHFFFAOYSA-N -1 3 368.437 3.671 20 0 FHADHM Cc1c(NC(=O)c2c[n-]c3ccc(C)cc3c2=O)cnn1C1CCCC1 ZINC000583088464 937109751 /nfs/dbraw/zinc/10/97/51/937109751.db2.gz IQADNLZUSWZVDI-UHFFFAOYSA-N -1 3 350.422 3.709 20 0 FHADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)[C@H]3CCCc4sccc43)cc2)n1 ZINC000123049985 937114194 /nfs/dbraw/zinc/11/41/94/937114194.db2.gz FVQZKBMPLVWDOL-INIZCTEOSA-N -1 3 365.458 3.865 20 0 FHADHM CC(C)CC(=C([O-])Nc1nc(-c2cccnc2)ns1)c1ccccc1 ZINC000535930215 937124570 /nfs/dbraw/zinc/12/45/70/937124570.db2.gz NFFSZZOQRKHJIJ-INIZCTEOSA-N -1 3 352.463 3.790 20 0 FHADHM CCc1noc(CC)c1C[N-]S(=O)(=O)c1cc(Cl)ccc1Cl ZINC000088780513 927193591 /nfs/dbraw/zinc/19/35/91/927193591.db2.gz JNVFWLWUCOXDHZ-UHFFFAOYSA-N -1 3 363.266 3.585 20 0 FHADHM CCS(=O)(=O)[N-]c1ccc(NC(=O)C[C@@H]2CCC[C@H](C)C2)cc1OC ZINC000153910955 937147327 /nfs/dbraw/zinc/14/73/27/937147327.db2.gz IXTFBEFPQUQMGY-UONOGXRCSA-N -1 3 368.499 3.612 20 0 FHADHM C[C@@H]1CC[C@@H]([N-]S(=O)(=O)c2c(Cl)cccc2Br)C1 ZINC000304326942 927314599 /nfs/dbraw/zinc/31/45/99/927314599.db2.gz TVWLPFXBWGZZPI-RKDXNWHRSA-N -1 3 352.681 3.569 20 0 FHADHM O=C(c1ccc(O)cc1[O-])N1CCC[C@@H](c2nc(C(F)(F)F)cs2)C1 ZINC000153908330 937151785 /nfs/dbraw/zinc/15/17/85/937151785.db2.gz XPNGQVDRJWEUCN-SECBINFHSA-N -1 3 372.368 3.593 20 0 FHADHM C[C@H]([N-]S(=O)(=O)c1cccc(Cl)c1Br)C1CCC1 ZINC000683145551 927461587 /nfs/dbraw/zinc/46/15/87/927461587.db2.gz VBXBYFUSNUXCQE-QMMMGPOBSA-N -1 3 352.681 3.569 20 0 FHADHM O=C([O-])[C@@H](CNCc1csc(-c2ccsc2)n1)Cc1ccccc1 ZINC000683170746 927736154 /nfs/dbraw/zinc/73/61/54/927736154.db2.gz BVGXHMPTJBCLNA-OAHLLOKOSA-N -1 3 358.488 3.905 20 0 FHADHM COc1ccc([C@H](CC(=O)[O-])NCc2cc3cc(OC)ccc3o2)cc1 ZINC000683171832 927740707 /nfs/dbraw/zinc/74/07/07/927740707.db2.gz QJOCRXLTKRZVHK-SFHVURJKSA-N -1 3 355.390 3.756 20 0 FHADHM CCCCc1nc(NC(=O)c2cccc3oc(C)nc32)c(C(=O)OCC)[n-]1 ZINC000471146798 927958343 /nfs/dbraw/zinc/95/83/43/927958343.db2.gz GMMFWDSTSUKLHB-UHFFFAOYSA-N -1 3 370.409 3.631 20 0 FHADHM O=c1[nH]c(CC(F)(F)F)c([O-])n1-c1ccc(Cl)c(C(F)(F)F)c1 ZINC000278122051 937220978 /nfs/dbraw/zinc/22/09/78/937220978.db2.gz QKAGSVJCHHAQEV-QMMMGPOBSA-N -1 3 360.641 3.736 20 0 FHADHM Cc1ccc(CN(CC(C)C)C(=O)c2cc(=O)[n-]c(C3CC3)n2)c(C)c1 ZINC000655157184 928373617 /nfs/dbraw/zinc/37/36/17/928373617.db2.gz YJGPNCPKYZUDBS-UHFFFAOYSA-N -1 3 353.466 3.975 20 0 FHADHM CCCCn1ccnc1-c1cccc(NC(=O)c2cccc3n[n-]nc32)c1 ZINC000583241850 937272869 /nfs/dbraw/zinc/27/28/69/937272869.db2.gz NWCUMYPTTOWFHQ-UHFFFAOYSA-N -1 3 360.421 3.874 20 0 FHADHM Cc1ccc(NC(=O)c2ccc3c(c2)[n-]c(=S)[nH]c3=O)c(CN(C)C)c1 ZINC000073129202 928791706 /nfs/dbraw/zinc/79/17/06/928791706.db2.gz IOHHWVBVKKNWBV-UHFFFAOYSA-N -1 3 368.462 3.620 20 0 FHADHM COc1ccc(CN(C)C)cc1[N-]S(=O)(=O)c1cccc(C(C)C)c1 ZINC000547712770 928816509 /nfs/dbraw/zinc/81/65/09/928816509.db2.gz BZZAEDNXLJXUJG-UHFFFAOYSA-N -1 3 362.495 3.681 20 0 FHADHM CC(=O)N1CCc2cc([N-]S(=O)(=O)c3c(C)c(C)cc(C)c3C)ccc21 ZINC000012068287 928826521 /nfs/dbraw/zinc/82/65/21/928826521.db2.gz RJUXIRRLOMZHQU-UHFFFAOYSA-N -1 3 372.490 3.630 20 0 FHADHM CSc1ccccc1S(=O)(=O)[N-][C@H](c1ccccc1)C(F)(F)F ZINC000547714280 928828264 /nfs/dbraw/zinc/82/82/64/928828264.db2.gz RJQPGDDHVUIBGQ-CQSZACIVSA-N -1 3 361.410 3.990 20 0 FHADHM Cc1ccc([N-]S(=O)(=O)c2ccc(C)c(C(=O)NC3CC(C)C3)c2)cc1 ZINC000080043831 937322417 /nfs/dbraw/zinc/32/24/17/937322417.db2.gz WDXYDRJRWJYAIJ-UHFFFAOYSA-N -1 3 372.490 3.633 20 0 FHADHM C[C@@H]1Cc2cc(S(=O)(=O)[N-]c3cncc(Cl)c3Cl)ccc2O1 ZINC000180287296 929444330 /nfs/dbraw/zinc/44/43/30/929444330.db2.gz MXLYGYOGADLXAU-MRVPVSSYSA-N -1 3 359.234 3.513 20 0 FHADHM C[C@H]1Cc2cc(S(=O)(=O)[N-]c3cncc(Cl)c3Cl)ccc2O1 ZINC000180287315 929444517 /nfs/dbraw/zinc/44/45/17/929444517.db2.gz MXLYGYOGADLXAU-QMMMGPOBSA-N -1 3 359.234 3.513 20 0 FHADHM Cn1cnc2cc([N-]S(=O)(=O)Cc3ccc(Cl)cc3Cl)ccc21 ZINC000683708236 929869424 /nfs/dbraw/zinc/86/94/24/929869424.db2.gz WWPOPMKADXVHRW-UHFFFAOYSA-N -1 3 370.261 3.822 20 0 FHADHM CC(C)COC[C@@H]([N-]S(=O)(=O)/C=C\c1ccc(F)cc1)c1ccco1 ZINC000255168314 930238825 /nfs/dbraw/zinc/23/88/25/930238825.db2.gz JAZKJBLOEBGARS-FPISAVPCSA-N -1 3 367.442 3.723 20 0 FHADHM Cc1ccc(-c2cc(C(=O)OCc3c(C)nn(C(F)F)c3C)n[n-]2)o1 ZINC000785006883 930329356 /nfs/dbraw/zinc/32/93/56/930329356.db2.gz DEZBXWFHVBEULN-UHFFFAOYSA-N -1 3 350.325 3.544 20 0 FHADHM Cc1ccc(-c2cc(C(=O)OCc3c(C)nn(C(F)F)c3C)[n-]n2)o1 ZINC000785006883 930329363 /nfs/dbraw/zinc/32/93/63/930329363.db2.gz DEZBXWFHVBEULN-UHFFFAOYSA-N -1 3 350.325 3.544 20 0 FHADHM O=C(Cc1ccc(OCCOc2ccccc2)cc1)[N-]OCC1CCC1 ZINC001167369120 930376337 /nfs/dbraw/zinc/37/63/37/930376337.db2.gz QLFJAGNSGNJGLD-UHFFFAOYSA-N -1 3 355.434 3.535 20 0 FHADHM Cc1cc(=O)[n-]c(C(C)(C)NC(=O)[C@H](C)Oc2cccc(C(C)(C)C)c2)n1 ZINC000622738930 930520605 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CC[C@@H](C(=O)N1CCCc2c(=O)[n-]cnc21)c1cccc(C(F)(F)F)c1 ZINC000893212426 942626214 /nfs/dbraw/zinc/62/62/14/942626214.db2.gz FSYJLKCDAJPIHI-CYBMUJFWSA-N -1 3 365.355 3.674 20 0 FHADHM COc1ccc(OC)c(-c2csc([N-]c3ncnc4ccncc43)n2)c1 ZINC000502698581 942665739 /nfs/dbraw/zinc/66/57/39/942665739.db2.gz NTRDEEUKHNPUMT-UHFFFAOYSA-N -1 3 365.418 3.909 20 0 FHADHM O=c1[n-]c(CN2CCOc3c(F)cccc3C2)nc2c3ccccc3oc21 ZINC000434612969 942797838 /nfs/dbraw/zinc/79/78/38/942797838.db2.gz YOQYTGQKPOMCDI-UHFFFAOYSA-N -1 3 365.364 3.615 20 0 FHADHM CC(C)c1cccc(-c2ccc(C(=O)N3CCc4c(nc[n-]c4=O)C3)o2)c1 ZINC000273203073 942907086 /nfs/dbraw/zinc/90/70/86/942907086.db2.gz IQPXOGBLGFCMFI-UHFFFAOYSA-N -1 3 363.417 3.764 20 0 FHADHM O=C(C=CCc1ccc(F)cc1)N=c1cc2ccc(Br)cn2[n-]1 ZINC000430102356 942915042 /nfs/dbraw/zinc/91/50/42/942915042.db2.gz AKUSXBZJAPWZBL-OWOJBTEDSA-N -1 3 374.213 3.700 20 0 FHADHM CCC1(CC)CCN(C(=O)c2cc(NC(=O)c3cnoc3C)ccc2[O-])C1 ZINC000273458770 942961925 /nfs/dbraw/zinc/96/19/25/942961925.db2.gz 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ZINC000503600504 943293229 /nfs/dbraw/zinc/29/32/29/943293229.db2.gz DQPOVKUEOXJYTQ-UHFFFAOYSA-N -1 3 357.435 3.681 20 0 FHADHM O=c1cc(CNc2cc(F)cc(F)c2Br)nc(C2CC2)[n-]1 ZINC000417026793 943302348 /nfs/dbraw/zinc/30/23/48/943302348.db2.gz LTICXFKRTCBRQH-UHFFFAOYSA-N -1 3 356.170 3.712 20 0 FHADHM CCc1ccc([O-])c(C(=O)NOCc2ccc(F)cc2Br)c1 ZINC000781878545 943307336 /nfs/dbraw/zinc/30/73/36/943307336.db2.gz AXXFPFKNERPFIR-UHFFFAOYSA-N -1 3 368.202 3.718 20 0 FHADHM CCCc1cc(=O)[n-]c(C(=Cc2cc(OC)c(OC)c(OC)c2)CC)n1 ZINC000435339437 943341207 /nfs/dbraw/zinc/34/12/07/943341207.db2.gz TZHPORIEMKEVRK-ZROIWOOFSA-N -1 3 358.438 3.699 20 0 FHADHM CCCc1cc(=O)[n-]c(C(=Cc2c(Br)cnn2C)CC)n1 ZINC000435341458 943342948 /nfs/dbraw/zinc/34/29/48/943342948.db2.gz XOGKIWGGEHLJOW-YFHOEESVSA-N -1 3 351.248 3.581 20 0 FHADHM O=C(CCC(=O)c1cccc(F)c1)Nc1cc(Br)ccc1[O-] ZINC000503732568 943357073 /nfs/dbraw/zinc/35/70/73/943357073.db2.gz CJTOFMNUHZTDAK-UHFFFAOYSA-N -1 3 366.186 3.895 20 0 FHADHM CC(C)CCc1nc(C[S@](=O)Cc2cc(=O)[n-]c(C3CC3)n2)cs1 ZINC000417141414 943367606 /nfs/dbraw/zinc/36/76/06/943367606.db2.gz QDOKKNNRMSQJMV-XMMPIXPASA-N -1 3 365.524 3.554 20 0 FHADHM CN(C(=O)c1c[n-]c2c(F)cc(F)cc2c1=O)c1ccc2cc[nH]c2c1 ZINC000473556724 943448401 /nfs/dbraw/zinc/44/84/01/943448401.db2.gz XBRUMDYDDWWYSF-UHFFFAOYSA-N -1 3 353.328 3.564 20 0 FHADHM O=C(Cc1ccc(OC(F)F)cc1)Nc1ccc(Br)cc1[O-] ZINC000515205722 943566170 /nfs/dbraw/zinc/56/61/70/943566170.db2.gz ZSKGWGZYMAVZSE-UHFFFAOYSA-N -1 3 372.165 3.937 20 0 FHADHM O=C(Cc1cnn(-c2ccccc2)c1)Nc1ccc(Br)cc1[O-] ZINC000515205490 943566850 /nfs/dbraw/zinc/56/68/50/943566850.db2.gz CVNCJNGUCRVYBX-UHFFFAOYSA-N -1 3 372.222 3.522 20 0 FHADHM COc1cc(C)c([N-]S(=O)(=O)c2cccc(Br)c2)cc1C ZINC000435717090 943577226 /nfs/dbraw/zinc/57/72/26/943577226.db2.gz JYKXXKDQGSCMLN-UHFFFAOYSA-N -1 3 370.268 3.875 20 0 FHADHM COc1cc(C)c([N-]S(=O)(=O)c2ccc3c(c2)CC(C)(C)O3)cc1C ZINC000435733215 943587470 /nfs/dbraw/zinc/58/74/70/943587470.db2.gz RUBMHBRKNMKESN-UHFFFAOYSA-N -1 3 361.463 3.826 20 0 FHADHM CCN(CC)c1ccc(-c2nnc(SCc3ncccc3[O-])o2)cc1 ZINC000584791252 943622467 /nfs/dbraw/zinc/62/24/67/943622467.db2.gz CRRNQCMFUSNHHT-UHFFFAOYSA-N -1 3 356.451 3.976 20 0 FHADHM CC1CCC(C)([N-]S(=O)(=O)c2ccc(Br)s2)CC1 ZINC000504475813 943640323 /nfs/dbraw/zinc/64/03/23/943640323.db2.gz BJVQUEKWJDCURM-UHFFFAOYSA-N -1 3 352.319 3.758 20 0 FHADHM CCCc1csc(CNC[C@@H](Cc2ccccc2Cl)C(=O)[O-])n1 ZINC000417549584 943695816 /nfs/dbraw/zinc/69/58/16/943695816.db2.gz TZPWFASFYVVCPX-CYBMUJFWSA-N -1 3 352.887 3.782 20 0 FHADHM COc1ccc([C@H](CC(=O)[O-])NCc2ccc(C3CC3)cc2)cc1OC ZINC000417553393 943700630 /nfs/dbraw/zinc/70/06/30/943700630.db2.gz HERNPNMIXJGIMP-SFHVURJKSA-N -1 3 355.434 3.887 20 0 FHADHM COc1cc(CN[C@@H]2C[C@H](C(=O)[O-])c3ccccc32)c(SC)cc1OC ZINC000417618591 943754581 /nfs/dbraw/zinc/75/45/81/943754581.db2.gz DFSFYGBXAZHZOK-JKSUJKDBSA-N -1 3 373.474 3.829 20 0 FHADHM O=C([O-])C[C@@H](CNCc1ccc(Br)cc1Cl)C(F)F ZINC000417629149 943767858 /nfs/dbraw/zinc/76/78/58/943767858.db2.gz VGMPIAVBRFDDNG-QMMMGPOBSA-N -1 3 356.594 3.548 20 0 FHADHM O=C(N[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1)c1ccc(O)cc1[O-] ZINC000437410715 943784010 /nfs/dbraw/zinc/78/40/10/943784010.db2.gz ZGBPFHVNVCPKFH-AULYBMBSSA-N -1 3 351.324 3.793 20 0 FHADHM CC(C)C[C@@H](NC(=O)CN1CCCC[C@@H]1CCC(=O)[O-])c1ccccc1 ZINC000424248942 943804954 /nfs/dbraw/zinc/80/49/54/943804954.db2.gz ACVDIKDJKIEHPJ-RTBURBONSA-N -1 3 360.498 3.609 20 0 FHADHM C[C@H](NC(=O)CN1CCCC[C@@H]1CCC(=O)[O-])c1ccc2ccccc2c1 ZINC000424254923 943808482 /nfs/dbraw/zinc/80/84/82/943808482.db2.gz HIRPICCIHONLPS-OXJNMPFZSA-N -1 3 368.477 3.736 20 0 FHADHM CC(C)(C)OC(=O)C[C@H](NCc1ccc(-c2ccccc2)cc1F)C(=O)[O-] ZINC000417667238 943810645 /nfs/dbraw/zinc/81/06/45/943810645.db2.gz SJTDFRRAEOGWCH-SFHVURJKSA-N -1 3 373.424 3.767 20 0 FHADHM CCN(C(=O)CN1CCCC[C@H]1CCC(=O)[O-])c1cccc2ccccc21 ZINC000424262494 943811595 /nfs/dbraw/zinc/81/15/95/943811595.db2.gz QNMWYAXZFFJMRC-SFHVURJKSA-N -1 3 368.477 3.912 20 0 FHADHM C[C@@H](c1cc2ccccc2o1)N(C)C(=O)CN1CCCC[C@@H]1CCC(=O)[O-] ZINC000424262834 943812711 /nfs/dbraw/zinc/81/27/11/943812711.db2.gz QYUSQYZNDGWSDB-DOTOQJQBSA-N -1 3 372.465 3.672 20 0 FHADHM O=C([O-])CC[C@@H]1CCCCN1CC(=O)N[C@@H](c1ccccc1)C1CCCC1 ZINC000424266580 943813693 /nfs/dbraw/zinc/81/36/93/943813693.db2.gz XCXHXGWSRQLGJB-UGKGYDQZSA-N -1 3 372.509 3.753 20 0 FHADHM C[C@@H]1CCCN(Cc2cc(Cl)ccc2OCc2cccnc2)[C@H]1C(=O)[O-] ZINC000424270868 943828712 /nfs/dbraw/zinc/82/87/12/943828712.db2.gz OHQYIMJEKNBDLG-AUUYWEPGSA-N -1 3 374.868 3.999 20 0 FHADHM COC(=O)c1cccc2[n-]c(NC(=O)C3CCC(C(F)(F)F)CC3)nc21 ZINC000435903049 943836540 /nfs/dbraw/zinc/83/65/40/943836540.db2.gz PHYNEVYPNMGPLI-UHFFFAOYSA-N -1 3 369.343 3.657 20 0 FHADHM COCc1cccc(CC(=O)[N-]OCc2ccc(C(F)(F)F)cc2)c1 ZINC000189224614 943854386 /nfs/dbraw/zinc/85/43/86/943854386.db2.gz CEQGXZWHSOYUFX-UHFFFAOYSA-N -1 3 353.340 3.642 20 0 FHADHM CCc1ccc(CC)c([N-]S(=O)(=O)c2ccc(OCCOC)cc2)c1 ZINC000435974993 943897535 /nfs/dbraw/zinc/89/75/35/943897535.db2.gz RJMBBRRRTIQBHQ-UHFFFAOYSA-N -1 3 363.479 3.637 20 0 FHADHM Cc1ncc(CNC(=O)N[C@@H]2CCC[C@@H](c3cccc(Cl)c3)C2)c(=O)[n-]1 ZINC000517015354 943912285 /nfs/dbraw/zinc/91/22/85/943912285.db2.gz PWAUJNHXGWOMKO-RHSMWYFYSA-N -1 3 374.872 3.670 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)N3CCC[C@@H](CCF)C3)cc2)cc(=O)[n-]1 ZINC000664387475 943917309 /nfs/dbraw/zinc/91/73/09/943917309.db2.gz VTVIXVXHVIANPS-AWEZNQCLSA-N -1 3 358.417 3.761 20 0 FHADHM C[C@@H]1C[C@@]1(NC(=O)c1cc(=O)c2ccccc2[n-]1)c1ccc(Cl)cc1 ZINC000505743364 943933336 /nfs/dbraw/zinc/93/33/36/943933336.db2.gz GNANGWUDUGZLMG-ODXCJYRJSA-N -1 3 352.821 3.847 20 0 FHADHM Cc1noc(C)c1S(=O)(=O)[N-][C@H](CCc1ccccc1)c1ccccc1 ZINC000515524477 943976718 /nfs/dbraw/zinc/97/67/18/943976718.db2.gz HAFVNDAEZDMQMP-LJQANCHMSA-N -1 3 370.474 3.944 20 0 FHADHM Cc1cc(F)c(CN[C@H](CCSc2ccccc2)C(=O)[O-])c(F)c1 ZINC000424625336 944018396 /nfs/dbraw/zinc/01/83/96/944018396.db2.gz SPZBTSIDDHOOQR-QGZVFWFLSA-N -1 3 351.418 3.998 20 0 FHADHM O=C([O-])[C@@H]1CC[C@H](NCc2csc(COc3ccc(Cl)cc3)n2)C1 ZINC000424617046 944028185 /nfs/dbraw/zinc/02/81/85/944028185.db2.gz KQCFUQJVLKCABN-YPMHNXCESA-N -1 3 366.870 3.718 20 0 FHADHM CCSCC[C@@H](C)[N-]S(=O)(=O)c1sc(C)cc1Br ZINC000437702582 944045854 /nfs/dbraw/zinc/04/58/54/944045854.db2.gz JBDPXFVYBDYURN-MRVPVSSYSA-N -1 3 372.375 3.629 20 0 FHADHM CCn1nc(C)c(NC(=O)Nc2ccc(-c3cc(=O)[n-]c(C)n3)cc2)c1C ZINC000437765670 944082681 /nfs/dbraw/zinc/08/26/81/944082681.db2.gz PSEBIQAATQYPQF-UHFFFAOYSA-N -1 3 366.425 3.635 20 0 FHADHM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2ccc(OC3COC3)cc2)cc1 ZINC000436171848 944085149 /nfs/dbraw/zinc/08/51/49/944085149.db2.gz DSGHJMAKLHNEEU-AWEZNQCLSA-N -1 3 361.463 3.779 20 0 FHADHM CC(C)CO[C@H]1CCN(Cc2c(C(=O)[O-])sc3cccc(F)c32)C1 ZINC000517381776 944244233 /nfs/dbraw/zinc/24/42/33/944244233.db2.gz OOJNRWMAIFMQGH-LBPRGKRZSA-N -1 3 351.443 3.986 20 0 FHADHM Cc1nnc([C@H](C)[N-]S(=O)(=O)c2c(Cl)ccc3ccccc32)s1 ZINC000546074399 944269049 /nfs/dbraw/zinc/26/90/49/944269049.db2.gz WSGKLBHOSWLUOA-VIFPVBQESA-N -1 3 367.883 3.693 20 0 FHADHM Cc1noc(C)c1CNC(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000439051337 944297826 /nfs/dbraw/zinc/29/78/26/944297826.db2.gz CPKKZHVQQRLNIT-UHFFFAOYSA-N -1 3 350.418 3.712 20 0 FHADHM Cc1cccc(Oc2cc(CNC(=O)c3ccc(O)cc3[O-])ccn2)c1C ZINC000439053075 944299684 /nfs/dbraw/zinc/29/96/84/944299684.db2.gz FROPXWSXFUKAHG-UHFFFAOYSA-N -1 3 364.401 3.832 20 0 FHADHM Cc1cc(NC(=O)NN=c2ccc(Cl)n[n-]2)cc(C)c1Br ZINC000192418810 944337921 /nfs/dbraw/zinc/33/79/21/944337921.db2.gz XVOSFNCXEXAZSY-UHFFFAOYSA-N -1 3 370.638 3.658 20 0 FHADHM O=C(NCCc1coc(-c2ccc(F)cc2)n1)c1cc([O-])ccc1Cl ZINC000364327184 944344852 /nfs/dbraw/zinc/34/48/52/944344852.db2.gz ADYAWQHXXJEYME-UHFFFAOYSA-N -1 3 360.772 3.812 20 0 FHADHM [O-]c1coc2cc(OC[C@@H](O)Cn3c4ccccc4c4ccccc43)ccc12 ZINC000550177200 944353317 /nfs/dbraw/zinc/35/33/17/944353317.db2.gz RWAQWCBWDWHRNF-HNNXBMFYSA-N -1 3 373.408 3.810 20 0 FHADHM C[C@H](C(=O)N=c1cc(-c2cc(Cl)cc(Cl)c2)[n-][nH]1)C(F)(F)F ZINC000439150278 944365484 /nfs/dbraw/zinc/36/54/84/944365484.db2.gz CKDNDLTUYLLAQI-ZCFIWIBFSA-N -1 3 352.143 3.942 20 0 FHADHM CCc1ccc(C(=O)N2CCC(N3CCc4ccccc43)CC2)c([O-])c1 ZINC000436486363 944369803 /nfs/dbraw/zinc/36/98/03/944369803.db2.gz IWYZRSCAUAEKTQ-UHFFFAOYSA-N -1 3 350.462 3.622 20 0 FHADHM COc1cccc(C(=O)Nc2ncc(Cc3ccc(F)cc3)s2)c1[O-] ZINC000436490650 944373569 /nfs/dbraw/zinc/37/35/69/944373569.db2.gz YGEFDOLDIVDZIE-UHFFFAOYSA-N -1 3 358.394 3.840 20 0 FHADHM CNC(=O)c1cccc(NC(=O)c2cc(Cc3ccccc3)ccc2[O-])c1 ZINC000436513812 944384040 /nfs/dbraw/zinc/38/40/40/944384040.db2.gz NDUCJMNAFVJPEX-UHFFFAOYSA-N -1 3 360.413 3.595 20 0 FHADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CCO[C@H]2CCC[C@H]21 ZINC000436551796 944410088 /nfs/dbraw/zinc/41/00/88/944410088.db2.gz SJDNTCXDTGZXIJ-CTNGQTDRSA-N -1 3 351.446 3.571 20 0 FHADHM CCC[C@@H](NC(=O)c1ccc(C(C)C)cc1[O-])c1nnc2ccccn21 ZINC000436536110 944414435 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COc1ccc(C(=O)N(CCc2ccc(C)cc2)C[C@@H]2CCCO2)c([O-])c1 ZINC000436572755 944435372 /nfs/dbraw/zinc/43/53/72/944435372.db2.gz GJNBLCMPSKFUMY-IBGZPJMESA-N -1 3 369.461 3.573 20 0 FHADHM COc1ccc(C(=O)N2CC(OCc3cccc4ccccc43)C2)c([O-])c1 ZINC000436573156 944435965 /nfs/dbraw/zinc/43/59/65/944435965.db2.gz IDXUWXCDNYKZJW-UHFFFAOYSA-N -1 3 363.413 3.595 20 0 FHADHM CN(Cc1ccco1)Cc1ccccc1CNC(=O)c1cc(F)ccc1[O-] ZINC000436591369 944437759 /nfs/dbraw/zinc/43/77/59/944437759.db2.gz WGTFNUMOXSVOEE-UHFFFAOYSA-N -1 3 368.408 3.686 20 0 FHADHM CCc1c(NC(=O)c2cc(OC)ccc2[O-])cnn1-c1ccccc1C ZINC000436593018 944438135 /nfs/dbraw/zinc/43/81/35/944438135.db2.gz BMFIFSBTXRVDKX-UHFFFAOYSA-N -1 3 351.406 3.710 20 0 FHADHM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@H]1c1n[nH]c(-c2ccccc2)n1 ZINC000436600015 944442656 /nfs/dbraw/zinc/44/26/56/944442656.db2.gz GLQUEUCWCDOHSQ-HNNXBMFYSA-N -1 3 368.824 3.808 20 0 FHADHM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@@H]1c1n[nH]c(-c2ccccc2)n1 ZINC000436600016 944442807 /nfs/dbraw/zinc/44/28/07/944442807.db2.gz GLQUEUCWCDOHSQ-OAHLLOKOSA-N -1 3 368.824 3.808 20 0 FHADHM CCOc1ccc(S(=O)(=O)[N-]c2ccccc2N2CCCC2)c(C)c1 ZINC000517614919 944445088 /nfs/dbraw/zinc/44/50/88/944445088.db2.gz CAZRQUWLCNETHQ-UHFFFAOYSA-N -1 3 360.479 3.795 20 0 FHADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CCC[C@H]2COCC[C@H]21 ZINC000436587674 944449597 /nfs/dbraw/zinc/44/95/97/944449597.db2.gz QACPWNCKCUZAME-PZJWPPBQSA-N -1 3 365.473 3.819 20 0 FHADHM COCc1nc2cc(NC(=O)c3ccc4c(c3[O-])OC(C)(C)C4)ccc2o1 ZINC000436588511 944450338 /nfs/dbraw/zinc/45/03/38/944450338.db2.gz MYXGRNJUCWFJMR-UHFFFAOYSA-N -1 3 368.389 3.646 20 0 FHADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CCOCC12CCCC2 ZINC000436606898 944456811 /nfs/dbraw/zinc/45/68/11/944456811.db2.gz RCWXFMYJKKJJEV-UHFFFAOYSA-N -1 3 351.446 3.768 20 0 FHADHM Cc1nnc(-c2cccc(NC(=O)c3cc4c(cc3[O-])CCCC4)c2)n1C ZINC000436607749 944457485 /nfs/dbraw/zinc/45/74/85/944457485.db2.gz SJWLOJDBDKPMIQ-UHFFFAOYSA-N -1 3 362.433 3.627 20 0 FHADHM CN(C)[C@H](CNC(=O)c1cc(Cc2ccccc2)ccc1[O-])c1ccco1 ZINC000436614287 944463641 /nfs/dbraw/zinc/46/36/41/944463641.db2.gz VWMFQRCFUZGSIT-LJQANCHMSA-N -1 3 364.445 3.609 20 0 FHADHM COc1ccc(NC(=O)COC(=O)c2cc3ccsc3[n-]2)cc1Cl ZINC000023345633 944465877 /nfs/dbraw/zinc/46/58/77/944465877.db2.gz JAZWSEAHTVXBFN-UHFFFAOYSA-N -1 3 364.810 3.687 20 0 FHADHM COc1cc([C@H](C)NC(=O)c2ccc(O)cc2[O-])ccc1OC1CCCC1 ZINC000436625735 944466978 /nfs/dbraw/zinc/46/69/78/944466978.db2.gz PDLGWTDBZZORSY-ZDUSSCGKSA-N -1 3 371.433 3.919 20 0 FHADHM Cc1cccc(C(=O)Nc2ccc(Cl)c(F)c2N2CCOCC2)c1[O-] ZINC000436632792 944472688 /nfs/dbraw/zinc/47/26/88/944472688.db2.gz XUJPRTYJDQIIFV-UHFFFAOYSA-N -1 3 364.804 3.582 20 0 FHADHM CSc1ccc(-c2nsc(NC(=O)c3c([O-])cccc3O)n2)cc1 ZINC000436649954 944480720 /nfs/dbraw/zinc/48/07/20/944480720.db2.gz XBFYBFBNAHDWOR-UHFFFAOYSA-N -1 3 359.432 3.591 20 0 FHADHM CC(C)[C@@H](NC(=O)c1cc(Oc2ccccc2)ccc1[O-])c1ncon1 ZINC000436650213 944481972 /nfs/dbraw/zinc/48/19/72/944481972.db2.gz VIFXIGQWDVXTRK-QGZVFWFLSA-N -1 3 353.378 3.695 20 0 FHADHM CCCCOc1ccc(C(=O)N2Cc3ccc(O)cc3C3(CC3)C2)c([O-])c1 ZINC000436656103 944486891 /nfs/dbraw/zinc/48/68/91/944486891.db2.gz OKXZBTVNSAPINM-UHFFFAOYSA-N -1 3 367.445 3.964 20 0 FHADHM O=C(c1c([O-])cccc1O)N1CC[C@H](Oc2ccc(Cl)c(Cl)c2)C1 ZINC000436646005 944493708 /nfs/dbraw/zinc/49/37/08/944493708.db2.gz FSZAXPYZPVORAZ-NSHDSACASA-N -1 3 368.216 3.698 20 0 FHADHM CN(Cc1ccc(Br)cc1Cl)C(=O)c1c([O-])cccc1O ZINC000436672788 944506167 /nfs/dbraw/zinc/50/61/67/944506167.db2.gz COCGHFVRUUBYTD-UHFFFAOYSA-N -1 3 370.630 3.786 20 0 FHADHM O=C(N[C@@H]1CCO[C@H](C2CC2)C1)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436658320 944510005 /nfs/dbraw/zinc/51/00/05/944510005.db2.gz UUIYNUXFFNTFCN-KNQAVFIVSA-N -1 3 365.473 3.865 20 0 FHADHM CCOc1cc(CN[C@H](C(=O)[O-])c2ccc(C)cc2)cc(Cl)c1OC ZINC000426670656 944522496 /nfs/dbraw/zinc/52/24/96/944522496.db2.gz HHOQMWPEDMLULE-KRWDZBQOSA-N -1 3 363.841 3.971 20 0 FHADHM COc1cc(-c2nc(Cc3cccc(Cl)c3F)no2)cc(OC)c1[O-] ZINC000436686323 944525635 /nfs/dbraw/zinc/52/56/35/944525635.db2.gz DVCBQULURUTCRT-UHFFFAOYSA-N -1 3 364.760 3.843 20 0 FHADHM COc1cc(-c2nc(-c3cnc4ccsc4c3)no2)cc(OC)c1[O-] ZINC000436688743 944527491 /nfs/dbraw/zinc/52/74/91/944527491.db2.gz LOJSKCSVGUUHQF-UHFFFAOYSA-N -1 3 355.375 3.736 20 0 FHADHM COC(=O)c1cccc2[n-]c(NC(=O)c3cc(Cl)cc(Cl)c3)nc21 ZINC000438348717 944528886 /nfs/dbraw/zinc/52/88/86/944528886.db2.gz YOXLOQZOBUFNFM-UHFFFAOYSA-N -1 3 364.188 3.909 20 0 FHADHM COc1cc(-c2nc(CSc3ccc(F)cc3)no2)cc(OC)c1[O-] ZINC000436691007 944529256 /nfs/dbraw/zinc/52/92/56/944529256.db2.gz RMTBPXOCJWZZLC-UHFFFAOYSA-N -1 3 362.382 3.891 20 0 FHADHM Cc1ccc(C(=O)Nc2nc(CN3CCC(C)CC3)cs2)c([O-])c1C ZINC000436691427 944531132 /nfs/dbraw/zinc/53/11/32/944531132.db2.gz YEHRBHRDTVBOJT-UHFFFAOYSA-N -1 3 359.495 3.950 20 0 FHADHM O=C(c1ccc([O-])cc1)N1CCN(C/C=C\c2ccc(Cl)cc2)CC1 ZINC000436694726 944534533 /nfs/dbraw/zinc/53/45/33/944534533.db2.gz IMEHMCSORMWZQJ-UPHRSURJSA-N -1 3 356.853 3.517 20 0 FHADHM Cc1nc(CO[N-]C(=O)Cc2cccc3ccccc32)nc2ccccc12 ZINC000193627701 944535529 /nfs/dbraw/zinc/53/55/29/944535529.db2.gz VPZHQHBAQDEYBL-UHFFFAOYSA-N -1 3 357.413 3.882 20 0 FHADHM O=C(c1ccccc1[O-])N1CCN(Cc2cc(Cl)ccc2Cl)CC1 ZINC000436699014 944538024 /nfs/dbraw/zinc/53/80/24/944538024.db2.gz RYZYFUQYDMHXHA-UHFFFAOYSA-N -1 3 365.260 3.657 20 0 FHADHM O=C(Nc1cc(Br)ccc1[O-])c1cccc2ccc(=O)[nH]c21 ZINC000518619037 944549590 /nfs/dbraw/zinc/54/95/90/944549590.db2.gz DECTWNKFBIHACE-UHFFFAOYSA-N -1 3 359.179 3.661 20 0 FHADHM O=C(NC1(Cc2ccc(F)cc2Cl)CCOCC1)c1ccccc1[O-] ZINC000436724964 944564076 /nfs/dbraw/zinc/56/40/76/944564076.db2.gz TWJDPSKSJCTIFR-UHFFFAOYSA-N -1 3 363.816 3.706 20 0 FHADHM C/C=C/c1ccc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2[O-])cc1 ZINC000436741525 944571273 /nfs/dbraw/zinc/57/12/73/944571273.db2.gz CJWMVHDOCIWWPQ-OBNPVOHOSA-N -1 3 350.418 3.669 20 0 FHADHM CCOc1cc(-c2nc3ccc(OC)nc3[nH]2)cc(Br)c1[O-] ZINC000436743026 944571503 /nfs/dbraw/zinc/57/15/03/944571503.db2.gz WOKMGSPHGIIEQS-UHFFFAOYSA-N -1 3 364.199 3.500 20 0 FHADHM O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1c([O-])cc(Cl)cc1Cl ZINC000436756349 944580289 /nfs/dbraw/zinc/58/02/89/944580289.db2.gz CKFNFWHFUDJDCP-AWEZNQCLSA-N -1 3 365.260 3.703 20 0 FHADHM COc1ccc(C(=O)NCC2(c3cccc(C(F)(F)F)c3)CC2)c([O-])c1 ZINC000436750196 944588383 /nfs/dbraw/zinc/58/83/83/944588383.db2.gz WMMGDRLJOBAHSF-UHFFFAOYSA-N -1 3 365.351 3.881 20 0 FHADHM CC(C)c1ccc(C(=O)Nc2ccc(CN3CCOCC3)cc2)c([O-])c1 ZINC000436753656 944595565 /nfs/dbraw/zinc/59/55/65/944595565.db2.gz FNCLYGKEJKQIHI-UHFFFAOYSA-N -1 3 354.450 3.600 20 0 FHADHM COCCOc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(C)cc1[O-] ZINC000436754335 944596917 /nfs/dbraw/zinc/59/69/17/944596917.db2.gz HAVRYGBWISIGEV-UHFFFAOYSA-N -1 3 369.339 3.997 20 0 FHADHM COc1cc(C)c(NC(=O)c2ccc3c(c2[O-])OC(C)(C)C3)cc1OC ZINC000436756919 944599324 /nfs/dbraw/zinc/59/93/24/944599324.db2.gz SPJREETZBVSICO-UHFFFAOYSA-N -1 3 357.406 3.684 20 0 FHADHM CC(C)c1cc(C(=O)Nc2cccc(-c3nnn[n-]3)c2)c2ccccc2n1 ZINC000072728905 944603643 /nfs/dbraw/zinc/60/36/43/944603643.db2.gz KLMWBRUYRQXXDX-UHFFFAOYSA-N -1 3 358.405 3.791 20 0 FHADHM CC(C)c1cc(C(=O)Nc2cccc(-c3nn[n-]n3)c2)c2ccccc2n1 ZINC000072728905 944603645 /nfs/dbraw/zinc/60/36/45/944603645.db2.gz KLMWBRUYRQXXDX-UHFFFAOYSA-N -1 3 358.405 3.791 20 0 FHADHM CCOc1ccccc1[C@H](CC)NC(=O)c1cc(OC)c([O-])c(OC)c1 ZINC000436778283 944609582 /nfs/dbraw/zinc/60/95/82/944609582.db2.gz QENFTLFIUDBUTB-HNNXBMFYSA-N -1 3 359.422 3.689 20 0 FHADHM CCCN(C(=O)c1cc(NC(C)=O)ccc1[O-])[C@H](C)c1ccccc1OC ZINC000436785189 944629435 /nfs/dbraw/zinc/62/94/35/944629435.db2.gz DHSRLBINOOTBCR-CQSZACIVSA-N -1 3 370.449 3.973 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N[C@H]2c3cccc(F)c3CC[C@@H]2C)c1 ZINC000436785875 944631677 /nfs/dbraw/zinc/63/16/77/944631677.db2.gz HBUHIGTXMVCMIY-JEOXALJRSA-N -1 3 356.397 3.543 20 0 FHADHM CC(C)[C@@H](SCc1ccccc1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000609169849 944639118 /nfs/dbraw/zinc/63/91/18/944639118.db2.gz YELRQHSRNYTVBB-QGZVFWFLSA-N -1 3 367.478 3.763 20 0 FHADHM CC(C)[C@@H](SCc1ccccc1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000609169849 944639126 /nfs/dbraw/zinc/63/91/26/944639126.db2.gz YELRQHSRNYTVBB-QGZVFWFLSA-N -1 3 367.478 3.763 20 0 FHADHM C[C@H]1C[C@@H](CC(=O)N2CCN(C(=O)c3ccc([O-])cc3)CC2)CC(C)(C)C1 ZINC000436790639 944641341 /nfs/dbraw/zinc/64/13/41/944641341.db2.gz HDIOLRUGDIVSRS-IRXDYDNUSA-N -1 3 372.509 3.529 20 0 FHADHM CCc1ccc(C(=O)Nc2ccc(C(=O)Nc3cccnc3)cc2)c([O-])c1 ZINC000436795536 944648489 /nfs/dbraw/zinc/64/84/89/944648489.db2.gz FXXGIPQHWCRCTG-UHFFFAOYSA-N -1 3 361.401 3.854 20 0 FHADHM O=C(N=c1cc([C@@H]2CCCO2)[n-][nH]1)c1ccccc1COc1ccccc1 ZINC000473844089 944656043 /nfs/dbraw/zinc/65/60/43/944656043.db2.gz ASOCGMRULMELHO-IBGZPJMESA-N -1 3 363.417 3.514 20 0 FHADHM CCCc1c(NC(=O)c2cc(OC)ccc2[O-])cnn1-c1ccccc1 ZINC000436803548 944658167 /nfs/dbraw/zinc/65/81/67/944658167.db2.gz QBDKEUHRINFBCR-UHFFFAOYSA-N -1 3 351.406 3.791 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(C(=O)N3CCCC[C@H]3C)cc2)c([O-])c1 ZINC000436805825 944660199 /nfs/dbraw/zinc/66/01/99/944660199.db2.gz FTBFOCIVRQKADZ-OAHLLOKOSA-N -1 3 352.434 3.968 20 0 FHADHM COCC1(C)CCN(C(=O)c2cc(Cc3ccccc3)ccc2[O-])CC1 ZINC000436812109 944667701 /nfs/dbraw/zinc/66/77/01/944667701.db2.gz DBUNVRXBJXRANT-UHFFFAOYSA-N -1 3 353.462 3.872 20 0 FHADHM C[C@@H](O)C[C@@H]1CCCCN1C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436812919 944668479 /nfs/dbraw/zinc/66/84/79/944668479.db2.gz YMCVSZWOJSGMDP-CVEARBPZSA-N -1 3 355.434 3.950 20 0 FHADHM C[C@@H](C(=O)Nc1sccc1-c1nnn[n-]1)c1c(Cl)cccc1Cl ZINC000735570945 944671084 /nfs/dbraw/zinc/67/10/84/944671084.db2.gz QFJGSROCYRREMW-SSDOTTSWSA-N -1 3 368.249 3.977 20 0 FHADHM C[C@@H](C(=O)Nc1sccc1-c1nn[n-]n1)c1c(Cl)cccc1Cl ZINC000735570945 944671091 /nfs/dbraw/zinc/67/10/91/944671091.db2.gz QFJGSROCYRREMW-SSDOTTSWSA-N -1 3 368.249 3.977 20 0 FHADHM O=C(CCc1ccc(Cl)c(Cl)c1)N=c1cc([C@@H]2CCCO2)[n-][nH]1 ZINC000473847814 944673668 /nfs/dbraw/zinc/67/36/68/944673668.db2.gz FOUVXGCWCMJNEP-AWEZNQCLSA-N -1 3 354.237 3.561 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(C(=O)NCC(C)C)c(Cl)c2)c([O-])c1 ZINC000436820309 944689327 /nfs/dbraw/zinc/68/93/27/944689327.db2.gz GNWSPHOPZGKRDV-UHFFFAOYSA-N -1 3 360.841 3.992 20 0 FHADHM COC[C@@H](C)Oc1ccc(Cl)cc1NC(=O)c1cccc(OC)c1[O-] ZINC000436821974 944690448 /nfs/dbraw/zinc/69/04/48/944690448.db2.gz RGCHLTWYZCGNAC-LLVKDONJSA-N -1 3 365.813 3.720 20 0 FHADHM CCNC(=O)Nc1ccc(C)c(NC(=O)c2ccc3c(c2[O-])CCCC3)c1 ZINC000436824131 944692788 /nfs/dbraw/zinc/69/27/88/944692788.db2.gz ZAICJXZCGYGGRQ-UHFFFAOYSA-N -1 3 367.449 3.973 20 0 FHADHM CCCc1c(NC(=O)c2cc(OC)ccc2[O-])cnn1-c1ccc(F)cc1 ZINC000436853693 944700204 /nfs/dbraw/zinc/70/02/04/944700204.db2.gz RUOSQKLVWTXENB-UHFFFAOYSA-N -1 3 369.396 3.930 20 0 FHADHM O=C([O-])[C@@H](CNCc1ccn(-c2ccccc2)n1)Cc1cccc(Cl)c1 ZINC000426699295 944700678 /nfs/dbraw/zinc/70/06/78/944700678.db2.gz HRJOEJTVUPXEDA-MRXNPFEDSA-N -1 3 369.852 3.559 20 0 FHADHM O=C([O-])[C@@H](CNCc1ccn(-c2ccccc2)n1)Cc1ccccc1Cl ZINC000426703432 944705492 /nfs/dbraw/zinc/70/54/92/944705492.db2.gz LSWDBWGTVZIZCD-MRXNPFEDSA-N -1 3 369.852 3.559 20 0 FHADHM O=C(N[C@@H](c1ccccc1F)C1CCCC1)c1cc(=O)[n-]c(C2CC2)n1 ZINC000516313679 944715203 /nfs/dbraw/zinc/71/52/03/944715203.db2.gz QSUQYAQITTWRBO-GOSISDBHSA-N -1 3 355.413 3.860 20 0 FHADHM COc1ccccc1[C@@H](CC(C)C)NC(=O)c1cc(OC)c([O-])c(OC)c1 ZINC000436869652 944736635 /nfs/dbraw/zinc/73/66/35/944736635.db2.gz NLZPXRAGVFZWLG-MRXNPFEDSA-N -1 3 373.449 3.935 20 0 FHADHM O=C([O-])[C@@H](CSCCc1ccccc1)NCc1ccc(F)cc1Cl ZINC000426734455 944746094 /nfs/dbraw/zinc/74/60/94/944746094.db2.gz AKXCEHZDYSPTPJ-QGZVFWFLSA-N -1 3 367.873 3.998 20 0 FHADHM COc1ccc([O-])c(-c2nc([C@H](NC(=O)c3ccccc3)C(C)C)no2)c1 ZINC000436878806 944750681 /nfs/dbraw/zinc/75/06/81/944750681.db2.gz DMNHLCDRBYDHHQ-QGZVFWFLSA-N -1 3 367.405 3.578 20 0 FHADHM COc1cc2c(c(CN[C@H](C(=O)[O-])c3cccc(C)c3C)c1)O[C@H](C)C2 ZINC000426740615 944753613 /nfs/dbraw/zinc/75/36/13/944753613.db2.gz BQMFVYKQWCELLS-YJYMSZOUSA-N -1 3 355.434 3.551 20 0 FHADHM CSc1cc2c(cc1CN[C@H](C(=O)[O-])c1cccc(C)c1C)OCCO2 ZINC000426742400 944756125 /nfs/dbraw/zinc/75/61/25/944756125.db2.gz JKVZXATWXDMETM-IBGZPJMESA-N -1 3 373.474 3.712 20 0 FHADHM C[C@@H](N=c1cc(N[C@H](C)c2ccccc2)n2[n-]cnc2n1)c1ccccc1 ZINC000439567577 944769012 /nfs/dbraw/zinc/76/90/12/944769012.db2.gz HTQIHVAGKNBIBX-HZPDHXFCSA-N -1 3 358.449 3.892 20 0 FHADHM C[C@H]1C[C@H](CC(=O)N(C)c2ccc(-c3nnn[n-]3)cc2F)CC(C)(C)C1 ZINC000736231288 944771764 /nfs/dbraw/zinc/77/17/64/944771764.db2.gz WVCOMQOXCKYDFV-QWHCGFSZSA-N -1 3 359.449 3.821 20 0 FHADHM C[C@H]1C[C@H](CC(=O)N(C)c2ccc(-c3nn[n-]n3)cc2F)CC(C)(C)C1 ZINC000736231288 944771775 /nfs/dbraw/zinc/77/17/75/944771775.db2.gz WVCOMQOXCKYDFV-QWHCGFSZSA-N -1 3 359.449 3.821 20 0 FHADHM C[C@H]1CCC[C@H](C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCCC3)C1 ZINC000736243909 944776127 /nfs/dbraw/zinc/77/61/27/944776127.db2.gz AUUFNCNMMZLMOR-RYUDHWBXSA-N -1 3 359.499 3.962 20 0 FHADHM C[C@H]1CCC[C@H](C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCCC3)C1 ZINC000736243909 944776137 /nfs/dbraw/zinc/77/61/37/944776137.db2.gz AUUFNCNMMZLMOR-RYUDHWBXSA-N -1 3 359.499 3.962 20 0 FHADHM CSc1cc2c(cc1CN[C@H](CC(=O)[O-])c1ccccc1C)OCCO2 ZINC000426770986 944788912 /nfs/dbraw/zinc/78/89/12/944788912.db2.gz XYXFSGGWLYBLPX-MRXNPFEDSA-N -1 3 373.474 3.794 20 0 FHADHM COc1ccc([C@H](NCc2cc(Cl)cc3cccnc32)C(=O)[O-])cc1F ZINC000426775851 944793510 /nfs/dbraw/zinc/79/35/10/944793510.db2.gz DADVVWKPGOYKOA-SFHVURJKSA-N -1 3 374.799 3.951 20 0 FHADHM CCCSC[C@H](NCc1cc(Cl)ccc1Br)C(=O)[O-] ZINC000426781293 944798677 /nfs/dbraw/zinc/79/86/77/944798677.db2.gz AYKSNMBHIOIFDF-LBPRGKRZSA-N -1 3 366.708 3.789 20 0 FHADHM COc1cccc([C@@H](CC(=O)[O-])NCc2cccc(OC(F)F)c2)c1 ZINC000426805381 944806906 /nfs/dbraw/zinc/80/69/06/944806906.db2.gz AYCFEHACYUDHRV-MRXNPFEDSA-N -1 3 351.349 3.602 20 0 FHADHM Cc1nc(C)c(CN[C@@H](CC(=O)[O-])c2cccc(Br)c2)s1 ZINC000426807450 944809914 /nfs/dbraw/zinc/80/99/14/944809914.db2.gz HVLUMXPLMAMKOF-ZDUSSCGKSA-N -1 3 369.284 3.828 20 0 FHADHM COCCOc1cc(C)ccc1[N-]S(=O)(=O)Cc1cccc(Cl)c1 ZINC000655558848 944814602 /nfs/dbraw/zinc/81/46/02/944814602.db2.gz UCXBPLFNAKHGDK-UHFFFAOYSA-N -1 3 369.870 3.616 20 0 FHADHM O=C([O-])[C@H](NCc1ccc(OCC(F)(F)F)c(F)c1)c1ccsc1 ZINC000426793533 944816754 /nfs/dbraw/zinc/81/67/54/944816754.db2.gz QRPNSRRHUCZMHY-CYBMUJFWSA-N -1 3 363.332 3.744 20 0 FHADHM CCOc1ccc(CN[C@H](C(=O)[O-])c2ccc(CC)cc2)cc1OCC ZINC000426797887 944820104 /nfs/dbraw/zinc/82/01/04/944820104.db2.gz HIYQRBLEJMMZAC-FQEVSTJZSA-N -1 3 357.450 3.962 20 0 FHADHM CC(C)c1ccc(C(=O)N2CCCN3c4ccccc4C[C@H]3C2)c([O-])c1 ZINC000436933807 944821016 /nfs/dbraw/zinc/82/10/16/944821016.db2.gz DPRCDMOAIYFFAJ-SFHVURJKSA-N -1 3 350.462 3.793 20 0 FHADHM O=C([O-])[C@@H](NCc1ccc(Br)c(F)c1)c1cccc(F)c1 ZINC000426799604 944822261 /nfs/dbraw/zinc/82/22/61/944822261.db2.gz LLWOHKVBQBNMEE-AWEZNQCLSA-N -1 3 356.166 3.643 20 0 FHADHM [O-]c1cc2ccccc2cc1-c1nc(Cn2cc(Br)cn2)no1 ZINC000436942113 944828148 /nfs/dbraw/zinc/82/81/48/944828148.db2.gz UGUWTZSLEKLCSZ-UHFFFAOYSA-N -1 3 371.194 3.603 20 0 FHADHM O=C([O-])[C@H](NCc1ccc(F)c(Br)c1)c1cccc(F)c1 ZINC000426809918 944831208 /nfs/dbraw/zinc/83/12/08/944831208.db2.gz GSASEDJMWABLRE-CQSZACIVSA-N -1 3 356.166 3.643 20 0 FHADHM CCC1(C)CCN(C(=O)c2cc(NC(=O)c3cnoc3C)ccc2[O-])CC1 ZINC000436962388 944837766 /nfs/dbraw/zinc/83/77/66/944837766.db2.gz NRSWCSJWSHUUID-UHFFFAOYSA-N -1 3 371.437 3.593 20 0 FHADHM CCCSC[C@H](NCc1ccc(Cl)cc1Br)C(=O)[O-] ZINC000426818318 944842133 /nfs/dbraw/zinc/84/21/33/944842133.db2.gz RNADABBOWIKKQD-LBPRGKRZSA-N -1 3 366.708 3.789 20 0 FHADHM COc1ccc(C(=O)NCC[C@@H](c2ccccc2)C(F)(F)F)c([O-])c1 ZINC000436956335 944850818 /nfs/dbraw/zinc/85/08/18/944850818.db2.gz QIJJTNUQRSYPGE-HNNXBMFYSA-N -1 3 353.340 3.867 20 0 FHADHM Cc1oncc1C(=O)Nc1ccc([O-])c(C(=O)N2CCC[C@H]2CC(C)C)c1 ZINC000436958140 944853311 /nfs/dbraw/zinc/85/33/11/944853311.db2.gz ZQHQLPPRAFOUHQ-HNNXBMFYSA-N -1 3 371.437 3.592 20 0 FHADHM O=C(NCCCc1cccc(C(F)(F)F)c1)c1c[n-]c2ccccc2c1=O ZINC000507015424 944864512 /nfs/dbraw/zinc/86/45/12/944864512.db2.gz LWEAUZBOVKCEDO-UHFFFAOYSA-N -1 3 374.362 3.910 20 0 FHADHM Cc1ccc(C(=O)N(C)[C@@H]2c3cc(Cl)cc(Cl)c3C[C@H]2O)c([O-])c1 ZINC000436984135 944864920 /nfs/dbraw/zinc/86/49/20/944864920.db2.gz YQTDOHCHWWOVEN-IAGOWNOFSA-N -1 3 366.244 3.738 20 0 FHADHM C[C@@]1(CCCO)CCCN1C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436977991 944866807 /nfs/dbraw/zinc/86/68/07/944866807.db2.gz GZUASXCZRGJQMA-QHCPKHFHSA-N -1 3 367.489 3.945 20 0 FHADHM O=C(NCc1nc2cc(Cl)ccc2s1)c1cc(=O)c2ccccc2[n-]1 ZINC000518855622 944868725 /nfs/dbraw/zinc/86/87/25/944868725.db2.gz SOKSQTVWHZNZSD-UHFFFAOYSA-N -1 3 369.833 3.721 20 0 FHADHM CCCSC[C@@H](NCc1cc(Cl)c(OC)cc1Cl)C(=O)[O-] ZINC000426830451 944869020 /nfs/dbraw/zinc/86/90/20/944869020.db2.gz YCVBAEXTSFSGJY-GFCCVEGCSA-N -1 3 352.283 3.688 20 0 FHADHM Cc1nnc(-c2cccc(NC(=O)c3ccc4c(c3[O-])CCCC4)c2)n1C ZINC000436987091 944878768 /nfs/dbraw/zinc/87/87/68/944878768.db2.gz LNQQIDHCGBBBQA-UHFFFAOYSA-N -1 3 362.433 3.627 20 0 FHADHM COc1cc(F)ccc1NC(=O)Nc1ccc(-c2cc(=O)[n-]c(C)n2)cc1 ZINC000518911640 944915382 /nfs/dbraw/zinc/91/53/82/944915382.db2.gz KYCYLCODJBQKKW-UHFFFAOYSA-N -1 3 368.368 3.949 20 0 FHADHM COC(=O)c1ccc(C(=O)Nc2ccccc2OCCc2ccccc2)[n-]1 ZINC000432005022 944918359 /nfs/dbraw/zinc/91/83/59/944918359.db2.gz BOPWPRANHRWJAO-UHFFFAOYSA-N -1 3 364.401 3.675 20 0 FHADHM CCCCOc1ccc(C(=O)N=c2cc([C@H]3CCCO3)[n-][nH]2)c(Cl)c1 ZINC000473851939 944920202 /nfs/dbraw/zinc/92/02/02/944920202.db2.gz ACRNMTCEMPJNPR-MRXNPFEDSA-N -1 3 363.845 3.768 20 0 FHADHM COc1ccc(C(=O)C2CCN(CCc3ccccc3C(=O)[O-])CC2)cc1 ZINC000516479614 944925242 /nfs/dbraw/zinc/92/52/42/944925242.db2.gz QPPXOQLOTVXJNQ-UHFFFAOYSA-N -1 3 367.445 3.531 20 0 FHADHM CC(C)[C@@H]1C[C@@H](CC(=O)N=c2cc([C@@H]3CCCO3)[n-][nH]2)c2ccccc21 ZINC000473851343 944930792 /nfs/dbraw/zinc/93/07/92/944930792.db2.gz QUJGMSJOIMOGMJ-FNHZYXHNSA-N -1 3 353.466 3.939 20 0 FHADHM CCCc1c([N-]S(=O)(=O)CCC2CC2)cnn1-c1ccc(F)cc1 ZINC000432051850 944955413 /nfs/dbraw/zinc/95/54/13/944955413.db2.gz WHLIJYFZSSATRX-UHFFFAOYSA-N -1 3 351.447 3.506 20 0 FHADHM O=C(NCc1ccc([O-])c(F)c1)N1CCn2c(cc3cc(Cl)ccc32)C1 ZINC000426136874 944993460 /nfs/dbraw/zinc/99/34/60/944993460.db2.gz BYMMTVSHXJSMAD-UHFFFAOYSA-N -1 3 373.815 3.865 20 0 FHADHM CCOc1ccc(S(=O)(=O)[N-]c2cccc(CC(F)(F)F)c2)cc1 ZINC000438762851 945001105 /nfs/dbraw/zinc/00/11/05/945001105.db2.gz HVEXXJOMESPHEX-UHFFFAOYSA-N -1 3 359.369 3.991 20 0 FHADHM CC(C)[C@@H](C(=O)Nc1ccc(Cc2nnn[n-]2)cc1)c1cccc(Cl)c1 ZINC000427073944 945052346 /nfs/dbraw/zinc/05/23/46/945052346.db2.gz TVTFGVBNPWEOCD-GOSISDBHSA-N -1 3 369.856 3.822 20 0 FHADHM CC(C)[C@@H](C(=O)Nc1ccc(Cc2nn[n-]n2)cc1)c1cccc(Cl)c1 ZINC000427073944 945052356 /nfs/dbraw/zinc/05/23/56/945052356.db2.gz TVTFGVBNPWEOCD-GOSISDBHSA-N -1 3 369.856 3.822 20 0 FHADHM COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(Cl)cc2Cl)cs1 ZINC000438807007 945052374 /nfs/dbraw/zinc/05/23/74/945052374.db2.gz GRAFPXJSGDTUJX-UHFFFAOYSA-N -1 3 366.247 3.642 20 0 FHADHM CC(C)[C@H](C(=O)Nc1ccc(Cc2nnn[n-]2)cc1)c1cccc(Cl)c1 ZINC000427073947 945052503 /nfs/dbraw/zinc/05/25/03/945052503.db2.gz TVTFGVBNPWEOCD-SFHVURJKSA-N -1 3 369.856 3.822 20 0 FHADHM CC(C)[C@H](C(=O)Nc1ccc(Cc2nn[n-]n2)cc1)c1cccc(Cl)c1 ZINC000427073947 945052511 /nfs/dbraw/zinc/05/25/11/945052511.db2.gz TVTFGVBNPWEOCD-SFHVURJKSA-N -1 3 369.856 3.822 20 0 FHADHM O=C(Nc1ccc(Cc2nnn[n-]2)cc1)c1cccc(Oc2ccccc2)c1 ZINC000427079232 945061244 /nfs/dbraw/zinc/06/12/44/945061244.db2.gz XYYOUYJFMFVAMR-UHFFFAOYSA-N -1 3 371.400 3.835 20 0 FHADHM O=C(Nc1ccc(Cc2nn[n-]n2)cc1)c1cccc(Oc2ccccc2)c1 ZINC000427079232 945061253 /nfs/dbraw/zinc/06/12/53/945061253.db2.gz XYYOUYJFMFVAMR-UHFFFAOYSA-N -1 3 371.400 3.835 20 0 FHADHM COc1c(C)ccc([N-]S(=O)(=O)c2ccc3c(c2)CC(C)(C)O3)c1C ZINC000440297345 945384675 /nfs/dbraw/zinc/38/46/75/945384675.db2.gz VREKVPRZQFPSAG-UHFFFAOYSA-N -1 3 361.463 3.826 20 0 FHADHM Cc1cc(=O)[n-]c(C(C)(C)NCc2cccc(Br)c2C)n1 ZINC000660751690 945447657 /nfs/dbraw/zinc/44/76/57/945447657.db2.gz PATRNEUPVFQURH-UHFFFAOYSA-N -1 3 350.260 3.586 20 0 FHADHM COc1ccc(CNCCC(C)(C)CCC(=O)[O-])c(Br)c1O ZINC000426638286 945447905 /nfs/dbraw/zinc/44/79/05/945447905.db2.gz ISRRCJSUHHNWAZ-UHFFFAOYSA-N -1 3 374.275 3.534 20 0 FHADHM COc1ccc(C[NH2+]CCC(C)(C)CCC(=O)[O-])c(Br)c1[O-] ZINC000426638286 945447909 /nfs/dbraw/zinc/44/79/09/945447909.db2.gz ISRRCJSUHHNWAZ-UHFFFAOYSA-N -1 3 374.275 3.534 20 0 FHADHM CCc1cnc(CNC(=O)c2cc(Cc3ccccc3)ccc2[O-])s1 ZINC000440373176 945464338 /nfs/dbraw/zinc/46/43/38/945464338.db2.gz FCMFACMWGKJABR-UHFFFAOYSA-N -1 3 352.459 3.932 20 0 FHADHM CCc1cnc(C[N-]S(=O)(=O)c2c(Cl)ccc3ccccc32)s1 ZINC000440414921 945516617 /nfs/dbraw/zinc/51/66/17/945516617.db2.gz LKGFADULZUKQIT-UHFFFAOYSA-N -1 3 366.895 3.991 20 0 FHADHM C[C@H]1CN(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)C(C)(C)C1 ZINC000820743521 945544475 /nfs/dbraw/zinc/54/44/75/945544475.db2.gz UZWVKRBNOXJBOM-SECBINFHSA-N -1 3 368.363 3.538 20 0 FHADHM C[C@H]1CN(C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)C(C)(C)C1 ZINC000820743521 945544478 /nfs/dbraw/zinc/54/44/78/945544478.db2.gz UZWVKRBNOXJBOM-SECBINFHSA-N -1 3 368.363 3.538 20 0 FHADHM CC[C@@H](c1ccc(F)cc1F)[S@@](=O)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000820937673 945592499 /nfs/dbraw/zinc/59/24/99/945592499.db2.gz BSIVZRXINGURHI-LMKMVOKYSA-N -1 3 362.405 3.545 20 0 FHADHM CC[C@@H](c1ccc(F)cc1F)[S@@](=O)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000820937673 945592501 /nfs/dbraw/zinc/59/25/01/945592501.db2.gz BSIVZRXINGURHI-LMKMVOKYSA-N -1 3 362.405 3.545 20 0 FHADHM O=C(NCc1ncccc1[O-])c1cccnc1SCC1CCCCC1 ZINC000473633422 945633279 /nfs/dbraw/zinc/63/32/79/945633279.db2.gz IEKMYAAEMVRFAK-UHFFFAOYSA-N -1 3 357.479 3.785 20 0 FHADHM O=C(NCc1ncccc1[O-])[C@@H](Sc1ccccc1)c1ccccc1 ZINC000473633889 945634494 /nfs/dbraw/zinc/63/44/94/945634494.db2.gz MHGHQIDVNQCUDA-IBGZPJMESA-N -1 3 350.443 3.937 20 0 FHADHM O=C(NCc1ncccc1[O-])c1ccc(Oc2ccc(F)cc2F)cc1 ZINC000473630440 945643277 /nfs/dbraw/zinc/64/32/77/945643277.db2.gz RPMWSSLFUFYGDW-UHFFFAOYSA-N -1 3 356.328 3.788 20 0 FHADHM Cc1cc2c(o1)c(C(=O)NCc1ncccc1[O-])ccc2Br ZINC000473638263 945665732 /nfs/dbraw/zinc/66/57/32/945665732.db2.gz DUKISFOYAUVGAD-UHFFFAOYSA-N -1 3 361.195 3.534 20 0 FHADHM O=C(NCc1ncccc1[O-])c1sc(C2CC2)nc1-c1ccccc1 ZINC000473639342 945670760 /nfs/dbraw/zinc/67/07/60/945670760.db2.gz OSRBMYARTUVONN-UHFFFAOYSA-N -1 3 351.431 3.718 20 0 FHADHM CC(C)c1c(C(=O)NCc2ncccc2[O-])cnn1-c1ccc(Cl)cc1 ZINC000473642812 945676264 /nfs/dbraw/zinc/67/62/64/945676264.db2.gz XSQMPLQPQLUCHW-UHFFFAOYSA-N -1 3 370.840 3.680 20 0 FHADHM O=C(CCCCc1ccc(Br)cc1)NCc1ncccc1[O-] ZINC000473643880 945682661 /nfs/dbraw/zinc/68/26/61/945682661.db2.gz SWKGRGHWHUCTDA-UHFFFAOYSA-N -1 3 363.255 3.579 20 0 FHADHM Cc1ccc(CNC(=O)c2cc(=O)c3ccccc3[n-]2)c(OC(C)(C)C)c1 ZINC000440638044 945732221 /nfs/dbraw/zinc/73/22/21/945732221.db2.gz NLIUYKWAXPCSNM-UHFFFAOYSA-N -1 3 364.445 3.944 20 0 FHADHM Cc1nc(C)c(-c2csc(NC(=O)c3cc(=O)[n-]c(C4CC4)n3)n2)s1 ZINC000519761052 945741601 /nfs/dbraw/zinc/74/16/01/945741601.db2.gz BUZPKHLOBOSQPM-UHFFFAOYSA-N -1 3 373.463 3.509 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@H]3CCCO[C@H]3C(C)C)nc2)n1 ZINC000301518549 945826241 /nfs/dbraw/zinc/82/62/41/945826241.db2.gz HBBOXJLQQWJBJZ-KUHUBIRLSA-N -1 3 356.470 3.670 20 0 FHADHM CC(=O)CCCCC[N-]S(=O)(=O)c1c(Cl)ccc(C)c1Cl ZINC001211852819 945835329 /nfs/dbraw/zinc/83/53/29/945835329.db2.gz IXPDDLFSLVDQFW-UHFFFAOYSA-N -1 3 352.283 3.730 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NCC3(CCO)CCCCC3)nc2)n1 ZINC000301567420 945853394 /nfs/dbraw/zinc/85/33/94/945853394.db2.gz MPNCUJXBIOATPJ-UHFFFAOYSA-N -1 3 356.470 3.551 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H](C)C[C@@H](O)c3ccccc3)nc2)n1 ZINC000301748219 945946530 /nfs/dbraw/zinc/94/65/30/945946530.db2.gz RTLAUCMFCJILME-KBXCAEBGSA-N -1 3 364.449 3.731 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H](C)C[C@H](O)c3ccccc3)nc2)n1 ZINC000301748221 945947179 /nfs/dbraw/zinc/94/71/79/945947179.db2.gz RTLAUCMFCJILME-KSSFIOAISA-N -1 3 364.449 3.731 20 0 FHADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(Oc3ncc(F)cn3)cc2)cc1 ZINC000301797504 945969610 /nfs/dbraw/zinc/96/96/10/945969610.db2.gz UWEXWPGRVKAHQI-UHFFFAOYSA-N -1 3 359.382 3.517 20 0 FHADHM Cc1ccc([C@@H](O)COc2ccc(-c3ccc(-c4nnn[n-]4)cc3)cc2)cc1 ZINC000822230321 946010255 /nfs/dbraw/zinc/01/02/55/946010255.db2.gz CPBVATHEOKXPKE-NRFANRHFSA-N -1 3 372.428 3.955 20 0 FHADHM Cc1ccc([C@@H](O)COc2ccc(-c3ccc(-c4nn[n-]n4)cc3)cc2)cc1 ZINC000822230321 946010265 /nfs/dbraw/zinc/01/02/65/946010265.db2.gz CPBVATHEOKXPKE-NRFANRHFSA-N -1 3 372.428 3.955 20 0 FHADHM C[C@@H](OC(=O)c1cc(Cl)c(Cl)[n-]1)C(=O)Nc1cccnc1Cl ZINC000011810569 946036176 /nfs/dbraw/zinc/03/61/76/946036176.db2.gz ANQPSAZIOMEBJD-ZCFIWIBFSA-N -1 3 362.600 3.554 20 0 FHADHM C[C@@H](OC(=O)c1cc(Cl)c(Cl)[n-]1)C(=O)Nc1ccc(F)c(F)c1 ZINC000011810592 946037428 /nfs/dbraw/zinc/03/74/28/946037428.db2.gz AYPDAWSRYLQAFC-ZCFIWIBFSA-N -1 3 363.147 3.784 20 0 FHADHM Cc1cnn(-c2ccc([N-]S(=O)(=O)c3cc(C)ccc3C)cc2F)c1 ZINC000522880644 946044107 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O=C(Nc1ccccc1SC(F)(F)F)c1cc(-c2nn[n-]n2)cs1 ZINC000823373191 946419345 /nfs/dbraw/zinc/41/93/45/946419345.db2.gz SRAQQTAJSPBIJO-UHFFFAOYSA-N -1 3 371.369 3.792 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)c3c(C)oc(C)c3C)c2)n1 ZINC000047903225 946460692 /nfs/dbraw/zinc/46/06/92/946460692.db2.gz USOJYSKTHVUOPU-UHFFFAOYSA-N -1 3 351.406 3.770 20 0 FHADHM CC(=Cc1ccc(C)cc1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000823942282 946523308 /nfs/dbraw/zinc/52/33/08/946523308.db2.gz AIOFFMSALYPXFR-FMIVXFBMSA-N -1 3 353.813 3.871 20 0 FHADHM CC(=Cc1ccc(C)cc1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000823942282 946523316 /nfs/dbraw/zinc/52/33/16/946523316.db2.gz AIOFFMSALYPXFR-FMIVXFBMSA-N -1 3 353.813 3.871 20 0 FHADHM Cc1cc([N-]S(=O)(=O)c2cccc(Br)c2)ccc1N(C)C ZINC000303370614 946562420 /nfs/dbraw/zinc/56/24/20/946562420.db2.gz LJLZAHUHJYCGIB-UHFFFAOYSA-N -1 3 369.284 3.624 20 0 FHADHM CC(C)(CO)[C@H](CNc1ccc(Cl)cc1-c1nnn[n-]1)c1ccccc1 ZINC000824162878 946603975 /nfs/dbraw/zinc/60/39/75/946603975.db2.gz SGIKZMXYDAUZNS-MRXNPFEDSA-N -1 3 371.872 3.734 20 0 FHADHM CC(C)(CO)[C@H](CNc1ccc(Cl)cc1-c1nn[n-]n1)c1ccccc1 ZINC000824162878 946603982 /nfs/dbraw/zinc/60/39/82/946603982.db2.gz SGIKZMXYDAUZNS-MRXNPFEDSA-N -1 3 371.872 3.734 20 0 FHADHM CC(C)(CO)[C@@H](CNc1cc(Cl)ccc1-c1nnn[n-]1)c1ccccc1 ZINC000824163139 946605128 /nfs/dbraw/zinc/60/51/28/946605128.db2.gz ZETLMFVJDBDQEN-INIZCTEOSA-N -1 3 371.872 3.734 20 0 FHADHM CC(C)(CO)[C@@H](CNc1cc(Cl)ccc1-c1nn[n-]n1)c1ccccc1 ZINC000824163139 946605134 /nfs/dbraw/zinc/60/51/34/946605134.db2.gz ZETLMFVJDBDQEN-INIZCTEOSA-N -1 3 371.872 3.734 20 0 FHADHM Cc1cc(S(=O)(=O)[N-][C@@H](c2ccccc2)[C@H]2CCCO2)sc1Cl ZINC000473910445 946624395 /nfs/dbraw/zinc/62/43/95/946624395.db2.gz GNUBGKKURTXUEV-HIFRSBDPSA-N -1 3 371.911 3.909 20 0 FHADHM Brc1cccc(-c2nnn[n-]2)c1N1CCC[C@@]2(CC=CCC2)C1 ZINC001573279158 946632215 /nfs/dbraw/zinc/63/22/15/946632215.db2.gz DMMJQISJSNNPNJ-KRWDZBQOSA-N -1 3 374.286 3.956 20 0 FHADHM Brc1cccc(-c2nn[n-]n2)c1N1CCC[C@@]2(CC=CCC2)C1 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Cc1cc(S(=O)(=O)[N-][C@@H](C)CC(=O)c2ccccc2)sc1Cl ZINC000473945135 946853758 /nfs/dbraw/zinc/85/37/58/946853758.db2.gz MPAVVBUKBWEQDQ-NSHDSACASA-N -1 3 357.884 3.650 20 0 FHADHM Cc1ccc(F)c(S(=O)(=O)[N-]c2ccc(F)cc2Br)c1 ZINC000048655244 946863544 /nfs/dbraw/zinc/86/35/44/946863544.db2.gz FKHIPAHNDKZBOF-UHFFFAOYSA-N -1 3 362.195 3.837 20 0 FHADHM COc1cc(-c2nc([C@H]3CCOC4(CCCC4)C3)no2)cc(OC)c1[O-] ZINC000897186945 946869355 /nfs/dbraw/zinc/86/93/55/946869355.db2.gz LEMQWWKXWKTPJO-LBPRGKRZSA-N -1 3 360.410 3.666 20 0 FHADHM CC(=O)c1cc(-c2nnn[n-]2)ccc1NC(=O)c1ccc(C2CCC2)cc1 ZINC001573554561 946902686 /nfs/dbraw/zinc/90/26/86/946902686.db2.gz XLXPIWGHUCUITA-UHFFFAOYSA-N -1 3 361.405 3.589 20 0 FHADHM CC(=O)c1cc(-c2nn[n-]n2)ccc1NC(=O)c1ccc(C2CCC2)cc1 ZINC001573554561 946902695 /nfs/dbraw/zinc/90/26/95/946902695.db2.gz XLXPIWGHUCUITA-UHFFFAOYSA-N -1 3 361.405 3.589 20 0 FHADHM CN(C)C(=O)c1cc(Nc2cc(Br)cc(F)c2[O-])ccc1F ZINC001211859746 946907771 /nfs/dbraw/zinc/90/77/71/946907771.db2.gz IJHJOMAMJSLZCM-UHFFFAOYSA-N -1 3 371.181 3.878 20 0 FHADHM C[C@@H](OC(=O)CCc1ccc2[nH]ccc2c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824715957 946910486 /nfs/dbraw/zinc/91/04/86/946910486.db2.gz VRGTZELCKZWVFF-CYBMUJFWSA-N -1 3 361.405 3.585 20 0 FHADHM C[C@@H](OC(=O)CCc1ccc2[nH]ccc2c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824715957 946910495 /nfs/dbraw/zinc/91/04/95/946910495.db2.gz VRGTZELCKZWVFF-CYBMUJFWSA-N -1 3 361.405 3.585 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N3CCC[C@@]4(CC=CCC4)C3)nc2)n1 ZINC000114451583 946934762 /nfs/dbraw/zinc/93/47/62/946934762.db2.gz WIDASYVGAALXES-NRFANRHFSA-N -1 3 350.466 3.721 20 0 FHADHM Cc1nc(C)c(CC(=O)N2C[C@H](c3ccccc3)c3ccccc32)c(=O)[n-]1 ZINC000444513019 946984295 /nfs/dbraw/zinc/98/42/95/946984295.db2.gz NXNZDDZJHTUGRO-LJQANCHMSA-N -1 3 359.429 3.520 20 0 FHADHM Cc1c(Br)ccc([O-])c1NC(=O)c1cnc2n1[C@@H](C)CCC2 ZINC000652379132 946985303 /nfs/dbraw/zinc/98/53/03/946985303.db2.gz DKGUNSPEKCHFCC-VIFPVBQESA-N -1 3 364.243 3.809 20 0 FHADHM CS(=O)(=O)[N-]c1ccccc1NC(=O)c1ccc(Cl)cc1Cl ZINC000028020652 946985798 /nfs/dbraw/zinc/98/57/98/946985798.db2.gz QFEMCGBPAWTUIO-UHFFFAOYSA-N -1 3 359.234 3.617 20 0 FHADHM COc1ccc(Cl)cc1S(=O)(=O)[N-][C@@H](CC(F)(F)F)C(C)C ZINC000487369124 947000047 /nfs/dbraw/zinc/00/00/47/947000047.db2.gz SOYRBOBDLRJOOK-JTQLQIEISA-N -1 3 359.797 3.604 20 0 FHADHM C[C@@H]1CN(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)[C@H]2CCCC[C@@H]12 ZINC000824976916 947016930 /nfs/dbraw/zinc/01/69/30/947016930.db2.gz PKYXUGPZIKDZEP-GMXABZIVSA-N -1 3 360.849 3.563 20 0 FHADHM C[C@@H]1CN(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)[C@H]2CCCC[C@@H]12 ZINC000824976916 947016943 /nfs/dbraw/zinc/01/69/43/947016943.db2.gz PKYXUGPZIKDZEP-GMXABZIVSA-N -1 3 360.849 3.563 20 0 FHADHM CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1cc(F)c([O-])c(Cl)c1 ZINC000184335650 947062606 /nfs/dbraw/zinc/06/26/06/947062606.db2.gz PRUWLHJRLQMGHW-UHFFFAOYSA-N -1 3 368.811 3.528 20 0 FHADHM CC[C@H]1CC[C@@H](C)N1C(=O)c1c[n-]c2ccc(Br)cc2c1=O ZINC000444350846 947089322 /nfs/dbraw/zinc/08/93/22/947089322.db2.gz INIZITHTGVYSDA-PWSUYJOCSA-N -1 3 363.255 3.694 20 0 FHADHM O=S(=O)([N-]Cc1coc(-c2cccs2)n1)c1cccc(Cl)c1F ZINC000042986744 947118838 /nfs/dbraw/zinc/11/88/38/947118838.db2.gz ZCTKPYJHSQAIFK-UHFFFAOYSA-N -1 3 372.830 3.674 20 0 FHADHM CC[C@](NC(=O)c1cccc(CN(C)C)c1)(C(=O)[O-])c1ccc(Cl)cc1 ZINC000909607440 947122689 /nfs/dbraw/zinc/12/26/89/947122689.db2.gz ZZZCWQLQZDZTCP-HXUWFJFHSA-N -1 3 374.868 3.522 20 0 FHADHM CCCOc1ccc([C@@H](C)Nc2nccc(C)c2-c2nnn[n-]2)cc1OC ZINC000825339371 947158857 /nfs/dbraw/zinc/15/88/57/947158857.db2.gz XYUSWLNRNFTWSG-CYBMUJFWSA-N -1 3 368.441 3.541 20 0 FHADHM CCCOc1ccc([C@@H](C)Nc2nccc(C)c2-c2nn[n-]n2)cc1OC ZINC000825339371 947158862 /nfs/dbraw/zinc/15/88/62/947158862.db2.gz XYUSWLNRNFTWSG-CYBMUJFWSA-N -1 3 368.441 3.541 20 0 FHADHM CCN(C(=O)c1ccc(OC)cc1C)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825385669 947172063 /nfs/dbraw/zinc/17/20/63/947172063.db2.gz PZYDVMBHICOWEK-UHFFFAOYSA-N -1 3 371.828 3.504 20 0 FHADHM CCN(C(=O)c1ccc(OC)cc1C)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825385669 947172075 /nfs/dbraw/zinc/17/20/75/947172075.db2.gz PZYDVMBHICOWEK-UHFFFAOYSA-N -1 3 371.828 3.504 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)c1cc2c(s1)CCCCCC2 ZINC000523392703 947194098 /nfs/dbraw/zinc/19/40/98/947194098.db2.gz GWJHPOMLOSFCAX-UHFFFAOYSA-N -1 3 353.451 3.840 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)c1cc2c(s1)CCCCCC2 ZINC000523392703 947194105 /nfs/dbraw/zinc/19/41/05/947194105.db2.gz GWJHPOMLOSFCAX-UHFFFAOYSA-N -1 3 353.451 3.840 20 0 FHADHM COc1ccc(-n2c(CN(CCC(=O)[O-])C(C)C)nc3ccccc32)cc1 ZINC000652479024 947203534 /nfs/dbraw/zinc/20/35/34/947203534.db2.gz FXWSCNVOGZFWSB-UHFFFAOYSA-N -1 3 367.449 3.719 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@H](O)c3ccc(Cl)cc3)nc2)n1 ZINC000301193270 947226544 /nfs/dbraw/zinc/22/65/44/947226544.db2.gz XLJFGRCQQCXROG-INIZCTEOSA-N -1 3 370.840 3.606 20 0 FHADHM CC(C)COc1ccc(CCNC(=O)NCc2ccc([O-])c(F)c2)cc1 ZINC000523433294 947244497 /nfs/dbraw/zinc/24/44/97/947244497.db2.gz MDEXGAWICDHQIN-UHFFFAOYSA-N -1 3 360.429 3.608 20 0 FHADHM COc1ccc(-c2cnc(CN3CCC[C@H](C(C)(C)C(=O)[O-])C3)o2)cc1 ZINC000652499604 947248785 /nfs/dbraw/zinc/24/87/85/947248785.db2.gz DPFMZJYAWDEARB-HNNXBMFYSA-N -1 3 358.438 3.673 20 0 FHADHM CCc1ccc([C@@H]2CCCCCN2C(=O)Cc2c(C)nc(C)[n-]c2=O)o1 ZINC000523516942 947328648 /nfs/dbraw/zinc/32/86/48/947328648.db2.gz FNXSXXLPRBEQSO-KRWDZBQOSA-N -1 3 357.454 3.641 20 0 FHADHM CN(Cc1cccc(-c2nnn[n-]2)c1)C(=O)Nc1csc2ccccc12 ZINC000825971543 947390115 /nfs/dbraw/zinc/39/01/15/947390115.db2.gz KWQVBLVJEWGMLR-UHFFFAOYSA-N -1 3 364.434 3.745 20 0 FHADHM CN(Cc1cccc(-c2nn[n-]n2)c1)C(=O)Nc1csc2ccccc12 ZINC000825971543 947390129 /nfs/dbraw/zinc/39/01/29/947390129.db2.gz KWQVBLVJEWGMLR-UHFFFAOYSA-N -1 3 364.434 3.745 20 0 FHADHM O=S(=O)([N-]C[C@@H](c1c[nH]c2ccccc21)c1ccccc1)c1ccco1 ZINC000188559231 947441272 /nfs/dbraw/zinc/44/12/72/947441272.db2.gz CUFGZIBWATZHTE-QGZVFWFLSA-N -1 3 366.442 3.871 20 0 FHADHM O=C(NN=Cc1cc(Cl)ccc1[O-])c1cccc(Br)c1 ZINC000254301545 947488698 /nfs/dbraw/zinc/48/86/98/947488698.db2.gz SBHZNTIRNQLVGK-UHFFFAOYSA-N -1 3 353.603 3.572 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N(C)[C@@H](C)CSc2ccccc2)c1 ZINC000652622926 947523832 /nfs/dbraw/zinc/52/38/32/947523832.db2.gz WUBCECBKPWJKMH-ZDUSSCGKSA-N -1 3 358.463 3.603 20 0 FHADHM CC(C)[C@@H](N[C@H]1CCN(CC(=O)[O-])C1=O)c1ccc(C2CCCCC2)cc1 ZINC000662210269 947534396 /nfs/dbraw/zinc/53/43/96/947534396.db2.gz DROATXDJSAQYJV-PZJWPPBQSA-N -1 3 372.509 3.707 20 0 FHADHM CCOC(=O)c1ccc(NC(=O)[C@@H]2CCCC[C@@H]2C(F)(F)F)c([O-])c1 ZINC000536337340 947534371 /nfs/dbraw/zinc/53/43/71/947534371.db2.gz XLIAWFYQCPNCOX-NEPJUHHUSA-N -1 3 359.344 3.876 20 0 FHADHM O=C(NCc1ccc([O-])c(F)c1)N1CCn2c(cc3c2cccc3Cl)C1 ZINC000445132521 947543961 /nfs/dbraw/zinc/54/39/61/947543961.db2.gz HNMGTKBYGYEWRP-UHFFFAOYSA-N -1 3 373.815 3.865 20 0 FHADHM Cc1cc(F)c(S(=O)(=O)[N-]CCC2CC(OC(C)(C)C)C2)cc1F ZINC000432303491 947588667 /nfs/dbraw/zinc/58/86/67/947588667.db2.gz RJQQGWANKKAESS-UHFFFAOYSA-N -1 3 361.454 3.535 20 0 FHADHM CCc1ccc(C(=O)N(C)CC(=O)Nc2c(C)cc(C)cc2C)c([O-])c1 ZINC000189236343 947642144 /nfs/dbraw/zinc/64/21/44/947642144.db2.gz KWNUBQYIUCFFPU-UHFFFAOYSA-N -1 3 354.450 3.591 20 0 FHADHM CC(=CC(=O)N(C)c1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccc(F)cc1 ZINC001573357911 947654348 /nfs/dbraw/zinc/65/43/48/947654348.db2.gz BUWCGTPMJDXTMU-PKNBQFBNSA-N -1 3 371.803 3.726 20 0 FHADHM CC(=CC(=O)N(C)c1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccc(F)cc1 ZINC001573357911 947654356 /nfs/dbraw/zinc/65/43/56/947654356.db2.gz BUWCGTPMJDXTMU-PKNBQFBNSA-N -1 3 371.803 3.726 20 0 FHADHM O=C([N-]c1nnc(CC2CCCCC2)s1)c1ccc(Cn2cccn2)o1 ZINC000728848591 947675413 /nfs/dbraw/zinc/67/54/13/947675413.db2.gz YGHARKZWLLDGTD-UHFFFAOYSA-N -1 3 371.466 3.751 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCCC2)c1ccccc1 ZINC000826232071 947678870 /nfs/dbraw/zinc/67/88/70/947678870.db2.gz JPBSMGNKHYSVBL-LBPRGKRZSA-N -1 3 367.478 3.939 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCCC2)c1ccccc1 ZINC000826232071 947678912 /nfs/dbraw/zinc/67/89/12/947678912.db2.gz JPBSMGNKHYSVBL-LBPRGKRZSA-N -1 3 367.478 3.939 20 0 FHADHM CC(=CC(=O)NC1(c2ccc(-c3nnn[n-]3)cc2)CCC1)c1ccccc1C ZINC001573362817 947709281 /nfs/dbraw/zinc/70/92/81/947709281.db2.gz LRILMSOTHBKZGR-PEZBUJJGSA-N -1 3 373.460 3.774 20 0 FHADHM CC(=CC(=O)NC1(c2ccc(-c3nn[n-]n3)cc2)CCC1)c1ccccc1C ZINC001573362817 947709294 /nfs/dbraw/zinc/70/92/94/947709294.db2.gz LRILMSOTHBKZGR-PEZBUJJGSA-N -1 3 373.460 3.774 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)Nc1cc(C)cc(-c2nnn[n-]2)c1 ZINC001573364639 947723363 /nfs/dbraw/zinc/72/33/63/947723363.db2.gz ICXXDKQHVMSAFN-XFXZXTDPSA-N -1 3 353.813 3.871 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)Nc1cc(C)cc(-c2nn[n-]n2)c1 ZINC001573364639 947723365 /nfs/dbraw/zinc/72/33/65/947723365.db2.gz ICXXDKQHVMSAFN-XFXZXTDPSA-N -1 3 353.813 3.871 20 0 FHADHM C/C(=C\Cl)CSc1nccc(Oc2cccc(-c3nnn[n-]3)c2)n1 ZINC001573365828 947734677 /nfs/dbraw/zinc/73/46/77/947734677.db2.gz NSTXNJUSVJURDJ-CSKARUKUSA-N -1 3 360.830 3.684 20 0 FHADHM C/C(=C\Cl)CSc1nccc(Oc2cccc(-c3nn[n-]n3)c2)n1 ZINC001573365828 947734683 /nfs/dbraw/zinc/73/46/83/947734683.db2.gz NSTXNJUSVJURDJ-CSKARUKUSA-N -1 3 360.830 3.684 20 0 FHADHM CC(=CC(=O)N(c1cccc(-c2nnn[n-]2)c1)C1CCC1)c1ccccc1 ZINC001573365896 947735760 /nfs/dbraw/zinc/73/57/60/947735760.db2.gz USRXEAXHFHHRJV-SQFISAMPSA-N -1 3 359.433 3.856 20 0 FHADHM CC(=CC(=O)N(c1cccc(-c2nn[n-]n2)c1)C1CCC1)c1ccccc1 ZINC001573365896 947735768 /nfs/dbraw/zinc/73/57/68/947735768.db2.gz USRXEAXHFHHRJV-SQFISAMPSA-N -1 3 359.433 3.856 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)CC1CCC(C(F)(F)F)CC1 ZINC000826278253 947801865 /nfs/dbraw/zinc/80/18/65/947801865.db2.gz VTKRCEJCOSRXRO-UHFFFAOYSA-N -1 3 367.375 3.872 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)CC1CCC(C(F)(F)F)CC1 ZINC000826278253 947801869 /nfs/dbraw/zinc/80/18/69/947801869.db2.gz VTKRCEJCOSRXRO-UHFFFAOYSA-N -1 3 367.375 3.872 20 0 FHADHM Cc1ccc(CN(Cc2ccco2)c2nccc(C)c2-c2nnn[n-]2)s1 ZINC000826287866 947835770 /nfs/dbraw/zinc/83/57/70/947835770.db2.gz HESVFGQZAXXFSE-UHFFFAOYSA-N -1 3 366.450 3.740 20 0 FHADHM Cc1ccc(CN(Cc2ccco2)c2nccc(C)c2-c2nn[n-]n2)s1 ZINC000826287866 947835776 /nfs/dbraw/zinc/83/57/76/947835776.db2.gz HESVFGQZAXXFSE-UHFFFAOYSA-N -1 3 366.450 3.740 20 0 FHADHM Cc1ccc(NC(=O)C[C@@H](C)Nc2cccc(-c3nnn[n-]3)c2)c(Cl)c1 ZINC000826290174 947844298 /nfs/dbraw/zinc/84/42/98/947844298.db2.gz DJFHEWMJARHJSG-GFCCVEGCSA-N -1 3 370.844 3.658 20 0 FHADHM Cc1ccc(NC(=O)C[C@@H](C)Nc2cccc(-c3nn[n-]n3)c2)c(Cl)c1 ZINC000826290174 947844310 /nfs/dbraw/zinc/84/43/10/947844310.db2.gz DJFHEWMJARHJSG-GFCCVEGCSA-N -1 3 370.844 3.658 20 0 FHADHM Cc1ccnc(N(Cc2cccs2)Cc2cccs2)c1-c1nnn[n-]1 ZINC000826309366 947886956 /nfs/dbraw/zinc/88/69/56/947886956.db2.gz MLLOCLUXEPFEOY-UHFFFAOYSA-N -1 3 368.491 3.900 20 0 FHADHM Cc1ccnc(N(Cc2cccs2)Cc2cccs2)c1-c1nn[n-]n1 ZINC000826309366 947886958 /nfs/dbraw/zinc/88/69/58/947886958.db2.gz MLLOCLUXEPFEOY-UHFFFAOYSA-N -1 3 368.491 3.900 20 0 FHADHM CCCCOc1ccc(C(=O)N2CCO[C@H](c3ccccc3)C2)c([O-])c1 ZINC000190059312 947903942 /nfs/dbraw/zinc/90/39/42/947903942.db2.gz UJUYMASPHXLDPN-FQEVSTJZSA-N -1 3 355.434 3.785 20 0 FHADHM Cc1nc(C(C)C)sc1[C@H](C)OC(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000826323743 947944845 /nfs/dbraw/zinc/94/48/45/947944845.db2.gz PPYBUTGVSWOLJC-VIFPVBQESA-N -1 3 363.468 3.735 20 0 FHADHM Cc1nc(C(C)C)sc1[C@H](C)OC(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000826323743 947944852 /nfs/dbraw/zinc/94/48/52/947944852.db2.gz PPYBUTGVSWOLJC-VIFPVBQESA-N -1 3 363.468 3.735 20 0 FHADHM Cc1nc(C(C)C)sc1[C@@H](C)OC(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000826323742 947946189 /nfs/dbraw/zinc/94/61/89/947946189.db2.gz PPYBUTGVSWOLJC-SECBINFHSA-N -1 3 363.468 3.735 20 0 FHADHM Cc1nc(C(C)C)sc1[C@@H](C)OC(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000826323742 947946194 /nfs/dbraw/zinc/94/61/94/947946194.db2.gz PPYBUTGVSWOLJC-SECBINFHSA-N -1 3 363.468 3.735 20 0 FHADHM C[C@@H](CCc1ccco1)[N-]S(=O)(=O)c1csc(-c2ccccc2)n1 ZINC000500444957 948014189 /nfs/dbraw/zinc/01/41/89/948014189.db2.gz DKWCSLOZRWIIAK-ZDUSSCGKSA-N -1 3 362.476 3.703 20 0 FHADHM CC(C)(C)OC(=O)N=c1[n-]cc(C(=O)N(Cc2ccoc2)C2CC2)s1 ZINC000889087523 948063314 /nfs/dbraw/zinc/06/33/14/948063314.db2.gz ODUIMQRQBWGRQN-UHFFFAOYSA-N -1 3 363.439 3.888 20 0 FHADHM CC(C)(C)[C@@H](NC(=O)Nc1ccc2c(c1)C(=O)[N-]C2=O)c1ccc(F)cc1 ZINC000520494178 948105033 /nfs/dbraw/zinc/10/50/33/948105033.db2.gz YGNBWOYWEIBQAL-INIZCTEOSA-N -1 3 369.396 3.618 20 0 FHADHM FC(F)(F)CCCCN[C@H](c1cccc(-c2nnn[n-]2)c1)C(F)(F)F ZINC000826367503 948145916 /nfs/dbraw/zinc/14/59/16/948145916.db2.gz BDBYRYGSGHRYHP-LLVKDONJSA-N -1 3 367.297 3.792 20 0 FHADHM FC(F)(F)CCCCN[C@H](c1cccc(-c2nn[n-]n2)c1)C(F)(F)F ZINC000826367503 948145920 /nfs/dbraw/zinc/14/59/20/948145920.db2.gz BDBYRYGSGHRYHP-LLVKDONJSA-N -1 3 367.297 3.792 20 0 FHADHM FC(F)(F)[C@@H](NCCCc1ccccc1)c1cccc(-c2nnn[n-]2)c1 ZINC000826367096 948146548 /nfs/dbraw/zinc/14/65/48/948146548.db2.gz LSAUYFGBUWQUFB-INIZCTEOSA-N -1 3 361.371 3.693 20 0 FHADHM FC(F)(F)[C@@H](NCCCc1ccccc1)c1cccc(-c2nn[n-]n2)c1 ZINC000826367096 948146554 /nfs/dbraw/zinc/14/65/54/948146554.db2.gz LSAUYFGBUWQUFB-INIZCTEOSA-N -1 3 361.371 3.693 20 0 FHADHM FC1(F)CCC[C@H](Nc2ccc(Br)cc2-c2nnn[n-]2)C1 ZINC000826370084 948153104 /nfs/dbraw/zinc/15/31/04/948153104.db2.gz CTGSQCYETLQYJN-VIFPVBQESA-N -1 3 358.190 3.619 20 0 FHADHM FC1(F)CCC[C@H](Nc2ccc(Br)cc2-c2nn[n-]n2)C1 ZINC000826370084 948153139 /nfs/dbraw/zinc/15/31/39/948153139.db2.gz CTGSQCYETLQYJN-VIFPVBQESA-N -1 3 358.190 3.619 20 0 FHADHM CC(C)c1cnc(CNC[C@@H](Cc2cccc(Cl)c2)C(=O)[O-])s1 ZINC000417544347 948165767 /nfs/dbraw/zinc/16/57/67/948165767.db2.gz HFHGCSLYJYHTTR-CYBMUJFWSA-N -1 3 352.887 3.953 20 0 FHADHM C[C@@]1(C(=O)[O-])CCCN(Cc2ccc(Br)c3cccnc23)C1 ZINC000317558098 948208520 /nfs/dbraw/zinc/20/85/20/948208520.db2.gz UUXAHWCQRIRQCY-QGZVFWFLSA-N -1 3 363.255 3.684 20 0 FHADHM CCCCOc1ccc(C(=O)N2CCO[C@@H](c3cccs3)C2)c([O-])c1 ZINC000190643908 948220170 /nfs/dbraw/zinc/22/01/70/948220170.db2.gz MUECYRQDWCDBIB-QGZVFWFLSA-N -1 3 361.463 3.846 20 0 FHADHM Cc1nc([C@H]2CCCCN2Cc2nc3c4ccccc4oc3c(=O)[n-]2)no1 ZINC000613937474 948248269 /nfs/dbraw/zinc/24/82/69/948248269.db2.gz QLBGISFUJOZBHY-CYBMUJFWSA-N -1 3 365.393 3.500 20 0 FHADHM O=C([O-])[C@H](CC1CCCC1)NCc1csc(-c2ccc3c(c2)OCO3)n1 ZINC000417576667 948280415 /nfs/dbraw/zinc/28/04/15/948280415.db2.gz KNADZVPDTFDALO-HNNXBMFYSA-N -1 3 374.462 3.662 20 0 FHADHM COC(=O)c1ccc(C(=O)Nc2nc(-c3ccc(F)cc3)c(C)s2)[n-]1 ZINC000432403821 948338475 /nfs/dbraw/zinc/33/84/75/948338475.db2.gz CGRBYRMNPYLZDR-UHFFFAOYSA-N -1 3 359.382 3.625 20 0 FHADHM O=C(Nc1ncc(C2CCCCC2)s1)c1sccc1-c1nnn[n-]1 ZINC000826460049 948344199 /nfs/dbraw/zinc/34/41/99/948344199.db2.gz KWNYLRHCPFHBPU-UHFFFAOYSA-N -1 3 360.468 3.685 20 0 FHADHM O=C(Nc1ncc(C2CCCCC2)s1)c1sccc1-c1nn[n-]n1 ZINC000826460049 948344209 /nfs/dbraw/zinc/34/42/09/948344209.db2.gz KWNYLRHCPFHBPU-UHFFFAOYSA-N -1 3 360.468 3.685 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@@H]3CCC[C@@H](OC)C3)c2)n1 ZINC000432407572 948346484 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Cc1ccc(I)cc1NC(=O)c1cccc([O-])c1 ZINC000301887482 568368782 /nfs/dbraw/zinc/36/87/82/568368782.db2.gz PWGJCJWPRFMBFM-UHFFFAOYSA-N -1 3 353.159 3.558 20 0 FHADHM O=S(=O)([N-][C@H](Cc1ccccc1)c1cccs1)c1cncc(F)c1 ZINC000604890344 568381773 /nfs/dbraw/zinc/38/17/73/568381773.db2.gz YGCAPRHYEKHPSX-MRXNPFEDSA-N -1 3 362.451 3.545 20 0 FHADHM Cc1cccc(N2C[C@H](C(=O)Nc3cc(Cl)cc(C)c3[O-])CC2=O)c1C ZINC000604901883 568384995 /nfs/dbraw/zinc/38/49/95/568384995.db2.gz ALIWJDGQDAMFFT-CQSZACIVSA-N -1 3 372.852 3.962 20 0 FHADHM Cc1cc(Cl)cc(NC(=O)CCc2c(C)nc3ccnn3c2C)c1[O-] ZINC000604902215 568385117 /nfs/dbraw/zinc/38/51/17/568385117.db2.gz XSNVWVUYKXRLLL-UHFFFAOYSA-N -1 3 358.829 3.585 20 0 FHADHM CC(C)(C)c1ccc(NC(=O)CSc2n[n-]c(-c3ccccn3)n2)cc1 ZINC000604932761 568395193 /nfs/dbraw/zinc/39/51/93/568395193.db2.gz KNRJGRGRHXIIEB-UHFFFAOYSA-N -1 3 367.478 3.895 20 0 FHADHM COc1ccc(-n2ccnc2SCC(=O)Nc2ccc(C)cc2[O-])cc1 ZINC000007284589 568489748 /nfs/dbraw/zinc/48/97/48/568489748.db2.gz WHXYRYWODOPBTA-UHFFFAOYSA-N -1 3 369.446 3.626 20 0 FHADHM O=S(=O)(Cc1cc(-c2ccccc2)no1)[N-][C@H]1CSc2ccccc21 ZINC000605164365 568592840 /nfs/dbraw/zinc/59/28/40/568592840.db2.gz ZFAWWNCANHMPKH-KRWDZBQOSA-N -1 3 372.471 3.608 20 0 FHADHM Cc1sc(NC(=O)[C@@H](Cc2ccccc2)C(C)C)c(-c2nnn[n-]2)c1C ZINC000737562163 598829683 /nfs/dbraw/zinc/82/96/83/598829683.db2.gz LDKZRDCKVJHOLW-HNNXBMFYSA-N -1 3 369.494 3.998 20 0 FHADHM Cc1sc(NC(=O)[C@@H](Cc2ccccc2)C(C)C)c(-c2nn[n-]n2)c1C ZINC000737562163 598829686 /nfs/dbraw/zinc/82/96/86/598829686.db2.gz LDKZRDCKVJHOLW-HNNXBMFYSA-N -1 3 369.494 3.998 20 0 FHADHM CC[C@@H]1CCCCCN1C(=O)CCCCOc1cccc(-c2nnn[n-]2)c1 ZINC000736399618 598837249 /nfs/dbraw/zinc/83/72/49/598837249.db2.gz JADVREWQHTUNNT-QGZVFWFLSA-N -1 3 371.485 3.597 20 0 FHADHM CC[C@@H]1CCCCCN1C(=O)CCCCOc1cccc(-c2nn[n-]n2)c1 ZINC000736399618 598837251 /nfs/dbraw/zinc/83/72/51/598837251.db2.gz JADVREWQHTUNNT-QGZVFWFLSA-N -1 3 371.485 3.597 20 0 FHADHM CCOc1ccccc1NC(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736655259 598849209 /nfs/dbraw/zinc/84/92/09/598849209.db2.gz SNAAKZBYQFKEQC-UHFFFAOYSA-N -1 3 358.789 3.563 20 0 FHADHM CCOc1ccccc1NC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736655259 598849210 /nfs/dbraw/zinc/84/92/10/598849210.db2.gz SNAAKZBYQFKEQC-UHFFFAOYSA-N -1 3 358.789 3.563 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)Nc1cccc(C)c1C ZINC000736635042 598850788 /nfs/dbraw/zinc/85/07/88/598850788.db2.gz RJIINQCBJLVHKR-UHFFFAOYSA-N -1 3 352.398 3.526 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)Nc1cccc(C)c1C ZINC000736635042 598850789 /nfs/dbraw/zinc/85/07/89/598850789.db2.gz RJIINQCBJLVHKR-UHFFFAOYSA-N -1 3 352.398 3.526 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@H]1CC[C@@H](C)C[C@H]1C ZINC000736242957 598853791 /nfs/dbraw/zinc/85/37/91/598853791.db2.gz SRLUTOGLKQQDHI-RKVPGOIHSA-N -1 3 370.501 3.611 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@H]1CC[C@@H](C)C[C@H]1C ZINC000736242957 598853792 /nfs/dbraw/zinc/85/37/92/598853792.db2.gz SRLUTOGLKQQDHI-RKVPGOIHSA-N -1 3 370.501 3.611 20 0 FHADHM CCc1ccc(NC(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(F)F)cc1 ZINC000736689411 598852667 /nfs/dbraw/zinc/85/26/67/598852667.db2.gz GTVBXOYICJBQTC-UHFFFAOYSA-N -1 3 374.351 3.675 20 0 FHADHM CCc1ccc(NC(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(F)F)cc1 ZINC000736689411 598852668 /nfs/dbraw/zinc/85/26/68/598852668.db2.gz GTVBXOYICJBQTC-UHFFFAOYSA-N -1 3 374.351 3.675 20 0 FHADHM CCSc1cccc(NC(=O)CSc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736668073 598865739 /nfs/dbraw/zinc/86/57/39/598865739.db2.gz VDTAZUUUNFYFQY-UHFFFAOYSA-N -1 3 371.491 3.710 20 0 FHADHM CCSc1cccc(NC(=O)CSc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736668073 598865740 /nfs/dbraw/zinc/86/57/40/598865740.db2.gz VDTAZUUUNFYFQY-UHFFFAOYSA-N -1 3 371.491 3.710 20 0 FHADHM CC[C@@H]1CCCCCN1C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000736398517 598888831 /nfs/dbraw/zinc/88/88/31/598888831.db2.gz AZRLBCLPUQPHOB-CQSZACIVSA-N -1 3 359.478 3.610 20 0 FHADHM CC[C@@H]1CCCCCN1C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000736398517 598888832 /nfs/dbraw/zinc/88/88/32/598888832.db2.gz AZRLBCLPUQPHOB-CQSZACIVSA-N -1 3 359.478 3.610 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)NC1C[C@@H](C)C[C@H](C)C1 ZINC000736481755 598890959 /nfs/dbraw/zinc/89/09/59/598890959.db2.gz UQDLHCVTNJMCPQ-GJZGRUSLSA-N -1 3 370.501 3.613 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)NC1C[C@@H](C)C[C@H](C)C1 ZINC000736481755 598890962 /nfs/dbraw/zinc/89/09/62/598890962.db2.gz UQDLHCVTNJMCPQ-GJZGRUSLSA-N -1 3 370.501 3.613 20 0 FHADHM C[C@H](CC1CCCC1)C(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000735984994 598903101 /nfs/dbraw/zinc/90/31/01/598903101.db2.gz IBDHLLFXUGUXTQ-CQSZACIVSA-N -1 3 353.470 3.574 20 0 FHADHM C[C@H](CC1CCCC1)C(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000735984994 598903102 /nfs/dbraw/zinc/90/31/02/598903102.db2.gz IBDHLLFXUGUXTQ-CQSZACIVSA-N -1 3 353.470 3.574 20 0 FHADHM CC(C)(C)/C=C\C(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)nc1 ZINC000735593857 598904262 /nfs/dbraw/zinc/90/42/62/598904262.db2.gz MYVYJFDASULHSL-KHPPLWFESA-N -1 3 364.409 3.595 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CCC[C@]2(CC=CCC2)C1 ZINC000737290090 598923414 /nfs/dbraw/zinc/92/34/14/598923414.db2.gz BICVOIZOBZGDKV-LJQANCHMSA-N -1 3 352.442 3.529 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CCC[C@]2(CC=CCC2)C1 ZINC000737290090 598923416 /nfs/dbraw/zinc/92/34/16/598923416.db2.gz BICVOIZOBZGDKV-LJQANCHMSA-N -1 3 352.442 3.529 20 0 FHADHM CC[C@@H](CC1CCCC1)C(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000736348457 598924273 /nfs/dbraw/zinc/92/42/73/598924273.db2.gz BPLDNAJKRQLQPG-KRWDZBQOSA-N -1 3 367.497 3.964 20 0 FHADHM CC[C@@H](CC1CCCC1)C(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000736348457 598924274 /nfs/dbraw/zinc/92/42/74/598924274.db2.gz BPLDNAJKRQLQPG-KRWDZBQOSA-N -1 3 367.497 3.964 20 0 FHADHM Cc1ccc([C@H]2CCC[C@@H]2OC(=O)Cc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000737328158 598925302 /nfs/dbraw/zinc/92/53/02/598925302.db2.gz DIWKWEMMHNELPF-MOPGFXCFSA-N -1 3 362.433 3.597 20 0 FHADHM Cc1ccc([C@H]2CCC[C@@H]2OC(=O)Cc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000737328158 598925304 /nfs/dbraw/zinc/92/53/04/598925304.db2.gz DIWKWEMMHNELPF-MOPGFXCFSA-N -1 3 362.433 3.597 20 0 FHADHM COc1ccc([C@H](Nc2ncc(-c3nnn[n-]3)cc2Cl)C(C)C)cc1 ZINC000737073508 598935961 /nfs/dbraw/zinc/93/59/61/598935961.db2.gz CMRXPSGOMFCXKF-OAHLLOKOSA-N -1 3 358.833 3.733 20 0 FHADHM COc1ccc([C@H](Nc2ncc(-c3nn[n-]n3)cc2Cl)C(C)C)cc1 ZINC000737073508 598935962 /nfs/dbraw/zinc/93/59/62/598935962.db2.gz CMRXPSGOMFCXKF-OAHLLOKOSA-N -1 3 358.833 3.733 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1Sc1ccccc1Br ZINC000737557177 598936202 /nfs/dbraw/zinc/93/62/02/598936202.db2.gz CUKXRLRWSQZECQ-UHFFFAOYSA-N -1 3 368.647 3.829 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1Sc1ccccc1Br ZINC000737557177 598936204 /nfs/dbraw/zinc/93/62/04/598936204.db2.gz CUKXRLRWSQZECQ-UHFFFAOYSA-N -1 3 368.647 3.829 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1OCCSc1ccc2c(c1)CCC2 ZINC000737032746 598938177 /nfs/dbraw/zinc/93/81/77/598938177.db2.gz OAPQJMZIXPUJHX-UHFFFAOYSA-N -1 3 368.462 3.535 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1OCCSc1ccc2c(c1)CCC2 ZINC000737032746 598938178 /nfs/dbraw/zinc/93/81/78/598938178.db2.gz OAPQJMZIXPUJHX-UHFFFAOYSA-N -1 3 368.462 3.535 20 0 FHADHM CC(C)C[C@@H](C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000735755585 598939167 /nfs/dbraw/zinc/93/91/67/598939167.db2.gz HEJDABDCHDJNJY-HNAYVOBHSA-N -1 3 363.465 3.874 20 0 FHADHM CC(C)C[C@@H](C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000735755585 598939168 /nfs/dbraw/zinc/93/91/68/598939168.db2.gz HEJDABDCHDJNJY-HNAYVOBHSA-N -1 3 363.465 3.874 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1OCCS[C@@H](C)c1ccccc1F ZINC000737032763 598939802 /nfs/dbraw/zinc/93/98/02/598939802.db2.gz OCYGXJGGMGNMIG-LBPRGKRZSA-N -1 3 374.441 3.888 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1OCCS[C@@H](C)c1ccccc1F ZINC000737032763 598939804 /nfs/dbraw/zinc/93/98/04/598939804.db2.gz OCYGXJGGMGNMIG-LBPRGKRZSA-N -1 3 374.441 3.888 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1OCCS[C@H](C)c1cccs1 ZINC000737032842 598940147 /nfs/dbraw/zinc/94/01/47/598940147.db2.gz PMMXOUSVFJQCON-LLVKDONJSA-N -1 3 362.480 3.810 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1OCCS[C@H](C)c1cccs1 ZINC000737032842 598940149 /nfs/dbraw/zinc/94/01/49/598940149.db2.gz PMMXOUSVFJQCON-LLVKDONJSA-N -1 3 362.480 3.810 20 0 FHADHM CC(C)C[C@@H](C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccccc1 ZINC000735756778 598940579 /nfs/dbraw/zinc/94/05/79/598940579.db2.gz QRIOUBHRVCUZLD-OAHLLOKOSA-N -1 3 353.401 3.774 20 0 FHADHM CC(C)C[C@@H](C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccccc1 ZINC000735756778 598940584 /nfs/dbraw/zinc/94/05/84/598940584.db2.gz QRIOUBHRVCUZLD-OAHLLOKOSA-N -1 3 353.401 3.774 20 0 FHADHM CC(C)C[C@H]1CCCCCN1C(=O)CCc1ccc(-c2nnn[n-]2)cc1 ZINC000735795921 598943528 /nfs/dbraw/zinc/94/35/28/598943528.db2.gz PKPLNGMXHURHQF-GOSISDBHSA-N -1 3 355.486 3.617 20 0 FHADHM CC(C)C[C@H]1CCCCCN1C(=O)CCc1ccc(-c2nn[n-]n2)cc1 ZINC000735795921 598943530 /nfs/dbraw/zinc/94/35/30/598943530.db2.gz PKPLNGMXHURHQF-GOSISDBHSA-N -1 3 355.486 3.617 20 0 FHADHM Fc1ccc(NCc2ccc(-c3nnn[n-]3)cc2F)c(OCC2CC2)c1 ZINC000737655734 598979759 /nfs/dbraw/zinc/97/97/59/598979759.db2.gz FSFYKTUZXSNQMV-UHFFFAOYSA-N -1 3 357.364 3.546 20 0 FHADHM Fc1ccc(NCc2ccc(-c3nn[n-]n3)cc2F)c(OCC2CC2)c1 ZINC000737655734 598979761 /nfs/dbraw/zinc/97/97/61/598979761.db2.gz FSFYKTUZXSNQMV-UHFFFAOYSA-N -1 3 357.364 3.546 20 0 FHADHM Cc1cc(F)ccc1N(Cc1ccon1)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000737269736 598986642 /nfs/dbraw/zinc/98/66/42/598986642.db2.gz HUMYYRVCXXIKQL-UHFFFAOYSA-N -1 3 364.384 3.509 20 0 FHADHM Cc1cc(F)ccc1N(Cc1ccon1)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000737269736 598986643 /nfs/dbraw/zinc/98/66/43/598986643.db2.gz HUMYYRVCXXIKQL-UHFFFAOYSA-N -1 3 364.384 3.509 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)nc1)C(C)(C)C ZINC000735561113 599014823 /nfs/dbraw/zinc/01/48/23/599014823.db2.gz VSZVVEZBKBIWDZ-LBPRGKRZSA-N -1 3 366.425 3.675 20 0 FHADHM CC(C)(C)Oc1ccccc1NC(=S)Nc1ccccc1-c1nnn[n-]1 ZINC000735644548 599013659 /nfs/dbraw/zinc/01/36/59/599013659.db2.gz ZYYXKCSUTBIFEK-UHFFFAOYSA-N -1 3 368.466 3.853 20 0 FHADHM CC(C)(C)Oc1ccccc1NC(=S)Nc1ccccc1-c1nn[n-]n1 ZINC000735644548 599013661 /nfs/dbraw/zinc/01/36/61/599013661.db2.gz ZYYXKCSUTBIFEK-UHFFFAOYSA-N -1 3 368.466 3.853 20 0 FHADHM CC[C@H](NC(=O)Nc1cc(-c2nnn[n-]2)ccc1C)c1cc(F)ccc1F ZINC000736361664 599020655 /nfs/dbraw/zinc/02/06/55/599020655.db2.gz HGKUMGVIRNAHTP-HNNXBMFYSA-N -1 3 372.379 3.726 20 0 FHADHM CC[C@H](NC(=O)Nc1cc(-c2nn[n-]n2)ccc1C)c1cc(F)ccc1F ZINC000736361664 599020657 /nfs/dbraw/zinc/02/06/57/599020657.db2.gz HGKUMGVIRNAHTP-HNNXBMFYSA-N -1 3 372.379 3.726 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(NCCc2cccc(Cl)c2)n1 ZINC000737634997 599040017 /nfs/dbraw/zinc/04/00/17/599040017.db2.gz CNPLCWGNOPGXAI-UHFFFAOYSA-N -1 3 368.750 3.589 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(NCCc2cccc(Cl)c2)n1 ZINC000737634997 599040020 /nfs/dbraw/zinc/04/00/20/599040020.db2.gz CNPLCWGNOPGXAI-UHFFFAOYSA-N -1 3 368.750 3.589 20 0 FHADHM C[C@@H](CNc1cc(-c2nnn[n-]2)c2ccccc2n1)Cc1cccs1 ZINC000820275827 599040538 /nfs/dbraw/zinc/04/05/38/599040538.db2.gz SKKJWRNRGJCKQB-GFCCVEGCSA-N -1 3 350.451 3.767 20 0 FHADHM C[C@@H](CNc1cc(-c2nn[n-]n2)c2ccccc2n1)Cc1cccs1 ZINC000820275827 599040541 /nfs/dbraw/zinc/04/05/41/599040541.db2.gz SKKJWRNRGJCKQB-GFCCVEGCSA-N -1 3 350.451 3.767 20 0 FHADHM C[C@H](CNc1cc(-c2nnn[n-]2)c2ccccc2n1)Cc1cccs1 ZINC000820275828 599040939 /nfs/dbraw/zinc/04/09/39/599040939.db2.gz SKKJWRNRGJCKQB-LBPRGKRZSA-N -1 3 350.451 3.767 20 0 FHADHM C[C@H](CNc1cc(-c2nn[n-]n2)c2ccccc2n1)Cc1cccs1 ZINC000820275828 599040942 /nfs/dbraw/zinc/04/09/42/599040942.db2.gz SKKJWRNRGJCKQB-LBPRGKRZSA-N -1 3 350.451 3.767 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(NCc2ccc(Cl)s2)n1 ZINC000737635852 599043095 /nfs/dbraw/zinc/04/30/95/599043095.db2.gz NUWPROKLPMSAFV-UHFFFAOYSA-N -1 3 360.752 3.608 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(NCc2ccc(Cl)s2)n1 ZINC000737635852 599043099 /nfs/dbraw/zinc/04/30/99/599043099.db2.gz NUWPROKLPMSAFV-UHFFFAOYSA-N -1 3 360.752 3.608 20 0 FHADHM CC(C)c1csc([C@@H]2CCCN(c3cccc(F)c3-c3nnn[n-]3)C2)n1 ZINC000820197596 599043424 /nfs/dbraw/zinc/04/34/24/599043424.db2.gz MLNBDDRICRFBLQ-GFCCVEGCSA-N -1 3 372.473 3.970 20 0 FHADHM CC(C)c1csc([C@@H]2CCCN(c3cccc(F)c3-c3nn[n-]n3)C2)n1 ZINC000820197596 599043427 /nfs/dbraw/zinc/04/34/27/599043427.db2.gz MLNBDDRICRFBLQ-GFCCVEGCSA-N -1 3 372.473 3.970 20 0 FHADHM CO[C@@H](CNc1c(Cl)cccc1-c1nnn[n-]1)c1ccc(Cl)cc1 ZINC000821676597 599046152 /nfs/dbraw/zinc/04/61/52/599046152.db2.gz BMSQMWAAXBHGJN-AWEZNQCLSA-N -1 3 364.236 3.973 20 0 FHADHM CO[C@@H](CNc1c(Cl)cccc1-c1nn[n-]n1)c1ccc(Cl)cc1 ZINC000821676597 599046155 /nfs/dbraw/zinc/04/61/55/599046155.db2.gz BMSQMWAAXBHGJN-AWEZNQCLSA-N -1 3 364.236 3.973 20 0 FHADHM Cc1ccc2c(c1)CC[C@@H]2Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000737379350 599050167 /nfs/dbraw/zinc/05/01/67/599050167.db2.gz WBANIQGLJLBVCE-ZDUSSCGKSA-N -1 3 360.343 3.688 20 0 FHADHM Cc1ccc2c(c1)CC[C@@H]2Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000737379350 599050170 /nfs/dbraw/zinc/05/01/70/599050170.db2.gz WBANIQGLJLBVCE-ZDUSSCGKSA-N -1 3 360.343 3.688 20 0 FHADHM COc1cccc(-c2ccc(CNc3ncccc3-c3nnn[n-]3)cc2)c1 ZINC000821854786 599054603 /nfs/dbraw/zinc/05/46/03/599054603.db2.gz VHLXZJXUKZQRDY-UHFFFAOYSA-N -1 3 358.405 3.549 20 0 FHADHM COc1cccc(-c2ccc(CNc3ncccc3-c3nn[n-]n3)cc2)c1 ZINC000821854786 599054605 /nfs/dbraw/zinc/05/46/05/599054605.db2.gz VHLXZJXUKZQRDY-UHFFFAOYSA-N -1 3 358.405 3.549 20 0 FHADHM CC(C)c1cccc(NC(=O)CSc2ccc(-c3nnn[n-]3)cc2F)c1 ZINC000735928940 599065187 /nfs/dbraw/zinc/06/51/87/599065187.db2.gz SGOIANQLXKEGNQ-UHFFFAOYSA-N -1 3 371.441 3.860 20 0 FHADHM CC(C)c1cccc(NC(=O)CSc2ccc(-c3nn[n-]n3)cc2F)c1 ZINC000735928940 599065190 /nfs/dbraw/zinc/06/51/90/599065190.db2.gz SGOIANQLXKEGNQ-UHFFFAOYSA-N -1 3 371.441 3.860 20 0 FHADHM CCSCc1cccc(NC(=O)C=Cc2ccccc2-c2nnn[n-]2)c1 ZINC000736665433 599084035 /nfs/dbraw/zinc/08/40/35/599084035.db2.gz HYIQDSVZAOJFOA-KHPPLWFESA-N -1 3 365.462 3.772 20 0 FHADHM CCSCc1cccc(NC(=O)C=Cc2ccccc2-c2nn[n-]n2)c1 ZINC000736665433 599084037 /nfs/dbraw/zinc/08/40/37/599084037.db2.gz HYIQDSVZAOJFOA-KHPPLWFESA-N -1 3 365.462 3.772 20 0 FHADHM CC[C@]1(C)CCCN(c2c(-c3nnn[n-]3)cnc3c(F)cc(F)cc32)C1 ZINC000820950254 599089727 /nfs/dbraw/zinc/08/97/27/599089727.db2.gz LCQKVUZXPYHHTL-GOSISDBHSA-N -1 3 358.396 3.710 20 0 FHADHM CC[C@]1(C)CCCN(c2c(-c3nn[n-]n3)cnc3c(F)cc(F)cc32)C1 ZINC000820950254 599089731 /nfs/dbraw/zinc/08/97/31/599089731.db2.gz LCQKVUZXPYHHTL-GOSISDBHSA-N -1 3 358.396 3.710 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)NC[C@@H](C)C(C)(C)C ZINC000735831042 599103033 /nfs/dbraw/zinc/10/30/33/599103033.db2.gz MLCWJPTUABFBJL-OAHLLOKOSA-N -1 3 372.517 3.717 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)NC[C@@H](C)C(C)(C)C ZINC000735831042 599103035 /nfs/dbraw/zinc/10/30/35/599103035.db2.gz MLCWJPTUABFBJL-OAHLLOKOSA-N -1 3 372.517 3.717 20 0 FHADHM CC(C)CC[C@@H](NC(=O)NCc1cccc(-c2nnn[n-]2)c1)C(C)(C)C ZINC000735797427 599103427 /nfs/dbraw/zinc/10/34/27/599103427.db2.gz PEOVEFAUSIMVDR-MRXNPFEDSA-N -1 3 358.490 3.517 20 0 FHADHM CC(C)CC[C@@H](NC(=O)NCc1cccc(-c2nn[n-]n2)c1)C(C)(C)C ZINC000735797427 599103429 /nfs/dbraw/zinc/10/34/29/599103429.db2.gz PEOVEFAUSIMVDR-MRXNPFEDSA-N -1 3 358.490 3.517 20 0 FHADHM CCCCC[C@H](NC(=O)NCc1cccc(-c2nnn[n-]2)c1)C(C)(C)C ZINC000736441834 599104100 /nfs/dbraw/zinc/10/41/00/599104100.db2.gz VFXQWXYUXLCWCH-INIZCTEOSA-N -1 3 358.490 3.661 20 0 FHADHM CCCCC[C@H](NC(=O)NCc1cccc(-c2nn[n-]n2)c1)C(C)(C)C ZINC000736441834 599104102 /nfs/dbraw/zinc/10/41/02/599104102.db2.gz VFXQWXYUXLCWCH-INIZCTEOSA-N -1 3 358.490 3.661 20 0 FHADHM Clc1ccc(-c2nnc(CSc3ccccc3-c3nnn[n-]3)o2)cc1 ZINC000737565037 599111081 /nfs/dbraw/zinc/11/10/81/599111081.db2.gz MVKRIGVNOVABMJ-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1ccc(-c2nnc(CSc3ccccc3-c3nn[n-]n3)o2)cc1 ZINC000737565037 599111083 /nfs/dbraw/zinc/11/10/83/599111083.db2.gz MVKRIGVNOVABMJ-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1cc(Br)ccc1C=Cc1ccc(-c2nnn[n-]2)cn1 ZINC000822567753 599111356 /nfs/dbraw/zinc/11/13/56/599111356.db2.gz GNQRWQWRNXOYJS-GORDUTHDSA-N -1 3 362.618 3.848 20 0 FHADHM Clc1cc(Br)ccc1C=Cc1ccc(-c2nn[n-]n2)cn1 ZINC000822567753 599111357 /nfs/dbraw/zinc/11/13/57/599111357.db2.gz GNQRWQWRNXOYJS-GORDUTHDSA-N -1 3 362.618 3.848 20 0 FHADHM COC(=O)[C@H](Sc1ccc(Cl)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736903313 599112106 /nfs/dbraw/zinc/11/21/06/599112106.db2.gz ZNONCWZSFZOGER-CQSZACIVSA-N -1 3 360.826 3.527 20 0 FHADHM COC(=O)[C@H](Sc1ccc(Cl)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736903313 599112108 /nfs/dbraw/zinc/11/21/08/599112108.db2.gz ZNONCWZSFZOGER-CQSZACIVSA-N -1 3 360.826 3.527 20 0 FHADHM COC(=O)[C@H](SCc1cc(C)ccc1C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736902314 599113210 /nfs/dbraw/zinc/11/32/10/599113210.db2.gz SUXUENBGZJVWLI-QGZVFWFLSA-N -1 3 368.462 3.631 20 0 FHADHM COC(=O)[C@H](SCc1cc(C)ccc1C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736902314 599113213 /nfs/dbraw/zinc/11/32/13/599113213.db2.gz SUXUENBGZJVWLI-QGZVFWFLSA-N -1 3 368.462 3.631 20 0 FHADHM Cc1cc(F)ccc1N(Cc1cccc(-c2nnn[n-]2)c1)Cc1ccccn1 ZINC000737270157 599133544 /nfs/dbraw/zinc/13/35/44/599133544.db2.gz KJJRMRWGZJFFRC-UHFFFAOYSA-N -1 3 374.423 3.916 20 0 FHADHM Cc1cc(F)ccc1N(Cc1cccc(-c2nn[n-]n2)c1)Cc1ccccn1 ZINC000737270157 599133545 /nfs/dbraw/zinc/13/35/45/599133545.db2.gz KJJRMRWGZJFFRC-UHFFFAOYSA-N -1 3 374.423 3.916 20 0 FHADHM CCc1ccc(-c2ccc(C(=O)Nc3ccc(-c4nnn[n-]4)cc3)o2)cc1 ZINC000463617509 599133637 /nfs/dbraw/zinc/13/36/37/599133637.db2.gz XQYCRUDXEPFNNH-UHFFFAOYSA-N -1 3 359.389 3.941 20 0 FHADHM CCc1ccc(-c2ccc(C(=O)Nc3ccc(-c4nn[n-]n4)cc3)o2)cc1 ZINC000463617509 599133639 /nfs/dbraw/zinc/13/36/39/599133639.db2.gz XQYCRUDXEPFNNH-UHFFFAOYSA-N -1 3 359.389 3.941 20 0 FHADHM Cc1cc2cc(C(=O)N[C@@H](C)c3ccc(-c4nnn[n-]4)cc3)oc2cc1C ZINC000822212986 599137365 /nfs/dbraw/zinc/13/73/65/599137365.db2.gz PMMPUORMSNRYBM-ZDUSSCGKSA-N -1 3 361.405 3.721 20 0 FHADHM Cc1cc2cc(C(=O)N[C@@H](C)c3ccc(-c4nn[n-]n4)cc3)oc2cc1C ZINC000822212986 599137367 /nfs/dbraw/zinc/13/73/67/599137367.db2.gz PMMPUORMSNRYBM-ZDUSSCGKSA-N -1 3 361.405 3.721 20 0 FHADHM CN(C(=O)C1CCC(c2ccccc2)CC1)c1cccc(-c2nnn[n-]2)c1 ZINC000821569560 599146726 /nfs/dbraw/zinc/14/67/26/599146726.db2.gz OFHPLTPRLUAGDT-UHFFFAOYSA-N -1 3 361.449 3.804 20 0 FHADHM CN(C(=O)C1CCC(c2ccccc2)CC1)c1cccc(-c2nn[n-]n2)c1 ZINC000821569560 599146728 /nfs/dbraw/zinc/14/67/28/599146728.db2.gz OFHPLTPRLUAGDT-UHFFFAOYSA-N -1 3 361.449 3.804 20 0 FHADHM O=C(CC1CCC1)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000822940904 599151752 /nfs/dbraw/zinc/15/17/52/599151752.db2.gz JFMSHPFIXQGAEE-UHFFFAOYSA-N -1 3 363.421 3.574 20 0 FHADHM O=C(CC1CCC1)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000822940904 599151753 /nfs/dbraw/zinc/15/17/53/599151753.db2.gz JFMSHPFIXQGAEE-UHFFFAOYSA-N -1 3 363.421 3.574 20 0 FHADHM COc1ccc2nc(C=Cc3ccc(OC)c(-c4nnn[n-]4)c3)sc2c1 ZINC000737120100 599153933 /nfs/dbraw/zinc/15/39/33/599153933.db2.gz IHKBOVAABPRUEK-YWEYNIOJSA-N -1 3 365.418 3.664 20 0 FHADHM COc1ccc2nc(C=Cc3ccc(OC)c(-c4nn[n-]n4)c3)sc2c1 ZINC000737120100 599153935 /nfs/dbraw/zinc/15/39/35/599153935.db2.gz IHKBOVAABPRUEK-YWEYNIOJSA-N -1 3 365.418 3.664 20 0 FHADHM Cc1ccc(OC(F)F)c([C@@H](C)OC(=O)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737363935 599156671 /nfs/dbraw/zinc/15/66/71/599156671.db2.gz HCJQJZXJLXCLNK-LLVKDONJSA-N -1 3 374.347 3.695 20 0 FHADHM Cc1ccc(OC(F)F)c([C@@H](C)OC(=O)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737363935 599156673 /nfs/dbraw/zinc/15/66/73/599156673.db2.gz HCJQJZXJLXCLNK-LLVKDONJSA-N -1 3 374.347 3.695 20 0 FHADHM Cc1ccc(SCc2nnc(-c3cccc(-c4nnn[n-]4)c3)o2)c(C)c1 ZINC000737368191 599159224 /nfs/dbraw/zinc/15/92/24/599159224.db2.gz DOSIKKRPKGATDS-UHFFFAOYSA-N -1 3 364.434 3.826 20 0 FHADHM Cc1ccc(SCc2nnc(-c3cccc(-c4nn[n-]n4)c3)o2)c(C)c1 ZINC000737368191 599159226 /nfs/dbraw/zinc/15/92/26/599159226.db2.gz DOSIKKRPKGATDS-UHFFFAOYSA-N -1 3 364.434 3.826 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)ccc1OC(=O)C[C@@H](C)c1cccc(F)c1 ZINC000736626362 599160689 /nfs/dbraw/zinc/16/06/89/599160689.db2.gz GVWRPDBSYRUCOZ-GFCCVEGCSA-N -1 3 370.384 3.504 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)ccc1OC(=O)C[C@@H](C)c1cccc(F)c1 ZINC000736626362 599160690 /nfs/dbraw/zinc/16/06/90/599160690.db2.gz GVWRPDBSYRUCOZ-GFCCVEGCSA-N -1 3 370.384 3.504 20 0 FHADHM Cc1cc(N(Cc2ccc(-c3nnn[n-]3)cc2)CC(C)C)nc(C2CC2)n1 ZINC000737269318 599169231 /nfs/dbraw/zinc/16/92/31/599169231.db2.gz CRLKEGGIUDWTRF-UHFFFAOYSA-N -1 3 363.469 3.505 20 0 FHADHM Cc1cc(N(Cc2ccc(-c3nn[n-]n3)cc2)CC(C)C)nc(C2CC2)n1 ZINC000737269318 599169234 /nfs/dbraw/zinc/16/92/34/599169234.db2.gz CRLKEGGIUDWTRF-UHFFFAOYSA-N -1 3 363.469 3.505 20 0 FHADHM Cc1ccc(NC(=O)[C@H](C)Sc2ccc(-c3nnn[n-]3)cc2F)cc1C ZINC000737356620 599171070 /nfs/dbraw/zinc/17/10/70/599171070.db2.gz QSGZNGLYOPMMMS-LBPRGKRZSA-N -1 3 371.441 3.742 20 0 FHADHM Cc1ccc(NC(=O)[C@H](C)Sc2ccc(-c3nn[n-]n3)cc2F)cc1C ZINC000737356620 599171073 /nfs/dbraw/zinc/17/10/73/599171073.db2.gz QSGZNGLYOPMMMS-LBPRGKRZSA-N -1 3 371.441 3.742 20 0 FHADHM CCc1cccc(C)c1NC(=O)CSc1ccc(-c2nnn[n-]2)cc1F ZINC000736700545 599171400 /nfs/dbraw/zinc/17/14/00/599171400.db2.gz UMGZTNKREWRJLC-UHFFFAOYSA-N -1 3 371.441 3.607 20 0 FHADHM CCc1cccc(C)c1NC(=O)CSc1ccc(-c2nn[n-]n2)cc1F ZINC000736700545 599171401 /nfs/dbraw/zinc/17/14/01/599171401.db2.gz UMGZTNKREWRJLC-UHFFFAOYSA-N -1 3 371.441 3.607 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cn1)c1ccccc1Sc1ccccc1 ZINC000738149250 599188109 /nfs/dbraw/zinc/18/81/09/599188109.db2.gz DNQSZHXEXSDFKX-UHFFFAOYSA-N -1 3 374.429 3.665 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cn1)c1ccccc1Sc1ccccc1 ZINC000738149250 599188110 /nfs/dbraw/zinc/18/81/10/599188110.db2.gz DNQSZHXEXSDFKX-UHFFFAOYSA-N -1 3 374.429 3.665 20 0 FHADHM Cc1ccccc1[C@@H](C)CC(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000737420620 599190660 /nfs/dbraw/zinc/19/06/60/599190660.db2.gz IGZIQDFAQAKIKG-LSDHHAIUSA-N -1 3 350.422 3.973 20 0 FHADHM Cc1ccccc1[C@@H](C)CC(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000737420620 599190662 /nfs/dbraw/zinc/19/06/62/599190662.db2.gz IGZIQDFAQAKIKG-LSDHHAIUSA-N -1 3 350.422 3.973 20 0 FHADHM CC[C@H](C)N(Cc1ccccc1)C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000736327995 599218094 /nfs/dbraw/zinc/21/80/94/599218094.db2.gz UQMSKKFXCSRFQG-ZDUSSCGKSA-N -1 3 368.416 3.838 20 0 FHADHM CC[C@H](C)N(Cc1ccccc1)C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000736327995 599218096 /nfs/dbraw/zinc/21/80/96/599218096.db2.gz UQMSKKFXCSRFQG-ZDUSSCGKSA-N -1 3 368.416 3.838 20 0 FHADHM CS[C@H]1CCC[C@@H](Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)C1 ZINC000737180448 599233180 /nfs/dbraw/zinc/23/31/80/599233180.db2.gz QSSUPUQRIOGQJH-KOLCDFICSA-N -1 3 357.405 3.972 20 0 FHADHM CS[C@H]1CCC[C@@H](Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)C1 ZINC000737180448 599233184 /nfs/dbraw/zinc/23/31/84/599233184.db2.gz QSSUPUQRIOGQJH-KOLCDFICSA-N -1 3 357.405 3.972 20 0 FHADHM O=C(Nc1ccc(OC2CCCC2)c(F)c1)c1sccc1-c1nnn[n-]1 ZINC000738172284 599234884 /nfs/dbraw/zinc/23/48/84/599234884.db2.gz GATQEWGWRXGKDG-UHFFFAOYSA-N -1 3 373.413 3.641 20 0 FHADHM O=C(Nc1ccc(OC2CCCC2)c(F)c1)c1sccc1-c1nn[n-]n1 ZINC000738172284 599234885 /nfs/dbraw/zinc/23/48/85/599234885.db2.gz GATQEWGWRXGKDG-UHFFFAOYSA-N -1 3 373.413 3.641 20 0 FHADHM C[C@H](NC(=O)Nc1cccc2ccccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000820380199 599235001 /nfs/dbraw/zinc/23/50/01/599235001.db2.gz NELNGWFBMHWUEC-ZDUSSCGKSA-N -1 3 358.405 3.903 20 0 FHADHM C[C@H](NC(=O)Nc1cccc2ccccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000820380199 599235003 /nfs/dbraw/zinc/23/50/03/599235003.db2.gz NELNGWFBMHWUEC-ZDUSSCGKSA-N -1 3 358.405 3.903 20 0 FHADHM CCCC[C@@H](CC)CNC(=S)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821039475 599238539 /nfs/dbraw/zinc/23/85/39/599238539.db2.gz CFNXGIJGUBQTEK-UONOGXRCSA-N -1 3 360.531 3.608 20 0 FHADHM CCCC[C@@H](CC)CNC(=S)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821039475 599238541 /nfs/dbraw/zinc/23/85/41/599238541.db2.gz CFNXGIJGUBQTEK-UONOGXRCSA-N -1 3 360.531 3.608 20 0 FHADHM C[C@H]1CCN(C(=S)Nc2ccccc2-c2nnn[n-]2)[C@@H](c2ccco2)C1 ZINC000820715957 599238571 /nfs/dbraw/zinc/23/85/71/599238571.db2.gz GFDPUPJFNJFOID-SWLSCSKDSA-N -1 3 368.466 3.630 20 0 FHADHM C[C@H]1CCN(C(=S)Nc2ccccc2-c2nn[n-]n2)[C@@H](c2ccco2)C1 ZINC000820715957 599238573 /nfs/dbraw/zinc/23/85/73/599238573.db2.gz GFDPUPJFNJFOID-SWLSCSKDSA-N -1 3 368.466 3.630 20 0 FHADHM Cc1ccc(NC(=S)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c(C)c1 ZINC000822254665 599239767 /nfs/dbraw/zinc/23/97/67/599239767.db2.gz OEGZAFXGXOBCPM-CYBMUJFWSA-N -1 3 352.467 3.531 20 0 FHADHM Cc1ccc(NC(=S)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c(C)c1 ZINC000822254665 599239769 /nfs/dbraw/zinc/23/97/69/599239769.db2.gz OEGZAFXGXOBCPM-CYBMUJFWSA-N -1 3 352.467 3.531 20 0 FHADHM CC(C)c1ccc(NC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000820192364 599240318 /nfs/dbraw/zinc/24/03/18/599240318.db2.gz LDTOZSTVANZZAZ-ZDUSSCGKSA-N -1 3 350.426 3.873 20 0 FHADHM CC(C)c1ccc(NC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000820192364 599240319 /nfs/dbraw/zinc/24/03/19/599240319.db2.gz LDTOZSTVANZZAZ-ZDUSSCGKSA-N -1 3 350.426 3.873 20 0 FHADHM Cc1ccc(OCCCC(=O)Nc2cccc(-c3nnn[n-]3)c2C)c(C)c1 ZINC000822262556 607271084 /nfs/dbraw/zinc/27/10/84/607271084.db2.gz BHUWOMBRASTALN-UHFFFAOYSA-N -1 3 365.437 3.590 20 0 FHADHM Cc1ccc(OCCCC(=O)Nc2cccc(-c3nn[n-]n3)c2C)c(C)c1 ZINC000822262556 607271085 /nfs/dbraw/zinc/27/10/85/607271085.db2.gz BHUWOMBRASTALN-UHFFFAOYSA-N -1 3 365.437 3.590 20 0 FHADHM C[C@H](NC(=O)Nc1ccc(Cl)cc1F)c1cccc(-c2nnn[n-]2)c1 ZINC000820379548 599242877 /nfs/dbraw/zinc/24/28/77/599242877.db2.gz CXPYOGDWVUMQIS-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM C[C@H](NC(=O)Nc1ccc(Cl)cc1F)c1cccc(-c2nn[n-]n2)c1 ZINC000820379548 599242879 /nfs/dbraw/zinc/24/28/79/599242879.db2.gz CXPYOGDWVUMQIS-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM C[C@H]1C[C@@H](c2cccc(F)c2)N(C(=O)Nc2ccc(-c3nnn[n-]3)cc2)C1 ZINC000820668303 599242952 /nfs/dbraw/zinc/24/29/52/599242952.db2.gz RJJZDOLBVQBORO-SJCJKPOMSA-N -1 3 366.400 3.621 20 0 FHADHM C[C@H]1C[C@@H](c2cccc(F)c2)N(C(=O)Nc2ccc(-c3nn[n-]n3)cc2)C1 ZINC000820668303 599242954 /nfs/dbraw/zinc/24/29/54/599242954.db2.gz RJJZDOLBVQBORO-SJCJKPOMSA-N -1 3 366.400 3.621 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc(Cl)cc1F)c1cccc(-c2nnn[n-]2)c1 ZINC000820379547 599242998 /nfs/dbraw/zinc/24/29/98/599242998.db2.gz CXPYOGDWVUMQIS-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc(Cl)cc1F)c1cccc(-c2nn[n-]n2)c1 ZINC000820379547 599243000 /nfs/dbraw/zinc/24/30/00/599243000.db2.gz CXPYOGDWVUMQIS-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM c1nc(CSc2nc(-c3ccccc3)ccc2-c2nnn[n-]2)cs1 ZINC000738420800 599247162 /nfs/dbraw/zinc/24/71/62/599247162.db2.gz LZTFSQJPEZSDPL-UHFFFAOYSA-N -1 3 352.448 3.678 20 0 FHADHM c1nc(CSc2nc(-c3ccccc3)ccc2-c2nn[n-]n2)cs1 ZINC000738420800 599247163 /nfs/dbraw/zinc/24/71/63/599247163.db2.gz LZTFSQJPEZSDPL-UHFFFAOYSA-N -1 3 352.448 3.678 20 0 FHADHM CCN(C(=O)/C=C\C1CCCCC1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736501494 599248030 /nfs/dbraw/zinc/24/80/30/599248030.db2.gz CTLRRGWJCQFJER-MZLJFPOFSA-N -1 3 353.470 3.913 20 0 FHADHM CCN(C(=O)/C=C\C1CCCCC1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736501494 599248032 /nfs/dbraw/zinc/24/80/32/599248032.db2.gz CTLRRGWJCQFJER-MZLJFPOFSA-N -1 3 353.470 3.913 20 0 FHADHM Cc1c(NC(=O)N[C@H](C)c2ccc(Cl)s2)cccc1-c1nnn[n-]1 ZINC000822090158 607288999 /nfs/dbraw/zinc/28/89/99/607288999.db2.gz JARDIDIEWFPDBG-SECBINFHSA-N -1 3 362.846 3.773 20 0 FHADHM Cc1c(NC(=O)N[C@H](C)c2ccc(Cl)s2)cccc1-c1nn[n-]n1 ZINC000822090158 607289000 /nfs/dbraw/zinc/28/90/00/607289000.db2.gz JARDIDIEWFPDBG-SECBINFHSA-N -1 3 362.846 3.773 20 0 FHADHM Cc1cc(F)cc2c1ncc(-c1nnn[n-]1)c2N(C)Cc1cccc(F)c1 ZINC000737264489 599256541 /nfs/dbraw/zinc/25/65/41/599256541.db2.gz RQCMLUYCFBVIHV-UHFFFAOYSA-N -1 3 366.375 3.638 20 0 FHADHM Cc1cc(F)cc2c1ncc(-c1nn[n-]n1)c2N(C)Cc1cccc(F)c1 ZINC000737264489 599256543 /nfs/dbraw/zinc/25/65/43/599256543.db2.gz RQCMLUYCFBVIHV-UHFFFAOYSA-N -1 3 366.375 3.638 20 0 FHADHM Cc1c(NC(=O)c2sccc2SC(F)F)cccc1-c1nnn[n-]1 ZINC000822116609 607297094 /nfs/dbraw/zinc/29/70/94/607297094.db2.gz VEHQODLDOFNADZ-UHFFFAOYSA-N -1 3 367.406 3.804 20 0 FHADHM Cc1c(NC(=O)c2sccc2SC(F)F)cccc1-c1nn[n-]n1 ZINC000822116609 607297095 /nfs/dbraw/zinc/29/70/95/607297095.db2.gz VEHQODLDOFNADZ-UHFFFAOYSA-N -1 3 367.406 3.804 20 0 FHADHM Cc1c(NC(=O)[C@@H](C)Oc2cccc(C(C)C)c2)cccc1-c1nnn[n-]1 ZINC000822060715 607297242 /nfs/dbraw/zinc/29/72/42/607297242.db2.gz ICUKCBOFSWAXFO-CQSZACIVSA-N -1 3 365.437 3.705 20 0 FHADHM Cc1c(NC(=O)[C@@H](C)Oc2cccc(C(C)C)c2)cccc1-c1nn[n-]n1 ZINC000822060715 607297243 /nfs/dbraw/zinc/29/72/43/607297243.db2.gz ICUKCBOFSWAXFO-CQSZACIVSA-N -1 3 365.437 3.705 20 0 FHADHM CCC[C@@H]1[C@@H](C)CCCN1C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821033773 599262963 /nfs/dbraw/zinc/26/29/63/599262963.db2.gz FDYJKXWUTMTKMS-GRDNDAEWSA-N -1 3 356.474 3.538 20 0 FHADHM CCC[C@@H]1[C@@H](C)CCCN1C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821033773 599262964 /nfs/dbraw/zinc/26/29/64/599262964.db2.gz FDYJKXWUTMTKMS-GRDNDAEWSA-N -1 3 356.474 3.538 20 0 FHADHM CCOc1ccc(C(F)(F)F)cc1NCc1ccc(-c2nnn[n-]2)s1 ZINC000821417824 607313913 /nfs/dbraw/zinc/31/39/13/607313913.db2.gz SZAZDKFJXHNKNH-UHFFFAOYSA-N -1 3 369.372 3.958 20 0 FHADHM Clc1ccc2ncc(-c3nnn[n-]3)c(N3CCc4sccc4C3)c2c1 ZINC000737574766 599265168 /nfs/dbraw/zinc/26/51/68/599265168.db2.gz SMCFTWGBXZOGRI-UHFFFAOYSA-N -1 3 368.853 3.693 20 0 FHADHM Clc1ccc2ncc(-c3nn[n-]n3)c(N3CCc4sccc4C3)c2c1 ZINC000737574766 599265170 /nfs/dbraw/zinc/26/51/70/599265170.db2.gz SMCFTWGBXZOGRI-UHFFFAOYSA-N -1 3 368.853 3.693 20 0 FHADHM CCCCCN(C(=O)Nc1cc(-c2nnn[n-]2)ccc1OCC)C(C)C ZINC000821056148 599266114 /nfs/dbraw/zinc/26/61/14/599266114.db2.gz MLHQFWHHTOJCFE-UHFFFAOYSA-N -1 3 360.462 3.698 20 0 FHADHM CCCCCN(C(=O)Nc1cc(-c2nn[n-]n2)ccc1OCC)C(C)C ZINC000821056148 599266117 /nfs/dbraw/zinc/26/61/17/599266117.db2.gz MLHQFWHHTOJCFE-UHFFFAOYSA-N -1 3 360.462 3.698 20 0 FHADHM FC(F)(F)c1cc(NCc2ccc3c(c2)COC3)ccc1-c1nnn[n-]1 ZINC000822723764 607305821 /nfs/dbraw/zinc/30/58/21/607305821.db2.gz NNCHXVLUEJPQNE-UHFFFAOYSA-N -1 3 361.327 3.528 20 0 FHADHM FC(F)(F)c1cc(NCc2ccc3c(c2)COC3)ccc1-c1nn[n-]n1 ZINC000822723764 607305822 /nfs/dbraw/zinc/30/58/22/607305822.db2.gz NNCHXVLUEJPQNE-UHFFFAOYSA-N -1 3 361.327 3.528 20 0 FHADHM COc1ccc(CNc2ccccc2CC(F)(F)F)cc1-c1nnn[n-]1 ZINC000821824545 607318449 /nfs/dbraw/zinc/31/84/49/607318449.db2.gz MPMANEBHDVWTLM-UHFFFAOYSA-N -1 3 363.343 3.592 20 0 FHADHM COc1ccc(CNc2ccccc2CC(F)(F)F)cc1-c1nn[n-]n1 ZINC000821824545 607318450 /nfs/dbraw/zinc/31/84/50/607318450.db2.gz MPMANEBHDVWTLM-UHFFFAOYSA-N -1 3 363.343 3.592 20 0 FHADHM Cc1coc(-c2ccc(C)c(NCc3ccc(-c4nnn[n-]4)s3)c2)n1 ZINC000822402482 607319725 /nfs/dbraw/zinc/31/97/25/607319725.db2.gz BFNXJKKVXXSMKF-UHFFFAOYSA-N -1 3 352.423 3.812 20 0 FHADHM Cc1cc(-c2nn[n-]n2)cc(C)c1OCc1ncc(-c2ccc(F)cc2)o1 ZINC000737221585 599282854 /nfs/dbraw/zinc/28/28/54/599282854.db2.gz NBWLMSLQSGABJB-UHFFFAOYSA-N -1 3 365.368 3.857 20 0 FHADHM CN(C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)C1CCCCC1 ZINC000821572119 599286804 /nfs/dbraw/zinc/28/68/04/599286804.db2.gz SAYIOHCRICGEOC-UHFFFAOYSA-N -1 3 368.363 3.682 20 0 FHADHM CN(C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)C1CCCCC1 ZINC000821572119 599286805 /nfs/dbraw/zinc/28/68/05/599286805.db2.gz SAYIOHCRICGEOC-UHFFFAOYSA-N -1 3 368.363 3.682 20 0 FHADHM Cc1ccc(N(C)C(C)C)c(C(=O)Nc2cccc(-c3nnn[n-]3)c2C)c1 ZINC000822240904 607322249 /nfs/dbraw/zinc/32/22/49/607322249.db2.gz DGVQEJDNWLTJDS-UHFFFAOYSA-N -1 3 364.453 3.580 20 0 FHADHM Cc1ccc(N(C)C(C)C)c(C(=O)Nc2cccc(-c3nn[n-]n3)c2C)c1 ZINC000822240904 607322250 /nfs/dbraw/zinc/32/22/50/607322250.db2.gz DGVQEJDNWLTJDS-UHFFFAOYSA-N -1 3 364.453 3.580 20 0 FHADHM Cn1c2ccccc2nc1[C@@H](NC1CCC(C(=O)[O-])CC1)c1ccccc1 ZINC000263445046 598115168 /nfs/dbraw/zinc/11/51/68/598115168.db2.gz XOGNVMSZNPJYID-UHYCVJNDSA-N -1 3 363.461 3.896 20 0 FHADHM CN(Cc1ccccc1C(F)(F)F)c1ccc(-c2nn[n-]n2)cc1F ZINC000736827300 598236638 /nfs/dbraw/zinc/23/66/38/598236638.db2.gz AAFCOXXKBWUIOU-UHFFFAOYSA-N -1 3 351.307 3.661 20 0 FHADHM C[C@H](Nc1ccc(-c2nn[n-]n2)cc1F)c1ccc(Br)cc1 ZINC000736136801 598241750 /nfs/dbraw/zinc/24/17/50/598241750.db2.gz HNDWUVFODJNOIF-VIFPVBQESA-N -1 3 362.206 3.941 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1NCc1ccc(OC2CCCCC2)nc1 ZINC000737643122 598244654 /nfs/dbraw/zinc/24/46/54/598244654.db2.gz AXRGXXKHHIIBRY-UHFFFAOYSA-N -1 3 368.416 3.724 20 0 FHADHM COc1ccccc1CCNc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000737151055 598275383 /nfs/dbraw/zinc/27/53/83/598275383.db2.gz WMOVPYKJPASHIW-UHFFFAOYSA-N -1 3 363.343 3.549 20 0 FHADHM COc1ccccc1CCNc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000737151055 598275385 /nfs/dbraw/zinc/27/53/85/598275385.db2.gz WMOVPYKJPASHIW-UHFFFAOYSA-N -1 3 363.343 3.549 20 0 FHADHM CN(C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C)C1CCCCCC1 ZINC000736738543 598276797 /nfs/dbraw/zinc/27/67/97/598276797.db2.gz AEUCZFVRLKWMIC-UHFFFAOYSA-N -1 3 359.478 3.610 20 0 FHADHM CN(C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C)C1CCCCCC1 ZINC000736738543 598276800 /nfs/dbraw/zinc/27/68/00/598276800.db2.gz AEUCZFVRLKWMIC-UHFFFAOYSA-N -1 3 359.478 3.610 20 0 FHADHM CC(C)CN(CC(C)C)C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000735827359 598279122 /nfs/dbraw/zinc/27/91/22/598279122.db2.gz LQKJXTNABTVFAB-UHFFFAOYSA-N -1 3 361.494 3.569 20 0 FHADHM CC(C)CN(CC(C)C)C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000735827359 598279124 /nfs/dbraw/zinc/27/91/24/598279124.db2.gz LQKJXTNABTVFAB-UHFFFAOYSA-N -1 3 361.494 3.569 20 0 FHADHM CC[C@H](NC(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)C1CCCCC1 ZINC000736362937 598283883 /nfs/dbraw/zinc/28/38/83/598283883.db2.gz LNAUUBJUXYXJEL-GUYCJALGSA-N -1 3 356.474 3.586 20 0 FHADHM CC[C@H](NC(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)C1CCCCC1 ZINC000736362937 598283884 /nfs/dbraw/zinc/28/38/84/598283884.db2.gz LNAUUBJUXYXJEL-GUYCJALGSA-N -1 3 356.474 3.586 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)N(C)CCC1CCCCC1 ZINC000736638280 598292334 /nfs/dbraw/zinc/29/23/34/598292334.db2.gz ZVBXXJPUNLNRTQ-UHFFFAOYSA-N -1 3 372.473 3.700 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)N(C)CCC1CCCCC1 ZINC000736638280 598292335 /nfs/dbraw/zinc/29/23/35/598292335.db2.gz ZVBXXJPUNLNRTQ-UHFFFAOYSA-N -1 3 372.473 3.700 20 0 FHADHM CC[C@H](C)Oc1ccccc1C=CC(=O)Nc1sccc1-c1nnn[n-]1 ZINC000736328081 598297435 /nfs/dbraw/zinc/29/74/35/598297435.db2.gz NRYGZQDPUOAHOQ-LAUAKBEESA-N -1 3 369.450 3.757 20 0 FHADHM CC[C@H](C)Oc1ccccc1C=CC(=O)Nc1sccc1-c1nn[n-]n1 ZINC000736328081 598297437 /nfs/dbraw/zinc/29/74/37/598297437.db2.gz NRYGZQDPUOAHOQ-LAUAKBEESA-N -1 3 369.450 3.757 20 0 FHADHM Clc1ccc2c(c1Cl)CCN(Cc1ccc(-c3nnn[n-]3)cc1)C2 ZINC000737574838 598300841 /nfs/dbraw/zinc/30/08/41/598300841.db2.gz UIAWYMZWUQEANK-UHFFFAOYSA-N -1 3 360.248 3.732 20 0 FHADHM Clc1ccc2c(c1Cl)CCN(Cc1ccc(-c3nn[n-]n3)cc1)C2 ZINC000737574838 598300843 /nfs/dbraw/zinc/30/08/43/598300843.db2.gz UIAWYMZWUQEANK-UHFFFAOYSA-N -1 3 360.248 3.732 20 0 FHADHM Fc1cc2cccnc2c(CSCc2cccc(-c3nnn[n-]3)c2)c1 ZINC000737643121 598313894 /nfs/dbraw/zinc/31/38/94/598313894.db2.gz AURLQYZVCLNGMY-UHFFFAOYSA-N -1 3 351.410 3.987 20 0 FHADHM Fc1cc2cccnc2c(CSCc2cccc(-c3nn[n-]n3)c2)c1 ZINC000737643121 598313895 /nfs/dbraw/zinc/31/38/95/598313895.db2.gz AURLQYZVCLNGMY-UHFFFAOYSA-N -1 3 351.410 3.987 20 0 FHADHM O=C(CSCc1ccc(F)cc1-c1nnn[n-]1)c1c[nH]c2ccccc21 ZINC000737936062 598315665 /nfs/dbraw/zinc/31/56/65/598315665.db2.gz JOESJWJFXMZPMX-UHFFFAOYSA-N -1 3 367.409 3.603 20 0 FHADHM O=C(CSCc1ccc(F)cc1-c1nn[n-]n1)c1c[nH]c2ccccc21 ZINC000737936062 598315667 /nfs/dbraw/zinc/31/56/67/598315667.db2.gz JOESJWJFXMZPMX-UHFFFAOYSA-N -1 3 367.409 3.603 20 0 FHADHM C[C@@H]1CCC[C@@H](NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)[C@@H]1C ZINC000736249120 598317052 /nfs/dbraw/zinc/31/70/52/598317052.db2.gz FDQRFAIOCIZMAI-GPCCPHFNSA-N -1 3 364.906 3.631 20 0 FHADHM C[C@@H]1CCC[C@@H](NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)[C@@H]1C ZINC000736249120 598317054 /nfs/dbraw/zinc/31/70/54/598317054.db2.gz FDQRFAIOCIZMAI-GPCCPHFNSA-N -1 3 364.906 3.631 20 0 FHADHM Cc1ccc(F)c(NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c1 ZINC000737345632 598317477 /nfs/dbraw/zinc/31/74/77/598317477.db2.gz TXZNSASDOPCFTM-UHFFFAOYSA-N -1 3 362.821 3.777 20 0 FHADHM Cc1ccc(F)c(NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c1 ZINC000737345632 598317479 /nfs/dbraw/zinc/31/74/79/598317479.db2.gz TXZNSASDOPCFTM-UHFFFAOYSA-N -1 3 362.821 3.777 20 0 FHADHM CCCN(CC(C)C)C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736470979 598323617 /nfs/dbraw/zinc/32/36/17/598323617.db2.gz QNNWRWGKMSPYLY-UHFFFAOYSA-N -1 3 352.895 3.585 20 0 FHADHM CCCN(CC(C)C)C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736470979 598323619 /nfs/dbraw/zinc/32/36/19/598323619.db2.gz QNNWRWGKMSPYLY-UHFFFAOYSA-N -1 3 352.895 3.585 20 0 FHADHM Cc1sc(NC(=O)[C@@H]2CCCc3sccc32)c(-c2nnn[n-]2)c1C ZINC000822558064 607350079 /nfs/dbraw/zinc/35/00/79/607350079.db2.gz LYZJAOHYSDKMPX-LLVKDONJSA-N -1 3 359.480 3.665 20 0 FHADHM Cc1sc(NC(=O)[C@@H]2CCCc3sccc32)c(-c2nn[n-]n2)c1C ZINC000822558064 607350081 /nfs/dbraw/zinc/35/00/81/607350081.db2.gz LYZJAOHYSDKMPX-LLVKDONJSA-N -1 3 359.480 3.665 20 0 FHADHM CCC(C)(C)C(=O)Nc1ccc(Oc2ncccc2-c2nnn[n-]2)cc1C ZINC000736314037 598365162 /nfs/dbraw/zinc/36/51/62/598365162.db2.gz PZAUQBFZGQLANK-UHFFFAOYSA-N -1 3 366.425 3.737 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)[C@@H](OC1CCCC1)c1ccccc1 ZINC000104367839 598379303 /nfs/dbraw/zinc/37/93/03/598379303.db2.gz RKTWTKPGDAQEKF-SFHVURJKSA-N -1 3 363.421 3.506 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)[C@@H](OC1CCCC1)c1ccccc1 ZINC000104367839 598379304 /nfs/dbraw/zinc/37/93/04/598379304.db2.gz RKTWTKPGDAQEKF-SFHVURJKSA-N -1 3 363.421 3.506 20 0 FHADHM CCN(C(=O)c1cccc2cccnc21)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736508445 598382949 /nfs/dbraw/zinc/38/29/49/598382949.db2.gz LRNGFDMXTKHKCP-AWEZNQCLSA-N -1 3 372.432 3.638 20 0 FHADHM CCN(C(=O)c1cccc2cccnc21)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736508445 598382951 /nfs/dbraw/zinc/38/29/51/598382951.db2.gz LRNGFDMXTKHKCP-AWEZNQCLSA-N -1 3 372.432 3.638 20 0 FHADHM CC(C)Oc1cccc([C@@H](C)Nc2ncc(-c3nnn[n-]3)cc2Cl)c1 ZINC000735914325 598388829 /nfs/dbraw/zinc/38/88/29/598388829.db2.gz WPLAYNZDXXIFIE-LLVKDONJSA-N -1 3 358.833 3.875 20 0 FHADHM CC(C)Oc1cccc([C@@H](C)Nc2ncc(-c3nn[n-]n3)cc2Cl)c1 ZINC000735914325 598388830 /nfs/dbraw/zinc/38/88/30/598388830.db2.gz WPLAYNZDXXIFIE-LLVKDONJSA-N -1 3 358.833 3.875 20 0 FHADHM Fc1cccc2c1SCC[C@@H]2Nc1ncc(-c2nnn[n-]2)cc1Cl ZINC000737663116 598390445 /nfs/dbraw/zinc/39/04/45/598390445.db2.gz GORKMHSVBPPZAA-LBPRGKRZSA-N -1 3 362.821 3.703 20 0 FHADHM Fc1cccc2c1SCC[C@@H]2Nc1ncc(-c2nn[n-]n2)cc1Cl ZINC000737663116 598390447 /nfs/dbraw/zinc/39/04/47/598390447.db2.gz GORKMHSVBPPZAA-LBPRGKRZSA-N -1 3 362.821 3.703 20 0 FHADHM Cc1ccsc1-c1nnc(SCc2ccc(-c3nnn[n-]3)cc2)o1 ZINC000737441613 598394157 /nfs/dbraw/zinc/39/41/57/598394157.db2.gz HVOFEZAEKYKYJM-UHFFFAOYSA-N -1 3 356.436 3.579 20 0 FHADHM Cc1ccsc1-c1nnc(SCc2ccc(-c3nn[n-]n3)cc2)o1 ZINC000737441613 598394159 /nfs/dbraw/zinc/39/41/59/598394159.db2.gz HVOFEZAEKYKYJM-UHFFFAOYSA-N -1 3 356.436 3.579 20 0 FHADHM Cc1cccc(NC(=O)[C@@H](C)Sc2ccc(-c3nnn[n-]3)cc2)c1C ZINC000737398154 598414832 /nfs/dbraw/zinc/41/48/32/598414832.db2.gz DJMHXPHUYWAUTK-CYBMUJFWSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1cccc(NC(=O)[C@@H](C)Sc2ccc(-c3nn[n-]n3)cc2)c1C ZINC000737398154 598414834 /nfs/dbraw/zinc/41/48/34/598414834.db2.gz DJMHXPHUYWAUTK-CYBMUJFWSA-N -1 3 353.451 3.603 20 0 FHADHM CN(Cc1cn2ccccc2c1-c1nnn[n-]1)Cc1ccc(F)cc1Cl ZINC000736818863 598417661 /nfs/dbraw/zinc/41/76/61/598417661.db2.gz CQWVIDRTCOHGGL-UHFFFAOYSA-N -1 3 370.819 3.544 20 0 FHADHM O=C(Nc1ccccc1-c1nnn[n-]1)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000738190934 598420321 /nfs/dbraw/zinc/42/03/21/598420321.db2.gz FRRCTSXNCDBTLU-QWHCGFSZSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1ccccc1-c1nn[n-]n1)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000738190934 598420323 /nfs/dbraw/zinc/42/03/23/598420323.db2.gz FRRCTSXNCDBTLU-QWHCGFSZSA-N -1 3 374.231 3.916 20 0 FHADHM C[C@H](c1ccccc1)c1ccc(OC(=O)c2ccc(-c3nnn[n-]3)cn2)cc1 ZINC000736201760 598453496 /nfs/dbraw/zinc/45/34/96/598453496.db2.gz HQEZSEPHZCQXAJ-CQSZACIVSA-N -1 3 371.400 3.633 20 0 FHADHM C[C@H](c1ccccc1)c1ccc(OC(=O)c2ccc(-c3nn[n-]n3)cn2)cc1 ZINC000736201760 598453498 /nfs/dbraw/zinc/45/34/98/598453498.db2.gz HQEZSEPHZCQXAJ-CQSZACIVSA-N -1 3 371.400 3.633 20 0 FHADHM CC(C)Sc1ccc(Cl)cc1NC(=O)c1ccc(-c2nnn[n-]2)cn1 ZINC000735920990 598453738 /nfs/dbraw/zinc/45/37/38/598453738.db2.gz DLVHGOMNUGJTJI-UHFFFAOYSA-N -1 3 374.857 3.668 20 0 FHADHM CC(C)Sc1ccc(Cl)cc1NC(=O)c1ccc(-c2nn[n-]n2)cn1 ZINC000735920990 598453739 /nfs/dbraw/zinc/45/37/39/598453739.db2.gz DLVHGOMNUGJTJI-UHFFFAOYSA-N -1 3 374.857 3.668 20 0 FHADHM Cc1cc(O)c(C(C)C)cc1NC(=O)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000826271449 607357759 /nfs/dbraw/zinc/35/77/59/607357759.db2.gz RQOIXPIVGVGXCZ-UHFFFAOYSA-N -1 3 373.363 3.535 20 0 FHADHM Cc1cc(O)c(C(C)C)cc1NC(=O)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000826271449 607357761 /nfs/dbraw/zinc/35/77/61/607357761.db2.gz RQOIXPIVGVGXCZ-UHFFFAOYSA-N -1 3 373.363 3.535 20 0 FHADHM Cc1ccc(NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)c(F)c1 ZINC000737358137 598475173 /nfs/dbraw/zinc/47/51/73/598475173.db2.gz YASDYMJSBFPPAX-UHFFFAOYSA-N -1 3 366.400 3.511 20 0 FHADHM Cc1ccc(NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)c(F)c1 ZINC000737358137 598475175 /nfs/dbraw/zinc/47/51/75/598475175.db2.gz YASDYMJSBFPPAX-UHFFFAOYSA-N -1 3 366.400 3.511 20 0 FHADHM O=C(OCc1ccc(-c2nnn[n-]2)cc1)[C@@H]1C[C@H]1c1cccc2ccccc21 ZINC000738236218 598476099 /nfs/dbraw/zinc/47/60/99/598476099.db2.gz FIRVEZKPXVUDHQ-VQTJNVASSA-N -1 3 370.412 3.867 20 0 FHADHM O=C(OCc1ccc(-c2nn[n-]n2)cc1)[C@@H]1C[C@H]1c1cccc2ccccc21 ZINC000738236218 598476101 /nfs/dbraw/zinc/47/61/01/598476101.db2.gz FIRVEZKPXVUDHQ-VQTJNVASSA-N -1 3 370.412 3.867 20 0 FHADHM CCCCC[C@@H](C)NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000736440549 598476342 /nfs/dbraw/zinc/47/63/42/598476342.db2.gz DKHOGIRIUKMJMS-CQSZACIVSA-N -1 3 356.474 3.510 20 0 FHADHM CCCCC[C@@H](C)NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000736440549 598476344 /nfs/dbraw/zinc/47/63/44/598476344.db2.gz DKHOGIRIUKMJMS-CQSZACIVSA-N -1 3 356.474 3.510 20 0 FHADHM CCCCC[C@H](C)NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000736440548 598476354 /nfs/dbraw/zinc/47/63/54/598476354.db2.gz DKHOGIRIUKMJMS-AWEZNQCLSA-N -1 3 356.474 3.510 20 0 FHADHM CCCCC[C@H](C)NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000736440548 598476356 /nfs/dbraw/zinc/47/63/56/598476356.db2.gz DKHOGIRIUKMJMS-AWEZNQCLSA-N -1 3 356.474 3.510 20 0 FHADHM CSCc1ccc(NC(=O)N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000737183318 598477096 /nfs/dbraw/zinc/47/70/96/598477096.db2.gz YDDAYLRVSCMUDP-GFCCVEGCSA-N -1 3 368.466 3.612 20 0 FHADHM CSCc1ccc(NC(=O)N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000737183318 598477098 /nfs/dbraw/zinc/47/70/98/598477098.db2.gz YDDAYLRVSCMUDP-GFCCVEGCSA-N -1 3 368.466 3.612 20 0 FHADHM CC[C@](C)(NC(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000736312909 598483657 /nfs/dbraw/zinc/48/36/57/598483657.db2.gz DEZRLCDMNULMIS-XOBRGWDASA-N -1 3 364.453 3.552 20 0 FHADHM CC[C@](C)(NC(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000736312909 598483659 /nfs/dbraw/zinc/48/36/59/598483659.db2.gz DEZRLCDMNULMIS-XOBRGWDASA-N -1 3 364.453 3.552 20 0 FHADHM C[C@H](OC(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1)c1cccc(-c2nnn[n-]2)c1 ZINC000736151173 598484225 /nfs/dbraw/zinc/48/42/25/598484225.db2.gz LDAFMERHAMLEHD-ZLKJLUDKSA-N -1 3 368.359 3.840 20 0 FHADHM C[C@H](OC(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1)c1cccc(-c2nn[n-]n2)c1 ZINC000736151173 598484227 /nfs/dbraw/zinc/48/42/27/598484227.db2.gz LDAFMERHAMLEHD-ZLKJLUDKSA-N -1 3 368.359 3.840 20 0 FHADHM C[C@@H](OC(=O)COc1ccc2ccccc2c1)c1cccc(-c2nnn[n-]2)c1 ZINC000736157071 598485765 /nfs/dbraw/zinc/48/57/65/598485765.db2.gz YSTZSUHDJAPLFN-CQSZACIVSA-N -1 3 374.400 3.703 20 0 FHADHM C[C@@H](OC(=O)COc1ccc2ccccc2c1)c1cccc(-c2nn[n-]n2)c1 ZINC000736157071 598485766 /nfs/dbraw/zinc/48/57/66/598485766.db2.gz YSTZSUHDJAPLFN-CQSZACIVSA-N -1 3 374.400 3.703 20 0 FHADHM Cc1cccc(OCCC(=O)O[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1C ZINC000737401261 598486880 /nfs/dbraw/zinc/48/68/80/598486880.db2.gz MEDVZRNHQPNSLH-OAHLLOKOSA-N -1 3 366.421 3.557 20 0 FHADHM Cc1cccc(OCCC(=O)O[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1C ZINC000737401261 598486882 /nfs/dbraw/zinc/48/68/82/598486882.db2.gz MEDVZRNHQPNSLH-OAHLLOKOSA-N -1 3 366.421 3.557 20 0 FHADHM Cc1ccc2c(CC(=O)O[C@H](C)c3cccc(-c4nnn[n-]4)c3)coc2c1 ZINC000737372449 598488103 /nfs/dbraw/zinc/48/81/03/598488103.db2.gz YBSRQSUWRIARDV-CYBMUJFWSA-N -1 3 362.389 3.768 20 0 FHADHM Cc1ccc2c(CC(=O)O[C@H](C)c3cccc(-c4nn[n-]n4)c3)coc2c1 ZINC000737372449 598488105 /nfs/dbraw/zinc/48/81/05/598488105.db2.gz YBSRQSUWRIARDV-CYBMUJFWSA-N -1 3 362.389 3.768 20 0 FHADHM C[C@@H](OC(=O)CCSc1ccc(F)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000736147160 598488153 /nfs/dbraw/zinc/48/81/53/598488153.db2.gz BSELCADICSGEDW-GFCCVEGCSA-N -1 3 372.425 3.792 20 0 FHADHM C[C@@H](OC(=O)CCSc1ccc(F)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000736147160 598488155 /nfs/dbraw/zinc/48/81/55/598488155.db2.gz BSELCADICSGEDW-GFCCVEGCSA-N -1 3 372.425 3.792 20 0 FHADHM C[C@@H](OC(=O)CSCc1ccc(F)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000736155426 598488811 /nfs/dbraw/zinc/48/88/11/598488811.db2.gz NFYPXIMSQBIGFL-GFCCVEGCSA-N -1 3 372.425 3.543 20 0 FHADHM C[C@@H](OC(=O)CSCc1ccc(F)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000736155426 598488813 /nfs/dbraw/zinc/48/88/13/598488813.db2.gz NFYPXIMSQBIGFL-GFCCVEGCSA-N -1 3 372.425 3.543 20 0 FHADHM C[C@H](OC(=O)/C=C/Sc1ccccc1)c1cccc(-c2nnn[n-]2)c1 ZINC000736153670 598489037 /nfs/dbraw/zinc/48/90/37/598489037.db2.gz RIBDHIWEBWRBOS-NHAQELONSA-N -1 3 352.419 3.777 20 0 FHADHM C[C@H](OC(=O)/C=C/Sc1ccccc1)c1cccc(-c2nn[n-]n2)c1 ZINC000736153670 598489038 /nfs/dbraw/zinc/48/90/38/598489038.db2.gz RIBDHIWEBWRBOS-NHAQELONSA-N -1 3 352.419 3.777 20 0 FHADHM C[C@@H](OC(=O)Cc1c(F)cccc1Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000736155409 598490916 /nfs/dbraw/zinc/49/09/16/598490916.db2.gz MRQMDTSYFXZVTA-SNVBAGLBSA-N -1 3 360.776 3.506 20 0 FHADHM C[C@@H](OC(=O)Cc1c(F)cccc1Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000736155409 598490917 /nfs/dbraw/zinc/49/09/17/598490917.db2.gz MRQMDTSYFXZVTA-SNVBAGLBSA-N -1 3 360.776 3.506 20 0 FHADHM Cc1ncccc1C(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)cc1 ZINC000737502476 598493585 /nfs/dbraw/zinc/49/35/85/598493585.db2.gz ODHYVDWQCMUMDK-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ncccc1C(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)cc1 ZINC000737502476 598493587 /nfs/dbraw/zinc/49/35/87/598493587.db2.gz ODHYVDWQCMUMDK-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM CC(=O)c1ccc(Cl)c(Cl)c1OCc1ccc(-c2nnn[n-]2)cc1 ZINC000735495410 598493924 /nfs/dbraw/zinc/49/39/24/598493924.db2.gz IUBIWJSAAOGULQ-UHFFFAOYSA-N -1 3 363.204 3.955 20 0 FHADHM CC(=O)c1ccc(Cl)c(Cl)c1OCc1ccc(-c2nn[n-]n2)cc1 ZINC000735495410 598493925 /nfs/dbraw/zinc/49/39/25/598493925.db2.gz IUBIWJSAAOGULQ-UHFFFAOYSA-N -1 3 363.204 3.955 20 0 FHADHM O=C(c1ccc(-c2nnn[n-]2)cc1)N1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000738254429 598496677 /nfs/dbraw/zinc/49/66/77/598496677.db2.gz NEDMBILBYCGQMU-IBGZPJMESA-N -1 3 372.432 3.715 20 0 FHADHM O=C(c1ccc(-c2nn[n-]n2)cc1)N1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000738254429 598496679 /nfs/dbraw/zinc/49/66/79/598496679.db2.gz NEDMBILBYCGQMU-IBGZPJMESA-N -1 3 372.432 3.715 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@@H](C)c1ccc(CC)cc1 ZINC000736634393 598498343 /nfs/dbraw/zinc/49/83/43/598498343.db2.gz HAIGRXCRWQTXMQ-ZDUSSCGKSA-N -1 3 365.437 3.570 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@@H](C)c1ccc(CC)cc1 ZINC000736634393 598498345 /nfs/dbraw/zinc/49/83/45/598498345.db2.gz HAIGRXCRWQTXMQ-ZDUSSCGKSA-N -1 3 365.437 3.570 20 0 FHADHM FC(F)Oc1ccccc1CNc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000737638618 598508346 /nfs/dbraw/zinc/50/83/46/598508346.db2.gz GXSQLHSHABSCLS-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM FC(F)Oc1ccccc1CNc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000737638618 598508348 /nfs/dbraw/zinc/50/83/48/598508348.db2.gz GXSQLHSHABSCLS-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)[C@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000590030798 598513160 /nfs/dbraw/zinc/51/31/60/598513160.db2.gz GLEGLUSXJXMQFQ-OLZOCXBDSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)[C@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000590030798 598513162 /nfs/dbraw/zinc/51/31/62/598513162.db2.gz GLEGLUSXJXMQFQ-OLZOCXBDSA-N -1 3 374.231 3.916 20 0 FHADHM CC(C)CC[C@H]1CCC[C@@H]1NC(=S)Nc1ccccc1-c1nnn[n-]1 ZINC000735796794 598513572 /nfs/dbraw/zinc/51/35/72/598513572.db2.gz IISRYOZEXBAYAA-HIFRSBDPSA-N -1 3 358.515 3.758 20 0 FHADHM CC(C)CC[C@H]1CCC[C@@H]1NC(=S)Nc1ccccc1-c1nn[n-]n1 ZINC000735796794 598513573 /nfs/dbraw/zinc/51/35/73/598513573.db2.gz IISRYOZEXBAYAA-HIFRSBDPSA-N -1 3 358.515 3.758 20 0 FHADHM CCc1c(C)sc(NC(=O)C2(c3cccc(C)c3)CC2)c1-c1nnn[n-]1 ZINC000736670802 598515985 /nfs/dbraw/zinc/51/59/85/598515985.db2.gz SGEKIEDTFYKIMY-UHFFFAOYSA-N -1 3 367.478 3.778 20 0 FHADHM CCc1c(C)sc(NC(=O)C2(c3cccc(C)c3)CC2)c1-c1nn[n-]n1 ZINC000736670802 598515986 /nfs/dbraw/zinc/51/59/86/598515986.db2.gz SGEKIEDTFYKIMY-UHFFFAOYSA-N -1 3 367.478 3.778 20 0 FHADHM CCc1c(C)sc(NC(=O)C[C@@H](C)c2ccccc2)c1-c1nnn[n-]1 ZINC000736669232 598518251 /nfs/dbraw/zinc/51/82/51/598518251.db2.gz AELFAHCACYJLGS-LLVKDONJSA-N -1 3 355.467 3.931 20 0 FHADHM CCc1c(C)sc(NC(=O)C[C@@H](C)c2ccccc2)c1-c1nn[n-]n1 ZINC000736669232 598518253 /nfs/dbraw/zinc/51/82/53/598518253.db2.gz AELFAHCACYJLGS-LLVKDONJSA-N -1 3 355.467 3.931 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccc3ncsc3c2)c1-c1nnn[n-]1 ZINC000736675781 598518571 /nfs/dbraw/zinc/51/85/71/598518571.db2.gz NAXHAYIGUWIFOG-UHFFFAOYSA-N -1 3 370.463 3.661 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccc3ncsc3c2)c1-c1nn[n-]n1 ZINC000736675781 598518572 /nfs/dbraw/zinc/51/85/72/598518572.db2.gz NAXHAYIGUWIFOG-UHFFFAOYSA-N -1 3 370.463 3.661 20 0 FHADHM CCc1c(C)sc(NC(=O)CCCc2cccs2)c1-c1nnn[n-]1 ZINC000736671174 598518799 /nfs/dbraw/zinc/51/87/99/598518799.db2.gz SYTWAXZVGVRFQL-UHFFFAOYSA-N -1 3 361.496 3.822 20 0 FHADHM CCc1c(C)sc(NC(=O)CCCc2cccs2)c1-c1nn[n-]n1 ZINC000736671174 598518801 /nfs/dbraw/zinc/51/88/01/598518801.db2.gz SYTWAXZVGVRFQL-UHFFFAOYSA-N -1 3 361.496 3.822 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cc3ccccc3o2)c1-c1nnn[n-]1 ZINC000736676308 598519181 /nfs/dbraw/zinc/51/91/81/598519181.db2.gz RERSJCRJZYYDRL-UHFFFAOYSA-N -1 3 353.407 3.798 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cc3ccccc3o2)c1-c1nn[n-]n1 ZINC000736676308 598519182 /nfs/dbraw/zinc/51/91/82/598519182.db2.gz RERSJCRJZYYDRL-UHFFFAOYSA-N -1 3 353.407 3.798 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccc3ccccc3n2)c1-c1nnn[n-]1 ZINC000736676300 598519217 /nfs/dbraw/zinc/51/92/17/598519217.db2.gz QZLHGISWNCJZCI-UHFFFAOYSA-N -1 3 364.434 3.600 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccc3ccccc3n2)c1-c1nn[n-]n1 ZINC000736676300 598519218 /nfs/dbraw/zinc/51/92/18/598519218.db2.gz QZLHGISWNCJZCI-UHFFFAOYSA-N -1 3 364.434 3.600 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@H]1NC(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000735796717 598527727 /nfs/dbraw/zinc/52/77/27/598527727.db2.gz HDQMGDLQECDLBF-UWWQBHOKSA-N -1 3 370.501 3.832 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@H]1NC(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000735796717 598527728 /nfs/dbraw/zinc/52/77/28/598527728.db2.gz HDQMGDLQECDLBF-UWWQBHOKSA-N -1 3 370.501 3.832 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)c1ccc(SC(F)(F)F)cc1 ZINC000123626573 598530640 /nfs/dbraw/zinc/53/06/40/598530640.db2.gz ZDCXHAPEEIBQJF-UHFFFAOYSA-N -1 3 365.340 3.731 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)c1ccc(SC(F)(F)F)cc1 ZINC000123626573 598530642 /nfs/dbraw/zinc/53/06/42/598530642.db2.gz ZDCXHAPEEIBQJF-UHFFFAOYSA-N -1 3 365.340 3.731 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000108710229 598532538 /nfs/dbraw/zinc/53/25/38/598532538.db2.gz MJFWMUZGRPGURZ-RTBURBONSA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000108710229 598532540 /nfs/dbraw/zinc/53/25/40/598532540.db2.gz MJFWMUZGRPGURZ-RTBURBONSA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1ccccc1-c1nnn[n-]1)[C@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000738191042 598533777 /nfs/dbraw/zinc/53/37/77/598533777.db2.gz IAFYPAXPXFYZPY-ROUUACIJSA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1ccccc1-c1nn[n-]n1)[C@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000738191042 598533778 /nfs/dbraw/zinc/53/37/78/598533778.db2.gz IAFYPAXPXFYZPY-ROUUACIJSA-N -1 3 355.401 3.762 20 0 FHADHM C/C=C/C(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)c(Cl)c1 ZINC000736301361 598541840 /nfs/dbraw/zinc/54/18/40/598541840.db2.gz AGIODGJNMLLLMI-DUXPYHPUSA-N -1 3 369.812 3.614 20 0 FHADHM C/C=C/C(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)c(Cl)c1 ZINC000736301361 598541841 /nfs/dbraw/zinc/54/18/41/598541841.db2.gz AGIODGJNMLLLMI-DUXPYHPUSA-N -1 3 369.812 3.614 20 0 FHADHM O=C(CCC1CCCCC1)Nc1cc(-c2nnn[n-]2)ccc1OC(F)F ZINC000737823997 598547148 /nfs/dbraw/zinc/54/71/48/598547148.db2.gz MXNAOEWBBDCROQ-UHFFFAOYSA-N -1 3 365.384 3.767 20 0 FHADHM O=C(CCC1CCCCC1)Nc1cc(-c2nn[n-]n2)ccc1OC(F)F ZINC000737823997 598547150 /nfs/dbraw/zinc/54/71/50/598547150.db2.gz MXNAOEWBBDCROQ-UHFFFAOYSA-N -1 3 365.384 3.767 20 0 FHADHM O=C(COc1ccc(-c2nnn[n-]2)c(F)c1)c1ccc(-c2ccccc2)cc1 ZINC000737920200 598548737 /nfs/dbraw/zinc/54/87/37/598548737.db2.gz RSKXXFKJDSVQQU-UHFFFAOYSA-N -1 3 374.375 3.935 20 0 FHADHM O=C(COc1ccc(-c2nn[n-]n2)c(F)c1)c1ccc(-c2ccccc2)cc1 ZINC000737920200 598548739 /nfs/dbraw/zinc/54/87/39/598548739.db2.gz RSKXXFKJDSVQQU-UHFFFAOYSA-N -1 3 374.375 3.935 20 0 FHADHM FC(F)(F)c1ccccc1[C@H]1CCCN1c1ccc(-c2nnn[n-]2)cn1 ZINC000737635447 598551814 /nfs/dbraw/zinc/55/18/14/598551814.db2.gz GDOXIQYVDAXVGN-CQSZACIVSA-N -1 3 360.343 3.622 20 0 FHADHM FC(F)(F)c1ccccc1[C@H]1CCCN1c1ccc(-c2nn[n-]n2)cn1 ZINC000737635447 598551815 /nfs/dbraw/zinc/55/18/15/598551815.db2.gz GDOXIQYVDAXVGN-CQSZACIVSA-N -1 3 360.343 3.622 20 0 FHADHM CCOc1ccc(Br)cc1NCc1ccccc1-c1nnn[n-]1 ZINC000736635970 598552398 /nfs/dbraw/zinc/55/23/98/598552398.db2.gz GAZAXJVOVPLPTP-UHFFFAOYSA-N -1 3 374.242 3.640 20 0 FHADHM CCOc1ccc(Br)cc1NCc1ccccc1-c1nn[n-]n1 ZINC000736635970 598552401 /nfs/dbraw/zinc/55/24/01/598552401.db2.gz GAZAXJVOVPLPTP-UHFFFAOYSA-N -1 3 374.242 3.640 20 0 FHADHM CC(C)CN(C(=O)[C@H](C)c1ccccc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000735818620 598552871 /nfs/dbraw/zinc/55/28/71/598552871.db2.gz OTLBUTXFSQKNEO-CQSZACIVSA-N -1 3 367.428 3.799 20 0 FHADHM CC(C)CN(C(=O)[C@H](C)c1ccccc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000735818620 598552872 /nfs/dbraw/zinc/55/28/72/598552872.db2.gz OTLBUTXFSQKNEO-CQSZACIVSA-N -1 3 367.428 3.799 20 0 FHADHM Cc1ncccc1C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000737503047 598553938 /nfs/dbraw/zinc/55/39/38/598553938.db2.gz QUFHWHKDAICKOJ-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ncccc1C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000737503047 598553940 /nfs/dbraw/zinc/55/39/40/598553940.db2.gz QUFHWHKDAICKOJ-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM CSC[C@@H](C)C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000737180116 598555219 /nfs/dbraw/zinc/55/52/19/598555219.db2.gz PDDJVQBAFAKJHW-GFCCVEGCSA-N -1 3 369.450 3.597 20 0 FHADHM CSC[C@@H](C)C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000737180116 598555221 /nfs/dbraw/zinc/55/52/21/598555221.db2.gz PDDJVQBAFAKJHW-GFCCVEGCSA-N -1 3 369.450 3.597 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1)[C@@H]1CC=CCC1 ZINC000738173816 598555767 /nfs/dbraw/zinc/55/57/67/598555767.db2.gz SESBZDHEMBLKQR-CQSZACIVSA-N -1 3 361.405 3.954 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1)[C@@H]1CC=CCC1 ZINC000738173816 598555769 /nfs/dbraw/zinc/55/57/69/598555769.db2.gz SESBZDHEMBLKQR-CQSZACIVSA-N -1 3 361.405 3.954 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1)Nc1cccnc1 ZINC000738171081 598562852 /nfs/dbraw/zinc/56/28/52/598562852.db2.gz AGBOUAGHUHZXOC-UHFFFAOYSA-N -1 3 373.376 3.698 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1)Nc1cccnc1 ZINC000738171081 598562855 /nfs/dbraw/zinc/56/28/55/598562855.db2.gz AGBOUAGHUHZXOC-UHFFFAOYSA-N -1 3 373.376 3.698 20 0 FHADHM CCCCN(C)C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736453541 598563203 /nfs/dbraw/zinc/56/32/03/598563203.db2.gz QCGJXDBYBFASTF-UHFFFAOYSA-N -1 3 366.425 3.923 20 0 FHADHM CCCCN(C)C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736453541 598563205 /nfs/dbraw/zinc/56/32/05/598563205.db2.gz QCGJXDBYBFASTF-UHFFFAOYSA-N -1 3 366.425 3.923 20 0 FHADHM CCCN(CC)C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736471832 598564941 /nfs/dbraw/zinc/56/49/41/598564941.db2.gz XBOISOFTYRNPLQ-UHFFFAOYSA-N -1 3 366.425 3.923 20 0 FHADHM CCCN(CC)C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736471832 598564942 /nfs/dbraw/zinc/56/49/42/598564942.db2.gz XBOISOFTYRNPLQ-UHFFFAOYSA-N -1 3 366.425 3.923 20 0 FHADHM CC/C=C/CCOC(=O)c1ccc(COc2ccc(-c3nn[n-]n3)cc2)o1 ZINC000736407609 598565045 /nfs/dbraw/zinc/56/50/45/598565045.db2.gz AIMSFXYSEVDJGI-ONEGZZNKSA-N -1 3 368.393 3.552 20 0 FHADHM CCC[C@H](C)NC(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736426117 598565209 /nfs/dbraw/zinc/56/52/09/598565209.db2.gz XMEZHYQBJIQUOH-ZDUSSCGKSA-N -1 3 366.425 3.969 20 0 FHADHM CCC[C@H](C)NC(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736426117 598565212 /nfs/dbraw/zinc/56/52/12/598565212.db2.gz XMEZHYQBJIQUOH-ZDUSSCGKSA-N -1 3 366.425 3.969 20 0 FHADHM Cc1ccc(CNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)cc1F ZINC000737343332 598571503 /nfs/dbraw/zinc/57/15/03/598571503.db2.gz VCSXPZDVZVHQNQ-UHFFFAOYSA-N -1 3 351.307 3.945 20 0 FHADHM Cc1ccc(CNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)cc1F ZINC000737343332 598571504 /nfs/dbraw/zinc/57/15/04/598571504.db2.gz VCSXPZDVZVHQNQ-UHFFFAOYSA-N -1 3 351.307 3.945 20 0 FHADHM CCCCN(CC)c1ccc(C(=O)Nc2ccccc2-c2nnn[n-]2)cc1 ZINC000736457436 598571982 /nfs/dbraw/zinc/57/19/82/598571982.db2.gz VBJYIQJJFUBYRX-UHFFFAOYSA-N -1 3 364.453 3.745 20 0 FHADHM CCCCN(CC)c1ccc(C(=O)Nc2ccccc2-c2nn[n-]n2)cc1 ZINC000736457436 598571983 /nfs/dbraw/zinc/57/19/83/598571983.db2.gz VBJYIQJJFUBYRX-UHFFFAOYSA-N -1 3 364.453 3.745 20 0 FHADHM FC(F)(F)c1cc(N[C@H]2CCN(c3ccccc3)C2)ccc1-c1nnn[n-]1 ZINC000737633847 598580860 /nfs/dbraw/zinc/58/08/60/598580860.db2.gz WWYARVBVXXFYQQ-ZDUSSCGKSA-N -1 3 374.370 3.576 20 0 FHADHM FC(F)(F)c1cc(N[C@H]2CCN(c3ccccc3)C2)ccc1-c1nn[n-]n1 ZINC000737633847 598580862 /nfs/dbraw/zinc/58/08/62/598580862.db2.gz WWYARVBVXXFYQQ-ZDUSSCGKSA-N -1 3 374.370 3.576 20 0 FHADHM Cc1ccc(CCCCC(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)cc1 ZINC000737338639 598584015 /nfs/dbraw/zinc/58/40/15/598584015.db2.gz VFVKYFIXAWEFTN-UHFFFAOYSA-N -1 3 353.401 3.666 20 0 FHADHM Cc1ccc(CCCCC(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)cc1 ZINC000737338639 598584013 /nfs/dbraw/zinc/58/40/13/598584013.db2.gz VFVKYFIXAWEFTN-UHFFFAOYSA-N -1 3 353.401 3.666 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccc(Cl)c(Cl)c1 ZINC000738167759 598592675 /nfs/dbraw/zinc/59/26/75/598592675.db2.gz UGMBNUVYPUNDRS-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccc(Cl)c(Cl)c1 ZINC000738167759 598592677 /nfs/dbraw/zinc/59/26/77/598592677.db2.gz UGMBNUVYPUNDRS-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM Cc1cc2oc(=O)cc(CNc3cc(-c4nnn[n-]4)ccc3C)c2cc1C ZINC000737284350 598593525 /nfs/dbraw/zinc/59/35/25/598593525.db2.gz JSZHQTBBQOVQJL-UHFFFAOYSA-N -1 3 361.405 3.510 20 0 FHADHM Cc1cc2oc(=O)cc(CNc3cc(-c4nn[n-]n4)ccc3C)c2cc1C ZINC000737284350 598593526 /nfs/dbraw/zinc/59/35/26/598593526.db2.gz JSZHQTBBQOVQJL-UHFFFAOYSA-N -1 3 361.405 3.510 20 0 FHADHM Fc1ccc(NCc2ncc(-c3ccc(Cl)cc3)o2)cc1-c1nnn[n-]1 ZINC000737656035 598602362 /nfs/dbraw/zinc/60/23/62/598602362.db2.gz GMRXUVWDWDPTKI-UHFFFAOYSA-N -1 3 370.775 3.926 20 0 FHADHM Fc1ccc(NCc2ncc(-c3ccc(Cl)cc3)o2)cc1-c1nn[n-]n1 ZINC000737656035 598602364 /nfs/dbraw/zinc/60/23/64/598602364.db2.gz GMRXUVWDWDPTKI-UHFFFAOYSA-N -1 3 370.775 3.926 20 0 FHADHM C[C@@H](Oc1ccc(-c2nn[n-]n2)cc1)c1nc(-c2cccc(Cl)c2)no1 ZINC000736167715 598608807 /nfs/dbraw/zinc/60/88/07/598608807.db2.gz HHPJHZXXEXSVBJ-SNVBAGLBSA-N -1 3 368.784 3.710 20 0 FHADHM Cc1ccccc1CN(C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)C1CC1 ZINC000737426472 598625385 /nfs/dbraw/zinc/62/53/85/598625385.db2.gz MNPJUAGLZLKHPB-UHFFFAOYSA-N -1 3 366.400 3.511 20 0 FHADHM Cc1ccccc1CN(C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)C1CC1 ZINC000737426472 598625387 /nfs/dbraw/zinc/62/53/87/598625387.db2.gz MNPJUAGLZLKHPB-UHFFFAOYSA-N -1 3 366.400 3.511 20 0 FHADHM CN(Cc1ccc(C(F)(F)F)cc1)c1ccc(F)cc1-c1nnn[n-]1 ZINC000736816295 598629414 /nfs/dbraw/zinc/62/94/14/598629414.db2.gz FEGABQUUJNDAIQ-UHFFFAOYSA-N -1 3 351.307 3.661 20 0 FHADHM CN(Cc1ccc(C(F)(F)F)cc1)c1ccc(F)cc1-c1nn[n-]n1 ZINC000736816295 598629416 /nfs/dbraw/zinc/62/94/16/598629416.db2.gz FEGABQUUJNDAIQ-UHFFFAOYSA-N -1 3 351.307 3.661 20 0 FHADHM Oc1ccc(C2=CCN(c3ccc(-c4nnn[n-]4)c(Cl)c3)CC2)cc1 ZINC000738397956 598638519 /nfs/dbraw/zinc/63/85/19/598638519.db2.gz RRVUFPFWDLEEDV-UHFFFAOYSA-N -1 3 353.813 3.519 20 0 FHADHM Oc1ccc(C2=CCN(c3ccc(-c4nn[n-]n4)c(Cl)c3)CC2)cc1 ZINC000738397956 598638520 /nfs/dbraw/zinc/63/85/20/598638520.db2.gz RRVUFPFWDLEEDV-UHFFFAOYSA-N -1 3 353.813 3.519 20 0 FHADHM Cc1nc2ccccc2c(SCc2ccc(F)cc2-c2nnn[n-]2)n1 ZINC000737483906 598643428 /nfs/dbraw/zinc/64/34/28/598643428.db2.gz QFOLGZWRYFLKRB-UHFFFAOYSA-N -1 3 352.398 3.550 20 0 FHADHM Cc1nc2ccccc2c(SCc2ccc(F)cc2-c2nn[n-]n2)n1 ZINC000737483906 598643430 /nfs/dbraw/zinc/64/34/30/598643430.db2.gz QFOLGZWRYFLKRB-UHFFFAOYSA-N -1 3 352.398 3.550 20 0 FHADHM O=C(CCCCOc1cccc(-c2nnn[n-]2)c1)Nc1ccccc1Cl ZINC000737831596 598643689 /nfs/dbraw/zinc/64/36/89/598643689.db2.gz BHLQFBTZYRIDES-UHFFFAOYSA-N -1 3 371.828 3.708 20 0 FHADHM O=C(CCCCOc1cccc(-c2nn[n-]n2)c1)Nc1ccccc1Cl ZINC000737831596 598643690 /nfs/dbraw/zinc/64/36/90/598643690.db2.gz BHLQFBTZYRIDES-UHFFFAOYSA-N -1 3 371.828 3.708 20 0 FHADHM Cc1cccc(NC(=O)c2ccc(Oc3ccc(-c4nnn[n-]4)cn3)cc2)c1 ZINC000737400529 598644072 /nfs/dbraw/zinc/64/40/72/598644072.db2.gz VFHCEZIQXSKDNN-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1cccc(NC(=O)c2ccc(Oc3ccc(-c4nn[n-]n4)cn3)cc2)c1 ZINC000737400529 598644074 /nfs/dbraw/zinc/64/40/74/598644074.db2.gz VFHCEZIQXSKDNN-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM O=C(C[C@H](c1ccccc1)C(F)(F)F)Oc1ccc(-c2nnn[n-]2)cc1 ZINC000737810652 598646124 /nfs/dbraw/zinc/64/61/24/598646124.db2.gz YSZKTOXOCJPMBW-CQSZACIVSA-N -1 3 362.311 3.508 20 0 FHADHM O=C(C[C@H](c1ccccc1)C(F)(F)F)Oc1ccc(-c2nn[n-]n2)cc1 ZINC000737810652 598646126 /nfs/dbraw/zinc/64/61/26/598646126.db2.gz YSZKTOXOCJPMBW-CQSZACIVSA-N -1 3 362.311 3.508 20 0 FHADHM Cc1ccc(OC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)c(C)c1 ZINC000737364179 598646639 /nfs/dbraw/zinc/64/66/39/598646639.db2.gz JCKYPWYEDQRMNZ-UHFFFAOYSA-N -1 3 366.421 3.638 20 0 FHADHM Cc1ccc(OC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)c(C)c1 ZINC000737364179 598646640 /nfs/dbraw/zinc/64/66/40/598646640.db2.gz JCKYPWYEDQRMNZ-UHFFFAOYSA-N -1 3 366.421 3.638 20 0 FHADHM CCc1ccccc1NC(=O)CCCCOc1cccc(-c2nnn[n-]2)c1 ZINC000736702836 598647037 /nfs/dbraw/zinc/64/70/37/598647037.db2.gz WSQOYNBTECHINT-UHFFFAOYSA-N -1 3 365.437 3.617 20 0 FHADHM CCc1ccccc1NC(=O)CCCCOc1cccc(-c2nn[n-]n2)c1 ZINC000736702836 598647038 /nfs/dbraw/zinc/64/70/38/598647038.db2.gz WSQOYNBTECHINT-UHFFFAOYSA-N -1 3 365.437 3.617 20 0 FHADHM Cc1sc(NC(=O)[C@@H](C)CSc2ccccc2)c(-c2nnn[n-]2)c1C ZINC000737563597 598647618 /nfs/dbraw/zinc/64/76/18/598647618.db2.gz QHRKKVVXIMINDB-JTQLQIEISA-N -1 3 373.507 3.912 20 0 FHADHM Cc1sc(NC(=O)[C@@H](C)CSc2ccccc2)c(-c2nn[n-]n2)c1C ZINC000737563597 598647619 /nfs/dbraw/zinc/64/76/19/598647619.db2.gz QHRKKVVXIMINDB-JTQLQIEISA-N -1 3 373.507 3.912 20 0 FHADHM CC(C)[C@@H](CC(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000735711168 598651668 /nfs/dbraw/zinc/65/16/68/598651668.db2.gz WHYXAKHIEFRKEU-LJQANCHMSA-N -1 3 363.465 3.655 20 0 FHADHM CC(C)[C@@H](CC(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000735711168 598651670 /nfs/dbraw/zinc/65/16/70/598651670.db2.gz WHYXAKHIEFRKEU-LJQANCHMSA-N -1 3 363.465 3.655 20 0 FHADHM COc1ccc(Cl)cc1CNc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000737100070 598653570 /nfs/dbraw/zinc/65/35/70/598653570.db2.gz RLTNPNOAVAKUHF-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM COc1ccc(Cl)cc1CNc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000737100070 598653571 /nfs/dbraw/zinc/65/35/71/598653571.db2.gz RLTNPNOAVAKUHF-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM Cc1cccnc1NC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737436426 598666622 /nfs/dbraw/zinc/66/66/22/598666622.db2.gz MLHNGSGPKGHFJV-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Clc1cc(NCc2ccc(Br)cc2)ccc1-c1nnn[n-]1 ZINC000737564984 598674305 /nfs/dbraw/zinc/67/43/05/598674305.db2.gz LSNWAPDJXXRGHB-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM Clc1cc(NCc2ccc(Br)cc2)ccc1-c1nn[n-]n1 ZINC000737564984 598674307 /nfs/dbraw/zinc/67/43/07/598674307.db2.gz LSNWAPDJXXRGHB-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM Cc1cc(C)c(COC(=O)CSc2ccc(-c3nnn[n-]3)cc2)c(C)c1 ZINC000737247023 598714226 /nfs/dbraw/zinc/71/42/26/598714226.db2.gz RPYKJBDJKNECQV-UHFFFAOYSA-N -1 3 368.462 3.627 20 0 FHADHM Cc1cc(C)c(COC(=O)CSc2ccc(-c3nn[n-]n3)cc2)c(C)c1 ZINC000737247023 598714228 /nfs/dbraw/zinc/71/42/28/598714228.db2.gz RPYKJBDJKNECQV-UHFFFAOYSA-N -1 3 368.462 3.627 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CCCC2(CCCCC2)C1 ZINC000737289955 598729457 /nfs/dbraw/zinc/72/94/57/598729457.db2.gz AKFQLLGMUVUMGN-UHFFFAOYSA-N -1 3 354.458 3.753 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CCCC2(CCCCC2)C1 ZINC000737289955 598729459 /nfs/dbraw/zinc/72/94/59/598729459.db2.gz AKFQLLGMUVUMGN-UHFFFAOYSA-N -1 3 354.458 3.753 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)C[C@H](CC)c1ccccc1 ZINC000736638273 598736307 /nfs/dbraw/zinc/73/63/07/598736307.db2.gz ZSAUMMYEBNARLV-AWEZNQCLSA-N -1 3 365.437 3.788 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)C[C@H](CC)c1ccccc1 ZINC000736638273 598736308 /nfs/dbraw/zinc/73/63/08/598736308.db2.gz ZSAUMMYEBNARLV-AWEZNQCLSA-N -1 3 365.437 3.788 20 0 FHADHM CCN(C(=O)[C@@H](C)Cc1ccccc1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736503605 598741749 /nfs/dbraw/zinc/74/17/49/598741749.db2.gz YRERQYZSUDCKBY-JKSUJKDBSA-N -1 3 363.465 3.655 20 0 FHADHM CCN(C(=O)[C@@H](C)Cc1ccccc1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736503605 598741750 /nfs/dbraw/zinc/74/17/50/598741750.db2.gz YRERQYZSUDCKBY-JKSUJKDBSA-N -1 3 363.465 3.655 20 0 FHADHM CCSc1ccc([C@H](C)NC(=O)c2sccc2-c2nnn[n-]2)cc1 ZINC000736666705 598745829 /nfs/dbraw/zinc/74/58/29/598745829.db2.gz MROYYBOAOJXTKR-JTQLQIEISA-N -1 3 359.480 3.531 20 0 FHADHM CCSc1ccc([C@H](C)NC(=O)c2sccc2-c2nn[n-]n2)cc1 ZINC000736666705 598745830 /nfs/dbraw/zinc/74/58/30/598745830.db2.gz MROYYBOAOJXTKR-JTQLQIEISA-N -1 3 359.480 3.531 20 0 FHADHM Cc1ccccc1[C@H](NC(=S)Nc1ccccc1-c1nnn[n-]1)C(C)C ZINC000737421105 598752209 /nfs/dbraw/zinc/75/22/09/598752209.db2.gz KDRYQFXICYYSSY-QGZVFWFLSA-N -1 3 366.494 3.859 20 0 FHADHM Cc1ccccc1[C@H](NC(=S)Nc1ccccc1-c1nn[n-]n1)C(C)C ZINC000737421105 598752210 /nfs/dbraw/zinc/75/22/10/598752210.db2.gz KDRYQFXICYYSSY-QGZVFWFLSA-N -1 3 366.494 3.859 20 0 FHADHM Cc1ccccc1[C@H](NC(=S)Nc1ccccc1-c1nnn[n-]1)C1CC1 ZINC000737422904 598762560 /nfs/dbraw/zinc/76/25/60/598762560.db2.gz PLHDQEWHUXQGQI-QGZVFWFLSA-N -1 3 364.478 3.613 20 0 FHADHM Cc1ccccc1[C@H](NC(=S)Nc1ccccc1-c1nn[n-]n1)C1CC1 ZINC000737422904 598762561 /nfs/dbraw/zinc/76/25/61/598762561.db2.gz PLHDQEWHUXQGQI-QGZVFWFLSA-N -1 3 364.478 3.613 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NC(=O)c1cccc(C(F)F)c1 ZINC000735907267 598790171 /nfs/dbraw/zinc/79/01/71/598790171.db2.gz ZURCGVKKWIXTJJ-UHFFFAOYSA-N -1 3 373.363 3.844 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cccc(C(F)F)c1 ZINC000735907267 598790173 /nfs/dbraw/zinc/79/01/73/598790173.db2.gz ZURCGVKKWIXTJJ-UHFFFAOYSA-N -1 3 373.363 3.844 20 0 FHADHM Fc1ccc(CN2CCC[C@@H]2c2ccc(F)c(F)c2)c(-c2nn[n-]n2)c1 ZINC000737647397 598797020 /nfs/dbraw/zinc/79/70/20/598797020.db2.gz CTVGLUMEFYLSNM-QGZVFWFLSA-N -1 3 359.355 3.621 20 0 FHADHM CC(C)[C@H](c1ccccc1)N(C)C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000735733953 598798046 /nfs/dbraw/zinc/79/80/46/598798046.db2.gz DGJVDNVZSQSNRB-QGZVFWFLSA-N -1 3 350.426 3.728 20 0 FHADHM CC(C)[C@H](c1ccccc1)N(C)C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000735733953 598798048 /nfs/dbraw/zinc/79/80/48/598798048.db2.gz DGJVDNVZSQSNRB-QGZVFWFLSA-N -1 3 350.426 3.728 20 0 FHADHM CC[C@@H](CC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)CC(C)C)C(C)C ZINC000736333063 598819894 /nfs/dbraw/zinc/81/98/94/598819894.db2.gz PMKUYEXZHXGGLL-KRWDZBQOSA-N -1 3 357.502 3.924 20 0 FHADHM CC[C@@H](CC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)CC(C)C)C(C)C ZINC000736333063 598819896 /nfs/dbraw/zinc/81/98/96/598819896.db2.gz PMKUYEXZHXGGLL-KRWDZBQOSA-N -1 3 357.502 3.924 20 0 FHADHM Cc1ccc(N(C)C(=O)C=Cc2ccccc2-c2nnn[n-]2)cc1Cl ZINC000737347351 598822596 /nfs/dbraw/zinc/82/25/96/598822596.db2.gz NUNFXSUCUGDLQX-CSKARUKUSA-N -1 3 353.813 3.505 20 0 FHADHM Cc1ccc(N(C)C(=O)C=Cc2ccccc2-c2nn[n-]n2)cc1Cl ZINC000737347351 598822597 /nfs/dbraw/zinc/82/25/97/598822597.db2.gz NUNFXSUCUGDLQX-CSKARUKUSA-N -1 3 353.813 3.505 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccccc1OC1CCC1 ZINC000738152419 599293122 /nfs/dbraw/zinc/29/31/22/599293122.db2.gz SIBVPUCEQYOIHS-UHFFFAOYSA-N -1 3 369.812 3.704 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccccc1OC1CCC1 ZINC000738152419 599293124 /nfs/dbraw/zinc/29/31/24/599293124.db2.gz SIBVPUCEQYOIHS-UHFFFAOYSA-N -1 3 369.812 3.704 20 0 FHADHM C[C@H](c1ccc(-c2nnn[n-]2)cc1)N1CCc2[nH]c3ccc(F)cc3c2C1 ZINC000736202001 599316727 /nfs/dbraw/zinc/31/67/27/599316727.db2.gz YWQNOXYZONLWLJ-GFCCVEGCSA-N -1 3 362.412 3.606 20 0 FHADHM C[C@H](c1ccc(-c2nn[n-]n2)cc1)N1CCc2[nH]c3ccc(F)cc3c2C1 ZINC000736202001 599316730 /nfs/dbraw/zinc/31/67/30/599316730.db2.gz YWQNOXYZONLWLJ-GFCCVEGCSA-N -1 3 362.412 3.606 20 0 FHADHM Cc1csc(=Nc2ccccc2-c2nnn[n-]2)n1CCCC(F)(F)F ZINC000822408625 599324056 /nfs/dbraw/zinc/32/40/56/599324056.db2.gz GDMSZIQIOQXURO-UHFFFAOYSA-N -1 3 368.388 3.613 20 0 FHADHM Cc1csc(=Nc2ccccc2-c2nn[n-]n2)n1CCCC(F)(F)F ZINC000822408625 599324058 /nfs/dbraw/zinc/32/40/58/599324058.db2.gz GDMSZIQIOQXURO-UHFFFAOYSA-N -1 3 368.388 3.613 20 0 FHADHM C[C@H](SCc1nc(-c2ccccc2)no1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736194278 599326981 /nfs/dbraw/zinc/32/69/81/599326981.db2.gz YYQWSQNOVGJMIF-LBPRGKRZSA-N -1 3 364.434 3.911 20 0 FHADHM C[C@H](SCc1nc(-c2ccccc2)no1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736194278 599326983 /nfs/dbraw/zinc/32/69/83/599326983.db2.gz YYQWSQNOVGJMIF-LBPRGKRZSA-N -1 3 364.434 3.911 20 0 FHADHM Cc1cc(C)cc(NC(=O)CS[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737250843 599329750 /nfs/dbraw/zinc/32/97/50/599329750.db2.gz PRPVNJJGAOCUMW-AWEZNQCLSA-N -1 3 367.478 3.916 20 0 FHADHM Cc1cc(C)cc(NC(=O)CS[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737250843 599329753 /nfs/dbraw/zinc/32/97/53/599329753.db2.gz PRPVNJJGAOCUMW-AWEZNQCLSA-N -1 3 367.478 3.916 20 0 FHADHM Cc1ccc(NC(=O)CS[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000737357977 599332528 /nfs/dbraw/zinc/33/25/28/599332528.db2.gz VQBNFXLIQRCQDB-CYBMUJFWSA-N -1 3 353.451 3.608 20 0 FHADHM Cc1ccc(NC(=O)CS[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000737357977 599332531 /nfs/dbraw/zinc/33/25/31/599332531.db2.gz VQBNFXLIQRCQDB-CYBMUJFWSA-N -1 3 353.451 3.608 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1CNc1ccc(SC(F)F)cc1 ZINC000821737312 607369631 /nfs/dbraw/zinc/36/96/31/607369631.db2.gz USUWNKBDYMENHK-UHFFFAOYSA-N -1 3 363.393 3.802 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CNc1ccc(SC(F)F)cc1 ZINC000821737312 607369632 /nfs/dbraw/zinc/36/96/32/607369632.db2.gz USUWNKBDYMENHK-UHFFFAOYSA-N -1 3 363.393 3.802 20 0 FHADHM Cc1ccc(Cl)cc1NC(=O)CSc1ccccc1-c1nnn[n-]1 ZINC000822239688 599345449 /nfs/dbraw/zinc/34/54/49/599345449.db2.gz ABIKEIATQCVWOL-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1ccc(Cl)cc1NC(=O)CSc1ccccc1-c1nn[n-]n1 ZINC000822239688 599345450 /nfs/dbraw/zinc/34/54/50/599345450.db2.gz ABIKEIATQCVWOL-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM CC(C)[C@H](Sc1ccccc1-c1nnn[n-]1)C(=O)N[C@H]1CCCC[C@H]1C ZINC000820033589 599348832 /nfs/dbraw/zinc/34/88/32/599348832.db2.gz XJHUDMJSFDVJMM-KMFMINBZSA-N -1 3 373.526 3.678 20 0 FHADHM CC(C)[C@H](Sc1ccccc1-c1nn[n-]n1)C(=O)N[C@H]1CCCC[C@H]1C ZINC000820033589 599348837 /nfs/dbraw/zinc/34/88/37/599348837.db2.gz XJHUDMJSFDVJMM-KMFMINBZSA-N -1 3 373.526 3.678 20 0 FHADHM C[C@@H](Nc1cccc(N2CCCCC2=O)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820461496 599367457 /nfs/dbraw/zinc/36/74/57/599367457.db2.gz KZIKJSSUOUOVNU-CQSZACIVSA-N -1 3 362.437 3.557 20 0 FHADHM C[C@@H](Nc1cccc(N2CCCCC2=O)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820461496 599367460 /nfs/dbraw/zinc/36/74/60/599367460.db2.gz KZIKJSSUOUOVNU-CQSZACIVSA-N -1 3 362.437 3.557 20 0 FHADHM Cc1cccc(CSc2nc(-c3ccccc3)ccc2-c2nnn[n-]2)n1 ZINC000737395908 599370858 /nfs/dbraw/zinc/37/08/58/599370858.db2.gz BVRWWWLYUXVIBP-UHFFFAOYSA-N -1 3 360.446 3.924 20 0 FHADHM Cc1cccc(CSc2nc(-c3ccccc3)ccc2-c2nn[n-]n2)n1 ZINC000737395908 599370861 /nfs/dbraw/zinc/37/08/61/599370861.db2.gz BVRWWWLYUXVIBP-UHFFFAOYSA-N -1 3 360.446 3.924 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NC(=O)c1cc2occc2s1 ZINC000735905876 599371855 /nfs/dbraw/zinc/37/18/55/599371855.db2.gz NIPQWPMYHFBVHC-UHFFFAOYSA-N -1 3 369.406 3.714 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cc2occc2s1 ZINC000735905876 599371857 /nfs/dbraw/zinc/37/18/57/599371857.db2.gz NIPQWPMYHFBVHC-UHFFFAOYSA-N -1 3 369.406 3.714 20 0 FHADHM C[C@H](N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ncc(-c2ccccc2)o1 ZINC000820410071 599389492 /nfs/dbraw/zinc/38/94/92/599389492.db2.gz CQBBJUCARLFYCY-KBPBESRZSA-N -1 3 360.421 3.934 20 0 FHADHM C[C@@H](NCc1csc(-c2ccccc2)n1)c1cccc(-c2nn[n-]n2)c1 ZINC000820438738 599393500 /nfs/dbraw/zinc/39/35/00/599393500.db2.gz VZCCLDXQMUQYNT-CYBMUJFWSA-N -1 3 362.462 3.841 20 0 FHADHM Clc1ccc([C@@H](NCc2ccc(-c3nnn[n-]3)o2)c2ccccc2)cc1 ZINC000822573928 599395462 /nfs/dbraw/zinc/39/54/62/599395462.db2.gz KYQKQBUILFKSOE-SFHVURJKSA-N -1 3 365.824 3.992 20 0 FHADHM Clc1ccc([C@@H](NCc2ccc(-c3nn[n-]n3)o2)c2ccccc2)cc1 ZINC000822573928 599395465 /nfs/dbraw/zinc/39/54/65/599395465.db2.gz KYQKQBUILFKSOE-SFHVURJKSA-N -1 3 365.824 3.992 20 0 FHADHM COc1ccc(Cl)cc1CNc1cc(Cl)ccc1-c1nnn[n-]1 ZINC000737098845 599411664 /nfs/dbraw/zinc/41/16/64/599411664.db2.gz GIFBQXCYODKSEJ-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM COc1ccc(Cl)cc1CNc1cc(Cl)ccc1-c1nn[n-]n1 ZINC000737098845 599411667 /nfs/dbraw/zinc/41/16/67/599411667.db2.gz GIFBQXCYODKSEJ-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM CCCCOc1ncccc1CNc1cc(Cl)ccc1-c1nnn[n-]1 ZINC000736463011 599419015 /nfs/dbraw/zinc/41/90/15/599419015.db2.gz LFDJNXKCJHZMND-UHFFFAOYSA-N -1 3 358.833 3.706 20 0 FHADHM CCCCOc1ncccc1CNc1cc(Cl)ccc1-c1nn[n-]n1 ZINC000736463011 599419016 /nfs/dbraw/zinc/41/90/16/599419016.db2.gz LFDJNXKCJHZMND-UHFFFAOYSA-N -1 3 358.833 3.706 20 0 FHADHM c1ccc2nc(CCNc3cc(-c4nnn[n-]4)c4ccccc4n3)ccc2c1 ZINC000738442485 599421957 /nfs/dbraw/zinc/42/19/57/599421957.db2.gz OVVHNRKLYKOAEH-UHFFFAOYSA-N -1 3 367.416 3.618 20 0 FHADHM c1ccc2nc(CCNc3cc(-c4nn[n-]n4)c4ccccc4n3)ccc2c1 ZINC000738442485 599421959 /nfs/dbraw/zinc/42/19/59/599421959.db2.gz OVVHNRKLYKOAEH-UHFFFAOYSA-N -1 3 367.416 3.618 20 0 FHADHM CCc1cccc2c1OCC[C@H]2Nc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000736694981 599424932 /nfs/dbraw/zinc/42/49/32/599424932.db2.gz FTJBSHBNKGHFHC-GOSISDBHSA-N -1 3 372.432 3.913 20 0 FHADHM CCc1cccc2c1OCC[C@H]2Nc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000736694981 599424933 /nfs/dbraw/zinc/42/49/33/599424933.db2.gz FTJBSHBNKGHFHC-GOSISDBHSA-N -1 3 372.432 3.913 20 0 FHADHM Cc1ccccc1[C@@H]1CCN(c2cc(-c3nnn[n-]3)c3ccccc3n2)C1 ZINC000737422987 599425178 /nfs/dbraw/zinc/42/51/78/599425178.db2.gz OZVMWMCREAZSGT-OAHLLOKOSA-N -1 3 356.433 3.717 20 0 FHADHM Cc1ccccc1[C@@H]1CCN(c2cc(-c3nn[n-]n3)c3ccccc3n2)C1 ZINC000737422987 599425180 /nfs/dbraw/zinc/42/51/80/599425180.db2.gz OZVMWMCREAZSGT-OAHLLOKOSA-N -1 3 356.433 3.717 20 0 FHADHM CCCC[C@@H]1CCC[C@@H]1NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821043629 599434240 /nfs/dbraw/zinc/43/42/40/599434240.db2.gz QVYXKRYKJHGPHF-VBQJREDUSA-N -1 3 356.474 3.586 20 0 FHADHM CCCC[C@@H]1CCC[C@@H]1NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821043629 599434243 /nfs/dbraw/zinc/43/42/43/599434243.db2.gz QVYXKRYKJHGPHF-VBQJREDUSA-N -1 3 356.474 3.586 20 0 FHADHM Fc1cccc(Oc2ccccc2CNCc2ccc(-c3nnn[n-]3)o2)c1 ZINC000822791240 599435509 /nfs/dbraw/zinc/43/55/09/599435509.db2.gz GAULXZJMQDRTTP-UHFFFAOYSA-N -1 3 365.368 3.681 20 0 FHADHM Fc1cccc(Oc2ccccc2CNCc2ccc(-c3nn[n-]n3)o2)c1 ZINC000822791240 599435510 /nfs/dbraw/zinc/43/55/10/599435510.db2.gz GAULXZJMQDRTTP-UHFFFAOYSA-N -1 3 365.368 3.681 20 0 FHADHM CO[C@H](c1ccc(Cl)cc1)[C@H](C)Nc1cccc(F)c1-c1nnn[n-]1 ZINC000736962447 599443066 /nfs/dbraw/zinc/44/30/66/599443066.db2.gz OUAJDNAAXCRGJO-QFYYESIMSA-N -1 3 361.808 3.847 20 0 FHADHM CO[C@H](c1ccc(Cl)cc1)[C@H](C)Nc1cccc(F)c1-c1nn[n-]n1 ZINC000736962447 599443068 /nfs/dbraw/zinc/44/30/68/599443068.db2.gz OUAJDNAAXCRGJO-QFYYESIMSA-N -1 3 361.808 3.847 20 0 FHADHM CCCCc1noc([C@@H](C)SCc2ccc(F)cc2-c2nnn[n-]2)n1 ZINC000736466527 599451124 /nfs/dbraw/zinc/45/11/24/599451124.db2.gz MGDRJMJIGYDQHN-SNVBAGLBSA-N -1 3 362.434 3.726 20 0 FHADHM CCCCc1noc([C@@H](C)SCc2ccc(F)cc2-c2nn[n-]n2)n1 ZINC000736466527 599451127 /nfs/dbraw/zinc/45/11/27/599451127.db2.gz MGDRJMJIGYDQHN-SNVBAGLBSA-N -1 3 362.434 3.726 20 0 FHADHM FC(F)(F)c1cccc(C2(NCc3ccc(-c4nnn[n-]4)o3)CCC2)c1 ZINC000822729203 599455185 /nfs/dbraw/zinc/45/51/85/599455185.db2.gz VVBQPBCLSKTZCW-UHFFFAOYSA-N -1 3 363.343 3.648 20 0 FHADHM CC[C@H](C)C[C@H](C)NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)CC(C)C ZINC000820870782 599458813 /nfs/dbraw/zinc/45/88/13/599458813.db2.gz ZHXXLXKLJBMKSY-HOTGVXAUSA-N -1 3 372.517 3.859 20 0 FHADHM CC[C@H](C)C[C@H](C)NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)CC(C)C ZINC000820870782 599458815 /nfs/dbraw/zinc/45/88/15/599458815.db2.gz ZHXXLXKLJBMKSY-HOTGVXAUSA-N -1 3 372.517 3.859 20 0 FHADHM Cc1ccc2sc(C=Cc3cnc4ccc(-c5nnn[n-]5)cn34)nc2c1 ZINC000737378443 599461239 /nfs/dbraw/zinc/46/12/39/599461239.db2.gz BSGHICUFKBHQEN-DAXSKMNVSA-N -1 3 359.418 3.603 20 0 FHADHM Cc1ccc2sc(C=Cc3cnc4ccc(-c5nn[n-]n5)cn34)nc2c1 ZINC000737378443 599461240 /nfs/dbraw/zinc/46/12/40/599461240.db2.gz BSGHICUFKBHQEN-DAXSKMNVSA-N -1 3 359.418 3.603 20 0 FHADHM C[C@@H](NC(=O)C(C)(C)c1cccc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736094916 599464837 /nfs/dbraw/zinc/46/48/37/599464837.db2.gz AXQCWNCERSTLAB-GFCCVEGCSA-N -1 3 369.856 3.675 20 0 FHADHM C[C@@H](NC(=O)C(C)(C)c1cccc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736094916 599464840 /nfs/dbraw/zinc/46/48/40/599464840.db2.gz AXQCWNCERSTLAB-GFCCVEGCSA-N -1 3 369.856 3.675 20 0 FHADHM CC(C)C(=O)Nc1ccc(CNc2c(Cl)cccc2-c2nnn[n-]2)cc1 ZINC000820010731 599466743 /nfs/dbraw/zinc/46/67/43/599466743.db2.gz CYSDVUJCIUUNTE-UHFFFAOYSA-N -1 3 370.844 3.727 20 0 FHADHM CC(C)C(=O)Nc1ccc(CNc2c(Cl)cccc2-c2nn[n-]n2)cc1 ZINC000820010731 599466744 /nfs/dbraw/zinc/46/67/44/599466744.db2.gz CYSDVUJCIUUNTE-UHFFFAOYSA-N -1 3 370.844 3.727 20 0 FHADHM C[C@@H](Cc1ccc(Cl)cc1)N(C)c1ncc(-c2nnn[n-]2)cc1Cl ZINC000736055532 599472642 /nfs/dbraw/zinc/47/26/42/599472642.db2.gz GKMPIMDJTKTHGH-JTQLQIEISA-N -1 3 363.252 3.636 20 0 FHADHM C[C@@H](Cc1ccc(Cl)cc1)N(C)c1ncc(-c2nn[n-]n2)cc1Cl ZINC000736055532 599472645 /nfs/dbraw/zinc/47/26/45/599472645.db2.gz GKMPIMDJTKTHGH-JTQLQIEISA-N -1 3 363.252 3.636 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N[C@@H](Cc2ccccc2)C2CC2)n1 ZINC000737631555 599473188 /nfs/dbraw/zinc/47/31/88/599473188.db2.gz GMBZHYQPCYLJHD-AWEZNQCLSA-N -1 3 374.370 3.714 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N[C@@H](Cc2ccccc2)C2CC2)n1 ZINC000737631555 599473191 /nfs/dbraw/zinc/47/31/91/599473191.db2.gz GMBZHYQPCYLJHD-AWEZNQCLSA-N -1 3 374.370 3.714 20 0 FHADHM Fc1ccc(C[C@H]2CCN(c3ccc(-c4nnn[n-]4)c(Cl)c3)C2)cc1 ZINC000737647016 599473298 /nfs/dbraw/zinc/47/32/98/599473298.db2.gz CBYTYKKGYNHXNX-CYBMUJFWSA-N -1 3 357.820 3.728 20 0 FHADHM Fc1ccc(C[C@H]2CCN(c3ccc(-c4nn[n-]n4)c(Cl)c3)C2)cc1 ZINC000737647016 599473301 /nfs/dbraw/zinc/47/33/01/599473301.db2.gz CBYTYKKGYNHXNX-CYBMUJFWSA-N -1 3 357.820 3.728 20 0 FHADHM CCO[C@@H](C)c1nc(CSCc2ccc(-c3nnn[n-]3)cc2)cs1 ZINC000736616666 599481041 /nfs/dbraw/zinc/48/10/41/599481041.db2.gz OTMIJNOQYIPPCA-NSHDSACASA-N -1 3 361.496 3.854 20 0 FHADHM CCO[C@@H](C)c1nc(CSCc2ccc(-c3nn[n-]n3)cc2)cs1 ZINC000736616666 599481043 /nfs/dbraw/zinc/48/10/43/599481043.db2.gz OTMIJNOQYIPPCA-NSHDSACASA-N -1 3 361.496 3.854 20 0 FHADHM C[C@@H](C[C@H](O)c1ccc(F)cc1)Nc1c(Cl)cccc1-c1nnn[n-]1 ZINC000820231579 607381363 /nfs/dbraw/zinc/38/13/63/607381363.db2.gz BSIIOYXXDNBXMM-BONVTDFDSA-N -1 3 361.808 3.583 20 0 FHADHM C[C@@H](C[C@H](O)c1ccc(F)cc1)Nc1c(Cl)cccc1-c1nn[n-]n1 ZINC000820231579 607381365 /nfs/dbraw/zinc/38/13/65/607381365.db2.gz BSIIOYXXDNBXMM-BONVTDFDSA-N -1 3 361.808 3.583 20 0 FHADHM C[C@H](NC(=O)c1cc(Cl)sc1Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000820391842 599504053 /nfs/dbraw/zinc/50/40/53/599504053.db2.gz RQLHVGBNRJPZEE-ZETCQYMHSA-N -1 3 368.249 3.726 20 0 FHADHM C[C@H](NC(=O)c1cc(Cl)sc1Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000820391842 599504054 /nfs/dbraw/zinc/50/40/54/599504054.db2.gz RQLHVGBNRJPZEE-ZETCQYMHSA-N -1 3 368.249 3.726 20 0 FHADHM CN(C[C@H]1CCCO[C@H]1c1ccccc1)c1ccc(F)cc1-c1nnn[n-]1 ZINC000821596804 599507992 /nfs/dbraw/zinc/50/79/92/599507992.db2.gz VRKVLYHBIOAXPY-BEFAXECRSA-N -1 3 367.428 3.610 20 0 FHADHM CN(C[C@H]1CCCO[C@H]1c1ccccc1)c1ccc(F)cc1-c1nn[n-]n1 ZINC000821596804 599507995 /nfs/dbraw/zinc/50/79/95/599507995.db2.gz VRKVLYHBIOAXPY-BEFAXECRSA-N -1 3 367.428 3.610 20 0 FHADHM CC(C)[C@@H](CC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000820323787 599508769 /nfs/dbraw/zinc/50/87/69/599508769.db2.gz ZBOZAYGOBYUCTH-DNVCBOLYSA-N -1 3 363.465 3.874 20 0 FHADHM CC(C)[C@@H](CC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000820323787 599508771 /nfs/dbraw/zinc/50/87/71/599508771.db2.gz ZBOZAYGOBYUCTH-DNVCBOLYSA-N -1 3 363.465 3.874 20 0 FHADHM Cc1csc([C@@H]2CCCN(c3ccc(Cl)cc3-c3nnn[n-]3)C2)n1 ZINC000822408921 599509319 /nfs/dbraw/zinc/50/93/19/599509319.db2.gz ISQHFZQVJOFJQT-LLVKDONJSA-N -1 3 360.874 3.669 20 0 FHADHM Cc1csc([C@@H]2CCCN(c3ccc(Cl)cc3-c3nn[n-]n3)C2)n1 ZINC000822408921 599509321 /nfs/dbraw/zinc/50/93/21/599509321.db2.gz ISQHFZQVJOFJQT-LLVKDONJSA-N -1 3 360.874 3.669 20 0 FHADHM Cc1ccc(CCCCC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000822236402 599524909 /nfs/dbraw/zinc/52/49/09/599524909.db2.gz XXHSUYMRZSJUDJ-INIZCTEOSA-N -1 3 363.465 3.765 20 0 FHADHM Cc1ccc(CCCCC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000822236402 599524911 /nfs/dbraw/zinc/52/49/11/599524911.db2.gz XXHSUYMRZSJUDJ-INIZCTEOSA-N -1 3 363.465 3.765 20 0 FHADHM CS[C@@H]1CCC[C@@H](Nc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)C1 ZINC000737180956 599526884 /nfs/dbraw/zinc/52/68/84/599526884.db2.gz URCPSSBPNUZVOO-GHMZBOCLSA-N -1 3 357.405 3.972 20 0 FHADHM CC(C)c1ccc([C@@H](C)CC(=O)NCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000735925175 599541217 /nfs/dbraw/zinc/54/12/17/599541217.db2.gz YQFBQNMNWYHJDW-HNNXBMFYSA-N -1 3 363.465 3.800 20 0 FHADHM CC(C)c1ccc([C@@H](C)CC(=O)NCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000735925175 599541219 /nfs/dbraw/zinc/54/12/19/599541219.db2.gz YQFBQNMNWYHJDW-HNNXBMFYSA-N -1 3 363.465 3.800 20 0 FHADHM CCc1ccc([C@@H](C)CC(=O)N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000736684625 599541977 /nfs/dbraw/zinc/54/19/77/599541977.db2.gz BHLHVZOZODHXJE-GJZGRUSLSA-N -1 3 363.465 3.800 20 0 FHADHM CCc1ccc([C@@H](C)CC(=O)N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000736684625 599541980 /nfs/dbraw/zinc/54/19/80/599541980.db2.gz BHLHVZOZODHXJE-GJZGRUSLSA-N -1 3 363.465 3.800 20 0 FHADHM O=C(CC/C=C\c1ccccc1)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000737823894 599543059 /nfs/dbraw/zinc/54/30/59/599543059.db2.gz CSFOEHISJDSUKA-YWEYNIOJSA-N -1 3 353.813 3.952 20 0 FHADHM O=C(CC/C=C\c1ccccc1)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000737823894 599543061 /nfs/dbraw/zinc/54/30/61/599543061.db2.gz CSFOEHISJDSUKA-YWEYNIOJSA-N -1 3 353.813 3.952 20 0 FHADHM c1ccc(C[C@H]2CCCN(c3c(-c4nnn[n-]4)cnc4ccccc43)C2)cc1 ZINC000823779525 599543478 /nfs/dbraw/zinc/54/34/78/599543478.db2.gz FPDRESKQGNQDHD-QGZVFWFLSA-N -1 3 370.460 3.874 20 0 FHADHM c1ccc(C[C@H]2CCCN(c3c(-c4nn[n-]n4)cnc4ccccc43)C2)cc1 ZINC000823779525 599543481 /nfs/dbraw/zinc/54/34/81/599543481.db2.gz FPDRESKQGNQDHD-QGZVFWFLSA-N -1 3 370.460 3.874 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)CC/C=C/c2ccccc2)s1 ZINC000736678218 599543955 /nfs/dbraw/zinc/54/39/55/599543955.db2.gz ARTVTBGOIRYELE-UXBLZVDNSA-N -1 3 353.451 3.923 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)CC/C=C/c2ccccc2)s1 ZINC000736678218 599543957 /nfs/dbraw/zinc/54/39/57/599543957.db2.gz ARTVTBGOIRYELE-UXBLZVDNSA-N -1 3 353.451 3.923 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)N(Cc1ccoc1)C1CCCCC1 ZINC000823358790 599551489 /nfs/dbraw/zinc/55/14/89/599551489.db2.gz FMPWWZDILDQXOH-UHFFFAOYSA-N -1 3 366.425 3.827 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)N(Cc1ccoc1)C1CCCCC1 ZINC000823358790 599551491 /nfs/dbraw/zinc/55/14/91/599551491.db2.gz FMPWWZDILDQXOH-UHFFFAOYSA-N -1 3 366.425 3.827 20 0 FHADHM C[C@@H]1C[C@H](c2ccccc2)CN1c1c(-c2nnn[n-]2)cnc2ccccc21 ZINC000820668297 599559135 /nfs/dbraw/zinc/55/91/35/599559135.db2.gz RHUICMHRPLBMMV-ZBFHGGJFSA-N -1 3 356.433 3.797 20 0 FHADHM C[C@@H]1C[C@H](c2ccccc2)CN1c1c(-c2nn[n-]n2)cnc2ccccc21 ZINC000820668297 599559138 /nfs/dbraw/zinc/55/91/38/599559138.db2.gz RHUICMHRPLBMMV-ZBFHGGJFSA-N -1 3 356.433 3.797 20 0 FHADHM Cc1ccc([C@@H]2CCCCCN2C(=O)c2sccc2-c2nnn[n-]2)o1 ZINC000737330415 599561303 /nfs/dbraw/zinc/56/13/03/599561303.db2.gz NLSKSKKPJXGXKE-ZDUSSCGKSA-N -1 3 357.439 3.587 20 0 FHADHM Cc1ccc([C@@H]2CCCCCN2C(=O)c2sccc2-c2nn[n-]n2)o1 ZINC000737330415 599561306 /nfs/dbraw/zinc/56/13/06/599561306.db2.gz NLSKSKKPJXGXKE-ZDUSSCGKSA-N -1 3 357.439 3.587 20 0 FHADHM CCN(C(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1)C1CCC1 ZINC000736508447 599571694 /nfs/dbraw/zinc/57/16/94/599571694.db2.gz LTWWMUOQUVPGES-UHFFFAOYSA-N -1 3 362.437 3.625 20 0 FHADHM Cc1cc(NCc2ccccc2-c2nnn[n-]2)ccc1OCC(F)(F)F ZINC000737280057 599582327 /nfs/dbraw/zinc/58/23/27/599582327.db2.gz JZHYEKNXSPAJFE-UHFFFAOYSA-N -1 3 363.343 3.728 20 0 FHADHM Cc1cc(NCc2ccccc2-c2nn[n-]n2)ccc1OCC(F)(F)F ZINC000737280057 599582329 /nfs/dbraw/zinc/58/23/29/599582329.db2.gz JZHYEKNXSPAJFE-UHFFFAOYSA-N -1 3 363.343 3.728 20 0 FHADHM Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)Nc2ccc(-c3nnn[n-]3)cc2)C1 ZINC000737424887 599599640 /nfs/dbraw/zinc/59/96/40/599599640.db2.gz YVNPRQITHXIGOP-GDBMZVCRSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)Nc2ccc(-c3nn[n-]n3)cc2)C1 ZINC000737424887 599599641 /nfs/dbraw/zinc/59/96/41/599599641.db2.gz YVNPRQITHXIGOP-GDBMZVCRSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1ccc([C@H](C)CNC(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1 ZINC000737319960 599609174 /nfs/dbraw/zinc/60/91/74/599609174.db2.gz HVSUQKIWKWXYTQ-GFCCVEGCSA-N -1 3 370.844 3.754 20 0 FHADHM Cc1ccc([C@H](C)CNC(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1 ZINC000737319960 599609176 /nfs/dbraw/zinc/60/91/76/599609176.db2.gz HVSUQKIWKWXYTQ-GFCCVEGCSA-N -1 3 370.844 3.754 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CCCC[C@@H]1[C@@H](C)CC ZINC000736633873 599610334 /nfs/dbraw/zinc/61/03/34/599610334.db2.gz FVGGJSCRDZALDF-XJKSGUPXSA-N -1 3 372.473 3.698 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CCCC[C@@H]1[C@@H](C)CC ZINC000736633873 599610336 /nfs/dbraw/zinc/61/03/36/599610336.db2.gz FVGGJSCRDZALDF-XJKSGUPXSA-N -1 3 372.473 3.698 20 0 FHADHM Cc1nc(-c2cccc(C(=O)Oc3ccc(-c4nn[n-]n4)cc3)c2)cs1 ZINC000822419216 599620685 /nfs/dbraw/zinc/62/06/85/599620685.db2.gz NJBRXFBBGUUDIS-UHFFFAOYSA-N -1 3 363.402 3.518 20 0 FHADHM Cc1sc(NC(=O)[C@@H](c2ccccc2)C(C)C)c(-c2nnn[n-]2)c1C ZINC000822557930 599628779 /nfs/dbraw/zinc/62/87/79/599628779.db2.gz KUSJWDUDTDCISA-CQSZACIVSA-N -1 3 355.467 3.923 20 0 FHADHM Cc1sc(NC(=O)[C@@H](c2ccccc2)C(C)C)c(-c2nn[n-]n2)c1C ZINC000822557930 599628780 /nfs/dbraw/zinc/62/87/80/599628780.db2.gz KUSJWDUDTDCISA-CQSZACIVSA-N -1 3 355.467 3.923 20 0 FHADHM CC(C)[C@@H](C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1)c1ccccc1 ZINC000820015148 599629335 /nfs/dbraw/zinc/62/93/35/599629335.db2.gz ATMMMTKMAFMDDZ-MRXNPFEDSA-N -1 3 355.829 3.898 20 0 FHADHM CC(C)[C@@H](C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1)c1ccccc1 ZINC000820015148 599629336 /nfs/dbraw/zinc/62/93/36/599629336.db2.gz ATMMMTKMAFMDDZ-MRXNPFEDSA-N -1 3 355.829 3.898 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@@H](C)CCc2ccccc2F)s1 ZINC000821465055 599630451 /nfs/dbraw/zinc/63/04/51/599630451.db2.gz AKZJXLZPEVTNNI-NSHDSACASA-N -1 3 373.457 3.837 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@@H](C)CCc2ccccc2F)s1 ZINC000821465055 599630452 /nfs/dbraw/zinc/63/04/52/599630452.db2.gz AKZJXLZPEVTNNI-NSHDSACASA-N -1 3 373.457 3.837 20 0 FHADHM Cc1cc(C)cc(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)c1 ZINC000822196230 599633856 /nfs/dbraw/zinc/63/38/56/599633856.db2.gz AQKGGQIQUIRGGV-UHFFFAOYSA-N -1 3 361.327 3.755 20 0 FHADHM Cc1cc(C)cc(C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)c1 ZINC000822196230 599633857 /nfs/dbraw/zinc/63/38/57/599633857.db2.gz AQKGGQIQUIRGGV-UHFFFAOYSA-N -1 3 361.327 3.755 20 0 FHADHM Cc1c2c(sc1NC(=O)C=Cc1ccccc1-c1nnn[n-]1)CCCC2 ZINC000822067265 599651206 /nfs/dbraw/zinc/65/12/06/599651206.db2.gz IWNKIHIVUDHFNI-ZHACJKMWSA-N -1 3 365.462 3.767 20 0 FHADHM Cc1c2c(sc1NC(=O)C=Cc1ccccc1-c1nn[n-]n1)CCCC2 ZINC000822067265 599651207 /nfs/dbraw/zinc/65/12/07/599651207.db2.gz IWNKIHIVUDHFNI-ZHACJKMWSA-N -1 3 365.462 3.767 20 0 FHADHM CC(C)C[C@@H]1CCN(C(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)C1 ZINC000820067190 599663549 /nfs/dbraw/zinc/66/35/49/599663549.db2.gz FRPFOXCXJDSQNE-NSHDSACASA-N -1 3 364.906 3.585 20 0 FHADHM CC(C)C[C@@H]1CCN(C(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)C1 ZINC000820067190 599663550 /nfs/dbraw/zinc/66/35/50/599663550.db2.gz FRPFOXCXJDSQNE-NSHDSACASA-N -1 3 364.906 3.585 20 0 FHADHM C[C@H](C(=O)OCc1ccc(-c2nnn[n-]2)cc1F)c1cccc(Cl)c1 ZINC000819884758 599665195 /nfs/dbraw/zinc/66/51/95/599665195.db2.gz ZCVNQSBJNLQHGL-JTQLQIEISA-N -1 3 360.776 3.506 20 0 FHADHM C[C@H](C(=O)OCc1ccc(-c2nn[n-]n2)cc1F)c1cccc(Cl)c1 ZINC000819884758 599665196 /nfs/dbraw/zinc/66/51/96/599665196.db2.gz ZCVNQSBJNLQHGL-JTQLQIEISA-N -1 3 360.776 3.506 20 0 FHADHM C[C@H](NC(=O)N[C@H]1CCCC[C@@H]1C(C)(C)C)c1cccc(-c2nnn[n-]2)c1 ZINC000820357334 599668149 /nfs/dbraw/zinc/66/81/49/599668149.db2.gz GKRLXARXAZBYRT-JQFCIGGWSA-N -1 3 370.501 3.832 20 0 FHADHM C[C@H](NC(=O)N[C@H]1CCCC[C@@H]1C(C)(C)C)c1cccc(-c2nn[n-]n2)c1 ZINC000820357334 599668150 /nfs/dbraw/zinc/66/81/50/599668150.db2.gz GKRLXARXAZBYRT-JQFCIGGWSA-N -1 3 370.501 3.832 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@H](C)C1CCCCC1 ZINC000820339427 599675510 /nfs/dbraw/zinc/67/55/10/599675510.db2.gz BYQSKDWGSWQBDZ-OAHLLOKOSA-N -1 3 370.501 3.756 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@H](C)C1CCCCC1 ZINC000820339427 599675511 /nfs/dbraw/zinc/67/55/11/599675511.db2.gz BYQSKDWGSWQBDZ-OAHLLOKOSA-N -1 3 370.501 3.756 20 0 FHADHM CC1(C)CCC(NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)CC1 ZINC000820589417 599675529 /nfs/dbraw/zinc/67/55/29/599675529.db2.gz FBVJZGIXGWDQRG-UHFFFAOYSA-N -1 3 368.485 3.510 20 0 FHADHM CC1(C)CCC(NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)CC1 ZINC000820589417 599675530 /nfs/dbraw/zinc/67/55/30/599675530.db2.gz FBVJZGIXGWDQRG-UHFFFAOYSA-N -1 3 368.485 3.510 20 0 FHADHM CCOc1ccccc1[C@H](CC(C)C)NCc1ccc(-c2nnn[n-]2)o1 ZINC000821430690 599695322 /nfs/dbraw/zinc/69/53/22/599695322.db2.gz DHEGZDSOUSPRLF-INIZCTEOSA-N -1 3 355.442 3.735 20 0 FHADHM CCOc1ccccc1[C@H](CC(C)C)NCc1ccc(-c2nn[n-]n2)o1 ZINC000821430690 599695323 /nfs/dbraw/zinc/69/53/23/599695323.db2.gz DHEGZDSOUSPRLF-INIZCTEOSA-N -1 3 355.442 3.735 20 0 FHADHM C[C@@H](C(=O)Oc1ccc(-c2ccc(-c3nnn[n-]3)cc2)cc1)c1cccnc1 ZINC000819883769 599695749 /nfs/dbraw/zinc/69/57/49/599695749.db2.gz MSJBMIZDFIOAGT-CQSZACIVSA-N -1 3 371.400 3.638 20 0 FHADHM C[C@@H](C(=O)Oc1ccc(-c2ccc(-c3nn[n-]n3)cc2)cc1)c1cccnc1 ZINC000819883769 599695750 /nfs/dbraw/zinc/69/57/50/599695750.db2.gz MSJBMIZDFIOAGT-CQSZACIVSA-N -1 3 371.400 3.638 20 0 FHADHM Cc1ccc(C(=O)[O-])cc1NC(=O)[C@@H](C)N1CC[C@H](c2ccccc2C)C1 ZINC000738518625 599717005 /nfs/dbraw/zinc/71/70/05/599717005.db2.gz MCDLMAWICUHUGV-AEFFLSMTSA-N -1 3 366.461 3.818 20 0 FHADHM CC(C)Oc1ccc(NC(=O)c2cc3occc3s2)cc1-c1nnn[n-]1 ZINC000820169094 607395154 /nfs/dbraw/zinc/39/51/54/607395154.db2.gz FGDJZBXKSBZEFU-UHFFFAOYSA-N -1 3 369.406 3.714 20 0 FHADHM CC(C)Oc1ccc(NC(=O)c2cc3occc3s2)cc1-c1nn[n-]n1 ZINC000820169094 607395155 /nfs/dbraw/zinc/39/51/55/607395155.db2.gz FGDJZBXKSBZEFU-UHFFFAOYSA-N -1 3 369.406 3.714 20 0 FHADHM CC(C)Oc1ccc(NC(=O)c2cccc(C(F)F)c2)cc1-c1nnn[n-]1 ZINC000820174709 607396998 /nfs/dbraw/zinc/39/69/98/607396998.db2.gz WLIHDPHJWWEYHB-UHFFFAOYSA-N -1 3 373.363 3.844 20 0 FHADHM CC(C)Oc1ccc(NC(=O)c2cccc(C(F)F)c2)cc1-c1nn[n-]n1 ZINC000820174709 607397000 /nfs/dbraw/zinc/39/70/00/607397000.db2.gz WLIHDPHJWWEYHB-UHFFFAOYSA-N -1 3 373.363 3.844 20 0 FHADHM CCCCS[C@@H](C)C(=O)Nc1ccc(OC(C)C)c(-c2nnn[n-]2)c1 ZINC000821077387 607397240 /nfs/dbraw/zinc/39/72/40/607397240.db2.gz CZKYZUBBAJLOMP-LBPRGKRZSA-N -1 3 363.487 3.514 20 0 FHADHM CCCCS[C@@H](C)C(=O)Nc1ccc(OC(C)C)c(-c2nn[n-]n2)c1 ZINC000821077387 607397241 /nfs/dbraw/zinc/39/72/41/607397241.db2.gz CZKYZUBBAJLOMP-LBPRGKRZSA-N -1 3 363.487 3.514 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)O[C@H](c1ccccc1)c1ccncc1 ZINC000826251645 607399923 /nfs/dbraw/zinc/39/99/23/607399923.db2.gz WOPAUPMXAZHEDR-LJQANCHMSA-N -1 3 371.400 3.517 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)O[C@H](c1ccccc1)c1ccncc1 ZINC000826251645 607399925 /nfs/dbraw/zinc/39/99/25/607399925.db2.gz WOPAUPMXAZHEDR-LJQANCHMSA-N -1 3 371.400 3.517 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@@H]1C(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000826316098 607400616 /nfs/dbraw/zinc/40/06/16/607400616.db2.gz CTTBYTFYTQKSGY-DFBGVHRSSA-N -1 3 354.435 3.645 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@@H]1C(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000826316098 607400617 /nfs/dbraw/zinc/40/06/17/607400617.db2.gz CTTBYTFYTQKSGY-DFBGVHRSSA-N -1 3 354.435 3.645 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@@H]1C(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000826316700 607401537 /nfs/dbraw/zinc/40/15/37/607401537.db2.gz WGUNUQLXQGIUOE-DFBGVHRSSA-N -1 3 354.435 3.645 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@@H]1C(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000826316700 607401539 /nfs/dbraw/zinc/40/15/39/607401539.db2.gz WGUNUQLXQGIUOE-DFBGVHRSSA-N -1 3 354.435 3.645 20 0 FHADHM O=C([O-])CN(Cc1cccc(OC(F)F)c1)Cc1ccc(F)c(F)c1 ZINC000739796548 599865095 /nfs/dbraw/zinc/86/50/95/599865095.db2.gz VSFKEZABWBEIQM-UHFFFAOYSA-N -1 3 357.303 3.653 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1COC(=O)[C@@H](C)c1cccc(Cl)c1 ZINC000826252883 607402897 /nfs/dbraw/zinc/40/28/97/607402897.db2.gz WTZGEJPDAWYTQD-LBPRGKRZSA-N -1 3 356.813 3.675 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1COC(=O)[C@@H](C)c1cccc(Cl)c1 ZINC000826252883 607402899 /nfs/dbraw/zinc/40/28/99/607402899.db2.gz WTZGEJPDAWYTQD-LBPRGKRZSA-N -1 3 356.813 3.675 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1COC(=O)Cc1csc2ccccc12 ZINC000826254080 607406789 /nfs/dbraw/zinc/40/67/89/607406789.db2.gz SUZJZWPQLQNBOP-UHFFFAOYSA-N -1 3 364.430 3.676 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1COC(=O)Cc1csc2ccccc12 ZINC000826254080 607406790 /nfs/dbraw/zinc/40/67/90/607406790.db2.gz SUZJZWPQLQNBOP-UHFFFAOYSA-N -1 3 364.430 3.676 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1COC(=O)C[C@@H](C)c1ccccc1F ZINC000826253708 607406898 /nfs/dbraw/zinc/40/68/98/607406898.db2.gz ZQNLLMXVCQRPHV-CYBMUJFWSA-N -1 3 354.385 3.551 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1COC(=O)C[C@@H](C)c1ccccc1F ZINC000826253708 607406900 /nfs/dbraw/zinc/40/69/00/607406900.db2.gz ZQNLLMXVCQRPHV-CYBMUJFWSA-N -1 3 354.385 3.551 20 0 FHADHM O=C([O-])Nc1cccc(C(=O)N[C@@H](CN2CCCCC2)c2ccccc2)c1 ZINC000740029504 599936630 /nfs/dbraw/zinc/93/66/30/599936630.db2.gz ROMCYHGWQBZVTO-IBGZPJMESA-N -1 3 367.449 3.734 20 0 FHADHM Cc1cc(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)ccc1C(=O)[O-] ZINC000738442779 600018294 /nfs/dbraw/zinc/01/82/94/600018294.db2.gz RNXATUMIQOERIS-LJQANCHMSA-N -1 3 367.449 3.652 20 0 FHADHM COc1ccc([C@H](NCC(=O)Nc2cc(C(=O)[O-])ccc2C)C(C)C)cc1 ZINC000737969338 600048662 /nfs/dbraw/zinc/04/86/62/600048662.db2.gz FUXUZXOVTNLLQE-HXUWFJFHSA-N -1 3 370.449 3.627 20 0 FHADHM C[C@H](NC(=O)OC(C)(C)C)C1CCN([C@@H](C)c2ccc(C(=O)[O-])o2)CC1 ZINC000736651660 600093543 /nfs/dbraw/zinc/09/35/43/600093543.db2.gz ZWZXGEQTDRUEPT-STQMWFEESA-N -1 3 366.458 3.664 20 0 FHADHM O=C([O-])c1cc(F)ccc1CN1CCC(C(=O)Nc2ccc(F)cc2)CC1 ZINC000740078483 600099815 /nfs/dbraw/zinc/09/98/15/600099815.db2.gz KGCRBXPPKJSHQY-UHFFFAOYSA-N -1 3 374.387 3.514 20 0 FHADHM C[C@@H]1CCCC[C@@]1(CNC(=O)OC(C)(C)C)NCc1occc1C(=O)[O-] ZINC000736779611 600147227 /nfs/dbraw/zinc/14/72/27/600147227.db2.gz JCFZIDGOBFGILY-YJYMSZOUSA-N -1 3 366.458 3.541 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@@H]1C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000826316120 607431114 /nfs/dbraw/zinc/43/11/14/607431114.db2.gz DGOYQIMEVIFXGL-OLZOCXBDSA-N -1 3 370.482 3.535 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@@H]1C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000826316120 607431115 /nfs/dbraw/zinc/43/11/15/607431115.db2.gz DGOYQIMEVIFXGL-OLZOCXBDSA-N -1 3 370.482 3.535 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1cc(-c2ccccc2)ns1 ZINC000826249761 607432368 /nfs/dbraw/zinc/43/23/68/607432368.db2.gz TUQFXDMXYNFHFH-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1cc(-c2ccccc2)ns1 ZINC000826249761 607432369 /nfs/dbraw/zinc/43/23/69/607432369.db2.gz TUQFXDMXYNFHFH-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM CCc1ccc(-c2ccc(C(=O)N(C)c3ccc(-c4nnn[n-]4)cc3)o2)cc1 ZINC000825700524 607433167 /nfs/dbraw/zinc/43/31/67/607433167.db2.gz IVTWHGBPWWRREN-UHFFFAOYSA-N -1 3 373.416 3.966 20 0 FHADHM CN(Cc1ccc(OCc2cccnc2)cc1)Cc1ccc(C(=O)[O-])cc1 ZINC000737486548 600289935 /nfs/dbraw/zinc/28/99/35/600289935.db2.gz AUNDCARPBVIYSI-UHFFFAOYSA-N -1 3 362.429 3.991 20 0 FHADHM Cc1nn(Cc2ccccc2)c(Cl)c1CN1CCC2(C[C@@H]2C(=O)[O-])CC1 ZINC000738927284 600291859 /nfs/dbraw/zinc/29/18/59/600291859.db2.gz JNAOWJAZXRZFEQ-QGZVFWFLSA-N -1 3 373.884 3.580 20 0 FHADHM Cc1nn(-c2ccccc2)c(Cl)c1CN1CCC2(C[C@H]2C(=O)[O-])CC1 ZINC000738902964 600304961 /nfs/dbraw/zinc/30/49/61/600304961.db2.gz RVCQCFBFCTZESE-INIZCTEOSA-N -1 3 359.857 3.521 20 0 FHADHM C[C@H]1CCCC[C@@]1(CNC(=O)OC(C)(C)C)NCc1ccc(C(=O)[O-])o1 ZINC000387861908 600315743 /nfs/dbraw/zinc/31/57/43/600315743.db2.gz NIKCDFKUWWACBM-DJJJIMSYSA-N -1 3 366.458 3.541 20 0 FHADHM CCC[C@](C)(NCc1csc(-c2ccc(OC)c(OC)c2)n1)C(=O)[O-] ZINC000736962833 600322597 /nfs/dbraw/zinc/32/25/97/600322597.db2.gz PGBNQZUFKDWPJM-SFHVURJKSA-N -1 3 364.467 3.560 20 0 FHADHM CCc1ccc(-c2ccc(C(=O)N(C)c3ccc(-c4nn[n-]n4)cc3)o2)cc1 ZINC000825700524 607433169 /nfs/dbraw/zinc/43/31/69/607433169.db2.gz IVTWHGBPWWRREN-UHFFFAOYSA-N -1 3 373.416 3.966 20 0 FHADHM CCCc1sc(C(=O)N(C)c2ccc(-c3nnn[n-]3)cc2)cc1CC ZINC000825352650 607441356 /nfs/dbraw/zinc/44/13/56/607441356.db2.gz OSHHXMICVHPIHM-UHFFFAOYSA-N -1 3 355.467 3.720 20 0 FHADHM CCCc1sc(C(=O)N(C)c2ccc(-c3nn[n-]n3)cc2)cc1CC ZINC000825352650 607441358 /nfs/dbraw/zinc/44/13/58/607441358.db2.gz OSHHXMICVHPIHM-UHFFFAOYSA-N -1 3 355.467 3.720 20 0 FHADHM COc1cc(CN[C@@H](C(=O)[O-])c2cccc(Cl)c2)ccc1OC(F)F ZINC000426747565 600417982 /nfs/dbraw/zinc/41/79/82/600417982.db2.gz QDXDHFUGHZPYJQ-OAHLLOKOSA-N -1 3 371.767 3.866 20 0 FHADHM C[C@H](N[C@H](C(=O)[O-])c1ccc(F)cc1)c1ccc(NC(=O)C2CC2)cc1 ZINC000736661275 600421692 /nfs/dbraw/zinc/42/16/92/600421692.db2.gz DPKJLQIQDCZVJQ-SGTLLEGYSA-N -1 3 356.397 3.651 20 0 FHADHM O=C([O-])[C@@H](NCc1ccc(N2CCCCC2)nc1)c1cccc(Cl)c1 ZINC000739499783 600425488 /nfs/dbraw/zinc/42/54/88/600425488.db2.gz JZWZTVIYGBGQOD-SFHVURJKSA-N -1 3 359.857 3.641 20 0 FHADHM CC(C)CC(=O)Nc1cccc(CN[C@H](C(=O)[O-])c2ccc(F)cc2)c1 ZINC000736401374 600428317 /nfs/dbraw/zinc/42/83/17/600428317.db2.gz HZZXGWZRSWQQEK-IBGZPJMESA-N -1 3 358.413 3.726 20 0 FHADHM O=C([O-])[C@H](NCc1ccc(Oc2cccc(F)c2)nc1)c1ccccc1 ZINC000738526182 600432208 /nfs/dbraw/zinc/43/22/08/600432208.db2.gz QNVWKMCRVVRHPR-LJQANCHMSA-N -1 3 352.365 3.929 20 0 FHADHM COc1ccc(CN[C@@H](C(=O)[O-])c2ccc(F)cc2)cc1Br ZINC000738008545 600433320 /nfs/dbraw/zinc/43/33/20/600433320.db2.gz NMKIYAKYKFKTJO-OAHLLOKOSA-N -1 3 368.202 3.512 20 0 FHADHM Cc1[nH]c(C(=O)CN2C[C@@H](c3ccccc3C)C[C@@H]2C)c(C)c1C(=O)[O-] ZINC000738761180 600434269 /nfs/dbraw/zinc/43/42/69/600434269.db2.gz PAVJAHKVRDFXNI-BBRMVZONSA-N -1 3 354.450 3.699 20 0 FHADHM O=C([O-])[C@@H](c1ccc(F)cc1)N1CCC[C@H](C(=O)c2ccc(F)cc2)C1 ZINC000580456706 600440738 /nfs/dbraw/zinc/44/07/38/600440738.db2.gz NQQDEECYYWMWSE-MAUKXSAKSA-N -1 3 359.372 3.685 20 0 FHADHM O=C([O-])Nc1ccccc1C(=O)NC[C@H]1CCCCN1Cc1ccccc1 ZINC000740045677 600575427 /nfs/dbraw/zinc/57/54/27/600575427.db2.gz JJLWHVYEFDNYKQ-QGZVFWFLSA-N -1 3 367.449 3.561 20 0 FHADHM O=C([O-])[C@H](NC[C@H]1Cc2ccccc2O1)c1ccc(Cl)cc1Cl ZINC000833165320 600737504 /nfs/dbraw/zinc/73/75/04/600737504.db2.gz BIEUDKJNNBFQPK-MLGOLLRUSA-N -1 3 352.217 3.712 20 0 FHADHM CN(Cc1cc(C(=O)[O-])co1)CC1(c2ccc(Br)cc2)CC1 ZINC000582008272 600794437 /nfs/dbraw/zinc/79/44/37/600794437.db2.gz GMGUUKDJFOMOLP-UHFFFAOYSA-N -1 3 364.239 3.904 20 0 FHADHM C[C@H]1CN2CCCC[C@H]2CN1Cc1csc(-c2cccc(C(=O)[O-])c2)n1 ZINC000828499489 600830765 /nfs/dbraw/zinc/83/07/65/600830765.db2.gz AMCBHYZKSWDBOA-KSSFIOAISA-N -1 3 371.506 3.567 20 0 FHADHM O=C([O-])N1CCC[C@H](NCc2cc(Cl)ccc2OC2CCCC2)C1 ZINC000833279110 600896477 /nfs/dbraw/zinc/89/64/77/600896477.db2.gz FWWYAUCAZJFXJZ-HNNXBMFYSA-N -1 3 352.862 3.893 20 0 FHADHM Cc1nccn1[C@@H]1CCCN([C@H](C(=O)[O-])c2ccc(Cl)cc2Cl)C1 ZINC000833010437 601002404 /nfs/dbraw/zinc/00/24/04/601002404.db2.gz HPCKVNWBXLLTEB-CJNGLKHVSA-N -1 3 368.264 3.961 20 0 FHADHM C[C@H]1CCN(Cc2ccccc2)CCN1C(=O)c1ccc(NC(=O)[O-])cc1 ZINC000828295488 601108569 /nfs/dbraw/zinc/10/85/69/601108569.db2.gz ILHPXCJVEKXORI-INIZCTEOSA-N -1 3 367.449 3.513 20 0 FHADHM CN(C(=O)Nc1ccc(C(=O)[O-])cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000388478318 601128244 /nfs/dbraw/zinc/12/82/44/601128244.db2.gz JTOTXHCFGVOUSU-IBGZPJMESA-N -1 3 367.449 3.513 20 0 FHADHM Cc1c(Cl)cccc1NC(=O)CN[C@@H](c1ccccc1)[C@@H](C)C(=O)[O-] ZINC000832854274 601202256 /nfs/dbraw/zinc/20/22/56/601202256.db2.gz CPDYUIVGXMQORR-FZKQIMNGSA-N -1 3 360.841 3.639 20 0 FHADHM CCc1ccc2c(CN[C@@H](c3ccccc3)[C@H](C)C(=O)[O-])cc(=O)oc2c1 ZINC000830259684 601204427 /nfs/dbraw/zinc/20/44/27/601204427.db2.gz CQURMKZSJFOKQD-LHSJRXKWSA-N -1 3 365.429 3.907 20 0 FHADHM Cc1ccc2cc(C(=O)Nc3ccc(-c4nnn[n-]4)c(Cl)c3)ccc2n1 ZINC000822280446 607497205 /nfs/dbraw/zinc/49/72/05/607497205.db2.gz NWPJYOGEODMVDH-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1ccc2cc(C(=O)Nc3ccc(-c4nn[n-]n4)c(Cl)c3)ccc2n1 ZINC000822280446 607497206 /nfs/dbraw/zinc/49/72/06/607497206.db2.gz NWPJYOGEODMVDH-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM CN(Cc1ncc(-c2ccccc2)s1)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000825961873 607511777 /nfs/dbraw/zinc/51/17/77/607511777.db2.gz OFHZWADDIQUARW-UHFFFAOYSA-N -1 3 362.462 3.622 20 0 FHADHM CN(Cc1ncc(-c2ccccc2)s1)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000825961873 607511779 /nfs/dbraw/zinc/51/17/79/607511779.db2.gz OFHZWADDIQUARW-UHFFFAOYSA-N -1 3 362.462 3.622 20 0 FHADHM CN(Cc1ccc(Br)cc1)Cc1ccc(C(=O)[O-])c(F)c1 ZINC000234293243 601613654 /nfs/dbraw/zinc/61/36/54/601613654.db2.gz KDBIZYMDXCQFNV-UHFFFAOYSA-N -1 3 352.203 3.918 20 0 FHADHM CC(C)(CN[C@H](C(=O)c1c[nH]c2ccccc12)c1ccccc1)C(=O)[O-] ZINC000826607109 601644662 /nfs/dbraw/zinc/64/46/62/601644662.db2.gz IRBRNGZQMMFDAJ-SFHVURJKSA-N -1 3 350.418 3.792 20 0 FHADHM C[C@H](C(=O)[O-])[C@H](NCC(=O)Nc1ccc2ccccc2c1)c1ccccc1 ZINC000826052969 601657669 /nfs/dbraw/zinc/65/76/69/601657669.db2.gz HQSNPDHRQPCVBR-BTYIYWSLSA-N -1 3 362.429 3.830 20 0 FHADHM Cc1sc(C(=O)[O-])cc1COC(=O)C1CCN(Cc2ccccc2)CC1 ZINC000833030950 601731120 /nfs/dbraw/zinc/73/11/20/601731120.db2.gz DCHBIMKSQOYIJS-UHFFFAOYSA-N -1 3 373.474 3.710 20 0 FHADHM O=C([O-])N1CCC[C@H]1[C@@H]1CCCCN1Cc1cnc(-c2ccccc2)nc1 ZINC000740514566 601924675 /nfs/dbraw/zinc/92/46/75/601924675.db2.gz CUPJIAWBMSPVNE-OALUTQOASA-N -1 3 366.465 3.641 20 0 FHADHM COC(=O)c1cccc(CN[C@H](C(=O)[O-])c2cc(Cl)cc(Cl)c2)c1 ZINC000831453734 601978498 /nfs/dbraw/zinc/97/84/98/601978498.db2.gz ZPJFTALBPHYTCZ-HNNXBMFYSA-N -1 3 368.216 3.696 20 0 FHADHM C[C@@H](NCc1csc(-c2ccc(F)cc2)n1)[C@H]1CCCN(C(=O)[O-])C1 ZINC000739031805 602003119 /nfs/dbraw/zinc/00/31/19/602003119.db2.gz QWNUFPKGJCHMQQ-OCCSQVGLSA-N -1 3 363.458 3.817 20 0 FHADHM Cc1nccn1[C@@H]1CCCN([C@@H](C(=O)[O-])c2cc(Cl)cc(Cl)c2)C1 ZINC000833011555 602040602 /nfs/dbraw/zinc/04/06/02/602040602.db2.gz YAZVDJPMNUAMJI-HZPDHXFCSA-N -1 3 368.264 3.961 20 0 FHADHM COc1cc(OC)cc([C@@H](NCc2ccc(C(C)(C)C)cc2)C(=O)[O-])c1 ZINC000832056288 602169398 /nfs/dbraw/zinc/16/93/98/602169398.db2.gz BDAWZKLXYNITRK-LJQANCHMSA-N -1 3 357.450 3.917 20 0 FHADHM C[C@H](NC(=O)[O-])[C@H]1CCCCN1Cc1ccc(OCc2ccncc2)cc1 ZINC000739005101 602260070 /nfs/dbraw/zinc/26/00/70/602260070.db2.gz VXRLWSKNECNYNU-OXJNMPFZSA-N -1 3 369.465 3.671 20 0 FHADHM O=C(Nc1ccccc1Nc1ccccc1)c1sccc1-c1nnn[n-]1 ZINC000826457438 607569876 /nfs/dbraw/zinc/56/98/76/607569876.db2.gz BCUUWSFAFDDEED-UHFFFAOYSA-N -1 3 362.418 3.924 20 0 FHADHM O=C(Nc1ccccc1Nc1ccccc1)c1sccc1-c1nn[n-]n1 ZINC000826457438 607569878 /nfs/dbraw/zinc/56/98/78/607569878.db2.gz BCUUWSFAFDDEED-UHFFFAOYSA-N -1 3 362.418 3.924 20 0 FHADHM CCn1nc(C)c(CNC[C@H](NC(=O)[O-])c2ccc(C(C)C)cc2)c1C ZINC000739571621 602647342 /nfs/dbraw/zinc/64/73/42/602647342.db2.gz WAJPLOLGCSLNEL-IBGZPJMESA-N -1 3 358.486 3.742 20 0 FHADHM Cc1ccc(NC(=O)[C@H](C)[C@H](NC(=O)[O-])c2ccccc2)c(CN(C)C)c1 ZINC000830352784 602934790 /nfs/dbraw/zinc/93/47/90/602934790.db2.gz JWPBLCLBAORQHO-BEFAXECRSA-N -1 3 369.465 3.640 20 0 FHADHM Cc1ccc(C(=O)N(CCN2CCCC2)c2ccccc2)cc1NC(=O)[O-] ZINC000830188275 602979561 /nfs/dbraw/zinc/97/95/61/602979561.db2.gz WVAZZLRFGSCBOS-UHFFFAOYSA-N -1 3 367.449 3.828 20 0 FHADHM C[C@@H](CNC(=O)Nc1cc(NC(=O)[O-])ccc1F)N(C)Cc1ccccc1 ZINC000738921453 603040876 /nfs/dbraw/zinc/04/08/76/603040876.db2.gz UVKWKWGZKZSXBE-ZDUSSCGKSA-N -1 3 374.416 3.558 20 0 FHADHM CN(C)CCN(C(=O)c1ccc(NC(=O)[O-])cc1Cl)c1ccccc1 ZINC000739606171 603233723 /nfs/dbraw/zinc/23/37/23/603233723.db2.gz GEVMNHNNWFHAAO-UHFFFAOYSA-N -1 3 361.829 3.638 20 0 FHADHM Cc1ccc(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1NC(=O)[O-] ZINC000830210652 603392837 /nfs/dbraw/zinc/39/28/37/603392837.db2.gz CNVDNCTWYGCEHI-CRAIPNDOSA-N -1 3 367.449 3.650 20 0 FHADHM C[C@@H](NCc1ccc(NC(=O)[O-])nc1)[C@@H](O)c1c(Cl)cccc1Cl ZINC000825503838 603559816 /nfs/dbraw/zinc/55/98/16/603559816.db2.gz XYFWUKDNHHDDIK-RFAUZJTJSA-N -1 3 370.236 3.690 20 0 FHADHM CCC(CC)(CNCc1cc2cnn(C(C)C)c2nc1Cl)NC(=O)[O-] ZINC000826561100 603603196 /nfs/dbraw/zinc/60/31/96/603603196.db2.gz KOIBFDXSETYSNR-UHFFFAOYSA-N -1 3 367.881 3.582 20 0 FHADHM O=C(Nc1cccc(O)c1)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000826457254 607645141 /nfs/dbraw/zinc/64/51/41/607645141.db2.gz SZLKAZMRJJCCJO-UHFFFAOYSA-N -1 3 372.388 3.568 20 0 FHADHM CC[C@@H](NC(=O)c1ccc(-c2nnn[n-]2)cc1C)c1ccc(Cl)cc1 ZINC000825133020 607652758 /nfs/dbraw/zinc/65/27/58/607652758.db2.gz HJMBIEFEQHOMTB-MRXNPFEDSA-N -1 3 355.829 3.710 20 0 FHADHM CC[C@@H](NC(=O)c1ccc(-c2nn[n-]n2)cc1C)c1ccc(Cl)cc1 ZINC000825133020 607652759 /nfs/dbraw/zinc/65/27/59/607652759.db2.gz HJMBIEFEQHOMTB-MRXNPFEDSA-N -1 3 355.829 3.710 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N[C@H](C)c1ccc2ccccc2c1 ZINC000826246770 607649661 /nfs/dbraw/zinc/64/96/61/607649661.db2.gz KVRBZLRLJSRISJ-CQSZACIVSA-N -1 3 357.417 3.819 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N[C@H](C)c1ccc2ccccc2c1 ZINC000826246770 607649662 /nfs/dbraw/zinc/64/96/62/607649662.db2.gz KVRBZLRLJSRISJ-CQSZACIVSA-N -1 3 357.417 3.819 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N(Cc1ccco1)Cc1ccccc1 ZINC000826244070 607658407 /nfs/dbraw/zinc/65/84/07/607658407.db2.gz GCUCIKPKIBYHGW-UHFFFAOYSA-N -1 3 373.416 3.611 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N(Cc1ccco1)Cc1ccccc1 ZINC000826244070 607658409 /nfs/dbraw/zinc/65/84/09/607658409.db2.gz GCUCIKPKIBYHGW-UHFFFAOYSA-N -1 3 373.416 3.611 20 0 FHADHM CCN(C(=O)c1ccc(-c2nnn[n-]2)cc1C)[C@H](C)c1ccc(F)cc1 ZINC000825380789 607666054 /nfs/dbraw/zinc/66/60/54/607666054.db2.gz TYFJWPORGVAFBJ-CYBMUJFWSA-N -1 3 353.401 3.538 20 0 FHADHM CCN(C(=O)c1ccc(-c2nn[n-]n2)cc1C)[C@H](C)c1ccc(F)cc1 ZINC000825380789 607666056 /nfs/dbraw/zinc/66/60/56/607666056.db2.gz TYFJWPORGVAFBJ-CYBMUJFWSA-N -1 3 353.401 3.538 20 0 FHADHM CCCCOc1ccccc1NC(=O)c1ccc(-c2nnn[n-]2)cc1C ZINC000825296529 607668120 /nfs/dbraw/zinc/66/81/20/607668120.db2.gz NEQFIAQMGNYIRA-UHFFFAOYSA-N -1 3 351.410 3.606 20 0 FHADHM CCCCOc1ccccc1NC(=O)c1ccc(-c2nn[n-]n2)cc1C ZINC000825296529 607668122 /nfs/dbraw/zinc/66/81/22/607668122.db2.gz NEQFIAQMGNYIRA-UHFFFAOYSA-N -1 3 351.410 3.606 20 0 FHADHM Cc1ccc(CN(C)C)cc1NC(=O)[C@H](C)[C@H](NC(=O)[O-])c1ccccc1 ZINC000830308823 604084731 /nfs/dbraw/zinc/08/47/31/604084731.db2.gz OUPPHZDTOIJIDQ-BEFAXECRSA-N -1 3 369.465 3.640 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1NCc1cccc(-c2ccccn2)c1 ZINC000826350961 607679148 /nfs/dbraw/zinc/67/91/48/607679148.db2.gz RJWNCOAOHSQTRJ-UHFFFAOYSA-N -1 3 363.812 3.589 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1NCc1cccc(-c2ccccn2)c1 ZINC000826350961 607679149 /nfs/dbraw/zinc/67/91/49/607679149.db2.gz RJWNCOAOHSQTRJ-UHFFFAOYSA-N -1 3 363.812 3.589 20 0 FHADHM Cc1c([C@@H](C)N[C@H]2CCCN(C(=O)[O-])C2)cnn1-c1cccc(Cl)c1 ZINC000832854111 604286617 /nfs/dbraw/zinc/28/66/17/604286617.db2.gz UITJXPADZGNIKE-DOMZBBRYSA-N -1 3 362.861 3.627 20 0 FHADHM C[C@@H](CC(=O)Nc1ccccc1C(F)(F)F)NCc1ccc(C(=O)[O-])o1 ZINC000827241181 604329498 /nfs/dbraw/zinc/32/94/98/604329498.db2.gz SHRCDYFJKATXTM-JTQLQIEISA-N -1 3 370.327 3.504 20 0 FHADHM Cc1cc([C@@H](C)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)oc1C(=O)[O-] ZINC000832871142 604384749 /nfs/dbraw/zinc/38/47/49/604384749.db2.gz ORLWVVJTXKTGSS-CYBMUJFWSA-N -1 3 374.412 3.837 20 0 FHADHM C[C@@H](NC(=O)C[C@H](C)c1ccc(F)cc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000824384650 607692502 /nfs/dbraw/zinc/69/25/02/607692502.db2.gz FSPOCMQHUAUMOU-NWDGAFQWSA-N -1 3 371.391 3.516 20 0 FHADHM C[C@@H](NC(=O)C[C@H](C)c1ccc(F)cc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000824384650 607692504 /nfs/dbraw/zinc/69/25/04/607692504.db2.gz FSPOCMQHUAUMOU-NWDGAFQWSA-N -1 3 371.391 3.516 20 0 FHADHM Cc1ccccc1[C@H]1C[C@@H](C)N(C(=O)c2ccc(-c3nnn[n-]3)cc2C)C1 ZINC000826244234 607693506 /nfs/dbraw/zinc/69/35/06/607693506.db2.gz KZRLKCVBUOHIBC-WBVHZDCISA-N -1 3 361.449 3.502 20 0 FHADHM Cc1ccccc1[C@H]1C[C@@H](C)N(C(=O)c2ccc(-c3nn[n-]n3)cc2C)C1 ZINC000826244234 607693507 /nfs/dbraw/zinc/69/35/07/607693507.db2.gz KZRLKCVBUOHIBC-WBVHZDCISA-N -1 3 361.449 3.502 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1C[C@H](C)C[C@H]1c1cccc(F)c1 ZINC000826244537 607695864 /nfs/dbraw/zinc/69/58/64/607695864.db2.gz WMWKAUVKQJOKGF-XIKOKIGWSA-N -1 3 365.412 3.538 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1C[C@H](C)C[C@H]1c1cccc(F)c1 ZINC000826244537 607695866 /nfs/dbraw/zinc/69/58/66/607695866.db2.gz WMWKAUVKQJOKGF-XIKOKIGWSA-N -1 3 365.412 3.538 20 0 FHADHM CCN(CC)[C@@H](CNC(=O)Nc1cc(C(=O)[O-])cs1)c1ccsc1 ZINC000829666389 604523588 /nfs/dbraw/zinc/52/35/88/604523588.db2.gz FYEHCROBOWVKRN-ZDUSSCGKSA-N -1 3 367.496 3.712 20 0 FHADHM Cc1cc(NC(=O)c2ccc(-c3nnn[n-]3)cc2C)c2cccnc2c1C ZINC000826249462 607697273 /nfs/dbraw/zinc/69/72/73/607697273.db2.gz DXBTXRNVEWAEBT-UHFFFAOYSA-N -1 3 358.405 3.592 20 0 FHADHM Cc1cc(NC(=O)c2ccc(-c3nn[n-]n3)cc2C)c2cccnc2c1C ZINC000826249462 607697275 /nfs/dbraw/zinc/69/72/75/607697275.db2.gz DXBTXRNVEWAEBT-UHFFFAOYSA-N -1 3 358.405 3.592 20 0 FHADHM Cc1cc(CN2CCSC[C@H]2CC(=O)[O-])ccc1Oc1cccnc1 ZINC000833745388 604661178 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C[C@H](C(=O)Nc1ccc2ccccc2c1)N1CCC[C@@H](C(C)(C)C(=O)[O-])C1 ZINC000833409538 604949612 /nfs/dbraw/zinc/94/96/12/604949612.db2.gz OILOQLJEQLMOTP-CRAIPNDOSA-N -1 3 368.477 3.990 20 0 FHADHM O=C([O-])[C@@H](NCc1ccc(OCc2cccc(F)c2)cc1)c1cccnc1 ZINC000833170558 604992667 /nfs/dbraw/zinc/99/26/67/604992667.db2.gz YIGUGAACWUKYBB-FQEVSTJZSA-N -1 3 366.392 3.715 20 0 FHADHM C[C@@]1(NCc2nc3cc(C(F)(F)F)ccc3o2)CCCC[C@@H]1C(=O)[O-] ZINC000833569854 605060156 /nfs/dbraw/zinc/06/01/56/605060156.db2.gz PQLTYSVJFZKZGO-BDJLRTHQSA-N -1 3 356.344 3.970 20 0 FHADHM C[C@@H](Oc1ccc(CN[C@H]2CCCc3c2cnn3C(C)(C)C)cc1)C(=O)[O-] ZINC000833540890 605091435 /nfs/dbraw/zinc/09/14/35/605091435.db2.gz NUKLZUPRBPJDLZ-KDOFPFPSSA-N -1 3 371.481 3.657 20 0 FHADHM Cc1noc(C)c1[C@H](C)CNc1ccc(-c2nn[n-]n2)cc1C(F)(F)F ZINC000826339205 607734349 /nfs/dbraw/zinc/73/43/49/607734349.db2.gz VVJASKAXZYFTTE-MRVPVSSYSA-N -1 3 366.347 3.706 20 0 FHADHM O=C([O-])c1ccc(F)c(CN[C@H](CN2CCCCC2)c2ccccc2)c1 ZINC000833780936 605269524 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369.465 3.529 20 0 FHADHM C[C@@H](NC(=O)[O-])[C@H]1CCCN(Cc2ccccc2OCc2cccnc2)C1 ZINC000833813537 605601472 /nfs/dbraw/zinc/60/14/72/605601472.db2.gz PSUCHVWFKNSSPO-AEFFLSMTSA-N -1 3 369.465 3.529 20 0 FHADHM C[C@H]1CC[C@H](NC(=O)CCc2ccc(-c3nnn[n-]3)cc2)c2ccccc21 ZINC000824914925 607771987 /nfs/dbraw/zinc/77/19/87/607771987.db2.gz ADKRCWJFKFUNBM-LIRRHRJNSA-N -1 3 361.449 3.554 20 0 FHADHM C[C@H]1CC[C@H](NC(=O)CCc2ccc(-c3nn[n-]n3)cc2)c2ccccc21 ZINC000824914925 607771988 /nfs/dbraw/zinc/77/19/88/607771988.db2.gz ADKRCWJFKFUNBM-LIRRHRJNSA-N -1 3 361.449 3.554 20 0 FHADHM C[C@@H]1CC[C@H](NC(=O)C=Cc2ccccc2-c2nnn[n-]2)c2ccccc21 ZINC000824919522 607772079 /nfs/dbraw/zinc/77/20/79/607772079.db2.gz VZUBZYWCKWZDQM-UGRDJDSXSA-N -1 3 359.433 3.635 20 0 FHADHM C[C@@H]1CC[C@H](NC(=O)C=Cc2ccccc2-c2nn[n-]n2)c2ccccc21 ZINC000824919522 607772080 /nfs/dbraw/zinc/77/20/80/607772080.db2.gz VZUBZYWCKWZDQM-UGRDJDSXSA-N -1 3 359.433 3.635 20 0 FHADHM O=C([O-])N[C@H]1C[C@H](NCc2cccc(OCC(F)F)c2)c2ccccc21 ZINC000834158100 605802316 /nfs/dbraw/zinc/80/23/16/605802316.db2.gz MEIZYQCUDUUWPK-IRXDYDNUSA-N -1 3 362.376 3.874 20 0 FHADHM C[C@@H](Nc1ccc(-c2nnn[n-]2)nc1)c1cc(F)c(Cl)cc1Cl ZINC000820455529 606025931 /nfs/dbraw/zinc/02/59/31/606025931.db2.gz JESWQIODMVVIMI-SSDOTTSWSA-N -1 3 353.188 3.881 20 0 FHADHM C[C@@H](Nc1ccc(-c2nn[n-]n2)nc1)c1cc(F)c(Cl)cc1Cl ZINC000820455529 606025935 /nfs/dbraw/zinc/02/59/35/606025935.db2.gz JESWQIODMVVIMI-SSDOTTSWSA-N -1 3 353.188 3.881 20 0 FHADHM FC(F)(F)[C@@H]1CCC[C@H](Nc2nc3ccccc3cc2-c2nnn[n-]2)C1 ZINC000822713913 606035257 /nfs/dbraw/zinc/03/52/57/606035257.db2.gz BMMBSPXICBGAMH-NEPJUHHUSA-N -1 3 362.359 3.948 20 0 FHADHM FC(F)(F)[C@@H]1CCC[C@H](Nc2nc3ccccc3cc2-c2nn[n-]n2)C1 ZINC000822713913 606035262 /nfs/dbraw/zinc/03/52/62/606035262.db2.gz BMMBSPXICBGAMH-NEPJUHHUSA-N -1 3 362.359 3.948 20 0 FHADHM COc1ccc([C@@H](Nc2ccc(-c3nnn[n-]3)nc2)c2ccc(C)cc2)cc1 ZINC000821783195 606056078 /nfs/dbraw/zinc/05/60/78/606056078.db2.gz ZLBZPJJHNWWWKR-FQEVSTJZSA-N -1 3 372.432 3.780 20 0 FHADHM COc1ccc([C@@H](Nc2ccc(-c3nn[n-]n3)nc2)c2ccc(C)cc2)cc1 ZINC000821783195 606056082 /nfs/dbraw/zinc/05/60/82/606056082.db2.gz ZLBZPJJHNWWWKR-FQEVSTJZSA-N -1 3 372.432 3.780 20 0 FHADHM COc1ccccc1Oc1ccc(CNc2ccc(-c3nnn[n-]3)nc2)cc1 ZINC000821903716 606084563 /nfs/dbraw/zinc/08/45/63/606084563.db2.gz LYTCGOSLUUQCRJ-UHFFFAOYSA-N -1 3 374.404 3.675 20 0 FHADHM COc1ccccc1Oc1ccc(CNc2ccc(-c3nn[n-]n3)nc2)cc1 ZINC000821903716 606084565 /nfs/dbraw/zinc/08/45/65/606084565.db2.gz LYTCGOSLUUQCRJ-UHFFFAOYSA-N -1 3 374.404 3.675 20 0 FHADHM CC[C@H](C)Oc1ccc(C(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000820876027 606116901 /nfs/dbraw/zinc/11/69/01/606116901.db2.gz KJMFYYRQMOOABQ-KBPBESRZSA-N -1 3 365.437 3.535 20 0 FHADHM CC[C@H](C)Oc1ccc(C(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000820876027 606116902 /nfs/dbraw/zinc/11/69/02/606116902.db2.gz KJMFYYRQMOOABQ-KBPBESRZSA-N -1 3 365.437 3.535 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2 ZINC000819773526 606121740 /nfs/dbraw/zinc/12/17/40/606121740.db2.gz SWPPXKPWRJNRHA-KTKRTIGZSA-N -1 3 369.425 3.598 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2 ZINC000819773526 606121741 /nfs/dbraw/zinc/12/17/41/606121741.db2.gz SWPPXKPWRJNRHA-KTKRTIGZSA-N -1 3 369.425 3.598 20 0 FHADHM C[C@H](NC(=O)c1c(Cl)cccc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000820386424 606136403 /nfs/dbraw/zinc/13/64/03/606136403.db2.gz YTWUOBWTWLSWBB-VIFPVBQESA-N -1 3 362.220 3.665 20 0 FHADHM C[C@H](NC(=O)c1c(Cl)cccc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000820386424 606136404 /nfs/dbraw/zinc/13/64/04/606136404.db2.gz YTWUOBWTWLSWBB-VIFPVBQESA-N -1 3 362.220 3.665 20 0 FHADHM C[C@H](c1ccc(Cl)cc1)[C@H](C)N(C)C(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000820562720 606149105 /nfs/dbraw/zinc/14/91/05/606149105.db2.gz ILWMCNYQMADADX-STQMWFEESA-N -1 3 369.856 3.784 20 0 FHADHM C[C@H](c1ccc(Cl)cc1)[C@H](C)N(C)C(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC000820562720 606149107 /nfs/dbraw/zinc/14/91/07/606149107.db2.gz ILWMCNYQMADADX-STQMWFEESA-N -1 3 369.856 3.784 20 0 FHADHM C[C@@H](NC(=O)c1c(Cl)cccc1Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000820384346 606153443 /nfs/dbraw/zinc/15/34/43/606153443.db2.gz CBFZMDQOQDZYHA-SECBINFHSA-N -1 3 362.220 3.665 20 0 FHADHM C[C@@H](NC(=O)c1c(Cl)cccc1Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000820384346 606153445 /nfs/dbraw/zinc/15/34/45/606153445.db2.gz CBFZMDQOQDZYHA-SECBINFHSA-N -1 3 362.220 3.665 20 0 FHADHM CCN(Cc1csc([C@H](C)OC)n1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821230560 606158273 /nfs/dbraw/zinc/15/82/73/606158273.db2.gz NICVCNWCDASRAX-OLZOCXBDSA-N -1 3 372.498 3.614 20 0 FHADHM CCN(Cc1csc([C@H](C)OC)n1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821230560 606158274 /nfs/dbraw/zinc/15/82/74/606158274.db2.gz NICVCNWCDASRAX-OLZOCXBDSA-N -1 3 372.498 3.614 20 0 FHADHM CCc1cnc(CN(C)c2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)s1 ZINC000821496503 606164520 /nfs/dbraw/zinc/16/45/20/606164520.db2.gz HELMZYBHRLJTHX-UHFFFAOYSA-N -1 3 368.388 3.541 20 0 FHADHM CCc1cnc(CN(C)c2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)s1 ZINC000821496503 606164522 /nfs/dbraw/zinc/16/45/22/606164522.db2.gz HELMZYBHRLJTHX-UHFFFAOYSA-N -1 3 368.388 3.541 20 0 FHADHM CC(C)(C)n1ncc2c1CCC[C@@H]2Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000819976147 606224230 /nfs/dbraw/zinc/22/42/30/606224230.db2.gz ONFKNDHRPWMMAH-HNNXBMFYSA-N -1 3 371.876 3.961 20 0 FHADHM CC(C)(C)n1ncc2c1CCC[C@@H]2Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000819976147 606224232 /nfs/dbraw/zinc/22/42/32/606224232.db2.gz ONFKNDHRPWMMAH-HNNXBMFYSA-N -1 3 371.876 3.961 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1)[C@H]1C[C@H]1C1CC1 ZINC000823350386 606252626 /nfs/dbraw/zinc/25/26/26/606252626.db2.gz LDKPQDDNTMGTMN-ROUUACIJSA-N -1 3 361.405 3.644 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1)[C@H]1C[C@H]1C1CC1 ZINC000823350386 606252627 /nfs/dbraw/zinc/25/26/27/606252627.db2.gz LDKPQDDNTMGTMN-ROUUACIJSA-N -1 3 361.405 3.644 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)[C@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000823344356 606270837 /nfs/dbraw/zinc/27/08/37/606270837.db2.gz WGQFTNBILDXUCO-SJORKVTESA-N -1 3 373.391 3.901 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)[C@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000823344356 606270839 /nfs/dbraw/zinc/27/08/39/606270839.db2.gz WGQFTNBILDXUCO-SJORKVTESA-N -1 3 373.391 3.901 20 0 FHADHM CC(C)c1ccc(CCC(=O)Nc2ccc(F)cc2-c2nnn[n-]2)cc1 ZINC000820192747 606271784 /nfs/dbraw/zinc/27/17/84/606271784.db2.gz XWCIBLMSAJRKLK-UHFFFAOYSA-N -1 3 353.401 3.701 20 0 FHADHM CC(C)c1ccc(CCC(=O)Nc2ccc(F)cc2-c2nn[n-]n2)cc1 ZINC000820192747 606271786 /nfs/dbraw/zinc/27/17/86/606271786.db2.gz XWCIBLMSAJRKLK-UHFFFAOYSA-N -1 3 353.401 3.701 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cc(C)ccc1C ZINC000821122901 606281636 /nfs/dbraw/zinc/28/16/36/606281636.db2.gz BJUHGRRUZSLDOT-UHFFFAOYSA-N -1 3 350.426 3.558 20 0 FHADHM CCCC(CCC)S[C@@H]1CCN(c2sccc2-c2nnn[n-]2)C1=O ZINC000821014432 606310612 /nfs/dbraw/zinc/31/06/12/606310612.db2.gz HCIYYVWPQDHOOS-CYBMUJFWSA-N -1 3 365.528 3.736 20 0 FHADHM CCCC(CCC)S[C@@H]1CCN(c2sccc2-c2nn[n-]n2)C1=O ZINC000821014432 606310613 /nfs/dbraw/zinc/31/06/13/606310613.db2.gz HCIYYVWPQDHOOS-CYBMUJFWSA-N -1 3 365.528 3.736 20 0 FHADHM CC(C)Sc1ccc(Cl)cc1NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC000820184229 606320144 /nfs/dbraw/zinc/32/01/44/606320144.db2.gz XNWUOJZVCDKGAS-UHFFFAOYSA-N -1 3 362.846 3.601 20 0 FHADHM CC(C)Sc1ccc(Cl)cc1NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC000820184229 606320146 /nfs/dbraw/zinc/32/01/46/606320146.db2.gz XNWUOJZVCDKGAS-UHFFFAOYSA-N -1 3 362.846 3.601 20 0 FHADHM Cc1cccc(C)c1NC(=O)[C@H](C)Sc1cccc(-c2nnn[n-]2)c1 ZINC000822294371 606324678 /nfs/dbraw/zinc/32/46/78/606324678.db2.gz YGRMHUGZPQFPBT-ZDUSSCGKSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1cccc(C)c1NC(=O)[C@H](C)Sc1cccc(-c2nn[n-]n2)c1 ZINC000822294371 606324679 /nfs/dbraw/zinc/32/46/79/606324679.db2.gz YGRMHUGZPQFPBT-ZDUSSCGKSA-N -1 3 353.451 3.603 20 0 FHADHM C[C@@H](OC(=O)Cc1c(F)cccc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000820497708 606340402 /nfs/dbraw/zinc/34/04/02/606340402.db2.gz UTKWIWLUDDDBHS-SNVBAGLBSA-N -1 3 360.776 3.506 20 0 FHADHM C[C@@H](OC(=O)Cc1c(F)cccc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000820497708 606340404 /nfs/dbraw/zinc/34/04/04/606340404.db2.gz UTKWIWLUDDDBHS-SNVBAGLBSA-N -1 3 360.776 3.506 20 0 FHADHM COc1cccc2cc(C(=O)O[C@H](C)c3ccc(-c4nnn[n-]4)cc3)oc21 ZINC000821877789 606345419 /nfs/dbraw/zinc/34/54/19/606345419.db2.gz VPWOTMFZNLJDNG-LLVKDONJSA-N -1 3 364.361 3.540 20 0 FHADHM COc1cccc2cc(C(=O)O[C@H](C)c3ccc(-c4nn[n-]n4)cc3)oc21 ZINC000821877789 606345420 /nfs/dbraw/zinc/34/54/20/606345420.db2.gz VPWOTMFZNLJDNG-LLVKDONJSA-N -1 3 364.361 3.540 20 0 FHADHM C[C@H](OC(=O)[C@@H]1CCSc2ccccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488465 606346087 /nfs/dbraw/zinc/34/60/87/606346087.db2.gz OKGDRZPNRCUYFX-BLLLJJGKSA-N -1 3 366.446 3.751 20 0 FHADHM C[C@H](OC(=O)[C@@H]1CCSc2ccccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488465 606346088 /nfs/dbraw/zinc/34/60/88/606346088.db2.gz OKGDRZPNRCUYFX-BLLLJJGKSA-N -1 3 366.446 3.751 20 0 FHADHM CCCc1nc(C)c(C(=O)O[C@H](C)c2ccc(-c3nnn[n-]3)cc2)s1 ZINC000821141995 606349888 /nfs/dbraw/zinc/34/98/88/606349888.db2.gz BDSMOZJRLPIXFD-LLVKDONJSA-N -1 3 357.439 3.502 20 0 FHADHM CCCc1nc(C)c(C(=O)O[C@H](C)c2ccc(-c3nn[n-]n3)cc2)s1 ZINC000821141995 606349889 /nfs/dbraw/zinc/34/98/89/606349889.db2.gz BDSMOZJRLPIXFD-LLVKDONJSA-N -1 3 357.439 3.502 20 0 FHADHM C[C@@H](CSc1ccccc1)C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820292824 606353847 /nfs/dbraw/zinc/35/38/47/606353847.db2.gz HSAQASXFPOXTLN-KBPBESRZSA-N -1 3 368.462 3.899 20 0 FHADHM C[C@@H](CSc1ccccc1)C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820292824 606353849 /nfs/dbraw/zinc/35/38/49/606353849.db2.gz HSAQASXFPOXTLN-KBPBESRZSA-N -1 3 368.462 3.899 20 0 FHADHM CC(F)(F)CCC(=O)Oc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000820306992 606358755 /nfs/dbraw/zinc/35/87/55/606358755.db2.gz HXSTXLOYAADTSJ-UHFFFAOYSA-N -1 3 374.347 4.000 20 0 FHADHM CC(F)(F)CCC(=O)Oc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000820306992 606358757 /nfs/dbraw/zinc/35/87/57/606358757.db2.gz HXSTXLOYAADTSJ-UHFFFAOYSA-N -1 3 374.347 4.000 20 0 FHADHM C[C@H](OC(=O)[C@H]1C[C@@H]1c1cc(F)ccc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000820487750 606359332 /nfs/dbraw/zinc/35/93/32/606359332.db2.gz IKXLYOMIUFIWRP-JJMVLAAESA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@H]1C[C@@H]1c1cc(F)ccc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000820487750 606359334 /nfs/dbraw/zinc/35/93/34/606359334.db2.gz IKXLYOMIUFIWRP-JJMVLAAESA-N -1 3 370.359 3.553 20 0 FHADHM CSC[C@H](C)C(=O)Oc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000821956454 606360188 /nfs/dbraw/zinc/36/01/88/606360188.db2.gz PDAFJAVIZVWXPP-LBPRGKRZSA-N -1 3 370.434 3.564 20 0 FHADHM CSC[C@H](C)C(=O)Oc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000821956454 606360190 /nfs/dbraw/zinc/36/01/90/606360190.db2.gz PDAFJAVIZVWXPP-LBPRGKRZSA-N -1 3 370.434 3.564 20 0 FHADHM CS/C=C/C(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1 ZINC000821956370 606363488 /nfs/dbraw/zinc/36/34/88/606363488.db2.gz NEVNKYLQQHTZTJ-CMDGGOBGSA-N -1 3 371.397 3.613 20 0 FHADHM CS/C=C/C(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1 ZINC000821956370 606363489 /nfs/dbraw/zinc/36/34/89/606363489.db2.gz NEVNKYLQQHTZTJ-CMDGGOBGSA-N -1 3 371.397 3.613 20 0 FHADHM Cc1sc(NC(=O)c2cnc3ccccc3c2C)c(-c2nnn[n-]2)c1C ZINC000822563927 606372632 /nfs/dbraw/zinc/37/26/32/606372632.db2.gz QFWPHCFTIKWNKK-UHFFFAOYSA-N -1 3 364.434 3.654 20 0 FHADHM Cc1sc(NC(=O)c2cnc3ccccc3c2C)c(-c2nn[n-]n2)c1C ZINC000822563927 606372634 /nfs/dbraw/zinc/37/26/34/606372634.db2.gz QFWPHCFTIKWNKK-UHFFFAOYSA-N -1 3 364.434 3.654 20 0 FHADHM Fc1cc2nc(C(Cl)=Cc3ccc(-c4nnn[n-]4)s3)[nH]c2cc1F ZINC000822754414 606390950 /nfs/dbraw/zinc/39/09/50/606390950.db2.gz ZOUCJQBOECUONX-CLTKARDFSA-N -1 3 364.768 3.820 20 0 FHADHM C[C@H](OC(=O)Cc1coc2cc(F)ccc12)c1cccc(-c2nnn[n-]2)c1 ZINC000820501120 606395068 /nfs/dbraw/zinc/39/50/68/606395068.db2.gz HTICRVAJSBBINF-NSHDSACASA-N -1 3 366.352 3.599 20 0 FHADHM C[C@H](OC(=O)Cc1coc2cc(F)ccc12)c1cccc(-c2nn[n-]n2)c1 ZINC000820501120 606395070 /nfs/dbraw/zinc/39/50/70/606395070.db2.gz HTICRVAJSBBINF-NSHDSACASA-N -1 3 366.352 3.599 20 0 FHADHM c1coc(COCc2cccc(NCc3ccc(-c4nnn[n-]4)s3)c2)c1 ZINC000823751281 606412377 /nfs/dbraw/zinc/41/23/77/606412377.db2.gz DHGILKNKIGCCAL-UHFFFAOYSA-N -1 3 367.434 3.850 20 0 FHADHM Fc1cc(F)c(F)c(CNc2ccc(-c3nnn[n-]3)c(Cl)c2)c1F ZINC000822754346 606431413 /nfs/dbraw/zinc/43/14/13/606431413.db2.gz ZCUDEXWERJGBOG-UHFFFAOYSA-N -1 3 357.698 3.689 20 0 FHADHM Fc1cc(F)c(F)c(CNc2ccc(-c3nn[n-]n3)c(Cl)c2)c1F ZINC000822754346 606431415 /nfs/dbraw/zinc/43/14/15/606431415.db2.gz ZCUDEXWERJGBOG-UHFFFAOYSA-N -1 3 357.698 3.689 20 0 FHADHM O=C(c1sccc1-c1nnn[n-]1)N1CC=C(c2ccc(Cl)cc2)CC1 ZINC000823498347 606450593 /nfs/dbraw/zinc/45/05/93/606450593.db2.gz LYROOKDUDMIEAJ-UHFFFAOYSA-N -1 3 371.853 3.511 20 0 FHADHM O=C(c1sccc1-c1nn[n-]n1)N1CC=C(c2ccc(Cl)cc2)CC1 ZINC000823498347 606450595 /nfs/dbraw/zinc/45/05/95/606450595.db2.gz LYROOKDUDMIEAJ-UHFFFAOYSA-N -1 3 371.853 3.511 20 0 FHADHM Cc1oc(-c2cccs2)nc1CNc1cc(-c2nnn[n-]2)ccc1C ZINC000822221353 606454523 /nfs/dbraw/zinc/45/45/23/606454523.db2.gz LLCLASDGELSRDC-UHFFFAOYSA-N -1 3 352.423 3.812 20 0 FHADHM Cc1oc(-c2cccs2)nc1CNc1cc(-c2nn[n-]n2)ccc1C ZINC000822221353 606454525 /nfs/dbraw/zinc/45/45/25/606454525.db2.gz LLCLASDGELSRDC-UHFFFAOYSA-N -1 3 352.423 3.812 20 0 FHADHM O=C(OC(c1ccccc1)c1ccccc1)c1cc(-c2nnn[n-]2)cs1 ZINC000823392161 606463592 /nfs/dbraw/zinc/46/35/92/606463592.db2.gz MBGROVXADMTTSL-UHFFFAOYSA-N -1 3 362.414 3.875 20 0 FHADHM O=C(OC(c1ccccc1)c1ccccc1)c1cc(-c2nn[n-]n2)cs1 ZINC000823392161 606463594 /nfs/dbraw/zinc/46/35/94/606463594.db2.gz MBGROVXADMTTSL-UHFFFAOYSA-N -1 3 362.414 3.875 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccc2ccccc2n1)c1cccc(-c2nnn[n-]2)c1 ZINC000820487772 606464794 /nfs/dbraw/zinc/46/47/94/606464794.db2.gz IQKPAZAMIHHKMA-GCZGRYASSA-N -1 3 371.400 3.733 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccc2ccccc2n1)c1cccc(-c2nn[n-]n2)c1 ZINC000820487772 606464797 /nfs/dbraw/zinc/46/47/97/606464797.db2.gz IQKPAZAMIHHKMA-GCZGRYASSA-N -1 3 371.400 3.733 20 0 FHADHM FC(F)Oc1cccc(CSc2ncc(-c3nnn[n-]3)cc2Cl)c1 ZINC000822737268 606475198 /nfs/dbraw/zinc/47/51/98/606475198.db2.gz SGCVUAANGNYARN-UHFFFAOYSA-N -1 3 369.784 3.809 20 0 FHADHM FC(F)Oc1cccc(CSc2ncc(-c3nn[n-]n3)cc2Cl)c1 ZINC000822737268 606475200 /nfs/dbraw/zinc/47/52/00/606475200.db2.gz SGCVUAANGNYARN-UHFFFAOYSA-N -1 3 369.784 3.809 20 0 FHADHM Cc1cc(C)c(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCCC3)o1 ZINC000822194215 606489191 /nfs/dbraw/zinc/48/91/91/606489191.db2.gz NPUYDFOZICHUGX-UHFFFAOYSA-N -1 3 357.439 3.659 20 0 FHADHM Cc1cc(C)c(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCCC3)o1 ZINC000822194215 606489192 /nfs/dbraw/zinc/48/91/92/606489192.db2.gz NPUYDFOZICHUGX-UHFFFAOYSA-N -1 3 357.439 3.659 20 0 FHADHM CCCCN(C(=O)c1cc(-c2nnn[n-]2)cs1)[C@H](C)c1ccccc1 ZINC000821061101 606492035 /nfs/dbraw/zinc/49/20/35/606492035.db2.gz MYJIFISGWHVEOK-CYBMUJFWSA-N -1 3 355.467 3.932 20 0 FHADHM CCCCN(C(=O)c1cc(-c2nn[n-]n2)cs1)[C@H](C)c1ccccc1 ZINC000821061101 606492036 /nfs/dbraw/zinc/49/20/36/606492036.db2.gz MYJIFISGWHVEOK-CYBMUJFWSA-N -1 3 355.467 3.932 20 0 FHADHM CCCCN(C(=O)c1cc(-c2nnn[n-]2)cs1)[C@@H](C)c1ccc(C)o1 ZINC000821062329 606492122 /nfs/dbraw/zinc/49/21/22/606492122.db2.gz WRETVUSHRSQCFC-LBPRGKRZSA-N -1 3 359.455 3.833 20 0 FHADHM CCCCN(C(=O)c1cc(-c2nn[n-]n2)cs1)[C@@H](C)c1ccc(C)o1 ZINC000821062329 606492124 /nfs/dbraw/zinc/49/21/24/606492124.db2.gz WRETVUSHRSQCFC-LBPRGKRZSA-N -1 3 359.455 3.833 20 0 FHADHM O=C(Cc1cccc(-c2nnn[n-]2)c1)N(Cc1ccccc1)c1ccccc1 ZINC000823087160 606492424 /nfs/dbraw/zinc/49/24/24/606492424.db2.gz INSWXXYMYGOIHF-UHFFFAOYSA-N -1 3 369.428 3.643 20 0 FHADHM O=C(Cc1cccc(-c2nn[n-]n2)c1)N(Cc1ccccc1)c1ccccc1 ZINC000823087160 606492426 /nfs/dbraw/zinc/49/24/26/606492426.db2.gz INSWXXYMYGOIHF-UHFFFAOYSA-N -1 3 369.428 3.643 20 0 FHADHM CCN(C(=O)c1cc(-c2nnn[n-]2)cs1)[C@@H](C)c1cc2ccccc2o1 ZINC000821154170 606497245 /nfs/dbraw/zinc/49/72/45/606497245.db2.gz KPARMBSJUNBZFE-NSHDSACASA-N -1 3 367.434 3.898 20 0 FHADHM CCN(C(=O)c1cc(-c2nn[n-]n2)cs1)[C@@H](C)c1cc2ccccc2o1 ZINC000821154170 606497247 /nfs/dbraw/zinc/49/72/47/606497247.db2.gz KPARMBSJUNBZFE-NSHDSACASA-N -1 3 367.434 3.898 20 0 FHADHM Cc1cc(-c2csc(NC(=O)c3cc(-c4nnn[n-]4)cs3)n2)c(C)o1 ZINC000822128450 606498121 /nfs/dbraw/zinc/49/81/21/606498121.db2.gz CHJKJLBUXLLVIC-UHFFFAOYSA-N -1 3 372.435 3.514 20 0 FHADHM Cc1cc(-c2csc(NC(=O)c3cc(-c4nn[n-]n4)cs3)n2)c(C)o1 ZINC000822128450 606498122 /nfs/dbraw/zinc/49/81/22/606498122.db2.gz CHJKJLBUXLLVIC-UHFFFAOYSA-N -1 3 372.435 3.514 20 0 FHADHM C[C@@H](NC(=O)c1cc(-c2nnn[n-]2)cs1)c1cc2ccccc2s1 ZINC000820390188 606508814 /nfs/dbraw/zinc/50/88/14/606508814.db2.gz FXAFESGDDKETGU-SECBINFHSA-N -1 3 355.448 3.634 20 0 FHADHM C[C@@H](NC(=O)c1cc(-c2nn[n-]n2)cs1)c1cc2ccccc2s1 ZINC000820390188 606508817 /nfs/dbraw/zinc/50/88/17/606508817.db2.gz FXAFESGDDKETGU-SECBINFHSA-N -1 3 355.448 3.634 20 0 FHADHM CCc1ccc([C@@H]2CCCCCN2C(=O)c2cc(-c3nnn[n-]3)cs2)o1 ZINC000821481573 606516386 /nfs/dbraw/zinc/51/63/86/606516386.db2.gz LJDCQXWNELCPMV-AWEZNQCLSA-N -1 3 371.466 3.841 20 0 FHADHM CCc1ccc([C@@H]2CCCCCN2C(=O)c2cc(-c3nn[n-]n3)cs2)o1 ZINC000821481573 606516387 /nfs/dbraw/zinc/51/63/87/606516387.db2.gz LJDCQXWNELCPMV-AWEZNQCLSA-N -1 3 371.466 3.841 20 0 FHADHM Cc1ccc([C@@H]2CCC[C@H]2N(C)C(=O)c2cc(-c3nnn[n-]3)cs2)cc1 ZINC000822232945 606519714 /nfs/dbraw/zinc/51/97/14/606519714.db2.gz FDQNKUKHWREQDW-JKSUJKDBSA-N -1 3 367.478 3.645 20 0 FHADHM Cc1ccc([C@@H]2CCC[C@H]2N(C)C(=O)c2cc(-c3nn[n-]n3)cs2)cc1 ZINC000822232945 606519716 /nfs/dbraw/zinc/51/97/16/606519716.db2.gz FDQNKUKHWREQDW-JKSUJKDBSA-N -1 3 367.478 3.645 20 0 FHADHM O=C(Cc1cccc(-c2nnn[n-]2)c1)Nc1ccc(Nc2ccccc2)cc1 ZINC000823103238 606523615 /nfs/dbraw/zinc/52/36/15/606523615.db2.gz BALCVMNNGALJIQ-UHFFFAOYSA-N -1 3 370.416 3.792 20 0 FHADHM O=C(Cc1cccc(-c2nn[n-]n2)c1)Nc1ccc(Nc2ccccc2)cc1 ZINC000823103238 606523617 /nfs/dbraw/zinc/52/36/17/606523617.db2.gz BALCVMNNGALJIQ-UHFFFAOYSA-N -1 3 370.416 3.792 20 0 FHADHM Cc1ccc(C(F)(F)F)cc1NC(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000822230719 606524702 /nfs/dbraw/zinc/52/47/02/606524702.db2.gz OGDSBDQOVXEIKB-UHFFFAOYSA-N -1 3 353.329 3.508 20 0 FHADHM Cc1ccc(C(F)(F)F)cc1NC(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000822230719 606524704 /nfs/dbraw/zinc/52/47/04/606524704.db2.gz OGDSBDQOVXEIKB-UHFFFAOYSA-N -1 3 353.329 3.508 20 0 FHADHM O=C(Cc1cccc(-c2nnn[n-]2)c1)Nc1cccc(Nc2ccccc2)c1 ZINC000823108439 606559077 /nfs/dbraw/zinc/55/90/77/606559077.db2.gz NFLFDXIPFOUXCF-UHFFFAOYSA-N -1 3 370.416 3.792 20 0 FHADHM O=C(Cc1cccc(-c2nn[n-]n2)c1)Nc1cccc(Nc2ccccc2)c1 ZINC000823108439 606559078 /nfs/dbraw/zinc/55/90/78/606559078.db2.gz NFLFDXIPFOUXCF-UHFFFAOYSA-N -1 3 370.416 3.792 20 0 FHADHM O=C(OCCSc1ccc(Cl)cc1)c1cc(-c2nnn[n-]2)cs1 ZINC000823410455 606562818 /nfs/dbraw/zinc/56/28/18/606562818.db2.gz WMWWUFQYKBAPIG-UHFFFAOYSA-N -1 3 366.855 3.531 20 0 FHADHM O=C(OCCSc1ccc(Cl)cc1)c1cc(-c2nn[n-]n2)cs1 ZINC000823410455 606562820 /nfs/dbraw/zinc/56/28/20/606562820.db2.gz WMWWUFQYKBAPIG-UHFFFAOYSA-N -1 3 366.855 3.531 20 0 FHADHM CC1CC(NC(=O)Nc2ccc(Oc3ccccc3-c3nnn[n-]3)cc2)C1 ZINC000820657959 606574369 /nfs/dbraw/zinc/57/43/69/606574369.db2.gz NTWJUPTXLKNNST-UHFFFAOYSA-N -1 3 364.409 3.579 20 0 FHADHM CC1CC(NC(=O)Nc2ccc(Oc3ccccc3-c3nn[n-]n3)cc2)C1 ZINC000820657959 606574371 /nfs/dbraw/zinc/57/43/71/606574371.db2.gz NTWJUPTXLKNNST-UHFFFAOYSA-N -1 3 364.409 3.579 20 0 FHADHM FC(F)(F)[C@@H]1CCC[C@H](CNc2ncc(-c3nnn[n-]3)cc2Cl)C1 ZINC000822714489 606595268 /nfs/dbraw/zinc/59/52/68/606595268.db2.gz NVSLEEUAVXDXMN-WCBMZHEXSA-N -1 3 360.771 3.696 20 0 FHADHM FC(F)(F)[C@@H]1CCC[C@H](CNc2ncc(-c3nn[n-]n3)cc2Cl)C1 ZINC000822714489 606595269 /nfs/dbraw/zinc/59/52/69/606595269.db2.gz NVSLEEUAVXDXMN-WCBMZHEXSA-N -1 3 360.771 3.696 20 0 FHADHM FC(F)(F)[C@H]1CCC[C@@H](CNc2nc3c(cc2-c2nnn[n-]2)CCC3)C1 ZINC000822714956 606595612 /nfs/dbraw/zinc/59/56/12/606595612.db2.gz XOZKOSRAQWBJPG-PWSUYJOCSA-N -1 3 366.391 3.531 20 0 FHADHM FC(F)(F)[C@H]1CCC[C@@H](CNc2nc3c(cc2-c2nn[n-]n2)CCC3)C1 ZINC000822714956 606595614 /nfs/dbraw/zinc/59/56/14/606595614.db2.gz XOZKOSRAQWBJPG-PWSUYJOCSA-N -1 3 366.391 3.531 20 0 FHADHM COc1cccc([C@@H](C)CC(=O)Nc2sc(C)c(C)c2-c2nnn[n-]2)c1 ZINC000821859622 606601130 /nfs/dbraw/zinc/60/11/30/606601130.db2.gz REXWANKEUMWWKQ-JTQLQIEISA-N -1 3 371.466 3.686 20 0 FHADHM COc1cccc([C@@H](C)CC(=O)Nc2sc(C)c(C)c2-c2nn[n-]n2)c1 ZINC000821859622 606601131 /nfs/dbraw/zinc/60/11/31/606601131.db2.gz REXWANKEUMWWKQ-JTQLQIEISA-N -1 3 371.466 3.686 20 0 FHADHM C[C@H](NC(=O)c1cc2cccc(Cl)c2o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820390310 606602279 /nfs/dbraw/zinc/60/22/79/606602279.db2.gz GXQMFXAOZOXILY-JTQLQIEISA-N -1 3 367.796 3.757 20 0 FHADHM C[C@H](NC(=O)c1cc2cccc(Cl)c2o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820390310 606602280 /nfs/dbraw/zinc/60/22/80/606602280.db2.gz GXQMFXAOZOXILY-JTQLQIEISA-N -1 3 367.796 3.757 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@H](C)c1ccc2ccccc2c1 ZINC000821756337 606602640 /nfs/dbraw/zinc/60/26/40/606602640.db2.gz NRKWVIXCJQHHHT-CYBMUJFWSA-N -1 3 373.416 3.771 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@H](C)c1ccc2ccccc2c1 ZINC000821756337 606602641 /nfs/dbraw/zinc/60/26/41/606602641.db2.gz NRKWVIXCJQHHHT-CYBMUJFWSA-N -1 3 373.416 3.771 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1)c1ccc(Cl)s1 ZINC000819866636 606624027 /nfs/dbraw/zinc/62/40/27/606624027.db2.gz ONDTXMLQXYYWOH-SSDOTTSWSA-N -1 3 368.249 3.977 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1)c1ccc(Cl)s1 ZINC000819866636 606624028 /nfs/dbraw/zinc/62/40/28/606624028.db2.gz ONDTXMLQXYYWOH-SSDOTTSWSA-N -1 3 368.249 3.977 20 0 FHADHM CC1(C(=O)Nc2cccc(OCc3cccc(-c4nnn[n-]4)c3)c2)CCC1 ZINC000820576955 606627590 /nfs/dbraw/zinc/62/75/90/606627590.db2.gz DNRLNZCMUWSRSO-UHFFFAOYSA-N -1 3 363.421 3.574 20 0 FHADHM CC1(C(=O)Nc2cccc(OCc3cccc(-c4nn[n-]n4)c3)c2)CCC1 ZINC000820576955 606627592 /nfs/dbraw/zinc/62/75/92/606627592.db2.gz DNRLNZCMUWSRSO-UHFFFAOYSA-N -1 3 363.421 3.574 20 0 FHADHM COc1c(C)cnc(CSc2ccc(Cl)cc2-c2nnn[n-]2)c1C ZINC000821698539 606631178 /nfs/dbraw/zinc/63/11/78/606631178.db2.gz NVYALBLLUBEKCT-UHFFFAOYSA-N -1 3 361.858 3.833 20 0 FHADHM COc1c(C)cnc(CSc2ccc(Cl)cc2-c2nn[n-]n2)c1C ZINC000821698539 606631181 /nfs/dbraw/zinc/63/11/81/606631181.db2.gz NVYALBLLUBEKCT-UHFFFAOYSA-N -1 3 361.858 3.833 20 0 FHADHM CC1(C(=O)Nc2ccc(OCc3cccc(-c4nnn[n-]4)c3)cc2)CCC1 ZINC000820576912 606631193 /nfs/dbraw/zinc/63/11/93/606631193.db2.gz CEXPWSAXEIPPNK-UHFFFAOYSA-N -1 3 363.421 3.574 20 0 FHADHM CC1(C(=O)Nc2ccc(OCc3cccc(-c4nn[n-]n4)c3)cc2)CCC1 ZINC000820576912 606631194 /nfs/dbraw/zinc/63/11/94/606631194.db2.gz CEXPWSAXEIPPNK-UHFFFAOYSA-N -1 3 363.421 3.574 20 0 FHADHM CC(C)c1ccc(-c2noc(CNc3cccc(-c4nnn[n-]4)c3)n2)cc1 ZINC000820187491 606659895 /nfs/dbraw/zinc/65/98/95/606659895.db2.gz DIXQNPCLFYCVFA-UHFFFAOYSA-N -1 3 361.409 3.652 20 0 FHADHM CC(C)c1ccc(-c2noc(CNc3cccc(-c4nn[n-]n4)c3)n2)cc1 ZINC000820187491 606659896 /nfs/dbraw/zinc/65/98/96/606659896.db2.gz DIXQNPCLFYCVFA-UHFFFAOYSA-N -1 3 361.409 3.652 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CC[C@@H]1c1ccc(Cl)cc1 ZINC000822217805 606660720 /nfs/dbraw/zinc/66/07/20/606660720.db2.gz NYHFWWBJZMNSFF-MRXNPFEDSA-N -1 3 368.828 3.807 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CC[C@@H]1c1ccc(Cl)cc1 ZINC000822217805 606660721 /nfs/dbraw/zinc/66/07/21/606660721.db2.gz NYHFWWBJZMNSFF-MRXNPFEDSA-N -1 3 368.828 3.807 20 0 FHADHM O=C(Nc1ccc(Cl)c(Cl)c1)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000823332631 606661448 /nfs/dbraw/zinc/66/14/48/606661448.db2.gz PLTAIRLAFUXXRG-UHFFFAOYSA-N -1 3 370.146 3.704 20 0 FHADHM O=C(Nc1ccc(Cl)c(Cl)c1)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000823332631 606661449 /nfs/dbraw/zinc/66/14/49/606661449.db2.gz PLTAIRLAFUXXRG-UHFFFAOYSA-N -1 3 370.146 3.704 20 0 FHADHM CC(C)C[C@H](C)OCCC(=O)N(CC(C)C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820057120 606669969 /nfs/dbraw/zinc/66/99/69/606669969.db2.gz WWEPEXQNKURONQ-INIZCTEOSA-N -1 3 373.501 3.697 20 0 FHADHM CC(C)C[C@H](C)OCCC(=O)N(CC(C)C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820057120 606669970 /nfs/dbraw/zinc/66/99/70/606669970.db2.gz WWEPEXQNKURONQ-INIZCTEOSA-N -1 3 373.501 3.697 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H]2C[C@H]2Cc2ccccc2)c1-c1nnn[n-]1 ZINC000821465751 606676880 /nfs/dbraw/zinc/67/68/80/606676880.db2.gz NTFQBURRYHYBEZ-UKRRQHHQSA-N -1 3 367.478 3.616 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H]2C[C@H]2Cc2ccccc2)c1-c1nn[n-]n1 ZINC000821465751 606676881 /nfs/dbraw/zinc/67/68/81/606676881.db2.gz NTFQBURRYHYBEZ-UKRRQHHQSA-N -1 3 367.478 3.616 20 0 FHADHM CC(C)C[C@@H]1CCCCCN1C(=O)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000820063153 606681728 /nfs/dbraw/zinc/68/17/28/606681728.db2.gz RRJYNQNPYAHEJN-ZDUSSCGKSA-N -1 3 363.412 3.576 20 0 FHADHM CC(C)C[C@@H]1CCCCCN1C(=O)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000820063153 606681729 /nfs/dbraw/zinc/68/17/29/606681729.db2.gz RRJYNQNPYAHEJN-ZDUSSCGKSA-N -1 3 363.412 3.576 20 0 FHADHM Cc1cc(C)cc(CS[C@@H](C)C(=O)Nc2ccccc2-c2nnn[n-]2)c1 ZINC000822196880 606706577 /nfs/dbraw/zinc/70/65/77/606706577.db2.gz ZVRWJKGMGGSYPJ-AWEZNQCLSA-N -1 3 367.478 3.744 20 0 FHADHM Cc1cc(C)cc(CS[C@@H](C)C(=O)Nc2ccccc2-c2nn[n-]n2)c1 ZINC000822196880 606706579 /nfs/dbraw/zinc/70/65/79/606706579.db2.gz ZVRWJKGMGGSYPJ-AWEZNQCLSA-N -1 3 367.478 3.744 20 0 FHADHM Cc1ccc([C@@H](C)Nc2nc(C(F)(F)F)ccc2-c2nnn[n-]2)cc1F ZINC000822229135 606733212 /nfs/dbraw/zinc/73/32/12/606733212.db2.gz NSHSJCGRAOLKHI-SECBINFHSA-N -1 3 366.322 3.901 20 0 FHADHM Cc1ccc([C@@H](C)Nc2nc(C(F)(F)F)ccc2-c2nn[n-]n2)cc1F ZINC000822229135 606733213 /nfs/dbraw/zinc/73/32/13/606733213.db2.gz NSHSJCGRAOLKHI-SECBINFHSA-N -1 3 366.322 3.901 20 0 FHADHM C[C@H](OC1CCCCCC1)C(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820519231 606759345 /nfs/dbraw/zinc/75/93/45/606759345.db2.gz QTKAGTPUKNDVOT-KBPBESRZSA-N -1 3 358.442 3.599 20 0 FHADHM C[C@H](OC1CCCCCC1)C(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820519231 606759347 /nfs/dbraw/zinc/75/93/47/606759347.db2.gz QTKAGTPUKNDVOT-KBPBESRZSA-N -1 3 358.442 3.599 20 0 FHADHM C[C@@H](OC1CCCCCC1)C(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820519289 606759456 /nfs/dbraw/zinc/75/94/56/606759456.db2.gz QTKAGTPUKNDVOT-ZIAGYGMSSA-N -1 3 358.442 3.599 20 0 FHADHM C[C@@H](OC1CCCCCC1)C(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820519289 606759458 /nfs/dbraw/zinc/75/94/58/606759458.db2.gz QTKAGTPUKNDVOT-ZIAGYGMSSA-N -1 3 358.442 3.599 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(OCc2coc(-c3cccs3)n2)c1 ZINC000822574190 606781573 /nfs/dbraw/zinc/78/15/73/606781573.db2.gz PSJLFIVWRODXJB-UHFFFAOYSA-N -1 3 359.798 3.816 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(OCc2coc(-c3cccs3)n2)c1 ZINC000822574190 606781574 /nfs/dbraw/zinc/78/15/74/606781574.db2.gz PSJLFIVWRODXJB-UHFFFAOYSA-N -1 3 359.798 3.816 20 0 FHADHM Cc1ccc(C)c([C@@H]2CCCN2C(=O)Nc2cccc(-c3nnn[n-]3)c2)c1 ZINC000822230724 606783262 /nfs/dbraw/zinc/78/32/62/606783262.db2.gz OLPYGDNEARWXNF-SFHVURJKSA-N -1 3 362.437 3.853 20 0 FHADHM Cc1ccc(C)c([C@@H]2CCCN2C(=O)Nc2cccc(-c3nn[n-]n3)c2)c1 ZINC000822230724 606783264 /nfs/dbraw/zinc/78/32/64/606783264.db2.gz OLPYGDNEARWXNF-SFHVURJKSA-N -1 3 362.437 3.853 20 0 FHADHM CCCC[C@@H](NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)C1CCC1 ZINC000821043685 606794806 /nfs/dbraw/zinc/79/48/06/606794806.db2.gz SPIWEMWHEQWDHB-CXAGYDPISA-N -1 3 356.474 3.586 20 0 FHADHM CCCC[C@@H](NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)C1CCC1 ZINC000821043685 606794808 /nfs/dbraw/zinc/79/48/08/606794808.db2.gz SPIWEMWHEQWDHB-CXAGYDPISA-N -1 3 356.474 3.586 20 0 FHADHM Fc1ccccc1C=C1CCN(c2ncc(-c3nnn[n-]3)cc2Cl)CC1 ZINC000822795465 606802966 /nfs/dbraw/zinc/80/29/66/606802966.db2.gz BJAVMLXYKDVOBU-UHFFFAOYSA-N -1 3 370.819 3.738 20 0 FHADHM Fc1ccccc1C=C1CCN(c2ncc(-c3nn[n-]n3)cc2Cl)CC1 ZINC000822795465 606802967 /nfs/dbraw/zinc/80/29/67/606802967.db2.gz BJAVMLXYKDVOBU-UHFFFAOYSA-N -1 3 370.819 3.738 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)Cc2ccc(C)cc2Cl)s1 ZINC000821465801 606810624 /nfs/dbraw/zinc/81/06/24/606810624.db2.gz PYRYVVVSSZAWHG-UHFFFAOYSA-N -1 3 361.858 3.634 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)Cc2ccc(C)cc2Cl)s1 ZINC000821465801 606810626 /nfs/dbraw/zinc/81/06/26/606810626.db2.gz PYRYVVVSSZAWHG-UHFFFAOYSA-N -1 3 361.858 3.634 20 0 FHADHM O=C(Nc1ccccc1CCC(F)(F)F)c1cc(-c2nnn[n-]2)cs1 ZINC000823373139 606816976 /nfs/dbraw/zinc/81/69/76/606816976.db2.gz RIPNDSXSEQSQAP-UHFFFAOYSA-N -1 3 367.356 3.675 20 0 FHADHM O=C(Nc1ccccc1CCC(F)(F)F)c1cc(-c2nn[n-]n2)cs1 ZINC000823373139 606816977 /nfs/dbraw/zinc/81/69/77/606816977.db2.gz RIPNDSXSEQSQAP-UHFFFAOYSA-N -1 3 367.356 3.675 20 0 FHADHM O[C@@H](COc1ccc(-c2ccccc2)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000823690769 606853565 /nfs/dbraw/zinc/85/35/65/606853565.db2.gz UAARVUZDQROQOR-FQEVSTJZSA-N -1 3 358.401 3.646 20 0 FHADHM O[C@@H](COc1ccc(-c2ccccc2)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000823690769 606853570 /nfs/dbraw/zinc/85/35/70/606853570.db2.gz UAARVUZDQROQOR-FQEVSTJZSA-N -1 3 358.401 3.646 20 0 FHADHM O=C(Cc1ccc(-c2nnn[n-]2)cc1)N(c1ccc(F)cc1)C1CCCC1 ZINC000823073776 606856109 /nfs/dbraw/zinc/85/61/09/606856109.db2.gz BPJXJUUDOXEJQD-UHFFFAOYSA-N -1 3 365.412 3.524 20 0 FHADHM O=C(Cc1ccc(-c2nn[n-]n2)cc1)N(c1ccc(F)cc1)C1CCCC1 ZINC000823073776 606856111 /nfs/dbraw/zinc/85/61/11/606856111.db2.gz BPJXJUUDOXEJQD-UHFFFAOYSA-N -1 3 365.412 3.524 20 0 FHADHM c1ccc2c(c1)CC(SCCCOc1cccc(-c3nnn[n-]3)c1)=N2 ZINC000823762099 606867781 /nfs/dbraw/zinc/86/77/81/606867781.db2.gz INKKQLRAZMYQOD-UHFFFAOYSA-N -1 3 351.435 3.655 20 0 FHADHM c1ccc2c(c1)CC(SCCCOc1cccc(-c3nn[n-]n3)c1)=N2 ZINC000823762099 606867782 /nfs/dbraw/zinc/86/77/82/606867782.db2.gz INKKQLRAZMYQOD-UHFFFAOYSA-N -1 3 351.435 3.655 20 0 FHADHM CC1(CNC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)CCCCC1 ZINC000820612430 606872299 /nfs/dbraw/zinc/87/22/99/606872299.db2.gz DKRQTHVZMRSNNC-UHFFFAOYSA-N -1 3 368.485 3.511 20 0 FHADHM CC1(CNC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)CCCCC1 ZINC000820612430 606872301 /nfs/dbraw/zinc/87/23/01/606872301.db2.gz DKRQTHVZMRSNNC-UHFFFAOYSA-N -1 3 368.485 3.511 20 0 FHADHM CN(Cc1nc(-c2ccccc2)c[nH]1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000821616729 606880169 /nfs/dbraw/zinc/88/01/69/606880169.db2.gz FFFNXBZIGIVMFJ-UHFFFAOYSA-N -1 3 365.828 3.547 20 0 FHADHM CN(Cc1nc(-c2ccccc2)c[nH]1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000821616729 606880170 /nfs/dbraw/zinc/88/01/70/606880170.db2.gz FFFNXBZIGIVMFJ-UHFFFAOYSA-N -1 3 365.828 3.547 20 0 FHADHM CC(C)C[C@H]1CCCCN1C(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000820062226 606880408 /nfs/dbraw/zinc/88/04/08/606880408.db2.gz KOKKRURBATWMIZ-QGZVFWFLSA-N -1 3 373.526 3.527 20 0 FHADHM CC(C)C[C@H]1CCCCN1C(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000820062226 606880410 /nfs/dbraw/zinc/88/04/10/606880410.db2.gz KOKKRURBATWMIZ-QGZVFWFLSA-N -1 3 373.526 3.527 20 0 FHADHM Fc1ccc(CNc2ccccc2OC2CCCC2)cc1-c1nnn[n-]1 ZINC000822771973 606927995 /nfs/dbraw/zinc/92/79/95/606927995.db2.gz NLJUVLJPFNCQRF-UHFFFAOYSA-N -1 3 353.401 3.939 20 0 FHADHM Fc1ccc(CNc2ccccc2OC2CCCC2)cc1-c1nn[n-]n1 ZINC000822771973 606927996 /nfs/dbraw/zinc/92/79/96/606927996.db2.gz NLJUVLJPFNCQRF-UHFFFAOYSA-N -1 3 353.401 3.939 20 0 FHADHM Cc1ccc(C(=O)N(C)c2cc(Cl)ccc2-c2nnn[n-]2)cc1Cl ZINC000822226083 606965206 /nfs/dbraw/zinc/96/52/06/606965206.db2.gz CAIUZSVWHFUAGG-UHFFFAOYSA-N -1 3 362.220 3.759 20 0 FHADHM Cc1ccc(C(=O)N(C)c2cc(Cl)ccc2-c2nn[n-]n2)cc1Cl ZINC000822226083 606965208 /nfs/dbraw/zinc/96/52/08/606965208.db2.gz CAIUZSVWHFUAGG-UHFFFAOYSA-N -1 3 362.220 3.759 20 0 FHADHM CC(C)c1ccc(NC(=O)C(C)(C)Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000820192482 606976501 /nfs/dbraw/zinc/97/65/01/606976501.db2.gz PZYYBHOJPOVLGP-UHFFFAOYSA-N -1 3 365.437 3.786 20 0 FHADHM CC(C)c1ccc(NC(=O)C(C)(C)Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000820192482 606976502 /nfs/dbraw/zinc/97/65/02/606976502.db2.gz PZYYBHOJPOVLGP-UHFFFAOYSA-N -1 3 365.437 3.786 20 0 FHADHM C[C@@H](NC(=O)c1ccc(-c2ccco2)s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820391992 606991714 /nfs/dbraw/zinc/99/17/14/606991714.db2.gz SHPAZCSKSVBIOI-LLVKDONJSA-N -1 3 365.418 3.679 20 0 FHADHM C[C@@H](NC(=O)c1ccc(-c2ccco2)s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820391992 606991715 /nfs/dbraw/zinc/99/17/15/606991715.db2.gz SHPAZCSKSVBIOI-LLVKDONJSA-N -1 3 365.418 3.679 20 0 FHADHM C[C@@H](C(=O)OCc1ccc(F)c(-c2nnn[n-]2)c1)c1cccc(Cl)c1 ZINC000819884211 607001607 /nfs/dbraw/zinc/00/16/07/607001607.db2.gz UHVTYPPCEJYWKE-SNVBAGLBSA-N -1 3 360.776 3.506 20 0 FHADHM C[C@@H](C(=O)OCc1ccc(F)c(-c2nn[n-]n2)c1)c1cccc(Cl)c1 ZINC000819884211 607001608 /nfs/dbraw/zinc/00/16/08/607001608.db2.gz UHVTYPPCEJYWKE-SNVBAGLBSA-N -1 3 360.776 3.506 20 0 FHADHM Fc1ccc(COc2ccc(Cl)c3cccnc23)cc1-c1nnn[n-]1 ZINC000822771326 607007352 /nfs/dbraw/zinc/00/73/52/607007352.db2.gz FXAFWYVJOPUMSI-UHFFFAOYSA-N -1 3 355.760 3.786 20 0 FHADHM Fc1ccc(COc2ccc(Cl)c3cccnc23)cc1-c1nn[n-]n1 ZINC000822771326 607007353 /nfs/dbraw/zinc/00/73/53/607007353.db2.gz FXAFWYVJOPUMSI-UHFFFAOYSA-N -1 3 355.760 3.786 20 0 FHADHM Brc1cc(CSc2cccc(-c3nnn[n-]3)c2)cs1 ZINC000819688313 607014428 /nfs/dbraw/zinc/01/44/28/607014428.db2.gz GIWQMJYKEQVSFN-UHFFFAOYSA-N -1 3 353.270 3.983 20 0 FHADHM Brc1cc(CSc2cccc(-c3nn[n-]n3)c2)cs1 ZINC000819688313 607014430 /nfs/dbraw/zinc/01/44/30/607014430.db2.gz GIWQMJYKEQVSFN-UHFFFAOYSA-N -1 3 353.270 3.983 20 0 FHADHM CC(C)[C@@H](Sc1cccc(-c2nnn[n-]2)c1)C(=O)Nc1ccccc1F ZINC000820031557 607016542 /nfs/dbraw/zinc/01/65/42/607016542.db2.gz FQFANPRPJBQWRF-MRXNPFEDSA-N -1 3 371.441 3.761 20 0 FHADHM CC(C)[C@@H](Sc1cccc(-c2nn[n-]n2)c1)C(=O)Nc1ccccc1F ZINC000820031557 607016544 /nfs/dbraw/zinc/01/65/44/607016544.db2.gz FQFANPRPJBQWRF-MRXNPFEDSA-N -1 3 371.441 3.761 20 0 FHADHM CCC[C@H](NC(=O)CSc1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000821021781 607016871 /nfs/dbraw/zinc/01/68/71/607016871.db2.gz OZOKFMCMBCFOGL-KRWDZBQOSA-N -1 3 367.478 3.616 20 0 FHADHM CCC[C@H](NC(=O)CSc1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000821021781 607016873 /nfs/dbraw/zinc/01/68/73/607016873.db2.gz OZOKFMCMBCFOGL-KRWDZBQOSA-N -1 3 367.478 3.616 20 0 FHADHM Cc1cn(CC(=O)Nc2c(C(C)C)cccc2C(C)C)cc1-c1nnn[n-]1 ZINC000822384074 607021638 /nfs/dbraw/zinc/02/16/38/607021638.db2.gz GVFZRYYDDQKQHB-UHFFFAOYSA-N -1 3 366.469 3.862 20 0 FHADHM Cc1cn(CC(=O)Nc2c(C(C)C)cccc2C(C)C)cc1-c1nn[n-]n1 ZINC000822384074 607021639 /nfs/dbraw/zinc/02/16/39/607021639.db2.gz GVFZRYYDDQKQHB-UHFFFAOYSA-N -1 3 366.469 3.862 20 0 FHADHM C[C@H](NC(=O)Cc1ccc(C(C)(C)C)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000820333778 607024344 /nfs/dbraw/zinc/02/43/44/607024344.db2.gz GCBFIUZEMQQEOI-AWEZNQCLSA-N -1 3 363.465 3.584 20 0 FHADHM C[C@H](NC(=O)Cc1ccc(C(C)(C)C)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000820333778 607024346 /nfs/dbraw/zinc/02/43/46/607024346.db2.gz GCBFIUZEMQQEOI-AWEZNQCLSA-N -1 3 363.465 3.584 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)C[C@@H]1CC[C@@H](C)C1 ZINC000820087756 607033924 /nfs/dbraw/zinc/03/39/24/607033924.db2.gz ZEPJXLBIXGRJQR-NVXWUHKLSA-N -1 3 355.486 3.678 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)C[C@@H]1CC[C@@H](C)C1 ZINC000820087756 607033926 /nfs/dbraw/zinc/03/39/26/607033926.db2.gz ZEPJXLBIXGRJQR-NVXWUHKLSA-N -1 3 355.486 3.678 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1ccc(Cl)cc1C ZINC000821123056 607045000 /nfs/dbraw/zinc/04/50/00/607045000.db2.gz JGAWUCPXDIJKGF-UHFFFAOYSA-N -1 3 370.844 3.903 20 0 FHADHM O=C(CCc1ccc(-c2nnn[n-]2)cc1)O[C@@H]1CCc2sc(Cl)cc21 ZINC000822978387 607094314 /nfs/dbraw/zinc/09/43/14/607094314.db2.gz IXRTYHLVFUADBU-CYBMUJFWSA-N -1 3 374.853 3.745 20 0 FHADHM O=C(CCc1ccc(-c2nn[n-]n2)cc1)O[C@@H]1CCc2sc(Cl)cc21 ZINC000822978387 607094315 /nfs/dbraw/zinc/09/43/15/607094315.db2.gz IXRTYHLVFUADBU-CYBMUJFWSA-N -1 3 374.853 3.745 20 0 FHADHM O=C(c1cc(-c2nnn[n-]2)cs1)N1CCc2cc(-c3ccccc3)ccc21 ZINC000823472245 607100756 /nfs/dbraw/zinc/10/07/56/607100756.db2.gz FRZYOFCTIRYBAP-UHFFFAOYSA-N -1 3 373.441 3.798 20 0 FHADHM O=C(c1cc(-c2nn[n-]n2)cs1)N1CCc2cc(-c3ccccc3)ccc21 ZINC000823472245 607100758 /nfs/dbraw/zinc/10/07/58/607100758.db2.gz FRZYOFCTIRYBAP-UHFFFAOYSA-N -1 3 373.441 3.798 20 0 FHADHM C[C@H]1CN(c2ccc(-c3nnn[n-]3)c(Cl)c2)C[C@@H](c2ccsc2)O1 ZINC000820768571 607115761 /nfs/dbraw/zinc/11/57/61/607115761.db2.gz ODCKUKXRWIDTNS-BONVTDFDSA-N -1 3 361.858 3.548 20 0 FHADHM C[C@H]1CN(c2ccc(-c3nn[n-]n3)c(Cl)c2)C[C@@H](c2ccsc2)O1 ZINC000820768571 607115762 /nfs/dbraw/zinc/11/57/62/607115762.db2.gz ODCKUKXRWIDTNS-BONVTDFDSA-N -1 3 361.858 3.548 20 0 FHADHM O=C(Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)[C@@H]1CC12CCC2 ZINC000823367200 607125938 /nfs/dbraw/zinc/12/59/38/607125938.db2.gz GAUNNEVKIMPVKX-KRWDZBQOSA-N -1 3 361.405 3.788 20 0 FHADHM O=C(Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)[C@@H]1CC12CCC2 ZINC000823367200 607125940 /nfs/dbraw/zinc/12/59/40/607125940.db2.gz GAUNNEVKIMPVKX-KRWDZBQOSA-N -1 3 361.405 3.788 20 0 FHADHM CC[C@@H](C)c1ccc(NC(=O)COc2ccc(-c3nnn[n-]3)cc2F)cc1 ZINC000820882669 607134007 /nfs/dbraw/zinc/13/40/07/607134007.db2.gz XFVQZQQNWLESSW-GFCCVEGCSA-N -1 3 369.400 3.537 20 0 FHADHM CC[C@@H](C)c1ccc(NC(=O)COc2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000820882669 607134009 /nfs/dbraw/zinc/13/40/09/607134009.db2.gz XFVQZQQNWLESSW-GFCCVEGCSA-N -1 3 369.400 3.537 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1OCc1csc(Cc2ccccc2)n1 ZINC000822748410 607136633 /nfs/dbraw/zinc/13/66/33/607136633.db2.gz XRYWVGOLQNBWRY-UHFFFAOYSA-N -1 3 367.409 3.632 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1OCc1csc(Cc2ccccc2)n1 ZINC000822748410 607136635 /nfs/dbraw/zinc/13/66/35/607136635.db2.gz XRYWVGOLQNBWRY-UHFFFAOYSA-N -1 3 367.409 3.632 20 0 FHADHM Fc1ccc(-c2nc(COc3ccc(-c4nnn[n-]4)cc3F)cs2)cc1 ZINC000822753998 607140401 /nfs/dbraw/zinc/14/04/01/607140401.db2.gz VRMKUGCFZXAVSX-UHFFFAOYSA-N -1 3 371.372 3.847 20 0 FHADHM Fc1ccc(-c2nc(COc3ccc(-c4nn[n-]n4)cc3F)cs2)cc1 ZINC000822753998 607140402 /nfs/dbraw/zinc/14/04/02/607140402.db2.gz VRMKUGCFZXAVSX-UHFFFAOYSA-N -1 3 371.372 3.847 20 0 FHADHM O=C(Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1)[C@@H]1CC12CCC2 ZINC000823383026 607144970 /nfs/dbraw/zinc/14/49/70/607144970.db2.gz JRMMSISYBIFXNA-ZDUSSCGKSA-N -1 3 351.435 3.724 20 0 FHADHM O=C(Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1)[C@@H]1CC12CCC2 ZINC000823383026 607144972 /nfs/dbraw/zinc/14/49/72/607144972.db2.gz JRMMSISYBIFXNA-ZDUSSCGKSA-N -1 3 351.435 3.724 20 0 FHADHM CCc1cc(C)c(C(=O)N(CC)[C@H](C)c2ccc(-c3nnn[n-]3)cc2)o1 ZINC000821471200 607157045 /nfs/dbraw/zinc/15/70/45/607157045.db2.gz WXHBEVDRQAHSTE-CYBMUJFWSA-N -1 3 353.426 3.554 20 0 FHADHM CCc1cc(C)c(C(=O)N(CC)[C@H](C)c2ccc(-c3nn[n-]n3)cc2)o1 ZINC000821471200 607157046 /nfs/dbraw/zinc/15/70/46/607157046.db2.gz WXHBEVDRQAHSTE-CYBMUJFWSA-N -1 3 353.426 3.554 20 0 FHADHM Cc1cccc(-c2cncc(C(=O)Nc3ccc(F)c(-c4nnn[n-]4)c3)c2)c1 ZINC000822283699 607177715 /nfs/dbraw/zinc/17/77/15/607177715.db2.gz AXSAGOQJQQTMJI-UHFFFAOYSA-N -1 3 374.379 3.629 20 0 FHADHM Cc1cccc(-c2cncc(C(=O)Nc3ccc(F)c(-c4nn[n-]n4)c3)c2)c1 ZINC000822283699 607177716 /nfs/dbraw/zinc/17/77/16/607177716.db2.gz AXSAGOQJQQTMJI-UHFFFAOYSA-N -1 3 374.379 3.629 20 0 FHADHM C[C@H](CC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccccc1F ZINC000820225461 607189870 /nfs/dbraw/zinc/18/98/70/607189870.db2.gz JKWJEGQJZSWLDB-SNVBAGLBSA-N -1 3 359.792 3.792 20 0 FHADHM C[C@H](CC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccccc1F ZINC000820225461 607189871 /nfs/dbraw/zinc/18/98/71/607189871.db2.gz JKWJEGQJZSWLDB-SNVBAGLBSA-N -1 3 359.792 3.792 20 0 FHADHM Cc1ccc(CCC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)c(C)c1 ZINC000822234787 607190017 /nfs/dbraw/zinc/19/00/17/607190017.db2.gz HMDMJVHGMZBOTJ-UHFFFAOYSA-N -1 3 355.829 3.708 20 0 FHADHM Cc1ccc(CCC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)c(C)c1 ZINC000822234787 607190018 /nfs/dbraw/zinc/19/00/18/607190018.db2.gz HMDMJVHGMZBOTJ-UHFFFAOYSA-N -1 3 355.829 3.708 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)c1cc2c(s1)CCCC2 ZINC000823318762 607190515 /nfs/dbraw/zinc/19/05/15/607190515.db2.gz JMGLZWFJJCDUKL-UHFFFAOYSA-N -1 3 359.842 3.713 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)c1cc2c(s1)CCCC2 ZINC000823318762 607190516 /nfs/dbraw/zinc/19/05/16/607190516.db2.gz JMGLZWFJJCDUKL-UHFFFAOYSA-N -1 3 359.842 3.713 20 0 FHADHM Cc1cccc([C@@H](C)CNC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)c1 ZINC000822288750 607196664 /nfs/dbraw/zinc/19/66/64/607196664.db2.gz IJDPYRNMTSDKAL-LBPRGKRZSA-N -1 3 370.844 3.754 20 0 FHADHM Cc1cccc([C@@H](C)CNC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)c1 ZINC000822288750 607196665 /nfs/dbraw/zinc/19/66/65/607196665.db2.gz IJDPYRNMTSDKAL-LBPRGKRZSA-N -1 3 370.844 3.754 20 0 FHADHM CCC(CC)CN(CC)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820893601 607197179 /nfs/dbraw/zinc/19/71/79/607197179.db2.gz SUCQCRNEHIRFIW-UHFFFAOYSA-N -1 3 350.854 3.810 20 0 FHADHM CCC(CC)CN(CC)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820893601 607197180 /nfs/dbraw/zinc/19/71/80/607197180.db2.gz SUCQCRNEHIRFIW-UHFFFAOYSA-N -1 3 350.854 3.810 20 0 FHADHM Cc1ccc([C@@H](C)CNC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000822228873 607201077 /nfs/dbraw/zinc/20/10/77/607201077.db2.gz HPHKKCYAGXPRDI-LBPRGKRZSA-N -1 3 370.844 3.754 20 0 FHADHM Cc1ccc([C@@H](C)CNC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000822228873 607201078 /nfs/dbraw/zinc/20/10/78/607201078.db2.gz HPHKKCYAGXPRDI-LBPRGKRZSA-N -1 3 370.844 3.754 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N1CCC[C@]2(CC=CCC2)C1 ZINC000823315345 607202130 /nfs/dbraw/zinc/20/21/30/607202130.db2.gz XKDFYBWIHZOHDW-GOSISDBHSA-N -1 3 372.860 3.874 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N1CCC[C@]2(CC=CCC2)C1 ZINC000823315345 607202131 /nfs/dbraw/zinc/20/21/31/607202131.db2.gz XKDFYBWIHZOHDW-GOSISDBHSA-N -1 3 372.860 3.874 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)NC1(c2ccccc2)CCC1 ZINC000823319330 607203041 /nfs/dbraw/zinc/20/30/41/607203041.db2.gz SGUZCRCFFQMWTQ-UHFFFAOYSA-N -1 3 368.828 3.721 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)NC1(c2ccccc2)CCC1 ZINC000823319330 607203042 /nfs/dbraw/zinc/20/30/42/607203042.db2.gz SGUZCRCFFQMWTQ-UHFFFAOYSA-N -1 3 368.828 3.721 20 0 FHADHM Cc1ccc2c(CC(=O)Nc3ccc(-c4nnn[n-]4)cc3Cl)coc2c1 ZINC000822274593 607241627 /nfs/dbraw/zinc/24/16/27/607241627.db2.gz BZZYHPVDESBXJN-UHFFFAOYSA-N -1 3 367.796 3.756 20 0 FHADHM Cc1ccc2c(CC(=O)Nc3ccc(-c4nn[n-]n4)cc3Cl)coc2c1 ZINC000822274593 607241628 /nfs/dbraw/zinc/24/16/28/607241628.db2.gz BZZYHPVDESBXJN-UHFFFAOYSA-N -1 3 367.796 3.756 20 0 FHADHM O=C(C=Cc1ccc(Cl)s1)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822929438 607242393 /nfs/dbraw/zinc/24/23/93/607242393.db2.gz UJIVOPPMFMJPPK-UTCJRWHESA-N -1 3 366.233 3.887 20 0 FHADHM O=C(C=Cc1ccc(Cl)s1)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822929438 607242394 /nfs/dbraw/zinc/24/23/94/607242394.db2.gz UJIVOPPMFMJPPK-UTCJRWHESA-N -1 3 366.233 3.887 20 0 FHADHM Cc1nc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCCC3)c(C)s1 ZINC000826323737 607783426 /nfs/dbraw/zinc/78/34/26/607783426.db2.gz PNBXOJRZHUWYKJ-UHFFFAOYSA-N -1 3 374.495 3.523 20 0 FHADHM Cc1nc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCCC3)c(C)s1 ZINC000826323737 607783427 /nfs/dbraw/zinc/78/34/27/607783427.db2.gz PNBXOJRZHUWYKJ-UHFFFAOYSA-N -1 3 374.495 3.523 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1OCc1coc(-c2c(F)cccc2F)n1 ZINC000826255026 607784026 /nfs/dbraw/zinc/78/40/26/607784026.db2.gz JBVIZYIBBNOKIP-UHFFFAOYSA-N -1 3 369.331 3.687 20 0 FHADHM Cc1c(C(=O)N(C)c2ccccc2-c2nnn[n-]2)oc2c1c(C)ccc2C ZINC000826284780 607789306 /nfs/dbraw/zinc/78/93/06/607789306.db2.gz FOTJSNAZADUEAC-UHFFFAOYSA-N -1 3 361.405 3.815 20 0 FHADHM Cc1c(C(=O)N(C)c2ccccc2-c2nn[n-]n2)oc2c1c(C)ccc2C ZINC000826284780 607789307 /nfs/dbraw/zinc/78/93/07/607789307.db2.gz FOTJSNAZADUEAC-UHFFFAOYSA-N -1 3 361.405 3.815 20 0 FHADHM CCN(C(=O)c1ccc(-c2ccco2)s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825379766 607797466 /nfs/dbraw/zinc/79/74/66/607797466.db2.gz KQZDLCIFZXNTLX-UHFFFAOYSA-N -1 3 365.418 3.855 20 0 FHADHM CCN(C(=O)c1ccc(-c2ccco2)s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825379766 607797467 /nfs/dbraw/zinc/79/74/67/607797467.db2.gz KQZDLCIFZXNTLX-UHFFFAOYSA-N -1 3 365.418 3.855 20 0 FHADHM CCN(C(=O)c1ccc(OCC(C)C)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825385682 607797797 /nfs/dbraw/zinc/79/77/97/607797797.db2.gz QJDCEEPGGIQHEY-UHFFFAOYSA-N -1 3 365.437 3.568 20 0 FHADHM CCN(C(=O)c1ccc(OCC(C)C)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825385682 607797798 /nfs/dbraw/zinc/79/77/98/607797798.db2.gz QJDCEEPGGIQHEY-UHFFFAOYSA-N -1 3 365.437 3.568 20 0 FHADHM CCN(C(=O)C[C@H]1CCCc2ccccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000825366546 607798192 /nfs/dbraw/zinc/79/81/92/607798192.db2.gz BQTRACSDWCVRQV-QGZVFWFLSA-N -1 3 361.449 3.730 20 0 FHADHM CCN(C(=O)C[C@H]1CCCc2ccccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000825366546 607798193 /nfs/dbraw/zinc/79/81/93/607798193.db2.gz BQTRACSDWCVRQV-QGZVFWFLSA-N -1 3 361.449 3.730 20 0 FHADHM CCN(C(=O)CCSc1ccc(F)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825372442 607799385 /nfs/dbraw/zinc/79/93/85/607799385.db2.gz YTWBYPDAIFJGQY-UHFFFAOYSA-N -1 3 371.441 3.541 20 0 FHADHM CCN(C(=O)CCSc1ccc(F)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825372442 607799386 /nfs/dbraw/zinc/79/93/86/607799386.db2.gz YTWBYPDAIFJGQY-UHFFFAOYSA-N -1 3 371.441 3.541 20 0 FHADHM CCN(C(=O)C[C@H](C)c1ccc(F)cc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000825367918 607799728 /nfs/dbraw/zinc/79/97/28/607799728.db2.gz XPIMPDDDZIBFMZ-LBPRGKRZSA-N -1 3 371.391 3.692 20 0 FHADHM CCN(C(=O)C[C@H](C)c1ccc(F)cc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000825367918 607799729 /nfs/dbraw/zinc/79/97/29/607799729.db2.gz XPIMPDDDZIBFMZ-LBPRGKRZSA-N -1 3 371.391 3.692 20 0 FHADHM CCN(C(=O)c1ccc(OC(C)(C)C)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825385543 607800800 /nfs/dbraw/zinc/80/08/00/607800800.db2.gz KDCZRQDYXTUAIQ-UHFFFAOYSA-N -1 3 365.437 3.711 20 0 FHADHM CCN(C(=O)c1ccc(OC(C)(C)C)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825385543 607800801 /nfs/dbraw/zinc/80/08/01/607800801.db2.gz KDCZRQDYXTUAIQ-UHFFFAOYSA-N -1 3 365.437 3.711 20 0 FHADHM Fc1ccc(N2CCC(Oc3ccccc3Cl)CC2)c(-c2nnn[n-]2)c1 ZINC000826375479 607820478 /nfs/dbraw/zinc/82/04/78/607820478.db2.gz PEQBUDSHHUOMBX-UHFFFAOYSA-N -1 3 373.819 3.707 20 0 FHADHM Fc1ccc(N2CCC(Oc3ccccc3Cl)CC2)c(-c2nn[n-]n2)c1 ZINC000826375479 607820479 /nfs/dbraw/zinc/82/04/79/607820479.db2.gz PEQBUDSHHUOMBX-UHFFFAOYSA-N -1 3 373.819 3.707 20 0 FHADHM C[C@H](Cc1ccccc1Cl)C(=O)N(C)c1ccc(-c2nnn[n-]2)cc1F ZINC000824457494 607826993 /nfs/dbraw/zinc/82/69/93/607826993.db2.gz NXNVHMKEKYMSEJ-LLVKDONJSA-N -1 3 373.819 3.501 20 0 FHADHM C[C@H](Cc1ccccc1Cl)C(=O)N(C)c1ccc(-c2nn[n-]n2)cc1F ZINC000824457494 607826994 /nfs/dbraw/zinc/82/69/94/607826994.db2.gz NXNVHMKEKYMSEJ-LLVKDONJSA-N -1 3 373.819 3.501 20 0 FHADHM CCc1cccc(NC(=O)c2c(Cl)cc(-c3nnn[n-]3)cc2Cl)c1 ZINC000825722486 607833542 /nfs/dbraw/zinc/83/35/42/607833542.db2.gz HVFPLQHTWJGJLX-UHFFFAOYSA-N -1 3 362.220 3.988 20 0 FHADHM CCc1cccc(NC(=O)c2c(Cl)cc(-c3nn[n-]n3)cc2Cl)c1 ZINC000825722486 607833543 /nfs/dbraw/zinc/83/35/43/607833543.db2.gz HVFPLQHTWJGJLX-UHFFFAOYSA-N -1 3 362.220 3.988 20 0 FHADHM COc1ccc([C@@H]2CCCN2c2ccc3cc(-c4nnn[n-]4)ccc3n2)cc1 ZINC000826189698 607838873 /nfs/dbraw/zinc/83/88/73/607838873.db2.gz BPIXZHLIUSRIDZ-IBGZPJMESA-N -1 3 372.432 3.765 20 0 FHADHM COc1ccc([C@@H]2CCCN2c2ccc3cc(-c4nn[n-]n4)ccc3n2)cc1 ZINC000826189698 607838874 /nfs/dbraw/zinc/83/88/74/607838874.db2.gz BPIXZHLIUSRIDZ-IBGZPJMESA-N -1 3 372.432 3.765 20 0 FHADHM O[C@H](CSc1ccc(-c2nnn[n-]2)cc1Cl)c1ccc(F)cc1F ZINC000826504829 607843448 /nfs/dbraw/zinc/84/34/48/607843448.db2.gz FTRHWXJBLJQIAK-CYBMUJFWSA-N -1 3 368.796 3.624 20 0 FHADHM O[C@H](CSc1ccc(-c2nn[n-]n2)cc1Cl)c1ccc(F)cc1F ZINC000826504829 607843449 /nfs/dbraw/zinc/84/34/49/607843449.db2.gz FTRHWXJBLJQIAK-CYBMUJFWSA-N -1 3 368.796 3.624 20 0 FHADHM CC(=O)Nc1cccc(CSc2ccc(-c3nnn[n-]3)cc2Cl)c1 ZINC000824004676 607844200 /nfs/dbraw/zinc/84/42/00/607844200.db2.gz CQFISXVHYSIKMJ-UHFFFAOYSA-N -1 3 359.842 3.771 20 0 FHADHM CC(=O)Nc1cccc(CSc2ccc(-c3nn[n-]n3)cc2Cl)c1 ZINC000824004676 607844201 /nfs/dbraw/zinc/84/42/01/607844201.db2.gz CQFISXVHYSIKMJ-UHFFFAOYSA-N -1 3 359.842 3.771 20 0 FHADHM C[C@@H]1OCC[C@H]1SCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000825019256 607845935 /nfs/dbraw/zinc/84/59/35/607845935.db2.gz CPSWSMNORIVUIS-SCLBCKFNSA-N -1 3 352.463 3.944 20 0 FHADHM C[C@@H]1OCC[C@H]1SCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000825019256 607845936 /nfs/dbraw/zinc/84/59/36/607845936.db2.gz CPSWSMNORIVUIS-SCLBCKFNSA-N -1 3 352.463 3.944 20 0 FHADHM C[C@H]1OCC[C@H]1SCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000825019255 607846059 /nfs/dbraw/zinc/84/60/59/607846059.db2.gz CPSWSMNORIVUIS-FZKQIMNGSA-N -1 3 352.463 3.944 20 0 FHADHM C[C@H]1OCC[C@H]1SCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000825019255 607846060 /nfs/dbraw/zinc/84/60/60/607846060.db2.gz CPSWSMNORIVUIS-FZKQIMNGSA-N -1 3 352.463 3.944 20 0 FHADHM Cc1c(C(=O)OCc2ccccc2-c2nnn[n-]2)cccc1-c1ccccn1 ZINC000826235407 607857271 /nfs/dbraw/zinc/85/72/71/607857271.db2.gz JJPLIWMMCILAMB-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM Cc1c(C(=O)OCc2ccccc2-c2nn[n-]n2)cccc1-c1ccccn1 ZINC000826235407 607857272 /nfs/dbraw/zinc/85/72/72/607857272.db2.gz JJPLIWMMCILAMB-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)c1cccc(-c2ccccn2)c1C ZINC000826278506 607861545 /nfs/dbraw/zinc/86/15/45/607861545.db2.gz GQLTYICBKJGZJY-UHFFFAOYSA-N -1 3 370.416 3.798 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cccc(-c2ccccn2)c1C ZINC000826278506 607861546 /nfs/dbraw/zinc/86/15/46/607861546.db2.gz GQLTYICBKJGZJY-UHFFFAOYSA-N -1 3 370.416 3.798 20 0 FHADHM C[C@H](Cc1cccc(Cl)c1)C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000824457516 607881222 /nfs/dbraw/zinc/88/12/22/607881222.db2.gz OOXDTHCLLSQCGJ-CHWSQXEVSA-N -1 3 369.856 3.576 20 0 FHADHM C[C@H](Cc1cccc(Cl)c1)C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000824457516 607881223 /nfs/dbraw/zinc/88/12/23/607881223.db2.gz OOXDTHCLLSQCGJ-CHWSQXEVSA-N -1 3 369.856 3.576 20 0 FHADHM C[C@H](Cc1cccc(Cl)c1)C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000824457517 607881243 /nfs/dbraw/zinc/88/12/43/607881243.db2.gz OOXDTHCLLSQCGJ-OLZOCXBDSA-N -1 3 369.856 3.576 20 0 FHADHM C[C@H](Cc1cccc(Cl)c1)C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000824457517 607881244 /nfs/dbraw/zinc/88/12/44/607881244.db2.gz OOXDTHCLLSQCGJ-OLZOCXBDSA-N -1 3 369.856 3.576 20 0 FHADHM C[C@H](Cc1cccc(Cl)c1)C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000824459070 607905873 /nfs/dbraw/zinc/90/58/73/607905873.db2.gz ZJSCPWBJDLNSHA-CHWSQXEVSA-N -1 3 369.856 3.576 20 0 FHADHM C[C@H](Cc1cccc(Cl)c1)C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000824459070 607905874 /nfs/dbraw/zinc/90/58/74/607905874.db2.gz ZJSCPWBJDLNSHA-CHWSQXEVSA-N -1 3 369.856 3.576 20 0 FHADHM CCC(=O)c1cc(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)ccc1F ZINC000825035175 607962874 /nfs/dbraw/zinc/96/28/74/607962874.db2.gz WIZJPKNSGSVCKI-UHFFFAOYSA-N -1 3 373.775 3.504 20 0 FHADHM CCC(=O)c1cc(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)ccc1F ZINC000825035175 607962875 /nfs/dbraw/zinc/96/28/75/607962875.db2.gz WIZJPKNSGSVCKI-UHFFFAOYSA-N -1 3 373.775 3.504 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000823943500 607970433 /nfs/dbraw/zinc/97/04/33/607970433.db2.gz PWKYOSVLLHPWJZ-JLHYYAGUSA-N -1 3 367.840 3.582 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000823943500 607970434 /nfs/dbraw/zinc/97/04/34/607970434.db2.gz PWKYOSVLLHPWJZ-JLHYYAGUSA-N -1 3 367.840 3.582 20 0 FHADHM CCCn1c2ccc(-c3nnn[n-]3)cc2nc1-c1ccc2ccccc2n1 ZINC000825352939 607975041 /nfs/dbraw/zinc/97/50/41/607975041.db2.gz RYHSECNKRGVEIR-UHFFFAOYSA-N -1 3 355.405 3.842 20 0 FHADHM CCCn1c2ccc(-c3nn[n-]n3)cc2nc1-c1ccc2ccccc2n1 ZINC000825352939 607975042 /nfs/dbraw/zinc/97/50/42/607975042.db2.gz RYHSECNKRGVEIR-UHFFFAOYSA-N -1 3 355.405 3.842 20 0 FHADHM CCn1c2ccc(-c3nnn[n-]3)cc2nc1-c1cccc(-c2ccccn2)c1 ZINC000825782598 607975774 /nfs/dbraw/zinc/97/57/74/607975774.db2.gz IOQWGWPURSPRMF-UHFFFAOYSA-N -1 3 367.416 3.965 20 0 FHADHM CCn1c2ccc(-c3nn[n-]n3)cc2nc1-c1cccc(-c2ccccn2)c1 ZINC000825782598 607975775 /nfs/dbraw/zinc/97/57/75/607975775.db2.gz IOQWGWPURSPRMF-UHFFFAOYSA-N -1 3 367.416 3.965 20 0 FHADHM c1ccc(CCn2c3ccccc3nc2-c2cccc(-c3nnn[n-]3)c2)nc1 ZINC000826521136 607976243 /nfs/dbraw/zinc/97/62/43/607976243.db2.gz BCPXWUDUKHKNHV-UHFFFAOYSA-N -1 3 367.416 3.521 20 0 FHADHM c1ccc(CCn2c3ccccc3nc2-c2cccc(-c3nn[n-]n3)c2)nc1 ZINC000826521136 607976244 /nfs/dbraw/zinc/97/62/44/607976244.db2.gz BCPXWUDUKHKNHV-UHFFFAOYSA-N -1 3 367.416 3.521 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)C(C)=Cc1cccc(Cl)c1 ZINC000826185456 607980552 /nfs/dbraw/zinc/98/05/52/607980552.db2.gz KPUWCUQXPMGBNI-DHZHZOJOSA-N -1 3 369.812 3.571 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)C(C)=Cc1cccc(Cl)c1 ZINC000826185456 607980553 /nfs/dbraw/zinc/98/05/53/607980553.db2.gz KPUWCUQXPMGBNI-DHZHZOJOSA-N -1 3 369.812 3.571 20 0 FHADHM COCC[C@H](Sc1nc(C)cc(C)c1-c1nnn[n-]1)c1ccccc1 ZINC000826154952 608014260 /nfs/dbraw/zinc/01/42/60/608014260.db2.gz BCAHWLPVCUVNOB-HNNXBMFYSA-N -1 3 355.467 3.748 20 0 FHADHM COCC[C@H](Sc1nc(C)cc(C)c1-c1nn[n-]n1)c1ccccc1 ZINC000826154952 608014261 /nfs/dbraw/zinc/01/42/61/608014261.db2.gz BCAHWLPVCUVNOB-HNNXBMFYSA-N -1 3 355.467 3.748 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1cc(-c2ccccc2)cnc1C ZINC000826249660 608027243 /nfs/dbraw/zinc/02/72/43/608027243.db2.gz NMKJDAHHBZFWJC-UHFFFAOYSA-N -1 3 370.416 3.798 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1cc(-c2ccccc2)cnc1C ZINC000826249660 608027244 /nfs/dbraw/zinc/02/72/44/608027244.db2.gz NMKJDAHHBZFWJC-UHFFFAOYSA-N -1 3 370.416 3.798 20 0 FHADHM Cn1c2ccc(NCc3cc(-c4nn[n-]n4)cs3)cc2nc1C(C)(C)C ZINC000826354990 608028202 /nfs/dbraw/zinc/02/82/02/608028202.db2.gz FLAZVGRAYPGGLK-UHFFFAOYSA-N -1 3 367.482 3.725 20 0 FHADHM C[C@H](Nc1ccc(-c2nn[n-]n2)cc1Br)c1cccc(O)c1 ZINC000824648717 608048736 /nfs/dbraw/zinc/04/87/36/608048736.db2.gz JDSALUPTONBBRD-VIFPVBQESA-N -1 3 360.215 3.508 20 0 FHADHM Cc1ccc(Br)c(NCc2ccc(F)c(-c3nnn[n-]3)c2)c1 ZINC000826281419 608048936 /nfs/dbraw/zinc/04/89/36/608048936.db2.gz QPAGRLNXHMNRBX-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Cc1ccc(Br)c(NCc2ccc(F)c(-c3nn[n-]n3)c2)c1 ZINC000826281419 608048937 /nfs/dbraw/zinc/04/89/37/608048937.db2.gz QPAGRLNXHMNRBX-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Fc1ccc(CNc2ccc(-c3nn[n-]n3)cc2Br)c(F)c1 ZINC000826374655 608048971 /nfs/dbraw/zinc/04/89/71/608048971.db2.gz HVDMZQNDVXJVCY-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Cc1nc([C@@H](C)Nc2ccc(-c3nn[n-]n3)cc2Br)cs1 ZINC000826323839 608050349 /nfs/dbraw/zinc/05/03/49/608050349.db2.gz UIRYHMKRJOGPNL-SSDOTTSWSA-N -1 3 365.260 3.567 20 0 FHADHM c1ccc(C[C@H]2c3ccccc3CCN2c2ncccc2-c2nnn[n-]2)cc1 ZINC000826520093 608053689 /nfs/dbraw/zinc/05/36/89/608053689.db2.gz AJWHVMQPWUDIMQ-FQEVSTJZSA-N -1 3 368.444 3.608 20 0 FHADHM c1ccc(C[C@H]2c3ccccc3CCN2c2ncccc2-c2nn[n-]n2)cc1 ZINC000826520093 608053690 /nfs/dbraw/zinc/05/36/90/608053690.db2.gz AJWHVMQPWUDIMQ-FQEVSTJZSA-N -1 3 368.444 3.608 20 0 FHADHM CC(C)(C)[C@H]1C[C@H](Nc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)CCO1 ZINC000824080473 608149965 /nfs/dbraw/zinc/14/99/65/608149965.db2.gz XXNPLGNLMGLIRN-BXUZGUMPSA-N -1 3 369.391 3.891 20 0 FHADHM CC(C)(C)[C@H]1C[C@H](Nc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)CCO1 ZINC000824080473 608149967 /nfs/dbraw/zinc/14/99/67/608149967.db2.gz XXNPLGNLMGLIRN-BXUZGUMPSA-N -1 3 369.391 3.891 20 0 FHADHM CCN(C(=O)CCCC(F)(F)F)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825371744 608150125 /nfs/dbraw/zinc/15/01/25/608150125.db2.gz JQPPHJOJQWUZOS-NSHDSACASA-N -1 3 355.364 3.509 20 0 FHADHM CCN(C(=O)CCCC(F)(F)F)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825371744 608150127 /nfs/dbraw/zinc/15/01/27/608150127.db2.gz JQPPHJOJQWUZOS-NSHDSACASA-N -1 3 355.364 3.509 20 0 FHADHM CCSc1cccc(C(=O)N(CC)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000825674359 608158565 /nfs/dbraw/zinc/15/85/65/608158565.db2.gz KJPIEMUADYTYBT-UHFFFAOYSA-N -1 3 353.451 3.645 20 0 FHADHM CCSc1cccc(C(=O)N(CC)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000825674359 608158566 /nfs/dbraw/zinc/15/85/66/608158566.db2.gz KJPIEMUADYTYBT-UHFFFAOYSA-N -1 3 353.451 3.645 20 0 FHADHM CCSc1cccc(C(=O)N(C)c2cc(Cl)ccc2-c2nnn[n-]2)c1 ZINC000825675157 608160017 /nfs/dbraw/zinc/16/00/17/608160017.db2.gz YFPFYSBHEUZSHV-UHFFFAOYSA-N -1 3 373.869 3.909 20 0 FHADHM CCSc1cccc(C(=O)N(C)c2cc(Cl)ccc2-c2nn[n-]n2)c1 ZINC000825675157 608160018 /nfs/dbraw/zinc/16/00/18/608160018.db2.gz YFPFYSBHEUZSHV-UHFFFAOYSA-N -1 3 373.869 3.909 20 0 FHADHM O=C(N[C@H]1CC12CCCCC2)c1ccccc1-c1ccccc1-c1nnn[n-]1 ZINC000826428608 608164969 /nfs/dbraw/zinc/16/49/69/608164969.db2.gz GXPUJSFJCPYAMD-IBGZPJMESA-N -1 3 373.460 3.986 20 0 FHADHM O=C(N[C@H]1CC12CCCCC2)c1ccccc1-c1ccccc1-c1nn[n-]n1 ZINC000826428608 608164970 /nfs/dbraw/zinc/16/49/70/608164970.db2.gz GXPUJSFJCPYAMD-IBGZPJMESA-N -1 3 373.460 3.986 20 0 FHADHM C[C@H](OC(=O)C1(c2ccc(Cl)cc2)CC1)c1cccc(-c2nnn[n-]2)c1 ZINC000824713911 608182774 /nfs/dbraw/zinc/18/27/74/608182774.db2.gz LGXCGENWBUQQSA-LBPRGKRZSA-N -1 3 368.824 3.856 20 0 FHADHM C[C@H](OC(=O)C1(c2ccc(Cl)cc2)CC1)c1cccc(-c2nn[n-]n2)c1 ZINC000824713911 608182775 /nfs/dbraw/zinc/18/27/75/608182775.db2.gz LGXCGENWBUQQSA-LBPRGKRZSA-N -1 3 368.824 3.856 20 0 FHADHM COc1c(C)cnc(CSc2cccc(Cl)c2-c2nnn[n-]2)c1C ZINC000826166805 608207663 /nfs/dbraw/zinc/20/76/63/608207663.db2.gz BMVBYBREWRJULT-UHFFFAOYSA-N -1 3 361.858 3.833 20 0 FHADHM COc1c(C)cnc(CSc2cccc(Cl)c2-c2nn[n-]n2)c1C ZINC000826166805 608207665 /nfs/dbraw/zinc/20/76/65/608207665.db2.gz BMVBYBREWRJULT-UHFFFAOYSA-N -1 3 361.858 3.833 20 0 FHADHM C[C@@H](Nc1ccc2cc(-c3nnn[n-]3)ccc2n1)c1ccc(F)c(F)c1 ZINC000824658272 608221526 /nfs/dbraw/zinc/22/15/26/608221526.db2.gz VIKCKEZORCSEBE-SNVBAGLBSA-N -1 3 352.348 3.866 20 0 FHADHM C[C@@H](Nc1ccc2cc(-c3nn[n-]n3)ccc2n1)c1ccc(F)c(F)c1 ZINC000824658272 608221527 /nfs/dbraw/zinc/22/15/27/608221527.db2.gz VIKCKEZORCSEBE-SNVBAGLBSA-N -1 3 352.348 3.866 20 0 FHADHM FC(F)(F)[C@@H]1CCC[C@H](Nc2ccc3cc(-c4nnn[n-]4)ccc3n2)C1 ZINC000826367038 608221837 /nfs/dbraw/zinc/22/18/37/608221837.db2.gz JETVVBCQQQPTLI-OLZOCXBDSA-N -1 3 362.359 3.948 20 0 FHADHM FC(F)(F)[C@@H]1CCC[C@H](Nc2ccc3cc(-c4nn[n-]n4)ccc3n2)C1 ZINC000826367038 608221838 /nfs/dbraw/zinc/22/18/38/608221838.db2.gz JETVVBCQQQPTLI-OLZOCXBDSA-N -1 3 362.359 3.948 20 0 FHADHM FC(F)Oc1ccccc1CNc1ccc2cc(-c3nnn[n-]3)ccc2n1 ZINC000826370442 608222002 /nfs/dbraw/zinc/22/20/02/608222002.db2.gz SOOOWMIWNFYMHQ-UHFFFAOYSA-N -1 3 368.347 3.628 20 0 FHADHM FC(F)Oc1ccccc1CNc1ccc2cc(-c3nn[n-]n3)ccc2n1 ZINC000826370442 608222004 /nfs/dbraw/zinc/22/20/04/608222004.db2.gz SOOOWMIWNFYMHQ-UHFFFAOYSA-N -1 3 368.347 3.628 20 0 FHADHM CC(C)c1nc(CCNc2ccc3cc(-c4nnn[n-]4)ccc3n2)cs1 ZINC000824358912 608225089 /nfs/dbraw/zinc/22/50/89/608225089.db2.gz RVAZIHDRRKTCCO-UHFFFAOYSA-N -1 3 365.466 3.649 20 0 FHADHM CC(C)c1nc(CCNc2ccc3cc(-c4nn[n-]n4)ccc3n2)cs1 ZINC000824358912 608225090 /nfs/dbraw/zinc/22/50/90/608225090.db2.gz RVAZIHDRRKTCCO-UHFFFAOYSA-N -1 3 365.466 3.649 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nnn[n-]2)c1)[C@H](c1ccccc1)C1CC1 ZINC000826453345 608229833 /nfs/dbraw/zinc/22/98/33/608229833.db2.gz HZKZZWVUKJDNQY-MRXNPFEDSA-N -1 3 353.813 3.652 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nn[n-]n2)c1)[C@H](c1ccccc1)C1CC1 ZINC000826453345 608229834 /nfs/dbraw/zinc/22/98/34/608229834.db2.gz HZKZZWVUKJDNQY-MRXNPFEDSA-N -1 3 353.813 3.652 20 0 FHADHM c1c2ccccc2[nH]c1CCNc1ccc2cc(-c3nnn[n-]3)ccc2n1 ZINC000826522983 608234070 /nfs/dbraw/zinc/23/40/70/608234070.db2.gz WBINQLKJDWELSY-UHFFFAOYSA-N -1 3 355.405 3.551 20 0 FHADHM c1c2ccccc2[nH]c1CCNc1ccc2cc(-c3nn[n-]n3)ccc2n1 ZINC000826522983 608234072 /nfs/dbraw/zinc/23/40/72/608234072.db2.gz WBINQLKJDWELSY-UHFFFAOYSA-N -1 3 355.405 3.551 20 0 FHADHM COc1ccc([C@H](OC)[C@@H](C)Nc2c(Cl)cccc2-c2nnn[n-]2)cc1 ZINC000826189163 608239300 /nfs/dbraw/zinc/23/93/00/608239300.db2.gz OTVORTSMZRKZQM-PIGZYNQJSA-N -1 3 373.844 3.717 20 0 FHADHM COc1ccc([C@H](OC)[C@@H](C)Nc2c(Cl)cccc2-c2nn[n-]n2)cc1 ZINC000826189163 608239302 /nfs/dbraw/zinc/23/93/02/608239302.db2.gz OTVORTSMZRKZQM-PIGZYNQJSA-N -1 3 373.844 3.717 20 0 FHADHM CC(C)[C@@H]1C[C@H](Nc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)CCO1 ZINC000824213325 608242488 /nfs/dbraw/zinc/24/24/88/608242488.db2.gz ABGRSIJQFRGLOL-RISCZKNCSA-N -1 3 355.364 3.501 20 0 FHADHM CC(C)[C@H]1C[C@H](Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)CCO1 ZINC000824216634 608242764 /nfs/dbraw/zinc/24/27/64/608242764.db2.gz UFWISTDLDBXFLL-BXUZGUMPSA-N -1 3 355.364 3.501 20 0 FHADHM CC(C)[C@H]1C[C@H](Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)CCO1 ZINC000824216634 608242766 /nfs/dbraw/zinc/24/27/66/608242766.db2.gz UFWISTDLDBXFLL-BXUZGUMPSA-N -1 3 355.364 3.501 20 0 FHADHM CCc1ccc(C2=CCN(C(=O)c3ccc(-c4nnn[n-]4)cc3C)CC2)cc1 ZINC000825704247 608246203 /nfs/dbraw/zinc/24/62/03/608246203.db2.gz FFIOFYHLJPIVPD-UHFFFAOYSA-N -1 3 373.460 3.667 20 0 FHADHM CCc1ccc(C2=CCN(C(=O)c3ccc(-c4nn[n-]n4)cc3C)CC2)cc1 ZINC000825704247 608246204 /nfs/dbraw/zinc/24/62/04/608246204.db2.gz FFIOFYHLJPIVPD-UHFFFAOYSA-N -1 3 373.460 3.667 20 0 FHADHM CC(C)(C)c1ccc2c(c1)CCCN2C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000824135658 608251098 /nfs/dbraw/zinc/25/10/98/608251098.db2.gz IMEFBROKWYZMQD-UHFFFAOYSA-N -1 3 361.449 3.757 20 0 FHADHM CC(C)(C)c1ccc2c(c1)CCCN2C(=O)c1cccc(-c2nn[n-]n2)c1 ZINC000824135658 608251099 /nfs/dbraw/zinc/25/10/99/608251099.db2.gz IMEFBROKWYZMQD-UHFFFAOYSA-N -1 3 361.449 3.757 20 0 FHADHM C[C@@H](CC(=O)Nc1ccc(F)cc1-c1nnn[n-]1)Cc1ccc(Cl)cc1 ZINC000824385312 608261606 /nfs/dbraw/zinc/26/16/06/608261606.db2.gz QBQXRSWSFRPDHH-LLVKDONJSA-N -1 3 373.819 3.867 20 0 FHADHM C[C@@H](CC(=O)Nc1ccc(F)cc1-c1nn[n-]n1)Cc1ccc(Cl)cc1 ZINC000824385312 608261607 /nfs/dbraw/zinc/26/16/07/608261607.db2.gz QBQXRSWSFRPDHH-LLVKDONJSA-N -1 3 373.819 3.867 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)[C@@H](c1ccccc1)C1CC1 ZINC000826452208 608266052 /nfs/dbraw/zinc/26/60/52/608266052.db2.gz LEHPEWBPEZDFAX-INIZCTEOSA-N -1 3 353.813 3.652 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)[C@@H](c1ccccc1)C1CC1 ZINC000826452208 608266055 /nfs/dbraw/zinc/26/60/55/608266055.db2.gz LEHPEWBPEZDFAX-INIZCTEOSA-N -1 3 353.813 3.652 20 0 FHADHM Cc1c(NC(=O)N[C@H]2CCCc3cc(F)ccc32)cccc1-c1nnn[n-]1 ZINC000826241653 608307875 /nfs/dbraw/zinc/30/78/75/608307875.db2.gz KPZNWPAKIIJDDP-KRWDZBQOSA-N -1 3 366.400 3.513 20 0 FHADHM Cc1c(NC(=O)N[C@H]2CCCc3cc(F)ccc32)cccc1-c1nn[n-]n1 ZINC000826241653 608307877 /nfs/dbraw/zinc/30/78/77/608307877.db2.gz KPZNWPAKIIJDDP-KRWDZBQOSA-N -1 3 366.400 3.513 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CNc1ccc(SC(F)F)cc1 ZINC000826170765 608319222 /nfs/dbraw/zinc/31/92/22/608319222.db2.gz OWXDTAAMXVQAGS-UHFFFAOYSA-N -1 3 363.393 3.802 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CNc1ccc(SC(F)F)cc1 ZINC000826170765 608319224 /nfs/dbraw/zinc/31/92/24/608319224.db2.gz OWXDTAAMXVQAGS-UHFFFAOYSA-N -1 3 363.393 3.802 20 0 FHADHM CC(C)(C)OCc1ccccc1C(=O)OCc1cccc(-c2nnn[n-]2)c1 ZINC000824119663 608324853 /nfs/dbraw/zinc/32/48/53/608324853.db2.gz NHGCXMJBTMWEBG-UHFFFAOYSA-N -1 3 366.421 3.539 20 0 FHADHM CC(C)(C)OCc1ccccc1C(=O)OCc1cccc(-c2nn[n-]n2)c1 ZINC000824119663 608324856 /nfs/dbraw/zinc/32/48/56/608324856.db2.gz NHGCXMJBTMWEBG-UHFFFAOYSA-N -1 3 366.421 3.539 20 0 FHADHM CC(C)(C)/C=C/C(=O)NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000824080643 608329315 /nfs/dbraw/zinc/32/93/15/608329315.db2.gz YVKDGRWDGPZGHZ-OUKQBFOZSA-N -1 3 361.449 3.752 20 0 FHADHM CC(C)(C)/C=C/C(=O)NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000824080643 608329317 /nfs/dbraw/zinc/32/93/17/608329317.db2.gz YVKDGRWDGPZGHZ-OUKQBFOZSA-N -1 3 361.449 3.752 20 0 FHADHM Cc1cc(C)c(CC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)c(C)c1 ZINC000826263351 608342525 /nfs/dbraw/zinc/34/25/25/608342525.db2.gz WSOHWYMSKZDPER-UHFFFAOYSA-N -1 3 355.829 3.627 20 0 FHADHM Cc1cc(C)c(CC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)c(C)c1 ZINC000826263351 608342527 /nfs/dbraw/zinc/34/25/27/608342527.db2.gz WSOHWYMSKZDPER-UHFFFAOYSA-N -1 3 355.829 3.627 20 0 FHADHM CCN(C(=O)c1coc2ccccc12)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825390644 608346025 /nfs/dbraw/zinc/34/60/25/608346025.db2.gz IVXSJLDRWYBAKK-UHFFFAOYSA-N -1 3 367.796 3.933 20 0 FHADHM CCN(C(=O)c1coc2ccccc12)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825390644 608346026 /nfs/dbraw/zinc/34/60/26/608346026.db2.gz IVXSJLDRWYBAKK-UHFFFAOYSA-N -1 3 367.796 3.933 20 0 FHADHM CCc1ccccc1C(=O)N(CC)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825722961 608346075 /nfs/dbraw/zinc/34/60/75/608346075.db2.gz OWRDTIZQSQOUAA-UHFFFAOYSA-N -1 3 355.829 3.749 20 0 FHADHM CCc1ccccc1C(=O)N(CC)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825722961 608346077 /nfs/dbraw/zinc/34/60/77/608346077.db2.gz OWRDTIZQSQOUAA-UHFFFAOYSA-N -1 3 355.829 3.749 20 0 FHADHM CCN(C(=O)[C@@H](C)c1ccc(C)o1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825363223 608346464 /nfs/dbraw/zinc/34/64/64/608346464.db2.gz VVDJNBKEMSYBOQ-NSHDSACASA-N -1 3 359.817 3.578 20 0 FHADHM CCN(C(=O)[C@@H](C)c1ccc(C)o1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825363223 608346465 /nfs/dbraw/zinc/34/64/65/608346465.db2.gz VVDJNBKEMSYBOQ-NSHDSACASA-N -1 3 359.817 3.578 20 0 FHADHM CCOc1cccc(C(=O)N(CC)c2ccc(-c3nnn[n-]3)c(Cl)c2)c1 ZINC000825648975 608347186 /nfs/dbraw/zinc/34/71/86/608347186.db2.gz IRLXHARNVXNTDT-UHFFFAOYSA-N -1 3 371.828 3.586 20 0 FHADHM CCOc1cccc(C(=O)N(CC)c2ccc(-c3nn[n-]n3)c(Cl)c2)c1 ZINC000825648975 608347188 /nfs/dbraw/zinc/34/71/88/608347188.db2.gz IRLXHARNVXNTDT-UHFFFAOYSA-N -1 3 371.828 3.586 20 0 FHADHM C[C@@H](NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1)c1cscn1 ZINC000824612246 608362487 /nfs/dbraw/zinc/36/24/87/608362487.db2.gz LKAGCSJFWSIUQD-CYBMUJFWSA-N -1 3 362.462 3.841 20 0 FHADHM C[C@@H](NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1)c1cscn1 ZINC000824612246 608362489 /nfs/dbraw/zinc/36/24/89/608362489.db2.gz LKAGCSJFWSIUQD-CYBMUJFWSA-N -1 3 362.462 3.841 20 0 FHADHM C[C@@H](CCC(=O)OCc1cccc(-c2nnn[n-]2)c1F)c1ccccc1 ZINC000824401634 608452998 /nfs/dbraw/zinc/45/29/98/608452998.db2.gz RHFFFAMFFQDUMZ-ZDUSSCGKSA-N -1 3 354.385 3.633 20 0 FHADHM C[C@@H](CCC(=O)OCc1cccc(-c2nn[n-]n2)c1F)c1ccccc1 ZINC000824401634 608453000 /nfs/dbraw/zinc/45/30/00/608453000.db2.gz RHFFFAMFFQDUMZ-ZDUSSCGKSA-N -1 3 354.385 3.633 20 0 FHADHM Cc1nc(C2CCCCC2)sc1C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000537148043 608458882 /nfs/dbraw/zinc/45/88/82/608458882.db2.gz ZEUGQICRTOMBIX-UHFFFAOYSA-N -1 3 368.466 3.932 20 0 FHADHM Cc1nc(C2CCCCC2)sc1C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000537148043 608458883 /nfs/dbraw/zinc/45/88/83/608458883.db2.gz ZEUGQICRTOMBIX-UHFFFAOYSA-N -1 3 368.466 3.932 20 0 FHADHM Cc1oc(-c2ccccc2)nc1CN[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000826340061 608464381 /nfs/dbraw/zinc/46/43/81/608464381.db2.gz GCNNLIMJIBFMFP-ZDUSSCGKSA-N -1 3 360.421 3.681 20 0 FHADHM Cc1ccc(NC(=O)N2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)c(C)c1 ZINC000826291144 608469044 /nfs/dbraw/zinc/46/90/44/608469044.db2.gz RPKXHWWILZDGFW-UHFFFAOYSA-N -1 3 374.448 3.805 20 0 FHADHM Cc1ccc(NC(=O)N2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)c(C)c1 ZINC000826291144 608469046 /nfs/dbraw/zinc/46/90/46/608469046.db2.gz RPKXHWWILZDGFW-UHFFFAOYSA-N -1 3 374.448 3.805 20 0 FHADHM Cc1cc(Br)ccc1NCc1cccc(-c2nnn[n-]2)c1F ZINC000826256447 608479012 /nfs/dbraw/zinc/47/90/12/608479012.db2.gz KBQPRDRHFIXGKO-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Cc1cc(Br)ccc1NCc1cccc(-c2nn[n-]n2)c1F ZINC000826256447 608479014 /nfs/dbraw/zinc/47/90/14/608479014.db2.gz KBQPRDRHFIXGKO-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Cc1ccc(NC(=O)C(C)C)cc1NCc1cccc(-c2nnn[n-]2)c1F ZINC000826290496 608481195 /nfs/dbraw/zinc/48/11/95/608481195.db2.gz OMNLMXZJBOIQTJ-UHFFFAOYSA-N -1 3 368.416 3.521 20 0 FHADHM Cc1ccc(NC(=O)C(C)C)cc1NCc1cccc(-c2nn[n-]n2)c1F ZINC000826290496 608481197 /nfs/dbraw/zinc/48/11/97/608481197.db2.gz OMNLMXZJBOIQTJ-UHFFFAOYSA-N -1 3 368.416 3.521 20 0 FHADHM CCCC[C@@H](CC)C(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000825258880 608481390 /nfs/dbraw/zinc/48/13/90/608481390.db2.gz GNNYEQCPAHRANT-OAHLLOKOSA-N -1 3 353.470 3.699 20 0 FHADHM CCCC[C@@H](CC)C(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000825258880 608481392 /nfs/dbraw/zinc/48/13/92/608481392.db2.gz GNNYEQCPAHRANT-OAHLLOKOSA-N -1 3 353.470 3.699 20 0 FHADHM CCCC[C@H](CC)C(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000825258879 608481696 /nfs/dbraw/zinc/48/16/96/608481696.db2.gz GNNYEQCPAHRANT-HNNXBMFYSA-N -1 3 353.470 3.699 20 0 FHADHM CCCC[C@H](CC)C(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000825258879 608481697 /nfs/dbraw/zinc/48/16/97/608481697.db2.gz GNNYEQCPAHRANT-HNNXBMFYSA-N -1 3 353.470 3.699 20 0 FHADHM C[C@@H](NCc1ncc(-c2ccc(F)cc2)o1)c1cccc(-c2nn[n-]n2)c1 ZINC000824633998 608482585 /nfs/dbraw/zinc/48/25/85/608482585.db2.gz SWBOFEITKDGLCY-GFCCVEGCSA-N -1 3 364.384 3.512 20 0 FHADHM Cc1ccc(NC(=O)N2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)s1 ZINC000826290892 608491753 /nfs/dbraw/zinc/49/17/53/608491753.db2.gz FUABRJUIUOJRHD-UHFFFAOYSA-N -1 3 366.450 3.558 20 0 FHADHM Cc1ccc(NC(=O)N2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)s1 ZINC000826290892 608491754 /nfs/dbraw/zinc/49/17/54/608491754.db2.gz FUABRJUIUOJRHD-UHFFFAOYSA-N -1 3 366.450 3.558 20 0 FHADHM c1coc(CN(Cc2cccs2)Cc2ccc(-c3nnn[n-]3)s2)c1 ZINC000826525869 608499241 /nfs/dbraw/zinc/49/92/41/608499241.db2.gz CENXEQOEMQBGSA-UHFFFAOYSA-N -1 3 357.464 3.785 20 0 FHADHM c1coc(CN(Cc2cccs2)Cc2ccc(-c3nn[n-]n3)s2)c1 ZINC000826525869 608499242 /nfs/dbraw/zinc/49/92/42/608499242.db2.gz CENXEQOEMQBGSA-UHFFFAOYSA-N -1 3 357.464 3.785 20 0 FHADHM c1coc(CN(Cc2cc(-c3nnn[n-]3)cs2)Cc2ccccc2)c1 ZINC000826521187 608501296 /nfs/dbraw/zinc/50/12/96/608501296.db2.gz CVZPIJRMJOGYKL-UHFFFAOYSA-N -1 3 351.435 3.724 20 0 FHADHM c1coc(CN(Cc2cc(-c3nn[n-]n3)cs2)Cc2ccccc2)c1 ZINC000826521187 608501297 /nfs/dbraw/zinc/50/12/97/608501297.db2.gz CVZPIJRMJOGYKL-UHFFFAOYSA-N -1 3 351.435 3.724 20 0 FHADHM C[C@H](c1nc2ccccc2s1)N(C)Cc1ccc(-c2nnn[n-]2)s1 ZINC000824778498 608503647 /nfs/dbraw/zinc/50/36/47/608503647.db2.gz QEJRFLXVOJXDIW-SNVBAGLBSA-N -1 3 356.480 3.731 20 0 FHADHM C[C@H](c1nc2ccccc2s1)N(C)Cc1ccc(-c2nn[n-]n2)s1 ZINC000824778498 608503649 /nfs/dbraw/zinc/50/36/49/608503649.db2.gz QEJRFLXVOJXDIW-SNVBAGLBSA-N -1 3 356.480 3.731 20 0 FHADHM C[C@H](c1ccc(Cl)cc1Cl)N(C)Cc1ccc(-c2nn[n-]n2)o1 ZINC000824762615 608525938 /nfs/dbraw/zinc/52/59/38/608525938.db2.gz HVQOAWCSVVVKDH-SECBINFHSA-N -1 3 352.225 3.960 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CN[C@@H](C)c1ccc(F)cc1Cl ZINC000826169844 608535244 /nfs/dbraw/zinc/53/52/44/608535244.db2.gz HMLOAZZAZRFVFJ-JTQLQIEISA-N -1 3 361.808 3.519 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CN[C@@H](C)c1ccc(F)cc1Cl ZINC000826169844 608535245 /nfs/dbraw/zinc/53/52/45/608535245.db2.gz HMLOAZZAZRFVFJ-JTQLQIEISA-N -1 3 361.808 3.519 20 0 FHADHM CC[C@H](Nc1cccc(F)c1-c1nnn[n-]1)c1nc(-c2ccccc2)c[nH]1 ZINC000825146977 608540555 /nfs/dbraw/zinc/54/05/55/608540555.db2.gz GCGICHJYBJYXRD-AWEZNQCLSA-N -1 3 363.400 3.959 20 0 FHADHM CC[C@H](Nc1cccc(F)c1-c1nn[n-]n1)c1nc(-c2ccccc2)c[nH]1 ZINC000825146977 608540557 /nfs/dbraw/zinc/54/05/57/608540557.db2.gz GCGICHJYBJYXRD-AWEZNQCLSA-N -1 3 363.400 3.959 20 0 FHADHM Fc1ccc(C2(NCc3cccc(-c4nnn[n-]4)c3F)CCCC2)c(F)c1 ZINC000826374000 608552737 /nfs/dbraw/zinc/55/27/37/608552737.db2.gz HQSDCMCUNOCPSD-UHFFFAOYSA-N -1 3 373.382 3.843 20 0 FHADHM O=C(Nc1cccc(C(F)(F)F)c1)c1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000826456763 608572490 /nfs/dbraw/zinc/57/24/90/608572490.db2.gz WBTDMEAHDCNVCY-UHFFFAOYSA-N -1 3 367.718 3.791 20 0 FHADHM O=C(Nc1cccc(C(F)(F)F)c1)c1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000826456763 608572491 /nfs/dbraw/zinc/57/24/91/608572491.db2.gz WBTDMEAHDCNVCY-UHFFFAOYSA-N -1 3 367.718 3.791 20 0 FHADHM CCCCN(C(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1)c1ccccc1 ZINC000825282704 608573459 /nfs/dbraw/zinc/57/34/59/608573459.db2.gz WZQSVHUNAYEPIE-UHFFFAOYSA-N -1 3 355.829 3.967 20 0 FHADHM CCCCN(C(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1)c1ccccc1 ZINC000825282704 608573461 /nfs/dbraw/zinc/57/34/61/608573461.db2.gz WZQSVHUNAYEPIE-UHFFFAOYSA-N -1 3 355.829 3.967 20 0 FHADHM C[C@@H]1CCCN(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)[C@H]1C ZINC000824937802 608604816 /nfs/dbraw/zinc/60/48/16/608604816.db2.gz RJTSHONGOCBHAQ-ZJUUUORDSA-N -1 3 368.363 3.538 20 0 FHADHM C[C@@H]1CCCN(C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)[C@H]1C ZINC000824937802 608604817 /nfs/dbraw/zinc/60/48/17/608604817.db2.gz RJTSHONGOCBHAQ-ZJUUUORDSA-N -1 3 368.363 3.538 20 0 FHADHM C[C@@H]1CC[C@H](C)CN1C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000824909785 608605156 /nfs/dbraw/zinc/60/51/56/608605156.db2.gz UTACEAFEHCSWTC-VHSXEESVSA-N -1 3 368.363 3.538 20 0 FHADHM C[C@@H]1CC[C@H](C)CN1C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000824909785 608605160 /nfs/dbraw/zinc/60/51/60/608605160.db2.gz UTACEAFEHCSWTC-VHSXEESVSA-N -1 3 368.363 3.538 20 0 FHADHM Cc1ccc([C@@H]2CSCCN2Cc2cccc(-c3nnn[n-]3)c2F)cc1 ZINC000826285618 608651863 /nfs/dbraw/zinc/65/18/63/608651863.db2.gz FBZFOGCWFLTLIZ-KRWDZBQOSA-N -1 3 369.469 3.604 20 0 FHADHM Cc1ccc([C@@H]2CSCCN2Cc2cccc(-c3nn[n-]n3)c2F)cc1 ZINC000826285618 608651865 /nfs/dbraw/zinc/65/18/65/608651865.db2.gz FBZFOGCWFLTLIZ-KRWDZBQOSA-N -1 3 369.469 3.604 20 0 FHADHM c1sc(CN2CCCC[C@H]2c2nc3ccccc3o2)cc1-c1nnn[n-]1 ZINC000826524128 608742257 /nfs/dbraw/zinc/74/22/57/608742257.db2.gz KMKBEDOICKJSIB-HNNXBMFYSA-N -1 3 366.450 3.797 20 0 FHADHM c1sc(CN2CCCC[C@H]2c2nc3ccccc3o2)cc1-c1nn[n-]n1 ZINC000826524128 608742258 /nfs/dbraw/zinc/74/22/58/608742258.db2.gz KMKBEDOICKJSIB-HNNXBMFYSA-N -1 3 366.450 3.797 20 0 FHADHM c1ccc(COCc2cccc(CNc3cnccc3-c3nnn[n-]3)c2)cc1 ZINC000826521284 608776383 /nfs/dbraw/zinc/77/63/83/608776383.db2.gz HAAUMFWCMOBXQZ-UHFFFAOYSA-N -1 3 372.432 3.591 20 0 FHADHM c1ccc(COCc2cccc(CNc3cnccc3-c3nn[n-]n3)c2)cc1 ZINC000826521284 608776385 /nfs/dbraw/zinc/77/63/85/608776385.db2.gz HAAUMFWCMOBXQZ-UHFFFAOYSA-N -1 3 372.432 3.591 20 0 FHADHM COc1cc(F)cc(CNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)c1 ZINC000826180785 608799635 /nfs/dbraw/zinc/79/96/35/608799635.db2.gz WZVRWHSWSBOOCO-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM COc1cc(F)cc(CNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)c1 ZINC000826180785 608799638 /nfs/dbraw/zinc/79/96/38/608799638.db2.gz WZVRWHSWSBOOCO-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM Fc1cc(CN2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)cc(F)c1F ZINC000826372354 608858080 /nfs/dbraw/zinc/85/80/80/608858080.db2.gz SHSLWAIGXBLJFI-UHFFFAOYSA-N -1 3 371.366 3.573 20 0 FHADHM Fc1cc(CN2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)cc(F)c1F ZINC000826372354 608858083 /nfs/dbraw/zinc/85/80/83/608858083.db2.gz SHSLWAIGXBLJFI-UHFFFAOYSA-N -1 3 371.366 3.573 20 0 FHADHM CC(C)Sc1ccccc1NCc1cnc2ccc(-c3nnn[n-]3)cn12 ZINC000824338184 608858890 /nfs/dbraw/zinc/85/88/90/608858890.db2.gz SBKRFSUFBFZOPY-UHFFFAOYSA-N -1 3 365.466 3.627 20 0 FHADHM CC(C)Sc1ccccc1NCc1cnc2ccc(-c3nn[n-]n3)cn12 ZINC000824338184 608858891 /nfs/dbraw/zinc/85/88/91/608858891.db2.gz SBKRFSUFBFZOPY-UHFFFAOYSA-N -1 3 365.466 3.627 20 0 FHADHM COc1ccc(F)cc1[C@@H](C)N[C@@H](C)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000826209052 609134006 /nfs/dbraw/zinc/13/40/06/609134006.db2.gz KOUSQSBUVYIAEY-WDEREUQCSA-N -1 3 359.380 3.565 20 0 FHADHM O=C(CCc1ccc(-c2nnn[n-]2)cc1)N1CCC[C@@H]1/C=C\c1ccccc1 ZINC000826408550 609138117 /nfs/dbraw/zinc/13/81/17/609138117.db2.gz LIGBAHIENASJKF-QNOJTCODSA-N -1 3 373.460 3.504 20 0 FHADHM O=C(CCc1ccc(-c2nn[n-]n2)cc1)N1CCC[C@@H]1/C=C\c1ccccc1 ZINC000826408550 609138120 /nfs/dbraw/zinc/13/81/20/609138120.db2.gz LIGBAHIENASJKF-QNOJTCODSA-N -1 3 373.460 3.504 20 0 FHADHM Fc1cccc(F)c1[C@@H](NCc1cccc(-c2nnn[n-]2)c1)C(F)(F)F ZINC000826377603 609152703 /nfs/dbraw/zinc/15/27/03/609152703.db2.gz YMAYFFSSYMDJMO-CQSZACIVSA-N -1 3 369.297 3.538 20 0 FHADHM Fc1cccc(F)c1[C@@H](NCc1cccc(-c2nn[n-]n2)c1)C(F)(F)F ZINC000826377603 609152704 /nfs/dbraw/zinc/15/27/04/609152704.db2.gz YMAYFFSSYMDJMO-CQSZACIVSA-N -1 3 369.297 3.538 20 0 FHADHM Cc1ccc(NC(=O)C2CC2)cc1N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000826290733 609158297 /nfs/dbraw/zinc/15/82/97/609158297.db2.gz XQPOUGIYBNOOBJ-ZDUSSCGKSA-N -1 3 362.437 3.697 20 0 FHADHM Cc1ccc(NC(=O)C2CC2)cc1N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000826290733 609158298 /nfs/dbraw/zinc/15/82/98/609158298.db2.gz XQPOUGIYBNOOBJ-ZDUSSCGKSA-N -1 3 362.437 3.697 20 0 FHADHM Clc1cnc(COc2ccc(-c3nnn[n-]3)cc2Cl)c(Cl)c1 ZINC000826353825 609174353 /nfs/dbraw/zinc/17/43/53/609174353.db2.gz FLNUIXVGHZINBQ-UHFFFAOYSA-N -1 3 356.600 3.801 20 0 FHADHM Clc1cnc(COc2ccc(-c3nn[n-]n3)cc2Cl)c(Cl)c1 ZINC000826353825 609174355 /nfs/dbraw/zinc/17/43/55/609174355.db2.gz FLNUIXVGHZINBQ-UHFFFAOYSA-N -1 3 356.600 3.801 20 0 FHADHM CC(C)CCCSCC(=O)Nc1cc(Cl)ccc1-c1nnn[n-]1 ZINC000824244790 609181622 /nfs/dbraw/zinc/18/16/22/609181622.db2.gz TZFFKEWBRHRQJA-UHFFFAOYSA-N -1 3 353.879 3.628 20 0 FHADHM CC(C)CCCSCC(=O)Nc1cc(Cl)ccc1-c1nn[n-]n1 ZINC000824244790 609181623 /nfs/dbraw/zinc/18/16/23/609181623.db2.gz TZFFKEWBRHRQJA-UHFFFAOYSA-N -1 3 353.879 3.628 20 0 FHADHM Cc1cccc(CSCc2ccc(-c3nnn[n-]3)cc2OC(F)F)n1 ZINC000826298496 609184149 /nfs/dbraw/zinc/18/41/49/609184149.db2.gz VVSUJVXTMVMFTP-UHFFFAOYSA-N -1 3 363.393 3.605 20 0 FHADHM Cc1cccc(CSCc2ccc(-c3nn[n-]n3)cc2OC(F)F)n1 ZINC000826298496 609184151 /nfs/dbraw/zinc/18/41/51/609184151.db2.gz VVSUJVXTMVMFTP-UHFFFAOYSA-N -1 3 363.393 3.605 20 0 FHADHM O=C(c1c[nH]c(-c2nnn[n-]2)c1)N1CCCCC[C@H]1c1ccc(Cl)cc1 ZINC000826469688 609215013 /nfs/dbraw/zinc/21/50/13/609215013.db2.gz OMXUBLYZHLPBKZ-INIZCTEOSA-N -1 3 370.844 3.606 20 0 FHADHM O=C(c1c[nH]c(-c2nn[n-]n2)c1)N1CCCCC[C@H]1c1ccc(Cl)cc1 ZINC000826469688 609215015 /nfs/dbraw/zinc/21/50/15/609215015.db2.gz OMXUBLYZHLPBKZ-INIZCTEOSA-N -1 3 370.844 3.606 20 0 FHADHM COc1cc(N[C@H](C)c2cccc(-c3nnn[n-]3)c2)ccc1Br ZINC000826180733 609243427 /nfs/dbraw/zinc/24/34/27/609243427.db2.gz UOXHXZREEBXEFG-SNVBAGLBSA-N -1 3 374.242 3.811 20 0 FHADHM COc1cc(N[C@H](C)c2cccc(-c3nn[n-]n3)c2)ccc1Br ZINC000826180733 609243429 /nfs/dbraw/zinc/24/34/29/609243429.db2.gz UOXHXZREEBXEFG-SNVBAGLBSA-N -1 3 374.242 3.811 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Oc1cccc(Oc2cccnc2)c1 ZINC000826252790 609257900 /nfs/dbraw/zinc/25/79/00/609257900.db2.gz RNHVTHDULOEKQQ-UHFFFAOYSA-N -1 3 373.372 3.582 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Oc1cccc(Oc2cccnc2)c1 ZINC000826252790 609257901 /nfs/dbraw/zinc/25/79/01/609257901.db2.gz RNHVTHDULOEKQQ-UHFFFAOYSA-N -1 3 373.372 3.582 20 0 FHADHM FC(F)Oc1ccccc1N[C@H]1CCCc2cc(-c3nnn[n-]3)ccc21 ZINC000826370461 609272699 /nfs/dbraw/zinc/27/26/99/609272699.db2.gz UIMRVJUUVFNJBS-AWEZNQCLSA-N -1 3 357.364 3.958 20 0 FHADHM FC(F)Oc1ccccc1N[C@H]1CCCc2cc(-c3nn[n-]n3)ccc21 ZINC000826370461 609272700 /nfs/dbraw/zinc/27/27/00/609272700.db2.gz UIMRVJUUVFNJBS-AWEZNQCLSA-N -1 3 357.364 3.958 20 0 FHADHM CCOc1cc2c(cc1N[C@@H](C)c1cccc(-c3nnn[n-]3)c1)O[C@@H](C)C2 ZINC000825621683 609273689 /nfs/dbraw/zinc/27/36/89/609273689.db2.gz XESWPKYJLVHQFC-STQMWFEESA-N -1 3 365.437 3.762 20 0 FHADHM CCOc1cc2c(cc1N[C@@H](C)c1cccc(-c3nn[n-]n3)c1)O[C@@H](C)C2 ZINC000825621683 609273690 /nfs/dbraw/zinc/27/36/90/609273690.db2.gz XESWPKYJLVHQFC-STQMWFEESA-N -1 3 365.437 3.762 20 0 FHADHM CSc1cc2c(cc1N[C@@H](C)c1ccc(-c3nnn[n-]3)cc1)OCCO2 ZINC000826230520 609278746 /nfs/dbraw/zinc/27/87/46/609278746.db2.gz XHLJCFHLBSVFSN-NSHDSACASA-N -1 3 369.450 3.533 20 0 FHADHM CSc1cc2c(cc1N[C@@H](C)c1ccc(-c3nn[n-]n3)cc1)OCCO2 ZINC000826230520 609278748 /nfs/dbraw/zinc/27/87/48/609278748.db2.gz XHLJCFHLBSVFSN-NSHDSACASA-N -1 3 369.450 3.533 20 0 FHADHM Cc1cccc([C@H]2CCCN2C(=O)c2ccc(Cl)c(-c3nnn[n-]3)c2)c1 ZINC000826297959 609299202 /nfs/dbraw/zinc/29/92/02/609299202.db2.gz XWGNIRNYNOTJSS-QGZVFWFLSA-N -1 3 367.840 3.806 20 0 FHADHM Cc1cccc([C@H]2CCCN2C(=O)c2ccc(Cl)c(-c3nn[n-]n3)c2)c1 ZINC000826297959 609299204 /nfs/dbraw/zinc/29/92/04/609299204.db2.gz XWGNIRNYNOTJSS-QGZVFWFLSA-N -1 3 367.840 3.806 20 0 FHADHM CCC(CC)[C@@H]1C[C@@H](Nc2c(F)cc(-c3nnn[n-]3)cc2F)CCO1 ZINC000825107556 609322216 /nfs/dbraw/zinc/32/22/16/609322216.db2.gz QRULXIGJLROEFG-WFASDCNBSA-N -1 3 351.401 3.541 20 0 FHADHM CCC(CC)[C@@H]1C[C@@H](Nc2c(F)cc(-c3nn[n-]n3)cc2F)CCO1 ZINC000825107556 609322217 /nfs/dbraw/zinc/32/22/17/609322217.db2.gz QRULXIGJLROEFG-WFASDCNBSA-N -1 3 351.401 3.541 20 0 FHADHM C[C@@H](NCc1cc(-c2ccccc2)on1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824606129 609331866 /nfs/dbraw/zinc/33/18/66/609331866.db2.gz NNUFPVUQLGWYTA-GFCCVEGCSA-N -1 3 364.384 3.512 20 0 FHADHM C[C@@H](NCc1cc(-c2ccccc2)on1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824606129 609331868 /nfs/dbraw/zinc/33/18/68/609331868.db2.gz NNUFPVUQLGWYTA-GFCCVEGCSA-N -1 3 364.384 3.512 20 0 FHADHM CCOc1ccccc1[C@@H](C)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000825654115 609332583 /nfs/dbraw/zinc/33/25/83/609332583.db2.gz OPHNOGDXVAUSGB-QWHCGFSZSA-N -1 3 355.417 3.816 20 0 FHADHM FC(F)(F)[C@@H](CCc1ccccc1)NCc1ccc(-c2nnn[n-]2)cc1 ZINC000826367344 609347075 /nfs/dbraw/zinc/34/70/75/609347075.db2.gz VQTWLBXEBNNZSQ-MRXNPFEDSA-N -1 3 361.371 3.520 20 0 FHADHM FC(F)(F)[C@@H](CCc1ccccc1)NCc1ccc(-c2nn[n-]n2)cc1 ZINC000826367344 609347076 /nfs/dbraw/zinc/34/70/76/609347076.db2.gz VQTWLBXEBNNZSQ-MRXNPFEDSA-N -1 3 361.371 3.520 20 0 FHADHM C[C@@H](Nc1ccc(N2CCCCC2)nc1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824656134 609348903 /nfs/dbraw/zinc/34/89/03/609348903.db2.gz IAKWGDLRXJBUOS-CYBMUJFWSA-N -1 3 367.432 3.564 20 0 FHADHM C[C@@H](Nc1ccc(N2CCCCC2)nc1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824656134 609348906 /nfs/dbraw/zinc/34/89/06/609348906.db2.gz IAKWGDLRXJBUOS-CYBMUJFWSA-N -1 3 367.432 3.564 20 0 FHADHM Cc1nn(-c2ccccc2)cc1N[C@H](C)c1ccc(-c2nnn[n-]2)cc1F ZINC000826332972 609351756 /nfs/dbraw/zinc/35/17/56/609351756.db2.gz OQLFESJWNHFPBB-GFCCVEGCSA-N -1 3 363.400 3.673 20 0 FHADHM Cc1nn(-c2ccccc2)cc1N[C@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000826332972 609351757 /nfs/dbraw/zinc/35/17/57/609351757.db2.gz OQLFESJWNHFPBB-GFCCVEGCSA-N -1 3 363.400 3.673 20 0 FHADHM Brc1cc(-c2nn[n-]n2)ccc1CN1CCC[C@H]1c1ccco1 ZINC000823821654 609361044 /nfs/dbraw/zinc/36/10/44/609361044.db2.gz XFTKJCXAAKTTJQ-AWEZNQCLSA-N -1 3 374.242 3.559 20 0 FHADHM CC1(C)CC[C@@H](C(=O)N(Cc2ccco2)c2ccccc2-c2nnn[n-]2)C1 ZINC000824796024 609377865 /nfs/dbraw/zinc/37/78/65/609377865.db2.gz LNTBDCDTIKAYIG-CQSZACIVSA-N -1 3 365.437 3.819 20 0 FHADHM CC1(C)CC[C@@H](C(=O)N(Cc2ccco2)c2ccccc2-c2nn[n-]n2)C1 ZINC000824796024 609377868 /nfs/dbraw/zinc/37/78/68/609377868.db2.gz LNTBDCDTIKAYIG-CQSZACIVSA-N -1 3 365.437 3.819 20 0 FHADHM Fc1cc(NCc2ccc(-c3nnn[n-]3)cc2)cc(F)c1N1CCCCC1 ZINC000826372629 609446753 /nfs/dbraw/zinc/44/67/53/609446753.db2.gz GBDWIHYBCYFFCX-UHFFFAOYSA-N -1 3 370.407 3.747 20 0 FHADHM Fc1cc(NCc2ccc(-c3nn[n-]n3)cc2)cc(F)c1N1CCCCC1 ZINC000826372629 609446755 /nfs/dbraw/zinc/44/67/55/609446755.db2.gz GBDWIHYBCYFFCX-UHFFFAOYSA-N -1 3 370.407 3.747 20 0 FHADHM CCCCOc1cc(CNc2cccc(-c3nnn[n-]3)c2)ccc1OC ZINC000825291357 609474276 /nfs/dbraw/zinc/47/42/76/609474276.db2.gz PWLCUMBXXNPRRO-UHFFFAOYSA-N -1 3 353.426 3.666 20 0 FHADHM CCCCOc1cc(CNc2cccc(-c3nn[n-]n3)c2)ccc1OC ZINC000825291357 609474279 /nfs/dbraw/zinc/47/42/79/609474279.db2.gz PWLCUMBXXNPRRO-UHFFFAOYSA-N -1 3 353.426 3.666 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NCc1cnc(C2CCCC2)s1 ZINC000825631537 609476665 /nfs/dbraw/zinc/47/66/65/609476665.db2.gz CUUWBXIOCWQJOC-UHFFFAOYSA-N -1 3 370.482 3.992 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NCc1cnc(C2CCCC2)s1 ZINC000825631537 609476666 /nfs/dbraw/zinc/47/66/66/609476666.db2.gz CUUWBXIOCWQJOC-UHFFFAOYSA-N -1 3 370.482 3.992 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NCc1cc(F)c(F)c(F)c1 ZINC000824324606 609478773 /nfs/dbraw/zinc/47/87/73/609478773.db2.gz RIRVJUPDGUKNJY-UHFFFAOYSA-N -1 3 363.343 3.683 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NCc1cc(F)c(F)c(F)c1 ZINC000824324606 609478775 /nfs/dbraw/zinc/47/87/75/609478775.db2.gz RIRVJUPDGUKNJY-UHFFFAOYSA-N -1 3 363.343 3.683 20 0 FHADHM CC(C)Oc1c(F)cc(NCc2cccc(-c3nnn[n-]3)c2F)cc1F ZINC000824314854 609480028 /nfs/dbraw/zinc/48/00/28/609480028.db2.gz IJXQHWRHCCUFEY-UHFFFAOYSA-N -1 3 363.343 3.683 20 0 FHADHM CC(C)Oc1c(F)cc(NCc2cccc(-c3nn[n-]n3)c2F)cc1F ZINC000824314854 609480029 /nfs/dbraw/zinc/48/00/29/609480029.db2.gz IJXQHWRHCCUFEY-UHFFFAOYSA-N -1 3 363.343 3.683 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NCc1cnc(-c2cccs2)s1 ZINC000826186834 609481937 /nfs/dbraw/zinc/48/19/37/609481937.db2.gz MGOFFMUPJJAFIZ-UHFFFAOYSA-N -1 3 370.463 3.672 20 0 FHADHM C[C@H]1CCC[C@@H]1C(=O)N(Cc1ccccc1)c1ccccc1-c1nnn[n-]1 ZINC000824927273 609482797 /nfs/dbraw/zinc/48/27/97/609482797.db2.gz NKSLJHNLLQGDLQ-RDJZCZTQSA-N -1 3 361.449 3.836 20 0 FHADHM C[C@H]1CCC[C@@H]1C(=O)N(Cc1ccccc1)c1ccccc1-c1nn[n-]n1 ZINC000824927273 609482800 /nfs/dbraw/zinc/48/28/00/609482800.db2.gz NKSLJHNLLQGDLQ-RDJZCZTQSA-N -1 3 361.449 3.836 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NCc1ccc(CSC(F)F)o1 ZINC000826187096 609484094 /nfs/dbraw/zinc/48/40/94/609484094.db2.gz ZYUANIDLBYLCRR-UHFFFAOYSA-N -1 3 367.381 3.536 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NCc1ccc(CSC(F)F)o1 ZINC000826187096 609484096 /nfs/dbraw/zinc/48/40/96/609484096.db2.gz ZYUANIDLBYLCRR-UHFFFAOYSA-N -1 3 367.381 3.536 20 0 FHADHM CC(C)OCCCC(=O)Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1 ZINC000824309486 609489404 /nfs/dbraw/zinc/48/94/04/609489404.db2.gz QMVUTYLKHKGNHP-UHFFFAOYSA-N -1 3 371.466 3.739 20 0 FHADHM CC(C)OCCCC(=O)Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1 ZINC000824309486 609489407 /nfs/dbraw/zinc/48/94/07/609489407.db2.gz QMVUTYLKHKGNHP-UHFFFAOYSA-N -1 3 371.466 3.739 20 0 FHADHM CC(C)Oc1ccc(NCc2cnc(C3CC3)s2)cc1-c1nnn[n-]1 ZINC000824329182 609490003 /nfs/dbraw/zinc/49/00/03/609490003.db2.gz KNWLOCSFARMCHP-UHFFFAOYSA-N -1 3 356.455 3.600 20 0 FHADHM CC(C)Oc1ccc(NCc2cnc(C3CC3)s2)cc1-c1nn[n-]n1 ZINC000824329182 609490004 /nfs/dbraw/zinc/49/00/04/609490004.db2.gz KNWLOCSFARMCHP-UHFFFAOYSA-N -1 3 356.455 3.600 20 0 FHADHM CC(C)Oc1ccc(NCc2nccc3ccccc32)cc1-c1nnn[n-]1 ZINC000824333519 609492520 /nfs/dbraw/zinc/49/25/20/609492520.db2.gz LBQXFJXURHTHDC-UHFFFAOYSA-N -1 3 360.421 3.814 20 0 FHADHM CC(C)Oc1ccc(NCc2nccc3ccccc32)cc1-c1nn[n-]n1 ZINC000824333519 609492522 /nfs/dbraw/zinc/49/25/22/609492522.db2.gz LBQXFJXURHTHDC-UHFFFAOYSA-N -1 3 360.421 3.814 20 0 FHADHM Cc1cc(NCc2cc(-c3nnn[n-]3)cs2)cnc1N1CCCC[C@@H]1C ZINC000826271470 609512856 /nfs/dbraw/zinc/51/28/56/609512856.db2.gz SKFWMWYFJOTBEW-ZDUSSCGKSA-N -1 3 369.498 3.623 20 0 FHADHM Cc1cc(NCc2cc(-c3nn[n-]n3)cs2)cnc1N1CCCC[C@@H]1C ZINC000826271470 609512857 /nfs/dbraw/zinc/51/28/57/609512857.db2.gz SKFWMWYFJOTBEW-ZDUSSCGKSA-N -1 3 369.498 3.623 20 0 FHADHM COc1ccc([C@H](Nc2nccc(C)c2-c2nnn[n-]2)c2ccccc2)cc1 ZINC000826188641 609521941 /nfs/dbraw/zinc/52/19/41/609521941.db2.gz BWYIGTRHJNTMTF-LJQANCHMSA-N -1 3 372.432 3.780 20 0 FHADHM COc1ccc([C@H](Nc2nccc(C)c2-c2nn[n-]n2)c2ccccc2)cc1 ZINC000826188641 609521943 /nfs/dbraw/zinc/52/19/43/609521943.db2.gz BWYIGTRHJNTMTF-LJQANCHMSA-N -1 3 372.432 3.780 20 0 FHADHM CCN(C(=O)[C@H]1C[C@H](C)C[C@H](C)C1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825366509 609523825 /nfs/dbraw/zinc/52/38/25/609523825.db2.gz ATVMSVGNPMEJCR-FSZRXZPDSA-N -1 3 355.486 3.849 20 0 FHADHM CCN(C(=O)[C@H]1C[C@H](C)C[C@H](C)C1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825366509 609523826 /nfs/dbraw/zinc/52/38/26/609523826.db2.gz ATVMSVGNPMEJCR-FSZRXZPDSA-N -1 3 355.486 3.849 20 0 FHADHM CC[C@@H](C)[C@@H](C)C(=O)N(Cc1ccco1)c1ccccc1-c1nnn[n-]1 ZINC000825051836 609525191 /nfs/dbraw/zinc/52/51/91/609525191.db2.gz SPYAVQOGUMMUSD-ZIAGYGMSSA-N -1 3 353.426 3.675 20 0 FHADHM CC[C@@H](C)[C@@H](C)C(=O)N(Cc1ccco1)c1ccccc1-c1nn[n-]n1 ZINC000825051836 609525193 /nfs/dbraw/zinc/52/51/93/609525193.db2.gz SPYAVQOGUMMUSD-ZIAGYGMSSA-N -1 3 353.426 3.675 20 0 FHADHM Cc1c(Cl)cnc(NCc2coc(-c3cccs3)n2)c1-c1nnn[n-]1 ZINC000826240551 609527542 /nfs/dbraw/zinc/52/75/42/609527542.db2.gz ZMYLLUZSIYFYBB-UHFFFAOYSA-N -1 3 373.829 3.552 20 0 FHADHM Cc1c(Cl)cnc(NCc2coc(-c3cccs3)n2)c1-c1nn[n-]n1 ZINC000826240551 609527543 /nfs/dbraw/zinc/52/75/43/609527543.db2.gz ZMYLLUZSIYFYBB-UHFFFAOYSA-N -1 3 373.829 3.552 20 0 FHADHM CC/C(C)=C(/C)C(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)CC(F)(F)F ZINC000825051815 609529907 /nfs/dbraw/zinc/52/99/07/609529907.db2.gz SKBCSKQAPYWMEI-QXMHVHEDSA-N -1 3 367.375 3.504 20 0 FHADHM CC/C(C)=C(/C)C(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)CC(F)(F)F ZINC000825051815 609529908 /nfs/dbraw/zinc/52/99/08/609529908.db2.gz SKBCSKQAPYWMEI-QXMHVHEDSA-N -1 3 367.375 3.504 20 0 FHADHM COc1ccccc1[C@@H]1CCCN1c1ncc(Cl)c(C)c1-c1nnn[n-]1 ZINC000826218839 609546073 /nfs/dbraw/zinc/54/60/73/609546073.db2.gz MAXUANYALVQNRG-AWEZNQCLSA-N -1 3 370.844 3.574 20 0 FHADHM COc1ccccc1[C@@H]1CCCN1c1ncc(Cl)c(C)c1-c1nn[n-]n1 ZINC000826218839 609546075 /nfs/dbraw/zinc/54/60/75/609546075.db2.gz MAXUANYALVQNRG-AWEZNQCLSA-N -1 3 370.844 3.574 20 0 FHADHM COc1ccccc1[C@H]1CCCN1c1ncc(Cl)c(C)c1-c1nnn[n-]1 ZINC000826218840 609546281 /nfs/dbraw/zinc/54/62/81/609546281.db2.gz MAXUANYALVQNRG-CQSZACIVSA-N -1 3 370.844 3.574 20 0 FHADHM COc1ccccc1[C@H]1CCCN1c1ncc(Cl)c(C)c1-c1nn[n-]n1 ZINC000826218840 609546283 /nfs/dbraw/zinc/54/62/83/609546283.db2.gz MAXUANYALVQNRG-CQSZACIVSA-N -1 3 370.844 3.574 20 0 FHADHM Cc1nc2c(s1)[C@H](Nc1ccc3cc(-c4nnn[n-]4)ccc3n1)CCC2 ZINC000826328189 609565128 /nfs/dbraw/zinc/56/51/28/609565128.db2.gz IIKIUICFXDGZLZ-OAHLLOKOSA-N -1 3 363.450 3.669 20 0 FHADHM Cc1nc2c(s1)[C@H](Nc1ccc3cc(-c4nn[n-]n4)ccc3n1)CCC2 ZINC000826328189 609565130 /nfs/dbraw/zinc/56/51/30/609565130.db2.gz IIKIUICFXDGZLZ-OAHLLOKOSA-N -1 3 363.450 3.669 20 0 FHADHM Cc1nc2c(s1)[C@H](Nc1nc3ccccc3cc1-c1nnn[n-]1)CCC2 ZINC000826328569 609566326 /nfs/dbraw/zinc/56/63/26/609566326.db2.gz WESPBNFPQPEAGU-OAHLLOKOSA-N -1 3 363.450 3.669 20 0 FHADHM Cc1nc2c(s1)[C@H](Nc1nc3ccccc3cc1-c1nn[n-]n1)CCC2 ZINC000826328569 609566328 /nfs/dbraw/zinc/56/63/28/609566328.db2.gz WESPBNFPQPEAGU-OAHLLOKOSA-N -1 3 363.450 3.669 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)Nc1ncccc1-c1ccccc1 ZINC000826402366 609608942 /nfs/dbraw/zinc/60/89/42/609608942.db2.gz RVJXKXCLRUGERC-OUKQBFOZSA-N -1 3 368.400 3.581 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)Nc1ncccc1-c1ccccc1 ZINC000826402366 609608943 /nfs/dbraw/zinc/60/89/43/609608943.db2.gz RVJXKXCLRUGERC-OUKQBFOZSA-N -1 3 368.400 3.581 20 0 FHADHM O=C(Cc1cc2ccccc2o1)OCc1ccc(Cl)cc1-c1nnn[n-]1 ZINC000826421342 609616419 /nfs/dbraw/zinc/61/64/19/609616419.db2.gz DCIYZBWNWZMPNM-UHFFFAOYSA-N -1 3 368.780 3.552 20 0 FHADHM O=C(Cc1cc2ccccc2o1)OCc1ccc(Cl)cc1-c1nn[n-]n1 ZINC000826421342 609616420 /nfs/dbraw/zinc/61/64/20/609616420.db2.gz DCIYZBWNWZMPNM-UHFFFAOYSA-N -1 3 368.780 3.552 20 0 FHADHM O=c1[nH]c(CC(F)(F)F)c([O-])n1-c1ccc(COC2CCCC2)cc1 ZINC000277996896 936333428 /nfs/dbraw/zinc/33/34/28/936333428.db2.gz KGZKBECVPMSRMP-CQSZACIVSA-N -1 3 356.344 3.523 20 0 FHADHM COc1ccc([C@H]2CCCN2CCOc2cccc(C(=O)[O-])c2)cc1OC ZINC000582970686 936333520 /nfs/dbraw/zinc/33/35/20/936333520.db2.gz RFHTYFZSPTUFNP-GOSISDBHSA-N -1 3 371.433 3.618 20 0 FHADHM CCc1ccc([O-])c(C(=O)N2CCN(CC(F)(F)F)c3ccccc32)c1 ZINC000582980669 936341118 /nfs/dbraw/zinc/34/11/18/936341118.db2.gz BFNDKSMJSROQOY-UHFFFAOYSA-N -1 3 364.367 3.984 20 0 FHADHM O=C(CC1CCC(c2ccccc2)CC1)N=c1cc([C@H]2CCCO2)[n-][nH]1 ZINC000473853827 945069077 /nfs/dbraw/zinc/06/90/77/945069077.db2.gz 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FHADHM CCc1cccc(C(=O)N2CCC(OCc3ccccc3F)CC2)c1[O-] ZINC000092058777 937220134 /nfs/dbraw/zinc/22/01/34/937220134.db2.gz OVPBXGYUXRBZPP-UHFFFAOYSA-N -1 3 357.425 3.915 20 0 FHADHM O=C(NCc1ccc([O-])c(F)c1)N1CCCC[C@@H]1c1nc2ccccc2[nH]1 ZINC000458428081 937236690 /nfs/dbraw/zinc/23/66/90/937236690.db2.gz UXMDULIBCQRRRQ-QGZVFWFLSA-N -1 3 368.412 3.844 20 0 FHADHM CCc1ccc(CN(CC(C)C)C(=O)c2cc(=O)[n-]c(C3CC3)n2)cc1 ZINC000655156496 928364281 /nfs/dbraw/zinc/36/42/81/928364281.db2.gz GABPURPKQHUENJ-UHFFFAOYSA-N -1 3 353.466 3.920 20 0 FHADHM O=C(NCCCc1c(Cl)cccc1Cl)c1cc(=O)[n-]c(C2CC2)n1 ZINC000655253267 928555183 /nfs/dbraw/zinc/55/51/83/928555183.db2.gz CZGSZAMWZRDPLV-UHFFFAOYSA-N -1 3 366.248 3.729 20 0 FHADHM O=C(c1ccc(O)cc1[O-])N1CCC(CCc2ccc(F)cc2F)CC1 ZINC000655265033 928597469 /nfs/dbraw/zinc/59/74/69/928597469.db2.gz YWYSIVMBGUFOBA-UHFFFAOYSA-N -1 3 361.388 3.861 20 0 FHADHM O=C(NCc1ncccc1[O-])Nc1ccc2c(c1)OC1(CCCCC1)O2 ZINC000471181995 928649545 /nfs/dbraw/zinc/64/95/45/928649545.db2.gz JGFRCELOWWHSEW-UHFFFAOYSA-N -1 3 355.394 3.541 20 0 FHADHM O=[N+]([O-])c1cc([N-]S(=O)(=O)C2=Cc3ccccc3CC2)ccc1Cl ZINC000069447144 928671674 /nfs/dbraw/zinc/67/16/74/928671674.db2.gz LFQXLGYTHVWQBR-UHFFFAOYSA-N -1 3 364.810 3.977 20 0 FHADHM Cc1cc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2[O-])ccc1Cl ZINC000655340167 928731988 /nfs/dbraw/zinc/73/19/88/928731988.db2.gz XUJKWHOSBGIHDE-MRXNPFEDSA-N -1 3 358.825 3.597 20 0 FHADHM Cc1ccc(Oc2ccc(NC(=O)NCc3ncccc3[O-])cn2)cc1C ZINC000471210323 929077100 /nfs/dbraw/zinc/07/71/00/929077100.db2.gz KODKFPLSMSUSKU-UHFFFAOYSA-N -1 3 364.405 3.913 20 0 FHADHM O=S(=O)([N-]c1cncc(Cl)c1Cl)c1ccc(Cl)cc1F ZINC000180288527 929444713 /nfs/dbraw/zinc/44/47/13/929444713.db2.gz PXLSQVCJGUCWGB-UHFFFAOYSA-N -1 3 355.605 3.982 20 0 FHADHM CCOc1cc2c(cc1/C=C\C(=O)Nc1cccc([O-])c1F)O[C@@H](C)C2 ZINC000255044404 929559138 /nfs/dbraw/zinc/55/91/38/929559138.db2.gz AEXKPDZTGINXRT-KRZKBDHCSA-N -1 3 357.381 3.905 20 0 FHADHM C[C@@H](Cc1ccsc1)NCc1ccc(C(=O)[O-])cc1Br ZINC000235131179 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C[C@@H]1CN(Cc2coc(-c3ccccc3C(F)(F)F)n2)C[C@@]1(C)C(=O)[O-] ZINC000634693602 930282044 /nfs/dbraw/zinc/28/20/44/930282044.db2.gz GSKRSFNPSXIQOJ-PIGZYNQJSA-N -1 3 368.355 3.903 20 0 FHADHM O=C(Nc1ccc(Br)cc1[O-])[C@H]1CCCN1c1ccccc1 ZINC000683821731 930299768 /nfs/dbraw/zinc/29/97/68/930299768.db2.gz ZLWGRORWSIOMHX-OAHLLOKOSA-N -1 3 361.239 3.762 20 0 FHADHM O=S(=O)([N-][C@@H]1CCC[C@H](F)C1)c1cc(Cl)ccc1Br ZINC000580187100 930340947 /nfs/dbraw/zinc/34/09/47/930340947.db2.gz ABRNHKLJLNZGFB-VHSXEESVSA-N -1 3 370.671 3.662 20 0 FHADHM COc1ccc(C)cc1S(=O)(=O)[N-]c1cccc(CN2CCCCC2)c1 ZINC000580192544 930346995 /nfs/dbraw/zinc/34/69/95/930346995.db2.gz SFYGWDNBKJSEQO-UHFFFAOYSA-N -1 3 374.506 3.790 20 0 FHADHM COC(=O)c1cc(Nc2cccc([O-])c2Cl)c(NC(C)=O)cc1OC ZINC001210859759 930418793 /nfs/dbraw/zinc/41/87/93/930418793.db2.gz NDDTYTDZIWFIGD-UHFFFAOYSA-N -1 3 364.785 3.543 20 0 FHADHM CCOc1cc([C@H]2NC3(CC3)C(=O)N2c2ccccc2)cc(Cl)c1[O-] ZINC000580289071 930442190 /nfs/dbraw/zinc/44/21/90/930442190.db2.gz 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ZINC000580758764 931116938 /nfs/dbraw/zinc/11/69/38/931116938.db2.gz MGZWJWOZHRYPDW-UHFFFAOYSA-N -1 3 353.451 3.607 20 0 FHADHM CCc1ccc(S(=O)(=O)[N-]c2ccc(OC[C@@H]3CCCO3)cc2)cc1 ZINC000055631565 931166003 /nfs/dbraw/zinc/16/60/03/931166003.db2.gz SEDSWZGCHCNIRH-SFHVURJKSA-N -1 3 361.463 3.608 20 0 FHADHM O=C1[N-]C(=O)C(=CNc2ccc(Oc3ccncc3)cc2)c2ccccc21 ZINC000050530203 931240454 /nfs/dbraw/zinc/24/04/54/931240454.db2.gz PLYPZQMXAZFJFL-CPNJWEJPSA-N -1 3 357.369 3.597 20 0 FHADHM CC[C@@H](Nc1ccc(OC)c([N-]S(C)(=O)=O)c1)c1ccc(F)cc1 ZINC000160716659 931440878 /nfs/dbraw/zinc/44/08/78/931440878.db2.gz OIPXVPJIKONNBG-OAHLLOKOSA-N -1 3 352.431 3.769 20 0 FHADHM CC(=O)c1cccc(NC(=O)c2ccc(OC(C)C)c(C(C)=O)c2)c1[O-] ZINC000656395872 931578036 /nfs/dbraw/zinc/57/80/36/931578036.db2.gz AOHSLQAUDYDNSQ-UHFFFAOYSA-N -1 3 355.390 3.837 20 0 FHADHM Cc1cc(F)cc(C(=O)Nc2cc(I)ccc2[O-])c1 ZINC000610490456 931741640 /nfs/dbraw/zinc/74/16/40/931741640.db2.gz APYIZNSQXNRCLY-UHFFFAOYSA-N -1 3 371.149 3.697 20 0 FHADHM CC(=O)c1ccc(OCc2cc(=O)[n-]c(C3CC3)n2)c(Br)c1 ZINC000650337544 931970356 /nfs/dbraw/zinc/97/03/56/931970356.db2.gz ZEZOMEGTWTXCIR-UHFFFAOYSA-N -1 3 363.211 3.604 20 0 FHADHM COCc1csc(CN[C@H](C(=O)[O-])c2ccc(Br)cc2)c1 ZINC000656565536 932082289 /nfs/dbraw/zinc/08/22/89/932082289.db2.gz PHCQWGBWJNUZQE-AWEZNQCLSA-N -1 3 370.268 3.573 20 0 FHADHM CCc1ccc(C(=O)N2CCC(C(=O)c3cc(F)ccc3F)CC2)c([O-])c1 ZINC000276218898 932116526 /nfs/dbraw/zinc/11/65/26/932116526.db2.gz LCPYTQBHZPJWJV-UHFFFAOYSA-N -1 3 373.399 3.968 20 0 FHADHM CCOc1cc(CN2C[C@@H](C(F)(F)F)OC[C@H]2C)cc(Cl)c1[O-] ZINC000656610069 932167863 /nfs/dbraw/zinc/16/78/63/932167863.db2.gz DFZURLYBKZKJTE-RNCFNFMXSA-N -1 3 353.768 3.596 20 0 FHADHM CCCc1cc(=O)[n-]c(C(=Cc2ccc(O[C@@H]3CCOC3)cc2)CC)n1 ZINC000656613194 932175205 /nfs/dbraw/zinc/17/52/05/932175205.db2.gz HJBSUAYUAMLKAX-APEZIOSESA-N -1 3 354.450 3.841 20 0 FHADHM CSc1ccncc1[N-]C(=O)c1cc2c(C(F)F)nn(C)c2s1 ZINC000684287174 932183547 /nfs/dbraw/zinc/18/35/47/932183547.db2.gz 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CCc1cccc(C(=O)N[C@H](c2nc(-c3ccncc3)no2)C(C)C)c1[O-] ZINC000094088254 938934626 /nfs/dbraw/zinc/93/46/26/938934626.db2.gz DBXMIPXEKUDUPA-INIZCTEOSA-N -1 3 366.421 3.527 20 0 FHADHM COC(=O)c1cccc2[n-]c(NC(=O)[C@H]3C[C@@H]3c3ccccc3Cl)nc21 ZINC000219865607 938964314 /nfs/dbraw/zinc/96/43/14/938964314.db2.gz PLENDHMCARWSKX-OLZOCXBDSA-N -1 3 369.808 3.745 20 0 FHADHM COC(=O)c1cccc2[n-]c(NC(=O)[C@@H]3C[C@H]3c3ccccc3Cl)nc21 ZINC000219865650 938964381 /nfs/dbraw/zinc/96/43/81/938964381.db2.gz PLENDHMCARWSKX-QWHCGFSZSA-N -1 3 369.808 3.745 20 0 FHADHM COc1ccc(OC)c([C@@H](C)NC(=O)CCCc2ccc([O-])c(F)c2)c1 ZINC000468412510 939006744 /nfs/dbraw/zinc/00/67/44/939006744.db2.gz TURCWAJMSWUSLS-CYBMUJFWSA-N -1 3 361.413 3.749 20 0 FHADHM CCOC(=O)c1ncc(NC(=O)CC(c2ccccc2)c2ccccc2)[n-]1 ZINC000617871993 939010707 /nfs/dbraw/zinc/01/07/07/939010707.db2.gz KTHAKWFPMDPARZ-UHFFFAOYSA-N -1 3 363.417 3.747 20 0 FHADHM CCOC(=O)c1nc(NC(=O)CC(c2ccccc2)c2ccccc2)c[n-]1 ZINC000617871993 939010708 /nfs/dbraw/zinc/01/07/08/939010708.db2.gz KTHAKWFPMDPARZ-UHFFFAOYSA-N -1 3 363.417 3.747 20 0 FHADHM [O-]c1ccc(Br)cc1CN1CCSC[C@@H]1c1nccs1 ZINC000186661765 939014958 /nfs/dbraw/zinc/01/49/58/939014958.db2.gz BJJAFEGCUUWFNO-GFCCVEGCSA-N -1 3 371.325 3.901 20 0 FHADHM [O-]c1cc(Br)cnc1CN[C@@H]1CCSc2ccccc21 ZINC000892415418 939013027 /nfs/dbraw/zinc/01/30/27/939013027.db2.gz HBYYSRZBWMFMTH-GFCCVEGCSA-N -1 3 351.269 3.876 20 0 FHADHM O=C(Nc1ccc(-c2ccccc2)cc1)Nc1ccc2c(c1)C(=O)[N-]C2=O ZINC000065770572 939063345 /nfs/dbraw/zinc/06/33/45/939063345.db2.gz PCVNYGWCXVDFTK-UHFFFAOYSA-N -1 3 357.369 3.881 20 0 FHADHM Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)NC[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000438923007 945227417 /nfs/dbraw/zinc/22/74/17/945227417.db2.gz WYMOUWZKKGPLNF-NWDGAFQWSA-N -1 3 373.419 3.887 20 0 FHADHM Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)NC[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000438923009 945227487 /nfs/dbraw/zinc/22/74/87/945227487.db2.gz WYMOUWZKKGPLNF-VXGBXAGGSA-N -1 3 373.419 3.887 20 0 FHADHM CCOC(=O)c1ccc(NC(=O)c2ccc(C(F)(F)F)s2)c([O-])c1 ZINC000586802062 939216018 /nfs/dbraw/zinc/21/60/18/939216018.db2.gz XTWMPXRFZDQIQI-UHFFFAOYSA-N -1 3 359.325 3.902 20 0 FHADHM O=C(Nc1sc2c(c1-c1nnn[n-]1)CCCC2)[C@@H]1C[C@@H]1C1CCCCC1 ZINC000738210553 945254671 /nfs/dbraw/zinc/25/46/71/945254671.db2.gz RASPOCHCHOQDMD-ZIAGYGMSSA-N -1 3 371.510 3.962 20 0 FHADHM O=C(Nc1sc2c(c1-c1nn[n-]n1)CCCC2)[C@@H]1C[C@@H]1C1CCCCC1 ZINC000738210553 945254680 /nfs/dbraw/zinc/25/46/80/945254680.db2.gz RASPOCHCHOQDMD-ZIAGYGMSSA-N -1 3 371.510 3.962 20 0 FHADHM CCCc1noc2nc(-c3ccco3)cc(C(=O)[N-]c3nnc(C)s3)c12 ZINC000516796007 945253773 /nfs/dbraw/zinc/25/37/73/945253773.db2.gz BVQSBIUKYGFWJD-UHFFFAOYSA-N -1 3 369.406 3.848 20 0 FHADHM C[C@@H]1Cc2cc(S(=O)(=O)[N-]c3ccc(OC(F)(F)F)cc3)ccc2O1 ZINC000519266719 945259527 /nfs/dbraw/zinc/25/95/27/945259527.db2.gz FCYNSCOUDXXSDN-SNVBAGLBSA-N -1 3 373.352 3.709 20 0 FHADHM Cc1c([N-]S(=O)(=O)c2ccc3c(c2)C[C@@H](C)O3)cccc1-c1ncco1 ZINC000427303274 945271245 /nfs/dbraw/zinc/27/12/45/945271245.db2.gz YTZKCMUGOMMWJU-GFCCVEGCSA-N -1 3 370.430 3.774 20 0 FHADHM O=C(CCc1ccc(Cl)cc1)OCc1noc(-c2ccccc2[O-])n1 ZINC000782599682 939935862 /nfs/dbraw/zinc/93/58/62/939935862.db2.gz DRZBBCCXTTWKJJ-UHFFFAOYSA-N -1 3 358.781 3.772 20 0 FHADHM O=C(c1cc([O-])ccc1Cl)N1C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C1 ZINC000685767576 940008898 /nfs/dbraw/zinc/00/88/98/940008898.db2.gz TWLXSDZMNFNXKI-RKDXNWHRSA-N -1 3 361.669 3.858 20 0 FHADHM CSc1ccc([O-])c(C(=O)N2CCC3(CC2)OCc2ccccc23)c1 ZINC000612379153 940036860 /nfs/dbraw/zinc/03/68/60/940036860.db2.gz SWEBFBPIJKDZIY-UHFFFAOYSA-N -1 3 355.459 3.776 20 0 FHADHM O=C(Nc1cc(Br)ccc1[O-])c1ccncc1Br ZINC000159879537 940177682 /nfs/dbraw/zinc/17/76/82/940177682.db2.gz FEYYCEKKQMFBCB-UHFFFAOYSA-N -1 3 372.016 3.565 20 0 FHADHM COc1cc(CN(C(=O)c2cc(SC)ccc2[O-])C2CC2)ccc1O ZINC000612623615 940185031 /nfs/dbraw/zinc/18/50/31/940185031.db2.gz NVWRGYZKFQOPDN-UHFFFAOYSA-N -1 3 359.447 3.633 20 0 FHADHM O=C(N=c1cc2ccc(Br)cn2[n-]1)c1ccc(C(F)F)cc1 ZINC000511359114 940189370 /nfs/dbraw/zinc/18/93/70/940189370.db2.gz DEQXPOACUYQFDT-UHFFFAOYSA-N -1 3 366.165 3.709 20 0 FHADHM C[C@@H](OC(=O)c1cc(Cl)c(Cl)[n-]1)c1ccc(S(C)(=O)=O)cc1 ZINC000782627100 940196114 /nfs/dbraw/zinc/19/61/14/940196114.db2.gz HXFYUSIBRKCLBX-MRVPVSSYSA-N -1 3 362.234 3.643 20 0 FHADHM O=C(NCc1ccc([O-])c(F)c1)NCc1ccc(F)cc1C(F)(F)F ZINC000155963293 940399581 /nfs/dbraw/zinc/39/95/81/940399581.db2.gz OVPCGQVQQGTDSI-UHFFFAOYSA-N -1 3 360.282 3.689 20 0 FHADHM O=C(Nc1ccc(Cl)cc1[O-])c1c(C(F)(F)F)nc2n1CCCC2 ZINC000613028238 940405243 /nfs/dbraw/zinc/40/52/43/940405243.db2.gz OHIDRLUQLCRJRG-UHFFFAOYSA-N -1 3 359.735 3.850 20 0 FHADHM O=C(c1cc([O-])ccc1Cl)N1CCO[C@@H](c2ccc(Cl)cc2)C1 ZINC000431729699 940427100 /nfs/dbraw/zinc/42/71/00/940427100.db2.gz DSXPKDOBBLIVLE-MRXNPFEDSA-N -1 3 352.217 3.913 20 0 FHADHM CC(C)Oc1ccc(CC[C@@H](C)NC(=O)c2cc(F)cc3n[n-]nc32)cc1 ZINC000431730308 940433212 /nfs/dbraw/zinc/43/32/12/940433212.db2.gz GWUDZDLTFXRSCP-CYBMUJFWSA-N -1 3 370.428 3.635 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N3CCOc4ccc(C)cc4C3)nc2)n1 ZINC000376209044 940470319 /nfs/dbraw/zinc/47/03/19/940470319.db2.gz URSLPRQSLDFYGZ-UHFFFAOYSA-N -1 3 362.433 3.514 20 0 FHADHM CC(C)CC(=O)Nc1cccc(CNC(=O)c2cc([O-])ccc2Cl)c1 ZINC000431762161 940478996 /nfs/dbraw/zinc/47/89/96/940478996.db2.gz XPQBOHCKKOEAED-UHFFFAOYSA-N -1 3 360.841 3.960 20 0 FHADHM Cc1csc(-c2ccc(NC(=O)c3cc(F)cc4n[n-]nc43)cc2)n1 ZINC000431769998 940486871 /nfs/dbraw/zinc/48/68/71/940486871.db2.gz JMEJXKVPFLKFQY-UHFFFAOYSA-N -1 3 353.382 3.781 20 0 FHADHM Cc1cc(Br)sc1S(=O)(=O)[N-]C[C@@H]1CCC[C@H]1C ZINC001211639212 940492734 /nfs/dbraw/zinc/49/27/34/940492734.db2.gz YMGVYQCAPQQTGQ-SCZZXKLOSA-N -1 3 352.319 3.534 20 0 FHADHM O=C(COc1cccc(Br)c1)Nc1ccc(Cl)cc1[O-] ZINC000536220844 940500025 /nfs/dbraw/zinc/50/00/25/940500025.db2.gz WQASDFASWBUOEE-UHFFFAOYSA-N -1 3 356.603 3.826 20 0 FHADHM CCc1ccc([C@H](O)CNc2ccc(-c3nc(CC)cc(=O)[n-]3)cn2)cc1 ZINC000376241383 940509032 /nfs/dbraw/zinc/50/90/32/940509032.db2.gz JNEJPBUIZFLIIL-GOSISDBHSA-N -1 3 364.449 3.515 20 0 FHADHM O=C(NCc1cc(=O)[n-]c(C2CCC2)n1)c1[nH]c2ccccc2c1Cl ZINC000636318669 940606421 /nfs/dbraw/zinc/60/64/21/940606421.db2.gz DGQHWHHHNGUGCY-UHFFFAOYSA-N -1 3 356.813 3.514 20 0 FHADHM O=C(NCc1cc(=O)[n-]c(C2CCC2)n1)c1cc(Cl)cc(Cl)c1F ZINC000636324370 940622193 /nfs/dbraw/zinc/62/21/93/940622193.db2.gz XMDIFBHBIHWVBY-UHFFFAOYSA-N -1 3 370.211 3.826 20 0 FHADHM COC(=O)c1ccc(-c2nc(C3(c4ccccc4F)CCCC3)no2)[n-]1 ZINC000426611294 945336931 /nfs/dbraw/zinc/33/69/31/945336931.db2.gz ISFHBLWXRWNYDI-UHFFFAOYSA-N -1 3 355.369 3.851 20 0 FHADHM CC(C)C[C@H](C(=O)N1CCc2c(=O)[n-]cnc2C1)c1ccc(Cl)cc1 ZINC000613429250 940699888 /nfs/dbraw/zinc/69/98/88/940699888.db2.gz MTLGOYNTQNRXCX-INIZCTEOSA-N -1 3 359.857 3.550 20 0 FHADHM CC(C)n1cc(Br)cc1C(=O)NCc1ccc([O-])c(F)c1 ZINC000174210361 940710679 /nfs/dbraw/zinc/71/06/79/940710679.db2.gz IGRVIOCVJACYFY-UHFFFAOYSA-N -1 3 355.207 3.606 20 0 FHADHM Cc1ccccc1[C@@H](C(C)C)N(C)C(=O)Nc1ccc2c(c1)C(=O)[N-]C2=O ZINC000112385551 945351434 /nfs/dbraw/zinc/35/14/34/945351434.db2.gz SNQCDDRKDJEUCT-GOSISDBHSA-N -1 3 365.433 3.740 20 0 FHADHM Cc1cnc([C@@H](C)[N-]S(=O)(=O)c2cc(C(F)(F)F)ccc2F)s1 ZINC000175626940 940896018 /nfs/dbraw/zinc/89/60/18/940896018.db2.gz LRHZBVRBXMMEIF-MRVPVSSYSA-N -1 3 368.377 3.649 20 0 FHADHM Cc1ccc(Cl)c(S(=O)(=O)[N-][C@H]2CCOC3(CCC3)C2)c1Cl ZINC000330126649 945367921 /nfs/dbraw/zinc/36/79/21/945367921.db2.gz CDNYDIUQKJKHHD-NSHDSACASA-N -1 3 364.294 3.682 20 0 FHADHM O=C(CCc1ncc(-c2ccc(Cl)cc2)o1)[N-]OCCC(F)(F)F ZINC000162964132 941065090 /nfs/dbraw/zinc/06/50/90/941065090.db2.gz HEZVCMHFDMEPGR-UHFFFAOYSA-N -1 3 362.735 3.928 20 0 FHADHM COc1ccc(C(=O)N[C@H](C)c2noc(-c3ccc(Cl)cc3)n2)c([O-])c1 ZINC000176772066 941075871 /nfs/dbraw/zinc/07/58/71/941075871.db2.gz KVXWCQGPVUWDLC-SNVBAGLBSA-N -1 3 373.796 3.595 20 0 FHADHM CC(C)[C@@H](C[N-]S(=O)(=O)c1cc(F)ccc1Cl)c1cccnc1 ZINC000177016935 941094017 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CC1(C)C[C@H](N(Cc2ccccc2)C(=O)NCc2ccc([O-])c(F)c2)CO1 ZINC000664189876 941942029 /nfs/dbraw/zinc/94/20/29/941942029.db2.gz APQZBVLSIRWYON-KRWDZBQOSA-N -1 3 372.440 3.811 20 0 FHADHM Cc1ccc(-c2nc(NC(=O)c3ccc(F)cc3C(F)(F)F)n[n-]2)o1 ZINC000181874819 942092888 /nfs/dbraw/zinc/09/28/88/942092888.db2.gz PMKHPLLNQGZRMH-UHFFFAOYSA-N -1 3 354.263 3.783 20 0 FHADHM O=S(=O)([N-]Cc1cc(F)cc(F)c1)c1c(Cl)cccc1Cl ZINC000030518370 942181088 /nfs/dbraw/zinc/18/10/88/942181088.db2.gz WJNODDMAGTVDLA-UHFFFAOYSA-N -1 3 352.189 3.750 20 0 FHADHM CCc1c(C(=O)CSCc2cc(=O)[n-]c(C3CC3)n2)[nH]c(C)c1C(C)=O ZINC000419585512 942322575 /nfs/dbraw/zinc/32/25/75/942322575.db2.gz KHBBCLAYUILBSM-UHFFFAOYSA-N -1 3 373.478 3.577 20 0 FHADHM CO[C@H](CC(C)C)CS(=O)(=O)[N-]c1cccc(-c2nc(C)c(C)o2)c1 ZINC000421160922 942378518 /nfs/dbraw/zinc/37/85/18/942378518.db2.gz ZBUQZDDSWYEMNJ-QGZVFWFLSA-N -1 3 366.483 3.761 20 0 FHADHM O=C(Nc1cc(Cl)ccc1[O-])c1cccc([N+](=O)[O-])c1Br ZINC000180543771 942381209 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FHADHM COc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)OC2(CCCC2)O3)cc1 ZINC000007055647 944480649 /nfs/dbraw/zinc/48/06/49/944480649.db2.gz FCWMRMLEVFNAFG-UHFFFAOYSA-N -1 3 361.419 3.538 20 0 FHADHM CC(=O)c1ccc(C(=O)NCCCO[C@@H]2CCCc3ccccc32)cc1[O-] ZINC000436650612 944480759 /nfs/dbraw/zinc/48/07/59/944480759.db2.gz SDLGDJRFXKFSRU-OAQYLSRUSA-N -1 3 367.445 3.809 20 0 FHADHM CC(=O)c1ccc(C(=O)N(Cc2ccccc2)CC2CCOCC2)cc1[O-] ZINC000436651651 944482614 /nfs/dbraw/zinc/48/26/14/944482614.db2.gz XNLQZLWHIDRYRR-UHFFFAOYSA-N -1 3 367.445 3.664 20 0 FHADHM COc1ccc(C(=O)N[C@H](c2c[nH]c3ccccc32)C(F)(F)F)c([O-])c1 ZINC000436656139 944488267 /nfs/dbraw/zinc/48/82/67/944488267.db2.gz OUCURHOZDJDODV-MRXNPFEDSA-N -1 3 364.323 3.916 20 0 FHADHM CC[C@H](C)Oc1cccc(NC(=O)CCNC(=O)c2ccc(C)cc2[O-])c1 ZINC000436665092 944498739 /nfs/dbraw/zinc/49/87/39/944498739.db2.gz LLZSMZOMPILTOG-HNNXBMFYSA-N -1 3 370.449 3.637 20 0 FHADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CC[C@@H](COC(F)F)C1 ZINC000436666148 944501777 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ZINC000436754674 944597158 /nfs/dbraw/zinc/59/71/58/944597158.db2.gz JONQXHRVRZSSSS-UHFFFAOYSA-N -1 3 362.832 3.579 20 0 FHADHM COc1ccc(C(=O)N[C@@H](C)c2nc3ccccc3n2C(F)F)c([O-])c1 ZINC000436755817 944598230 /nfs/dbraw/zinc/59/82/30/944598230.db2.gz AHEZSIVXXXNUAV-JTQLQIEISA-N -1 3 361.348 3.637 20 0 FHADHM COc1ccc(C(=O)NCc2ccc(OC)c(OC3CCCC3)c2)c([O-])c1 ZINC000436776970 944606350 /nfs/dbraw/zinc/60/63/50/944606350.db2.gz BARFOCGZZHSIGY-UHFFFAOYSA-N -1 3 371.433 3.661 20 0 FHADHM CC(C)[C@@H](C)CNC(=O)C[C@@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000183923951 944607725 /nfs/dbraw/zinc/60/77/25/944607725.db2.gz WTQNLIFPZZLIRM-OXJNMPFZSA-N -1 3 368.477 3.662 20 0 FHADHM CC1(C)Cc2ccc(C(=O)Nc3cnn(Cc4ccccc4)c3)c([O-])c2O1 ZINC000436785081 944629321 /nfs/dbraw/zinc/62/93/21/944629321.db2.gz ZTKWHYGTOSFFSX-UHFFFAOYSA-N -1 3 363.417 3.603 20 0 FHADHM COc1ccccc1[C@@H](CC(C)C)NC(=O)c1cc(NC(C)=O)ccc1[O-] ZINC000436791709 944642143 /nfs/dbraw/zinc/64/21/43/944642143.db2.gz SVDDYCRJPKGPEJ-GOSISDBHSA-N -1 3 370.449 3.876 20 0 FHADHM CCc1ccc(C(=O)N[C@@H](c2nccn2C)c2ccc(Cl)cc2)c([O-])c1 ZINC000436815718 944651535 /nfs/dbraw/zinc/65/15/35/944651535.db2.gz XIDWMJZSHBZKSC-GOSISDBHSA-N -1 3 369.852 3.861 20 0 FHADHM O=C(NCCCc1c[nH]c2ccc(F)cc12)c1c[n-]c2ccccc2c1=O ZINC000506239554 944656023 /nfs/dbraw/zinc/65/60/23/944656023.db2.gz WNOABCYJDVUJAA-UHFFFAOYSA-N -1 3 363.392 3.511 20 0 FHADHM COC(=O)c1cccc([N-]C(=O)c2cc(-c3cccc(Cl)c3)no2)c1O ZINC000436804830 944658890 /nfs/dbraw/zinc/65/88/90/944658890.db2.gz VULUXAXOJHMCQG-UHFFFAOYSA-N -1 3 372.764 3.740 20 0 FHADHM C[C@@H](O)C[C@H]1CCCCN1C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436812921 944668503 /nfs/dbraw/zinc/66/85/03/944668503.db2.gz YMCVSZWOJSGMDP-HZPDHXFCSA-N -1 3 355.434 3.950 20 0 FHADHM COc1ccc(C(=O)N(C)Cc2ccc(OCC(F)(F)F)cc2)c([O-])c1 ZINC000436828739 944674465 /nfs/dbraw/zinc/67/44/65/944674465.db2.gz MXYNMXMOXSFDDZ-UHFFFAOYSA-N -1 3 369.339 3.614 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)NC[C@H](Cc2ccccc2)C(C)C)c1 ZINC000436831725 944678357 /nfs/dbraw/zinc/67/83/57/944678357.db2.gz GDQFJOLHTNFGJA-KRWDZBQOSA-N -1 3 354.450 3.595 20 0 FHADHM Cc1ccc(C(=O)N(C)CCOc2ccc(C(F)(F)F)cc2)c([O-])c1 ZINC000436834273 944680060 /nfs/dbraw/zinc/68/00/60/944680060.db2.gz LSPSHUBQKXEXFP-UHFFFAOYSA-N -1 3 353.340 3.870 20 0 FHADHM CCc1ccc(C(=O)N2CCC(Nc3cccc(OC)c3)CC2)c([O-])c1 ZINC000436834152 944681506 /nfs/dbraw/zinc/68/15/06/944681506.db2.gz NTGIIJYORHZXIN-UHFFFAOYSA-N -1 3 354.450 3.680 20 0 FHADHM COc1ccc(C(=O)N[C@@H](C)Cc2ccc(C(F)(F)F)cc2)c([O-])c1 ZINC000436835531 944683978 /nfs/dbraw/zinc/68/39/78/944683978.db2.gz AETWPMZJZKUTQN-NSHDSACASA-N -1 3 353.340 3.781 20 0 FHADHM Cc1ccc(C(=O)Nc2ccccc2C(=O)N2CCC(C)CC2)c([O-])c1 ZINC000436819364 944688139 /nfs/dbraw/zinc/68/81/39/944688139.db2.gz IBINTECWDWGBQY-UHFFFAOYSA-N -1 3 352.434 3.825 20 0 FHADHM CC(C)c1ccc(C(=O)N(C)Cc2nc(-c3cccs3)no2)c([O-])c1 ZINC000436821861 944690815 /nfs/dbraw/zinc/69/08/15/944690815.db2.gz QQOGYBVSYREQOT-UHFFFAOYSA-N -1 3 357.435 3.899 20 0 FHADHM CC1(C)Cc2ccc(C(=O)N3CCN(C4CC4)c4ccccc43)c([O-])c2O1 ZINC000436839873 944704849 /nfs/dbraw/zinc/70/48/49/944704849.db2.gz QPYQWVUTKYZGEP-UHFFFAOYSA-N -1 3 364.445 3.735 20 0 FHADHM CCc1ccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC2CC2)c([O-])c1 ZINC000436839526 944706392 /nfs/dbraw/zinc/70/63/92/944706392.db2.gz PXJBUUVRNXKVGJ-UHFFFAOYSA-N -1 3 364.445 3.896 20 0 FHADHM COc1cccc(C(=O)Nc2ccccc2O[C@@H](C)C(F)(F)F)c1[O-] ZINC000436846430 944714594 /nfs/dbraw/zinc/71/45/94/944714594.db2.gz WYIIIQUTNZTXSJ-JTQLQIEISA-N -1 3 355.312 3.983 20 0 FHADHM CC[C@H]1CN(C(=O)c2cc(CCc3ccccc3)ccc2[O-])C[C@H](C)O1 ZINC000436847800 944714747 /nfs/dbraw/zinc/71/47/47/944714747.db2.gz LSCKUWJLHQJBHL-LPHOPBHVSA-N -1 3 353.462 3.817 20 0 FHADHM COc1cc(CN[C@@H](c2ccccc2)[C@@H](C)C(=O)[O-])cc(Cl)c1OC ZINC000426723570 944725304 /nfs/dbraw/zinc/72/53/04/944725304.db2.gz MPQCBCCRBGREHL-SJKOYZFVSA-N -1 3 363.841 3.909 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@H](OC)C3CCCCC3)nc2)n1 ZINC000664587674 944726722 /nfs/dbraw/zinc/72/67/22/944726722.db2.gz VXBQGKFEKBZJCZ-KRWDZBQOSA-N -1 3 356.470 3.814 20 0 FHADHM COc1cccc(C(=O)Nc2cccc(CCC(=O)OC(C)(C)C)c2)c1[O-] ZINC000436861404 944727270 /nfs/dbraw/zinc/72/72/70/944727270.db2.gz UIULQZIQOZHOBD-UHFFFAOYSA-N -1 3 371.433 3.927 20 0 FHADHM O=C([O-])[C@@H](CNCc1ccn(-c2ccccc2)n1)Cc1ccc(Cl)cc1 ZINC000426707723 944730298 /nfs/dbraw/zinc/73/02/98/944730298.db2.gz CHLMPPBCPPTNGW-MRXNPFEDSA-N -1 3 369.852 3.559 20 0 FHADHM CCOc1c(OC)cc(CN[C@@H](C(=O)[O-])c2cccc(C)c2C)cc1OC ZINC000426734862 944745396 /nfs/dbraw/zinc/74/53/96/944745396.db2.gz RLSSBWMFXSMWKP-LJQANCHMSA-N -1 3 373.449 3.635 20 0 FHADHM C[C@@H](NC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)C1CCCCC1 ZINC000736124727 944746125 /nfs/dbraw/zinc/74/61/25/944746125.db2.gz HOIUPJMAPPWXJR-SNVBAGLBSA-N -1 3 364.906 3.775 20 0 FHADHM C[C@@H](NC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)C1CCCCC1 ZINC000736124727 944746134 /nfs/dbraw/zinc/74/61/34/944746134.db2.gz HOIUPJMAPPWXJR-SNVBAGLBSA-N -1 3 364.906 3.775 20 0 FHADHM Cc1cccc(CCC[N-]S(=O)(=O)c2c(Cl)cccc2Cl)n1 ZINC000509609943 944758371 /nfs/dbraw/zinc/75/83/71/944758371.db2.gz TVNYQLOXXPOREX-UHFFFAOYSA-N -1 3 359.278 3.608 20 0 FHADHM Cc1ccc(C(=O)NCCc2nc(-c3ccc4ccccc4c3)no2)c([O-])c1 ZINC000436885419 944760265 /nfs/dbraw/zinc/76/02/65/944760265.db2.gz NRUYRJBDHCAULR-UHFFFAOYSA-N -1 3 373.412 3.876 20 0 FHADHM COc1cccc(-c2nc([C@@H](NC(=O)c3ccccc3)C(C)C)no2)c1[O-] ZINC000436886711 944761717 /nfs/dbraw/zinc/76/17/17/944761717.db2.gz NTNLBTSUFVZVQW-INIZCTEOSA-N -1 3 367.405 3.578 20 0 FHADHM COc1cccc([C@@H](CC(=O)[O-])NCc2ccc(OC(F)(F)F)cc2)c1 ZINC000426765197 944763666 /nfs/dbraw/zinc/76/36/66/944763666.db2.gz CTHKWIAZOBVEST-MRXNPFEDSA-N -1 3 369.339 3.899 20 0 FHADHM CC1(C)CCCN(C(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)CC1 ZINC000736212416 944764150 /nfs/dbraw/zinc/76/41/50/944764150.db2.gz YEHDFSZHXTYOEH-UHFFFAOYSA-N -1 3 364.906 3.729 20 0 FHADHM CC1(C)CCCN(C(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)CC1 ZINC000736212416 944764156 /nfs/dbraw/zinc/76/41/56/944764156.db2.gz YEHDFSZHXTYOEH-UHFFFAOYSA-N -1 3 364.906 3.729 20 0 FHADHM C[C@H](CN1CCN(C(=O)c2ccc([O-])cc2)CC1)c1cccc(Cl)c1 ZINC000436891968 944767841 /nfs/dbraw/zinc/76/78/41/944767841.db2.gz JJVPPVGEIGFBBH-OAHLLOKOSA-N -1 3 358.869 3.607 20 0 FHADHM Cc1cc(C)cc([C@@H](NCc2cnn(Cc3ccc(F)cc3)c2)C(=O)[O-])c1 ZINC000426753385 944774487 /nfs/dbraw/zinc/77/44/87/944774487.db2.gz IAWXNYVCZPTSGP-HXUWFJFHSA-N -1 3 367.424 3.603 20 0 FHADHM O=C([O-])C[C@@H](NCc1ccc2ncccc2c1)c1cnn(-c2ccccc2)c1 ZINC000426755178 944775324 /nfs/dbraw/zinc/77/53/24/944775324.db2.gz XJJMDVRIUBETRZ-OAQYLSRUSA-N -1 3 372.428 3.726 20 0 FHADHM COc1cc(C)c(CN[C@@H](C(=O)[O-])c2ccc(Cl)c(F)c2)cc1OC ZINC000426755472 944776712 /nfs/dbraw/zinc/77/67/12/944776712.db2.gz ZQHKMGDFOWRMLW-QGZVFWFLSA-N -1 3 367.804 3.720 20 0 FHADHM Cc1c[nH]c(=O)n1-c1cccc(-c2nc3cc(Cl)ccc3c(=O)[n-]2)c1 ZINC000516376568 944779489 /nfs/dbraw/zinc/77/94/89/944779489.db2.gz QKBNAHRZFQTWRE-UHFFFAOYSA-N -1 3 352.781 3.856 20 0 FHADHM O=C([O-])C[C@H](NC/C=C/c1ccc(F)cc1)c1cnn(-c2ccccc2)c1 ZINC000426758482 944780930 /nfs/dbraw/zinc/78/09/30/944780930.db2.gz IGFPXBBGLHSHLA-SGSXCFNPSA-N -1 3 365.408 3.830 20 0 FHADHM [O-]c1cc2ccccc2cc1-c1nc(-c2cccnc2-n2cccn2)no1 ZINC000436911664 944781177 /nfs/dbraw/zinc/78/11/77/944781177.db2.gz UWKIYSWYOFLWHF-UHFFFAOYSA-N -1 3 355.357 3.843 20 0 FHADHM CSc1cc2c(cc1CN[C@@H](CC(=O)[O-])c1ccccc1C)OCCO2 ZINC000426770985 944788745 /nfs/dbraw/zinc/78/87/45/944788745.db2.gz XYXFSGGWLYBLPX-INIZCTEOSA-N -1 3 373.474 3.794 20 0 FHADHM CN(CC(C)(C)C)C(=O)C[C@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436932112 944795866 /nfs/dbraw/zinc/79/58/66/944795866.db2.gz MQTAUMKRZQYVKG-IBGZPJMESA-N -1 3 368.477 3.758 20 0 FHADHM COc1cccc(C[C@H](NCc2csc(-c3ccccc3)n2)C(=O)[O-])c1 ZINC000426784905 944801067 /nfs/dbraw/zinc/80/10/67/944801067.db2.gz NXJFBMXCRYSCEH-SFHVURJKSA-N -1 3 368.458 3.604 20 0 FHADHM CC[C@H](C(=O)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1)C(=O)OC ZINC000436927704 944815108 /nfs/dbraw/zinc/81/51/08/944815108.db2.gz QKHJQIBCGHHDMS-GFCCVEGCSA-N -1 3 370.430 3.807 20 0 FHADHM CCc1ccc([C@H](NCc2ccc(OC(C)C)c(OC)c2)C(=O)[O-])cc1 ZINC000426795339 944818693 /nfs/dbraw/zinc/81/86/93/944818693.db2.gz WQNPQPREHOTJEI-FQEVSTJZSA-N -1 3 357.450 3.960 20 0 FHADHM COc1cccc([C@@H](CC(=O)[O-])NCc2cc(Br)cs2)c1 ZINC000426803374 944826051 /nfs/dbraw/zinc/82/60/51/944826051.db2.gz MIEVDAIQACEBBM-CQSZACIVSA-N -1 3 370.268 3.825 20 0 FHADHM Cc1ccc([O-])c(C(=O)Nc2cccc(CN3C[C@@H](C)O[C@H](C)C3)c2)c1 ZINC000436940446 944827836 /nfs/dbraw/zinc/82/78/36/944827836.db2.gz AFNYIMAATAMATC-HZPDHXFCSA-N -1 3 354.450 3.562 20 0 FHADHM COC(=O)CCCOc1ccc(NC(=O)c2ccc(C)c(C)c2[O-])cc1 ZINC000436944532 944833311 /nfs/dbraw/zinc/83/33/11/944833311.db2.gz MWMWEHJZDFRBGY-UHFFFAOYSA-N -1 3 357.406 3.593 20 0 FHADHM COCCCOc1cc(C)ccc1-c1noc(-c2cccc(OC)c2[O-])n1 ZINC000436945428 944833433 /nfs/dbraw/zinc/83/34/33/944833433.db2.gz GAIBTFHFFGWASG-UHFFFAOYSA-N -1 3 370.405 3.842 20 0 FHADHM Cc1ccc(C(=O)N2CCc3c(Br)ccc(F)c3C2)c([O-])c1 ZINC000436947361 944833993 /nfs/dbraw/zinc/83/39/93/944833993.db2.gz LYMIWSGGUUFQSF-UHFFFAOYSA-N -1 3 364.214 3.801 20 0 FHADHM COc1cccc(CN[C@H](CC(=O)[O-])c2cccc(Br)c2)c1 ZINC000426821962 944844274 /nfs/dbraw/zinc/84/42/74/944844274.db2.gz YRCHYHOJRPLIMG-MRXNPFEDSA-N -1 3 364.239 3.763 20 0 FHADHM O=C(Nc1nnc([C@@H]2CCCc3ccccc32)s1)c1c([O-])cccc1O ZINC000436955353 944850986 /nfs/dbraw/zinc/85/09/86/944850986.db2.gz KHJNUKIIAZLBIJ-CYBMUJFWSA-N -1 3 367.430 3.670 20 0 FHADHM Cc1cccnc1C(F)(F)C(=O)[N-]CCOc1ccc(C(F)(F)F)cc1 ZINC000195361706 944860555 /nfs/dbraw/zinc/86/05/55/944860555.db2.gz HONLZGMUPBESLG-UHFFFAOYSA-N -1 3 374.309 3.696 20 0 FHADHM CCCCOc1ccc(C(=O)N(C)CCOc2ccccc2F)c([O-])c1 ZINC000436973263 944860951 /nfs/dbraw/zinc/86/09/51/944860951.db2.gz SKNHMYYHSINCCS-UHFFFAOYSA-N -1 3 361.413 3.861 20 0 FHADHM COc1cc(N(C)C(=O)c2ccc3c(c2[O-])CCCC3)cc(OC)c1OC ZINC000436969455 944876527 /nfs/dbraw/zinc/87/65/27/944876527.db2.gz 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O=S(=O)([N-][C@H](c1ccccc1)C1(CO)CCC1)c1ccc(Cl)s1 ZINC000432283559 947078623 /nfs/dbraw/zinc/07/86/23/947078623.db2.gz IKEQDQURWABWHW-OAHLLOKOSA-N -1 3 371.911 3.584 20 0 FHADHM CCC(CC)n1nc(C(=O)Nc2sc(C)c(C)c2-c2nnn[n-]2)cc1C ZINC000825114141 947082462 /nfs/dbraw/zinc/08/24/62/947082462.db2.gz JZAQUCLXZGKWEL-UHFFFAOYSA-N -1 3 373.486 3.663 20 0 FHADHM CCC(CC)n1nc(C(=O)Nc2sc(C)c(C)c2-c2nn[n-]n2)cc1C ZINC000825114141 947082470 /nfs/dbraw/zinc/08/24/70/947082470.db2.gz JZAQUCLXZGKWEL-UHFFFAOYSA-N -1 3 373.486 3.663 20 0 FHADHM CCc1ccc([O-])c(C(=O)N(C)Cc2ccc(OC)c(OC(F)F)c2)c1 ZINC000523319421 947111827 /nfs/dbraw/zinc/11/18/27/947111827.db2.gz ZXZVIHYYUYJTAN-UHFFFAOYSA-N -1 3 365.376 3.837 20 0 FHADHM CCCOCc1ccccc1CNc1ncc(Cl)c(C)c1-c1nnn[n-]1 ZINC000825339099 947158895 /nfs/dbraw/zinc/15/88/95/947158895.db2.gz MRRDCLYYQXTBIO-UHFFFAOYSA-N -1 3 372.860 3.762 20 0 FHADHM CCCOCc1ccccc1CNc1ncc(Cl)c(C)c1-c1nn[n-]n1 ZINC000825339099 947158902 /nfs/dbraw/zinc/15/89/02/947158902.db2.gz MRRDCLYYQXTBIO-UHFFFAOYSA-N -1 3 372.860 3.762 20 0 FHADHM Cc1nc2ccccc2n1CCNc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1 ZINC000301172382 947216159 /nfs/dbraw/zinc/21/61/59/947216159.db2.gz KQLSPWIOIIXXGQ-UHFFFAOYSA-N -1 3 374.448 3.631 20 0 FHADHM CC[C@H]1[C@H](C)CCN1C(=O)c1c[n-]c2ccc(Br)cc2c1=O ZINC000444363262 947229785 /nfs/dbraw/zinc/22/97/85/947229785.db2.gz IVKVWRDGIUBMKS-BMIGLBTASA-N -1 3 363.255 3.551 20 0 FHADHM Cc1oc(-c2cccs2)nc1CN1CC[C@](C(=O)[O-])(c2ccccc2)C1 ZINC000652501710 947240234 /nfs/dbraw/zinc/24/02/34/947240234.db2.gz JKQZCYNMXUJAJN-HXUWFJFHSA-N -1 3 368.458 3.940 20 0 FHADHM COc1ccc(-c2noc([C@H](C)N3CCC[C@@H](C(C)(C)C(=O)[O-])C3)n2)cc1 ZINC000652498643 947247927 /nfs/dbraw/zinc/24/79/27/947247927.db2.gz OSTNLYKZZBGRNJ-DZGCQCFKSA-N -1 3 373.453 3.629 20 0 FHADHM O=C(CCC(=O)c1ccc2ccccc2c1)NCc1ccc([O-])c(F)c1 ZINC000523424357 947254527 /nfs/dbraw/zinc/25/45/27/947254527.db2.gz UMLPIKNFEOAVNR-UHFFFAOYSA-N -1 3 351.377 3.964 20 0 FHADHM Fc1ccccc1[N-]c1nnc(Sc2ccc3nccnc3n2)s1 ZINC000301289356 947268426 /nfs/dbraw/zinc/26/84/26/947268426.db2.gz WFFTYSTXXUJAQB-UHFFFAOYSA-N -1 3 356.411 3.910 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@@H](OC)c3ccccc3)nc2)n1 ZINC000301381022 947318249 /nfs/dbraw/zinc/31/82/49/947318249.db2.gz UIPPIVALQWEZOW-QGZVFWFLSA-N -1 3 350.422 3.606 20 0 FHADHM Cc1ccc(NC(=O)CC2CC2)cc1S(=O)(=O)[N-]c1ccccc1F ZINC000028965403 947319959 /nfs/dbraw/zinc/31/99/59/947319959.db2.gz WEEIURBXQSUBAE-UHFFFAOYSA-N -1 3 362.426 3.674 20 0 FHADHM CC(C)CO[C@H](C)c1noc(CN(C)Cc2cc(Cl)ccc2[O-])n1 ZINC000093885734 947498588 /nfs/dbraw/zinc/49/85/88/947498588.db2.gz VNQKNPKZEMGSRR-GFCCVEGCSA-N -1 3 353.850 3.794 20 0 FHADHM COc1cc(C(=O)N(C)[C@@H](C)CSc2ccccc2)cc(OC)c1[O-] ZINC000652622502 947524085 /nfs/dbraw/zinc/52/40/85/947524085.db2.gz MEAYNWBHDVRAQY-ZDUSSCGKSA-N -1 3 361.463 3.662 20 0 FHADHM CCOC(=O)c1ccc(NC(=O)[C@H]2CCCC[C@@H]2C(F)(F)F)c([O-])c1 ZINC000536337345 947535069 /nfs/dbraw/zinc/53/50/69/947535069.db2.gz XLIAWFYQCPNCOX-RYUDHWBXSA-N -1 3 359.344 3.876 20 0 FHADHM COc1ccc(Cl)cc1-c1cc(=NC(=O)C[C@@H](C)c2cccnc2)[nH][n-]1 ZINC000523756475 947572284 /nfs/dbraw/zinc/57/22/84/947572284.db2.gz SWIMEGXBPMZFCZ-GFCCVEGCSA-N -1 3 370.840 3.688 20 0 FHADHM CC(C)c1ccc([C@H]2CCCN2C(=O)CNC(=O)c2ccc([O-])cc2)cc1 ZINC000536353877 947664960 /nfs/dbraw/zinc/66/49/60/947664960.db2.gz KQTHBFFYUAMNGF-HXUWFJFHSA-N -1 3 366.461 3.609 20 0 FHADHM CSc1cc(C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)ccc1F ZINC000826229604 947671644 /nfs/dbraw/zinc/67/16/44/947671644.db2.gz KOQSMBPOZCMIPS-UHFFFAOYSA-N -1 3 363.805 3.633 20 0 FHADHM CSc1cc(C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)ccc1F ZINC000826229604 947671649 /nfs/dbraw/zinc/67/16/49/947671649.db2.gz KOQSMBPOZCMIPS-UHFFFAOYSA-N -1 3 363.805 3.633 20 0 FHADHM CCOc1cc(C=NNC(=O)c2ccc(Cl)cc2)cc(Cl)c1[O-] ZINC000254835091 947672885 /nfs/dbraw/zinc/67/28/85/947672885.db2.gz SSBJIUABDHXSIE-UHFFFAOYSA-N -1 3 353.205 3.862 20 0 FHADHM CC(C)c1ccc(-c2nc(CC(=O)N[C@@H](C)c3ccccc3)no2)c([O-])c1 ZINC000445305246 947690223 /nfs/dbraw/zinc/69/02/23/947690223.db2.gz ZLLCHVBNSMZHPL-AWEZNQCLSA-N -1 3 365.433 3.986 20 0 FHADHM CC(=O)c1ccc(C(=O)N2CCC[C@@H](c3nc4ccccc4o3)C2)cc1[O-] ZINC000663302090 947697282 /nfs/dbraw/zinc/69/72/82/947697282.db2.gz GJLVKYKFPVJZLX-OAHLLOKOSA-N -1 3 364.401 3.756 20 0 FHADHM CC(=CC(=O)Nc1nc(C)cc(C)c1-c1nnn[n-]1)c1cccc(Cl)c1 ZINC001573361800 947697639 /nfs/dbraw/zinc/69/76/39/947697639.db2.gz DZFXHKVFMDMIRY-CSKARUKUSA-N -1 3 368.828 3.574 20 0 FHADHM CC(=CC(=O)Nc1nc(C)cc(C)c1-c1nn[n-]n1)c1cccc(Cl)c1 ZINC001573361800 947697645 /nfs/dbraw/zinc/69/76/45/947697645.db2.gz DZFXHKVFMDMIRY-CSKARUKUSA-N -1 3 368.828 3.574 20 0 FHADHM Cc1c2c(sc1NC(=O)c1ccc(-c3nnn[n-]3)cc1C)CCCC2 ZINC000826251484 947728466 /nfs/dbraw/zinc/72/84/66/947728466.db2.gz QXIQIMZUHJMJNR-UHFFFAOYSA-N -1 3 353.451 3.676 20 0 FHADHM Cc1c2c(sc1NC(=O)c1ccc(-c3nn[n-]n3)cc1C)CCCC2 ZINC000826251484 947728471 /nfs/dbraw/zinc/72/84/71/947728471.db2.gz QXIQIMZUHJMJNR-UHFFFAOYSA-N -1 3 353.451 3.676 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)N(C)[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC001573365172 947730107 /nfs/dbraw/zinc/73/01/07/947730107.db2.gz LJSRGMVHYDREOH-YBEMTRGBSA-N -1 3 365.412 3.629 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)N(C)[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC001573365172 947730115 /nfs/dbraw/zinc/73/01/15/947730115.db2.gz LJSRGMVHYDREOH-YBEMTRGBSA-N -1 3 365.412 3.629 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)N(C)c1ccc(-c2nnn[n-]2)cc1 ZINC001573366887 947751014 /nfs/dbraw/zinc/75/10/14/947751014.db2.gz UUJVEWTXPOQKGC-QXMHVHEDSA-N -1 3 353.813 3.586 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)N(C)c1ccc(-c2nn[n-]n2)cc1 ZINC001573366887 947751024 /nfs/dbraw/zinc/75/10/24/947751024.db2.gz UUJVEWTXPOQKGC-QXMHVHEDSA-N -1 3 353.813 3.586 20 0 FHADHM Cc1cc(CN[C@H](C)c2ccc(-c3cccc(-c4nn[n-]n4)c3)cc2)no1 ZINC000826267030 947771612 /nfs/dbraw/zinc/77/16/12/947771612.db2.gz MGMKUDFZHBBXHM-CQSZACIVSA-N -1 3 360.421 3.681 20 0 FHADHM COc1ccc(NC(=O)Nc2ccc(-c3cc(=O)[n-]c(C)n3)cc2)cc1F ZINC000520470143 947774032 /nfs/dbraw/zinc/77/40/32/947774032.db2.gz IOZMLMJIBGLNFY-UHFFFAOYSA-N -1 3 368.368 3.949 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)c(NCc2ccccc2OC2CCCC2)n1 ZINC000826276982 947799066 /nfs/dbraw/zinc/79/90/66/947799066.db2.gz FLENQVMWWICWHA-UHFFFAOYSA-N -1 3 350.426 3.504 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)c(NCc2ccccc2OC2CCCC2)n1 ZINC000826276982 947799072 /nfs/dbraw/zinc/79/90/72/947799072.db2.gz FLENQVMWWICWHA-UHFFFAOYSA-N -1 3 350.426 3.504 20 0 FHADHM O=C([N-]c1csnc1-c1ccccc1)c1cnn(-c2ccc(F)cc2)n1 ZINC001126237706 947815026 /nfs/dbraw/zinc/81/50/26/947815026.db2.gz ZDJIFKZCWWYRAY-UHFFFAOYSA-N -1 3 365.393 3.782 20 0 FHADHM Cc1ccc(C[C@@H](Nc2nccc(C)c2-c2nnn[n-]2)c2ccccn2)cc1 ZINC000826287391 947831832 /nfs/dbraw/zinc/83/18/32/947831832.db2.gz NGMWQUNQWSJJRU-GOSISDBHSA-N -1 3 371.448 3.669 20 0 FHADHM Cc1ccc(C[C@@H](Nc2nccc(C)c2-c2nn[n-]n2)c2ccccn2)cc1 ZINC000826287391 947831847 /nfs/dbraw/zinc/83/18/47/947831847.db2.gz NGMWQUNQWSJJRU-GOSISDBHSA-N -1 3 371.448 3.669 20 0 FHADHM Cc1sc(NC(=O)[C@@H](C)Cc2ccc(C)cc2)c(-c2nnn[n-]2)c1C ZINC000826286940 947832218 /nfs/dbraw/zinc/83/22/18/947832218.db2.gz WJNKDTLOIJBMQL-NSHDSACASA-N -1 3 355.467 3.671 20 0 FHADHM Cc1sc(NC(=O)[C@@H](C)Cc2ccc(C)cc2)c(-c2nn[n-]n2)c1C ZINC000826286940 947832226 /nfs/dbraw/zinc/83/22/26/947832226.db2.gz WJNKDTLOIJBMQL-NSHDSACASA-N -1 3 355.467 3.671 20 0 FHADHM Cc1cc(S(=O)(=O)[N-]CCC2CC(OC(C)(C)C)C2)c(F)cc1F ZINC000432311456 947871318 /nfs/dbraw/zinc/87/13/18/947871318.db2.gz LKMNHCJORBKZPS-UHFFFAOYSA-N -1 3 361.454 3.535 20 0 FHADHM CC(C)(C)CC(=O)N1CCC[C@H]1C(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000129979257 947895903 /nfs/dbraw/zinc/89/59/03/947895903.db2.gz PWLUDFXAGGHMTR-ZDUSSCGKSA-N -1 3 372.387 3.777 20 0 FHADHM C[C@@H](C(=O)N1Cc2cccc(-c3nnn[n-]3)c2C1)c1ccc2ccccc2c1 ZINC001573651241 947919587 /nfs/dbraw/zinc/91/95/87/947919587.db2.gz KJMFKKCKJYTJAV-CQSZACIVSA-N -1 3 369.428 3.666 20 0 FHADHM C[C@@H](C(=O)N1Cc2cccc(-c3nn[n-]n3)c2C1)c1ccc2ccccc2c1 ZINC001573651241 947919591 /nfs/dbraw/zinc/91/95/91/947919591.db2.gz KJMFKKCKJYTJAV-CQSZACIVSA-N -1 3 369.428 3.666 20 0 FHADHM Cc1nc(CN[C@H](C)c2ccc(-c3cccc(-c4nnn[n-]4)c3)cc2)oc1C ZINC000826326460 947952684 /nfs/dbraw/zinc/95/26/84/947952684.db2.gz QCNDCGOEEANQRB-CQSZACIVSA-N -1 3 374.448 3.989 20 0 FHADHM Cc1nc(CN[C@H](C)c2ccc(-c3cccc(-c4nn[n-]n4)c3)cc2)oc1C ZINC000826326460 947952693 /nfs/dbraw/zinc/95/26/93/947952693.db2.gz QCNDCGOEEANQRB-CQSZACIVSA-N -1 3 374.448 3.989 20 0 FHADHM O=C(NC1CCCCC1)NC1CCN(Cc2cccc([O-])c2Cl)CC1 ZINC000507769220 948133239 /nfs/dbraw/zinc/13/32/39/948133239.db2.gz JAHMDDHQLWNPIH-UHFFFAOYSA-N -1 3 365.905 3.642 20 0 FHADHM FC(F)(F)[C@@H](NCc1cccc(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000826367190 948146332 /nfs/dbraw/zinc/14/63/32/948146332.db2.gz OXOTXEWZUKYYSE-AWEZNQCLSA-N -1 3 367.762 3.913 20 0 FHADHM FC(F)(F)[C@@H](NCc1cccc(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000826367190 948146338 /nfs/dbraw/zinc/14/63/38/948146338.db2.gz OXOTXEWZUKYYSE-AWEZNQCLSA-N -1 3 367.762 3.913 20 0 FHADHM FC(F)[C@H](CCc1ccccc1)NC1(c2cccc(-c3nnn[n-]3)c2)CC1 ZINC000826369279 948152857 /nfs/dbraw/zinc/15/28/57/948152857.db2.gz VPENXIIYOXRGQU-KRWDZBQOSA-N -1 3 369.419 3.712 20 0 FHADHM FC(F)[C@H](CCc1ccccc1)NC1(c2cccc(-c3nn[n-]n3)c2)CC1 ZINC000826369279 948152864 /nfs/dbraw/zinc/15/28/64/948152864.db2.gz VPENXIIYOXRGQU-KRWDZBQOSA-N -1 3 369.419 3.712 20 0 FHADHM CC(C)[C@H](Sc1ccccc1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000520506995 948203910 /nfs/dbraw/zinc/20/39/10/948203910.db2.gz SOUYXFQLULUNKK-INIZCTEOSA-N -1 3 353.451 3.622 20 0 FHADHM CC(C)[C@H](Sc1ccccc1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000520506995 948203914 /nfs/dbraw/zinc/20/39/14/948203914.db2.gz SOUYXFQLULUNKK-INIZCTEOSA-N -1 3 353.451 3.622 20 0 FHADHM O=C(CC1CCC(C(F)(F)F)CC1)Nc1ccccc1-c1nnn[n-]1 ZINC000826404152 948230038 /nfs/dbraw/zinc/23/00/38/948230038.db2.gz PSLRCYKOACXBCB-UHFFFAOYSA-N -1 3 353.348 3.564 20 0 FHADHM O=C(CC1CCC(C(F)(F)F)CC1)Nc1ccccc1-c1nn[n-]n1 ZINC000826404152 948230045 /nfs/dbraw/zinc/23/00/45/948230045.db2.gz PSLRCYKOACXBCB-UHFFFAOYSA-N -1 3 353.348 3.564 20 0 FHADHM CC(=O)N1CCc2cc([N-]S(=O)(=O)c3ccc(C(C)(C)C)cc3)ccc21 ZINC000001501528 948231165 /nfs/dbraw/zinc/23/11/65/948231165.db2.gz UKLOBIBHMZBJAO-UHFFFAOYSA-N -1 3 372.490 3.694 20 0 FHADHM COc1cccc(C(=O)Nc2ccc(Oc3nccc(C)n3)cc2)c1[O-] ZINC000441541945 948237767 /nfs/dbraw/zinc/23/77/67/948237767.db2.gz OHNBHOQUIWHOIW-UHFFFAOYSA-N -1 3 351.362 3.544 20 0 FHADHM O=C(CCc1ccc2[nH]ccc2c1)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000826409014 948242783 /nfs/dbraw/zinc/24/27/83/948242783.db2.gz FFCBZVPORWWODO-UHFFFAOYSA-N -1 3 366.812 3.573 20 0 FHADHM O=C(CCc1ccc2[nH]ccc2c1)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000826409014 948242794 /nfs/dbraw/zinc/24/27/94/948242794.db2.gz FFCBZVPORWWODO-UHFFFAOYSA-N -1 3 366.812 3.573 20 0 FHADHM O=C(Nc1cccc2ccc(O)cc21)c1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000826457210 948332354 /nfs/dbraw/zinc/33/23/54/948332354.db2.gz RFGHBLCYWVUDAE-UHFFFAOYSA-N -1 3 365.780 3.631 20 0 FHADHM O=C(Nc1cccc2ccc(O)cc21)c1ccc(Cl)c(-c2nn[n-]n2)c1 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373.210 3.501 20 0 FHADHM CC(C)Cc1n[n-]c(=NC(=O)NC[C@@H]2CCCN2Cc2ccccc2)s1 ZINC000604092499 520448761 /nfs/dbraw/zinc/44/87/61/520448761.db2.gz KFNYUKQSSVCNBE-INIZCTEOSA-N -1 3 373.526 3.523 20 0 FHADHM Cc1cc(C(=O)N=c2cc(-c3cccs3)o[n-]2)nn1C1CCOCC1 ZINC000630008518 522580309 /nfs/dbraw/zinc/58/03/09/522580309.db2.gz BPIDMPKCJMMXDC-UHFFFAOYSA-N -1 3 358.423 3.512 20 0 FHADHM Cc1[n-][nH]c(=NC(=O)[C@@H](C)N(C)CC(F)(F)F)c1-c1ccc(C)cc1 ZINC000630021433 522587076 /nfs/dbraw/zinc/58/70/76/522587076.db2.gz RBXXHRVRSZUFGC-GFCCVEGCSA-N -1 3 354.376 3.515 20 0 FHADHM O=C(N=c1cc([C@@H]2CCCO2)[n-][nH]1)c1cccc(NCc2ccccn2)c1 ZINC000636143922 522767247 /nfs/dbraw/zinc/76/72/47/522767247.db2.gz NMJAYEWTPAWNBU-SFHVURJKSA-N -1 3 363.421 3.521 20 0 FHADHM CN(C)[C@H](CNc1ncc(C(=O)[O-])s1)c1cccc(C(F)(F)F)c1 ZINC000630458943 522861421 /nfs/dbraw/zinc/86/14/21/522861421.db2.gz IGKFDQDYKAGTOI-LLVKDONJSA-N -1 3 359.373 3.575 20 0 FHADHM CC(C)(C)OCc1cc(C(=O)Nc2cc(Br)ccc2[O-])no1 ZINC000186260404 567895320 /nfs/dbraw/zinc/89/53/20/567895320.db2.gz PAETZSKIJMDDSA-UHFFFAOYSA-N -1 3 369.215 3.710 20 0 FHADHM Cc1csc([C@@H](C)NC(=O)c2ccc(C(=O)c3cccc([O-])c3)cc2)n1 ZINC000186511390 567929189 /nfs/dbraw/zinc/92/91/89/567929189.db2.gz OKNZMBJOMXZGIR-CYBMUJFWSA-N -1 3 366.442 3.879 20 0 FHADHM COC(=O)c1cccc([N-]C(=O)c2coc(C(F)(F)F)n2)c1OC(C)C ZINC000602153269 567943584 /nfs/dbraw/zinc/94/35/84/567943584.db2.gz UQONKDKSNUIQNL-UHFFFAOYSA-N -1 3 372.299 3.520 20 0 FHADHM CCC[C@H]([N-]S(=O)(=O)c1cc(OC)ccc1Cl)c1ccccn1 ZINC000602255465 567960256 /nfs/dbraw/zinc/96/02/56/567960256.db2.gz NFIYLFHSMIADJV-HNNXBMFYSA-N -1 3 354.859 3.563 20 0 FHADHM Cc1ccsc1[C@H]1C[C@H]1C(=O)Nc1cccc(-c2nc(C)cc(=O)[n-]2)c1 ZINC000161790855 567964900 /nfs/dbraw/zinc/96/49/00/567964900.db2.gz AMGAEMQNFPQEJB-JKSUJKDBSA-N -1 3 365.458 3.857 20 0 FHADHM COC(=O)c1cc(Cl)c(Cl)c([N-]C(=O)c2cc(C3CC3)no2)c1 ZINC000602419390 567978466 /nfs/dbraw/zinc/97/84/66/567978466.db2.gz ANNBVQRTKPPCCY-UHFFFAOYSA-N -1 3 355.177 3.898 20 0 FHADHM COc1ccc(C(=O)N(C)C[C@@H]2CCCO[C@H]2c2ccccc2)c([O-])c1 ZINC000051468119 567979553 /nfs/dbraw/zinc/97/95/53/567979553.db2.gz BGPIVMIDEDQYRH-JXFKEZNVSA-N -1 3 355.434 3.641 20 0 FHADHM O=C(NC[C@H](c1ccccc1)C(F)(F)F)c1c[n-]c2ccccc2c1=O ZINC000188641074 568032395 /nfs/dbraw/zinc/03/23/95/568032395.db2.gz VAOAIRRPBSVKRX-OAHLLOKOSA-N -1 3 360.335 3.604 20 0 FHADHM CSC[C@@H](C)C(=O)N=c1[nH][n-]c(C)c1-c1ccc(Br)cc1 ZINC000603202591 568073145 /nfs/dbraw/zinc/07/31/45/568073145.db2.gz LGDBVARURZPXBQ-SECBINFHSA-N -1 3 368.300 3.507 20 0 FHADHM O=S(=O)([N-]C[C@@H]1OCCc2ccccc21)c1c(Cl)cccc1Cl ZINC000603506950 568109878 /nfs/dbraw/zinc/10/98/78/568109878.db2.gz ZHFBWHRNBOMIDK-HNNXBMFYSA-N -1 3 372.273 3.586 20 0 FHADHM O=S(=O)(Cc1c(Cl)cccc1Cl)[N-]Cc1ccc(Cl)o1 ZINC000603499936 568112670 /nfs/dbraw/zinc/11/26/70/568112670.db2.gz GIOLSGBLXJETTF-UHFFFAOYSA-N -1 3 354.642 3.859 20 0 FHADHM O=C(NCc1cc2c([nH]c1=O)CCC2)c1cc(Cc2ccccc2)ccc1[O-] ZINC000603550152 568118267 /nfs/dbraw/zinc/11/82/67/568118267.db2.gz OAIPQSMXLPYAAC-UHFFFAOYSA-N -1 3 374.440 3.502 20 0 FHADHM CC[C@H]([N-]S(=O)(=O)c1ccsc1C(=O)OC)c1cccc(Cl)c1 ZINC000603640187 568129304 /nfs/dbraw/zinc/12/93/04/568129304.db2.gz FKUYSQFABZRAGI-LBPRGKRZSA-N -1 3 373.883 3.618 20 0 FHADHM Cc1cccc([O-])c1C(=O)N1C[C@@H](O)C[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000626261593 568141130 /nfs/dbraw/zinc/14/11/30/568141130.db2.gz BPXRQMXGTWUQQC-LSDHHAIUSA-N -1 3 365.351 3.668 20 0 FHADHM CCN(Cc1nc(=O)c2c(-c3ccccc3)csc2[n-]1)C[C@H]1CCOC1 ZINC000604052220 568206535 /nfs/dbraw/zinc/20/65/35/568206535.db2.gz HNDASPNXXWBTBI-CQSZACIVSA-N -1 3 369.490 3.922 20 0 FHADHM C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2C(=O)c2cc([O-])ccc2C(F)(F)F)C1 ZINC000408262293 568225015 /nfs/dbraw/zinc/22/50/15/568225015.db2.gz WJNBBELLXJVFJH-HWHUXHBOSA-N -1 3 371.399 3.813 20 0 FHADHM CC(C)(C)c1cc(CS(=O)(=O)[N-]c2ccc(Br)cc2)no1 ZINC000430982813 568238648 /nfs/dbraw/zinc/23/86/48/568238648.db2.gz VVRLHNQQWDOYFS-UHFFFAOYSA-N -1 3 373.272 3.677 20 0 FHADHM CC(C)(C)[C@H](CC1CCCCC1)NC(=O)CNC(=O)c1ccc([O-])cc1 ZINC000604606212 568325549 /nfs/dbraw/zinc/32/55/49/568325549.db2.gz HHBFPJYDAQKLEF-SFHVURJKSA-N -1 3 360.498 3.623 20 0 FHADHM Cc1c(Cl)cc(F)c([N-]C(=O)c2cncc(N3CCCC3)n2)c1F ZINC000637056711 568332250 /nfs/dbraw/zinc/33/22/50/568332250.db2.gz JWCGWPQQYQAIIN-UHFFFAOYSA-N -1 3 352.772 3.569 20 0 FHADHM Cc1nc(C)c(CC(=O)Nc2ccc(OC3CCCCC3)cc2)c(=O)[n-]1 ZINC000604747599 568356515 /nfs/dbraw/zinc/35/65/15/568356515.db2.gz DNTGZZDPMRHIES-UHFFFAOYSA-N -1 3 355.438 3.692 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2cccc(-c3csc(C)n3)c2)cc1 ZINC000005089953 568378203 /nfs/dbraw/zinc/37/82/03/568378203.db2.gz QQALXAJAPRFPIY-UHFFFAOYSA-N -1 3 360.460 3.928 20 0 FHADHM Cc1nn(C(C)(C)C)c(C)c1C(=O)N=c1cc(-c2cc(C)cc(C)c2)[n-][nH]1 ZINC000604901494 568384781 /nfs/dbraw/zinc/38/47/81/568384781.db2.gz QCGVCBKYIKXGKR-UHFFFAOYSA-N -1 3 365.481 3.936 20 0 FHADHM Cc1cc(Cl)cc(NC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)c1[O-] ZINC000604901598 568384820 /nfs/dbraw/zinc/38/48/20/568384820.db2.gz JRLIYCIVTHANLF-OAHLLOKOSA-N -1 3 359.857 3.600 20 0 FHADHM O=C(N[C@H](c1ccccc1)c1ccc2c(c1)CCCO2)c1csc(=O)[n-]1 ZINC000365299848 568450104 /nfs/dbraw/zinc/45/01/04/568450104.db2.gz QNVNEHDTRHSNLO-GOSISDBHSA-N -1 3 366.442 3.693 20 0 FHADHM CCOc1ccc(S(=O)(=O)[N-]c2ccc(-c3cncnc3)cc2)cc1C ZINC000605118893 568573635 /nfs/dbraw/zinc/57/36/35/568573635.db2.gz MUGZOKPIVBKBIS-UHFFFAOYSA-N -1 3 369.446 3.652 20 0 FHADHM Cc1ccc([N-]S(C)(=O)=O)c(NC(=O)[C@H]2CC[C@H](C3CCC3)CC2)c1 ZINC000669205483 568660820 /nfs/dbraw/zinc/66/08/20/568660820.db2.gz ZRHAFOYIFVWBKZ-WKILWMFISA-N -1 3 364.511 3.912 20 0 FHADHM Cc1nnc(-c2cccc(-c3nnn[n-]3)c2)n1Cc1ccc(C(C)(C)C)cc1 ZINC000737524620 598826836 /nfs/dbraw/zinc/82/68/36/598826836.db2.gz OPLOPDCDUOJFEV-UHFFFAOYSA-N -1 3 373.464 3.779 20 0 FHADHM Cc1nnc(-c2cccc(-c3nn[n-]n3)c2)n1Cc1ccc(C(C)(C)C)cc1 ZINC000737524620 598826838 /nfs/dbraw/zinc/82/68/38/598826838.db2.gz OPLOPDCDUOJFEV-UHFFFAOYSA-N -1 3 373.464 3.779 20 0 FHADHM Cc1cccc([C@H](C)C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)c1 ZINC000737386217 598831877 /nfs/dbraw/zinc/83/18/77/598831877.db2.gz XGBNUVJQEYXUDP-INIZCTEOSA-N -1 3 363.465 3.716 20 0 FHADHM Cc1cccc([C@H](C)C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)c1 ZINC000737386217 598831878 /nfs/dbraw/zinc/83/18/78/598831878.db2.gz XGBNUVJQEYXUDP-INIZCTEOSA-N -1 3 363.465 3.716 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)Nc1ccc(C(C)C)cc1 ZINC000737063144 598851423 /nfs/dbraw/zinc/85/14/23/598851423.db2.gz NZZJBFSGNZTQCI-UHFFFAOYSA-N -1 3 352.398 3.643 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)Nc1ccc(C(C)C)cc1 ZINC000737063144 598851424 /nfs/dbraw/zinc/85/14/24/598851424.db2.gz NZZJBFSGNZTQCI-UHFFFAOYSA-N -1 3 352.398 3.643 20 0 FHADHM Cc1nnc(NCC2(c3cccs3)CCCCC2)c(-c2nnn[n-]2)c1C ZINC000737520375 598855142 /nfs/dbraw/zinc/85/51/42/598855142.db2.gz JOBIKUOLZKKUDV-UHFFFAOYSA-N -1 3 369.498 3.649 20 0 FHADHM Cc1nnc(NCC2(c3cccs3)CCCCC2)c(-c2nn[n-]n2)c1C ZINC000737520375 598855144 /nfs/dbraw/zinc/85/51/44/598855144.db2.gz JOBIKUOLZKKUDV-UHFFFAOYSA-N -1 3 369.498 3.649 20 0 FHADHM Fc1ccc(NCc2ccc(-c3nnn[n-]3)cc2)c(OCC(F)(F)F)c1 ZINC000737656097 598871927 /nfs/dbraw/zinc/87/19/27/598871927.db2.gz IFAKFTCUSTUXMJ-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM Fc1ccc(NCc2ccc(-c3nn[n-]n3)cc2)c(OCC(F)(F)F)c1 ZINC000737656097 598871928 /nfs/dbraw/zinc/87/19/28/598871928.db2.gz IFAKFTCUSTUXMJ-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)NCCCC(C)(C)C ZINC000735831020 598889538 /nfs/dbraw/zinc/88/95/38/598889538.db2.gz MBNJNXQLFCIBHA-UHFFFAOYSA-N -1 3 372.517 3.861 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)NCCCC(C)(C)C ZINC000735831020 598889540 /nfs/dbraw/zinc/88/95/40/598889540.db2.gz MBNJNXQLFCIBHA-UHFFFAOYSA-N -1 3 372.517 3.861 20 0 FHADHM Clc1ccc(Nc2ccc(N3CCCCC3)nc2)c(-c2nnn[n-]2)c1 ZINC000737576157 598891507 /nfs/dbraw/zinc/89/15/07/598891507.db2.gz WOTQXZORKNMELP-UHFFFAOYSA-N -1 3 355.833 3.649 20 0 FHADHM Clc1ccc(Nc2ccc(N3CCCCC3)nc2)c(-c2nn[n-]n2)c1 ZINC000737576157 598891509 /nfs/dbraw/zinc/89/15/09/598891509.db2.gz WOTQXZORKNMELP-UHFFFAOYSA-N -1 3 355.833 3.649 20 0 FHADHM O=C(CCc1ccc(-c2nnn[n-]2)cc1)OCc1ccc2ccccc2c1 ZINC000737853565 598896930 /nfs/dbraw/zinc/89/69/30/598896930.db2.gz NBDMNKXWBYCTMW-UHFFFAOYSA-N -1 3 358.401 3.696 20 0 FHADHM O=C(CCc1ccc(-c2nn[n-]n2)cc1)OCc1ccc2ccccc2c1 ZINC000737853565 598896932 /nfs/dbraw/zinc/89/69/32/598896932.db2.gz NBDMNKXWBYCTMW-UHFFFAOYSA-N -1 3 358.401 3.696 20 0 FHADHM Cc1nc(CSc2nc(-c3ccccc3)ccc2-c2nnn[n-]2)cs1 ZINC000737476309 598902040 /nfs/dbraw/zinc/90/20/40/598902040.db2.gz AZRWYTJJDYXYMX-UHFFFAOYSA-N -1 3 366.475 3.986 20 0 FHADHM Cc1nc(CSc2nc(-c3ccccc3)ccc2-c2nn[n-]n2)cs1 ZINC000737476309 598902042 /nfs/dbraw/zinc/90/20/42/598902042.db2.gz AZRWYTJJDYXYMX-UHFFFAOYSA-N -1 3 366.475 3.986 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@H](C)CC1CCCC1 ZINC000736480005 598903485 /nfs/dbraw/zinc/90/34/85/598903485.db2.gz PEOMEXRDFQSYDU-OAHLLOKOSA-N -1 3 355.486 3.822 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@H](C)CC1CCCC1 ZINC000736480005 598903486 /nfs/dbraw/zinc/90/34/86/598903486.db2.gz PEOMEXRDFQSYDU-OAHLLOKOSA-N -1 3 355.486 3.822 20 0 FHADHM CCN(C(=O)[C@@H](C)CC1CCCC1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736502897 598903722 /nfs/dbraw/zinc/90/37/22/598903722.db2.gz QLKGLUZKXYOZAY-LSDHHAIUSA-N -1 3 355.486 3.993 20 0 FHADHM CCN(C(=O)[C@@H](C)CC1CCCC1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736502897 598903723 /nfs/dbraw/zinc/90/37/23/598903723.db2.gz QLKGLUZKXYOZAY-LSDHHAIUSA-N -1 3 355.486 3.993 20 0 FHADHM C[C@H]1CCCCCN1C(=O)c1ccccc1-c1ccccc1-c1nnn[n-]1 ZINC000736265432 598907595 /nfs/dbraw/zinc/90/75/95/598907595.db2.gz AOIFFNXHLRVTFR-HNNXBMFYSA-N -1 3 361.449 3.938 20 0 FHADHM C[C@H]1CCCCCN1C(=O)c1ccccc1-c1ccccc1-c1nn[n-]n1 ZINC000736265432 598907596 /nfs/dbraw/zinc/90/75/96/598907596.db2.gz AOIFFNXHLRVTFR-HNNXBMFYSA-N -1 3 361.449 3.938 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@@H]2C(=O)Nc2sccc2-c2nnn[n-]2)cc1 ZINC000735922035 598911037 /nfs/dbraw/zinc/91/10/37/598911037.db2.gz AHMULZLEZMHDFL-CABCVRRESA-N -1 3 353.451 3.794 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@@H]2C(=O)Nc2sccc2-c2nn[n-]n2)cc1 ZINC000735922035 598911040 /nfs/dbraw/zinc/91/10/40/598911040.db2.gz AHMULZLEZMHDFL-CABCVRRESA-N -1 3 353.451 3.794 20 0 FHADHM CC(C)N(C)c1ccc(Nc2ncc(-c3nnn[n-]3)cc2Cl)cc1F ZINC000735859284 598940771 /nfs/dbraw/zinc/94/07/71/598940771.db2.gz QRUULYRHPWHGKA-UHFFFAOYSA-N -1 3 361.812 3.642 20 0 FHADHM CC(C)N(C)c1ccc(Nc2ncc(-c3nn[n-]n3)cc2Cl)cc1F ZINC000735859284 598940773 /nfs/dbraw/zinc/94/07/73/598940773.db2.gz QRUULYRHPWHGKA-UHFFFAOYSA-N -1 3 361.812 3.642 20 0 FHADHM C[C@H]1C[C@H](C)N(C(=O)c2cccc(Oc3ccc(-c4nnn[n-]4)cc3)c2)C1 ZINC000736228593 598951499 /nfs/dbraw/zinc/95/14/99/598951499.db2.gz OITBXSIGUYELLH-KBPBESRZSA-N -1 3 363.421 3.530 20 0 FHADHM C[C@H]1C[C@H](C)N(C(=O)c2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)C1 ZINC000736228593 598951500 /nfs/dbraw/zinc/95/15/00/598951500.db2.gz OITBXSIGUYELLH-KBPBESRZSA-N -1 3 363.421 3.530 20 0 FHADHM Fc1cccc(Cl)c1[C@@H]1C[C@H]1Nc1nc2c(cc1-c1nnn[n-]1)CCC2 ZINC000737659383 598972118 /nfs/dbraw/zinc/97/21/18/598972118.db2.gz CPVXMBOCNFIQMU-MEBBXXQBSA-N -1 3 370.819 3.511 20 0 FHADHM Fc1cccc(Cl)c1[C@@H]1C[C@H]1Nc1nc2c(cc1-c1nn[n-]n1)CCC2 ZINC000737659383 598972120 /nfs/dbraw/zinc/97/21/20/598972120.db2.gz CPVXMBOCNFIQMU-MEBBXXQBSA-N -1 3 370.819 3.511 20 0 FHADHM CC[C@@H](Nc1ncc(-c2nnn[n-]2)cc1Cl)c1cc(F)ccc1F ZINC000736370426 598975175 /nfs/dbraw/zinc/97/51/75/598975175.db2.gz RITMUZDUQDTYKF-CYBMUJFWSA-N -1 3 350.760 3.757 20 0 FHADHM CC[C@@H](Nc1ncc(-c2nn[n-]n2)cc1Cl)c1cc(F)ccc1F ZINC000736370426 598975176 /nfs/dbraw/zinc/97/51/76/598975176.db2.gz RITMUZDUQDTYKF-CYBMUJFWSA-N -1 3 350.760 3.757 20 0 FHADHM C[C@H](CNC(=O)c1ccccc1-c1ccccc1-c1nnn[n-]1)C(C)(C)C ZINC000736025753 599007018 /nfs/dbraw/zinc/00/70/18/599007018.db2.gz JLNQDJGLQIGWTP-CQSZACIVSA-N -1 3 363.465 3.946 20 0 FHADHM C[C@H](CNC(=O)c1ccccc1-c1ccccc1-c1nn[n-]n1)C(C)(C)C ZINC000736025753 599007021 /nfs/dbraw/zinc/00/70/21/599007021.db2.gz JLNQDJGLQIGWTP-CQSZACIVSA-N -1 3 363.465 3.946 20 0 FHADHM COC(=O)C[C@H](C)SCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000736910477 599014324 /nfs/dbraw/zinc/01/43/24/599014324.db2.gz FDAXETAJOTVZJM-ZDUSSCGKSA-N -1 3 368.462 3.719 20 0 FHADHM COC(=O)C[C@H](C)SCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000736910477 599014326 /nfs/dbraw/zinc/01/43/26/599014326.db2.gz FDAXETAJOTVZJM-ZDUSSCGKSA-N -1 3 368.462 3.719 20 0 FHADHM CC(C)C[C@H](C(=O)OCc1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000735756458 599019131 /nfs/dbraw/zinc/01/91/31/599019131.db2.gz ONQXUUCNPKOYOM-SFHVURJKSA-N -1 3 350.422 3.740 20 0 FHADHM CC(C)C[C@H](C(=O)OCc1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000735756458 599019133 /nfs/dbraw/zinc/01/91/33/599019133.db2.gz ONQXUUCNPKOYOM-SFHVURJKSA-N -1 3 350.422 3.740 20 0 FHADHM Cc1c(NCC(=O)Nc2ccccc2C(C)(C)C)cccc1-c1nnn[n-]1 ZINC000822123231 607257106 /nfs/dbraw/zinc/25/71/06/607257106.db2.gz WTHKITWRVSAVLV-UHFFFAOYSA-N -1 3 364.453 3.523 20 0 FHADHM Cc1c(NCC(=O)Nc2ccccc2C(C)(C)C)cccc1-c1nn[n-]n1 ZINC000822123231 607257107 /nfs/dbraw/zinc/25/71/07/607257107.db2.gz WTHKITWRVSAVLV-UHFFFAOYSA-N -1 3 364.453 3.523 20 0 FHADHM Fc1ccc2c(c1)CC[C@H]2Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000737669029 599050418 /nfs/dbraw/zinc/05/04/18/599050418.db2.gz YITXLTBSNUWSBS-GFCCVEGCSA-N -1 3 364.306 3.519 20 0 FHADHM Fc1ccc2c(c1)CC[C@H]2Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000737669029 599050421 /nfs/dbraw/zinc/05/04/21/599050421.db2.gz YITXLTBSNUWSBS-GFCCVEGCSA-N -1 3 364.306 3.519 20 0 FHADHM C[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2Cl)CC[C@@H]1c1ccccc1 ZINC000820774321 599050743 /nfs/dbraw/zinc/05/07/43/599050743.db2.gz ANWQOIZOAUOMRG-DOMZBBRYSA-N -1 3 354.845 3.545 20 0 FHADHM C[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2Cl)CC[C@@H]1c1ccccc1 ZINC000820774321 599050745 /nfs/dbraw/zinc/05/07/45/599050745.db2.gz ANWQOIZOAUOMRG-DOMZBBRYSA-N -1 3 354.845 3.545 20 0 FHADHM FC(F)(F)c1cccc(C2(CNc3ncccc3-c3nnn[n-]3)CCC2)c1 ZINC000822729260 599051146 /nfs/dbraw/zinc/05/11/46/599051146.db2.gz YQUNPHNRTLMUFP-UHFFFAOYSA-N -1 3 374.370 3.814 20 0 FHADHM FC(F)(F)c1cccc(C2(CNc3ncccc3-c3nn[n-]n3)CCC2)c1 ZINC000822729260 599051149 /nfs/dbraw/zinc/05/11/49/599051149.db2.gz YQUNPHNRTLMUFP-UHFFFAOYSA-N -1 3 374.370 3.814 20 0 FHADHM Cc1ccccc1[C@H]1CCN(c2nc(C(F)(F)F)ccc2-c2nnn[n-]2)C1 ZINC000737422658 599051351 /nfs/dbraw/zinc/05/13/51/599051351.db2.gz NGQJMKZMONCLNX-LBPRGKRZSA-N -1 3 374.370 3.583 20 0 FHADHM Cc1ccccc1[C@H]1CCN(c2nc(C(F)(F)F)ccc2-c2nn[n-]n2)C1 ZINC000737422658 599051355 /nfs/dbraw/zinc/05/13/55/599051355.db2.gz NGQJMKZMONCLNX-LBPRGKRZSA-N -1 3 374.370 3.583 20 0 FHADHM Cc1ccc(-c2noc(CSc3ccc(-c4nnn[n-]4)cc3F)n2)cc1 ZINC000737302597 599064643 /nfs/dbraw/zinc/06/46/43/599064643.db2.gz AWNATHUTJMOBNK-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM Cc1ccc(-c2noc(CSc3ccc(-c4nn[n-]n4)cc3F)n2)cc1 ZINC000737302597 599064647 /nfs/dbraw/zinc/06/46/47/599064647.db2.gz AWNATHUTJMOBNK-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM COc1ccc(OCCCSc2ccc(-c3nnn[n-]3)cc2F)cc1 ZINC000737109257 599066412 /nfs/dbraw/zinc/06/64/12/599066412.db2.gz HVUXYSVKUNKEDB-UHFFFAOYSA-N -1 3 360.414 3.576 20 0 FHADHM COc1ccc(OCCCSc2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000737109257 599066415 /nfs/dbraw/zinc/06/64/15/599066415.db2.gz HVUXYSVKUNKEDB-UHFFFAOYSA-N -1 3 360.414 3.576 20 0 FHADHM O=C(C1CCCCCCC1)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000737791539 599068938 /nfs/dbraw/zinc/06/89/38/599068938.db2.gz LJGNBEJTNXECAC-UHFFFAOYSA-N -1 3 353.470 3.718 20 0 FHADHM O=C(C1CCCCCCC1)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000737791539 599068939 /nfs/dbraw/zinc/06/89/39/599068939.db2.gz LJGNBEJTNXECAC-UHFFFAOYSA-N -1 3 353.470 3.718 20 0 FHADHM C[C@@H](C(=O)Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1)c1ccco1 ZINC000735571594 599070267 /nfs/dbraw/zinc/07/02/67/599070267.db2.gz ZJNRHBXKYHXZMA-LLVKDONJSA-N -1 3 365.418 3.930 20 0 FHADHM C[C@@H](C(=O)Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1)c1ccco1 ZINC000735571594 599070271 /nfs/dbraw/zinc/07/02/71/599070271.db2.gz ZJNRHBXKYHXZMA-LLVKDONJSA-N -1 3 365.418 3.930 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)C1CCCCCCC1 ZINC000736479906 599070974 /nfs/dbraw/zinc/07/09/74/599070974.db2.gz LSZDIMHCYAHPLU-UHFFFAOYSA-N -1 3 355.486 3.966 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)C1CCCCCCC1 ZINC000736479906 599070978 /nfs/dbraw/zinc/07/09/78/599070978.db2.gz LSZDIMHCYAHPLU-UHFFFAOYSA-N -1 3 355.486 3.966 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1CSC[C@@H]1OCCc2ccccc21 ZINC000737639491 599102305 /nfs/dbraw/zinc/10/23/05/599102305.db2.gz DGFQMERBZPXRHK-KRWDZBQOSA-N -1 3 356.426 3.553 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CSC[C@@H]1OCCc2ccccc21 ZINC000737639491 599102307 /nfs/dbraw/zinc/10/23/07/599102307.db2.gz DGFQMERBZPXRHK-KRWDZBQOSA-N -1 3 356.426 3.553 20 0 FHADHM CCCCC[C@@H](NC(=O)NCc1ccc(-c2nnn[n-]2)cc1)C(C)(C)C ZINC000736441602 599104307 /nfs/dbraw/zinc/10/43/07/599104307.db2.gz SSGGLFZWVUKKHM-MRXNPFEDSA-N -1 3 358.490 3.661 20 0 FHADHM CCCCC[C@@H](NC(=O)NCc1ccc(-c2nn[n-]n2)cc1)C(C)(C)C ZINC000736441602 599104310 /nfs/dbraw/zinc/10/43/10/599104310.db2.gz SSGGLFZWVUKKHM-MRXNPFEDSA-N -1 3 358.490 3.661 20 0 FHADHM C[C@H](CCC1CCCCC1)NC(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1 ZINC000735984999 599105833 /nfs/dbraw/zinc/10/58/33/599105833.db2.gz IBFOOHQEOGENGS-OAHLLOKOSA-N -1 3 370.501 3.757 20 0 FHADHM C[C@H](CCC1CCCCC1)NC(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1 ZINC000735984999 599105835 /nfs/dbraw/zinc/10/58/35/599105835.db2.gz IBFOOHQEOGENGS-OAHLLOKOSA-N -1 3 370.501 3.757 20 0 FHADHM CC(C)[C@H](C)S[C@@H](C)C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2 ZINC000820549096 599130878 /nfs/dbraw/zinc/13/08/78/599130878.db2.gz KDLZCSFWTVVWBR-UWVGGRQHSA-N -1 3 365.528 3.522 20 0 FHADHM CC(C)[C@H](C)S[C@@H](C)C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2 ZINC000820549096 599130880 /nfs/dbraw/zinc/13/08/80/599130880.db2.gz KDLZCSFWTVVWBR-UWVGGRQHSA-N -1 3 365.528 3.522 20 0 FHADHM CC[C@H]1CCC[C@H](OC(=O)CSCc2ccc(-c3nnn[n-]3)cc2)C1 ZINC000736401904 599156266 /nfs/dbraw/zinc/15/62/66/599156266.db2.gz ZXJIUKTWMWETMJ-BBRMVZONSA-N -1 3 360.483 3.612 20 0 FHADHM CC[C@H]1CCC[C@H](OC(=O)CSCc2ccc(-c3nn[n-]n3)cc2)C1 ZINC000736401904 599156270 /nfs/dbraw/zinc/15/62/70/599156270.db2.gz ZXJIUKTWMWETMJ-BBRMVZONSA-N -1 3 360.483 3.612 20 0 FHADHM C[C@@H](CC(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1)c1cccc(F)c1 ZINC000735977501 599159324 /nfs/dbraw/zinc/15/93/24/599159324.db2.gz PHUOCJXUKZGRFQ-JTQLQIEISA-N -1 3 359.792 3.792 20 0 FHADHM C[C@@H](CC(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1)c1cccc(F)c1 ZINC000735977501 599159325 /nfs/dbraw/zinc/15/93/25/599159325.db2.gz PHUOCJXUKZGRFQ-JTQLQIEISA-N -1 3 359.792 3.792 20 0 FHADHM CC(C)c1ccc(C(=O)[C@@H](C)Sc2ccc(-c3nnn[n-]3)cn2)cc1 ZINC000736189221 599163916 /nfs/dbraw/zinc/16/39/16/599163916.db2.gz BKDQDXWNKYRDFB-GFCCVEGCSA-N -1 3 353.451 3.749 20 0 FHADHM CC(C)c1ccc(C(=O)[C@@H](C)Sc2ccc(-c3nn[n-]n3)cn2)cc1 ZINC000736189221 599163919 /nfs/dbraw/zinc/16/39/19/599163919.db2.gz BKDQDXWNKYRDFB-GFCCVEGCSA-N -1 3 353.451 3.749 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1SCc1cc(-c2ccccc2)no1 ZINC000737645417 599170519 /nfs/dbraw/zinc/17/05/19/599170519.db2.gz XJDOXZCUSQSKJM-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1SCc1cc(-c2ccccc2)no1 ZINC000737645417 599170520 /nfs/dbraw/zinc/17/05/20/599170520.db2.gz XJDOXZCUSQSKJM-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM Cc1ccc([C@@H]2CSCCN2Cc2cc(-c3nn[n-]n3)ccc2F)cc1 ZINC000737333753 599176435 /nfs/dbraw/zinc/17/64/35/599176435.db2.gz VQWGERSQTPSFLC-SFHVURJKSA-N -1 3 369.469 3.604 20 0 FHADHM S=C(Nc1ccccc1-c1nnn[n-]1)N[C@H](CC1CC1)c1ccccc1 ZINC000738408106 599177269 /nfs/dbraw/zinc/17/72/69/599177269.db2.gz KNPBGZQZVLUIRT-QGZVFWFLSA-N -1 3 364.478 3.695 20 0 FHADHM S=C(Nc1ccccc1-c1nn[n-]n1)N[C@H](CC1CC1)c1ccccc1 ZINC000738408106 599177273 /nfs/dbraw/zinc/17/72/73/599177273.db2.gz KNPBGZQZVLUIRT-QGZVFWFLSA-N -1 3 364.478 3.695 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@H](C)c2cccc(Cl)c2)s1 ZINC000736678719 599184828 /nfs/dbraw/zinc/18/48/28/599184828.db2.gz GCFLBLNPJAEVKE-SECBINFHSA-N -1 3 361.858 3.886 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@H](C)c2cccc(Cl)c2)s1 ZINC000736678719 599184830 /nfs/dbraw/zinc/18/48/30/599184830.db2.gz GCFLBLNPJAEVKE-SECBINFHSA-N -1 3 361.858 3.886 20 0 FHADHM CC(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cc2)c(-c2nnn[n-]2)c1 ZINC000819817672 599189531 /nfs/dbraw/zinc/18/95/31/599189531.db2.gz JVGAZPITDVKNHT-UHFFFAOYSA-N -1 3 363.299 3.636 20 0 FHADHM CC(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cc2)c(-c2nn[n-]n2)c1 ZINC000819817672 599189534 /nfs/dbraw/zinc/18/95/34/599189534.db2.gz JVGAZPITDVKNHT-UHFFFAOYSA-N -1 3 363.299 3.636 20 0 FHADHM Cc1ccccc1[C@@H](C)CC(=O)OCc1cc(-c2nnn[n-]2)ccc1F ZINC000737419188 599186287 /nfs/dbraw/zinc/18/62/87/599186287.db2.gz DQCCPPHXVNLAEF-ZDUSSCGKSA-N -1 3 354.385 3.551 20 0 FHADHM Cc1ccccc1[C@@H](C)CC(=O)OCc1cc(-c2nn[n-]n2)ccc1F ZINC000737419188 599186288 /nfs/dbraw/zinc/18/62/88/599186288.db2.gz DQCCPPHXVNLAEF-ZDUSSCGKSA-N -1 3 354.385 3.551 20 0 FHADHM O=C(Nc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1)c1ccco1 ZINC000823355386 599219433 /nfs/dbraw/zinc/21/94/33/599219433.db2.gz BOTUEOIIJAWHMA-UHFFFAOYSA-N -1 3 365.324 3.643 20 0 FHADHM O=C(Nc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1)c1ccco1 ZINC000823355386 599219436 /nfs/dbraw/zinc/21/94/36/599219436.db2.gz BOTUEOIIJAWHMA-UHFFFAOYSA-N -1 3 365.324 3.643 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)Nc1ccccc1CC(F)(F)F ZINC000737804174 599227542 /nfs/dbraw/zinc/22/75/42/599227542.db2.gz ZBUSUVSMHVLWPI-MDZDMXLPSA-N -1 3 373.338 3.623 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)Nc1ccccc1CC(F)(F)F ZINC000737804174 599227544 /nfs/dbraw/zinc/22/75/44/599227544.db2.gz ZBUSUVSMHVLWPI-MDZDMXLPSA-N -1 3 373.338 3.623 20 0 FHADHM Cc1cc(C)cc(NC(=S)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000822196842 599239595 /nfs/dbraw/zinc/23/95/95/599239595.db2.gz YJHPXXFOWNGZPV-CYBMUJFWSA-N -1 3 352.467 3.531 20 0 FHADHM Cc1cc(C)cc(NC(=S)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000822196842 599239597 /nfs/dbraw/zinc/23/95/97/599239597.db2.gz YJHPXXFOWNGZPV-CYBMUJFWSA-N -1 3 352.467 3.531 20 0 FHADHM CCSc1ccc(CC(=O)O[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000825674071 607777550 /nfs/dbraw/zinc/77/75/50/607777550.db2.gz HMYDAKNGDHVDAV-ZDUSSCGKSA-N -1 3 368.462 3.826 20 0 FHADHM CCSc1ccc(CC(=O)O[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000825674071 607777551 /nfs/dbraw/zinc/77/75/51/607777551.db2.gz HMYDAKNGDHVDAV-ZDUSSCGKSA-N -1 3 368.462 3.826 20 0 FHADHM CS[C@H]1CC[C@H](n2c(C)csc2=Nc2ccccc2-c2nnn[n-]2)C1 ZINC000821951093 599235840 /nfs/dbraw/zinc/23/58/40/599235840.db2.gz UKNAQGWDEFICNA-STQMWFEESA-N -1 3 372.523 3.727 20 0 FHADHM CS[C@H]1CC[C@H](n2c(C)csc2=Nc2ccccc2-c2nn[n-]n2)C1 ZINC000821951093 599235841 /nfs/dbraw/zinc/23/58/41/599235841.db2.gz UKNAQGWDEFICNA-STQMWFEESA-N -1 3 372.523 3.727 20 0 FHADHM Cc1c(NC(=O)c2cc3cccc(Cl)c3o2)cccc1-c1nnn[n-]1 ZINC000822108399 607267371 /nfs/dbraw/zinc/26/73/71/607267371.db2.gz IUJFWMQYYYGCLI-UHFFFAOYSA-N -1 3 353.769 3.827 20 0 FHADHM Cc1c(NC(=O)c2cc3cccc(Cl)c3o2)cccc1-c1nn[n-]n1 ZINC000822108399 607267372 /nfs/dbraw/zinc/26/73/72/607267372.db2.gz IUJFWMQYYYGCLI-UHFFFAOYSA-N -1 3 353.769 3.827 20 0 FHADHM Cc1c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)cccc1-c1nnn[n-]1 ZINC000822108992 607267380 /nfs/dbraw/zinc/26/73/80/607267380.db2.gz OBSXFSFLFITCHM-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM Cc1c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)cccc1-c1nn[n-]n1 ZINC000822108992 607267381 /nfs/dbraw/zinc/26/73/81/607267381.db2.gz OBSXFSFLFITCHM-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM CC(C)(C)c1ccccc1NC(=O)NCc1cc(-c2nnn[n-]2)ccc1F ZINC000819957561 599241841 /nfs/dbraw/zinc/24/18/41/599241841.db2.gz BACGBSXSONOOBM-UHFFFAOYSA-N -1 3 368.416 3.625 20 0 FHADHM CC(C)(C)c1ccccc1NC(=O)NCc1cc(-c2nn[n-]n2)ccc1F ZINC000819957561 599241844 /nfs/dbraw/zinc/24/18/44/599241844.db2.gz BACGBSXSONOOBM-UHFFFAOYSA-N -1 3 368.416 3.625 20 0 FHADHM C[C@@H]1C[C@H](c2cccc(F)c2)N(C(=O)Nc2ccc(-c3nnn[n-]3)cc2)C1 ZINC000820668304 599242752 /nfs/dbraw/zinc/24/27/52/599242752.db2.gz RJJZDOLBVQBORO-SJKOYZFVSA-N -1 3 366.400 3.621 20 0 FHADHM C[C@@H]1C[C@H](c2cccc(F)c2)N(C(=O)Nc2ccc(-c3nn[n-]n3)cc2)C1 ZINC000820668304 599242753 /nfs/dbraw/zinc/24/27/53/599242753.db2.gz RJJZDOLBVQBORO-SJKOYZFVSA-N -1 3 366.400 3.621 20 0 FHADHM C[C@H]1C[C@H](c2cccc(F)c2)N(C(=O)Nc2cccc(-c3nnn[n-]3)c2)C1 ZINC000820668587 599247085 /nfs/dbraw/zinc/24/70/85/599247085.db2.gz VBIUGGQLZMXCDS-YVEFUNNKSA-N -1 3 366.400 3.621 20 0 FHADHM C[C@H]1C[C@H](c2cccc(F)c2)N(C(=O)Nc2cccc(-c3nn[n-]n3)c2)C1 ZINC000820668587 599247087 /nfs/dbraw/zinc/24/70/87/599247087.db2.gz VBIUGGQLZMXCDS-YVEFUNNKSA-N -1 3 366.400 3.621 20 0 FHADHM CCN(C(=O)/C=C\C1CCCCC1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736501493 599248258 /nfs/dbraw/zinc/24/82/58/599248258.db2.gz CTLRRGWJCQFJER-KQGZCTBQSA-N -1 3 353.470 3.913 20 0 FHADHM CCN(C(=O)/C=C\C1CCCCC1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736501493 599248262 /nfs/dbraw/zinc/24/82/62/599248262.db2.gz CTLRRGWJCQFJER-KQGZCTBQSA-N -1 3 353.470 3.913 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)/C=C/C1CCCCC1 ZINC000735873590 599248268 /nfs/dbraw/zinc/24/82/68/599248268.db2.gz CRECZUWMNZAHBO-JLHYYAGUSA-N -1 3 353.470 3.740 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)/C=C/C1CCCCC1 ZINC000735873590 599248270 /nfs/dbraw/zinc/24/82/70/599248270.db2.gz CRECZUWMNZAHBO-JLHYYAGUSA-N -1 3 353.470 3.740 20 0 FHADHM CCN(Cc1ccc(C)cc1)C(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000821222484 607281134 /nfs/dbraw/zinc/28/11/34/607281134.db2.gz UXZQYTTURRIPAK-UHFFFAOYSA-N -1 3 350.426 3.538 20 0 FHADHM CCN(Cc1ccc(C)cc1)C(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000821222484 607281135 /nfs/dbraw/zinc/28/11/35/607281135.db2.gz UXZQYTTURRIPAK-UHFFFAOYSA-N -1 3 350.426 3.538 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc(Cl)c(F)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820380670 599253859 /nfs/dbraw/zinc/25/38/59/599253859.db2.gz YFVOLNGYPAGPCT-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc(Cl)c(F)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820380670 599253860 /nfs/dbraw/zinc/25/38/60/599253860.db2.gz YFVOLNGYPAGPCT-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM Cc1c(NC(=O)C2(c3ccc(F)cc3)CCCC2)cccc1-c1nnn[n-]1 ZINC000822061196 607293874 /nfs/dbraw/zinc/29/38/74/607293874.db2.gz KUWMIEMRVQXTDN-UHFFFAOYSA-N -1 3 365.412 3.765 20 0 FHADHM Cc1c(NC(=O)C2(c3ccc(F)cc3)CCCC2)cccc1-c1nn[n-]n1 ZINC000822061196 607293875 /nfs/dbraw/zinc/29/38/75/607293875.db2.gz KUWMIEMRVQXTDN-UHFFFAOYSA-N -1 3 365.412 3.765 20 0 FHADHM Cc1c(NC(=O)[C@@H](Sc2ccccc2)C(C)C)cccc1-c1nnn[n-]1 ZINC000822061805 607293940 /nfs/dbraw/zinc/29/39/40/607293940.db2.gz YIUJWGXYUFOWLQ-KRWDZBQOSA-N -1 3 367.478 3.931 20 0 FHADHM Cc1c(NC(=O)[C@@H](Sc2ccccc2)C(C)C)cccc1-c1nn[n-]n1 ZINC000822061805 607293941 /nfs/dbraw/zinc/29/39/41/607293941.db2.gz YIUJWGXYUFOWLQ-KRWDZBQOSA-N -1 3 367.478 3.931 20 0 FHADHM Cc1c(NC(=O)[C@@H](C)Sc2ccc(Cl)cc2)cccc1-c1nnn[n-]1 ZINC000822060197 607295672 /nfs/dbraw/zinc/29/56/72/607295672.db2.gz GBVLFRTZOQIYEY-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM Cc1c(NC(=O)[C@@H](C)Sc2ccc(Cl)cc2)cccc1-c1nn[n-]n1 ZINC000822060197 607295673 /nfs/dbraw/zinc/29/56/73/607295673.db2.gz GBVLFRTZOQIYEY-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM C[C@@H](NC(=O)c1cccc(-c2nnn[n-]2)c1)c1cccc(Cl)c1Cl ZINC000736123149 599261441 /nfs/dbraw/zinc/26/14/41/599261441.db2.gz OFGOKJHCBALIND-SECBINFHSA-N -1 3 362.220 3.665 20 0 FHADHM C[C@@H](NC(=O)c1cccc(-c2nn[n-]n2)c1)c1cccc(Cl)c1Cl ZINC000736123149 599261442 /nfs/dbraw/zinc/26/14/42/599261442.db2.gz OFGOKJHCBALIND-SECBINFHSA-N -1 3 362.220 3.665 20 0 FHADHM O[C@@H]1CCCC[C@H]1CCCNc1ccc(-c2nn[n-]n2)cc1C(F)(F)F ZINC000823706784 607306734 /nfs/dbraw/zinc/30/67/34/607306734.db2.gz PCMFXLOSQQTYLZ-XHDPSFHLSA-N -1 3 369.391 3.629 20 0 FHADHM CC(C)(C)c1nc2cc(NCc3cc(-c4nnn[n-]4)cs3)ccc2o1 ZINC000819965427 607309687 /nfs/dbraw/zinc/30/96/87/607309687.db2.gz GNXVJEJQPNMZFF-UHFFFAOYSA-N -1 3 354.439 3.979 20 0 FHADHM CC(C)(C)c1nc2cc(NCc3cc(-c4nn[n-]n4)cs3)ccc2o1 ZINC000819965427 607309688 /nfs/dbraw/zinc/30/96/88/607309688.db2.gz GNXVJEJQPNMZFF-UHFFFAOYSA-N -1 3 354.439 3.979 20 0 FHADHM c1sc(CNc2ccc3c(c2)OC2(CCCC2)O3)cc1-c1nnn[n-]1 ZINC000823767176 607311274 /nfs/dbraw/zinc/31/12/74/607311274.db2.gz OTNREGZUITXIFT-UHFFFAOYSA-N -1 3 355.423 3.582 20 0 FHADHM c1sc(CNc2ccc3c(c2)OC2(CCCC2)O3)cc1-c1nn[n-]n1 ZINC000823767176 607311275 /nfs/dbraw/zinc/31/12/75/607311275.db2.gz OTNREGZUITXIFT-UHFFFAOYSA-N -1 3 355.423 3.582 20 0 FHADHM CCCCOc1ccccc1NCc1ccc(OC)c(-c2nnn[n-]2)c1 ZINC000821077471 607311473 /nfs/dbraw/zinc/31/14/73/607311473.db2.gz HBKRSLOCQZVFOP-UHFFFAOYSA-N -1 3 353.426 3.666 20 0 FHADHM CCCCOc1ccccc1NCc1ccc(OC)c(-c2nn[n-]n2)c1 ZINC000821077471 607311474 /nfs/dbraw/zinc/31/14/74/607311474.db2.gz HBKRSLOCQZVFOP-UHFFFAOYSA-N -1 3 353.426 3.666 20 0 FHADHM CCCOc1ccc(NCc2ccc(OC)c(-c3nnn[n-]3)c2)c(C)c1 ZINC000821134206 607313202 /nfs/dbraw/zinc/31/32/02/607313202.db2.gz NZLZZCKMHJYUQN-UHFFFAOYSA-N -1 3 353.426 3.585 20 0 FHADHM CCCOc1ccc(NCc2ccc(OC)c(-c3nn[n-]n3)c2)c(C)c1 ZINC000821134206 607313203 /nfs/dbraw/zinc/31/32/03/607313203.db2.gz NZLZZCKMHJYUQN-UHFFFAOYSA-N -1 3 353.426 3.585 20 0 FHADHM Cc1nc(-c2cccc(NCc3ccc(-c4nnn[n-]4)s3)c2)oc1C ZINC000822418994 607313480 /nfs/dbraw/zinc/31/34/80/607313480.db2.gz LBIRAGHWUHQDGU-UHFFFAOYSA-N -1 3 352.423 3.812 20 0 FHADHM COc1ccc(CNc2cc(Cl)ccc2SC)cc1-c1nnn[n-]1 ZINC000821821709 607314192 /nfs/dbraw/zinc/31/41/92/607314192.db2.gz SDEINFMBYPVJQW-UHFFFAOYSA-N -1 3 361.858 3.863 20 0 FHADHM COc1ccc(CNc2cc(Cl)ccc2SC)cc1-c1nn[n-]n1 ZINC000821821709 607314193 /nfs/dbraw/zinc/31/41/93/607314193.db2.gz SDEINFMBYPVJQW-UHFFFAOYSA-N -1 3 361.858 3.863 20 0 FHADHM FC(F)Oc1ccc(NCc2ccc(-c3nnn[n-]3)s2)c2cccnc12 ZINC000822736986 607314740 /nfs/dbraw/zinc/31/47/40/607314740.db2.gz NNBYEHYDGWRDTJ-UHFFFAOYSA-N -1 3 374.376 3.690 20 0 FHADHM c1cc(-c2nnn[n-]2)sc1CNc1cccc(OCc2cscn2)c1 ZINC000823757766 607316537 /nfs/dbraw/zinc/31/65/37/607316537.db2.gz URPMOXSZTNESHN-UHFFFAOYSA-N -1 3 370.463 3.576 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N[C@@H]2CSc3ccccc32)n1 ZINC000737632880 599269557 /nfs/dbraw/zinc/26/95/57/599269557.db2.gz OEDKZWUPKGOYSQ-SNVBAGLBSA-N -1 3 364.356 3.539 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N[C@@H]2CSc3ccccc32)n1 ZINC000737632880 599269559 /nfs/dbraw/zinc/26/95/59/599269559.db2.gz OEDKZWUPKGOYSQ-SNVBAGLBSA-N -1 3 364.356 3.539 20 0 FHADHM Cc1cc(NCc2ccc(-c3nnn[n-]3)s2)ccc1OCC(F)(F)F ZINC000822209291 607317847 /nfs/dbraw/zinc/31/78/47/607317847.db2.gz BKAVCHNFBCOJCF-UHFFFAOYSA-N -1 3 369.372 3.790 20 0 FHADHM Cc1cc(F)cc(NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)c1 ZINC000822203423 607319441 /nfs/dbraw/zinc/31/94/41/607319441.db2.gz SVVUTPWHVRAMRV-UHFFFAOYSA-N -1 3 368.416 3.757 20 0 FHADHM Cc1cc(F)cc(NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)c1 ZINC000822203423 607319442 /nfs/dbraw/zinc/31/94/42/607319442.db2.gz SVVUTPWHVRAMRV-UHFFFAOYSA-N -1 3 368.416 3.757 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1ccc(F)cc1Cl ZINC000736489317 599279069 /nfs/dbraw/zinc/27/90/69/599279069.db2.gz XSSYOWWSEULECW-UHFFFAOYSA-N -1 3 374.807 3.733 20 0 FHADHM Cc1cc(-c2nn[n-]n2)cc(C)c1OCC(=O)Nc1cccc(C(C)C)c1 ZINC000737220631 599282789 /nfs/dbraw/zinc/28/27/89/599282789.db2.gz CVWPCFADVXMCTO-UHFFFAOYSA-N -1 3 365.437 3.624 20 0 FHADHM FC(F)Oc1ccc(CNc2cccc(Cl)c2-c2nnn[n-]2)cc1 ZINC000822733367 599285115 /nfs/dbraw/zinc/28/51/15/599285115.db2.gz ZLNYAHLAQDVFTK-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM FC(F)Oc1ccc(CNc2cccc(Cl)c2-c2nn[n-]n2)cc1 ZINC000822733367 599285116 /nfs/dbraw/zinc/28/51/16/599285116.db2.gz ZLNYAHLAQDVFTK-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM C[C@H](Sc1nnc(-c2cccs2)n1C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736193524 599287889 /nfs/dbraw/zinc/28/78/89/599287889.db2.gz SIFCCAHUMGIVFL-JTQLQIEISA-N -1 3 369.479 3.577 20 0 FHADHM C[C@H](Sc1nnc(-c2cccs2)n1C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736193524 599287891 /nfs/dbraw/zinc/28/78/91/599287891.db2.gz SIFCCAHUMGIVFL-JTQLQIEISA-N -1 3 369.479 3.577 20 0 FHADHM Cc1nnc(S[C@H](C)c2ccc(-c3nnn[n-]3)cc2)n1-c1ccccc1 ZINC000737532686 599288749 /nfs/dbraw/zinc/28/87/49/599288749.db2.gz KGGPPFLGZXWLJX-GFCCVEGCSA-N -1 3 363.450 3.609 20 0 FHADHM Cc1nnc(S[C@H](C)c2ccc(-c3nn[n-]n3)cc2)n1-c1ccccc1 ZINC000737532686 599288751 /nfs/dbraw/zinc/28/87/51/599288751.db2.gz KGGPPFLGZXWLJX-GFCCVEGCSA-N -1 3 363.450 3.609 20 0 FHADHM C[C@H](Sc1nccc(C(F)(F)F)n1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736192434 599289695 /nfs/dbraw/zinc/28/96/95/599289695.db2.gz MTRDWRHCLHOBLF-QMMMGPOBSA-N -1 3 352.345 3.529 20 0 FHADHM C[C@H](Sc1nccc(C(F)(F)F)n1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736192434 599289697 /nfs/dbraw/zinc/28/96/97/599289697.db2.gz MTRDWRHCLHOBLF-QMMMGPOBSA-N -1 3 352.345 3.529 20 0 FHADHM CCN(C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)[C@@H](C)C(C)C ZINC000821154527 599292021 /nfs/dbraw/zinc/29/20/21/599292021.db2.gz OLUKZHYESVLKAU-JTQLQIEISA-N -1 3 370.379 3.784 20 0 FHADHM CCN(C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)[C@@H](C)C(C)C ZINC000821154527 599292023 /nfs/dbraw/zinc/29/20/23/599292023.db2.gz OLUKZHYESVLKAU-JTQLQIEISA-N -1 3 370.379 3.784 20 0 FHADHM COc1cc(CN2CCC(C(=O)[O-])CC2)ccc1OCc1cccs1 ZINC000820763915 598119447 /nfs/dbraw/zinc/11/94/47/598119447.db2.gz LRQNDBGWSXRVNS-UHFFFAOYSA-N -1 3 361.463 3.632 20 0 FHADHM C[C@@H](NCc1cccc(C(=O)[O-])c1)c1ccc(OCc2nccn2C)cc1 ZINC000820148205 598192027 /nfs/dbraw/zinc/19/20/27/598192027.db2.gz MCLIADUOMBWWJO-OAHLLOKOSA-N -1 3 365.433 3.548 20 0 FHADHM Fc1ccc(-c2c[nH]c(Sc3cccc(F)c3-c3nnn[n-]3)n2)cc1 ZINC000737651577 598236411 /nfs/dbraw/zinc/23/64/11/598236411.db2.gz LFGIHFDFINOZNI-UHFFFAOYSA-N -1 3 356.361 3.686 20 0 FHADHM CC(C)CCOc1ccc([C@H](C)Nc2ncccc2-c2nnn[n-]2)cc1 ZINC000735820475 598243598 /nfs/dbraw/zinc/24/35/98/598243598.db2.gz TVDMWUBNDLSSSM-AWEZNQCLSA-N -1 3 352.442 3.860 20 0 FHADHM CC(C)CCOc1ccc([C@H](C)Nc2ncccc2-c2nn[n-]n2)cc1 ZINC000735820475 598243600 /nfs/dbraw/zinc/24/36/00/598243600.db2.gz TVDMWUBNDLSSSM-AWEZNQCLSA-N -1 3 352.442 3.860 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N[C@@H](c1ccccc1)C1CCC1 ZINC000737291090 598265826 /nfs/dbraw/zinc/26/58/26/598265826.db2.gz HRMRYDXLVLTCKH-SFHVURJKSA-N -1 3 362.437 3.838 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N[C@@H](c1ccccc1)C1CCC1 ZINC000737291090 598265828 /nfs/dbraw/zinc/26/58/28/598265828.db2.gz HRMRYDXLVLTCKH-SFHVURJKSA-N -1 3 362.437 3.838 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N[C@H](c1ccccc1)C1CCC1 ZINC000737291089 598266001 /nfs/dbraw/zinc/26/60/01/598266001.db2.gz HRMRYDXLVLTCKH-GOSISDBHSA-N -1 3 362.437 3.838 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N[C@H](c1ccccc1)C1CCC1 ZINC000737291089 598266002 /nfs/dbraw/zinc/26/60/02/598266002.db2.gz HRMRYDXLVLTCKH-GOSISDBHSA-N -1 3 362.437 3.838 20 0 FHADHM C[C@H]1CCN(C(=O)Nc2cccc(Oc3ccc(-c4nnn[n-]4)cc3)c2)C1 ZINC000736278621 598267103 /nfs/dbraw/zinc/26/71/03/598267103.db2.gz SAYJSSCAFXTJLS-ZDUSSCGKSA-N -1 3 364.409 3.533 20 0 FHADHM C[C@H]1CCN(C(=O)Nc2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)C1 ZINC000736278621 598267105 /nfs/dbraw/zinc/26/71/05/598267105.db2.gz SAYJSSCAFXTJLS-ZDUSSCGKSA-N -1 3 364.409 3.533 20 0 FHADHM COc1ccc(CN(C)c2ccc(-c3nn[n-]n3)cc2C(F)(F)F)cc1 ZINC000737091340 598274060 /nfs/dbraw/zinc/27/40/60/598274060.db2.gz TXOBCGOOFNQSGS-UHFFFAOYSA-N -1 3 363.343 3.531 20 0 FHADHM C[C@H]1CN(C(=O)Nc2cc(-c3nnn[n-]3)cn2C(C)(C)C)c2ccccc21 ZINC000736282638 598278435 /nfs/dbraw/zinc/27/84/35/598278435.db2.gz ZABLYXZNNCGDSA-LBPRGKRZSA-N -1 3 365.441 3.579 20 0 FHADHM C[C@H]1CN(C(=O)Nc2cc(-c3nn[n-]n3)cn2C(C)(C)C)c2ccccc21 ZINC000736282638 598278437 /nfs/dbraw/zinc/27/84/37/598278437.db2.gz ZABLYXZNNCGDSA-LBPRGKRZSA-N -1 3 365.441 3.579 20 0 FHADHM CC(C)Sc1ccc(C(=O)N(C)c2ccc(-c3nnn[n-]3)cc2F)cc1 ZINC000735921752 598279671 /nfs/dbraw/zinc/27/96/71/598279671.db2.gz ZUEHSAZVOVNPAT-UHFFFAOYSA-N -1 3 371.441 3.783 20 0 FHADHM CC(C)Sc1ccc(C(=O)N(C)c2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000735921752 598279672 /nfs/dbraw/zinc/27/96/72/598279672.db2.gz ZUEHSAZVOVNPAT-UHFFFAOYSA-N -1 3 371.441 3.783 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)Nc2cc(-c3nnn[n-]3)cn2C(C)(C)C)s1 ZINC000737320471 598279857 /nfs/dbraw/zinc/27/98/57/598279857.db2.gz KXOQKRYCKBZGNJ-NSHDSACASA-N -1 3 373.486 3.676 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)Nc2cc(-c3nn[n-]n3)cn2C(C)(C)C)s1 ZINC000737320471 598279858 /nfs/dbraw/zinc/27/98/58/598279858.db2.gz KXOQKRYCKBZGNJ-NSHDSACASA-N -1 3 373.486 3.676 20 0 FHADHM CC[C@H](NC(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1)C1CCCCC1 ZINC000736362936 598284100 /nfs/dbraw/zinc/28/41/00/598284100.db2.gz LNAUUBJUXYXJEL-DYVFJYSZSA-N -1 3 356.474 3.586 20 0 FHADHM CC[C@H](NC(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1)C1CCCCC1 ZINC000736362936 598284102 /nfs/dbraw/zinc/28/41/02/598284102.db2.gz LNAUUBJUXYXJEL-DYVFJYSZSA-N -1 3 356.474 3.586 20 0 FHADHM CC[C@H](C)Oc1ccccc1C=CC(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000729846029 598296711 /nfs/dbraw/zinc/29/67/11/598296711.db2.gz ZIRPCACWCVCRCD-UELRPHRMSA-N -1 3 363.421 3.696 20 0 FHADHM CC[C@H](C)Oc1ccccc1C=CC(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000729846029 598296713 /nfs/dbraw/zinc/29/67/13/598296713.db2.gz ZIRPCACWCVCRCD-UELRPHRMSA-N -1 3 363.421 3.696 20 0 FHADHM CCN(C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccccc1 ZINC000736508806 598315257 /nfs/dbraw/zinc/31/52/57/598315257.db2.gz NKLQFMCHYBMFQT-UHFFFAOYSA-N -1 3 358.858 3.743 20 0 FHADHM CCN(C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccccc1 ZINC000736508806 598315259 /nfs/dbraw/zinc/31/52/59/598315259.db2.gz NKLQFMCHYBMFQT-UHFFFAOYSA-N -1 3 358.858 3.743 20 0 FHADHM S=C(NCCCC1CCCC1)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000738400935 598319361 /nfs/dbraw/zinc/31/93/61/598319361.db2.gz KMQSYESIRIOREY-UHFFFAOYSA-N -1 3 364.906 3.777 20 0 FHADHM S=C(NCCCC1CCCC1)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000738400935 598319359 /nfs/dbraw/zinc/31/93/59/598319359.db2.gz KMQSYESIRIOREY-UHFFFAOYSA-N -1 3 364.906 3.777 20 0 FHADHM CC[C@@H]1CCCC[C@@H]1NC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736400695 598319961 /nfs/dbraw/zinc/31/99/61/598319961.db2.gz RKSNXBFCLURBND-YGRLFVJLSA-N -1 3 364.906 3.775 20 0 FHADHM CC[C@@H]1CCCC[C@@H]1NC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736400695 598319962 /nfs/dbraw/zinc/31/99/62/598319962.db2.gz RKSNXBFCLURBND-YGRLFVJLSA-N -1 3 364.906 3.775 20 0 FHADHM C[C@H]1CCC[C@@H](CNC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)C1 ZINC000736248536 598321914 /nfs/dbraw/zinc/32/19/14/598321914.db2.gz JCFNOJBGZIZNPL-WDEREUQCSA-N -1 3 364.906 3.633 20 0 FHADHM C[C@H]1CCC[C@@H](CNC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)C1 ZINC000736248536 598321915 /nfs/dbraw/zinc/32/19/15/598321915.db2.gz JCFNOJBGZIZNPL-WDEREUQCSA-N -1 3 364.906 3.633 20 0 FHADHM Cc1ccc(C)c(N(C)C(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c1 ZINC000737321656 598322602 /nfs/dbraw/zinc/32/26/02/598322602.db2.gz HYVVJENLMPFUDS-UHFFFAOYSA-N -1 3 372.885 3.970 20 0 FHADHM Cc1ccc(C)c(N(C)C(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c1 ZINC000737321656 598322603 /nfs/dbraw/zinc/32/26/03/598322603.db2.gz HYVVJENLMPFUDS-UHFFFAOYSA-N -1 3 372.885 3.970 20 0 FHADHM Cc1cccc2c1CCN2C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000737408189 598324637 /nfs/dbraw/zinc/32/46/37/598324637.db2.gz IDSVFEMNIKRZHH-UHFFFAOYSA-N -1 3 370.869 3.588 20 0 FHADHM Cc1cccc2c1CCN2C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000737408189 598324638 /nfs/dbraw/zinc/32/46/38/598324638.db2.gz IDSVFEMNIKRZHH-UHFFFAOYSA-N -1 3 370.869 3.588 20 0 FHADHM Cc1cc(F)ccc1C(=O)N(CC(C)C)c1ccc(-c2nnn[n-]2)cc1 ZINC000822204237 607351285 /nfs/dbraw/zinc/35/12/85/607351285.db2.gz JBLMMVGHJYXJKU-UHFFFAOYSA-N -1 3 353.401 3.617 20 0 FHADHM Cc1cc(F)ccc1C(=O)N(CC(C)C)c1ccc(-c2nn[n-]n2)cc1 ZINC000822204237 607351286 /nfs/dbraw/zinc/35/12/86/607351286.db2.gz JBLMMVGHJYXJKU-UHFFFAOYSA-N -1 3 353.401 3.617 20 0 FHADHM CC[C@H](Oc1ccccc1C(C)C)C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000517310708 598358174 /nfs/dbraw/zinc/35/81/74/598358174.db2.gz VOKVSFOLAXBHMR-KRWDZBQOSA-N -1 3 365.437 3.786 20 0 FHADHM CC[C@H](Oc1ccccc1C(C)C)C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000517310708 598358176 /nfs/dbraw/zinc/35/81/76/598358176.db2.gz VOKVSFOLAXBHMR-KRWDZBQOSA-N -1 3 365.437 3.786 20 0 FHADHM CC[C@@H](Oc1ccccc1C(C)C)C(=O)Oc1ccc(-c2nnn[n-]2)cc1 ZINC000736391328 598358871 /nfs/dbraw/zinc/35/88/71/598358871.db2.gz MPPZUTLIXWGUKH-QGZVFWFLSA-N -1 3 366.421 3.753 20 0 FHADHM CC[C@@H](Oc1ccccc1C(C)C)C(=O)Oc1ccc(-c2nn[n-]n2)cc1 ZINC000736391328 598358873 /nfs/dbraw/zinc/35/88/73/598358873.db2.gz MPPZUTLIXWGUKH-QGZVFWFLSA-N -1 3 366.421 3.753 20 0 FHADHM C[C@@H](CC(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1)c1ccccc1F ZINC000735978556 598364912 /nfs/dbraw/zinc/36/49/12/598364912.db2.gz WVTJBGALUGOJTD-JTQLQIEISA-N -1 3 359.792 3.792 20 0 FHADHM C[C@@H](CC(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1)c1ccccc1F ZINC000735978556 598364913 /nfs/dbraw/zinc/36/49/13/598364913.db2.gz WVTJBGALUGOJTD-JTQLQIEISA-N -1 3 359.792 3.792 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)C[C@@H](C)c1ccccc1F ZINC000736638061 598365535 /nfs/dbraw/zinc/36/55/35/598365535.db2.gz XLPBHTUEFBRYEI-GFCCVEGCSA-N -1 3 369.400 3.537 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)C[C@@H](C)c1ccccc1F ZINC000736638061 598365536 /nfs/dbraw/zinc/36/55/36/598365536.db2.gz XLPBHTUEFBRYEI-GFCCVEGCSA-N -1 3 369.400 3.537 20 0 FHADHM Cc1cccc(CC(=O)N(Cc2ccco2)c2ccccc2-c2nnn[n-]2)c1 ZINC000737391410 598365550 /nfs/dbraw/zinc/36/55/50/598365550.db2.gz AWJDRFAOWXWUAP-UHFFFAOYSA-N -1 3 373.416 3.544 20 0 FHADHM Cc1cccc(CC(=O)N(Cc2ccco2)c2ccccc2-c2nn[n-]n2)c1 ZINC000737391410 598365551 /nfs/dbraw/zinc/36/55/51/598365551.db2.gz AWJDRFAOWXWUAP-UHFFFAOYSA-N -1 3 373.416 3.544 20 0 FHADHM CC(C)(C)Sc1ccc(NC(=O)Cc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000735643698 598365636 /nfs/dbraw/zinc/36/56/36/598365636.db2.gz QISRFGSHXYDZTI-UHFFFAOYSA-N -1 3 367.478 3.939 20 0 FHADHM CC(C)(C)Sc1ccc(NC(=O)Cc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000735643698 598365638 /nfs/dbraw/zinc/36/56/38/598365638.db2.gz QISRFGSHXYDZTI-UHFFFAOYSA-N -1 3 367.478 3.939 20 0 FHADHM Cc1ccc(Oc2ccccc2CNc2ccc(-c3nnn[n-]3)cn2)cc1 ZINC000737366102 598386716 /nfs/dbraw/zinc/38/67/16/598386716.db2.gz OZJVNZRVJONQFO-UHFFFAOYSA-N -1 3 358.405 3.975 20 0 FHADHM Cc1ccc(Oc2ccccc2CNc2ccc(-c3nn[n-]n3)cn2)cc1 ZINC000737366102 598386717 /nfs/dbraw/zinc/38/67/17/598386717.db2.gz OZJVNZRVJONQFO-UHFFFAOYSA-N -1 3 358.405 3.975 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1NCCNc1cccc2ccccc21 ZINC000737557466 598386887 /nfs/dbraw/zinc/38/68/87/598386887.db2.gz FFOYGFHYHKJDNJ-UHFFFAOYSA-N -1 3 365.828 3.592 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1NCCNc1cccc2ccccc21 ZINC000737557466 598386888 /nfs/dbraw/zinc/38/68/88/598386888.db2.gz FFOYGFHYHKJDNJ-UHFFFAOYSA-N -1 3 365.828 3.592 20 0 FHADHM CN(Cc1cc(Cl)cc(Cl)c1)c1ncc(-c2nnn[n-]2)cc1Cl ZINC000736813406 598390919 /nfs/dbraw/zinc/39/09/19/598390919.db2.gz BHYTZYTZKCYEEC-UHFFFAOYSA-N -1 3 369.643 3.858 20 0 FHADHM CN(Cc1cc(Cl)cc(Cl)c1)c1ncc(-c2nn[n-]n2)cc1Cl ZINC000736813406 598390921 /nfs/dbraw/zinc/39/09/21/598390921.db2.gz BHYTZYTZKCYEEC-UHFFFAOYSA-N -1 3 369.643 3.858 20 0 FHADHM Cc1ccsc1-c1nnc(SCc2ccc(F)cc2-c2nnn[n-]2)o1 ZINC000737442198 598394398 /nfs/dbraw/zinc/39/43/98/598394398.db2.gz NNRCQDZLWLPLKE-UHFFFAOYSA-N -1 3 374.426 3.718 20 0 FHADHM Cc1ccsc1-c1nnc(SCc2ccc(F)cc2-c2nn[n-]n2)o1 ZINC000737442198 598394400 /nfs/dbraw/zinc/39/44/00/598394400.db2.gz NNRCQDZLWLPLKE-UHFFFAOYSA-N -1 3 374.426 3.718 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1OCc1ccc(Cl)c2cccnc12 ZINC000737222144 598395418 /nfs/dbraw/zinc/39/54/18/598395418.db2.gz SXVLOZYDSNZMAI-UHFFFAOYSA-N -1 3 351.797 3.956 20 0 FHADHM Cc1ccc(NC(=O)[C@H](C)Sc2ccc(-c3nnn[n-]3)cc2)c(Cl)c1 ZINC000737357396 598414644 /nfs/dbraw/zinc/41/46/44/598414644.db2.gz YMYURKDXKWUORJ-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM Cc1ccc(NC(=O)[C@H](C)Sc2ccc(-c3nn[n-]n3)cc2)c(Cl)c1 ZINC000737357396 598414646 /nfs/dbraw/zinc/41/46/46/598414646.db2.gz YMYURKDXKWUORJ-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)Nc1cc(F)cc(F)c1 ZINC000735873248 598425761 /nfs/dbraw/zinc/42/57/61/598425761.db2.gz DLBXGSHZICQMTN-UHFFFAOYSA-N -1 3 372.379 3.587 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)Nc1cc(F)cc(F)c1 ZINC000735873248 598425763 /nfs/dbraw/zinc/42/57/63/598425763.db2.gz DLBXGSHZICQMTN-UHFFFAOYSA-N -1 3 372.379 3.587 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)NC[C@@H]1CCC[C@H](C)C1 ZINC000736247209 598429543 /nfs/dbraw/zinc/42/95/43/598429543.db2.gz BKMCGXBNTLHDIG-DOTOQJQBSA-N -1 3 370.501 3.613 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)NC[C@@H]1CCC[C@H](C)C1 ZINC000736247209 598429544 /nfs/dbraw/zinc/42/95/44/598429544.db2.gz BKMCGXBNTLHDIG-DOTOQJQBSA-N -1 3 370.501 3.613 20 0 FHADHM Cc1cc(C)c2c(c1)N(C(=S)Nc1ccccc1-c1nnn[n-]1)CCC2 ZINC000737247943 598441755 /nfs/dbraw/zinc/44/17/55/598441755.db2.gz BFOCQBCUZBBHNA-UHFFFAOYSA-N -1 3 364.478 3.633 20 0 FHADHM Cc1cc(C)c2c(c1)N(C(=S)Nc1ccccc1-c1nn[n-]n1)CCC2 ZINC000737247943 598441756 /nfs/dbraw/zinc/44/17/56/598441756.db2.gz BFOCQBCUZBBHNA-UHFFFAOYSA-N -1 3 364.478 3.633 20 0 FHADHM CCN(C(=O)CSCc1ccc(-c2nnn[n-]2)cc1)[C@H]1CCCC[C@@H]1C ZINC000736506197 598445670 /nfs/dbraw/zinc/44/56/70/598445670.db2.gz XQACSMNLKSZXBD-YOEHRIQHSA-N -1 3 373.526 3.527 20 0 FHADHM CCN(C(=O)CSCc1ccc(-c2nn[n-]n2)cc1)[C@H]1CCCC[C@@H]1C ZINC000736506197 598445671 /nfs/dbraw/zinc/44/56/71/598445671.db2.gz XQACSMNLKSZXBD-YOEHRIQHSA-N -1 3 373.526 3.527 20 0 FHADHM CCCc1nc(C)c(C(=O)O[C@@H](C)c2cccc(-c3nnn[n-]3)c2)s1 ZINC000736495188 598484580 /nfs/dbraw/zinc/48/45/80/598484580.db2.gz JLAGUUJCAVXZRD-NSHDSACASA-N -1 3 357.439 3.502 20 0 FHADHM CCCc1nc(C)c(C(=O)O[C@@H](C)c2cccc(-c3nn[n-]n3)c2)s1 ZINC000736495188 598484581 /nfs/dbraw/zinc/48/45/81/598484581.db2.gz JLAGUUJCAVXZRD-NSHDSACASA-N -1 3 357.439 3.502 20 0 FHADHM CCN(Cc1nc(C)c2ccccc2n1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736555708 598486711 /nfs/dbraw/zinc/48/67/11/598486711.db2.gz JRBPNLUYSVQMEV-HNNXBMFYSA-N -1 3 373.464 3.701 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)c1cc2ccccc2s1 ZINC000735660476 598487489 /nfs/dbraw/zinc/48/74/89/598487489.db2.gz BDDDKLYNDNXBCK-UHFFFAOYSA-N -1 3 366.450 3.890 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)c1cc2ccccc2s1 ZINC000735660476 598487491 /nfs/dbraw/zinc/48/74/91/598487491.db2.gz BDDDKLYNDNXBCK-UHFFFAOYSA-N -1 3 366.450 3.890 20 0 FHADHM C[C@H](OC(=O)CCSc1ccc(F)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000736147161 598488459 /nfs/dbraw/zinc/48/84/59/598488459.db2.gz BSELCADICSGEDW-LBPRGKRZSA-N -1 3 372.425 3.792 20 0 FHADHM C[C@H](OC(=O)CCSc1ccc(F)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000736147161 598488461 /nfs/dbraw/zinc/48/84/61/598488461.db2.gz BSELCADICSGEDW-LBPRGKRZSA-N -1 3 372.425 3.792 20 0 FHADHM C[C@@H](CC(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C)c1ccccc1F ZINC000735976938 598489807 /nfs/dbraw/zinc/48/98/07/598489807.db2.gz QSCVKRQKVGEADV-LBPRGKRZSA-N -1 3 370.432 3.695 20 0 FHADHM C[C@@H](CC(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C)c1ccccc1F ZINC000735976938 598489808 /nfs/dbraw/zinc/48/98/08/598489808.db2.gz QSCVKRQKVGEADV-LBPRGKRZSA-N -1 3 370.432 3.695 20 0 FHADHM CC(=O)c1ccc(Cl)c(Cl)c1OCc1ccccc1-c1nnn[n-]1 ZINC000735495807 598494260 /nfs/dbraw/zinc/49/42/60/598494260.db2.gz OEPZQRVQUNHBNU-UHFFFAOYSA-N -1 3 363.204 3.955 20 0 FHADHM CC(=O)c1ccc(Cl)c(Cl)c1OCc1ccccc1-c1nn[n-]n1 ZINC000735495807 598494261 /nfs/dbraw/zinc/49/42/61/598494261.db2.gz OEPZQRVQUNHBNU-UHFFFAOYSA-N -1 3 363.204 3.955 20 0 FHADHM Cc1ccc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CC[C@@H](C)C3)cc1F ZINC000737316560 598495312 /nfs/dbraw/zinc/49/53/12/598495312.db2.gz YTGHRPFEADXGHN-SECBINFHSA-N -1 3 371.441 3.753 20 0 FHADHM Cc1ccc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CC[C@@H](C)C3)cc1F ZINC000737316560 598495313 /nfs/dbraw/zinc/49/53/13/598495313.db2.gz YTGHRPFEADXGHN-SECBINFHSA-N -1 3 371.441 3.753 20 0 FHADHM CCc1ccc([C@@H](C)C(=O)Nc2ccc(Cl)c(-c3nnn[n-]3)c2)cc1 ZINC000736688663 598498387 /nfs/dbraw/zinc/49/83/87/598498387.db2.gz QGZCHPZJHSTUNP-LLVKDONJSA-N -1 3 355.829 3.825 20 0 FHADHM CCc1ccc([C@@H](C)C(=O)Nc2ccc(Cl)c(-c3nn[n-]n3)c2)cc1 ZINC000736688663 598498389 /nfs/dbraw/zinc/49/83/89/598498389.db2.gz QGZCHPZJHSTUNP-LLVKDONJSA-N -1 3 355.829 3.825 20 0 FHADHM C[C@@H](Nc1ccc(-c2nn[n-]n2)cc1)c1ccc(F)c(Br)c1 ZINC000737194546 598504101 /nfs/dbraw/zinc/50/41/01/598504101.db2.gz OCOJPKYRNDQHBE-SECBINFHSA-N -1 3 362.206 3.941 20 0 FHADHM Clc1ccc(N2CCc3[nH]c4ccccc4c3C2)c(-c2nnn[n-]2)c1 ZINC000737575420 598508056 /nfs/dbraw/zinc/50/80/56/598508056.db2.gz UMZRXTXFQJJBLP-UHFFFAOYSA-N -1 3 350.813 3.564 20 0 FHADHM Clc1ccc(N2CCc3[nH]c4ccccc4c3C2)c(-c2nn[n-]n2)c1 ZINC000737575420 598508057 /nfs/dbraw/zinc/50/80/57/598508057.db2.gz UMZRXTXFQJJBLP-UHFFFAOYSA-N -1 3 350.813 3.564 20 0 FHADHM CCC[C@H](Cc1ccccc1)NC(=S)Nc1ccccc1-c1nnn[n-]1 ZINC000736425138 598513257 /nfs/dbraw/zinc/51/32/57/598513257.db2.gz BRUNSSQNUHDTCI-OAHLLOKOSA-N -1 3 366.494 3.565 20 0 FHADHM CCC[C@H](Cc1ccccc1)NC(=S)Nc1ccccc1-c1nn[n-]n1 ZINC000736425138 598513259 /nfs/dbraw/zinc/51/32/59/598513259.db2.gz BRUNSSQNUHDTCI-OAHLLOKOSA-N -1 3 366.494 3.565 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@H]1CC[C@H](C)CC1 ZINC000735831715 598516022 /nfs/dbraw/zinc/51/60/22/598516022.db2.gz UBTGYEPUXQNFLT-RZDIXWSQSA-N -1 3 370.501 3.613 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@H]1CC[C@H](C)CC1 ZINC000735831715 598516024 /nfs/dbraw/zinc/51/60/24/598516024.db2.gz UBTGYEPUXQNFLT-RZDIXWSQSA-N -1 3 370.501 3.613 20 0 FHADHM CCc1c(C)sc(NC(=O)c2csc(C(C)C)n2)c1-c1nnn[n-]1 ZINC000736679222 598516286 /nfs/dbraw/zinc/51/62/86/598516286.db2.gz OSUMSPKQDAGTAP-UHFFFAOYSA-N -1 3 362.484 3.631 20 0 FHADHM CCc1c(C)sc(NC(=O)c2csc(C(C)C)n2)c1-c1nn[n-]n1 ZINC000736679222 598516288 /nfs/dbraw/zinc/51/62/88/598516288.db2.gz OSUMSPKQDAGTAP-UHFFFAOYSA-N -1 3 362.484 3.631 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H]2C[C@@H]2c2ccc(F)cc2)c1-c1nnn[n-]1 ZINC000736670807 598516751 /nfs/dbraw/zinc/51/67/51/598516751.db2.gz SHEHMMSNJBCALZ-ZIAGYGMSSA-N -1 3 371.441 3.680 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H]2C[C@@H]2c2ccc(F)cc2)c1-c1nn[n-]n1 ZINC000736670807 598516752 /nfs/dbraw/zinc/51/67/52/598516752.db2.gz SHEHMMSNJBCALZ-ZIAGYGMSSA-N -1 3 371.441 3.680 20 0 FHADHM CCc1c(C)sc(NC(=O)C=Cc2cccc(F)c2)c1-c1nnn[n-]1 ZINC000736671179 598516905 /nfs/dbraw/zinc/51/69/05/598516905.db2.gz TUNCBQRCGBHQMK-FPLPWBNLSA-N -1 3 357.414 3.590 20 0 FHADHM CCc1c(C)sc(NC(=O)C=Cc2cccc(F)c2)c1-c1nn[n-]n1 ZINC000736671179 598516906 /nfs/dbraw/zinc/51/69/06/598516906.db2.gz TUNCBQRCGBHQMK-FPLPWBNLSA-N -1 3 357.414 3.590 20 0 FHADHM COc1ccc2cc([C@H](C)C(=O)Oc3ccc(-c4nnn[n-]4)cc3)ccc2c1 ZINC000737120088 598530420 /nfs/dbraw/zinc/53/04/20/598530420.db2.gz IDLHTMAXNCOVCX-ZDUSSCGKSA-N -1 3 374.400 3.738 20 0 FHADHM COc1ccc2cc([C@H](C)C(=O)Oc3ccc(-c4nn[n-]n4)cc3)ccc2c1 ZINC000737120088 598530421 /nfs/dbraw/zinc/53/04/21/598530421.db2.gz IDLHTMAXNCOVCX-ZDUSSCGKSA-N -1 3 374.400 3.738 20 0 FHADHM CCC[C@@H](C)C(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736418125 598543277 /nfs/dbraw/zinc/54/32/77/598543277.db2.gz AIMLKFQDETXAGV-CQSZACIVSA-N -1 3 365.437 3.820 20 0 FHADHM CCC[C@@H](C)C(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736418125 598543278 /nfs/dbraw/zinc/54/32/78/598543278.db2.gz AIMLKFQDETXAGV-CQSZACIVSA-N -1 3 365.437 3.820 20 0 FHADHM CC(C)COc1ccccc1C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000735843845 598551540 /nfs/dbraw/zinc/55/15/40/598551540.db2.gz BLYRFVKAKPPEGM-UHFFFAOYSA-N -1 3 371.828 3.807 20 0 FHADHM CC(C)COc1ccccc1C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000735843845 598551541 /nfs/dbraw/zinc/55/15/41/598551541.db2.gz BLYRFVKAKPPEGM-UHFFFAOYSA-N -1 3 371.828 3.807 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1)c1ccsc1 ZINC000738173394 598556005 /nfs/dbraw/zinc/55/60/05/598556005.db2.gz PYKNFQXUKZEROW-UHFFFAOYSA-N -1 3 363.402 3.973 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1)c1ccsc1 ZINC000738173394 598556007 /nfs/dbraw/zinc/55/60/07/598556007.db2.gz PYKNFQXUKZEROW-UHFFFAOYSA-N -1 3 363.402 3.973 20 0 FHADHM CN(CC1CC1)C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736794425 598564113 /nfs/dbraw/zinc/56/41/13/598564113.db2.gz SIUJZAPREDNVKT-UHFFFAOYSA-N -1 3 364.409 3.533 20 0 FHADHM CN(CC1CC1)C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736794425 598564116 /nfs/dbraw/zinc/56/41/16/598564116.db2.gz SIUJZAPREDNVKT-UHFFFAOYSA-N -1 3 364.409 3.533 20 0 FHADHM Fc1ccccc1OCCNc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000737669898 598572289 /nfs/dbraw/zinc/57/22/89/598572289.db2.gz QSQISWROUXITFS-UHFFFAOYSA-N -1 3 367.306 3.516 20 0 FHADHM Fc1ccccc1OCCNc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000737669898 598572291 /nfs/dbraw/zinc/57/22/91/598572291.db2.gz QSQISWROUXITFS-UHFFFAOYSA-N -1 3 367.306 3.516 20 0 FHADHM CC(C)COC1CCN(c2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)CC1 ZINC000735839060 598575519 /nfs/dbraw/zinc/57/55/19/598575519.db2.gz ZBMFWUGPQFQWHI-UHFFFAOYSA-N -1 3 369.391 3.527 20 0 FHADHM CC(C)COC1CCN(c2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)CC1 ZINC000735839060 598575520 /nfs/dbraw/zinc/57/55/20/598575520.db2.gz ZBMFWUGPQFQWHI-UHFFFAOYSA-N -1 3 369.391 3.527 20 0 FHADHM C[C@@H](NC(=O)Nc1cccc(-n2cccc2)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736116235 598582957 /nfs/dbraw/zinc/58/29/57/598582957.db2.gz LTIFJQHFGNSVKX-CQSZACIVSA-N -1 3 373.420 3.540 20 0 FHADHM C[C@@H](NC(=O)Nc1cccc(-n2cccc2)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736116235 598582958 /nfs/dbraw/zinc/58/29/58/598582958.db2.gz LTIFJQHFGNSVKX-CQSZACIVSA-N -1 3 373.420 3.540 20 0 FHADHM Cc1nc(-c2ccccn2)nc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1C ZINC000737464698 598592676 /nfs/dbraw/zinc/59/26/76/598592676.db2.gz VLGLRXPKRPFQGO-AWEZNQCLSA-N -1 3 372.436 3.509 20 0 FHADHM Cc1nc(-c2ccccn2)nc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1C ZINC000737464698 598592678 /nfs/dbraw/zinc/59/26/78/598592678.db2.gz VLGLRXPKRPFQGO-AWEZNQCLSA-N -1 3 372.436 3.509 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccc(-c2ccccc2)cc1 ZINC000738165313 598592895 /nfs/dbraw/zinc/59/28/95/598592895.db2.gz BXSHLTJNUJAMAK-UHFFFAOYSA-N -1 3 359.364 3.925 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccc(-c2ccccc2)cc1 ZINC000738165313 598592896 /nfs/dbraw/zinc/59/28/96/598592896.db2.gz BXSHLTJNUJAMAK-UHFFFAOYSA-N -1 3 359.364 3.925 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)c1[nH]c2ccc(F)cc2c1Cl ZINC000738167280 598599843 /nfs/dbraw/zinc/59/98/43/598599843.db2.gz QGEDAPPFGNSNLJ-UHFFFAOYSA-N -1 3 374.738 3.532 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)c1[nH]c2ccc(F)cc2c1Cl ZINC000738167280 598599845 /nfs/dbraw/zinc/59/98/45/598599845.db2.gz QGEDAPPFGNSNLJ-UHFFFAOYSA-N -1 3 374.738 3.532 20 0 FHADHM C[C@@H](OC(=O)c1ccc(-c2nnn[n-]2)cc1)c1ccc(C(F)(F)F)cc1 ZINC000736158344 598618373 /nfs/dbraw/zinc/61/83/73/598618373.db2.gz FYFZADBBEOJCEX-SNVBAGLBSA-N -1 3 362.311 3.804 20 0 FHADHM C[C@@H](OC(=O)c1ccc(-c2nn[n-]n2)cc1)c1ccc(C(F)(F)F)cc1 ZINC000736158344 598618375 /nfs/dbraw/zinc/61/83/75/598618375.db2.gz FYFZADBBEOJCEX-SNVBAGLBSA-N -1 3 362.311 3.804 20 0 FHADHM CC(C)c1cc(NC(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)on1 ZINC000735921941 598622258 /nfs/dbraw/zinc/62/22/58/598622258.db2.gz ANAVQXMIBLDVTP-UHFFFAOYSA-N -1 3 374.404 3.897 20 0 FHADHM CC(C)c1cc(NC(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)on1 ZINC000735921941 598622260 /nfs/dbraw/zinc/62/22/60/598622260.db2.gz ANAVQXMIBLDVTP-UHFFFAOYSA-N -1 3 374.404 3.897 20 0 FHADHM CC[C@H](NC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1cccc(Cl)c1 ZINC000736366200 598624366 /nfs/dbraw/zinc/62/43/66/598624366.db2.gz ZYDQKKOIYSXJOK-HNNXBMFYSA-N -1 3 374.807 3.932 20 0 FHADHM CC[C@H](NC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1cccc(Cl)c1 ZINC000736366200 598624371 /nfs/dbraw/zinc/62/43/71/598624371.db2.gz ZYDQKKOIYSXJOK-HNNXBMFYSA-N -1 3 374.807 3.932 20 0 FHADHM C[C@H](c1ccc(Cl)cc1)N(C)C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000736202308 598624622 /nfs/dbraw/zinc/62/46/22/598624622.db2.gz ZVZYUXJOSFLJNQ-SNVBAGLBSA-N -1 3 374.807 3.884 20 0 FHADHM C[C@H](c1ccc(Cl)cc1)N(C)C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000736202308 598624624 /nfs/dbraw/zinc/62/46/24/598624624.db2.gz ZVZYUXJOSFLJNQ-SNVBAGLBSA-N -1 3 374.807 3.884 20 0 FHADHM C[C@H](c1cccc(Cl)c1)N(C)C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000736201986 598628960 /nfs/dbraw/zinc/62/89/60/598628960.db2.gz YRUFIJOZRGMVOC-SNVBAGLBSA-N -1 3 374.807 3.884 20 0 FHADHM C[C@H](c1cccc(Cl)c1)N(C)C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000736201986 598628962 /nfs/dbraw/zinc/62/89/62/598628962.db2.gz YRUFIJOZRGMVOC-SNVBAGLBSA-N -1 3 374.807 3.884 20 0 FHADHM CN(Cc1ccc(Br)o1)c1c(Cl)cccc1-c1nnn[n-]1 ZINC000736816240 598632749 /nfs/dbraw/zinc/63/27/49/598632749.db2.gz BPVIVGGNMQBJDV-UHFFFAOYSA-N -1 3 368.622 3.512 20 0 FHADHM CN(Cc1ccc(Br)o1)c1c(Cl)cccc1-c1nn[n-]n1 ZINC000736816240 598632750 /nfs/dbraw/zinc/63/27/50/598632750.db2.gz BPVIVGGNMQBJDV-UHFFFAOYSA-N -1 3 368.622 3.512 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(NCC2(c3ccccc3)CCOCC2)c1 ZINC000737571070 598633387 /nfs/dbraw/zinc/63/33/87/598633387.db2.gz QKIQDAVKELUYGC-UHFFFAOYSA-N -1 3 369.856 3.680 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(NCC2(c3ccccc3)CCOCC2)c1 ZINC000737571070 598633388 /nfs/dbraw/zinc/63/33/88/598633388.db2.gz QKIQDAVKELUYGC-UHFFFAOYSA-N -1 3 369.856 3.680 20 0 FHADHM CN(Cc1nc2ccccc2s1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736831568 598637381 /nfs/dbraw/zinc/63/73/81/598637381.db2.gz PLBWRFYHRKAEFT-UHFFFAOYSA-N -1 3 356.842 3.766 20 0 FHADHM CN(Cc1nc2ccccc2s1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736831568 598637383 /nfs/dbraw/zinc/63/73/83/598637383.db2.gz PLBWRFYHRKAEFT-UHFFFAOYSA-N -1 3 356.842 3.766 20 0 FHADHM Cc1cccc(OC(=O)c2ccc(Oc3ccc(-c4nnn[n-]4)cn3)cc2)c1 ZINC000737399220 598644774 /nfs/dbraw/zinc/64/47/74/598644774.db2.gz IUKOBNDLIADHNR-UHFFFAOYSA-N -1 3 373.372 3.582 20 0 FHADHM Cc1cccc(OC(=O)c2ccc(Oc3ccc(-c4nn[n-]n4)cn3)cc2)c1 ZINC000737399220 598644776 /nfs/dbraw/zinc/64/47/76/598644776.db2.gz IUKOBNDLIADHNR-UHFFFAOYSA-N -1 3 373.372 3.582 20 0 FHADHM O=C(CCCCOc1cccc(-c2nnn[n-]2)c1)Nc1ccc(Cl)cc1 ZINC000737833119 598645433 /nfs/dbraw/zinc/64/54/33/598645433.db2.gz PCIJGVCWXABVLW-UHFFFAOYSA-N -1 3 371.828 3.708 20 0 FHADHM O=C(CCCCOc1cccc(-c2nn[n-]n2)c1)Nc1ccc(Cl)cc1 ZINC000737833119 598645435 /nfs/dbraw/zinc/64/54/35/598645435.db2.gz PCIJGVCWXABVLW-UHFFFAOYSA-N -1 3 371.828 3.708 20 0 FHADHM CC(C)CN(CC(C)C)C(=O)CCCCOc1cccc(-c2nnn[n-]2)c1 ZINC000735827633 598650819 /nfs/dbraw/zinc/65/08/19/598650819.db2.gz RZFREWYDPHOOMG-UHFFFAOYSA-N -1 3 373.501 3.556 20 0 FHADHM CC(C)CN(CC(C)C)C(=O)CCCCOc1cccc(-c2nn[n-]n2)c1 ZINC000735827633 598650820 /nfs/dbraw/zinc/65/08/20/598650820.db2.gz RZFREWYDPHOOMG-UHFFFAOYSA-N -1 3 373.501 3.556 20 0 FHADHM CC(C)(C)[C@H]1CCCC[C@@H]1NC(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000735597658 598651283 /nfs/dbraw/zinc/65/12/83/598651283.db2.gz RNOZMXQKPPUPTE-HOTGVXAUSA-N -1 3 373.526 3.680 20 0 FHADHM CC(C)(C)[C@H]1CCCC[C@@H]1NC(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000735597658 598651284 /nfs/dbraw/zinc/65/12/84/598651284.db2.gz RNOZMXQKPPUPTE-HOTGVXAUSA-N -1 3 373.526 3.680 20 0 FHADHM CN(Cc1ccc(Br)o1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736816310 598651576 /nfs/dbraw/zinc/65/15/76/598651576.db2.gz GCCXMQCLEUEMLC-UHFFFAOYSA-N -1 3 368.622 3.512 20 0 FHADHM CN(Cc1ccc(Br)o1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736816310 598651578 /nfs/dbraw/zinc/65/15/78/598651578.db2.gz GCCXMQCLEUEMLC-UHFFFAOYSA-N -1 3 368.622 3.512 20 0 FHADHM CCN(CC(C)C)C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736514474 598653053 /nfs/dbraw/zinc/65/30/53/598653053.db2.gz YWMNHYTYCFKDHZ-UHFFFAOYSA-N -1 3 365.437 3.777 20 0 FHADHM CCN(CC(C)C)C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736514474 598653055 /nfs/dbraw/zinc/65/30/55/598653055.db2.gz YWMNHYTYCFKDHZ-UHFFFAOYSA-N -1 3 365.437 3.777 20 0 FHADHM O=C(NCC1CCCC1)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000738045874 598654272 /nfs/dbraw/zinc/65/42/72/598654272.db2.gz RPZFWPCDHZIRKA-UHFFFAOYSA-N -1 3 363.421 3.579 20 0 FHADHM O=C(NCC1CCCC1)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000738045874 598654274 /nfs/dbraw/zinc/65/42/74/598654274.db2.gz RPZFWPCDHZIRKA-UHFFFAOYSA-N -1 3 363.421 3.579 20 0 FHADHM O=C(CSc1ccc(-c2nnn[n-]2)cc1)N1CCC[C@H]1C1CCCCC1 ZINC000737941930 598656289 /nfs/dbraw/zinc/65/62/89/598656289.db2.gz GUYVLFQAVJGRST-KRWDZBQOSA-N -1 3 371.510 3.530 20 0 FHADHM O=C(CSc1ccc(-c2nn[n-]n2)cc1)N1CCC[C@H]1C1CCCCC1 ZINC000737941930 598656291 /nfs/dbraw/zinc/65/62/91/598656291.db2.gz GUYVLFQAVJGRST-KRWDZBQOSA-N -1 3 371.510 3.530 20 0 FHADHM Cc1ccc(N(C(=O)CSc2ccc(-c3nnn[n-]3)cc2)C(C)C)cc1 ZINC000737347379 598658632 /nfs/dbraw/zinc/65/86/32/598658632.db2.gz OUYBYIMIANPDCP-UHFFFAOYSA-N -1 3 367.478 3.709 20 0 FHADHM Cc1ccc(N(C(=O)CSc2ccc(-c3nn[n-]n3)cc2)C(C)C)cc1 ZINC000737347379 598658633 /nfs/dbraw/zinc/65/86/33/598658633.db2.gz OUYBYIMIANPDCP-UHFFFAOYSA-N -1 3 367.478 3.709 20 0 FHADHM C[C@@H]1CCCN(C(=O)c2cccc(Oc3ccc(-c4nnn[n-]4)cc3)c2)C1 ZINC000736264473 598662707 /nfs/dbraw/zinc/66/27/07/598662707.db2.gz DQZVGSJLRBNUSC-CQSZACIVSA-N -1 3 363.421 3.531 20 0 FHADHM C[C@@H]1CCCN(C(=O)c2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)C1 ZINC000736264473 598662708 /nfs/dbraw/zinc/66/27/08/598662708.db2.gz DQZVGSJLRBNUSC-CQSZACIVSA-N -1 3 363.421 3.531 20 0 FHADHM CCCN(C(=O)CCc1ccc(-c2nnn[n-]2)cc1)c1ccc(Cl)cc1 ZINC000736471406 598667765 /nfs/dbraw/zinc/66/77/65/598667765.db2.gz VFZUOZYVBIYMNM-UHFFFAOYSA-N -1 3 369.856 3.896 20 0 FHADHM CCCN(C(=O)CCc1ccc(-c2nn[n-]n2)cc1)c1ccc(Cl)cc1 ZINC000736471406 598667767 /nfs/dbraw/zinc/66/77/67/598667767.db2.gz VFZUOZYVBIYMNM-UHFFFAOYSA-N -1 3 369.856 3.896 20 0 FHADHM Cc1cccc(NC(=O)[C@H](C)SCc2ccc(F)cc2-c2nnn[n-]2)c1 ZINC000737397842 598696454 /nfs/dbraw/zinc/69/64/54/598696454.db2.gz AMKGUZMDWQVXOJ-LBPRGKRZSA-N -1 3 371.441 3.575 20 0 FHADHM Cc1cccc(NC(=O)[C@H](C)SCc2ccc(F)cc2-c2nn[n-]n2)c1 ZINC000737397842 598696456 /nfs/dbraw/zinc/69/64/56/598696456.db2.gz AMKGUZMDWQVXOJ-LBPRGKRZSA-N -1 3 371.441 3.575 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)Nc1ccnc(-c2ccccc2)c1 ZINC000737802109 598697734 /nfs/dbraw/zinc/69/77/34/598697734.db2.gz OPFKZMHZBNRYPT-ZHACJKMWSA-N -1 3 368.400 3.581 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)Nc1ccnc(-c2ccccc2)c1 ZINC000737802109 598697736 /nfs/dbraw/zinc/69/77/36/598697736.db2.gz OPFKZMHZBNRYPT-ZHACJKMWSA-N -1 3 368.400 3.581 20 0 FHADHM Fc1cc(-c2nnn[n-]2)cc(F)c1N[C@@H](c1nccs1)c1ccccc1 ZINC000737640475 598757711 /nfs/dbraw/zinc/75/77/11/598757711.db2.gz YHTYJNAPIAKMOM-CQSZACIVSA-N -1 3 370.388 3.803 20 0 FHADHM Fc1cc(-c2nn[n-]n2)cc(F)c1N[C@@H](c1nccs1)c1ccccc1 ZINC000737640475 598757712 /nfs/dbraw/zinc/75/77/12/598757712.db2.gz YHTYJNAPIAKMOM-CQSZACIVSA-N -1 3 370.388 3.803 20 0 FHADHM Fc1cc(-c2nnn[n-]2)cc(F)c1N[C@H](c1nccs1)c1ccccc1 ZINC000737640474 598757754 /nfs/dbraw/zinc/75/77/54/598757754.db2.gz YHTYJNAPIAKMOM-AWEZNQCLSA-N -1 3 370.388 3.803 20 0 FHADHM Fc1cc(-c2nn[n-]n2)cc(F)c1N[C@H](c1nccs1)c1ccccc1 ZINC000737640474 598757756 /nfs/dbraw/zinc/75/77/56/598757756.db2.gz YHTYJNAPIAKMOM-AWEZNQCLSA-N -1 3 370.388 3.803 20 0 FHADHM C[C@H](Sc1cc(-c2nnn[n-]2)ccn1)c1ccc(Br)cc1 ZINC000736191437 598761754 /nfs/dbraw/zinc/76/17/54/598761754.db2.gz IQUFTNHJNAQQCT-VIFPVBQESA-N -1 3 362.256 3.878 20 0 FHADHM C[C@H](Sc1cc(-c2nn[n-]n2)ccn1)c1ccc(Br)cc1 ZINC000736191437 598761755 /nfs/dbraw/zinc/76/17/55/598761755.db2.gz IQUFTNHJNAQQCT-VIFPVBQESA-N -1 3 362.256 3.878 20 0 FHADHM C[C@H](SC1CCCCC1)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736189586 598762279 /nfs/dbraw/zinc/76/22/79/598762279.db2.gz PZPGLGJWCAHKIH-JTQLQIEISA-N -1 3 365.890 3.913 20 0 FHADHM C[C@H](SC1CCCCC1)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736189586 598762281 /nfs/dbraw/zinc/76/22/81/598762281.db2.gz PZPGLGJWCAHKIH-JTQLQIEISA-N -1 3 365.890 3.913 20 0 FHADHM CC[C@H](Cc1ccccc1)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736354586 598763008 /nfs/dbraw/zinc/76/30/08/598763008.db2.gz USLWQHWWPNQWIE-CYBMUJFWSA-N -1 3 355.829 3.728 20 0 FHADHM CC[C@H](Cc1ccccc1)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736354586 598763009 /nfs/dbraw/zinc/76/30/09/598763009.db2.gz USLWQHWWPNQWIE-CYBMUJFWSA-N -1 3 355.829 3.728 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1N1CCC[C@H]1CCc1ccccc1 ZINC000737560751 598771885 /nfs/dbraw/zinc/77/18/85/598771885.db2.gz BVKKLHBUTZJIGW-HNNXBMFYSA-N -1 3 354.845 3.517 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1N1CCC[C@H]1CCc1ccccc1 ZINC000737560751 598771886 /nfs/dbraw/zinc/77/18/86/598771886.db2.gz BVKKLHBUTZJIGW-HNNXBMFYSA-N -1 3 354.845 3.517 20 0 FHADHM CC(C)(C(=O)OCc1cccc(-c2nnn[n-]2)c1)c1ccccc1Cl ZINC000735582984 598778626 /nfs/dbraw/zinc/77/86/26/598778626.db2.gz QWOIXDZHOJLLCY-UHFFFAOYSA-N -1 3 356.813 3.541 20 0 FHADHM CC(C)(C(=O)OCc1cccc(-c2nn[n-]n2)c1)c1ccccc1Cl ZINC000735582984 598778628 /nfs/dbraw/zinc/77/86/28/598778628.db2.gz QWOIXDZHOJLLCY-UHFFFAOYSA-N -1 3 356.813 3.541 20 0 FHADHM CC(C)[C@H](c1ccccc1)N(C)C(=S)Nc1ccccc1-c1nnn[n-]1 ZINC000735735946 598789612 /nfs/dbraw/zinc/78/96/12/598789612.db2.gz QVUYMFTXHSKXMG-QGZVFWFLSA-N -1 3 366.494 3.893 20 0 FHADHM CC(C)[C@H](c1ccccc1)N(C)C(=S)Nc1ccccc1-c1nn[n-]n1 ZINC000735735946 598789614 /nfs/dbraw/zinc/78/96/14/598789614.db2.gz QVUYMFTXHSKXMG-QGZVFWFLSA-N -1 3 366.494 3.893 20 0 FHADHM CCN(C(=O)[C@H]1CCc2ccccc21)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736503418 598790240 /nfs/dbraw/zinc/79/02/40/598790240.db2.gz WHZRGVMMKUCJQV-KUHUBIRLSA-N -1 3 361.449 3.506 20 0 FHADHM CCN(C(=O)[C@H]1CCc2ccccc21)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736503418 598790242 /nfs/dbraw/zinc/79/02/42/598790242.db2.gz WHZRGVMMKUCJQV-KUHUBIRLSA-N -1 3 361.449 3.506 20 0 FHADHM Clc1ccc(NCc2cccc(Br)c2)c(-c2nnn[n-]2)c1 ZINC000737574859 598794769 /nfs/dbraw/zinc/79/47/69/598794769.db2.gz RATGUTIDMRHBNU-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM Clc1ccc(NCc2cccc(Br)c2)c(-c2nn[n-]n2)c1 ZINC000737574859 598794770 /nfs/dbraw/zinc/79/47/70/598794770.db2.gz RATGUTIDMRHBNU-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM CC(C)[C@@H](c1ccccc1)N(C)C(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000735736316 598798023 /nfs/dbraw/zinc/79/80/23/598798023.db2.gz RXUFPJXCAWILDY-KRWDZBQOSA-N -1 3 350.426 3.728 20 0 FHADHM CC(C)[C@@H](c1ccccc1)N(C)C(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000735736316 598798025 /nfs/dbraw/zinc/79/80/25/598798025.db2.gz RXUFPJXCAWILDY-KRWDZBQOSA-N -1 3 350.426 3.728 20 0 FHADHM CC[C@H](OC1CCCC1)C(=O)N(CC)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736380641 598802551 /nfs/dbraw/zinc/80/25/51/598802551.db2.gz XNSYTLYJNINDIM-KDOFPFPSSA-N -1 3 371.485 3.514 20 0 FHADHM CC[C@H](OC1CCCC1)C(=O)N(CC)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736380641 598802552 /nfs/dbraw/zinc/80/25/52/598802552.db2.gz XNSYTLYJNINDIM-KDOFPFPSSA-N -1 3 371.485 3.514 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)N(C1CC1)[C@@H]1CCCc2ccccc21 ZINC000738152473 598813265 /nfs/dbraw/zinc/81/32/65/598813265.db2.gz UYWOXZNLEAVKHA-LJQANCHMSA-N -1 3 374.448 3.941 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)N(C1CC1)[C@@H]1CCCc2ccccc21 ZINC000738152473 598813266 /nfs/dbraw/zinc/81/32/66/598813266.db2.gz UYWOXZNLEAVKHA-LJQANCHMSA-N -1 3 374.448 3.941 20 0 FHADHM O=C(C=Cc1ccco1)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737805332 598821560 /nfs/dbraw/zinc/82/15/60/598821560.db2.gz HJBDUSYGZFPMAT-KHPPLWFESA-N -1 3 373.372 3.904 20 0 FHADHM O=C(C=Cc1ccco1)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737805332 598821562 /nfs/dbraw/zinc/82/15/62/598821562.db2.gz HJBDUSYGZFPMAT-KHPPLWFESA-N -1 3 373.372 3.904 20 0 FHADHM CCCN(CCC)C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000821099337 599294798 /nfs/dbraw/zinc/29/47/98/599294798.db2.gz DWXDQTSUFQIKQR-UHFFFAOYSA-N -1 3 356.352 3.539 20 0 FHADHM CCCN(CCC)C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000821099337 599294800 /nfs/dbraw/zinc/29/48/00/599294800.db2.gz DWXDQTSUFQIKQR-UHFFFAOYSA-N -1 3 356.352 3.539 20 0 FHADHM CN(C(=O)c1cccc(Nc2ccccc2)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000736740824 599302777 /nfs/dbraw/zinc/30/27/77/599302777.db2.gz GICSJUGDFBQEFT-UHFFFAOYSA-N -1 3 370.416 3.887 20 0 FHADHM CN(C(=O)c1cccc(Nc2ccccc2)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000736740824 599302780 /nfs/dbraw/zinc/30/27/80/599302780.db2.gz GICSJUGDFBQEFT-UHFFFAOYSA-N -1 3 370.416 3.887 20 0 FHADHM CN(C(=O)c1cc2cc(Cl)ccc2o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736750460 599305247 /nfs/dbraw/zinc/30/52/47/599305247.db2.gz YFFHXXGLURTBKT-UHFFFAOYSA-N -1 3 353.769 3.543 20 0 FHADHM CN(C(=O)c1cc2cc(Cl)ccc2o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736750460 599305249 /nfs/dbraw/zinc/30/52/49/599305249.db2.gz YFFHXXGLURTBKT-UHFFFAOYSA-N -1 3 353.769 3.543 20 0 FHADHM CCN(C(=O)c1cccc(C(F)(F)F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736507936 599310015 /nfs/dbraw/zinc/31/00/15/599310015.db2.gz HCVXIWYTBUEMOC-UHFFFAOYSA-N -1 3 361.327 3.552 20 0 FHADHM CCN(C(=O)c1cccc(C(F)(F)F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736507936 599310018 /nfs/dbraw/zinc/31/00/18/599310018.db2.gz HCVXIWYTBUEMOC-UHFFFAOYSA-N -1 3 361.327 3.552 20 0 FHADHM CCN(C(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736501301 599310936 /nfs/dbraw/zinc/31/09/36/599310936.db2.gz CIDYTXCACBKMGU-QWHCGFSZSA-N -1 3 367.375 3.588 20 0 FHADHM CCN(C(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736501301 599310939 /nfs/dbraw/zinc/31/09/39/599310939.db2.gz CIDYTXCACBKMGU-QWHCGFSZSA-N -1 3 367.375 3.588 20 0 FHADHM CCOc1ccc(OCC)c(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736650692 599324160 /nfs/dbraw/zinc/32/41/60/599324160.db2.gz HPKNPTBSNLQWFZ-ZDUSSCGKSA-N -1 3 353.426 3.837 20 0 FHADHM CCOc1ccc(OCC)c(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736650692 599324162 /nfs/dbraw/zinc/32/41/62/599324162.db2.gz HPKNPTBSNLQWFZ-ZDUSSCGKSA-N -1 3 353.426 3.837 20 0 FHADHM Clc1ccc(NCCOc2cccc(-c3nnn[n-]3)c2)cc1Cl ZINC000737573482 599324210 /nfs/dbraw/zinc/32/42/10/599324210.db2.gz IMLJWWUAFXCFMF-UHFFFAOYSA-N -1 3 350.209 3.664 20 0 FHADHM Clc1ccc(NCCOc2cccc(-c3nn[n-]n3)c2)cc1Cl ZINC000737573482 599324213 /nfs/dbraw/zinc/32/42/13/599324213.db2.gz IMLJWWUAFXCFMF-UHFFFAOYSA-N -1 3 350.209 3.664 20 0 FHADHM COc1cc(OC)c(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1Cl ZINC000737052017 599324476 /nfs/dbraw/zinc/32/44/76/599324476.db2.gz PCPJPGBAVIHZNF-JTQLQIEISA-N -1 3 359.817 3.710 20 0 FHADHM COc1cc(OC)c(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1Cl ZINC000737052017 599324478 /nfs/dbraw/zinc/32/44/78/599324478.db2.gz PCPJPGBAVIHZNF-JTQLQIEISA-N -1 3 359.817 3.710 20 0 FHADHM C[C@H](SCCOCCOc1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736189266 599326299 /nfs/dbraw/zinc/32/62/99/599326299.db2.gz OTJSJNKMBOMRSC-HNNXBMFYSA-N -1 3 370.478 3.757 20 0 FHADHM C[C@H](SCCOCCOc1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736189266 599326300 /nfs/dbraw/zinc/32/63/00/599326300.db2.gz OTJSJNKMBOMRSC-HNNXBMFYSA-N -1 3 370.478 3.757 20 0 FHADHM C[C@H](S[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)C(=O)Nc1ccccc1 ZINC000736188005 599327575 /nfs/dbraw/zinc/32/75/75/599327575.db2.gz GIYSBZQJOCOVOI-STQMWFEESA-N -1 3 353.451 3.688 20 0 FHADHM C[C@H](S[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)C(=O)Nc1ccccc1 ZINC000736188005 599327577 /nfs/dbraw/zinc/32/75/77/599327577.db2.gz GIYSBZQJOCOVOI-STQMWFEESA-N -1 3 353.451 3.688 20 0 FHADHM Cc1cc(C)c(-c2nnn[n-]2)c(NCCOc2ccc3ccccc3c2)n1 ZINC000822193312 599328188 /nfs/dbraw/zinc/32/81/88/599328188.db2.gz RWFMODRZVPBIPQ-UHFFFAOYSA-N -1 3 360.421 3.523 20 0 FHADHM Cc1cc(C)c(-c2nn[n-]n2)c(NCCOc2ccc3ccccc3c2)n1 ZINC000822193312 599328189 /nfs/dbraw/zinc/32/81/89/599328189.db2.gz RWFMODRZVPBIPQ-UHFFFAOYSA-N -1 3 360.421 3.523 20 0 FHADHM CCc1ccc(NC(=O)CS[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000736692830 599328389 /nfs/dbraw/zinc/32/83/89/599328389.db2.gz ZFDSUXMCOCRHHN-CYBMUJFWSA-N -1 3 367.478 3.862 20 0 FHADHM CCc1ccc(NC(=O)CS[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000736692830 599328391 /nfs/dbraw/zinc/32/83/91/599328391.db2.gz ZFDSUXMCOCRHHN-CYBMUJFWSA-N -1 3 367.478 3.862 20 0 FHADHM CSc1ccc(Cl)cc1NCCOc1cccc(-c2nnn[n-]2)c1 ZINC000737192356 599328502 /nfs/dbraw/zinc/32/85/02/599328502.db2.gz XNMGFAPMXZMEII-UHFFFAOYSA-N -1 3 361.858 3.733 20 0 FHADHM CSc1ccc(Cl)cc1NCCOc1cccc(-c2nn[n-]n2)c1 ZINC000737192356 599328503 /nfs/dbraw/zinc/32/85/03/599328503.db2.gz XNMGFAPMXZMEII-UHFFFAOYSA-N -1 3 361.858 3.733 20 0 FHADHM Fc1ccc(NCc2cccc(OCC(F)(F)F)c2)cc1-c1nnn[n-]1 ZINC000737657556 599331193 /nfs/dbraw/zinc/33/11/93/599331193.db2.gz XADBOLRYFMNNSH-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM Fc1ccc(NCc2cccc(OCC(F)(F)F)c2)cc1-c1nn[n-]n1 ZINC000737657556 599331195 /nfs/dbraw/zinc/33/11/95/599331195.db2.gz XADBOLRYFMNNSH-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM Cc1ccc(NC(=O)CS[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1C ZINC000737357646 599332083 /nfs/dbraw/zinc/33/20/83/599332083.db2.gz QKDQKQQMRWRKQG-AWEZNQCLSA-N -1 3 367.478 3.916 20 0 FHADHM Cc1ccc(NC(=O)CS[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1C ZINC000737357646 599332087 /nfs/dbraw/zinc/33/20/87/599332087.db2.gz QKDQKQQMRWRKQG-AWEZNQCLSA-N -1 3 367.478 3.916 20 0 FHADHM Cc1ccc(NC(=O)CS[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c(F)c1 ZINC000737356593 599332169 /nfs/dbraw/zinc/33/21/69/599332169.db2.gz HWAYFAIIZUIFHP-LBPRGKRZSA-N -1 3 371.441 3.747 20 0 FHADHM Cc1ccc(NC(=O)CS[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c(F)c1 ZINC000737356593 599332170 /nfs/dbraw/zinc/33/21/70/599332170.db2.gz HWAYFAIIZUIFHP-LBPRGKRZSA-N -1 3 371.441 3.747 20 0 FHADHM Brc1cc(CSc2ccccc2-c2nnn[n-]2)cs1 ZINC000819688948 599349125 /nfs/dbraw/zinc/34/91/25/599349125.db2.gz RGZMQFHOZLTPRC-UHFFFAOYSA-N -1 3 353.270 3.983 20 0 FHADHM Brc1cc(CSc2ccccc2-c2nn[n-]n2)cs1 ZINC000819688948 599349128 /nfs/dbraw/zinc/34/91/28/599349128.db2.gz RGZMQFHOZLTPRC-UHFFFAOYSA-N -1 3 353.270 3.983 20 0 FHADHM CCN(C(=O)Nc1ccc(F)c(F)c1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736505713 599352074 /nfs/dbraw/zinc/35/20/74/599352074.db2.gz KXZWQCKDTISIBO-NSHDSACASA-N -1 3 372.379 3.760 20 0 FHADHM CCN(C(=O)Nc1ccc(F)c(F)c1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736505713 599352079 /nfs/dbraw/zinc/35/20/79/599352079.db2.gz KXZWQCKDTISIBO-NSHDSACASA-N -1 3 372.379 3.760 20 0 FHADHM CCN(C(=O)Nc1ccccc1C)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736504599 599352328 /nfs/dbraw/zinc/35/23/28/599352328.db2.gz BWZIPCHVFWMPHW-AWEZNQCLSA-N -1 3 350.426 3.790 20 0 FHADHM CCN(C(=O)Nc1ccccc1C)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736504599 599352331 /nfs/dbraw/zinc/35/23/31/599352331.db2.gz BWZIPCHVFWMPHW-AWEZNQCLSA-N -1 3 350.426 3.790 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1CNc1ccccc1CC(F)(F)F ZINC000821736183 607371268 /nfs/dbraw/zinc/37/12/68/607371268.db2.gz FJQFCTBSWOVDSG-UHFFFAOYSA-N -1 3 363.343 3.592 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CNc1ccccc1CC(F)(F)F ZINC000821736183 607371269 /nfs/dbraw/zinc/37/12/69/607371269.db2.gz FJQFCTBSWOVDSG-UHFFFAOYSA-N -1 3 363.343 3.592 20 0 FHADHM CC(C)C(=O)Nc1cccc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000820010775 599363481 /nfs/dbraw/zinc/36/34/81/599363481.db2.gz DUBZEIJYSMAIDP-ZDUSSCGKSA-N -1 3 350.426 3.634 20 0 FHADHM CC(C)C(=O)Nc1cccc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000820010775 599363482 /nfs/dbraw/zinc/36/34/82/599363482.db2.gz DUBZEIJYSMAIDP-ZDUSSCGKSA-N -1 3 350.426 3.634 20 0 FHADHM C[C@H](c1ncc(-c2ccccc2)o1)N(C)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000736200620 599363498 /nfs/dbraw/zinc/36/34/98/599363498.db2.gz AKWTXGBCYWOHKA-CQSZACIVSA-N -1 3 360.421 3.715 20 0 FHADHM C[C@H](Nc1ccc(OCC(F)(F)F)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820455772 599365172 /nfs/dbraw/zinc/36/51/72/599365172.db2.gz NDJOXJTZIZVQJY-NSHDSACASA-N -1 3 363.343 3.981 20 0 FHADHM C[C@H](Nc1ccc(OCC(F)(F)F)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820455772 599365173 /nfs/dbraw/zinc/36/51/73/599365173.db2.gz NDJOXJTZIZVQJY-NSHDSACASA-N -1 3 363.343 3.981 20 0 FHADHM C[C@H](N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ncc(-c2ccccc2)o1 ZINC000820414560 599366680 /nfs/dbraw/zinc/36/66/80/599366680.db2.gz ZFDIDDSRTZNANI-KBPBESRZSA-N -1 3 360.421 3.934 20 0 FHADHM COC[C@H](C)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)c(Cl)c1 ZINC000821682520 599373992 /nfs/dbraw/zinc/37/39/92/599373992.db2.gz HQTTXOYILREDSV-LBPRGKRZSA-N -1 3 373.844 3.546 20 0 FHADHM COC[C@H](C)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)c(Cl)c1 ZINC000821682520 599373994 /nfs/dbraw/zinc/37/39/94/599373994.db2.gz HQTTXOYILREDSV-LBPRGKRZSA-N -1 3 373.844 3.546 20 0 FHADHM CCc1nnc([C@@H](C)Oc2ccc(-c3ccc(-c4nnn[n-]4)cc3)cc2)o1 ZINC000821518555 599381523 /nfs/dbraw/zinc/38/15/23/599381523.db2.gz ZMBJNOQTTUBQCI-GFCCVEGCSA-N -1 3 362.393 3.619 20 0 FHADHM CCc1nnc([C@@H](C)Oc2ccc(-c3ccc(-c4nn[n-]n4)cc3)cc2)o1 ZINC000821518555 599381525 /nfs/dbraw/zinc/38/15/25/599381525.db2.gz ZMBJNOQTTUBQCI-GFCCVEGCSA-N -1 3 362.393 3.619 20 0 FHADHM CC(C)c1cccc(OCc2nnc(-c3ccc(-c4nnn[n-]4)cc3)o2)c1 ZINC000820197966 599381618 /nfs/dbraw/zinc/38/16/18/599381618.db2.gz PVPAPXXOOOHOPI-UHFFFAOYSA-N -1 3 362.393 3.619 20 0 FHADHM CC(C)c1cccc(OCc2nnc(-c3ccc(-c4nn[n-]n4)cc3)o2)c1 ZINC000820197966 599381621 /nfs/dbraw/zinc/38/16/21/599381621.db2.gz PVPAPXXOOOHOPI-UHFFFAOYSA-N -1 3 362.393 3.619 20 0 FHADHM C[C@@H](N[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1ncc(-c2ccccc2)o1 ZINC000820410074 599391443 /nfs/dbraw/zinc/39/14/43/599391443.db2.gz CQBBJUCARLFYCY-ZIAGYGMSSA-N -1 3 360.421 3.934 20 0 FHADHM Fc1ccc([C@H](NCc2ccc(-c3nnn[n-]3)o2)c2cccs2)cc1 ZINC000822766344 599396853 /nfs/dbraw/zinc/39/68/53/599396853.db2.gz HVNIFCVUOYMXNZ-INIZCTEOSA-N -1 3 355.398 3.540 20 0 FHADHM Fc1ccc([C@H](NCc2ccc(-c3nn[n-]n3)o2)c2cccs2)cc1 ZINC000822766344 599396856 /nfs/dbraw/zinc/39/68/56/599396856.db2.gz HVNIFCVUOYMXNZ-INIZCTEOSA-N -1 3 355.398 3.540 20 0 FHADHM COc1ccc(C)cc1[C@H](C)Nc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000737073542 599397289 /nfs/dbraw/zinc/39/72/89/599397289.db2.gz DJFLPBIARPETLN-ZDUSSCGKSA-N -1 3 360.421 3.905 20 0 FHADHM COc1ccc(C)cc1[C@H](C)Nc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000737073542 599397292 /nfs/dbraw/zinc/39/72/92/599397292.db2.gz DJFLPBIARPETLN-ZDUSSCGKSA-N -1 3 360.421 3.905 20 0 FHADHM C[C@@H](OCCCNc1cc(-c2nnn[n-]2)c2ccccc2n1)c1ccccc1 ZINC000736163274 599399135 /nfs/dbraw/zinc/39/91/35/599399135.db2.gz HPKCARICWMROJX-OAHLLOKOSA-N -1 3 374.448 3.995 20 0 FHADHM C[C@@H](OCCCNc1cc(-c2nn[n-]n2)c2ccccc2n1)c1ccccc1 ZINC000736163274 599399139 /nfs/dbraw/zinc/39/91/39/599399139.db2.gz HPKCARICWMROJX-OAHLLOKOSA-N -1 3 374.448 3.995 20 0 FHADHM CCc1ccc([C@@H](C)NC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000821483081 599401571 /nfs/dbraw/zinc/40/15/71/599401571.db2.gz WZYNFJJXXMATNS-ZIAGYGMSSA-N -1 3 364.453 3.551 20 0 FHADHM CCc1ccc([C@@H](C)NC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000821483081 599401574 /nfs/dbraw/zinc/40/15/74/599401574.db2.gz WZYNFJJXXMATNS-ZIAGYGMSSA-N -1 3 364.453 3.551 20 0 FHADHM Cc1cc([C@@H](C)NC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c(C)s1 ZINC000822191343 599407783 /nfs/dbraw/zinc/40/77/83/599407783.db2.gz IUPUYKTUNVJJLL-NWDGAFQWSA-N -1 3 370.482 3.666 20 0 FHADHM Cc1cc([C@@H](C)NC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c(C)s1 ZINC000822191343 599407785 /nfs/dbraw/zinc/40/77/85/599407785.db2.gz IUPUYKTUNVJJLL-NWDGAFQWSA-N -1 3 370.482 3.666 20 0 FHADHM Cc1ccccc1[C@H]1CCN(c2cc(-c3nnn[n-]3)c3ccccc3n2)C1 ZINC000737422982 599424984 /nfs/dbraw/zinc/42/49/84/599424984.db2.gz OZVMWMCREAZSGT-HNNXBMFYSA-N -1 3 356.433 3.717 20 0 FHADHM Cc1ccccc1[C@H]1CCN(c2cc(-c3nn[n-]n3)c3ccccc3n2)C1 ZINC000737422982 599424986 /nfs/dbraw/zinc/42/49/86/599424986.db2.gz OZVMWMCREAZSGT-HNNXBMFYSA-N -1 3 356.433 3.717 20 0 FHADHM COc1ccc(COCCCNc2cc(Cl)ccc2-c2nnn[n-]2)cc1 ZINC000737097427 599427229 /nfs/dbraw/zinc/42/72/29/599427229.db2.gz JHKGXBTZKYCKCX-UHFFFAOYSA-N -1 3 373.844 3.548 20 0 FHADHM COc1ccc(COCCCNc2cc(Cl)ccc2-c2nn[n-]n2)cc1 ZINC000737097427 599427231 /nfs/dbraw/zinc/42/72/31/599427231.db2.gz JHKGXBTZKYCKCX-UHFFFAOYSA-N -1 3 373.844 3.548 20 0 FHADHM Fc1cccc([C@H]2CCN(c3cc(-c4nnn[n-]4)c4ccccc4n3)C2)c1 ZINC000737666585 599430641 /nfs/dbraw/zinc/43/06/41/599430641.db2.gz MWQSOWXNWUUNLF-AWEZNQCLSA-N -1 3 360.396 3.548 20 0 FHADHM Fc1cccc([C@H]2CCN(c3cc(-c4nn[n-]n4)c4ccccc4n3)C2)c1 ZINC000737666585 599430643 /nfs/dbraw/zinc/43/06/43/599430643.db2.gz MWQSOWXNWUUNLF-AWEZNQCLSA-N -1 3 360.396 3.548 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CSc1nc(C)c(C)n1CC(C)C ZINC000821752103 607377547 /nfs/dbraw/zinc/37/75/47/607377547.db2.gz GRYNYZQRMQQCBE-UHFFFAOYSA-N -1 3 372.498 3.637 20 0 FHADHM CCS[C@@H]1CCCCN(c2cc(-c3nnn[n-]3)c3ccccc3n2)C1 ZINC000736664428 599436094 /nfs/dbraw/zinc/43/60/94/599436094.db2.gz KYPILUFZOBSPHN-CYBMUJFWSA-N -1 3 354.483 3.527 20 0 FHADHM CCS[C@@H]1CCCCN(c2cc(-c3nn[n-]n3)c3ccccc3n2)C1 ZINC000736664428 599436097 /nfs/dbraw/zinc/43/60/97/599436097.db2.gz KYPILUFZOBSPHN-CYBMUJFWSA-N -1 3 354.483 3.527 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@H](C)C[C@@H](C)CC ZINC000821104429 599458780 /nfs/dbraw/zinc/45/87/80/599458780.db2.gz CQCZUTCLHFDVPZ-LSDHHAIUSA-N -1 3 358.490 3.613 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@H](C)C[C@@H](C)CC ZINC000821104429 599458781 /nfs/dbraw/zinc/45/87/81/599458781.db2.gz CQCZUTCLHFDVPZ-LSDHHAIUSA-N -1 3 358.490 3.613 20 0 FHADHM Cc1ccc(C(C)C)c(OCCC(=O)Nc2sccc2-c2nnn[n-]2)c1 ZINC000737317832 599464213 /nfs/dbraw/zinc/46/42/13/599464213.db2.gz OFSLSTIOZKRIRX-UHFFFAOYSA-N -1 3 371.466 3.768 20 0 FHADHM Cc1ccc(C(C)C)c(OCCC(=O)Nc2sccc2-c2nn[n-]n2)c1 ZINC000737317832 599464214 /nfs/dbraw/zinc/46/42/14/599464214.db2.gz OFSLSTIOZKRIRX-UHFFFAOYSA-N -1 3 371.466 3.768 20 0 FHADHM C[C@H]1C[C@@H](c2ccc(F)cc2)CN1c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000736234388 599472153 /nfs/dbraw/zinc/47/21/53/599472153.db2.gz IVEVVFSGAVOIEV-GXFFZTMASA-N -1 3 359.355 3.666 20 0 FHADHM C[C@H]1C[C@@H](c2ccc(F)cc2)CN1c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000736234388 599472155 /nfs/dbraw/zinc/47/21/55/599472155.db2.gz IVEVVFSGAVOIEV-GXFFZTMASA-N -1 3 359.355 3.666 20 0 FHADHM CC[C@@H](C)C(=O)Nc1cccc(CNc2ccc(F)cc2-c2nnn[n-]2)c1 ZINC000820861915 599479970 /nfs/dbraw/zinc/47/99/70/599479970.db2.gz ONECKLZNJINYMM-GFCCVEGCSA-N -1 3 368.416 3.603 20 0 FHADHM CC[C@@H](C)C(=O)Nc1cccc(CNc2ccc(F)cc2-c2nn[n-]n2)c1 ZINC000820861915 599479972 /nfs/dbraw/zinc/47/99/72/599479972.db2.gz ONECKLZNJINYMM-GFCCVEGCSA-N -1 3 368.416 3.603 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1NCc1ccc(OC2CCCC2)nc1 ZINC000822585665 599483453 /nfs/dbraw/zinc/48/34/53/599483453.db2.gz JWDSEJOJZZEACZ-UHFFFAOYSA-N -1 3 370.844 3.849 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1NCc1ccc(OC2CCCC2)nc1 ZINC000822585665 599483456 /nfs/dbraw/zinc/48/34/56/599483456.db2.gz JWDSEJOJZZEACZ-UHFFFAOYSA-N -1 3 370.844 3.849 20 0 FHADHM Cc1ccc(C)c(OC2CCN(c3ccc(F)cc3-c3nnn[n-]3)CC2)c1 ZINC000822231842 599493337 /nfs/dbraw/zinc/49/33/37/599493337.db2.gz JFTGZBTWNWLPIC-UHFFFAOYSA-N -1 3 367.428 3.670 20 0 FHADHM Cc1ccc(C)c(OC2CCN(c3ccc(F)cc3-c3nn[n-]n3)CC2)c1 ZINC000822231842 599493339 /nfs/dbraw/zinc/49/33/39/599493339.db2.gz JFTGZBTWNWLPIC-UHFFFAOYSA-N -1 3 367.428 3.670 20 0 FHADHM C[C@@H](NC(=O)c1cc2sccc2s1)c1cccc(-c2nnn[n-]2)c1 ZINC000820391768 599501442 /nfs/dbraw/zinc/50/14/42/599501442.db2.gz QJKVKZCEPKQFHM-SECBINFHSA-N -1 3 355.448 3.634 20 0 FHADHM C[C@@H](NC(=O)c1cc2sccc2s1)c1cccc(-c2nn[n-]n2)c1 ZINC000820391768 599501445 /nfs/dbraw/zinc/50/14/45/599501445.db2.gz QJKVKZCEPKQFHM-SECBINFHSA-N -1 3 355.448 3.634 20 0 FHADHM Cc1nc([C@@H]2CCCN(c3cc(Cl)ccc3-c3nn[n-]n3)C2)sc1C ZINC000822435784 599509131 /nfs/dbraw/zinc/50/91/31/599509131.db2.gz BCMXMISQGYSPCN-GFCCVEGCSA-N -1 3 374.901 3.977 20 0 FHADHM Cc1nc([C@@H]2CCCN(c3cc(Cl)ccc3-c3nnn[n-]3)C2)sc1C ZINC000822435784 599509129 /nfs/dbraw/zinc/50/91/29/599509129.db2.gz BCMXMISQGYSPCN-GFCCVEGCSA-N -1 3 374.901 3.977 20 0 FHADHM Cc1nc([C@@H]2CCCN(c3c(Cl)cccc3-c3nnn[n-]3)C2)sc1C ZINC000822436755 599509350 /nfs/dbraw/zinc/50/93/50/599509350.db2.gz QJTFRLLQPPTSTD-GFCCVEGCSA-N -1 3 374.901 3.977 20 0 FHADHM Cc1nc([C@@H]2CCCN(c3c(Cl)cccc3-c3nn[n-]n3)C2)sc1C ZINC000822436755 599509351 /nfs/dbraw/zinc/50/93/51/599509351.db2.gz QJTFRLLQPPTSTD-GFCCVEGCSA-N -1 3 374.901 3.977 20 0 FHADHM Fc1ccc(N2CCc3c(ccc(Cl)c3Cl)C2)c(-c2nnn[n-]2)c1 ZINC000822778757 599517504 /nfs/dbraw/zinc/51/75/04/599517504.db2.gz NVSJQELSTUKPRO-UHFFFAOYSA-N -1 3 364.211 3.875 20 0 FHADHM Fc1ccc(N2CCc3c(ccc(Cl)c3Cl)C2)c(-c2nn[n-]n2)c1 ZINC000822778757 599517505 /nfs/dbraw/zinc/51/75/05/599517505.db2.gz NVSJQELSTUKPRO-UHFFFAOYSA-N -1 3 364.211 3.875 20 0 FHADHM CC(=CC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1Cl ZINC000819764144 599520143 /nfs/dbraw/zinc/52/01/43/599520143.db2.gz FWKCPFCTARKSIX-KXXVWKPMSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=CC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1Cl ZINC000819764144 599520145 /nfs/dbraw/zinc/52/01/45/599520145.db2.gz FWKCPFCTARKSIX-KXXVWKPMSA-N -1 3 367.840 3.801 20 0 FHADHM FC(F)(F)c1cc(-c2nn[n-]n2)ccc1N1CC[C@H](c2ccccc2)C1 ZINC000737628567 599523517 /nfs/dbraw/zinc/52/35/17/599523517.db2.gz XNBUHNUPYUYWJN-AWEZNQCLSA-N -1 3 359.355 3.879 20 0 FHADHM CCCO[C@H]1CCCN(c2ccc(-c3nn[n-]n3)cc2C(F)(F)F)CC1 ZINC000736488571 599524614 /nfs/dbraw/zinc/52/46/14/599524614.db2.gz PBZSCGMFHILTIM-ZDUSSCGKSA-N -1 3 369.391 3.671 20 0 FHADHM Cc1ccc(CN(C)c2c(-c3nnn[n-]3)cnc3c(C)cc(F)cc32)s1 ZINC000822237370 599524717 /nfs/dbraw/zinc/52/47/17/599524717.db2.gz QQIJOVBQBDXKIP-UHFFFAOYSA-N -1 3 368.441 3.869 20 0 FHADHM Cc1ccc(CN(C)c2c(-c3nn[n-]n3)cnc3c(C)cc(F)cc32)s1 ZINC000822237370 599524719 /nfs/dbraw/zinc/52/47/19/599524719.db2.gz QQIJOVBQBDXKIP-UHFFFAOYSA-N -1 3 368.441 3.869 20 0 FHADHM C[C@@H](NC(=O)c1cccc(Cl)c1Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000820397125 599526050 /nfs/dbraw/zinc/52/60/50/599526050.db2.gz MCNIIZCZVJRIEY-SECBINFHSA-N -1 3 362.220 3.665 20 0 FHADHM C[C@@H](NC(=O)c1cccc(Cl)c1Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000820397125 599526051 /nfs/dbraw/zinc/52/60/51/599526051.db2.gz MCNIIZCZVJRIEY-SECBINFHSA-N -1 3 362.220 3.665 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CC[C@H](C)C2)c1cccs1 ZINC000736280331 599538798 /nfs/dbraw/zinc/53/87/98/599538798.db2.gz QFDQNMKNXQTZLQ-VHSXEESVSA-N -1 3 373.507 3.857 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CC[C@H](C)C2)c1cccs1 ZINC000736280331 599538803 /nfs/dbraw/zinc/53/88/03/599538803.db2.gz QFDQNMKNXQTZLQ-VHSXEESVSA-N -1 3 373.507 3.857 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CC[C@@H](C)C2)c1cccs1 ZINC000736280328 599539180 /nfs/dbraw/zinc/53/91/80/599539180.db2.gz QFDQNMKNXQTZLQ-NXEZZACHSA-N -1 3 373.507 3.857 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CC[C@@H](C)C2)c1cccs1 ZINC000736280328 599539182 /nfs/dbraw/zinc/53/91/82/599539182.db2.gz QFDQNMKNXQTZLQ-NXEZZACHSA-N -1 3 373.507 3.857 20 0 FHADHM CCOc1cc(CNc2c(Cl)cccc2-c2nnn[n-]2)ccc1OC ZINC000821394099 599557819 /nfs/dbraw/zinc/55/78/19/599557819.db2.gz GEZJTBPTFHBVGY-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM CCOc1cc(CNc2c(Cl)cccc2-c2nn[n-]n2)ccc1OC ZINC000821394099 599557821 /nfs/dbraw/zinc/55/78/21/599557821.db2.gz GEZJTBPTFHBVGY-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM Cc1ccc([C@@H]2[C@H](C)CCCN2C(=O)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000737332974 599558553 /nfs/dbraw/zinc/55/85/53/599558553.db2.gz ZGZCIOYLOVBFBB-BEFAXECRSA-N -1 3 361.449 3.789 20 0 FHADHM Cc1ccc([C@@H]2[C@H](C)CCCN2C(=O)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000737332974 599558555 /nfs/dbraw/zinc/55/85/55/599558555.db2.gz ZGZCIOYLOVBFBB-BEFAXECRSA-N -1 3 361.449 3.789 20 0 FHADHM Cc1ccc(NC(=O)c2cccc(Nc3ccc(-c4nn[n-]n4)cc3)c2)nc1 ZINC000737361138 599562814 /nfs/dbraw/zinc/56/28/14/599562814.db2.gz UGLVWAXOSDQQKI-UHFFFAOYSA-N -1 3 371.404 3.566 20 0 FHADHM O=C(Nc1ccccc1)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000738191431 599564031 /nfs/dbraw/zinc/56/40/31/599564031.db2.gz KLYXOUCVCVXFFD-UHFFFAOYSA-N -1 3 356.389 3.863 20 0 FHADHM COC[C@H](Nc1ccc(-c2nn[n-]n2)cc1)c1cccc(C(F)(F)F)c1 ZINC000821683797 599564253 /nfs/dbraw/zinc/56/42/53/599564253.db2.gz KJUVWCNZYPGHKV-HNNXBMFYSA-N -1 3 363.343 3.685 20 0 FHADHM Clc1cccc2c1CCN(c1c(-c3nnn[n-]3)cnc3ccccc31)C2 ZINC000822585821 599567755 /nfs/dbraw/zinc/56/77/55/599567755.db2.gz NWFRKABCQWVZTA-UHFFFAOYSA-N -1 3 362.824 3.631 20 0 FHADHM Clc1cccc2c1CCN(c1c(-c3nn[n-]n3)cnc3ccccc31)C2 ZINC000822585821 599567756 /nfs/dbraw/zinc/56/77/56/599567756.db2.gz NWFRKABCQWVZTA-UHFFFAOYSA-N -1 3 362.824 3.631 20 0 FHADHM Fc1ccc(SCC(F)F)c(NCc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737656061 599582487 /nfs/dbraw/zinc/58/24/87/599582487.db2.gz HIEHIZNNKARJMJ-UHFFFAOYSA-N -1 3 365.384 3.975 20 0 FHADHM Fc1ccc(SCC(F)F)c(NCc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737656061 599582489 /nfs/dbraw/zinc/58/24/89/599582489.db2.gz HIEHIZNNKARJMJ-UHFFFAOYSA-N -1 3 365.384 3.975 20 0 FHADHM Cc1ccc(Oc2ccc(Nc3cccc(F)c3-c3nnn[n-]3)cc2)nn1 ZINC000822266537 599588931 /nfs/dbraw/zinc/58/89/31/599588931.db2.gz CAQGAFQYNFPIQI-UHFFFAOYSA-N -1 3 363.356 3.640 20 0 FHADHM Cc1ccc(Oc2ccc(Nc3cccc(F)c3-c3nn[n-]n3)cc2)nn1 ZINC000822266537 599588934 /nfs/dbraw/zinc/58/89/34/599588934.db2.gz CAQGAFQYNFPIQI-UHFFFAOYSA-N -1 3 363.356 3.640 20 0 FHADHM CCc1ccc([C@@H](C)CC(=O)OCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736687429 599605486 /nfs/dbraw/zinc/60/54/86/599605486.db2.gz MQTRKBVZXQXSBM-AWEZNQCLSA-N -1 3 350.422 3.666 20 0 FHADHM CCc1ccc([C@@H](C)CC(=O)OCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736687429 599605487 /nfs/dbraw/zinc/60/54/87/599605487.db2.gz MQTRKBVZXQXSBM-AWEZNQCLSA-N -1 3 350.422 3.666 20 0 FHADHM Cc1ccc([C@@H](C)CNC(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1 ZINC000737319961 599609363 /nfs/dbraw/zinc/60/93/63/599609363.db2.gz HVSUQKIWKWXYTQ-LBPRGKRZSA-N -1 3 370.844 3.754 20 0 FHADHM Cc1ccc([C@@H](C)CNC(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1 ZINC000737319961 599609366 /nfs/dbraw/zinc/60/93/66/599609366.db2.gz HVSUQKIWKWXYTQ-LBPRGKRZSA-N -1 3 370.844 3.754 20 0 FHADHM C[C@@H]1CCC[C@H](C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)C1 ZINC000820691865 599632688 /nfs/dbraw/zinc/63/26/88/599632688.db2.gz ZVBIVUNECWCRQP-ZJUUUORDSA-N -1 3 353.348 3.650 20 0 FHADHM C[C@@H]1CCC[C@H](C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)C1 ZINC000820691865 599632689 /nfs/dbraw/zinc/63/26/89/599632689.db2.gz ZVBIVUNECWCRQP-ZJUUUORDSA-N -1 3 353.348 3.650 20 0 FHADHM CCN(C(=O)c1cccc2cnccc21)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821161468 599648624 /nfs/dbraw/zinc/64/86/24/599648624.db2.gz YHPWWUSZHSYFEN-AWEZNQCLSA-N -1 3 372.432 3.638 20 0 FHADHM CCN(C(=O)c1cccc2cnccc21)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821161468 599648625 /nfs/dbraw/zinc/64/86/25/599648625.db2.gz YHPWWUSZHSYFEN-AWEZNQCLSA-N -1 3 372.432 3.638 20 0 FHADHM CCN(C(=O)c1cccc2cnccc21)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821161470 599648690 /nfs/dbraw/zinc/64/86/90/599648690.db2.gz YHPWWUSZHSYFEN-CQSZACIVSA-N -1 3 372.432 3.638 20 0 FHADHM CCN(C(=O)c1cccc2cnccc21)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821161470 599648691 /nfs/dbraw/zinc/64/86/91/599648691.db2.gz YHPWWUSZHSYFEN-CQSZACIVSA-N -1 3 372.432 3.638 20 0 FHADHM C[C@@H](C(=O)OCc1ccc(F)cc1-c1nnn[n-]1)c1cccc(Cl)c1 ZINC000819883958 599665650 /nfs/dbraw/zinc/66/56/50/599665650.db2.gz PFLQKRMOJUMGMM-SNVBAGLBSA-N -1 3 360.776 3.506 20 0 FHADHM C[C@@H](C(=O)OCc1ccc(F)cc1-c1nn[n-]n1)c1cccc(Cl)c1 ZINC000819883958 599665651 /nfs/dbraw/zinc/66/56/51/599665651.db2.gz PFLQKRMOJUMGMM-SNVBAGLBSA-N -1 3 360.776 3.506 20 0 FHADHM C[C@H](NC(=O)N[C@@H]1CCCC[C@@H]1C(C)(C)C)c1cccc(-c2nnn[n-]2)c1 ZINC000820357335 599667875 /nfs/dbraw/zinc/66/78/75/599667875.db2.gz GKRLXARXAZBYRT-RRQGHBQHSA-N -1 3 370.501 3.832 20 0 FHADHM C[C@H](NC(=O)N[C@@H]1CCCC[C@@H]1C(C)(C)C)c1cccc(-c2nn[n-]n2)c1 ZINC000820357335 599667876 /nfs/dbraw/zinc/66/78/76/599667876.db2.gz GKRLXARXAZBYRT-RRQGHBQHSA-N -1 3 370.501 3.832 20 0 FHADHM CC[C@](C)(NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000820852635 599674901 /nfs/dbraw/zinc/67/49/01/599674901.db2.gz DOVOMUYCQCKKJV-XOBRGWDASA-N -1 3 364.453 3.552 20 0 FHADHM CC[C@](C)(NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000820852635 599674902 /nfs/dbraw/zinc/67/49/02/599674902.db2.gz DOVOMUYCQCKKJV-XOBRGWDASA-N -1 3 364.453 3.552 20 0 FHADHM CCCN(CC1CCCCC1)C(=O)NCc1cc(-c2nnn[n-]2)ccc1F ZINC000821094980 599678840 /nfs/dbraw/zinc/67/88/40/599678840.db2.gz VVLOUPDKQZPDQU-UHFFFAOYSA-N -1 3 374.464 3.508 20 0 FHADHM CCCN(CC1CCCCC1)C(=O)NCc1cc(-c2nn[n-]n2)ccc1F ZINC000821094980 599678841 /nfs/dbraw/zinc/67/88/41/599678841.db2.gz VVLOUPDKQZPDQU-UHFFFAOYSA-N -1 3 374.464 3.508 20 0 FHADHM CC[C@@H](Nc1ccc(-c2nn[n-]n2)cc1)c1nc(C(F)(F)F)cs1 ZINC000820925967 599688284 /nfs/dbraw/zinc/68/82/84/599688284.db2.gz NTEWXIFWRXDMCO-SNVBAGLBSA-N -1 3 354.361 3.905 20 0 FHADHM Cc1ccc(-c2nc(CNc3ccc(F)cc3-c3nnn[n-]3)co2)cc1 ZINC000822214099 599688656 /nfs/dbraw/zinc/68/86/56/599688656.db2.gz PKGIXQQACMZUBK-UHFFFAOYSA-N -1 3 350.357 3.581 20 0 FHADHM Cc1ccc(-c2nc(CNc3ccc(F)cc3-c3nn[n-]n3)co2)cc1 ZINC000822214099 599688657 /nfs/dbraw/zinc/68/86/57/599688657.db2.gz PKGIXQQACMZUBK-UHFFFAOYSA-N -1 3 350.357 3.581 20 0 FHADHM Cc1cc(C)c(-c2nnn[n-]2)c(NCC2CCC(C(F)(F)F)CC2)n1 ZINC000822193356 599689290 /nfs/dbraw/zinc/68/92/90/599689290.db2.gz UQHMFLVGKAGVSC-UHFFFAOYSA-N -1 3 354.380 3.659 20 0 FHADHM Cc1cc(C)c(-c2nn[n-]n2)c(NCC2CCC(C(F)(F)F)CC2)n1 ZINC000822193356 599689291 /nfs/dbraw/zinc/68/92/91/599689291.db2.gz UQHMFLVGKAGVSC-UHFFFAOYSA-N -1 3 354.380 3.659 20 0 FHADHM Cc1ccc2[nH]cc(CCC(=O)Nc3cc(-c4nnn[n-]4)ccc3C)c2c1 ZINC000822275641 599698506 /nfs/dbraw/zinc/69/85/06/599698506.db2.gz XSKSTXJKJDTCPM-UHFFFAOYSA-N -1 3 360.421 3.536 20 0 FHADHM Cc1ccc2[nH]cc(CCC(=O)Nc3cc(-c4nn[n-]n4)ccc3C)c2c1 ZINC000822275641 599698507 /nfs/dbraw/zinc/69/85/07/599698507.db2.gz XSKSTXJKJDTCPM-UHFFFAOYSA-N -1 3 360.421 3.536 20 0 FHADHM Cc1cc(C)c(NC(=O)NC2(c3cccc(-c4nnn[n-]4)c3)CC2)c(C)c1 ZINC000826263825 607390573 /nfs/dbraw/zinc/39/05/73/607390573.db2.gz SCGRJJAGGINKAE-UHFFFAOYSA-N -1 3 362.437 3.603 20 0 FHADHM Cc1cc(C)c(NC(=O)NC2(c3cccc(-c4nn[n-]n4)c3)CC2)c(C)c1 ZINC000826263825 607390576 /nfs/dbraw/zinc/39/05/76/607390576.db2.gz SCGRJJAGGINKAE-UHFFFAOYSA-N -1 3 362.437 3.603 20 0 FHADHM CCCN(Cc1cc(C(=O)[O-])c(C)o1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000737020172 599794358 /nfs/dbraw/zinc/79/43/58/599794358.db2.gz SQBDYDVKPPSLDE-CQSZACIVSA-N -1 3 366.458 3.508 20 0 FHADHM O=C([O-])c1coc(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)c1 ZINC000566359372 599851351 /nfs/dbraw/zinc/85/13/51/599851351.db2.gz UWZWRGRWZVYRCB-CYBMUJFWSA-N -1 3 371.368 3.547 20 0 FHADHM CCc1cccc2c1OCC[C@@H]2NCc1cc(C)c(OCC(=O)[O-])c(C)c1 ZINC000737273037 599859808 /nfs/dbraw/zinc/85/98/08/599859808.db2.gz VIHJRNOITMKRJZ-IBGZPJMESA-N -1 3 369.461 3.943 20 0 FHADHM COc1ccc([C@H](NCc2cc(Cl)cc3cccnc32)C(=O)[O-])cc1 ZINC000737974309 599862344 /nfs/dbraw/zinc/86/23/44/599862344.db2.gz UPHLGCUNNMIRDY-SFHVURJKSA-N -1 3 356.809 3.812 20 0 FHADHM CCN(CC)[C@@H](CNC(=O)c1cccc(NC(=O)[O-])c1)c1ccsc1 ZINC000737086434 599930726 /nfs/dbraw/zinc/93/07/26/599930726.db2.gz XTVBYBZMAPJQSY-INIZCTEOSA-N -1 3 361.467 3.651 20 0 FHADHM O=C([O-])c1ccc(OC(=O)[C@@H]2CCCN(Cc3ccccc3)C2)c(Cl)c1 ZINC000740162389 599969606 /nfs/dbraw/zinc/96/96/06/599969606.db2.gz ZGTDQDPYTPNIQI-MRXNPFEDSA-N -1 3 373.836 3.856 20 0 FHADHM C[C@@H](NCc1ccc(-c2ccc(C(=O)[O-])cc2)o1)[C@@H](O)c1ccccc1 ZINC000020875540 600037812 /nfs/dbraw/zinc/03/78/12/600037812.db2.gz GTZDQPHUJRUZKY-JLTOFOAXSA-N -1 3 351.402 3.857 20 0 FHADHM O=C([O-])c1cc(F)ccc1CN1CCC(C(=O)Nc2cccc(F)c2)CC1 ZINC000740077035 600099738 /nfs/dbraw/zinc/09/97/38/600099738.db2.gz AQCCSTZBXSUVFP-UHFFFAOYSA-N -1 3 374.387 3.514 20 0 FHADHM Cc1cc(C)cc([C@@H](C)N[C@@H](C)C(=O)Nc2cc(C(=O)[O-])ccc2C)c1 ZINC000738364497 600139903 /nfs/dbraw/zinc/13/99/03/600139903.db2.gz WTRYEJWODOBTBZ-CVEARBPZSA-N -1 3 354.450 3.988 20 0 FHADHM Cc1ccc(C(=O)[O-])cc1NC(=O)[C@H](C)N(C)C[C@H](C)c1ccccc1 ZINC000738521050 600144310 /nfs/dbraw/zinc/14/43/10/600144310.db2.gz XTEAOBUJYXMWRC-HOTGVXAUSA-N -1 3 354.450 3.756 20 0 FHADHM Cc1ccsc1[C@H]1C[C@H]1C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2 ZINC000826316483 607428663 /nfs/dbraw/zinc/42/86/63/607428663.db2.gz POGCNDYUKXUGHJ-WDEREUQCSA-N -1 3 371.491 3.529 20 0 FHADHM Cc1ccsc1[C@H]1C[C@H]1C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2 ZINC000826316483 607428665 /nfs/dbraw/zinc/42/86/65/607428665.db2.gz POGCNDYUKXUGHJ-WDEREUQCSA-N -1 3 371.491 3.529 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@@H]2C[C@@H]2c2sccc2C)s1 ZINC000825694652 607430029 /nfs/dbraw/zinc/43/00/29/607430029.db2.gz YHGYWRWLWRFFIH-WDEREUQCSA-N -1 3 359.480 3.603 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@@H]2C[C@@H]2c2sccc2C)s1 ZINC000825694652 607430030 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Fc1ccc(CSCc2noc(C3CCCCC3)n2)c(-c2nn[n-]n2)c1 ZINC000822774481 607477829 /nfs/dbraw/zinc/47/78/29/607477829.db2.gz JZCPNZXYYOBDOL-UHFFFAOYSA-N -1 3 374.445 3.870 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1CNc1cccc(N2CCCCCC2)c1 ZINC000822743624 607490922 /nfs/dbraw/zinc/49/09/22/607490922.db2.gz ARTWOMKQTZYHHL-UHFFFAOYSA-N -1 3 366.444 3.998 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CNc1cccc(N2CCCCCC2)c1 ZINC000822743624 607490925 /nfs/dbraw/zinc/49/09/25/607490925.db2.gz ARTWOMKQTZYHHL-UHFFFAOYSA-N -1 3 366.444 3.998 20 0 FHADHM Cc1ccc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1C(=O)[O-] ZINC000832945547 601141515 /nfs/dbraw/zinc/14/15/15/601141515.db2.gz VNSAOPMFKLLSJR-INIZCTEOSA-N -1 3 373.478 3.713 20 0 FHADHM C[C@H](NC(=O)CN[C@@H](c1ccccc1)[C@H](C)C(=O)[O-])c1ccc(Cl)cc1 ZINC000827637897 601201879 /nfs/dbraw/zinc/20/18/79/601201879.db2.gz XKTDHIRNUXJTFQ-CKFHNAJUSA-N -1 3 374.868 3.569 20 0 FHADHM CCCCN(Cc1ccnc(-c2nnn[n-]2)c1)Cc1ccccc1Cl ZINC000825284969 607491574 /nfs/dbraw/zinc/49/15/74/607491574.db2.gz 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607518232 /nfs/dbraw/zinc/51/82/32/607518232.db2.gz RHHSDDKOVUKDRN-UHFFFAOYSA-N -1 3 364.434 3.611 20 0 FHADHM COc1ccc(CNc2ccc(-c3nccs3)cc2)cc1-c1nn[n-]n1 ZINC000826203998 607518234 /nfs/dbraw/zinc/51/82/34/607518234.db2.gz RHHSDDKOVUKDRN-UHFFFAOYSA-N -1 3 364.434 3.611 20 0 FHADHM CC(C)c1cccc(NC(=O)CN[C@H](c2ccccc2)[C@H](C)C(=O)[O-])c1 ZINC000827134362 601652457 /nfs/dbraw/zinc/65/24/57/601652457.db2.gz UHWBHGMTKLLHNJ-YWZLYKJASA-N -1 3 354.450 3.800 20 0 FHADHM C[C@@H](C(=O)[O-])[C@H](NCC(=O)Nc1ccc2ccccc2c1)c1ccccc1 ZINC000826052976 601657718 /nfs/dbraw/zinc/65/77/18/601657718.db2.gz HQSNPDHRQPCVBR-VFNWGFHPSA-N -1 3 362.429 3.830 20 0 FHADHM CC(C)CNC(=O)c1cccc(CN[C@H](c2ccccc2)[C@@H](C)C(=O)[O-])c1 ZINC000826891267 601657881 /nfs/dbraw/zinc/65/78/81/601657881.db2.gz MILZHROTZWUDFF-UZLBHIALSA-N -1 3 368.477 3.624 20 0 FHADHM CN1CCC(N(Cc2ccccc2)C(=O)c2ccc(NC(=O)[O-])cc2)CC1 ZINC000830923444 601674518 /nfs/dbraw/zinc/67/45/18/601674518.db2.gz JTMAWDVOQZQRHJ-UHFFFAOYSA-N -1 3 367.449 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COc1cc(CN2CCC[C@@H]([C@H]3CCCN3C(=O)[O-])C2)ccc1SC ZINC000739856472 602735697 /nfs/dbraw/zinc/73/56/97/602735697.db2.gz BEJUZMYEBPFYLW-HZPDHXFCSA-N -1 3 364.511 3.772 20 0 FHADHM Cc1ccc(NC(=O)[C@@H](C)[C@H](NC(=O)[O-])c2ccccc2)c(CN(C)C)c1 ZINC000830352788 602934871 /nfs/dbraw/zinc/93/48/71/602934871.db2.gz JWPBLCLBAORQHO-KXBFYZLASA-N -1 3 369.465 3.640 20 0 FHADHM O=C([O-])Nc1cc(C(=O)N(CCN2CCCC2)c2ccccc2)ccc1F ZINC000740693136 603009733 /nfs/dbraw/zinc/00/97/33/603009733.db2.gz PLAVMORYKBIJMI-UHFFFAOYSA-N -1 3 371.412 3.658 20 0 FHADHM O=C([O-])NC[C@H](NCc1ccc(-c2nc3ccccc3s2)o1)C1CC1 ZINC000740610666 603072529 /nfs/dbraw/zinc/07/25/29/603072529.db2.gz ACMHASJXZKNYOE-AWEZNQCLSA-N -1 3 357.435 3.692 20 0 FHADHM Cc1ccc(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cc1NC(=O)[O-] ZINC000830210655 603392764 /nfs/dbraw/zinc/39/27/64/603392764.db2.gz CNVDNCTWYGCEHI-QAPCUYQASA-N -1 3 367.449 3.650 20 0 FHADHM Cc1cscc1NC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000826320729 607648582 /nfs/dbraw/zinc/64/85/82/607648582.db2.gz BHSJTJHLBWCXBC-UHFFFAOYSA-N -1 3 350.860 3.699 20 0 FHADHM Cc1cscc1NC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000826320729 607648583 /nfs/dbraw/zinc/64/85/83/607648583.db2.gz BHSJTJHLBWCXBC-UHFFFAOYSA-N -1 3 350.860 3.699 20 0 FHADHM Cc1ccc(NC(=O)c2ccc(-c3nnn[n-]3)cc2C)cc1C(F)(F)F ZINC000826250343 607653992 /nfs/dbraw/zinc/65/39/92/607653992.db2.gz WIEMYZGNQWTIAG-UHFFFAOYSA-N -1 3 361.327 3.755 20 0 FHADHM Cc1ccc(NC(=O)c2ccc(-c3nn[n-]n3)cc2C)cc1C(F)(F)F ZINC000826250343 607653993 /nfs/dbraw/zinc/65/39/93/607653993.db2.gz WIEMYZGNQWTIAG-UHFFFAOYSA-N -1 3 361.327 3.755 20 0 FHADHM O=C([O-])N1CCc2cccc(CNC[C@H](O)c3cc4ccccc4s3)c21 ZINC000832086444 603870175 /nfs/dbraw/zinc/87/01/75/603870175.db2.gz FCVAUPKZBWTDDB-INIZCTEOSA-N -1 3 368.458 3.765 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N(C)Cc1csc2ccccc12 ZINC000826243327 607662902 /nfs/dbraw/zinc/66/29/02/607662902.db2.gz DBCQZUBGNRNKCZ-UHFFFAOYSA-N -1 3 363.446 3.662 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N(C)Cc1csc2ccccc12 ZINC000826243327 607662904 /nfs/dbraw/zinc/66/29/04/607662904.db2.gz DBCQZUBGNRNKCZ-UHFFFAOYSA-N -1 3 363.446 3.662 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1cccc(-c2nccs2)c1 ZINC000826250329 607667587 /nfs/dbraw/zinc/66/75/87/607667587.db2.gz WADHFRFPVCHNRK-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1cccc(-c2nccs2)c1 ZINC000826250329 607667589 /nfs/dbraw/zinc/66/75/89/607667589.db2.gz WADHFRFPVCHNRK-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1ccc(Oc2ccccc2)nc1 ZINC000826250361 607669015 /nfs/dbraw/zinc/66/90/15/607669015.db2.gz XHYQIRSBKWQTQE-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1ccc(Oc2ccccc2)nc1 ZINC000826250361 607669016 /nfs/dbraw/zinc/66/90/16/607669016.db2.gz XHYQIRSBKWQTQE-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM CCN(C(=O)c1ccc(-c2nnn[n-]2)cc1C)C12CC3CC(CC(C3)C1)C2 ZINC000825379096 607687408 /nfs/dbraw/zinc/68/74/08/607687408.db2.gz AJYGPSHZMUSKED-UHFFFAOYSA-N -1 3 365.481 3.606 20 0 FHADHM CCN(C(=O)c1ccc(-c2nn[n-]n2)cc1C)C12CC3CC(CC(C3)C1)C2 ZINC000825379096 607687411 /nfs/dbraw/zinc/68/74/11/607687411.db2.gz AJYGPSHZMUSKED-UHFFFAOYSA-N -1 3 365.481 3.606 20 0 FHADHM Cc1c([C@@H](C)N[C@@H]2CCCN(C(=O)[O-])C2)cnn1-c1cccc(Cl)c1 ZINC000832854112 604286814 /nfs/dbraw/zinc/28/68/14/604286814.db2.gz UITJXPADZGNIKE-IUODEOHRSA-N -1 3 362.861 3.627 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1CCC[C@@H](c2ccccc2)CC1 ZINC000826244943 607683081 /nfs/dbraw/zinc/68/30/81/607683081.db2.gz IRJPDPHJTRBZFG-QGZVFWFLSA-N -1 3 361.449 3.585 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1CCC[C@@H](c2ccccc2)CC1 ZINC000826244943 607683082 /nfs/dbraw/zinc/68/30/82/607683082.db2.gz IRJPDPHJTRBZFG-QGZVFWFLSA-N -1 3 361.449 3.585 20 0 FHADHM CC(C)(NCc1csc(-c2ccc(Br)cc2)n1)C(=O)[O-] ZINC000826630721 604422640 /nfs/dbraw/zinc/42/26/40/604422640.db2.gz PJTCGFOGVXXYFR-UHFFFAOYSA-N -1 3 355.257 3.525 20 0 FHADHM C[C@@H](c1cc2ccccc2o1)N(C)C(=O)CNC1(C(=O)[O-])CCCCCC1 ZINC000833546520 604481095 /nfs/dbraw/zinc/48/10/95/604481095.db2.gz IKOQVRUYDMXVMO-HNNXBMFYSA-N -1 3 372.465 3.719 20 0 FHADHM CC[C@@H](Cc1ccc(C)cc1)N(C)C(=O)c1ccc(-c2nnn[n-]2)cc1C ZINC000825128478 607695389 /nfs/dbraw/zinc/69/53/89/607695389.db2.gz VOFGOVQJKOFVMC-SFHVURJKSA-N -1 3 363.465 3.577 20 0 FHADHM CC[C@@H](Cc1ccc(C)cc1)N(C)C(=O)c1ccc(-c2nn[n-]n2)cc1C ZINC000825128478 607695390 /nfs/dbraw/zinc/69/53/90/607695390.db2.gz VOFGOVQJKOFVMC-SFHVURJKSA-N -1 3 363.465 3.577 20 0 FHADHM CCOc1ccc([C@@H]2CCCN2Cc2c(C)nn(CCC(=O)[O-])c2C)cc1 ZINC000833664109 604524148 /nfs/dbraw/zinc/52/41/48/604524148.db2.gz OPSUPQWMDMXPKJ-FQEVSTJZSA-N -1 3 371.481 3.710 20 0 FHADHM CCc1oc(C(=O)[O-])cc1CN1CCC(OCc2ccc(F)cc2)CC1 ZINC000652435266 604574724 /nfs/dbraw/zinc/57/47/24/604574724.db2.gz YKZLAAFKOHAVOE-UHFFFAOYSA-N -1 3 361.413 3.861 20 0 FHADHM C[C@@H](Oc1ccc(CN2CCC[C@H](Oc3ccccc3)C2)cc1)C(=O)[O-] ZINC000833537970 604586887 /nfs/dbraw/zinc/58/68/87/604586887.db2.gz AHKQNHFMZNSZMV-UZLBHIALSA-N -1 3 355.434 3.582 20 0 FHADHM C[C@@H](Oc1ccc(CN2CCC[C@@H](Oc3ccccc3)C2)cc1)C(=O)[O-] ZINC000833537969 604586896 /nfs/dbraw/zinc/58/68/96/604586896.db2.gz AHKQNHFMZNSZMV-OXQOHEQNSA-N -1 3 355.434 3.582 20 0 FHADHM COc1ccccc1[C@@H](CN[C@@H](C)c1ccc2ccccc2n1)NC(=O)[O-] ZINC000829599367 604760852 /nfs/dbraw/zinc/76/08/52/604760852.db2.gz USXXZQITHZXXIM-IFXJQAMLSA-N -1 3 365.433 3.903 20 0 FHADHM Fc1cccc(F)c1-n1ccc(CSc2ccccc2-c2nnn[n-]2)n1 ZINC000826377029 607713580 /nfs/dbraw/zinc/71/35/80/607713580.db2.gz BCBOBTBOOZBLHT-UHFFFAOYSA-N -1 3 370.388 3.623 20 0 FHADHM Fc1cccc(F)c1-n1ccc(CSc2ccccc2-c2nn[n-]n2)n1 ZINC000826377029 607713582 /nfs/dbraw/zinc/71/35/82/607713582.db2.gz BCBOBTBOOZBLHT-UHFFFAOYSA-N -1 3 370.388 3.623 20 0 FHADHM CC(C)(C)c1ccc(NC(=O)CN2CCC[C@@H](C(C)(C)C(=O)[O-])C2)cc1 ZINC000833448839 604932472 /nfs/dbraw/zinc/93/24/72/604932472.db2.gz ILEDKWDYLPJTGI-MRXNPFEDSA-N -1 3 360.498 3.745 20 0 FHADHM COCc1cccc(CN[C@H](C(=O)[O-])c2ccccc2C(F)(F)F)c1 ZINC000833726217 604975850 /nfs/dbraw/zinc/97/58/50/604975850.db2.gz WZXYCOHAQRCNAP-INIZCTEOSA-N -1 3 353.340 3.767 20 0 FHADHM CC[C@@](C)(COc1ncccc1Cl)NCc1cc(C)c(C(=O)[O-])o1 ZINC000833638557 604989461 /nfs/dbraw/zinc/98/94/61/604989461.db2.gz UMQVSZIWIYBPKX-KRWDZBQOSA-N -1 3 352.818 3.672 20 0 FHADHM O=C([O-])[C@H](NCc1ccc(Oc2ccc(F)cc2)cc1)c1cccnc1 ZINC000833169848 604990503 /nfs/dbraw/zinc/99/05/03/604990503.db2.gz LSTODTADMNFRLS-LJQANCHMSA-N -1 3 352.365 3.929 20 0 FHADHM COc1cc([C@@H](C)N[C@@H](C(=O)[O-])c2cccnc2)ccc1OC1CCCC1 ZINC000831955540 604993126 /nfs/dbraw/zinc/99/31/26/604993126.db2.gz LDFITVYHEQYBDX-JLTOFOAXSA-N -1 3 370.449 3.888 20 0 FHADHM Cc1c(C(=O)[O-])csc1NC(=O)c1oc2ccccc2c1CN(C)C ZINC000833741710 605158206 /nfs/dbraw/zinc/15/82/06/605158206.db2.gz VKIBKCSQLFUFAW-UHFFFAOYSA-N -1 3 358.419 3.815 20 0 FHADHM CC(C)(C)CN(Cc1nc2cc(C(=O)[O-])ccc2c(=O)[nH]1)CC(C)(C)C ZINC000833429941 605185835 /nfs/dbraw/zinc/18/58/35/605185835.db2.gz BBVNDPVQUSILJB-UHFFFAOYSA-N -1 3 359.470 3.928 20 0 FHADHM CC1=C(C(=O)[O-])C[C@H](CN2CC=C(c3c[nH]c4cc(F)ccc43)CC2)O1 ZINC000833585109 605361285 /nfs/dbraw/zinc/36/12/85/605361285.db2.gz UJAIYXDPIVLMMJ-OAHLLOKOSA-N -1 3 356.397 3.544 20 0 FHADHM CC1([C@H]2CCCN([C@H](C(=O)[O-])c3cc(Cl)cc(Cl)c3)C2)OCCO1 ZINC000833565176 605444400 /nfs/dbraw/zinc/44/44/00/605444400.db2.gz YMJJJZUVHILCNW-WFASDCNBSA-N -1 3 374.264 3.594 20 0 FHADHM Cn1cc([C@H](NCCc2ccc(NC(=O)[O-])cc2)c2cccc(F)c2)cn1 ZINC000833948284 605625451 /nfs/dbraw/zinc/62/54/51/605625451.db2.gz XJQOLAWXZFWOBY-LJQANCHMSA-N -1 3 368.412 3.571 20 0 FHADHM C[C@H](C(=O)Nc1nc(-c2cccc(-c3nnn[n-]3)c2)cs1)C1CCCC1 ZINC000824044951 607770352 /nfs/dbraw/zinc/77/03/52/607770352.db2.gz BRZBQAYVEIEBOF-NSHDSACASA-N -1 3 368.466 3.755 20 0 FHADHM C[C@H](C(=O)Nc1nc(-c2cccc(-c3nn[n-]n3)c2)cs1)C1CCCC1 ZINC000824044951 607770353 /nfs/dbraw/zinc/77/03/53/607770353.db2.gz BRZBQAYVEIEBOF-NSHDSACASA-N -1 3 368.466 3.755 20 0 FHADHM O=C([O-])N1CCC[C@@H]1[C@H]1CCC[C@@H]1NCc1coc(-c2cccs2)n1 ZINC000834107598 605988993 /nfs/dbraw/zinc/98/89/93/605988993.db2.gz MZROFIQBZSGTQL-SOUVJXGZSA-N -1 3 361.467 3.804 20 0 FHADHM CC[C@H]1CN(C(=O)c2sccc2-c2nnn[n-]2)CC[C@H]1c1ccccc1 ZINC000820994988 606030910 /nfs/dbraw/zinc/03/09/10/606030910.db2.gz LVRCQXIVVNCDGC-DZGCQCFKSA-N -1 3 367.478 3.584 20 0 FHADHM CC[C@H]1CN(C(=O)c2sccc2-c2nn[n-]n2)CC[C@H]1c1ccccc1 ZINC000820994988 606030916 /nfs/dbraw/zinc/03/09/16/606030916.db2.gz LVRCQXIVVNCDGC-DZGCQCFKSA-N -1 3 367.478 3.584 20 0 FHADHM O=C([O-])N1CCC[C@@H](NCc2csc(CCc3ccccc3)n2)CC1 ZINC000834107072 606043183 /nfs/dbraw/zinc/04/31/83/606043183.db2.gz NJDBEYWQYUSZIX-MRXNPFEDSA-N -1 3 359.495 3.550 20 0 FHADHM Cc1ccccc1[C@H]1CCN(c2nc3ccccc3cc2-c2nnn[n-]2)C1 ZINC000822351238 606068015 /nfs/dbraw/zinc/06/80/15/606068015.db2.gz MQLHOKFRVGVELX-INIZCTEOSA-N -1 3 356.433 3.717 20 0 FHADHM Cc1ccccc1[C@H]1CCN(c2nc3ccccc3cc2-c2nn[n-]n2)C1 ZINC000822351238 606068018 /nfs/dbraw/zinc/06/80/18/606068018.db2.gz MQLHOKFRVGVELX-INIZCTEOSA-N -1 3 356.433 3.717 20 0 FHADHM COc1ccc(-c2ccc(CNc3ccc(-c4nnn[n-]4)nc3)cc2)cc1 ZINC000821728419 606092369 /nfs/dbraw/zinc/09/23/69/606092369.db2.gz WHOSQYGQRXPIKP-UHFFFAOYSA-N -1 3 358.405 3.549 20 0 FHADHM COc1ccc(-c2ccc(CNc3ccc(-c4nn[n-]n4)nc3)cc2)cc1 ZINC000821728419 606092375 /nfs/dbraw/zinc/09/23/75/606092375.db2.gz WHOSQYGQRXPIKP-UHFFFAOYSA-N -1 3 358.405 3.549 20 0 FHADHM C[C@H]1c2ccccc2CN1C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820826485 606115076 /nfs/dbraw/zinc/11/50/76/606115076.db2.gz MTSCUGNBIZIHOE-JTQLQIEISA-N -1 3 354.801 3.629 20 0 FHADHM C[C@H]1c2ccccc2CN1C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820826485 606115077 /nfs/dbraw/zinc/11/50/77/606115077.db2.gz MTSCUGNBIZIHOE-JTQLQIEISA-N -1 3 354.801 3.629 20 0 FHADHM CC(=CC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1cccc(Cl)c1 ZINC000819765320 606116294 /nfs/dbraw/zinc/11/62/94/606116294.db2.gz OHOHMPQGTZLGSA-SRXBQZRASA-N -1 3 367.840 3.801 20 0 FHADHM CC(=CC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1cccc(Cl)c1 ZINC000819765320 606116296 /nfs/dbraw/zinc/11/62/96/606116296.db2.gz OHOHMPQGTZLGSA-SRXBQZRASA-N -1 3 367.840 3.801 20 0 FHADHM O=C(c1ccccc1-c1ccccc1-c1nnn[n-]1)N1C[C@@H]2CCCC[C@@H]2C1 ZINC000823493766 606121169 /nfs/dbraw/zinc/12/11/69/606121169.db2.gz VMIVFFNNJJDBCX-IYBDPMFKSA-N -1 3 373.460 3.796 20 0 FHADHM O=C(c1ccccc1-c1ccccc1-c1nn[n-]n1)N1C[C@@H]2CCCC[C@@H]2C1 ZINC000823493766 606121171 /nfs/dbraw/zinc/12/11/71/606121171.db2.gz VMIVFFNNJJDBCX-IYBDPMFKSA-N -1 3 373.460 3.796 20 0 FHADHM O=C(c1ccccc1-c1ccccc1-c1nnn[n-]1)N1C[C@H]2CCCC[C@@H]2C1 ZINC000823493765 606121281 /nfs/dbraw/zinc/12/12/81/606121281.db2.gz VMIVFFNNJJDBCX-HZPDHXFCSA-N -1 3 373.460 3.796 20 0 FHADHM O=C(c1ccccc1-c1ccccc1-c1nn[n-]n1)N1C[C@H]2CCCC[C@@H]2C1 ZINC000823493765 606121282 /nfs/dbraw/zinc/12/12/82/606121282.db2.gz VMIVFFNNJJDBCX-HZPDHXFCSA-N -1 3 373.460 3.796 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@H](C)c2ccc(Cl)s2)s1 ZINC000821465458 606126264 /nfs/dbraw/zinc/12/62/64/606126264.db2.gz HZQLBBNACYNKFI-SSDOTTSWSA-N -1 3 367.887 3.948 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@H](C)c2ccc(Cl)s2)s1 ZINC000821465458 606126265 /nfs/dbraw/zinc/12/62/65/606126265.db2.gz HZQLBBNACYNKFI-SSDOTTSWSA-N -1 3 367.887 3.948 20 0 FHADHM Cc1cccnc1C(=O)Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1 ZINC000822370318 606126623 /nfs/dbraw/zinc/12/66/23/606126623.db2.gz WMBUCHRPUZQQIU-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1cccnc1C(=O)Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1 ZINC000822370318 606126625 /nfs/dbraw/zinc/12/66/25/606126625.db2.gz WMBUCHRPUZQQIU-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1cccnc1C(=O)Oc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000822370157 606127934 /nfs/dbraw/zinc/12/79/34/606127934.db2.gz RXPQMDDUKYKZHI-UHFFFAOYSA-N -1 3 373.372 3.582 20 0 FHADHM COc1ccc(CNc2cccc(OCC(C)C)c2)cc1-c1nnn[n-]1 ZINC000821824089 606133139 /nfs/dbraw/zinc/13/31/39/606133139.db2.gz GKIJLPDMZFJOPZ-UHFFFAOYSA-N -1 3 353.426 3.522 20 0 FHADHM COc1ccc(CNc2cccc(OCC(C)C)c2)cc1-c1nn[n-]n1 ZINC000821824089 606133141 /nfs/dbraw/zinc/13/31/41/606133141.db2.gz GKIJLPDMZFJOPZ-UHFFFAOYSA-N -1 3 353.426 3.522 20 0 FHADHM C[C@@H](c1ccc(Cl)cc1)[C@H](C)N(C)C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000820563587 606149400 /nfs/dbraw/zinc/14/94/00/606149400.db2.gz RWCOTHFLQVVPIC-OLZOCXBDSA-N -1 3 369.856 3.784 20 0 FHADHM C[C@@H](c1ccc(Cl)cc1)[C@H](C)N(C)C(=O)c1cccc(-c2nn[n-]n2)c1 ZINC000820563587 606149402 /nfs/dbraw/zinc/14/94/02/606149402.db2.gz RWCOTHFLQVVPIC-OLZOCXBDSA-N -1 3 369.856 3.784 20 0 FHADHM Cc1c(COC(C)(C)C)cccc1NC(=O)c1sccc1-c1nnn[n-]1 ZINC000822027969 606150836 /nfs/dbraw/zinc/15/08/36/606150836.db2.gz KPRQQRJLDLVUSK-UHFFFAOYSA-N -1 3 371.466 3.804 20 0 FHADHM Cc1c(COC(C)(C)C)cccc1NC(=O)c1sccc1-c1nn[n-]n1 ZINC000822027969 606150837 /nfs/dbraw/zinc/15/08/37/606150837.db2.gz KPRQQRJLDLVUSK-UHFFFAOYSA-N -1 3 371.466 3.804 20 0 FHADHM CCN(Cc1csc([C@@H](C)OC)n1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821230559 606158102 /nfs/dbraw/zinc/15/81/02/606158102.db2.gz NICVCNWCDASRAX-CHWSQXEVSA-N -1 3 372.498 3.614 20 0 FHADHM CCN(Cc1csc([C@@H](C)OC)n1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821230559 606158104 /nfs/dbraw/zinc/15/81/04/606158104.db2.gz NICVCNWCDASRAX-CHWSQXEVSA-N -1 3 372.498 3.614 20 0 FHADHM Fc1cccc(-c2cnc(CSc3ccc(-c4nnn[n-]4)cc3)o2)c1 ZINC000822786270 606172035 /nfs/dbraw/zinc/17/20/35/606172035.db2.gz HAPQMYHFWOMESL-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM Fc1cccc(-c2cnc(CSc3ccc(-c4nn[n-]n4)cc3)o2)c1 ZINC000822786270 606172036 /nfs/dbraw/zinc/17/20/36/606172036.db2.gz HAPQMYHFWOMESL-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM CO[C@H](C)c1nc(CN(CC(C)C)c2ccc(-c3nn[n-]n3)cc2)cs1 ZINC000821675731 606178459 /nfs/dbraw/zinc/17/84/59/606178459.db2.gz RZUWPWDYOFPOKO-CYBMUJFWSA-N -1 3 372.498 3.693 20 0 FHADHM O=[S@@](Cc1ccc(-c2nnn[n-]2)cc1)Cc1cc(Cl)ccc1Cl ZINC000823606831 606181341 /nfs/dbraw/zinc/18/13/41/606181341.db2.gz NTSXZBFFMGWFMZ-QHCPKHFHSA-N -1 3 367.261 3.622 20 0 FHADHM O=[S@@](Cc1ccc(-c2nn[n-]n2)cc1)Cc1cc(Cl)ccc1Cl ZINC000823606831 606181342 /nfs/dbraw/zinc/18/13/42/606181342.db2.gz NTSXZBFFMGWFMZ-QHCPKHFHSA-N -1 3 367.261 3.622 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)c1ccc(-c2ccccc2)cc1 ZINC000823344078 606269254 /nfs/dbraw/zinc/26/92/54/606269254.db2.gz PUBYWCZXAFWOBN-UHFFFAOYSA-N -1 3 359.364 3.925 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)c1ccc(-c2ccccc2)cc1 ZINC000823344078 606269256 /nfs/dbraw/zinc/26/92/56/606269256.db2.gz PUBYWCZXAFWOBN-UHFFFAOYSA-N -1 3 359.364 3.925 20 0 FHADHM C[C@H](c1ccc2ccccc2c1)N(C(=O)c1cc(-c2nnn[n-]2)c[nH]1)C1CC1 ZINC000820563530 606316290 /nfs/dbraw/zinc/31/62/90/606316290.db2.gz RTALESKHBAIJMY-CYBMUJFWSA-N -1 3 372.432 3.714 20 0 FHADHM C[C@H](c1ccc2ccccc2c1)N(C(=O)c1cc(-c2nn[n-]n2)c[nH]1)C1CC1 ZINC000820563530 606316291 /nfs/dbraw/zinc/31/62/91/606316291.db2.gz RTALESKHBAIJMY-CYBMUJFWSA-N -1 3 372.432 3.714 20 0 FHADHM Fc1cccc(-c2nc(CSc3cccc(-c4nnn[n-]4)c3)co2)c1 ZINC000822786318 606324705 /nfs/dbraw/zinc/32/47/05/606324705.db2.gz JOGWEMFIWVVGRN-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM Fc1cccc(-c2nc(CSc3cccc(-c4nn[n-]n4)c3)co2)c1 ZINC000822786318 606324706 /nfs/dbraw/zinc/32/47/06/606324706.db2.gz JOGWEMFIWVVGRN-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM Cc1ccc(C)c(NC(=O)[C@H](C)Sc2cccc(-c3nnn[n-]3)c2)c1 ZINC000822231950 606325979 /nfs/dbraw/zinc/32/59/79/606325979.db2.gz NWAYRKPNSRNOKX-ZDUSSCGKSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1ccc(C)c(NC(=O)[C@H](C)Sc2cccc(-c3nn[n-]n3)c2)c1 ZINC000822231950 606325981 /nfs/dbraw/zinc/32/59/81/606325981.db2.gz NWAYRKPNSRNOKX-ZDUSSCGKSA-N -1 3 353.451 3.603 20 0 FHADHM CC(C)Oc1ccc(C(=O)CSc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000820154866 606326831 /nfs/dbraw/zinc/32/68/31/606326831.db2.gz AQPRUBGYOIUBRK-UHFFFAOYSA-N -1 3 354.435 3.629 20 0 FHADHM CC(C)Oc1ccc(C(=O)CSc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000820154866 606326832 /nfs/dbraw/zinc/32/68/32/606326832.db2.gz AQPRUBGYOIUBRK-UHFFFAOYSA-N -1 3 354.435 3.629 20 0 FHADHM c1ccc(-c2nnn[n-]2)c(Sc2ccc(-c3nc(C4CC4)no3)cc2)c1 ZINC000823774094 606328805 /nfs/dbraw/zinc/32/88/05/606328805.db2.gz ZFOWEYJWORWJRI-UHFFFAOYSA-N -1 3 362.418 3.945 20 0 FHADHM c1ccc(-c2nn[n-]n2)c(Sc2ccc(-c3nc(C4CC4)no3)cc2)c1 ZINC000823774094 606328807 /nfs/dbraw/zinc/32/88/07/606328807.db2.gz ZFOWEYJWORWJRI-UHFFFAOYSA-N -1 3 362.418 3.945 20 0 FHADHM C[C@@H](Oc1ccccc1Cl)C(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820550206 606339024 /nfs/dbraw/zinc/33/90/24/606339024.db2.gz VTJUXLXKEWOKPB-VXGBXAGGSA-N -1 3 372.812 3.592 20 0 FHADHM C[C@@H](Oc1ccccc1Cl)C(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820550206 606339025 /nfs/dbraw/zinc/33/90/25/606339025.db2.gz VTJUXLXKEWOKPB-VXGBXAGGSA-N -1 3 372.812 3.592 20 0 FHADHM C[C@H](OC(=O)COc1cccc2ccccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000820497127 606340579 /nfs/dbraw/zinc/34/05/79/606340579.db2.gz PYGVZDAQKOUYHS-AWEZNQCLSA-N -1 3 374.400 3.703 20 0 FHADHM C[C@H](OC(=O)COc1cccc2ccccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000820497127 606340581 /nfs/dbraw/zinc/34/05/81/606340581.db2.gz PYGVZDAQKOUYHS-AWEZNQCLSA-N -1 3 374.400 3.703 20 0 FHADHM C[C@H](OC(=O)c1ccccc1Br)c1ccc(-c2nnn[n-]2)cc1 ZINC000820512900 606342998 /nfs/dbraw/zinc/34/29/98/606342998.db2.gz PFLISTBCADDPJF-JTQLQIEISA-N -1 3 373.210 3.547 20 0 FHADHM C[C@H](OC(=O)c1ccccc1Br)c1ccc(-c2nn[n-]n2)cc1 ZINC000820512900 606343000 /nfs/dbraw/zinc/34/30/00/606343000.db2.gz PFLISTBCADDPJF-JTQLQIEISA-N -1 3 373.210 3.547 20 0 FHADHM Cc1ccc2c(CC(=O)O[C@@H](C)c3ccc(-c4nnn[n-]4)cc3)coc2c1 ZINC000822274791 606345078 /nfs/dbraw/zinc/34/50/78/606345078.db2.gz JKPNPHWMYYJGSK-ZDUSSCGKSA-N -1 3 362.389 3.768 20 0 FHADHM Cc1ccc2c(CC(=O)O[C@@H](C)c3ccc(-c4nn[n-]n4)cc3)coc2c1 ZINC000822274791 606345080 /nfs/dbraw/zinc/34/50/80/606345080.db2.gz JKPNPHWMYYJGSK-ZDUSSCGKSA-N -1 3 362.389 3.768 20 0 FHADHM Cc1ccc2cccc(C(=O)O[C@H](C)c3ccc(-c4nnn[n-]4)cc3)c2n1 ZINC000822280306 606347128 /nfs/dbraw/zinc/34/71/28/606347128.db2.gz KAWBHWRSJNGBOD-CYBMUJFWSA-N -1 3 359.389 3.641 20 0 FHADHM Cc1ccc2cccc(C(=O)O[C@H](C)c3ccc(-c4nn[n-]n4)cc3)c2n1 ZINC000822280306 606347130 /nfs/dbraw/zinc/34/71/30/606347130.db2.gz KAWBHWRSJNGBOD-CYBMUJFWSA-N -1 3 359.389 3.641 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)N1CCCC2(CCCCC2)C1 ZINC000823343684 606351436 /nfs/dbraw/zinc/35/14/36/606351436.db2.gz DIHBCAAOGANQSP-UHFFFAOYSA-N -1 3 358.421 3.584 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)N1CCCC2(CCCCC2)C1 ZINC000823343684 606351437 /nfs/dbraw/zinc/35/14/37/606351437.db2.gz DIHBCAAOGANQSP-UHFFFAOYSA-N -1 3 358.421 3.584 20 0 FHADHM Cc1ccc(SCC(=O)O[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000822266556 606353673 /nfs/dbraw/zinc/35/36/73/606353673.db2.gz CJRSFHGSOKHQPZ-CYBMUJFWSA-N -1 3 354.435 3.572 20 0 FHADHM Cc1ccc(SCC(=O)O[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000822266556 606353675 /nfs/dbraw/zinc/35/36/75/606353675.db2.gz CJRSFHGSOKHQPZ-CYBMUJFWSA-N -1 3 354.435 3.572 20 0 FHADHM C[C@H](OC(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488685 606357736 /nfs/dbraw/zinc/35/77/36/606357736.db2.gz RQGIHIUJJGQDGW-LEWSCRJBSA-N -1 3 368.359 3.840 20 0 FHADHM C[C@H](OC(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488685 606357737 /nfs/dbraw/zinc/35/77/37/606357737.db2.gz RQGIHIUJJGQDGW-LEWSCRJBSA-N -1 3 368.359 3.840 20 0 FHADHM Cc1nc2ccccc2cc1C(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000822462991 606358553 /nfs/dbraw/zinc/35/85/53/606358553.db2.gz MBYKFQRKHLRPED-CYBMUJFWSA-N -1 3 359.389 3.641 20 0 FHADHM Cc1nc2ccccc2cc1C(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000822462991 606358554 /nfs/dbraw/zinc/35/85/54/606358554.db2.gz MBYKFQRKHLRPED-CYBMUJFWSA-N -1 3 359.389 3.641 20 0 FHADHM C[C@@H](OC(=O)c1csc(C(C)(C)C)n1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820519367 606360263 /nfs/dbraw/zinc/36/02/63/606360263.db2.gz SRNVMGLAAVYIIE-SNVBAGLBSA-N -1 3 357.439 3.539 20 0 FHADHM C[C@@H](OC(=O)c1csc(C(C)(C)C)n1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820519367 606360265 /nfs/dbraw/zinc/36/02/65/606360265.db2.gz SRNVMGLAAVYIIE-SNVBAGLBSA-N -1 3 357.439 3.539 20 0 FHADHM CC(C)C[C@H](C)N(C)C(=O)CS[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820057356 606371598 /nfs/dbraw/zinc/37/15/98/606371598.db2.gz YXCUBIXFFYYJQL-UONOGXRCSA-N -1 3 361.515 3.554 20 0 FHADHM CC(C)C[C@H](C)N(C)C(=O)CS[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820057356 606371599 /nfs/dbraw/zinc/37/15/99/606371599.db2.gz YXCUBIXFFYYJQL-UONOGXRCSA-N -1 3 361.515 3.554 20 0 FHADHM C[C@@H](OC(=O)c1cccn1Cc1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820512541 606399154 /nfs/dbraw/zinc/39/91/54/606399154.db2.gz LZOUMGIBWXTEDH-OAHLLOKOSA-N -1 3 373.416 3.635 20 0 FHADHM C[C@@H](OC(=O)c1cccn1Cc1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820512541 606399155 /nfs/dbraw/zinc/39/91/55/606399155.db2.gz LZOUMGIBWXTEDH-OAHLLOKOSA-N -1 3 373.416 3.635 20 0 FHADHM FC(F)(F)c1ccc2ccc(Oc3ncccc3-c3nnn[n-]3)cc2n1 ZINC000822727998 606431092 /nfs/dbraw/zinc/43/10/92/606431092.db2.gz DGNAVSCBSWUSTG-UHFFFAOYSA-N -1 3 358.283 3.621 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)cc1CNc1cccc(OC(F)(F)F)c1 ZINC000822762089 606444179 /nfs/dbraw/zinc/44/41/79/606444179.db2.gz YNYCVBYVZSTZBO-UHFFFAOYSA-N -1 3 353.279 3.517 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CNc1cccc(OC(F)(F)F)c1 ZINC000822762089 606444180 /nfs/dbraw/zinc/44/41/80/606444180.db2.gz YNYCVBYVZSTZBO-UHFFFAOYSA-N -1 3 353.279 3.517 20 0 FHADHM Cc1csc(-c2cccc(OC(=O)c3cc(-c4nnn[n-]4)cs3)c2)n1 ZINC000822410063 606464549 /nfs/dbraw/zinc/46/45/49/606464549.db2.gz VZZAYJCZLYJONH-UHFFFAOYSA-N -1 3 369.431 3.579 20 0 FHADHM Cc1csc(-c2cccc(OC(=O)c3cc(-c4nn[n-]n4)cs3)c2)n1 ZINC000822410063 606464553 /nfs/dbraw/zinc/46/45/53/606464553.db2.gz VZZAYJCZLYJONH-UHFFFAOYSA-N -1 3 369.431 3.579 20 0 FHADHM Cc1sc(NC(=O)c2cc(-c3nnn[n-]3)cs2)nc1-c1ccccc1 ZINC000822564116 606478628 /nfs/dbraw/zinc/47/86/28/606478628.db2.gz USNWVFCXXQXQIU-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM Cc1sc(NC(=O)c2cc(-c3nn[n-]n3)cs2)nc1-c1ccccc1 ZINC000822564116 606478630 /nfs/dbraw/zinc/47/86/30/606478630.db2.gz USNWVFCXXQXQIU-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM C[C@H](c1cc2ccccc2o1)N(C)C(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000820555044 606488428 /nfs/dbraw/zinc/48/84/28/606488428.db2.gz FCQFTLXKOSUVRK-SNVBAGLBSA-N -1 3 353.407 3.508 20 0 FHADHM C[C@H](c1cc2ccccc2o1)N(C)C(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000820555044 606488431 /nfs/dbraw/zinc/48/84/31/606488431.db2.gz FCQFTLXKOSUVRK-SNVBAGLBSA-N -1 3 353.407 3.508 20 0 FHADHM CCCCN(C(=O)c1cc(-c2nnn[n-]2)cs1)[C@H](C)c1ccc(C)o1 ZINC000821062327 606491916 /nfs/dbraw/zinc/49/19/16/606491916.db2.gz WRETVUSHRSQCFC-GFCCVEGCSA-N -1 3 359.455 3.833 20 0 FHADHM CCCCN(C(=O)c1cc(-c2nn[n-]n2)cs1)[C@H](C)c1ccc(C)o1 ZINC000821062327 606491919 /nfs/dbraw/zinc/49/19/19/606491919.db2.gz WRETVUSHRSQCFC-GFCCVEGCSA-N -1 3 359.455 3.833 20 0 FHADHM CCCN(C(=O)Cc1cccc(-c2nnn[n-]2)c1)[C@@H](CC)c1ccccc1 ZINC000821083438 606505423 /nfs/dbraw/zinc/50/54/23/606505423.db2.gz YZUXVMIVACSNDI-IBGZPJMESA-N -1 3 363.465 3.799 20 0 FHADHM CCCN(C(=O)Cc1cccc(-c2nn[n-]n2)c1)[C@@H](CC)c1ccccc1 ZINC000821083438 606505424 /nfs/dbraw/zinc/50/54/24/606505424.db2.gz YZUXVMIVACSNDI-IBGZPJMESA-N -1 3 363.465 3.799 20 0 FHADHM Cc1ccccc1[C@@H](C(C)C)N(C)C(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000822345694 606511529 /nfs/dbraw/zinc/51/15/29/606511529.db2.gz PFIUYRLGVHSHFM-MRXNPFEDSA-N -1 3 355.467 3.706 20 0 FHADHM Cc1ccccc1[C@@H](C(C)C)N(C)C(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000822345694 606511530 /nfs/dbraw/zinc/51/15/30/606511530.db2.gz PFIUYRLGVHSHFM-MRXNPFEDSA-N -1 3 355.467 3.706 20 0 FHADHM O=C(Cc1cccc(-c2nnn[n-]2)c1)N1CCCCC[C@@H]1c1ccccc1 ZINC000823087199 606515744 /nfs/dbraw/zinc/51/57/44/606515744.db2.gz KHVQXJGQIWIREA-LJQANCHMSA-N -1 3 361.449 3.553 20 0 FHADHM O=C(Cc1cccc(-c2nn[n-]n2)c1)N1CCCCC[C@@H]1c1ccccc1 ZINC000823087199 606515745 /nfs/dbraw/zinc/51/57/45/606515745.db2.gz KHVQXJGQIWIREA-LJQANCHMSA-N -1 3 361.449 3.553 20 0 FHADHM Cc1ccc([C@H]2CCCCCN2C(=O)c2cc(-c3nnn[n-]3)cs2)o1 ZINC000822233222 606516481 /nfs/dbraw/zinc/51/64/81/606516481.db2.gz KTFAZFWOMCEICQ-CYBMUJFWSA-N -1 3 357.439 3.587 20 0 FHADHM Cc1ccc([C@H]2CCCCCN2C(=O)c2cc(-c3nn[n-]n3)cs2)o1 ZINC000822233222 606516482 /nfs/dbraw/zinc/51/64/82/606516482.db2.gz KTFAZFWOMCEICQ-CYBMUJFWSA-N -1 3 357.439 3.587 20 0 FHADHM Cc1cccc([C@@H]2CCCN2C(=O)c2cc(-c3nnn[n-]3)cs2)c1C ZINC000822299833 606542916 /nfs/dbraw/zinc/54/29/16/606542916.db2.gz WICNJNUXILNREJ-HNNXBMFYSA-N -1 3 353.451 3.522 20 0 FHADHM Cc1cccc([C@@H]2CCCN2C(=O)c2cc(-c3nn[n-]n3)cs2)c1C ZINC000822299833 606542917 /nfs/dbraw/zinc/54/29/17/606542917.db2.gz WICNJNUXILNREJ-HNNXBMFYSA-N -1 3 353.451 3.522 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N[C@H](C)c1c(F)cccc1Cl ZINC000822218183 606575270 /nfs/dbraw/zinc/57/52/70/606575270.db2.gz ZEEXIRPECMLCSO-SNVBAGLBSA-N -1 3 374.807 3.850 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N[C@H](C)c1c(F)cccc1Cl ZINC000822218183 606575272 /nfs/dbraw/zinc/57/52/72/606575272.db2.gz ZEEXIRPECMLCSO-SNVBAGLBSA-N -1 3 374.807 3.850 20 0 FHADHM CCc1ccc(CC)c(NC(=O)N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000821482822 606577781 /nfs/dbraw/zinc/57/77/81/606577781.db2.gz VKHSHFIAZTYECY-CYBMUJFWSA-N -1 3 364.453 3.874 20 0 FHADHM CCc1ccc(CC)c(NC(=O)N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000821482822 606577783 /nfs/dbraw/zinc/57/77/83/606577783.db2.gz VKHSHFIAZTYECY-CYBMUJFWSA-N -1 3 364.453 3.874 20 0 FHADHM CC(C)CC(C)(C)CNC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000820051737 606587652 /nfs/dbraw/zinc/58/76/52/606587652.db2.gz UWBQEIVDNUTSMU-UHFFFAOYSA-N -1 3 370.501 3.613 20 0 FHADHM CC(C)CC(C)(C)CNC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000820051737 606587654 /nfs/dbraw/zinc/58/76/54/606587654.db2.gz UWBQEIVDNUTSMU-UHFFFAOYSA-N -1 3 370.501 3.613 20 0 FHADHM COc1cccc([C@@H](C)CC(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c1 ZINC000821860011 606601046 /nfs/dbraw/zinc/60/10/46/606601046.db2.gz VXDUZCQCXOUBSQ-NSHDSACASA-N -1 3 371.828 3.661 20 0 FHADHM COc1cccc([C@@H](C)CC(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c1 ZINC000821860011 606601048 /nfs/dbraw/zinc/60/10/48/606601048.db2.gz VXDUZCQCXOUBSQ-NSHDSACASA-N -1 3 371.828 3.661 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccc2ccccc2c1 ZINC000819865374 606602113 /nfs/dbraw/zinc/60/21/13/606602113.db2.gz DLKXTLMUCNSTFZ-GFCCVEGCSA-N -1 3 361.380 3.901 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccc2ccccc2c1 ZINC000819865374 606602115 /nfs/dbraw/zinc/60/21/15/606602115.db2.gz DLKXTLMUCNSTFZ-GFCCVEGCSA-N -1 3 361.380 3.901 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)C/C=C/c1ccc(C)cc1 ZINC000821406412 606619737 /nfs/dbraw/zinc/61/97/37/606619737.db2.gz DHIYOPMTINKNOO-SNAWJCMRSA-N -1 3 363.421 3.616 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)C/C=C/c1ccc(C)cc1 ZINC000821406412 606619738 /nfs/dbraw/zinc/61/97/38/606619738.db2.gz DHIYOPMTINKNOO-SNAWJCMRSA-N -1 3 363.421 3.616 20 0 FHADHM Cc1ccc2nc(CSc3ccc(Cl)cc3-c3nnn[n-]3)cn2c1 ZINC000822280296 606628954 /nfs/dbraw/zinc/62/89/54/606628954.db2.gz JXCSADLKTLYMLR-UHFFFAOYSA-N -1 3 356.842 3.769 20 0 FHADHM Cc1ccc2nc(CSc3ccc(Cl)cc3-c3nn[n-]n3)cn2c1 ZINC000822280296 606628956 /nfs/dbraw/zinc/62/89/56/606628956.db2.gz JXCSADLKTLYMLR-UHFFFAOYSA-N -1 3 356.842 3.769 20 0 FHADHM O=C(CSc1ccc(Cl)cc1-c1nnn[n-]1)c1c[nH]c2ccccc21 ZINC000823066367 606629520 /nfs/dbraw/zinc/62/95/20/606629520.db2.gz WQKWXHMTUUOULT-UHFFFAOYSA-N -1 3 369.837 3.976 20 0 FHADHM O=C(CSc1ccc(Cl)cc1-c1nn[n-]n1)c1c[nH]c2ccccc21 ZINC000823066367 606629521 /nfs/dbraw/zinc/62/95/21/606629521.db2.gz WQKWXHMTUUOULT-UHFFFAOYSA-N -1 3 369.837 3.976 20 0 FHADHM CC[C@H](C)Oc1ccc(C(=O)Nc2cc(-c3nnn[n-]3)ccc2C)cc1 ZINC000820876688 606629640 /nfs/dbraw/zinc/62/96/40/606629640.db2.gz RZPRYHDMZGLJHR-ZDUSSCGKSA-N -1 3 351.410 3.605 20 0 FHADHM CC[C@H](C)Oc1ccc(C(=O)Nc2cc(-c3nn[n-]n3)ccc2C)cc1 ZINC000820876688 606629642 /nfs/dbraw/zinc/62/96/42/606629642.db2.gz RZPRYHDMZGLJHR-ZDUSSCGKSA-N -1 3 351.410 3.605 20 0 FHADHM CCN(C(=O)CSc1ccc(Cl)cc1-c1nnn[n-]1)c1ccccc1 ZINC000821155073 606630520 /nfs/dbraw/zinc/63/05/20/606630520.db2.gz VNNSLPIMNGKJEZ-UHFFFAOYSA-N -1 3 373.869 3.665 20 0 FHADHM CCN(C(=O)CSc1ccc(Cl)cc1-c1nn[n-]n1)c1ccccc1 ZINC000821155073 606630521 /nfs/dbraw/zinc/63/05/21/606630521.db2.gz VNNSLPIMNGKJEZ-UHFFFAOYSA-N -1 3 373.869 3.665 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)C=C(C)c1cccc(Cl)c1 ZINC000821755893 606630602 /nfs/dbraw/zinc/63/06/02/606630602.db2.gz JYCQBXVBWMHQKB-DHZHZOJOSA-N -1 3 369.812 3.571 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)C=C(C)c1cccc(Cl)c1 ZINC000821755893 606630603 /nfs/dbraw/zinc/63/06/03/606630603.db2.gz JYCQBXVBWMHQKB-DHZHZOJOSA-N -1 3 369.812 3.571 20 0 FHADHM Cc1ccc(NC(=O)CSc2ccc(Cl)cc2-c2nnn[n-]2)c(C)c1 ZINC000822248727 606630694 /nfs/dbraw/zinc/63/06/94/606630694.db2.gz LAZSBCBKANAFSW-UHFFFAOYSA-N -1 3 373.869 3.868 20 0 FHADHM Cc1ccc(NC(=O)CSc2ccc(Cl)cc2-c2nn[n-]n2)c(C)c1 ZINC000822248727 606630695 /nfs/dbraw/zinc/63/06/95/606630695.db2.gz LAZSBCBKANAFSW-UHFFFAOYSA-N -1 3 373.869 3.868 20 0 FHADHM COC(=O)c1ccc([C@H](C)Sc2ccc(Cl)cc2-c2nnn[n-]2)o1 ZINC000821668747 606630983 /nfs/dbraw/zinc/63/09/83/606630983.db2.gz GYEDEPLZJNXXSD-QMMMGPOBSA-N -1 3 364.814 3.753 20 0 FHADHM COC(=O)c1ccc([C@H](C)Sc2ccc(Cl)cc2-c2nn[n-]n2)o1 ZINC000821668747 606630985 /nfs/dbraw/zinc/63/09/85/606630985.db2.gz GYEDEPLZJNXXSD-QMMMGPOBSA-N -1 3 364.814 3.753 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1OCc1ncc(-c2cccc(F)c2)o1 ZINC000822137691 606637895 /nfs/dbraw/zinc/63/78/95/606637895.db2.gz WJOACIGQMYVOLL-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM Cc1ccc(-c2nc(CN[C@H](C)c3cccc(-c4nn[n-]n4)c3)co2)cc1 ZINC000822213766 606640380 /nfs/dbraw/zinc/64/03/80/606640380.db2.gz AANWNCRCAISZSO-CQSZACIVSA-N -1 3 360.421 3.681 20 0 FHADHM Cc1ccc(-c2nc(CN[C@@H](C)c3cccc(-c4nn[n-]n4)c3)co2)cc1 ZINC000822213765 606640383 /nfs/dbraw/zinc/64/03/83/606640383.db2.gz AANWNCRCAISZSO-AWEZNQCLSA-N -1 3 360.421 3.681 20 0 FHADHM O=C(Oc1cccc(Cl)c1Cl)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000823453839 606664301 /nfs/dbraw/zinc/66/43/01/606664301.db2.gz BKRNURYYBDBZGG-UHFFFAOYSA-N -1 3 371.130 3.671 20 0 FHADHM O=C(Oc1cccc(Cl)c1Cl)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000823453839 606664302 /nfs/dbraw/zinc/66/43/02/606664302.db2.gz BKRNURYYBDBZGG-UHFFFAOYSA-N -1 3 371.130 3.671 20 0 FHADHM CC(C)(C)[C@H](NC(=O)c1c(F)cc(-c2nnn[n-]2)cc1F)c1ccccc1 ZINC000819899080 606671636 /nfs/dbraw/zinc/67/16/36/606671636.db2.gz NATDESGIPMBXET-MRXNPFEDSA-N -1 3 371.391 3.662 20 0 FHADHM CC(C)(C)[C@H](NC(=O)c1c(F)cc(-c2nn[n-]n2)cc1F)c1ccccc1 ZINC000819899080 606671637 /nfs/dbraw/zinc/67/16/37/606671637.db2.gz NATDESGIPMBXET-MRXNPFEDSA-N -1 3 371.391 3.662 20 0 FHADHM CC[C@@H]1CCc2ccccc2N1C(=O)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000820989150 606685649 /nfs/dbraw/zinc/68/56/49/606685649.db2.gz MTILAFWZHMNFSO-CYBMUJFWSA-N -1 3 369.375 3.517 20 0 FHADHM CC[C@@H]1CCc2ccccc2N1C(=O)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000820989150 606685650 /nfs/dbraw/zinc/68/56/50/606685650.db2.gz MTILAFWZHMNFSO-CYBMUJFWSA-N -1 3 369.375 3.517 20 0 FHADHM CC(C)(C)c1csc(CN(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)n1 ZINC000819965473 606705770 /nfs/dbraw/zinc/70/57/70/606705770.db2.gz HVBUEBYFSSQIFF-UHFFFAOYSA-N -1 3 368.510 3.785 20 0 FHADHM CC(C)(C)c1csc(CN(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)n1 ZINC000819965473 606705772 /nfs/dbraw/zinc/70/57/72/606705772.db2.gz HVBUEBYFSSQIFF-UHFFFAOYSA-N -1 3 368.510 3.785 20 0 FHADHM Fc1ccc([C@@H]2CCN(c3cc(-c4nnn[n-]4)c4ccccc4n3)C2)cc1 ZINC000822767031 606728676 /nfs/dbraw/zinc/72/86/76/606728676.db2.gz UDPCIMDICQSVSD-CQSZACIVSA-N -1 3 360.396 3.548 20 0 FHADHM Fc1ccc([C@@H]2CCN(c3cc(-c4nn[n-]n4)c4ccccc4n3)C2)cc1 ZINC000822767031 606728678 /nfs/dbraw/zinc/72/86/78/606728678.db2.gz UDPCIMDICQSVSD-CQSZACIVSA-N -1 3 360.396 3.548 20 0 FHADHM O=C(O[C@@H]1CC[C@@H]2CCCC[C@H]2C1)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000823391825 606748470 /nfs/dbraw/zinc/74/84/70/606748470.db2.gz GPDBPQZETNJKBH-GMXVVIOVSA-N -1 3 362.380 3.661 20 0 FHADHM O=C(O[C@@H]1CC[C@@H]2CCCC[C@H]2C1)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000823391825 606748472 /nfs/dbraw/zinc/74/84/72/606748472.db2.gz GPDBPQZETNJKBH-GMXVVIOVSA-N -1 3 362.380 3.661 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1Oc1ccc(-c2nc(C3CC3)no2)cc1 ZINC000822136719 606763418 /nfs/dbraw/zinc/76/34/18/606763418.db2.gz ORBZALHVWRRBTQ-UHFFFAOYSA-N -1 3 360.377 3.895 20 0 FHADHM CCC1(CNC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)CCCC1 ZINC000820962602 606775175 /nfs/dbraw/zinc/77/51/75/606775175.db2.gz VKFPSVLJCVNELX-UHFFFAOYSA-N -1 3 370.501 3.757 20 0 FHADHM CCC1(CNC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)CCCC1 ZINC000820962602 606775177 /nfs/dbraw/zinc/77/51/77/606775177.db2.gz VKFPSVLJCVNELX-UHFFFAOYSA-N -1 3 370.501 3.757 20 0 FHADHM Fc1cccc(-c2nc(COc3cc(Cl)ccc3-c3nnn[n-]3)co2)c1 ZINC000822786231 606783009 /nfs/dbraw/zinc/78/30/09/606783009.db2.gz FOGMLGYTHKMNMK-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM Fc1cccc(-c2nc(COc3cc(Cl)ccc3-c3nn[n-]n3)co2)c1 ZINC000822786231 606783012 /nfs/dbraw/zinc/78/30/12/606783012.db2.gz FOGMLGYTHKMNMK-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM CCN(C(=O)c1cc(F)cc(Cl)c1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821160046 606787078 /nfs/dbraw/zinc/78/70/78/606787078.db2.gz GHFADZVQKIPHPR-NSHDSACASA-N -1 3 373.819 3.883 20 0 FHADHM CCN(C(=O)c1cc(F)cc(Cl)c1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821160046 606787081 /nfs/dbraw/zinc/78/70/81/606787081.db2.gz GHFADZVQKIPHPR-NSHDSACASA-N -1 3 373.819 3.883 20 0 FHADHM Cc1ccc(C)c([C@H]2CCCN2C(=O)C=Cc2ccccc2-c2nnn[n-]2)c1 ZINC000822230776 606807510 /nfs/dbraw/zinc/80/75/10/606807510.db2.gz QEMWRZVPSMPGGW-YVNCXZRQSA-N -1 3 373.460 3.860 20 0 FHADHM Cc1ccc(C)c([C@H]2CCCN2C(=O)C=Cc2ccccc2-c2nn[n-]n2)c1 ZINC000822230776 606807512 /nfs/dbraw/zinc/80/75/12/606807512.db2.gz QEMWRZVPSMPGGW-YVNCXZRQSA-N -1 3 373.460 3.860 20 0 FHADHM CC(C)N(C(=O)CS[C@H](C)c1ccc(-c2nnn[n-]2)cc1)C1CCCC1 ZINC000820548950 606827816 /nfs/dbraw/zinc/82/78/16/606827816.db2.gz JCFNVCLVPWWBTB-CQSZACIVSA-N -1 3 373.526 3.841 20 0 FHADHM CC(C)N(C(=O)CS[C@H](C)c1ccc(-c2nn[n-]n2)cc1)C1CCCC1 ZINC000820548950 606827817 /nfs/dbraw/zinc/82/78/17/606827817.db2.gz JCFNVCLVPWWBTB-CQSZACIVSA-N -1 3 373.526 3.841 20 0 FHADHM CC(C)(C)OCCCSCCCOc1ccc(-c2nn[n-]n2)cc1 ZINC000819951303 606847278 /nfs/dbraw/zinc/84/72/78/606847278.db2.gz RHYNUJWZGQARNJ-UHFFFAOYSA-N -1 3 350.488 3.574 20 0 FHADHM Cc1cc(F)c(C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)cc1F ZINC000822202226 606861065 /nfs/dbraw/zinc/86/10/65/606861065.db2.gz QPELGDYTMPSJKM-UHFFFAOYSA-N -1 3 371.391 3.504 20 0 FHADHM Cc1cc(F)c(C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)cc1F ZINC000822202226 606861067 /nfs/dbraw/zinc/86/10/67/606861067.db2.gz QPELGDYTMPSJKM-UHFFFAOYSA-N -1 3 371.391 3.504 20 0 FHADHM CC1(C)CCCC[C@@H]1NC(=O)CCCCOc1cccc(-c2nnn[n-]2)c1 ZINC000820596408 606873857 /nfs/dbraw/zinc/87/38/57/606873857.db2.gz PFYCBDQXTLEPRU-KRWDZBQOSA-N -1 3 371.485 3.501 20 0 FHADHM CC1(C)CCCC[C@@H]1NC(=O)CCCCOc1cccc(-c2nn[n-]n2)c1 ZINC000820596408 606873859 /nfs/dbraw/zinc/87/38/59/606873859.db2.gz PFYCBDQXTLEPRU-KRWDZBQOSA-N -1 3 371.485 3.501 20 0 FHADHM C[C@@H]1CC[C@@H](C)N1C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000820684770 606879406 /nfs/dbraw/zinc/87/94/06/606879406.db2.gz SABCDIZYEFWFCP-ZIAGYGMSSA-N -1 3 363.421 3.672 20 0 FHADHM C[C@@H]1CC[C@@H](C)N1C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000820684770 606879407 /nfs/dbraw/zinc/87/94/07/606879407.db2.gz SABCDIZYEFWFCP-ZIAGYGMSSA-N -1 3 363.421 3.672 20 0 FHADHM Cc1cc(N[C@H]2CCC(F)(F)C2)n2c3ccccc3nc2c1-c1nnn[n-]1 ZINC000822209531 606881386 /nfs/dbraw/zinc/88/13/86/606881386.db2.gz MQZXMVWCDAUFAQ-NSHDSACASA-N -1 3 369.379 3.576 20 0 FHADHM Cc1cc(N[C@H]2CCC(F)(F)C2)n2c3ccccc3nc2c1-c1nn[n-]n1 ZINC000822209531 606881387 /nfs/dbraw/zinc/88/13/87/606881387.db2.gz MQZXMVWCDAUFAQ-NSHDSACASA-N -1 3 369.379 3.576 20 0 FHADHM FC(F)(F)c1ccc(N2CCC[C@H]2c2ccccn2)c(-c2nnn[n-]2)c1 ZINC000822723648 606924957 /nfs/dbraw/zinc/92/49/57/606924957.db2.gz JJCAHHGEEZXCMH-HNNXBMFYSA-N -1 3 360.343 3.622 20 0 FHADHM FC(F)(F)c1ccc(N2CCC[C@H]2c2ccccn2)c(-c2nn[n-]n2)c1 ZINC000822723648 606924959 /nfs/dbraw/zinc/92/49/59/606924959.db2.gz JJCAHHGEEZXCMH-HNNXBMFYSA-N -1 3 360.343 3.622 20 0 FHADHM CN(C(=O)c1cc2cc(Cl)ccc2o1)c1ccccc1-c1nnn[n-]1 ZINC000821573377 606973144 /nfs/dbraw/zinc/97/31/44/606973144.db2.gz NYETVCSCUXMCFQ-UHFFFAOYSA-N -1 3 353.769 3.543 20 0 FHADHM CN(C(=O)c1cc2cc(Cl)ccc2o1)c1ccccc1-c1nn[n-]n1 ZINC000821573377 606973146 /nfs/dbraw/zinc/97/31/46/606973146.db2.gz NYETVCSCUXMCFQ-UHFFFAOYSA-N -1 3 353.769 3.543 20 0 FHADHM Cc1cccc(C)c1CNC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000822293575 606978926 /nfs/dbraw/zinc/97/89/26/606978926.db2.gz COMFUCQOZVHMID-UHFFFAOYSA-N -1 3 372.885 3.624 20 0 FHADHM Cc1cccc(C)c1CNC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000822293575 606978927 /nfs/dbraw/zinc/97/89/27/606978927.db2.gz COMFUCQOZVHMID-UHFFFAOYSA-N -1 3 372.885 3.624 20 0 FHADHM Cc1cc(Cl)ccc1NC(=O)C(C)(C)Oc1ccc(-c2nnn[n-]2)cc1 ZINC000822201934 606985779 /nfs/dbraw/zinc/98/57/79/606985779.db2.gz CIAYMFFARBZXOZ-UHFFFAOYSA-N -1 3 371.828 3.625 20 0 FHADHM Cc1cc(Cl)ccc1NC(=O)C(C)(C)Oc1ccc(-c2nn[n-]n2)cc1 ZINC000822201934 606985781 /nfs/dbraw/zinc/98/57/81/606985781.db2.gz CIAYMFFARBZXOZ-UHFFFAOYSA-N -1 3 371.828 3.625 20 0 FHADHM Cc1ccc(NC(=O)[C@H](C)Sc2cccc(-c3nnn[n-]3)c2)cc1C ZINC000822242653 607012062 /nfs/dbraw/zinc/01/20/62/607012062.db2.gz SJURLPOEENTUON-ZDUSSCGKSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1ccc(NC(=O)[C@H](C)Sc2cccc(-c3nn[n-]n3)c2)cc1C ZINC000822242653 607012064 /nfs/dbraw/zinc/01/20/64/607012064.db2.gz SJURLPOEENTUON-ZDUSSCGKSA-N -1 3 353.451 3.603 20 0 FHADHM CC(C)(C)c1ccccc1NC(=O)CSc1cccc(-c2nnn[n-]2)c1 ZINC000819959102 607016269 /nfs/dbraw/zinc/01/62/69/607016269.db2.gz YFQPCFVYOJOPAV-UHFFFAOYSA-N -1 3 367.478 3.895 20 0 FHADHM CC(C)(C)c1ccccc1NC(=O)CSc1cccc(-c2nn[n-]n2)c1 ZINC000819959102 607016272 /nfs/dbraw/zinc/01/62/72/607016272.db2.gz YFQPCFVYOJOPAV-UHFFFAOYSA-N -1 3 367.478 3.895 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1OCc1csc(-c2cccs2)n1 ZINC000822221641 607031376 /nfs/dbraw/zinc/03/13/76/607031376.db2.gz YYLNCMFPZXEFHX-UHFFFAOYSA-N -1 3 355.448 3.939 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1OCc1csc(-c2cccs2)n1 ZINC000822221641 607031378 /nfs/dbraw/zinc/03/13/78/607031378.db2.gz YYLNCMFPZXEFHX-UHFFFAOYSA-N -1 3 355.448 3.939 20 0 FHADHM CCCCc1noc([C@@H](C)SCc2cc(F)ccc2-c2nnn[n-]2)n1 ZINC000821082196 607034537 /nfs/dbraw/zinc/03/45/37/607034537.db2.gz IGLHPXIKXLNYGO-SNVBAGLBSA-N -1 3 362.434 3.726 20 0 FHADHM CCCCc1noc([C@@H](C)SCc2cc(F)ccc2-c2nn[n-]n2)n1 ZINC000821082196 607034539 /nfs/dbraw/zinc/03/45/39/607034539.db2.gz IGLHPXIKXLNYGO-SNVBAGLBSA-N -1 3 362.434 3.726 20 0 FHADHM Cc1cc(C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)ccc1Cl ZINC000822169041 607035187 /nfs/dbraw/zinc/03/51/87/607035187.db2.gz XFGMRDAARJGLGA-UHFFFAOYSA-N -1 3 369.856 3.879 20 0 FHADHM Cc1cc(C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)ccc1Cl ZINC000822169041 607035188 /nfs/dbraw/zinc/03/51/88/607035188.db2.gz XFGMRDAARJGLGA-UHFFFAOYSA-N -1 3 369.856 3.879 20 0 FHADHM Cc1ccc(Cl)c(OC(=O)C(C)(C)Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000822239853 607080104 /nfs/dbraw/zinc/08/01/04/607080104.db2.gz HPFXQTDMTKDTSE-UHFFFAOYSA-N -1 3 372.812 3.592 20 0 FHADHM Cc1ccc(Cl)c(OC(=O)C(C)(C)Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000822239853 607080106 /nfs/dbraw/zinc/08/01/06/607080106.db2.gz HPFXQTDMTKDTSE-UHFFFAOYSA-N -1 3 372.812 3.592 20 0 FHADHM C[C@@H]1CN(c2cc(Cl)ccc2-c2nnn[n-]2)C[C@H](c2ccsc2)O1 ZINC000820768324 607115715 /nfs/dbraw/zinc/11/57/15/607115715.db2.gz MNNVRRSDJJKCGM-MEBBXXQBSA-N -1 3 361.858 3.548 20 0 FHADHM C[C@@H]1CN(c2cc(Cl)ccc2-c2nn[n-]n2)C[C@H](c2ccsc2)O1 ZINC000820768324 607115716 /nfs/dbraw/zinc/11/57/16/607115716.db2.gz MNNVRRSDJJKCGM-MEBBXXQBSA-N -1 3 361.858 3.548 20 0 FHADHM Fc1ccc(NCc2cnc(-c3ccccc3)s2)cc1-c1nnn[n-]1 ZINC000822782805 607126359 /nfs/dbraw/zinc/12/63/59/607126359.db2.gz HNVSPIHDGSCJJV-UHFFFAOYSA-N -1 3 352.398 3.741 20 0 FHADHM Fc1ccc(NCc2cnc(-c3ccccc3)s2)cc1-c1nn[n-]n1 ZINC000822782805 607126360 /nfs/dbraw/zinc/12/63/60/607126360.db2.gz HNVSPIHDGSCJJV-UHFFFAOYSA-N -1 3 352.398 3.741 20 0 FHADHM CC(C)CC[C@H]1CCCN1C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000820073360 607140992 /nfs/dbraw/zinc/14/09/92/607140992.db2.gz SSGYGWCFYNMYBD-OAHLLOKOSA-N -1 3 373.505 3.856 20 0 FHADHM CC(C)CC[C@H]1CCCN1C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000820073360 607140993 /nfs/dbraw/zinc/14/09/93/607140993.db2.gz SSGYGWCFYNMYBD-OAHLLOKOSA-N -1 3 373.505 3.856 20 0 FHADHM CC[C@H](OC1CCCCC1)C(=O)Nc1sc(C)c(C)c1-c1nnn[n-]1 ZINC000820939031 607150100 /nfs/dbraw/zinc/15/01/00/607150100.db2.gz PAWIUGFBESBXJJ-ZDUSSCGKSA-N -1 3 363.487 3.611 20 0 FHADHM CC[C@H](OC1CCCCC1)C(=O)Nc1sc(C)c(C)c1-c1nn[n-]n1 ZINC000820939031 607150101 /nfs/dbraw/zinc/15/01/01/607150101.db2.gz PAWIUGFBESBXJJ-ZDUSSCGKSA-N -1 3 363.487 3.611 20 0 FHADHM CC(C)CC[C@H]1CCCN1C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820072292 607153009 /nfs/dbraw/zinc/15/30/09/607153009.db2.gz DTVGFJPZZWAPGT-WMLDXEAASA-N -1 3 356.474 3.538 20 0 FHADHM CC(C)CC[C@H]1CCCN1C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820072292 607153011 /nfs/dbraw/zinc/15/30/11/607153011.db2.gz DTVGFJPZZWAPGT-WMLDXEAASA-N -1 3 356.474 3.538 20 0 FHADHM CC(C)c1ccc(NCc2nnc(-c3cccc(-c4nnn[n-]4)c3)o2)cc1 ZINC000820191972 607166492 /nfs/dbraw/zinc/16/64/92/607166492.db2.gz CHROTEBCOJYMKV-UHFFFAOYSA-N -1 3 361.409 3.652 20 0 FHADHM CC(C)c1ccc(NCc2nnc(-c3cccc(-c4nn[n-]n4)c3)o2)cc1 ZINC000820191972 607166493 /nfs/dbraw/zinc/16/64/93/607166493.db2.gz CHROTEBCOJYMKV-UHFFFAOYSA-N -1 3 361.409 3.652 20 0 FHADHM CC[C@@H](Nc1ccc(C(F)(F)F)cc1-c1nnn[n-]1)C1CCOCC1 ZINC000820925083 607173648 /nfs/dbraw/zinc/17/36/48/607173648.db2.gz DBLXMPYCYHSQOL-CYBMUJFWSA-N -1 3 355.364 3.503 20 0 FHADHM CC[C@@H](Nc1ccc(C(F)(F)F)cc1-c1nn[n-]n1)C1CCOCC1 ZINC000820925083 607173649 /nfs/dbraw/zinc/17/36/49/607173649.db2.gz DBLXMPYCYHSQOL-CYBMUJFWSA-N -1 3 355.364 3.503 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccc(-n2cccc2)cc1 ZINC000823319104 607191232 /nfs/dbraw/zinc/19/12/32/607191232.db2.gz RCSFIEDETJSTJJ-UHFFFAOYSA-N -1 3 364.796 3.563 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccc(-n2cccc2)cc1 ZINC000823319104 607191233 /nfs/dbraw/zinc/19/12/33/607191233.db2.gz RCSFIEDETJSTJJ-UHFFFAOYSA-N -1 3 364.796 3.563 20 0 FHADHM O=C(Nc1cc(C(F)F)ccc1Cl)c1cc(-c2nnn[n-]2)cs1 ZINC000823299449 607192699 /nfs/dbraw/zinc/19/26/99/607192699.db2.gz XSIRZPQCUNSILP-UHFFFAOYSA-N -1 3 355.757 3.772 20 0 FHADHM O=C(Nc1cc(C(F)F)ccc1Cl)c1cc(-c2nn[n-]n2)cs1 ZINC000823299449 607192700 /nfs/dbraw/zinc/19/27/00/607192700.db2.gz XSIRZPQCUNSILP-UHFFFAOYSA-N -1 3 355.757 3.772 20 0 FHADHM CCC[C@@H](C)[C@H]1CCCN1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000821015619 607197209 /nfs/dbraw/zinc/19/72/09/607197209.db2.gz RMUHDGVVZMZCJK-IAQYHMDHSA-N -1 3 362.865 3.953 20 0 FHADHM CCC[C@@H](C)[C@H]1CCCN1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000821015619 607197210 /nfs/dbraw/zinc/19/72/10/607197210.db2.gz RMUHDGVVZMZCJK-IAQYHMDHSA-N -1 3 362.865 3.953 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N1CC[C@@H](c2ccccc2)C1 ZINC000823313527 607198492 /nfs/dbraw/zinc/19/84/92/607198492.db2.gz DNVFLSYCJOYMCH-CQSZACIVSA-N -1 3 368.828 3.542 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N1CC[C@@H](c2ccccc2)C1 ZINC000823313527 607198493 /nfs/dbraw/zinc/19/84/93/607198493.db2.gz DNVFLSYCJOYMCH-CQSZACIVSA-N -1 3 368.828 3.542 20 0 FHADHM CC(C)CN(C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)C1CCCC1 ZINC000820081626 607200761 /nfs/dbraw/zinc/20/07/61/607200761.db2.gz OHXMOJGOPFJLJN-UHFFFAOYSA-N -1 3 362.865 3.953 20 0 FHADHM CC(C)CN(C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)C1CCCC1 ZINC000820081626 607200762 /nfs/dbraw/zinc/20/07/62/607200762.db2.gz OHXMOJGOPFJLJN-UHFFFAOYSA-N -1 3 362.865 3.953 20 0 FHADHM COCc1ccccc1CNc1cc(-c2nnn[n-]2)ccc1C(F)(F)F ZINC000821695957 607227420 /nfs/dbraw/zinc/22/74/20/607227420.db2.gz OXRFLFLVPSWYIA-UHFFFAOYSA-N -1 3 363.343 3.644 20 0 FHADHM COCc1ccccc1CNc1cc(-c2nn[n-]n2)ccc1C(F)(F)F ZINC000821695957 607227421 /nfs/dbraw/zinc/22/74/21/607227421.db2.gz OXRFLFLVPSWYIA-UHFFFAOYSA-N -1 3 363.343 3.644 20 0 FHADHM Cc1cc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCCC3)oc1C ZINC000822182918 607235868 /nfs/dbraw/zinc/23/58/68/607235868.db2.gz DLUAETGKPPZQKD-UHFFFAOYSA-N -1 3 357.439 3.659 20 0 FHADHM Cc1cc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCCC3)oc1C ZINC000822182918 607235869 /nfs/dbraw/zinc/23/58/69/607235869.db2.gz DLUAETGKPPZQKD-UHFFFAOYSA-N -1 3 357.439 3.659 20 0 FHADHM CC[C@H](Cc1ccccc1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820914604 607241308 /nfs/dbraw/zinc/24/13/08/607241308.db2.gz PWEDGGKOMVFITG-CYBMUJFWSA-N -1 3 355.829 3.728 20 0 FHADHM CC[C@H](Cc1ccccc1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820914604 607241309 /nfs/dbraw/zinc/24/13/09/607241309.db2.gz PWEDGGKOMVFITG-CYBMUJFWSA-N -1 3 355.829 3.728 20 0 FHADHM CC(C)COc1cccc(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)c1 ZINC000820103036 607242048 /nfs/dbraw/zinc/24/20/48/607242048.db2.gz ODUMJJWBVNOJNZ-UHFFFAOYSA-N -1 3 371.828 3.807 20 0 FHADHM CC(C)COc1cccc(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)c1 ZINC000820103036 607242049 /nfs/dbraw/zinc/24/20/49/607242049.db2.gz ODUMJJWBVNOJNZ-UHFFFAOYSA-N -1 3 371.828 3.807 20 0 FHADHM CC[C@H](C)c1ccccc1OCC(=O)Oc1ccc(-c2nnn[n-]2)cc1F ZINC000820881802 607250489 /nfs/dbraw/zinc/25/04/89/607250489.db2.gz DBGSMYILWLGELH-LBPRGKRZSA-N -1 3 370.384 3.504 20 0 FHADHM CC[C@H](C)c1ccccc1OCC(=O)Oc1ccc(-c2nn[n-]n2)cc1F ZINC000820881802 607250490 /nfs/dbraw/zinc/25/04/90/607250490.db2.gz DBGSMYILWLGELH-LBPRGKRZSA-N -1 3 370.384 3.504 20 0 FHADHM CC1(C)C[C@H](NC(=S)Nc2ccccc2-c2nnn[n-]2)c2ccccc21 ZINC000820589716 607251525 /nfs/dbraw/zinc/25/15/25/607251525.db2.gz LIOQMGMDXGMOFL-INIZCTEOSA-N -1 3 364.478 3.576 20 0 FHADHM CC1(C)C[C@H](NC(=S)Nc2ccccc2-c2nn[n-]n2)c2ccccc21 ZINC000820589716 607251526 /nfs/dbraw/zinc/25/15/26/607251526.db2.gz LIOQMGMDXGMOFL-INIZCTEOSA-N -1 3 364.478 3.576 20 0 FHADHM C[C@H](CC(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(F)cc1F ZINC000824384533 607777774 /nfs/dbraw/zinc/77/77/74/607777774.db2.gz CZCQRKNXXNEPPL-VXGBXAGGSA-N -1 3 372.375 3.943 20 0 FHADHM C[C@H](CC(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(F)cc1F ZINC000824384533 607777775 /nfs/dbraw/zinc/77/77/75/607777775.db2.gz CZCQRKNXXNEPPL-VXGBXAGGSA-N -1 3 372.375 3.943 20 0 FHADHM O=C(c1ccc(-c2nnn[n-]2)cc1)N1CCCc2cc(Cl)cc(Cl)c21 ZINC000826471572 607791906 /nfs/dbraw/zinc/79/19/06/607791906.db2.gz FEEIHIFZTUGSRI-UHFFFAOYSA-N -1 3 374.231 3.767 20 0 FHADHM O=C(c1ccc(-c2nn[n-]n2)cc1)N1CCCc2cc(Cl)cc(Cl)c21 ZINC000826471572 607791907 /nfs/dbraw/zinc/79/19/07/607791907.db2.gz FEEIHIFZTUGSRI-UHFFFAOYSA-N -1 3 374.231 3.767 20 0 FHADHM Cc1ccc(Cl)cc1C(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C(C)C ZINC000826288973 607794200 /nfs/dbraw/zinc/79/42/00/607794200.db2.gz FGMHJSJONXOGDS-UHFFFAOYSA-N -1 3 369.856 3.879 20 0 FHADHM Cc1ccc(Cl)cc1C(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C(C)C ZINC000826288973 607794201 /nfs/dbraw/zinc/79/42/01/607794201.db2.gz FGMHJSJONXOGDS-UHFFFAOYSA-N -1 3 369.856 3.879 20 0 FHADHM CC[C@@H](C)Oc1ccc(C(=O)N(CC)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000825074376 607796730 /nfs/dbraw/zinc/79/67/30/607796730.db2.gz HJVJMWGCGBCSIE-CQSZACIVSA-N -1 3 365.437 3.711 20 0 FHADHM CC[C@@H](C)Oc1ccc(C(=O)N(CC)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000825074376 607796731 /nfs/dbraw/zinc/79/67/31/607796731.db2.gz HJVJMWGCGBCSIE-CQSZACIVSA-N -1 3 365.437 3.711 20 0 FHADHM CCN(C(=O)C[C@H](C)c1cccc(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825367569 607798126 /nfs/dbraw/zinc/79/81/26/607798126.db2.gz SQRHPYOIMAXGLQ-ZDUSSCGKSA-N -1 3 353.401 3.553 20 0 FHADHM CCN(C(=O)C[C@H](C)c1cccc(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825367569 607798127 /nfs/dbraw/zinc/79/81/27/607798127.db2.gz SQRHPYOIMAXGLQ-ZDUSSCGKSA-N -1 3 353.401 3.553 20 0 FHADHM CCc1cccc2c(CC(=O)N(CC)c3ccc(-c4nnn[n-]4)cc3)c[nH]c21 ZINC000825722918 607799566 /nfs/dbraw/zinc/79/95/66/607799566.db2.gz OEPSYRVYBSFWKM-UHFFFAOYSA-N -1 3 374.448 3.506 20 0 FHADHM CCc1cccc2c(CC(=O)N(CC)c3ccc(-c4nn[n-]n4)cc3)c[nH]c21 ZINC000825722918 607799567 /nfs/dbraw/zinc/79/95/67/607799567.db2.gz OEPSYRVYBSFWKM-UHFFFAOYSA-N -1 3 374.448 3.506 20 0 FHADHM Fc1cccc(N[C@@H](C[C@H]2CCOC2)c2ccccc2)c1-c1nnn[n-]1 ZINC000826377274 607811130 /nfs/dbraw/zinc/81/11/30/607811130.db2.gz LGSVYXROKUUYGT-DYVFJYSZSA-N -1 3 353.401 3.586 20 0 FHADHM Fc1cccc(N[C@@H](C[C@H]2CCOC2)c2ccccc2)c1-c1nn[n-]n1 ZINC000826377274 607811131 /nfs/dbraw/zinc/81/11/31/607811131.db2.gz LGSVYXROKUUYGT-DYVFJYSZSA-N -1 3 353.401 3.586 20 0 FHADHM C[C@H](NC(=O)CCC(C)(C)c1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824480473 607816093 /nfs/dbraw/zinc/81/60/93/607816093.db2.gz WNVCIDWKZJDCLF-HNNXBMFYSA-N -1 3 363.465 3.802 20 0 FHADHM C[C@H](NC(=O)CCC(C)(C)c1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824480473 607816094 /nfs/dbraw/zinc/81/60/94/607816094.db2.gz WNVCIDWKZJDCLF-HNNXBMFYSA-N -1 3 363.465 3.802 20 0 FHADHM Clc1ccccc1OC1CCN(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000826354004 607820319 /nfs/dbraw/zinc/82/03/19/607820319.db2.gz MDJHDGAREUDTMX-UHFFFAOYSA-N -1 3 355.829 3.568 20 0 FHADHM CCc1c(C)sc(NC(=O)C[C@H](C)c2c(C)noc2C)c1-c1nnn[n-]1 ZINC000825688115 607827182 /nfs/dbraw/zinc/82/71/82/607827182.db2.gz QHWSBCBOECKKDG-QMMMGPOBSA-N -1 3 374.470 3.536 20 0 FHADHM CCc1c(C)sc(NC(=O)C[C@H](C)c2c(C)noc2C)c1-c1nn[n-]n1 ZINC000825688115 607827183 /nfs/dbraw/zinc/82/71/83/607827183.db2.gz QHWSBCBOECKKDG-QMMMGPOBSA-N -1 3 374.470 3.536 20 0 FHADHM O=C(NC1CCCCCC1)c1c(Cl)cc(-c2nnn[n-]2)cc1Cl ZINC000826429746 607832907 /nfs/dbraw/zinc/83/29/07/607832907.db2.gz LZXBAZVMHWGAAJ-UHFFFAOYSA-N -1 3 354.241 3.626 20 0 FHADHM O=C(NC1CCCCCC1)c1c(Cl)cc(-c2nn[n-]n2)cc1Cl ZINC000826429746 607832908 /nfs/dbraw/zinc/83/29/08/607832908.db2.gz LZXBAZVMHWGAAJ-UHFFFAOYSA-N -1 3 354.241 3.626 20 0 FHADHM O[C@H](CSc1ccc(-c2nnn[n-]2)cc1Cl)c1c(F)cccc1F ZINC000826505347 607843312 /nfs/dbraw/zinc/84/33/12/607843312.db2.gz TVKVOJLPWRNVMM-GFCCVEGCSA-N -1 3 368.796 3.624 20 0 FHADHM O[C@H](CSc1ccc(-c2nn[n-]n2)cc1Cl)c1c(F)cccc1F ZINC000826505347 607843313 /nfs/dbraw/zinc/84/33/13/607843313.db2.gz TVKVOJLPWRNVMM-GFCCVEGCSA-N -1 3 368.796 3.624 20 0 FHADHM COc1ncc(CSc2ccc(-c3nnn[n-]3)cc2Cl)cc1Cl ZINC000826221966 607843869 /nfs/dbraw/zinc/84/38/69/607843869.db2.gz CJPHMVUBUKMMPG-UHFFFAOYSA-N -1 3 368.249 3.869 20 0 FHADHM COc1ncc(CSc2ccc(-c3nn[n-]n3)cc2Cl)cc1Cl ZINC000826221966 607843870 /nfs/dbraw/zinc/84/38/70/607843870.db2.gz CJPHMVUBUKMMPG-UHFFFAOYSA-N -1 3 368.249 3.869 20 0 FHADHM Cc1cccc2nc(CSc3ccc(-c4nnn[n-]4)cc3Cl)cn21 ZINC000826304943 607844684 /nfs/dbraw/zinc/84/46/84/607844684.db2.gz FEGOWSYSVLODLK-UHFFFAOYSA-N -1 3 356.842 3.769 20 0 FHADHM Cc1cccc2nc(CSc3ccc(-c4nn[n-]n4)cc3Cl)cn21 ZINC000826304943 607844685 /nfs/dbraw/zinc/84/46/85/607844685.db2.gz FEGOWSYSVLODLK-UHFFFAOYSA-N -1 3 356.842 3.769 20 0 FHADHM O=C(CSc1ccc(-c2nnn[n-]2)cc1Cl)c1ccc(F)cc1F ZINC000826420932 607844976 /nfs/dbraw/zinc/84/49/76/607844976.db2.gz JRVIWZMSMYTKBZ-UHFFFAOYSA-N -1 3 366.780 3.773 20 0 FHADHM O=C(CSc1ccc(-c2nn[n-]n2)cc1Cl)c1ccc(F)cc1F ZINC000826420932 607844977 /nfs/dbraw/zinc/84/49/77/607844977.db2.gz JRVIWZMSMYTKBZ-UHFFFAOYSA-N -1 3 366.780 3.773 20 0 FHADHM Cc1c(C(=O)N(C)c2cccc(-c3nnn[n-]3)c2)cccc1-c1ccccn1 ZINC000826234042 607861262 /nfs/dbraw/zinc/86/12/62/607861262.db2.gz FXJYGWJISGMVBJ-UHFFFAOYSA-N -1 3 370.416 3.514 20 0 FHADHM Cc1c(C(=O)N(C)c2cccc(-c3nn[n-]n3)c2)cccc1-c1ccccn1 ZINC000826234042 607861263 /nfs/dbraw/zinc/86/12/63/607861263.db2.gz FXJYGWJISGMVBJ-UHFFFAOYSA-N -1 3 370.416 3.514 20 0 FHADHM O[C@H](COc1ccc(Nc2ccccc2)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000826505397 607869930 /nfs/dbraw/zinc/86/99/30/607869930.db2.gz UTHCTKPZEJSMIF-HXUWFJFHSA-N -1 3 373.416 3.723 20 0 FHADHM O[C@H](COc1ccc(Nc2ccccc2)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000826505397 607869931 /nfs/dbraw/zinc/86/99/31/607869931.db2.gz UTHCTKPZEJSMIF-HXUWFJFHSA-N -1 3 373.416 3.723 20 0 FHADHM CCN(C(=O)c1ccc(C)cc1C)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825379509 607879160 /nfs/dbraw/zinc/87/91/60/607879160.db2.gz GOXHYINTFJZHCL-UHFFFAOYSA-N -1 3 355.829 3.804 20 0 FHADHM CCN(C(=O)c1ccc(C)cc1C)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825379509 607879161 /nfs/dbraw/zinc/87/91/61/607879161.db2.gz GOXHYINTFJZHCL-UHFFFAOYSA-N -1 3 355.829 3.804 20 0 FHADHM CC(C)[C@H](C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(F)cc1 ZINC000824470338 607905792 /nfs/dbraw/zinc/90/57/92/607905792.db2.gz HPXNIUKLBQJUAE-UGSOOPFHSA-N -1 3 367.428 3.623 20 0 FHADHM CC(C)[C@H](C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(F)cc1 ZINC000824470338 607905793 /nfs/dbraw/zinc/90/57/93/607905793.db2.gz HPXNIUKLBQJUAE-UGSOOPFHSA-N -1 3 367.428 3.623 20 0 FHADHM Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000826323749 607913042 /nfs/dbraw/zinc/91/30/42/607913042.db2.gz PVCJTTGHMOHBFE-LBPRGKRZSA-N -1 3 370.482 3.588 20 0 FHADHM Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)c1cccc(-c2nn[n-]n2)c1 ZINC000826323749 607913043 /nfs/dbraw/zinc/91/30/43/607913043.db2.gz PVCJTTGHMOHBFE-LBPRGKRZSA-N -1 3 370.482 3.588 20 0 FHADHM FC(F)(F)c1ccc(N2CCc3ccc(-c4nnn[n-]4)cc32)nc1Cl ZINC000826369254 607936051 /nfs/dbraw/zinc/93/60/51/607936051.db2.gz UHSCBVSQHZBODY-UHFFFAOYSA-N -1 3 366.734 3.628 20 0 FHADHM FC(F)(F)c1ccc(N2CCc3ccc(-c4nn[n-]n4)cc32)nc1Cl ZINC000826369254 607936052 /nfs/dbraw/zinc/93/60/52/607936052.db2.gz UHSCBVSQHZBODY-UHFFFAOYSA-N -1 3 366.734 3.628 20 0 FHADHM Cc1nnc(SCc2ccccc2-c2nnn[n-]2)n1[C@H]1CCC[C@H](C)C1 ZINC000826337323 607965847 /nfs/dbraw/zinc/96/58/47/607965847.db2.gz KJODEMHKRMVHMC-WFASDCNBSA-N -1 3 369.498 3.810 20 0 FHADHM Cc1nnc(SCc2ccccc2-c2nn[n-]n2)n1[C@H]1CCC[C@H](C)C1 ZINC000826337323 607965848 /nfs/dbraw/zinc/96/58/48/607965848.db2.gz KJODEMHKRMVHMC-WFASDCNBSA-N -1 3 369.498 3.810 20 0 FHADHM Cc1nnc(SCc2cccc(-c3nnn[n-]3)c2)n1[C@H]1CCC[C@H](C)C1 ZINC000826337722 607966170 /nfs/dbraw/zinc/96/61/70/607966170.db2.gz YWYRBVFRFZANRP-LRDDRELGSA-N -1 3 369.498 3.810 20 0 FHADHM Cc1nnc(SCc2cccc(-c3nn[n-]n3)c2)n1[C@H]1CCC[C@H](C)C1 ZINC000826337722 607966171 /nfs/dbraw/zinc/96/61/71/607966171.db2.gz YWYRBVFRFZANRP-LRDDRELGSA-N -1 3 369.498 3.810 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1CSCc1csc(C2CC2)n1 ZINC000826184938 607984334 /nfs/dbraw/zinc/98/43/34/607984334.db2.gz RBMXEZARWRYPSC-UHFFFAOYSA-N -1 3 359.480 3.643 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CSCc1csc(C2CC2)n1 ZINC000826184938 607984335 /nfs/dbraw/zinc/98/43/35/607984335.db2.gz RBMXEZARWRYPSC-UHFFFAOYSA-N -1 3 359.480 3.643 20 0 FHADHM COc1ccc(CSCc2csc(C3CC3)n2)cc1-c1nnn[n-]1 ZINC000826207916 607984483 /nfs/dbraw/zinc/98/44/83/607984483.db2.gz KIXIWYNKPSJIEU-UHFFFAOYSA-N -1 3 359.480 3.643 20 0 FHADHM COc1ccc(CSCc2csc(C3CC3)n2)cc1-c1nn[n-]n1 ZINC000826207916 607984484 /nfs/dbraw/zinc/98/44/84/607984484.db2.gz KIXIWYNKPSJIEU-UHFFFAOYSA-N -1 3 359.480 3.643 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)Nc1ccc(F)cc1-c1nnn[n-]1 ZINC000823943188 608005827 /nfs/dbraw/zinc/00/58/27/608005827.db2.gz OVVWGTYZGRABSK-NTMALXAHSA-N -1 3 357.776 3.701 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)Nc1ccc(F)cc1-c1nn[n-]n1 ZINC000823943188 608005828 /nfs/dbraw/zinc/00/58/28/608005828.db2.gz OVVWGTYZGRABSK-NTMALXAHSA-N -1 3 357.776 3.701 20 0 FHADHM Cc1cc2c(ncnc2SCc2ccc(-c3nnn[n-]3)cc2F)s1 ZINC000826273231 608056769 /nfs/dbraw/zinc/05/67/69/608056769.db2.gz UZQIXCIAWYCOHL-UHFFFAOYSA-N -1 3 358.427 3.611 20 0 FHADHM Cc1cc2c(ncnc2SCc2ccc(-c3nn[n-]n3)cc2F)s1 ZINC000826273231 608056770 /nfs/dbraw/zinc/05/67/70/608056770.db2.gz UZQIXCIAWYCOHL-UHFFFAOYSA-N -1 3 358.427 3.611 20 0 FHADHM Cc1c(Br)cccc1CSc1cc(-c2nnn[n-]2)ccn1 ZINC000826234443 608077029 /nfs/dbraw/zinc/07/70/29/608077029.db2.gz WZBCXRAVNGQEQZ-UHFFFAOYSA-N -1 3 362.256 3.625 20 0 FHADHM Cc1c(Br)cccc1CSc1cc(-c2nn[n-]n2)ccn1 ZINC000826234443 608077030 /nfs/dbraw/zinc/07/70/30/608077030.db2.gz WZBCXRAVNGQEQZ-UHFFFAOYSA-N -1 3 362.256 3.625 20 0 FHADHM Clc1ccc(Cl)c(COc2ccc(-c3nnn[n-]3)cc2Cl)n1 ZINC000826352321 608144277 /nfs/dbraw/zinc/14/42/77/608144277.db2.gz WVWIDNHEFPTPJE-UHFFFAOYSA-N -1 3 356.600 3.801 20 0 FHADHM Clc1ccc(Cl)c(COc2ccc(-c3nn[n-]n3)cc2Cl)n1 ZINC000826352321 608144278 /nfs/dbraw/zinc/14/42/78/608144278.db2.gz WVWIDNHEFPTPJE-UHFFFAOYSA-N -1 3 356.600 3.801 20 0 FHADHM CCSc1cccc(C(=O)Nc2cc(-c3nnn[n-]3)cn2C(C)(C)C)c1 ZINC000825674144 608155235 /nfs/dbraw/zinc/15/52/35/608155235.db2.gz IMIGQVXJOPOOLX-UHFFFAOYSA-N -1 3 370.482 3.788 20 0 FHADHM CCSc1cccc(C(=O)Nc2cc(-c3nn[n-]n3)cn2C(C)(C)C)c1 ZINC000825674144 608155236 /nfs/dbraw/zinc/15/52/36/608155236.db2.gz IMIGQVXJOPOOLX-UHFFFAOYSA-N -1 3 370.482 3.788 20 0 FHADHM CN(C(=O)C1(Cc2ccc(Cl)cc2)CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825812020 608160000 /nfs/dbraw/zinc/16/00/00/608160000.db2.gz FYGXJYWKRLDYGI-UHFFFAOYSA-N -1 3 367.840 3.506 20 0 FHADHM CN(C(=O)C1(Cc2ccc(Cl)cc2)CC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825812020 608160003 /nfs/dbraw/zinc/16/00/03/608160003.db2.gz FYGXJYWKRLDYGI-UHFFFAOYSA-N -1 3 367.840 3.506 20 0 FHADHM CN(C(=O)C1(Cc2ccc(Cl)cc2)CC1)c1ccccc1-c1nnn[n-]1 ZINC000825812690 608161624 /nfs/dbraw/zinc/16/16/24/608161624.db2.gz RDOXYXCVMGQONA-UHFFFAOYSA-N -1 3 367.840 3.506 20 0 FHADHM CN(C(=O)C1(Cc2ccc(Cl)cc2)CC1)c1ccccc1-c1nn[n-]n1 ZINC000825812690 608161625 /nfs/dbraw/zinc/16/16/25/608161625.db2.gz RDOXYXCVMGQONA-UHFFFAOYSA-N -1 3 367.840 3.506 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)C1(Cc2ccc(Cl)cc2)CC1 ZINC000826454329 608162313 /nfs/dbraw/zinc/16/23/13/608162313.db2.gz SATABUDJNZCAAP-UHFFFAOYSA-N -1 3 371.803 3.621 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)C1(Cc2ccc(Cl)cc2)CC1 ZINC000826454329 608162314 /nfs/dbraw/zinc/16/23/14/608162314.db2.gz SATABUDJNZCAAP-UHFFFAOYSA-N -1 3 371.803 3.621 20 0 FHADHM C[C@@H](OC(=O)[C@@H]1CCSc2ccccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000824715939 608181632 /nfs/dbraw/zinc/18/16/32/608181632.db2.gz VKZBINLGAZPESJ-MLGOLLRUSA-N -1 3 366.446 3.751 20 0 FHADHM C[C@@H](OC(=O)[C@@H]1CCSc2ccccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000824715939 608181634 /nfs/dbraw/zinc/18/16/34/608181634.db2.gz VKZBINLGAZPESJ-MLGOLLRUSA-N -1 3 366.446 3.751 20 0 FHADHM C[C@@H](OC(=O)[C@H](C)c1c(F)cccc1F)c1cccc(-c2nnn[n-]2)c1 ZINC000824705493 608182762 /nfs/dbraw/zinc/18/27/62/608182762.db2.gz BXJOOLQYGNRSMD-GHMZBOCLSA-N -1 3 358.348 3.553 20 0 FHADHM C[C@@H](OC(=O)[C@H](C)c1c(F)cccc1F)c1cccc(-c2nn[n-]n2)c1 ZINC000824705493 608182763 /nfs/dbraw/zinc/18/27/63/608182763.db2.gz BXJOOLQYGNRSMD-GHMZBOCLSA-N -1 3 358.348 3.553 20 0 FHADHM Cc1cccc(NC(=O)CSc2cccc(Cl)c2-c2nnn[n-]2)c1 ZINC000826298697 608206289 /nfs/dbraw/zinc/20/62/89/608206289.db2.gz DOELTSHWEYNEQN-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1cccc(NC(=O)CSc2cccc(Cl)c2-c2nn[n-]n2)c1 ZINC000826298697 608206290 /nfs/dbraw/zinc/20/62/90/608206290.db2.gz DOELTSHWEYNEQN-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Fc1ccc([C@@H]2CCCN2c2ccc3cc(-c4nnn[n-]4)ccc3n2)cc1 ZINC000826374151 608222548 /nfs/dbraw/zinc/22/25/48/608222548.db2.gz NONLDLRNNXHFEW-SFHVURJKSA-N -1 3 360.396 3.896 20 0 FHADHM Fc1ccc([C@@H]2CCCN2c2ccc3cc(-c4nn[n-]n4)ccc3n2)cc1 ZINC000826374151 608222550 /nfs/dbraw/zinc/22/25/50/608222550.db2.gz NONLDLRNNXHFEW-SFHVURJKSA-N -1 3 360.396 3.896 20 0 FHADHM Fc1ccc([C@H]2CCN(c3ccc4cc(-c5nnn[n-]5)ccc4n3)C2)cc1 ZINC000826373924 608232975 /nfs/dbraw/zinc/23/29/75/608232975.db2.gz FIIAFCKSLUXVPF-INIZCTEOSA-N -1 3 360.396 3.548 20 0 FHADHM Fc1ccc([C@H]2CCN(c3ccc4cc(-c5nn[n-]n5)ccc4n3)C2)cc1 ZINC000826373924 608232977 /nfs/dbraw/zinc/23/29/77/608232977.db2.gz FIIAFCKSLUXVPF-INIZCTEOSA-N -1 3 360.396 3.548 20 0 FHADHM COc1ccc([C@@H](OC)[C@H](C)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1 ZINC000826189931 608240027 /nfs/dbraw/zinc/24/00/27/608240027.db2.gz JPICCYYRBQHGMS-GTNSWQLSSA-N -1 3 373.844 3.717 20 0 FHADHM COc1ccc([C@@H](OC)[C@H](C)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1 ZINC000826189931 608240029 /nfs/dbraw/zinc/24/00/29/608240029.db2.gz JPICCYYRBQHGMS-GTNSWQLSSA-N -1 3 373.844 3.717 20 0 FHADHM CC(C)(C)c1ccc2c(c1)CCCN2C(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000824136391 608250694 /nfs/dbraw/zinc/25/06/94/608250694.db2.gz PERJRKBKXPQVFU-UHFFFAOYSA-N -1 3 367.478 3.819 20 0 FHADHM CC(C)(C)c1ccc2c(c1)CCCN2C(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000824136391 608250696 /nfs/dbraw/zinc/25/06/96/608250696.db2.gz PERJRKBKXPQVFU-UHFFFAOYSA-N -1 3 367.478 3.819 20 0 FHADHM CC[C@@H]1CC[C@H](C)N1C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000825195350 608264024 /nfs/dbraw/zinc/26/40/24/608264024.db2.gz WHCSSSDKBSMTAX-GXSJLCMTSA-N -1 3 368.363 3.680 20 0 FHADHM CC[C@@H]1CC[C@H](C)N1C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000825195350 608264026 /nfs/dbraw/zinc/26/40/26/608264026.db2.gz WHCSSSDKBSMTAX-GXSJLCMTSA-N -1 3 368.363 3.680 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)[C@@H](c1ccccc1)C1CC1 ZINC000826453150 608311548 /nfs/dbraw/zinc/31/15/48/608311548.db2.gz YFUZKFAGSXAAKS-INIZCTEOSA-N -1 3 353.813 3.652 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)[C@@H](c1ccccc1)C1CC1 ZINC000826453150 608311550 /nfs/dbraw/zinc/31/15/50/608311550.db2.gz YFUZKFAGSXAAKS-INIZCTEOSA-N -1 3 353.813 3.652 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CNc1ccccc1OC(C)(C)C ZINC000826170566 608320943 /nfs/dbraw/zinc/32/09/43/608320943.db2.gz FUUBXOSHDXMOFO-UHFFFAOYSA-N -1 3 353.426 3.665 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CNc1ccccc1OC(C)(C)C ZINC000826170566 608320945 /nfs/dbraw/zinc/32/09/45/608320945.db2.gz FUUBXOSHDXMOFO-UHFFFAOYSA-N -1 3 353.426 3.665 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CNc1ccc(Oc2ccccn2)cc1 ZINC000826171045 608321508 /nfs/dbraw/zinc/32/15/08/608321508.db2.gz ZWQRIASSJZZQPD-UHFFFAOYSA-N -1 3 374.404 3.675 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CNc1ccc(Oc2ccccn2)cc1 ZINC000826171045 608321511 /nfs/dbraw/zinc/32/15/11/608321511.db2.gz ZWQRIASSJZZQPD-UHFFFAOYSA-N -1 3 374.404 3.675 20 0 FHADHM C[C@@H](C(=O)NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1)C(C)(C)C ZINC000824039632 608327076 /nfs/dbraw/zinc/32/70/76/608327076.db2.gz GCLGDBYEDODRKW-AWEZNQCLSA-N -1 3 363.465 3.832 20 0 FHADHM C[C@@H](C(=O)NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1)C(C)(C)C ZINC000824039632 608327077 /nfs/dbraw/zinc/32/70/77/608327077.db2.gz GCLGDBYEDODRKW-AWEZNQCLSA-N -1 3 363.465 3.832 20 0 FHADHM Cc1cc(C)c(CC(=O)Nc2sc3c(c2-c2nnn[n-]2)CCC3)c(C)c1 ZINC000826263284 608339428 /nfs/dbraw/zinc/33/94/28/608339428.db2.gz TZJURBJXCBXFKL-UHFFFAOYSA-N -1 3 367.478 3.523 20 0 FHADHM Cc1cc(C)c(CC(=O)Nc2sc3c(c2-c2nn[n-]n2)CCC3)c(C)c1 ZINC000826263284 608339429 /nfs/dbraw/zinc/33/94/29/608339429.db2.gz TZJURBJXCBXFKL-UHFFFAOYSA-N -1 3 367.478 3.523 20 0 FHADHM CCN(C(=O)[C@H](C)c1ccsc1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825367425 608343624 /nfs/dbraw/zinc/34/36/24/608343624.db2.gz PTSBGGRZWCFVCS-SNVBAGLBSA-N -1 3 361.858 3.738 20 0 FHADHM CCN(C(=O)[C@H](C)c1ccsc1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825367425 608343627 /nfs/dbraw/zinc/34/36/27/608343627.db2.gz PTSBGGRZWCFVCS-SNVBAGLBSA-N -1 3 361.858 3.738 20 0 FHADHM C[C@@H](NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1)c1nccs1 ZINC000824612647 608362296 /nfs/dbraw/zinc/36/22/96/608362296.db2.gz OBHKGQDXOQOCQQ-CYBMUJFWSA-N -1 3 362.462 3.841 20 0 FHADHM C[C@@H](NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1)c1nccs1 ZINC000824612647 608362298 /nfs/dbraw/zinc/36/22/98/608362298.db2.gz OBHKGQDXOQOCQQ-CYBMUJFWSA-N -1 3 362.462 3.841 20 0 FHADHM C[C@H](NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1)c1cscn1 ZINC000824612247 608362373 /nfs/dbraw/zinc/36/23/73/608362373.db2.gz LKAGCSJFWSIUQD-ZDUSSCGKSA-N -1 3 362.462 3.841 20 0 FHADHM C[C@H](NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1)c1cscn1 ZINC000824612247 608362375 /nfs/dbraw/zinc/36/23/75/608362375.db2.gz LKAGCSJFWSIUQD-ZDUSSCGKSA-N -1 3 362.462 3.841 20 0 FHADHM C[C@@H](O)c1ccc(CNc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)cc1 ZINC000824708531 608373500 /nfs/dbraw/zinc/37/35/00/608373500.db2.gz YIPQWOCAWHZBBM-SNVBAGLBSA-N -1 3 363.343 3.551 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(NCc2nc(-c3ccccc3)c[nH]2)c1 ZINC000826351667 608376213 /nfs/dbraw/zinc/37/62/13/608376213.db2.gz VKOAJBBIHZCXSD-UHFFFAOYSA-N -1 3 351.801 3.522 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(NCc2nc(-c3ccccc3)c[nH]2)c1 ZINC000826351667 608376216 /nfs/dbraw/zinc/37/62/16/608376216.db2.gz VKOAJBBIHZCXSD-UHFFFAOYSA-N -1 3 351.801 3.522 20 0 FHADHM Oc1cccc2c1CC[C@H]2Nc1ccc(C(F)(F)F)cc1-c1nnn[n-]1 ZINC000826511437 608382064 /nfs/dbraw/zinc/38/20/64/608382064.db2.gz QGJWLCBRTPOCEO-CYBMUJFWSA-N -1 3 361.327 3.691 20 0 FHADHM Oc1cccc2c1CC[C@H]2Nc1ccc(C(F)(F)F)cc1-c1nn[n-]n1 ZINC000826511437 608382066 /nfs/dbraw/zinc/38/20/66/608382066.db2.gz QGJWLCBRTPOCEO-CYBMUJFWSA-N -1 3 361.327 3.691 20 0 FHADHM Fc1cc(NCc2ccc(-c3nnn[n-]3)cc2)cc(F)c1Br ZINC000826372938 608388975 /nfs/dbraw/zinc/38/89/75/608388975.db2.gz SKURIJVHOFSTQZ-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1cc(NCc2ccc(-c3nn[n-]n3)cc2)cc(F)c1Br ZINC000826372938 608388977 /nfs/dbraw/zinc/38/89/77/608388977.db2.gz SKURIJVHOFSTQZ-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM O=c1[nH]c2ccccc2cc1CSCc1cccc(-c2nnn[n-]2)c1F ZINC000826501413 608405309 /nfs/dbraw/zinc/40/53/09/608405309.db2.gz OXJBANXBNLLQPB-UHFFFAOYSA-N -1 3 367.409 3.693 20 0 FHADHM O=c1[nH]c2ccccc2cc1CSCc1cccc(-c2nn[n-]n2)c1F ZINC000826501413 608405310 /nfs/dbraw/zinc/40/53/10/608405310.db2.gz OXJBANXBNLLQPB-UHFFFAOYSA-N -1 3 367.409 3.693 20 0 FHADHM CC[C@H](C)n1ncc(NCc2ccc(-c3nnn[n-]3)cc2F)c1C1CC1 ZINC000825082327 608427968 /nfs/dbraw/zinc/42/79/68/608427968.db2.gz RYXKIUNADHSMDN-NSHDSACASA-N -1 3 355.421 3.663 20 0 FHADHM CC[C@H](C)n1ncc(NCc2ccc(-c3nn[n-]n3)cc2F)c1C1CC1 ZINC000825082327 608427970 /nfs/dbraw/zinc/42/79/70/608427970.db2.gz 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C[C@H]1CCCC[C@@H]1CC(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000824936159 608487908 /nfs/dbraw/zinc/48/79/08/608487908.db2.gz FEHLRSGBEIOSQK-HNAYVOBHSA-N -1 3 365.481 3.699 20 0 FHADHM C[C@H]1CCCC[C@@H]1CC(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000824936159 608487910 /nfs/dbraw/zinc/48/79/10/608487910.db2.gz FEHLRSGBEIOSQK-HNAYVOBHSA-N -1 3 365.481 3.699 20 0 FHADHM c1csc(CN(Cc2ccc(-c3nnn[n-]3)o2)Cc2cccs2)c1 ZINC000826526219 608506204 /nfs/dbraw/zinc/50/62/04/608506204.db2.gz POYUMIMBFFKBHV-UHFFFAOYSA-N -1 3 357.464 3.785 20 0 FHADHM c1csc(CN(Cc2ccc(-c3nn[n-]n3)o2)Cc2cccs2)c1 ZINC000826526219 608506206 /nfs/dbraw/zinc/50/62/06/608506206.db2.gz POYUMIMBFFKBHV-UHFFFAOYSA-N -1 3 357.464 3.785 20 0 FHADHM CC(C)Cc1ncc(CN(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)s1 ZINC000824281049 608520621 /nfs/dbraw/zinc/52/06/21/608520621.db2.gz YGOFKZFXWHAXOW-UHFFFAOYSA-N -1 3 368.510 3.686 20 0 FHADHM Cc1ccccc1-c1cnc(CNC2(c3cccc(-c4nnn[n-]4)c3)CC2)o1 ZINC000826305152 608529218 /nfs/dbraw/zinc/52/92/18/608529218.db2.gz MTFJIXAGBDLVKK-UHFFFAOYSA-N -1 3 372.432 3.609 20 0 FHADHM Cc1ccccc1-c1cnc(CNC2(c3cccc(-c4nn[n-]n4)c3)CC2)o1 ZINC000826305152 608529222 /nfs/dbraw/zinc/52/92/22/608529222.db2.gz MTFJIXAGBDLVKK-UHFFFAOYSA-N -1 3 372.432 3.609 20 0 FHADHM Cc1cccc2c1ncc(-c1nnn[n-]1)c2N1CCC(c2cccnc2)CC1 ZINC000826304718 608553831 /nfs/dbraw/zinc/55/38/31/608553831.db2.gz VWPCSTHERIANMF-UHFFFAOYSA-N -1 3 371.448 3.502 20 0 FHADHM Cc1cccc2c1ncc(-c1nn[n-]n1)c2N1CCC(c2cccnc2)CC1 ZINC000826304718 608553832 /nfs/dbraw/zinc/55/38/32/608553832.db2.gz VWPCSTHERIANMF-UHFFFAOYSA-N -1 3 371.448 3.502 20 0 FHADHM O=C(c1ccc(Cl)c(-c2nnn[n-]2)c1)N1CCCSc2ccccc21 ZINC000826473181 608574413 /nfs/dbraw/zinc/57/44/13/608574413.db2.gz NSZBJPSIDLJHKK-UHFFFAOYSA-N -1 3 371.853 3.663 20 0 FHADHM O=C(c1ccc(Cl)c(-c2nn[n-]n2)c1)N1CCCSc2ccccc21 ZINC000826473181 608574414 /nfs/dbraw/zinc/57/44/14/608574414.db2.gz NSZBJPSIDLJHKK-UHFFFAOYSA-N -1 3 371.853 3.663 20 0 FHADHM CC(C)Oc1ccc(NC(=O)c2ccc(Cl)c(-c3nnn[n-]3)c2)cc1 ZINC000824329980 608574429 /nfs/dbraw/zinc/57/44/29/608574429.db2.gz ZSHSWLXMFBJZNR-UHFFFAOYSA-N -1 3 357.801 3.560 20 0 FHADHM CC(C)Oc1ccc(NC(=O)c2ccc(Cl)c(-c3nn[n-]n3)c2)cc1 ZINC000824329980 608574430 /nfs/dbraw/zinc/57/44/30/608574430.db2.gz ZSHSWLXMFBJZNR-UHFFFAOYSA-N -1 3 357.801 3.560 20 0 FHADHM O=C(c1ccc(Cl)c(-c2nnn[n-]2)c1)N1CCC(c2ccccc2)CC1 ZINC000826473266 608574723 /nfs/dbraw/zinc/57/47/23/608574723.db2.gz QTVZRKJSZHNNRI-UHFFFAOYSA-N -1 3 367.840 3.540 20 0 FHADHM O=C(c1ccc(Cl)c(-c2nn[n-]n2)c1)N1CCC(c2ccccc2)CC1 ZINC000826473266 608574725 /nfs/dbraw/zinc/57/47/25/608574725.db2.gz QTVZRKJSZHNNRI-UHFFFAOYSA-N -1 3 367.840 3.540 20 0 FHADHM C[C@H](OC(=O)c1ccc(F)c(Cl)c1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000824723690 608576217 /nfs/dbraw/zinc/57/62/17/608576217.db2.gz UICGJMYRSQKZBG-QMMMGPOBSA-N -1 3 364.739 3.716 20 0 FHADHM C[C@H](OC(=O)c1ccc(F)c(Cl)c1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000824723690 608576218 /nfs/dbraw/zinc/57/62/18/608576218.db2.gz UICGJMYRSQKZBG-QMMMGPOBSA-N -1 3 364.739 3.716 20 0 FHADHM C[C@H]1CN(C(=O)c2ccc(Cl)c(-c3nnn[n-]3)c2)c2ccccc2S1 ZINC000824974664 608576583 /nfs/dbraw/zinc/57/65/83/608576583.db2.gz CWNHMTUHJXJOIG-JTQLQIEISA-N -1 3 371.853 3.661 20 0 FHADHM C[C@H]1CN(C(=O)c2ccc(Cl)c(-c3nn[n-]n3)c2)c2ccccc2S1 ZINC000824974664 608576584 /nfs/dbraw/zinc/57/65/84/608576584.db2.gz CWNHMTUHJXJOIG-JTQLQIEISA-N -1 3 371.853 3.661 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1cnc(-c2ccccc2)s1 ZINC000826250463 608584763 /nfs/dbraw/zinc/58/47/63/608584763.db2.gz CBOAQYUOSGEPRR-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1cnc(-c2ccccc2)s1 ZINC000826250463 608584764 /nfs/dbraw/zinc/58/47/64/608584764.db2.gz CBOAQYUOSGEPRR-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM CCSCCNc1cccc(OCc2cccc(-c3nnn[n-]3)c2)c1 ZINC000825674667 608617938 /nfs/dbraw/zinc/61/79/38/608617938.db2.gz PQCRVPRWNHGIIK-UHFFFAOYSA-N -1 3 355.467 3.611 20 0 FHADHM CCSCCNc1cccc(OCc2cccc(-c3nn[n-]n3)c2)c1 ZINC000825674667 608617939 /nfs/dbraw/zinc/61/79/39/608617939.db2.gz PQCRVPRWNHGIIK-UHFFFAOYSA-N -1 3 355.467 3.611 20 0 FHADHM CCc1nc(C)c([C@@H](C)N(C)Cc2cccc(-c3nnn[n-]3)c2F)s1 ZINC000825746070 608650919 /nfs/dbraw/zinc/65/09/19/608650919.db2.gz RFPXRHMBJBNUDC-LLVKDONJSA-N -1 3 360.462 3.526 20 0 FHADHM CCc1nc(C)c([C@@H](C)N(C)Cc2cccc(-c3nn[n-]n3)c2F)s1 ZINC000825746070 608650920 /nfs/dbraw/zinc/65/09/20/608650920.db2.gz RFPXRHMBJBNUDC-LLVKDONJSA-N -1 3 360.462 3.526 20 0 FHADHM FC(F)(F)c1ccccc1[C@@H]1CCCN1Cc1ccc(-c2nnn[n-]2)o1 ZINC000826369214 608675244 /nfs/dbraw/zinc/67/52/44/608675244.db2.gz SGPQBZHZASJIFI-AWEZNQCLSA-N -1 3 363.343 3.816 20 0 FHADHM FC(F)(F)c1ccccc1[C@@H]1CCCN1Cc1ccc(-c2nn[n-]n2)o1 ZINC000826369214 608675246 /nfs/dbraw/zinc/67/52/46/608675246.db2.gz SGPQBZHZASJIFI-AWEZNQCLSA-N -1 3 363.343 3.816 20 0 FHADHM Cc1ccc([C@@H]2CSCCN2Cc2ccc(-c3nnn[n-]3)s2)cc1 ZINC000826285909 608710158 /nfs/dbraw/zinc/71/01/58/608710158.db2.gz NLSLXKGWORWYFR-HNNXBMFYSA-N -1 3 357.508 3.527 20 0 FHADHM COC[C@H](Nc1ccc(C(F)(F)F)cc1-c1nnn[n-]1)c1ccccc1 ZINC000826152302 608798480 /nfs/dbraw/zinc/79/84/80/608798480.db2.gz VLSRFBSNIUVAQQ-HNNXBMFYSA-N -1 3 363.343 3.685 20 0 FHADHM COC[C@H](Nc1ccc(C(F)(F)F)cc1-c1nn[n-]n1)c1ccccc1 ZINC000826152302 608798481 /nfs/dbraw/zinc/79/84/81/608798481.db2.gz VLSRFBSNIUVAQQ-HNNXBMFYSA-N -1 3 363.343 3.685 20 0 FHADHM Cc1sc(NC(=O)CCc2cc(C)cc(C)c2)c(-c2nnn[n-]2)c1C ZINC000826264778 609145348 /nfs/dbraw/zinc/14/53/48/609145348.db2.gz ZYQXINJKWHJCNJ-UHFFFAOYSA-N -1 3 355.467 3.733 20 0 FHADHM Cc1sc(NC(=O)CCc2cc(C)cc(C)c2)c(-c2nn[n-]n2)c1C ZINC000826264778 609145350 /nfs/dbraw/zinc/14/53/50/609145350.db2.gz ZYQXINJKWHJCNJ-UHFFFAOYSA-N -1 3 355.467 3.733 20 0 FHADHM COc1cccc(F)c1[C@H](C)N[C@@H](C)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000826216485 609146925 /nfs/dbraw/zinc/14/69/25/609146925.db2.gz ASJNQAHIQNTGIF-QWRGUYRKSA-N -1 3 359.380 3.565 20 0 FHADHM COc1cccc(F)c1[C@H](C)N[C@@H](C)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000826216485 609146927 /nfs/dbraw/zinc/14/69/27/609146927.db2.gz ASJNQAHIQNTGIF-QWRGUYRKSA-N -1 3 359.380 3.565 20 0 FHADHM C[C@@H](NCc1csc(-c2ccco2)n1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824624796 609149789 /nfs/dbraw/zinc/14/97/89/609149789.db2.gz CFBWSECKVZUZDN-SNVBAGLBSA-N -1 3 370.413 3.573 20 0 FHADHM C[C@@H](NCc1csc(-c2ccco2)n1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824624796 609149791 /nfs/dbraw/zinc/14/97/91/609149791.db2.gz CFBWSECKVZUZDN-SNVBAGLBSA-N -1 3 370.413 3.573 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@H]2/C=C/c2ccccc2)cccc1-c1nnn[n-]1 ZINC000826241355 609159570 /nfs/dbraw/zinc/15/95/70/609159570.db2.gz ANGCVWHULUTBCV-UJGDBWEASA-N -1 3 374.448 3.885 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@H]2/C=C/c2ccccc2)cccc1-c1nn[n-]n1 ZINC000826241355 609159572 /nfs/dbraw/zinc/15/95/72/609159572.db2.gz ANGCVWHULUTBCV-UJGDBWEASA-N -1 3 374.448 3.885 20 0 FHADHM CC(=O)Nc1cc(N[C@H]2CCCc3cc(-c4nnn[n-]4)ccc32)ccc1C ZINC000823999845 609165067 /nfs/dbraw/zinc/16/50/67/609165067.db2.gz JHADXLSEHQBWHG-SFHVURJKSA-N -1 3 362.437 3.623 20 0 FHADHM CC(=O)Nc1cc(N[C@H]2CCCc3cc(-c4nn[n-]n4)ccc32)ccc1C ZINC000823999845 609165068 /nfs/dbraw/zinc/16/50/68/609165068.db2.gz JHADXLSEHQBWHG-SFHVURJKSA-N -1 3 362.437 3.623 20 0 FHADHM Cc1c(C)n(-c2ccccc2)c(NC(=O)c2ccccc2)c1-c1nnn[n-]1 ZINC000826234062 609165130 /nfs/dbraw/zinc/16/51/30/609165130.db2.gz GYGVQEGIGNGPTL-UHFFFAOYSA-N -1 3 358.405 3.527 20 0 FHADHM Cc1c(C)n(-c2ccccc2)c(NC(=O)c2ccccc2)c1-c1nn[n-]n1 ZINC000826234062 609165131 /nfs/dbraw/zinc/16/51/31/609165131.db2.gz GYGVQEGIGNGPTL-UHFFFAOYSA-N -1 3 358.405 3.527 20 0 FHADHM C[C@@H](Nc1ccc(OCC(F)F)cc1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824656533 609243537 /nfs/dbraw/zinc/24/35/37/609243537.db2.gz LHAACALJFGOWBZ-SNVBAGLBSA-N -1 3 363.343 3.823 20 0 FHADHM C[C@@H](Nc1ccc(OCC(F)F)cc1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824656533 609243538 /nfs/dbraw/zinc/24/35/38/609243538.db2.gz LHAACALJFGOWBZ-SNVBAGLBSA-N -1 3 363.343 3.823 20 0 FHADHM C[C@H](Cc1nnc(NCc2ccc(-c3nnn[n-]3)s2)o1)CC(C)(C)C ZINC000824464735 609266028 /nfs/dbraw/zinc/26/60/28/609266028.db2.gz JAIPPYXIDLSRHK-SNVBAGLBSA-N -1 3 361.475 3.538 20 0 FHADHM Fc1c2nc(NCc3cc(-c4nnn[n-]4)cs3)sc2ccc1Cl ZINC000826371682 609266378 /nfs/dbraw/zinc/26/63/78/609266378.db2.gz PUMFCWKAHGOCCA-UHFFFAOYSA-N -1 3 366.834 3.943 20 0 FHADHM Fc1c2nc(NCc3cc(-c4nn[n-]n4)cs3)sc2ccc1Cl ZINC000826371682 609266380 /nfs/dbraw/zinc/26/63/80/609266380.db2.gz PUMFCWKAHGOCCA-UHFFFAOYSA-N -1 3 366.834 3.943 20 0 FHADHM C[C@H](Nc1ccc(-c2csnn2)cc1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824649512 609274295 /nfs/dbraw/zinc/27/42/95/609274295.db2.gz NCLYIGHPWYGNGF-JTQLQIEISA-N -1 3 367.413 3.697 20 0 FHADHM C[C@H](Nc1ccc(-c2csnn2)cc1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824649512 609274297 /nfs/dbraw/zinc/27/42/97/609274297.db2.gz NCLYIGHPWYGNGF-JTQLQIEISA-N -1 3 367.413 3.697 20 0 FHADHM COc1c(F)cc(F)cc1N[C@@H]1CCCc2cc(-c3nnn[n-]3)ccc21 ZINC000826166992 609279012 /nfs/dbraw/zinc/27/90/12/609279012.db2.gz KXVHZEPOBCPIGO-OAHLLOKOSA-N -1 3 357.364 3.643 20 0 FHADHM COc1c(F)cc(F)cc1N[C@@H]1CCCc2cc(-c3nn[n-]n3)ccc21 ZINC000826166992 609279014 /nfs/dbraw/zinc/27/90/14/609279014.db2.gz KXVHZEPOBCPIGO-OAHLLOKOSA-N -1 3 357.364 3.643 20 0 FHADHM O=C(c1ccc(Cl)c(-c2nnn[n-]2)c1)N1CCC[C@@H]1C1CCCCC1 ZINC000826472988 609289316 /nfs/dbraw/zinc/28/93/16/609289316.db2.gz FVFOMQANDXYVGJ-MRXNPFEDSA-N -1 3 359.861 3.705 20 0 FHADHM O=C(c1ccc(Cl)c(-c2nn[n-]n2)c1)N1CCC[C@@H]1C1CCCCC1 ZINC000826472988 609289317 /nfs/dbraw/zinc/28/93/17/609289317.db2.gz FVFOMQANDXYVGJ-MRXNPFEDSA-N -1 3 359.861 3.705 20 0 FHADHM CC(C)c1cccc(N(C)C(=O)c2ccc(Cl)c(-c3nnn[n-]3)c2)c1 ZINC000824347616 609297934 /nfs/dbraw/zinc/29/79/34/609297934.db2.gz HLCWCMLUZPHHGE-UHFFFAOYSA-N -1 3 355.829 3.920 20 0 FHADHM CC(C)c1cccc(N(C)C(=O)c2ccc(Cl)c(-c3nn[n-]n3)c2)c1 ZINC000824347616 609297936 /nfs/dbraw/zinc/29/79/36/609297936.db2.gz HLCWCMLUZPHHGE-UHFFFAOYSA-N -1 3 355.829 3.920 20 0 FHADHM Cc1cc(Br)ccc1CSc1cc(-c2nnn[n-]2)ccn1 ZINC000826256489 609309010 /nfs/dbraw/zinc/30/90/10/609309010.db2.gz LXJSELWJZQLFNW-UHFFFAOYSA-N -1 3 362.256 3.625 20 0 FHADHM Cc1cc(Br)ccc1CSc1cc(-c2nn[n-]n2)ccn1 ZINC000826256489 609309011 /nfs/dbraw/zinc/30/90/11/609309011.db2.gz LXJSELWJZQLFNW-UHFFFAOYSA-N -1 3 362.256 3.625 20 0 FHADHM C[C@@H]1CCC[C@@H]1NC(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000824937182 609317552 /nfs/dbraw/zinc/31/75/52/609317552.db2.gz ODUCMGWJKLPZGR-CJNGLKHVSA-N -1 3 363.421 3.577 20 0 FHADHM C[C@@H]1CCC[C@@H]1NC(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000824937182 609317554 /nfs/dbraw/zinc/31/75/54/609317554.db2.gz ODUCMGWJKLPZGR-CJNGLKHVSA-N -1 3 363.421 3.577 20 0 FHADHM COc1ccc(C)cc1[C@@H](C)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000826189749 609324105 /nfs/dbraw/zinc/32/41/05/609324105.db2.gz DHUNMAXXAJMKIC-CHWSQXEVSA-N -1 3 355.417 3.735 20 0 FHADHM COc1ccc(F)cc1[C@@H](C)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1F ZINC000826209153 609328114 /nfs/dbraw/zinc/32/81/14/609328114.db2.gz PBVFSHAKWQUWCB-GHMZBOCLSA-N -1 3 359.380 3.565 20 0 FHADHM COc1ccc(F)cc1[C@@H](C)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000826209153 609328116 /nfs/dbraw/zinc/32/81/16/609328116.db2.gz PBVFSHAKWQUWCB-GHMZBOCLSA-N -1 3 359.380 3.565 20 0 FHADHM FC(F)(F)[C@@H](CCc1ccccc1)NCc1cc(-c2nnn[n-]2)cs1 ZINC000826366914 609347231 /nfs/dbraw/zinc/34/72/31/609347231.db2.gz CWBQMZZZFZVWPU-CQSZACIVSA-N -1 3 367.400 3.582 20 0 FHADHM FC(F)(F)[C@@H](CCc1ccccc1)NCc1cc(-c2nn[n-]n2)cs1 ZINC000826366914 609347233 /nfs/dbraw/zinc/34/72/33/609347233.db2.gz CWBQMZZZFZVWPU-CQSZACIVSA-N -1 3 367.400 3.582 20 0 FHADHM C[C@H](Nc1ccccc1OCC(F)F)c1ccc(-c2nnn[n-]2)cc1F ZINC000824663154 609347716 /nfs/dbraw/zinc/34/77/16/609347716.db2.gz VXGZDTWJNGDVAC-JTQLQIEISA-N -1 3 363.343 3.823 20 0 FHADHM C[C@H](Nc1ccccc1OCC(F)F)c1ccc(-c2nn[n-]n2)cc1F ZINC000824663154 609347718 /nfs/dbraw/zinc/34/77/18/609347718.db2.gz VXGZDTWJNGDVAC-JTQLQIEISA-N -1 3 363.343 3.823 20 0 FHADHM Cc1ccccc1CN(C)Cc1ccc(-c2nnn[n-]2)cc1Br ZINC000826307153 609357674 /nfs/dbraw/zinc/35/76/74/609357674.db2.gz XUHZPWQOKHQZRL-UHFFFAOYSA-N -1 3 372.270 3.570 20 0 FHADHM Cc1ccccc1CN(C)Cc1ccc(-c2nn[n-]n2)cc1Br ZINC000826307153 609357677 /nfs/dbraw/zinc/35/76/77/609357677.db2.gz XUHZPWQOKHQZRL-UHFFFAOYSA-N -1 3 372.270 3.570 20 0 FHADHM CCc1cc(NC(=O)N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)ccc1C ZINC000825700680 609383619 /nfs/dbraw/zinc/38/36/19/609383619.db2.gz PDKDEKAZHSOECL-CYBMUJFWSA-N -1 3 350.426 3.620 20 0 FHADHM CCc1cc(NC(=O)N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)ccc1C ZINC000825700680 609383621 /nfs/dbraw/zinc/38/36/21/609383621.db2.gz PDKDEKAZHSOECL-CYBMUJFWSA-N -1 3 350.426 3.620 20 0 FHADHM C[C@H]1CC[C@@]2(CCN(C(=O)Nc3ccc(-c4nnn[n-]4)c(Cl)c3)C2)C1 ZINC000824915733 609403183 /nfs/dbraw/zinc/40/31/83/609403183.db2.gz HXFXONZRHPTXRG-APPDUMDISA-N -1 3 360.849 3.564 20 0 FHADHM C[C@H]1CC[C@@]2(CCN(C(=O)Nc3ccc(-c4nn[n-]n4)c(Cl)c3)C2)C1 ZINC000824915733 609403185 /nfs/dbraw/zinc/40/31/85/609403185.db2.gz HXFXONZRHPTXRG-APPDUMDISA-N -1 3 360.849 3.564 20 0 FHADHM CC[C@@H](C)NC(=O)N[C@@H](C)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000825068445 609441471 /nfs/dbraw/zinc/44/14/71/609441471.db2.gz RUDJLNHTPWKRIS-KGLIPLIRSA-N -1 3 364.453 3.692 20 0 FHADHM CC[C@@H](C)NC(=O)N[C@@H](C)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000825068445 609441472 /nfs/dbraw/zinc/44/14/72/609441472.db2.gz RUDJLNHTPWKRIS-KGLIPLIRSA-N -1 3 364.453 3.692 20 0 FHADHM Cn1nc(C(F)(F)F)c(CSc2cccc(-c3nnn[n-]3)c2)c1Cl ZINC000826366254 609449451 /nfs/dbraw/zinc/44/94/51/609449451.db2.gz ZLFHLJRPTLFEQZ-UHFFFAOYSA-N -1 3 374.779 3.565 20 0 FHADHM Cn1nc(C(F)(F)F)c(CSc2cccc(-c3nn[n-]n3)c2)c1Cl ZINC000826366254 609449452 /nfs/dbraw/zinc/44/94/52/609449452.db2.gz ZLFHLJRPTLFEQZ-UHFFFAOYSA-N -1 3 374.779 3.565 20 0 FHADHM Cn1c(Cl)cnc1CSc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000826355893 609451386 /nfs/dbraw/zinc/45/13/86/609451386.db2.gz RIOOCCYENOFXML-UHFFFAOYSA-N -1 3 374.779 3.565 20 0 FHADHM Cn1c(Cl)cnc1CSc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000826355893 609451389 /nfs/dbraw/zinc/45/13/89/609451389.db2.gz RIOOCCYENOFXML-UHFFFAOYSA-N -1 3 374.779 3.565 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NCc1cnc(C2CC2)s1 ZINC000824323954 609478195 /nfs/dbraw/zinc/47/81/95/609478195.db2.gz DTOMCQOOFKIQLH-UHFFFAOYSA-N -1 3 356.455 3.600 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NCc1cnc(C2CC2)s1 ZINC000824323954 609478197 /nfs/dbraw/zinc/47/81/97/609478197.db2.gz DTOMCQOOFKIQLH-UHFFFAOYSA-N -1 3 356.455 3.600 20 0 FHADHM CCCOc1ccc(CNc2cc(-c3nnn[n-]3)ccc2C)cc1OC ZINC000825339150 609478673 /nfs/dbraw/zinc/47/86/73/609478673.db2.gz OVVCYOZUCMQNAP-UHFFFAOYSA-N -1 3 353.426 3.585 20 0 FHADHM CCCOc1ccc(CNc2cc(-c3nn[n-]n3)ccc2C)cc1OC ZINC000825339150 609478675 /nfs/dbraw/zinc/47/86/75/609478675.db2.gz OVVCYOZUCMQNAP-UHFFFAOYSA-N -1 3 353.426 3.585 20 0 FHADHM Cc1c(NCc2cnc(-c3cccs3)s2)cccc1-c1nnn[n-]1 ZINC000826242153 609486090 /nfs/dbraw/zinc/48/60/90/609486090.db2.gz BZOOGWYJRHJYAL-UHFFFAOYSA-N -1 3 354.464 3.972 20 0 FHADHM Cc1c(NCc2cnc(-c3cccs3)s2)cccc1-c1nn[n-]n1 ZINC000826242153 609486092 /nfs/dbraw/zinc/48/60/92/609486092.db2.gz BZOOGWYJRHJYAL-UHFFFAOYSA-N -1 3 354.464 3.972 20 0 FHADHM O=C(c1cccc(-c2nnn[n-]2)c1)N1CC=C(c2cccc3ccccc32)C1 ZINC000826473638 609502243 /nfs/dbraw/zinc/50/22/43/609502243.db2.gz HJCICTKYVBWRAT-UHFFFAOYSA-N -1 3 367.412 3.559 20 0 FHADHM O=C(c1cccc(-c2nn[n-]n2)c1)N1CC=C(c2cccc3ccccc32)C1 ZINC000826473638 609502244 /nfs/dbraw/zinc/50/22/44/609502244.db2.gz HJCICTKYVBWRAT-UHFFFAOYSA-N -1 3 367.412 3.559 20 0 FHADHM C[C@H](C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)c1ccccc1 ZINC000826232029 609502610 /nfs/dbraw/zinc/50/26/10/609502610.db2.gz FPRRIUCTRKZFQU-JTQLQIEISA-N -1 3 361.327 3.628 20 0 FHADHM C[C@H](C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)c1ccccc1 ZINC000826232029 609502611 /nfs/dbraw/zinc/50/26/11/609502611.db2.gz FPRRIUCTRKZFQU-JTQLQIEISA-N -1 3 361.327 3.628 20 0 FHADHM CC(C)(C)[C@H]1CCc2c(sc(NC(=O)C3=CCC3)c2-c2nnn[n-]2)C1 ZINC000824077490 609509687 /nfs/dbraw/zinc/50/96/87/609509687.db2.gz BPPZCOUEXJIKPZ-NSHDSACASA-N -1 3 357.483 3.738 20 0 FHADHM CC(C)(C)[C@H]1CCc2c(sc(NC(=O)C3=CCC3)c2-c2nn[n-]n2)C1 ZINC000824077490 609509690 /nfs/dbraw/zinc/50/96/90/609509690.db2.gz BPPZCOUEXJIKPZ-NSHDSACASA-N -1 3 357.483 3.738 20 0 FHADHM Cc1c(Cl)cnc(N[C@@H](C)c2ccc(F)cc2F)c1-c1nnn[n-]1 ZINC000826238392 609520468 /nfs/dbraw/zinc/52/04/68/609520468.db2.gz FLKAINAYFSNKNV-QMMMGPOBSA-N -1 3 350.760 3.675 20 0 FHADHM Cc1c(Cl)cnc(N[C@@H](C)c2ccc(F)cc2F)c1-c1nn[n-]n1 ZINC000826238392 609520471 /nfs/dbraw/zinc/52/04/71/609520471.db2.gz FLKAINAYFSNKNV-QMMMGPOBSA-N -1 3 350.760 3.675 20 0 FHADHM Cc1c(Cl)cnc(N(Cc2ccco2)Cc2ccco2)c1-c1nnn[n-]1 ZINC000826237350 609526201 /nfs/dbraw/zinc/52/62/01/609526201.db2.gz WQVHAPFDYMKMHQ-UHFFFAOYSA-N -1 3 370.800 3.616 20 0 FHADHM Cc1c(Cl)cnc(N(Cc2ccco2)Cc2ccco2)c1-c1nn[n-]n1 ZINC000826237350 609526203 /nfs/dbraw/zinc/52/62/03/609526203.db2.gz WQVHAPFDYMKMHQ-UHFFFAOYSA-N -1 3 370.800 3.616 20 0 FHADHM COc1ccc(F)cc1[C@@H](C)Nc1ncc(Cl)c(C)c1-c1nnn[n-]1 ZINC000826208976 609535855 /nfs/dbraw/zinc/53/58/55/609535855.db2.gz IIZQSSHTXZBEGZ-SECBINFHSA-N -1 3 362.796 3.544 20 0 FHADHM COc1ccc(F)cc1[C@@H](C)Nc1ncc(Cl)c(C)c1-c1nn[n-]n1 ZINC000826208976 609535857 /nfs/dbraw/zinc/53/58/57/609535857.db2.gz IIZQSSHTXZBEGZ-SECBINFHSA-N -1 3 362.796 3.544 20 0 FHADHM Cc1c(Cl)cnc(N[C@H](c2ccccc2)[C@@H]2CCCO2)c1-c1nnn[n-]1 ZINC000826239152 609545133 /nfs/dbraw/zinc/54/51/33/609545133.db2.gz YWXSARRLTSGHJM-GOEBONIOSA-N -1 3 370.844 3.556 20 0 FHADHM Cc1c(Cl)cnc(N[C@H](c2ccccc2)[C@@H]2CCCO2)c1-c1nn[n-]n1 ZINC000826239152 609545136 /nfs/dbraw/zinc/54/51/36/609545136.db2.gz YWXSARRLTSGHJM-GOEBONIOSA-N -1 3 370.844 3.556 20 0 FHADHM Cc1nc(N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)ccc1Br ZINC000826326828 609564929 /nfs/dbraw/zinc/56/49/29/609564929.db2.gz GOBYRXJWVRYGLA-VIFPVBQESA-N -1 3 359.231 3.506 20 0 FHADHM Cc1nc(N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)ccc1Br ZINC000826326828 609564930 /nfs/dbraw/zinc/56/49/30/609564930.db2.gz GOBYRXJWVRYGLA-VIFPVBQESA-N -1 3 359.231 3.506 20 0 FHADHM Cc1nc2c(s1)[C@@H](Nc1ccc3cc(-c4nnn[n-]4)ccc3n1)CCC2 ZINC000826328188 609565505 /nfs/dbraw/zinc/56/55/05/609565505.db2.gz IIKIUICFXDGZLZ-HNNXBMFYSA-N -1 3 363.450 3.669 20 0 FHADHM Cc1nc2c(s1)[C@@H](Nc1ccc3cc(-c4nn[n-]n4)ccc3n1)CCC2 ZINC000826328188 609565506 /nfs/dbraw/zinc/56/55/06/609565506.db2.gz IIKIUICFXDGZLZ-HNNXBMFYSA-N -1 3 363.450 3.669 20 0 FHADHM CC[C@H](C)[C@H](C)C(=O)Nc1nc(-c2cccc(-c3nnn[n-]3)c2)cs1 ZINC000825051289 609599442 /nfs/dbraw/zinc/59/94/42/609599442.db2.gz NEXRTEXOBSQQBJ-QWRGUYRKSA-N -1 3 356.455 3.611 20 0 FHADHM CC[C@H](C)[C@H](C)C(=O)Nc1nc(-c2cccc(-c3nn[n-]n3)c2)cs1 ZINC000825051289 609599443 /nfs/dbraw/zinc/59/94/43/609599443.db2.gz NEXRTEXOBSQQBJ-QWRGUYRKSA-N -1 3 356.455 3.611 20 0 FHADHM FC(F)Oc1cc(NCc2ccc(-c3nnn[n-]3)s2)ccc1Cl ZINC000826369708 609600120 /nfs/dbraw/zinc/60/01/20/609600120.db2.gz NVDKMDVHVOPNQO-UHFFFAOYSA-N -1 3 357.773 3.795 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)N1CCC[C@H]1/C=C\c1ccccc1 ZINC000826456296 609607670 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ZINC000656412915 931606403 /nfs/dbraw/zinc/60/64/03/931606403.db2.gz PWDSGVSAELVKTG-UHFFFAOYSA-N -1 3 368.905 3.525 20 0 FHADHM CCOc1cc(CN2C[C@H](C)O[C@H](C(F)(F)F)C2)cc(Cl)c1[O-] ZINC000656444428 931736646 /nfs/dbraw/zinc/73/66/46/931736646.db2.gz AGUOCPHYLXRERO-ZANVPECISA-N -1 3 353.768 3.596 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)c1sccc1-c1ccc(F)cc1 ZINC000068179321 931839514 /nfs/dbraw/zinc/83/95/14/931839514.db2.gz NWYSHVKZDZUZJG-UHFFFAOYSA-N -1 3 365.393 3.987 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)c1sccc1-c1ccc(F)cc1 ZINC000068179321 931839518 /nfs/dbraw/zinc/83/95/18/931839518.db2.gz NWYSHVKZDZUZJG-UHFFFAOYSA-N -1 3 365.393 3.987 20 0 FHADHM CCOc1ccc(CN[C@H](CC(=O)[O-])c2ccc(OC)c(OC)c2)c(C)c1 ZINC000656564825 932080074 /nfs/dbraw/zinc/08/00/74/932080074.db2.gz ADZVIHRQRAJYJF-GOSISDBHSA-N -1 3 373.449 3.717 20 0 FHADHM CCOc1ccc(C(=O)CCC(=O)Nc2cccc(C(C)=O)c2[O-])cc1F ZINC000581490186 932161537 /nfs/dbraw/zinc/16/15/37/932161537.db2.gz AMRAOKGCQNILLI-UHFFFAOYSA-N -1 3 373.380 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FHADHM Cc1c2cc(Cl)ccc2oc1S(=O)(=O)[N-][C@@H](C)c1ccncc1F ZINC000510628523 933321263 /nfs/dbraw/zinc/32/12/63/933321263.db2.gz OUJUVLVXOUWPIT-JTQLQIEISA-N -1 3 368.817 3.968 20 0 FHADHM O=C(NCc1ncccc1[O-])N[C@H](Cc1ccccc1)c1cccs1 ZINC000471911955 933690980 /nfs/dbraw/zinc/69/09/80/933690980.db2.gz PEWFQRINKPYRIF-OAHLLOKOSA-N -1 3 353.447 3.632 20 0 FHADHM O=C(Nc1ccc(NC(=O)c2cc([O-])ccc2Cl)nc1)c1ccccc1 ZINC000510775350 933702266 /nfs/dbraw/zinc/70/22/66/933702266.db2.gz DFNMUMMXPLAXCB-UHFFFAOYSA-N -1 3 367.792 3.945 20 0 FHADHM Cc1cc(NC(=O)c2c([O-])cccc2O)ccc1NC(=O)c1ccco1 ZINC000092119799 933881989 /nfs/dbraw/zinc/88/19/89/933881989.db2.gz ORFAGNCUAIFZHN-UHFFFAOYSA-N -1 3 352.346 3.504 20 0 FHADHM Cc1cc(Cl)c(C)c(S(=O)(=O)[N-]CC2(C(F)F)CC2)c1Cl ZINC000684594190 934331540 /nfs/dbraw/zinc/33/15/40/934331540.db2.gz WLPQQGXNHCUIOH-UHFFFAOYSA-N -1 3 358.237 3.934 20 0 FHADHM Cc1ccc(C[C@H](C)C(=O)Nc2ccc(-c3nc(C)cc(=O)[n-]3)cc2)cc1 ZINC000180971116 934457869 /nfs/dbraw/zinc/45/78/69/934457869.db2.gz DZIZJOQWJSTBCB-HNNXBMFYSA-N -1 3 361.445 3.871 20 0 FHADHM [O-]C(=NO[C@H]1CCCCO1)Nc1cc2ccccc2nc1Br ZINC000277126899 934537994 /nfs/dbraw/zinc/53/79/94/934537994.db2.gz SVKZHSBTSCLZKG-ZDUSSCGKSA-N -1 3 366.215 3.577 20 0 FHADHM O=C([N-]O[C@H]1CCCCO1)Nc1cc2ccccc2nc1Br ZINC000277126899 934537998 /nfs/dbraw/zinc/53/79/98/934537998.db2.gz SVKZHSBTSCLZKG-ZDUSSCGKSA-N -1 3 366.215 3.577 20 0 FHADHM CCOC(=O)c1nnc([N-]C(=O)c2cc3c(cccc3Cl)s2)s1 ZINC000610894590 934568348 /nfs/dbraw/zinc/56/83/48/934568348.db2.gz CRDBLEJYFDAKHS-UHFFFAOYSA-N -1 3 367.839 3.835 20 0 FHADHM Cc1nc(-c2ccncc2)[n-]c(=O)c1CCC(=O)N[C@@H]1CCCC(C)(C)C1 ZINC000277172416 934734016 /nfs/dbraw/zinc/73/40/16/934734016.db2.gz UMLVAADCQKIXMB-MRXNPFEDSA-N -1 3 368.481 3.570 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)c3c(F)cc(F)cc3F)c2)n1 ZINC000151339804 934769183 /nfs/dbraw/zinc/76/91/83/934769183.db2.gz FDSDKDINLMFHES-UHFFFAOYSA-N -1 3 373.334 3.669 20 0 FHADHM CO[C@@H](CSc1nnc([N-]c2ccccc2F)s1)[C@H]1CCOC1 ZINC000657228834 934789902 /nfs/dbraw/zinc/78/99/02/934789902.db2.gz XHQFRJVEQJKYDD-GWCFXTLKSA-N -1 3 355.460 3.564 20 0 FHADHM CCOc1ccc([N-]S(=O)(=O)c2ccc(OCC(F)F)cc2)c(C)c1 ZINC000181680488 934798737 /nfs/dbraw/zinc/79/87/37/934798737.db2.gz TWEIPXWVFDZAFK-UHFFFAOYSA-N -1 3 371.405 3.838 20 0 FHADHM C[C@H](CCNC(=O)NCc1ncccc1[O-])c1cccc(C(F)(F)F)c1 ZINC000472002953 934808552 /nfs/dbraw/zinc/80/85/52/934808552.db2.gz PSNISPQZJLXXLD-GFCCVEGCSA-N -1 3 367.371 3.799 20 0 FHADHM Cc1ccc(CNC(=O)NCc2ncccc2[O-])c(OCCC(C)C)c1 ZINC000472066538 934932853 /nfs/dbraw/zinc/93/28/53/934932853.db2.gz VFZGKXNMWQEOMO-UHFFFAOYSA-N -1 3 357.454 3.520 20 0 FHADHM CC(C)(C)c1nc(CN[C@@H](Cc2cccc(Cl)c2)C(=O)[O-])cs1 ZINC000277384299 935053081 /nfs/dbraw/zinc/05/30/81/935053081.db2.gz QYUNRRKEYPLVOD-AWEZNQCLSA-N -1 3 352.887 3.880 20 0 FHADHM C[C@@H](NC(=O)NCc1ncccc1[O-])[C@@H](C)c1ccccc1C(F)(F)F ZINC000472115908 935068986 /nfs/dbraw/zinc/06/89/86/935068986.db2.gz SDKWEGTVDNQRRG-VXGBXAGGSA-N -1 3 367.371 3.797 20 0 FHADHM [O-]c1ccc(F)c(CN[C@@H]2CCN(c3ccccc3OC(F)F)C2)c1F ZINC000511057523 935160595 /nfs/dbraw/zinc/16/05/95/935160595.db2.gz AFQITYKIYUDYCB-LLVKDONJSA-N -1 3 370.346 3.640 20 0 FHADHM Cc1nn(Cc2ccc(F)cc2)c(Cl)c1CN[C@@H](C)CCCC(=O)[O-] ZINC000277434867 935168714 /nfs/dbraw/zinc/16/87/14/935168714.db2.gz UFSFFBMKOASYBH-LBPRGKRZSA-N -1 3 367.852 3.765 20 0 FHADHM [O-]c1cccc(CN2CC(Oc3ccc(F)c(F)c3)C2)c1Br ZINC001140548562 935216843 /nfs/dbraw/zinc/21/68/43/935216843.db2.gz PXFBSLVTQXAOAF-UHFFFAOYSA-N -1 3 370.193 3.696 20 0 FHADHM COc1ccc([C@H](CC(=O)[O-])NCc2ccc(F)c(Cl)c2)cc1OC ZINC000277473037 935245897 /nfs/dbraw/zinc/24/58/97/935245897.db2.gz WFCBXRVKKSUTNB-HNNXBMFYSA-N -1 3 367.804 3.802 20 0 FHADHM CC(C)(C)OC(=O)C[C@@H]1CCCN1Cc1cccc([O-])c1Br ZINC001140552833 935284118 /nfs/dbraw/zinc/28/41/18/935284118.db2.gz LHDPAOZPXAKNLI-ZDUSSCGKSA-N -1 3 370.287 3.851 20 0 FHADHM Cc1nc2ccc(S(=O)(=O)[N-]c3ccc(F)c(F)c3F)cc2s1 ZINC000427113174 945098550 /nfs/dbraw/zinc/09/85/50/945098550.db2.gz HPDGAHQGSGQKGE-UHFFFAOYSA-N -1 3 358.366 3.823 20 0 FHADHM CCc1c(C(=O)Nc2cccc(C(C)=O)c2[O-])cnn1-c1ccc(F)cc1 ZINC000582257265 935454291 /nfs/dbraw/zinc/45/42/91/935454291.db2.gz PNORYQOCHOLJSQ-UHFFFAOYSA-N -1 3 367.380 3.734 20 0 FHADHM COc1ccc([O-])c(C(=O)Nc2ccc(C(=O)N3CCCC[C@@H]3C)cc2)c1 ZINC000097011609 935731037 /nfs/dbraw/zinc/73/10/37/935731037.db2.gz PPBUVZKBUVACLZ-AWEZNQCLSA-N -1 3 368.433 3.668 20 0 FHADHM Cc1cc(=O)[n-]c([C@@H](C)N(C)Cc2ccc(OCC(F)(F)F)cc2)n1 ZINC000511138782 935771786 /nfs/dbraw/zinc/77/17/86/935771786.db2.gz GJBHQSLSUHRFOI-GFCCVEGCSA-N -1 3 355.360 3.625 20 0 FHADHM CCCCCc1n[n-]c(=NC(=O)c2ccc(CN3CCCC3)cc2)s1 ZINC000548740534 935792246 /nfs/dbraw/zinc/79/22/46/935792246.db2.gz JUZFABQEXPINIP-UHFFFAOYSA-N -1 3 358.511 3.541 20 0 FHADHM Cc1ccc(Br)cc1CNC(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000439957386 945123905 /nfs/dbraw/zinc/12/39/05/945123905.db2.gz OSASCDYODXIQBV-UHFFFAOYSA-N -1 3 371.234 3.529 20 0 FHADHM Cc1ccc2cc(C(=O)N=c3cc4ccc(Br)cn4[n-]3)[nH]c2c1 ZINC000431457198 935852399 /nfs/dbraw/zinc/85/23/99/935852399.db2.gz HZHXFYKNCPFKND-UHFFFAOYSA-N -1 3 369.222 3.561 20 0 FHADHM CCc1cc(=O)[n-]c(CN(C)[C@H](c2ccc(F)cc2)c2cccnc2)n1 ZINC000119932984 935854714 /nfs/dbraw/zinc/85/47/14/935854714.db2.gz NKDLQRNSSFJGDB-HXUWFJFHSA-N -1 3 352.413 3.500 20 0 FHADHM O=C([N-]c1nnc(C2CC2)s1)c1csc(Cc2ccccc2F)n1 ZINC000117568191 935976692 /nfs/dbraw/zinc/97/66/92/935976692.db2.gz VFGCNGNWDZKLCR-UHFFFAOYSA-N -1 3 360.439 3.854 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N2CC[C@H](c3ccccc3)[C@@H](C)C2)c1 ZINC000076472731 936029385 /nfs/dbraw/zinc/02/93/85/936029385.db2.gz IZUIXZHMMKAWQU-KSSFIOAISA-N -1 3 352.434 3.616 20 0 FHADHM C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc([O-])c(Cl)c1 ZINC000077638339 936051799 /nfs/dbraw/zinc/05/17/99/936051799.db2.gz UWVGZZYNAWSZBP-OAHLLOKOSA-N -1 3 358.869 3.782 20 0 FHADHM COc1ccccc1[C@H]([N-]c1nnc(C(F)(F)F)s1)c1nccn1C ZINC000153380726 936145007 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Cc1nc(-c2ccc(NC(=O)N3CCSC(C)(C)CC3)cc2)cc(=O)[n-]1 ZINC000583477554 938270040 /nfs/dbraw/zinc/27/00/40/938270040.db2.gz AKINRXSMJUBLND-UHFFFAOYSA-N -1 3 372.494 3.907 20 0 FHADHM Cc1ccc(NC(=O)[C@H]2C[C@@H]2C)cc1S(=O)(=O)[N-]c1ccccc1F ZINC000022743926 938276374 /nfs/dbraw/zinc/27/63/74/938276374.db2.gz RJSNSQRIASXQNZ-JSGCOSHPSA-N -1 3 362.426 3.529 20 0 FHADHM COc1ccc([O-])c(C(=O)Nc2ccc(C)cc2OC[C@@H]2CCCO2)c1 ZINC000536074369 938308518 /nfs/dbraw/zinc/30/85/18/938308518.db2.gz YPTMYOGDOKPYEM-HNNXBMFYSA-N -1 3 357.406 3.519 20 0 FHADHM CC(C)(C)c1nc2ccc(-n3c([O-])c(CC(F)(F)F)[nH]c3=O)cc2s1 ZINC000278327095 938309432 /nfs/dbraw/zinc/30/94/32/938309432.db2.gz XXLSBBWZGBOHQK-SNVBAGLBSA-N -1 3 371.384 3.971 20 0 FHADHM Cc1cc(S(=O)(=O)[N-][C@H](C)C[C@@H](O)c2ccccc2)sc1Cl ZINC000188099453 938330954 /nfs/dbraw/zinc/33/09/54/938330954.db2.gz MWYNPEDYYALULH-DGCLKSJQSA-N -1 3 359.900 3.500 20 0 FHADHM CCC1(C[N-]S(=O)(=O)c2c(Cl)ccc(C)c2Cl)CCOCC1 ZINC000466913990 938463651 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O=C1C[C@H]([N-]S(=O)(=O)c2c(Cl)cc(F)cc2Cl)c2ccccc21 ZINC000435435581 943414697 /nfs/dbraw/zinc/41/46/97/943414697.db2.gz BEYNICOUXJBALT-ZDUSSCGKSA-N -1 3 374.220 3.739 20 0 FHADHM CCCCn1c(=O)[n-]nc1S[C@H](C(=O)N[C@@H]1CCCC[C@H]1C)C(C)C ZINC000514984967 943433667 /nfs/dbraw/zinc/43/36/67/943433667.db2.gz CILWARCAFAFYIQ-KFWWJZLASA-N -1 3 368.547 3.595 20 0 FHADHM CSc1cc(NC(=O)NCc2nc(C(F)(F)F)n[n-]2)ccc1Cl ZINC000417281604 943486648 /nfs/dbraw/zinc/48/66/48/943486648.db2.gz SHJBWZDYAAIEDR-UHFFFAOYSA-N -1 3 365.768 3.521 20 0 FHADHM Cc1ccnn1-c1ccc(C(=O)Nc2ccc(Br)cc2[O-])cc1 ZINC000515078219 943488393 /nfs/dbraw/zinc/48/83/93/943488393.db2.gz AKSADESQTMRESD-UHFFFAOYSA-N -1 3 372.222 3.901 20 0 FHADHM CC(C)(C[N-]S(=O)(=O)c1ccccc1C(F)(F)F)CC(F)(F)F ZINC000660197641 943529810 /nfs/dbraw/zinc/52/98/10/943529810.db2.gz GNMWIXUKAMCLAI-UHFFFAOYSA-N -1 3 363.323 3.962 20 0 FHADHM O=C(Nc1ccc(Br)cc1[O-])c1cc2ccccc2[nH]c1=O ZINC000515205906 943566085 /nfs/dbraw/zinc/56/60/85/943566085.db2.gz 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COc1ccc(CN[C@@H]2C[C@H](C(=O)[O-])c3ccccc32)c(OC(F)F)c1 ZINC000417629489 943767840 /nfs/dbraw/zinc/76/78/40/943767840.db2.gz QHZWHPSNJIBCIH-JKSUJKDBSA-N -1 3 363.360 3.699 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N[C@H]2C[C@H](c3cccc(Cl)c3)C2)c1 ZINC000437401275 943777571 /nfs/dbraw/zinc/77/75/71/943777571.db2.gz WLRUSJKUOADULG-SAZUREKKSA-N -1 3 358.825 3.680 20 0 FHADHM CC1CCN([C@@H](CN=c2[n-]nc(C(F)F)s2)c2cccs2)CC1 ZINC000515325058 943789940 /nfs/dbraw/zinc/78/99/40/943789940.db2.gz IFOMJUFXOMVCDP-NSHDSACASA-N -1 3 358.483 3.844 20 0 FHADHM Cc1ncsc1CN[C@H](c1ccc(Br)cc1)[C@@H](C)C(=O)[O-] ZINC000417641175 943790485 /nfs/dbraw/zinc/79/04/85/943790485.db2.gz OSMORISDVJJECQ-OTYXRUKQSA-N -1 3 369.284 3.766 20 0 FHADHM CC(C)Cc1ccc([C@H](C)NC(=O)CN2CCCC[C@@H]2CCC(=O)[O-])cc1 ZINC000424257520 943809507 /nfs/dbraw/zinc/80/95/07/943809507.db2.gz KNFOAQYMMNRCQM-FXAWDEMLSA-N -1 3 374.525 3.782 20 0 FHADHM C[C@H](c1cc2ccccc2o1)N(C)C(=O)CN1CCCC[C@H]1CCC(=O)[O-] ZINC000424262837 943812862 /nfs/dbraw/zinc/81/28/62/943812862.db2.gz QYUSQYZNDGWSDB-WBVHZDCISA-N -1 3 372.465 3.672 20 0 FHADHM C[C@H](c1cc2ccccc2o1)N(C)C(=O)CN1CCCC[C@@H]1CCC(=O)[O-] ZINC000424262835 943812908 /nfs/dbraw/zinc/81/29/08/943812908.db2.gz QYUSQYZNDGWSDB-NVXWUHKLSA-N -1 3 372.465 3.672 20 0 FHADHM O=C(N[C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1)c1ccc(O)cc1[O-] ZINC000437478063 943847035 /nfs/dbraw/zinc/84/70/35/943847035.db2.gz BIMWVJWZXRFIQD-AULYBMBSSA-N -1 3 351.324 3.793 20 0 FHADHM COC[C@@H](C)Nc1ccccc1NC(=O)c1ccc2c(c1[O-])OC(C)(C)C2 ZINC000437597523 943939677 /nfs/dbraw/zinc/93/96/77/943939677.db2.gz CZGGCNRCOOPVMY-CYBMUJFWSA-N -1 3 370.449 3.805 20 0 FHADHM COC(=O)c1cnc([N-]C(=O)c2nc(-c3ccccc3)cs2)c(Cl)c1 ZINC000578193219 943962316 /nfs/dbraw/zinc/96/23/16/943962316.db2.gz KGKQFKMDCQDEMM-UHFFFAOYSA-N -1 3 373.821 3.897 20 0 FHADHM Cc1noc(C)c1S(=O)(=O)[N-][C@@H](CCc1ccccc1)c1ccccc1 ZINC000515524476 943977010 /nfs/dbraw/zinc/97/70/10/943977010.db2.gz HAFVNDAEZDMQMP-IBGZPJMESA-N -1 3 370.474 3.944 20 0 FHADHM O=C(Nc1ccc(Br)cc1[O-])c1cncc(C(F)(F)F)c1 ZINC000577985800 943985356 /nfs/dbraw/zinc/98/53/56/943985356.db2.gz LXHJYSKLCNFQEM-UHFFFAOYSA-N -1 3 361.117 3.821 20 0 FHADHM Cc1cc(F)c(CNC[C@@H](Cc2ccccc2Cl)C(=O)[O-])c(F)c1 ZINC000424620347 944015404 /nfs/dbraw/zinc/01/54/04/944015404.db2.gz OPJBSWRKWMCHEH-CYBMUJFWSA-N -1 3 353.796 3.960 20 0 FHADHM O=C(N=c1cc2ccc(Br)cn2[n-]1)c1cc(F)ccc1Cl ZINC000506112717 944060900 /nfs/dbraw/zinc/06/09/00/944060900.db2.gz NDWWVFQZEWFYGB-UHFFFAOYSA-N -1 3 368.593 3.564 20 0 FHADHM O=C(NC1CC(F)(c2cccc(Cl)c2)C1)c1cc(F)cc2n[n-]nc21 ZINC000505135201 944064883 /nfs/dbraw/zinc/06/48/83/944064883.db2.gz RZYVFRZXPVUWSD-UHFFFAOYSA-N -1 3 362.767 3.508 20 0 FHADHM Cc1cc(S(=O)(=O)[N-]c2ccc(NC(=O)C(C)C)cc2)ccc1F ZINC000517173757 944064939 /nfs/dbraw/zinc/06/49/39/944064939.db2.gz CVEOKWBJBLVSID-UHFFFAOYSA-N -1 3 350.415 3.529 20 0 FHADHM COc1ccc([O-])c(C(=O)Nc2cccc(-c3ncc4n3CCCC4)c2)c1 ZINC000436175568 944087897 /nfs/dbraw/zinc/08/78/97/944087897.db2.gz MPFYKKBWUBXQEB-UHFFFAOYSA-N -1 3 363.417 3.853 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)N[C@H]3C[C@@H]3Cc3ccccc3)cc2)cc(=O)[n-]1 ZINC000437756793 944087947 /nfs/dbraw/zinc/08/79/47/944087947.db2.gz ISVXKUHRMKMFCV-HKUYNNGSSA-N -1 3 374.444 3.910 20 0 FHADHM O=S(=O)([N-]CCc1ccc(F)cc1Cl)c1ccc(Cl)s1 ZINC000500142080 944162979 /nfs/dbraw/zinc/16/29/79/944162979.db2.gz HWRBQTXTILEBHP-UHFFFAOYSA-N -1 3 354.255 3.715 20 0 FHADHM O=C(Nc1ccc(Br)cc1[O-])C1=NO[C@@H](c2ccccc2)C1 ZINC000053500721 944209248 /nfs/dbraw/zinc/20/92/48/944209248.db2.gz GUZHHNZWEKXGRP-OAHLLOKOSA-N -1 3 361.195 3.611 20 0 FHADHM Cc1ccc(C(=O)[N-]n2cnc3sc4c(c3c2=O)CCCC4)c(Cl)c1 ZINC000191760521 944224778 /nfs/dbraw/zinc/22/47/78/944224778.db2.gz JUAYZAHHOMXQSX-UHFFFAOYSA-N -1 3 373.865 3.683 20 0 FHADHM Cc1cc2cc(CNC[C@@H](Oc3ccc(F)cc3)C(=O)[O-])oc2cc1C ZINC000426663470 944253025 /nfs/dbraw/zinc/25/30/25/944253025.db2.gz LZWRPHMCIABVGP-LJQANCHMSA-N -1 3 357.381 3.811 20 0 FHADHM Cc1cc(N(C)C)ccc1[N-]S(=O)(=O)c1cccc(C(F)(F)F)c1 ZINC000518328521 944277864 /nfs/dbraw/zinc/27/78/64/944277864.db2.gz FFQJXHAXLVIOJJ-UHFFFAOYSA-N -1 3 358.385 3.881 20 0 FHADHM CC(C)N(Cc1cccc(Br)c1)C(=O)c1ccc(O)cc1[O-] ZINC000439052097 944298473 /nfs/dbraw/zinc/29/84/73/944298473.db2.gz DDUDAZXTFAUXAK-UHFFFAOYSA-N -1 3 364.239 3.911 20 0 FHADHM CCc1ccc(C(=O)N(CCc2ccccn2)Cc2ccncc2)c([O-])c1 ZINC000438112880 944350114 /nfs/dbraw/zinc/35/01/14/944350114.db2.gz CRGJWWLCWBPYAQ-UHFFFAOYSA-N -1 3 361.445 3.630 20 0 FHADHM O=S(=O)([N-]c1ccc(F)c(-c2nc[nH]n2)c1)c1cccc2ccccc21 ZINC000436476983 944358229 /nfs/dbraw/zinc/35/82/29/944358229.db2.gz KKEKUJHKFYHUBA-UHFFFAOYSA-N -1 3 368.393 3.565 20 0 FHADHM C[C@H](CCOCc1ccccc1)NC(=O)CCCc1ccc([O-])c(F)c1 ZINC000518425382 944370792 /nfs/dbraw/zinc/37/07/92/944370792.db2.gz JAWHMOHVVGDKIQ-MRXNPFEDSA-N -1 3 359.441 3.966 20 0 FHADHM CC[C@H]1C[C@@]1(NC(=O)c1cc(NC(C)=O)ccc1[O-])c1cccc(C)c1 ZINC000436509042 944379640 /nfs/dbraw/zinc/37/96/40/944379640.db2.gz FKVYJZDHTWSGIY-BTYIYWSLSA-N -1 3 352.434 3.714 20 0 FHADHM CCNC(=O)Nc1cccc(NC(=O)c2cc3c(cc2[O-])CCCC3)c1 ZINC000436529239 944396959 /nfs/dbraw/zinc/39/69/59/944396959.db2.gz AVWIZYHQDSSMJQ-UHFFFAOYSA-N -1 3 353.422 3.665 20 0 FHADHM CCCN(C(=O)c1ccc(C)cc1[O-])[C@H](C)CC(=O)Nc1ccccc1 ZINC000436518641 944405879 /nfs/dbraw/zinc/40/58/79/944405879.db2.gz RQILMPOSJLIBSR-MRXNPFEDSA-N -1 3 354.450 3.970 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(-c3nnc4n3CCCC4)cc2)c([O-])c1C ZINC000436554883 944412450 /nfs/dbraw/zinc/41/24/50/944412450.db2.gz KHHQTMSRFUWZIZ-UHFFFAOYSA-N -1 3 362.433 3.856 20 0 FHADHM CCOc1ccc(CN(C(=O)c2cc(OC)c([O-])c(OC)c2)C(C)C)cc1 ZINC000436538817 944415364 /nfs/dbraw/zinc/41/53/64/944415364.db2.gz WOLTUDIXBNLFDK-UHFFFAOYSA-N -1 3 373.449 3.859 20 0 FHADHM Cc1cccc(C(=O)Nc2ccc(Oc3ccccc3C(N)=O)cc2)c1[O-] ZINC000436578023 944425614 /nfs/dbraw/zinc/42/56/14/944425614.db2.gz VNIFLCLLJMLPRU-UHFFFAOYSA-N -1 3 362.385 3.844 20 0 FHADHM CCn1cc(NC(=O)c2cc(Oc3ccccc3)ccc2[O-])ccc1=O ZINC000436563749 944429406 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CC[C@@H](c1ccc(F)cc1F)N1CCN(C(=O)c2ccc([O-])cc2)CC1 ZINC000436618697 944452109 /nfs/dbraw/zinc/45/21/09/944452109.db2.gz MKUUDBQXINOWDI-IBGZPJMESA-N -1 3 360.404 3.580 20 0 FHADHM CCc1ccc(C(=O)N2C[C@H](c3ccccc3)[C@@H]3COCC[C@H]32)c([O-])c1 ZINC000436600695 944452838 /nfs/dbraw/zinc/45/28/38/944452838.db2.gz AUAYCLBEFCBXPE-HSALFYBXSA-N -1 3 351.446 3.599 20 0 FHADHM Cc1cccc(C[C@H](CNCc2nc3c(s2)C[C@@H](C)CC3)C(=O)[O-])c1 ZINC000426668444 944455835 /nfs/dbraw/zinc/45/58/35/944455835.db2.gz FDOCPLSZNVJSQH-GOEBONIOSA-N -1 3 358.507 3.609 20 0 FHADHM COc1ccc(CN(CC2CCC2)C(=O)c2ccccc2[O-])c(OC)c1 ZINC000436610855 944460531 /nfs/dbraw/zinc/46/05/31/944460531.db2.gz NRKAUESBHIUJDV-UHFFFAOYSA-N -1 3 355.434 3.852 20 0 FHADHM CCc1noc(C)c1C(=O)[N-]c1nnc(Cc2ccc(Cl)cc2)s1 ZINC000426327730 944463455 /nfs/dbraw/zinc/46/34/55/944463455.db2.gz VWXVRWNNUSDLLD-UHFFFAOYSA-N -1 3 362.842 3.893 20 0 FHADHM CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1cc(F)cc(Cl)c1[O-] ZINC000436637375 944476542 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CC(=O)c1ccc(C(=O)NCc2ccccc2N2CCCCC2)cc1[O-] ZINC000436674661 944508307 /nfs/dbraw/zinc/50/83/07/944508307.db2.gz WEXVLCZFDNYITL-UHFFFAOYSA-N -1 3 352.434 3.515 20 0 FHADHM O=C(c1ccc2ccccc2c1[O-])N1CCN(CCc2cccs2)CC1 ZINC000436677251 944515584 /nfs/dbraw/zinc/51/55/84/944515584.db2.gz CFVVZOZCHQTZJH-UHFFFAOYSA-N -1 3 366.486 3.607 20 0 FHADHM COC(=O)c1cnc(SCc2c(C)nn(-c3ccccc3)c2Cl)[n-]1 ZINC000193537197 944520428 /nfs/dbraw/zinc/52/04/28/944520428.db2.gz ZKZMLUHAHNXBEU-UHFFFAOYSA-N -1 3 362.842 3.636 20 0 FHADHM O=C(NCCCc1nccs1)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436682475 944522296 /nfs/dbraw/zinc/52/22/96/944522296.db2.gz QFNWZUOJJJQYIQ-UHFFFAOYSA-N -1 3 352.459 3.802 20 0 FHADHM CCOc1cc(NC(=O)c2ccc3c(c2[O-])OC(C)(C)C3)ccc1OC ZINC000436682725 944522410 /nfs/dbraw/zinc/52/24/10/944522410.db2.gz RINHBNVPMLCVNL-UHFFFAOYSA-N -1 3 357.406 3.765 20 0 FHADHM CC(C)c1ccc(C(=O)N2CCN(C(=O)C(C)(C)C)CC2(C)C)c([O-])c1 ZINC000436700300 944540524 /nfs/dbraw/zinc/54/05/24/944540524.db2.gz UXIQNJWTHQKUPD-UHFFFAOYSA-N -1 3 360.498 3.625 20 0 FHADHM CC1(C)CN(C(=O)c2c([O-])cccc2O)c2ccc(Br)cc21 ZINC000436712883 944551746 /nfs/dbraw/zinc/55/17/46/944551746.db2.gz CEZLAMMVVAOKFC-UHFFFAOYSA-N -1 3 362.223 3.798 20 0 FHADHM Cc1cccc(Cl)c1NC(=O)CSCc1cc(=O)[n-]c(C2CC2)n1 ZINC000516168316 944553703 /nfs/dbraw/zinc/55/37/03/944553703.db2.gz FMHKMBCHLXUEBR-UHFFFAOYSA-N -1 3 363.870 3.893 20 0 FHADHM Cc1ccc(C(=O)N[C@@H](c2nccn2C)c2ccc(Cl)cc2)c([O-])c1 ZINC000436716009 944554464 /nfs/dbraw/zinc/55/44/64/944554464.db2.gz NSLGPDDBRILTRH-QGZVFWFLSA-N -1 3 355.825 3.607 20 0 FHADHM C[C@@H]1CCN(c2cc(C(=O)Nc3ccc([O-])c(C(F)(F)F)c3)ccn2)C1 ZINC000436721323 944561499 /nfs/dbraw/zinc/56/14/99/944561499.db2.gz IZTBFCCJUHWVJM-LLVKDONJSA-N -1 3 365.355 3.905 20 0 FHADHM CSc1nnc(CNC(=O)c2cc(Oc3ccccc3)ccc2[O-])s1 ZINC000436738529 944568405 /nfs/dbraw/zinc/56/84/05/944568405.db2.gz OGTZXCBXRREDBG-UHFFFAOYSA-N -1 3 373.459 3.688 20 0 FHADHM Cc1nnc(NC(=O)c2cc(Oc3ccccc3)ccc2[O-])n1C1CC1 ZINC000436739359 944568888 /nfs/dbraw/zinc/56/88/88/944568888.db2.gz WFHNEFUTAWJDEL-UHFFFAOYSA-N -1 3 350.378 3.672 20 0 FHADHM CCN(C(=O)c1ccc2c(c1[O-])OC(C)(C)C2)c1ccc(OC)c(OC)c1 ZINC000436758141 944580373 /nfs/dbraw/zinc/58/03/73/944580373.db2.gz LOTOHAZKOSZEAQ-UHFFFAOYSA-N -1 3 371.433 3.790 20 0 FHADHM CC(C)c1ccc(C(=O)N2CSC[C@@H]2C(=O)Nc2ccccc2)c([O-])c1 ZINC000436760361 944583485 /nfs/dbraw/zinc/58/34/85/944583485.db2.gz ORGIOMNKCOWAAS-QGZVFWFLSA-N -1 3 370.474 3.669 20 0 FHADHM CCc1ccc(C(=O)N2CCC(Cc3ccccc3CO)CC2)c([O-])c1 ZINC000436746346 944586323 /nfs/dbraw/zinc/58/63/23/944586323.db2.gz YGAQDFPZWIPVBR-UHFFFAOYSA-N -1 3 353.462 3.542 20 0 FHADHM Cc1ccc(C(=O)NCCC(=O)N(C)c2ccccc2C(C)C)c([O-])c1 ZINC000436773348 944602975 /nfs/dbraw/zinc/60/29/75/944602975.db2.gz IUFVBBMAGDHCIH-UHFFFAOYSA-N -1 3 354.450 3.607 20 0 FHADHM CC(C(=O)Nc1ccc(-c2nnn[n-]2)cc1)(c1ccccc1)c1ccccc1 ZINC000104368165 944622177 /nfs/dbraw/zinc/62/21/77/944622177.db2.gz ZHLHMOIJFWEHNE-UHFFFAOYSA-N -1 3 369.428 3.811 20 0 FHADHM CC(C(=O)Nc1ccc(-c2nn[n-]n2)cc1)(c1ccccc1)c1ccccc1 ZINC000104368165 944622183 /nfs/dbraw/zinc/62/21/83/944622183.db2.gz ZHLHMOIJFWEHNE-UHFFFAOYSA-N -1 3 369.428 3.811 20 0 FHADHM CCCCOc1ccc(C(=O)NCCc2nnc(C(C)C)s2)c([O-])c1 ZINC000436770550 944622496 /nfs/dbraw/zinc/62/24/96/944622496.db2.gz PIFVBUDPEXGXRW-UHFFFAOYSA-N -1 3 363.483 3.519 20 0 FHADHM COc1ccc2c(c1)C=C(S(=O)(=O)[N-]c1c(C)cccc1OC)CC2 ZINC000194213968 944629966 /nfs/dbraw/zinc/62/99/66/944629966.db2.gz ZOMPPQXANWHTOB-UHFFFAOYSA-N -1 3 359.447 3.741 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N[C@H]2c3cccc(F)c3CC[C@H]2C)c1 ZINC000436785877 944631632 /nfs/dbraw/zinc/63/16/32/944631632.db2.gz HBUHIGTXMVCMIY-NSPYISDASA-N -1 3 356.397 3.543 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N(Cc2ccccc2F)CC(C)C)c1 ZINC000436786914 944632596 /nfs/dbraw/zinc/63/25/96/944632596.db2.gz LHWJECUPVCBFDF-UHFFFAOYSA-N -1 3 358.413 3.788 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N(C)[C@@H](Cc2ccc(F)cc2)C(C)C)c1 ZINC000436789703 944638717 /nfs/dbraw/zinc/63/87/17/944638717.db2.gz LXFFRRYVZHCQQS-IBGZPJMESA-N -1 3 372.440 3.829 20 0 FHADHM C[C@H](C(=O)Nc1cccc(-c2nnn[n-]2)c1)c1c(Cl)cccc1Cl ZINC000625108091 944639359 /nfs/dbraw/zinc/63/93/59/944639359.db2.gz XIDDTFCEBXXYIP-VIFPVBQESA-N -1 3 362.220 3.916 20 0 FHADHM C[C@H](C(=O)Nc1cccc(-c2nn[n-]n2)c1)c1c(Cl)cccc1Cl ZINC000625108091 944639361 /nfs/dbraw/zinc/63/93/61/944639361.db2.gz XIDDTFCEBXXYIP-VIFPVBQESA-N -1 3 362.220 3.916 20 0 FHADHM CC(C)[C@H](SCc1ccccc1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000609169840 944640457 /nfs/dbraw/zinc/64/04/57/944640457.db2.gz YELRQHSRNYTVBB-KRWDZBQOSA-N -1 3 367.478 3.763 20 0 FHADHM CC(C)[C@H](SCc1ccccc1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000609169840 944640467 /nfs/dbraw/zinc/64/04/67/944640467.db2.gz YELRQHSRNYTVBB-KRWDZBQOSA-N -1 3 367.478 3.763 20 0 FHADHM CCC(CC)n1ccc(C(=O)Nc2cc(Br)ccc2[O-])n1 ZINC000436797075 944648411 /nfs/dbraw/zinc/64/84/11/944648411.db2.gz MCEUCOPGAPEHSE-UHFFFAOYSA-N -1 3 352.232 3.965 20 0 FHADHM COCCCC[C@H](NC(=O)c1c[n-]c2ccccc2c1=O)c1ccccc1 ZINC000473842828 944651411 /nfs/dbraw/zinc/65/14/11/944651411.db2.gz MIOLILULTJQZFR-IBGZPJMESA-N -1 3 364.445 3.816 20 0 FHADHM CCc1ccc(C(=O)N2CCC[C@@H]2c2cc(OC)ccc2OC)c([O-])c1 ZINC000436803102 944656868 /nfs/dbraw/zinc/65/68/68/944656868.db2.gz MNZIUTSEOPJCFE-GOSISDBHSA-N -1 3 355.434 3.949 20 0 FHADHM CN(Cc1cc(Br)ccc1Cl)C(=O)c1ccc(O)cc1[O-] ZINC000436807490 944663578 /nfs/dbraw/zinc/66/35/78/944663578.db2.gz LHTYVWXKGWUGIV-UHFFFAOYSA-N -1 3 370.630 3.786 20 0 FHADHM Cc1ccc([O-])c(C(=O)Nc2ccc(C(=O)N3CCCC[C@H]3C)cc2)c1 ZINC000436809062 944665231 /nfs/dbraw/zinc/66/52/31/944665231.db2.gz RLGKTOBOCPLQFD-OAHLLOKOSA-N -1 3 352.434 3.968 20 0 FHADHM CC(C)c1ccc(C(=O)N[C@@H](C)c2noc(Cc3ccccc3)n2)c([O-])c1 ZINC000436811872 944667402 /nfs/dbraw/zinc/66/74/02/944667402.db2.gz VVMSHUANWDOVIR-AWEZNQCLSA-N -1 3 365.433 3.980 20 0 FHADHM O=C(N=c1cc([C@@H]2CCCO2)[n-][nH]1)c1ccccc1CCc1ccccc1 ZINC000473847790 944673213 /nfs/dbraw/zinc/67/32/13/944673213.db2.gz DZMLLNODKYHKMB-FQEVSTJZSA-N -1 3 361.445 3.721 20 0 FHADHM O=C(N[C@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1)c1ccccc1[O-] ZINC000436816181 944673443 /nfs/dbraw/zinc/67/34/43/944673443.db2.gz CRWXONTWODPFAN-LJQANCHMSA-N -1 3 373.412 3.688 20 0 FHADHM CC(C)(O)CN(C(=O)c1cc(CCc2ccccc2)ccc1[O-])C1CC1 ZINC000436831176 944677313 /nfs/dbraw/zinc/67/73/13/944677313.db2.gz XJUHIVDKDRNJEV-UHFFFAOYSA-N -1 3 353.462 3.553 20 0 FHADHM O=C(N[C@H]1C[C@H](c2ccc(Br)cc2)C1)c1ccc(O)cc1[O-] ZINC000436833236 944678876 /nfs/dbraw/zinc/67/88/76/944678876.db2.gz VBASCRHCRYGNDD-AULYBMBSSA-N -1 3 362.223 3.536 20 0 FHADHM COc1ccc(NC(=O)c2cccc(C)c2[O-])cc1Oc1ccc(C)nn1 ZINC000436836312 944686547 /nfs/dbraw/zinc/68/65/47/944686547.db2.gz HJPJPNHWIRKGOZ-UHFFFAOYSA-N -1 3 365.389 3.852 20 0 FHADHM CCc1ccc(-c2nc([C@H]3CN(Cc4ccccc4)CCO3)no2)c([O-])c1 ZINC000436855537 944703170 /nfs/dbraw/zinc/70/31/70/944703170.db2.gz XFRWGHLOZCOHGR-LJQANCHMSA-N -1 3 365.433 3.578 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@H]1C[C@@H]1C1CCCCC1 ZINC000735873550 944709546 /nfs/dbraw/zinc/70/95/46/944709546.db2.gz CBEYIWIILHXUMS-MOPGFXCFSA-N -1 3 367.497 3.820 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@H]1C[C@@H]1C1CCCCC1 ZINC000735873550 944709552 /nfs/dbraw/zinc/70/95/52/944709552.db2.gz CBEYIWIILHXUMS-MOPGFXCFSA-N -1 3 367.497 3.820 20 0 FHADHM COc1cccc(C(=O)Nc2ccc(Cl)cc2OCC(F)F)c1[O-] ZINC000436843830 944709640 /nfs/dbraw/zinc/70/96/40/944709640.db2.gz KFMFCRDQQHCYKU-UHFFFAOYSA-N -1 3 357.740 3.950 20 0 FHADHM Cc1nn(-c2ccc(F)cc2)c(C)c1CNCc1ccccc1CC(=O)[O-] ZINC000426691851 944711149 /nfs/dbraw/zinc/71/11/49/944711149.db2.gz LYFATSRHMYPBAS-UHFFFAOYSA-N -1 3 367.424 3.545 20 0 FHADHM COc1cccc([C@@H]2C[C@H](C)CN2C(=O)c2cc(OC)c([O-])c(OC)c2)c1 ZINC000436848301 944714672 /nfs/dbraw/zinc/71/46/72/944714672.db2.gz UPWXWFWRNGRWFW-GUYCJALGSA-N -1 3 371.433 3.641 20 0 FHADHM O=C(c1ccc(O)cc1[O-])N1CC[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000436850935 944719531 /nfs/dbraw/zinc/71/95/31/944719531.db2.gz JPBSWRBSIFXYMA-LBPRGKRZSA-N -1 3 351.324 3.746 20 0 FHADHM O=C([O-])C[C@@H](NCc1cccc2cc[nH]c21)c1cnn(-c2ccccc2)c1 ZINC000426727157 944723678 /nfs/dbraw/zinc/72/36/78/944723678.db2.gz NBCMEMIKHLMOIM-LJQANCHMSA-N -1 3 360.417 3.659 20 0 FHADHM COc1cc2c(c(CN[C@H](c3ccccc3)[C@H](C)C(=O)[O-])c1)O[C@H](C)C2 ZINC000426724785 944726234 /nfs/dbraw/zinc/72/62/34/944726234.db2.gz VQKDOTICTFTBBO-TYILLQQXSA-N -1 3 355.434 3.570 20 0 FHADHM CCc1ccc(C(=O)Nc2ccc(OCCCOC)c(OC)c2)c([O-])c1 ZINC000436864938 944730203 /nfs/dbraw/zinc/73/02/03/944730203.db2.gz PETMZIJAAKPYTB-UHFFFAOYSA-N -1 3 359.422 3.631 20 0 FHADHM CCSc1ccc(Cl)cc1[N-]C(=O)c1ccc(C(=O)OC)cn1 ZINC000517855062 944734648 /nfs/dbraw/zinc/73/46/48/944734648.db2.gz ZJASSDNDCWXZSJ-UHFFFAOYSA-N -1 3 350.827 3.886 20 0 FHADHM COc1ccc([C@H]2CCCN2C(=O)c2ccc(C(C)=O)c([O-])c2)cc1OC ZINC000436872086 944737479 /nfs/dbraw/zinc/73/74/79/944737479.db2.gz SDKCCSDWAKOUKL-QGZVFWFLSA-N -1 3 369.417 3.589 20 0 FHADHM COC(=O)c1ccc(-c2nc(Cc3csc(-c4ccccc4)n3)no2)[n-]1 ZINC000426423873 944748991 /nfs/dbraw/zinc/74/89/91/944748991.db2.gz CECQKNAVSNQCLX-UHFFFAOYSA-N -1 3 366.402 3.566 20 0 FHADHM COc1cc2c(c(CN[C@@H](C(=O)[O-])c3cccc(C)c3C)c1)O[C@H](C)C2 ZINC000426740611 944753577 /nfs/dbraw/zinc/75/35/77/944753577.db2.gz BQMFVYKQWCELLS-BFUOFWGJSA-N -1 3 355.434 3.551 20 0 FHADHM CCc1ccc(-c2nc(CC(=O)Nc3ccc(Cl)cc3)no2)c([O-])c1 ZINC000436879546 944753510 /nfs/dbraw/zinc/75/35/10/944753510.db2.gz XIQVCWNERWBFJR-UHFFFAOYSA-N -1 3 357.797 3.839 20 0 FHADHM Cc1ccc(-c2nc([C@H](NC(=O)c3ccccc3)C(C)C)no2)c([O-])c1 ZINC000436880490 944754307 /nfs/dbraw/zinc/75/43/07/944754307.db2.gz JXMGTZNCWIUFSQ-QGZVFWFLSA-N -1 3 351.406 3.878 20 0 FHADHM Cc1ccc(-c2nc([C@@H](NC(=O)c3ccccc3)C(C)C)no2)c([O-])c1 ZINC000436880488 944754583 /nfs/dbraw/zinc/75/45/83/944754583.db2.gz JXMGTZNCWIUFSQ-KRWDZBQOSA-N -1 3 351.406 3.878 20 0 FHADHM O=C(c1cc2c(cc1[O-])CCCC2)N1CC2(CCOCC2)c2ccccc21 ZINC000436886145 944760780 /nfs/dbraw/zinc/76/07/80/944760780.db2.gz FUTGNQMDANDPBO-UHFFFAOYSA-N -1 3 363.457 3.980 20 0 FHADHM COc1cccc([C@@H](CC(=O)[O-])NCc2cccc3cccnc32)c1OC ZINC000426766142 944765212 /nfs/dbraw/zinc/76/52/12/944765212.db2.gz XELIHYJUNNFXMI-QGZVFWFLSA-N -1 3 366.417 3.558 20 0 FHADHM COc1ccc(CN[C@@H](C(=O)[O-])c2cc(C)cc(C)c2)cc1OC(F)F ZINC000426753945 944773856 /nfs/dbraw/zinc/77/38/56/944773856.db2.gz MFJAWXHSSNHTMS-QGZVFWFLSA-N -1 3 365.376 3.829 20 0 FHADHM O=C([O-])[C@H](NCc1ccc(OC(F)F)cc1)c1ccc(Cl)c(F)c1 ZINC000426755332 944776683 /nfs/dbraw/zinc/77/66/83/944776683.db2.gz YKRRKIRAABRIOL-CQSZACIVSA-N -1 3 359.731 3.996 20 0 FHADHM COc1cccc([C@H](CNC(=O)c2ccc(Cl)cc2[O-])N2CCCC2)c1 ZINC000436911881 944780916 /nfs/dbraw/zinc/78/09/16/944780916.db2.gz RVKKWFBNJRFPLP-SFHVURJKSA-N -1 3 374.868 3.621 20 0 FHADHM Cc1nc(CCNC(=O)c2cc(Oc3ccccc3)ccc2[O-])c(C)o1 ZINC000436901762 944792362 /nfs/dbraw/zinc/79/23/62/944792362.db2.gz IBWDBUJSIIKNNA-UHFFFAOYSA-N -1 3 352.390 3.762 20 0 FHADHM CSc1ccsc1C(=O)Nc1nc(-c2ccc([O-])c(Cl)c2)n[nH]1 ZINC000436916770 944798996 /nfs/dbraw/zinc/79/89/96/944798996.db2.gz XLVMHQOULHZNPP-UHFFFAOYSA-N -1 3 366.855 3.866 20 0 FHADHM CCCN(CC(=O)Nc1ccccc1OC)Cc1c(F)ccc([O-])c1F ZINC000506962435 944801583 /nfs/dbraw/zinc/80/15/83/944801583.db2.gz MFZTZMNRKZCWBL-UHFFFAOYSA-N -1 3 364.392 3.530 20 0 FHADHM COc1cccc([C@H](CC(=O)[O-])NC/C=C\c2ccc(F)cc2)c1OC ZINC000426805458 944806624 /nfs/dbraw/zinc/80/66/24/944806624.db2.gz BQEDNAPFMKYUQK-CHYADLBTSA-N -1 3 359.397 3.662 20 0 FHADHM COc1cccc(C(=O)Nc2ccc(OC3CCOCC3)c(C)c2)c1[O-] ZINC000436922845 944806968 /nfs/dbraw/zinc/80/69/68/944806968.db2.gz QQVVBYUBEWBNHV-UHFFFAOYSA-N -1 3 357.406 3.519 20 0 FHADHM COc1cc(C=Cc2cc(=O)[n-]c(C3CC3)n2)c(Br)cc1O ZINC000436926720 944812647 /nfs/dbraw/zinc/81/26/47/944812647.db2.gz MJKNHIAAXPXUOO-SNAWJCMRSA-N -1 3 363.211 3.707 20 0 FHADHM Cc1c([O-])ccc2c(CN3CCO[C@@H](c4cccc(F)c4)C3)cc(=O)oc12 ZINC000066848879 944813783 /nfs/dbraw/zinc/81/37/83/944813783.db2.gz 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ZINC000436964191 944840917 /nfs/dbraw/zinc/84/09/17/944840917.db2.gz PSBJGKODZWZLJQ-UHFFFAOYSA-N -1 3 371.289 3.719 20 0 FHADHM O=C(CSc1cc(Cl)ccc1Cl)N=c1cc([C@H]2CCCO2)[n-][nH]1 ZINC000473851161 944844225 /nfs/dbraw/zinc/84/42/25/944844225.db2.gz BBIPAHVBYFTMQN-GFCCVEGCSA-N -1 3 372.277 3.721 20 0 FHADHM CCc1ccc([C@@H](NCc2ccc(OC(F)F)c(OC)c2)C(=O)[O-])cc1 ZINC000426823842 944846470 /nfs/dbraw/zinc/84/64/70/944846470.db2.gz FCVOCHADXLWMBH-QGZVFWFLSA-N -1 3 365.376 3.775 20 0 FHADHM COCCOc1ccc(-c2noc(-c3cc4ccccc4cc3[O-])n2)cn1 ZINC000436952725 944848675 /nfs/dbraw/zinc/84/86/75/944848675.db2.gz YLBZPEGGVRQYGA-UHFFFAOYSA-N -1 3 363.373 3.683 20 0 FHADHM COc1ccc(CN[C@@H](C(=O)[O-])c2cccc(F)c2)cc1Br ZINC000426825779 944849799 /nfs/dbraw/zinc/84/97/99/944849799.db2.gz BSNWECUTNFZILM-OAHLLOKOSA-N -1 3 368.202 3.512 20 0 FHADHM CCCCOc1ccc(CN[C@H](C(=O)[O-])c2cccc(F)c2)cc1OC ZINC000426826204 944850432 /nfs/dbraw/zinc/85/04/32/944850432.db2.gz ODQIQVNPZAAMCE-IBGZPJMESA-N -1 3 361.413 3.929 20 0 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CC(C)(CO)[C@@H](CNc1c(Cl)cccc1-c1nnn[n-]1)c1ccccc1 ZINC000824163126 946604252 /nfs/dbraw/zinc/60/42/52/946604252.db2.gz YVLKKBURVUAFFH-HNNXBMFYSA-N -1 3 371.872 3.734 20 0 FHADHM CC(C)(CO)[C@@H](CNc1c(Cl)cccc1-c1nn[n-]n1)c1ccccc1 ZINC000824163126 946604256 /nfs/dbraw/zinc/60/42/56/946604256.db2.gz YVLKKBURVUAFFH-HNNXBMFYSA-N -1 3 371.872 3.734 20 0 FHADHM Cc1cc(S(=O)(=O)[N-]Cc2ccccc2OC(F)F)sc1Cl ZINC000473910690 946622606 /nfs/dbraw/zinc/62/26/06/946622606.db2.gz HHBXFESEYFZESH-UHFFFAOYSA-N -1 3 367.826 3.790 20 0 FHADHM Cc1cc(S(=O)(=O)[N-]Cc2ccc(OC(F)F)cc2)sc1Cl ZINC000473912289 946625322 /nfs/dbraw/zinc/62/53/22/946625322.db2.gz PTFZWQZLDDJWSH-UHFFFAOYSA-N -1 3 367.826 3.790 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@@H]2C(=O)Nc2ccc(Cc3nnn[n-]3)cc2)cc1 ZINC000473909351 946636123 /nfs/dbraw/zinc/63/61/23/946636123.db2.gz BQLMCYZEHDDMDV-MOPGFXCFSA-N -1 3 361.449 3.656 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@@H]2C(=O)Nc2ccc(Cc3nn[n-]n3)cc2)cc1 ZINC000473909351 946636125 /nfs/dbraw/zinc/63/61/25/946636125.db2.gz BQLMCYZEHDDMDV-MOPGFXCFSA-N -1 3 361.449 3.656 20 0 FHADHM Cc1nc(C)c(CC(=O)N[C@H](C)c2cc(Cl)ccc2Cl)c(=O)[n-]1 ZINC000428361098 946697615 /nfs/dbraw/zinc/69/76/15/946697615.db2.gz JNZVQJMDIAUADA-MRVPVSSYSA-N -1 3 354.237 3.526 20 0 FHADHM C[C@@H](NC(=O)/C=C/C1CC1)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824479845 946729762 /nfs/dbraw/zinc/72/97/62/946729762.db2.gz QEHCVMYJMGHQRD-WEKMIXOTSA-N -1 3 359.433 3.677 20 0 FHADHM C[C@@H](NC(=O)/C=C/C1CC1)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824479845 946729772 /nfs/dbraw/zinc/72/97/72/946729772.db2.gz QEHCVMYJMGHQRD-WEKMIXOTSA-N -1 3 359.433 3.677 20 0 FHADHM C[C@H](NC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)C1CCC1 ZINC000824522347 946761061 /nfs/dbraw/zinc/76/10/61/946761061.db2.gz RABZKSLJAXQMPC-ZDUSSCGKSA-N -1 3 363.421 3.577 20 0 FHADHM C[C@H](NC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)C1CCC1 ZINC000824522347 946761067 /nfs/dbraw/zinc/76/10/67/946761067.db2.gz RABZKSLJAXQMPC-ZDUSSCGKSA-N -1 3 363.421 3.577 20 0 FHADHM C[C@H](N[C@@H](c1ccccc1)c1ccccn1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824536931 946773086 /nfs/dbraw/zinc/77/30/86/946773086.db2.gz AIPYZVGVFLSALO-XOBRGWDASA-N -1 3 374.423 3.841 20 0 FHADHM C[C@H](N[C@@H](c1ccccc1)c1ccccn1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824536931 946773099 /nfs/dbraw/zinc/77/30/99/946773099.db2.gz AIPYZVGVFLSALO-XOBRGWDASA-N -1 3 374.423 3.841 20 0 FHADHM C[C@H](N[C@H](c1nccs1)c1ccccc1)c1cccc(-c2nnn[n-]2)c1 ZINC000824537632 946775078 /nfs/dbraw/zinc/77/50/78/946775078.db2.gz FGRQKKHVVRAHKQ-GUYCJALGSA-N -1 3 362.462 3.763 20 0 FHADHM C[C@H](N[C@H](c1nccs1)c1ccccc1)c1cccc(-c2nn[n-]n2)c1 ZINC000824537632 946775084 /nfs/dbraw/zinc/77/50/84/946775084.db2.gz FGRQKKHVVRAHKQ-GUYCJALGSA-N -1 3 362.462 3.763 20 0 FHADHM C[C@@H](N[C@@H](c1cccc(F)c1)c1ccccn1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824540085 946780386 /nfs/dbraw/zinc/78/03/86/946780386.db2.gz RKCHRFYCGKTBHV-VLIAUNLRSA-N -1 3 374.423 3.841 20 0 FHADHM O=C(NCc1ncccc1[O-])NC(CCC(F)(F)F)CCC(F)(F)F ZINC000661901192 946850559 /nfs/dbraw/zinc/85/05/59/946850559.db2.gz ZTMHHDIHSDPOJU-UHFFFAOYSA-N -1 3 373.297 3.640 20 0 FHADHM CC(=O)c1cc(Cl)ccc1OCc1cc(Cl)cc(-c2nnn[n-]2)c1 ZINC001573553710 946890007 /nfs/dbraw/zinc/89/00/07/946890007.db2.gz JMMQYOIJZIPJMZ-UHFFFAOYSA-N -1 3 363.204 3.955 20 0 FHADHM CC(=O)c1cc(Cl)ccc1OCc1cc(Cl)cc(-c2nn[n-]n2)c1 ZINC001573553710 946890024 /nfs/dbraw/zinc/89/00/24/946890024.db2.gz JMMQYOIJZIPJMZ-UHFFFAOYSA-N -1 3 363.204 3.955 20 0 FHADHM C[C@@H]1CC[C@H](C(=O)NCc2ccc(-c3ccccc3-c3nnn[n-]3)cc2)C1 ZINC000824901555 946986438 /nfs/dbraw/zinc/98/64/38/946986438.db2.gz ZCOZNGMGRSYPGI-PBHICJAKSA-N -1 3 361.449 3.586 20 0 FHADHM C[C@@H]1CC[C@H](C(=O)NCc2ccc(-c3ccccc3-c3nn[n-]n3)cc2)C1 ZINC000824901555 946986446 /nfs/dbraw/zinc/98/64/46/946986446.db2.gz ZCOZNGMGRSYPGI-PBHICJAKSA-N -1 3 361.449 3.586 20 0 FHADHM CC[C@H](C(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(OC)cc1 ZINC000825039564 947055565 /nfs/dbraw/zinc/05/55/65/947055565.db2.gz UAXQESQEVPKFJT-UGSOOPFHSA-N -1 3 366.421 3.673 20 0 FHADHM CC[C@H](C(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(OC)cc1 ZINC000825039564 947055576 /nfs/dbraw/zinc/05/55/76/947055576.db2.gz UAXQESQEVPKFJT-UGSOOPFHSA-N -1 3 366.421 3.673 20 0 FHADHM CC[C@@H](C(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(OC)cc1 ZINC000825039563 947055690 /nfs/dbraw/zinc/05/56/90/947055690.db2.gz UAXQESQEVPKFJT-SCLBCKFNSA-N -1 3 366.421 3.673 20 0 FHADHM CC[C@@H](C(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(OC)cc1 ZINC000825039563 947055701 /nfs/dbraw/zinc/05/57/01/947055701.db2.gz UAXQESQEVPKFJT-SCLBCKFNSA-N -1 3 366.421 3.673 20 0 FHADHM CCC(CC)CS(=O)(=O)[N-][C@H](CCC(C)(C)C)C(=O)OC(C)(C)C ZINC001211897329 947065451 /nfs/dbraw/zinc/06/54/51/947065451.db2.gz QKISYBKINUGUBE-OAHLLOKOSA-N -1 3 363.564 3.879 20 0 FHADHM CCCNc1ccc(Cl)cc1NC(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000825333122 947156340 /nfs/dbraw/zinc/15/63/40/947156340.db2.gz SBICLPODSBOYQA-UHFFFAOYSA-N -1 3 362.846 3.656 20 0 FHADHM CCCNc1ccc(Cl)cc1NC(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000825333122 947156343 /nfs/dbraw/zinc/15/63/43/947156343.db2.gz SBICLPODSBOYQA-UHFFFAOYSA-N -1 3 362.846 3.656 20 0 FHADHM CCCNc1ccc(Cl)cc1NC(=O)Cc1cccc(-c2nnn[n-]2)c1 ZINC000825332197 947156836 /nfs/dbraw/zinc/15/68/36/947156836.db2.gz FOWSLGUFFNZPMM-UHFFFAOYSA-N -1 3 370.844 3.523 20 0 FHADHM CCCNc1ccc(Cl)cc1NC(=O)Cc1cccc(-c2nn[n-]n2)c1 ZINC000825332197 947156845 /nfs/dbraw/zinc/15/68/45/947156845.db2.gz FOWSLGUFFNZPMM-UHFFFAOYSA-N -1 3 370.844 3.523 20 0 FHADHM CCN(C(=O)c1cc(C)cc(F)c1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825379267 947168132 /nfs/dbraw/zinc/16/81/32/947168132.db2.gz FKMNJDYPCASBPU-UHFFFAOYSA-N -1 3 359.792 3.634 20 0 FHADHM CCN(C(=O)c1cc(C)cc(F)c1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825379267 947168146 /nfs/dbraw/zinc/16/81/46/947168146.db2.gz FKMNJDYPCASBPU-UHFFFAOYSA-N -1 3 359.792 3.634 20 0 FHADHM C[C@H](CN(Cc1cnn(Cc2ccccc2)c1)Cc1ccccc1)C(=O)[O-] ZINC000652456514 947173178 /nfs/dbraw/zinc/17/31/78/947173178.db2.gz OLRFNATUJRBOAI-GOSISDBHSA-N -1 3 363.461 3.654 20 0 FHADHM C[C@H]([N-]S(=O)(=O)c1cncc(Cl)c1)c1nc(C(C)(C)C)cs1 ZINC000330453509 947173552 /nfs/dbraw/zinc/17/35/52/947173552.db2.gz LRSCQMMXXDGEPU-VIFPVBQESA-N -1 3 359.904 3.529 20 0 FHADHM CCN(CC)C(=O)N[C@@H](C)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000825406047 947177138 /nfs/dbraw/zinc/17/71/38/947177138.db2.gz HIWPOVPAXLQTIM-AWEZNQCLSA-N -1 3 364.453 3.646 20 0 FHADHM CCN(CC)C(=O)N[C@@H](C)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000825406047 947177141 /nfs/dbraw/zinc/17/71/41/947177141.db2.gz HIWPOVPAXLQTIM-AWEZNQCLSA-N -1 3 364.453 3.646 20 0 FHADHM Cc1ccc(-c2nc(NC(=O)[C@H](C)Oc3cccc4ccccc43)n[n-]2)o1 ZINC000444822048 947234119 /nfs/dbraw/zinc/23/41/19/947234119.db2.gz GBIXLYKWDOWLJP-ZDUSSCGKSA-N -1 3 362.389 3.932 20 0 FHADHM Cc1ccc(OCc2nc(CN3C[C@@H]4CCC[C@@H]4[C@@H]3C(=O)[O-])cs2)cc1 ZINC000652491190 947235265 /nfs/dbraw/zinc/23/52/65/947235265.db2.gz AEBHHOPHLISFPO-UCLAIMLFSA-N -1 3 372.490 3.716 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@@H](O)c3ccccc3Cl)nc2)n1 ZINC000301359182 947306577 /nfs/dbraw/zinc/30/65/77/947306577.db2.gz OAWGBAYBXHEPPO-MRXNPFEDSA-N -1 3 370.840 3.606 20 0 FHADHM CCO[C@H]1C[C@H](Nc2ccc(-c3nc(CC)cc(=O)[n-]3)cn2)C12CCCC2 ZINC000301424165 947336906 /nfs/dbraw/zinc/33/69/06/947336906.db2.gz FZYBGEZEEZHDEP-IRXDYDNUSA-N -1 3 368.481 3.956 20 0 FHADHM CCO[C@@H]1C[C@@H](Nc2ccc(-c3nc(CC)cc(=O)[n-]3)cn2)C12CCCC2 ZINC000301424164 947337510 /nfs/dbraw/zinc/33/75/10/947337510.db2.gz FZYBGEZEEZHDEP-IAGOWNOFSA-N -1 3 368.481 3.956 20 0 FHADHM CN(C[C@@H]1CC=CCC1)C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825908531 947365731 /nfs/dbraw/zinc/36/57/31/947365731.db2.gz JBOMPKPVCAGBRU-LLVKDONJSA-N -1 3 362.890 3.505 20 0 FHADHM CN(C[C@@H]1CC=CCC1)C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825908531 947365745 /nfs/dbraw/zinc/36/57/45/947365745.db2.gz JBOMPKPVCAGBRU-LLVKDONJSA-N -1 3 362.890 3.505 20 0 FHADHM COc1ccc(NC(=O)c2cccc(CN3CCCCC3)c2)c(C(=O)[O-])c1 ZINC000909613549 947383747 /nfs/dbraw/zinc/38/37/47/947383747.db2.gz PVRQJIAFHCKLCC-UHFFFAOYSA-N -1 3 368.433 3.632 20 0 FHADHM CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)Nc1csc2ccccc12 ZINC000825958446 947387825 /nfs/dbraw/zinc/38/78/25/947387825.db2.gz WXISEYWTBLZYJE-UHFFFAOYSA-N -1 3 364.434 3.745 20 0 FHADHM CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)Nc1csc2ccccc12 ZINC000825958446 947387838 /nfs/dbraw/zinc/38/78/38/947387838.db2.gz WXISEYWTBLZYJE-UHFFFAOYSA-N -1 3 364.434 3.745 20 0 FHADHM CCOC(=O)c1ccc(NC(=O)c2sc(C)cc2OC(F)F)c([O-])c1 ZINC000536335505 947531987 /nfs/dbraw/zinc/53/19/87/947531987.db2.gz FZIBZGRCWYCIIU-UHFFFAOYSA-N -1 3 371.361 3.793 20 0 FHADHM COCc1csc(CN[C@H](C(=O)[O-])c2cccc(C(F)(F)F)c2)c1 ZINC000663261880 947584533 /nfs/dbraw/zinc/58/45/33/947584533.db2.gz NYIFUSJLCATCOE-AWEZNQCLSA-N -1 3 359.369 3.829 20 0 FHADHM COc1cc2ccccc2cc1CNC[C@@H](CCC(=O)[O-])C(F)(F)F ZINC000663261536 947584662 /nfs/dbraw/zinc/58/46/62/947584662.db2.gz KOFCTICYUFOSTN-OAHLLOKOSA-N -1 3 355.356 3.981 20 0 FHADHM COc1cc(C=NNc2ccc([N+](=O)[O-])cc2)cc(Br)c1[O-] ZINC000254751627 947616297 /nfs/dbraw/zinc/61/62/97/947616297.db2.gz CCYPVLNXMHQBLV-UHFFFAOYSA-N -1 3 366.171 3.518 20 0 FHADHM COc1ccc2oc([C@H](C)Nc3nccc(C)c3-c3nnn[n-]3)c(C)c2c1 ZINC000826213865 947623490 /nfs/dbraw/zinc/62/34/90/947623490.db2.gz PKRIZKKPRLLVNZ-LBPRGKRZSA-N -1 3 364.409 3.806 20 0 FHADHM COc1ccc2oc([C@H](C)Nc3nccc(C)c3-c3nn[n-]n3)c(C)c2c1 ZINC000826213865 947623498 /nfs/dbraw/zinc/62/34/98/947623498.db2.gz PKRIZKKPRLLVNZ-LBPRGKRZSA-N -1 3 364.409 3.806 20 0 FHADHM Cc1ccc([O-])c(C(=O)Nc2ccc(NC(=O)NCc3ccco3)cc2)c1 ZINC000021209171 947653503 /nfs/dbraw/zinc/65/35/03/947653503.db2.gz KEZXHCABUKDZPW-UHFFFAOYSA-N -1 3 365.389 3.868 20 0 FHADHM Cc1oncc1C(=O)Nc1ccc([O-])c(C(=O)N[C@@H]2CCC[C@@H](C)CC2)c1 ZINC000189472406 947738796 /nfs/dbraw/zinc/73/87/96/947738796.db2.gz OZTUXUMEZNHMJB-TZMCWYRMSA-N -1 3 371.437 3.640 20 0 FHADHM O=C(c1cc2c(cc1[O-])OCO2)N1CCC[C@H]1Cc1ccccc1Cl ZINC000094039770 947783193 /nfs/dbraw/zinc/78/31/93/947783193.db2.gz RPIBTJXRIQTNNS-ZDUSSCGKSA-N -1 3 359.809 3.622 20 0 FHADHM Cc1cc(NCc2cc(-c3nnn[n-]3)cs2)ccc1Br ZINC000826271475 947787580 /nfs/dbraw/zinc/78/75/80/947787580.db2.gz SPLCFFDSHJWJST-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM Cc1cc(NCc2cc(-c3nn[n-]n3)cs2)ccc1Br ZINC000826271475 947787584 /nfs/dbraw/zinc/78/75/84/947787584.db2.gz SPLCFFDSHJWJST-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM Cc1ccc(C2CCN(c3cc(Cl)ccc3-c3nnn[n-]3)CC2)cn1 ZINC000826285960 947825225 /nfs/dbraw/zinc/82/52/25/947825225.db2.gz PBDBFFCWCZOZAF-UHFFFAOYSA-N -1 3 354.845 3.608 20 0 FHADHM Cc1ccc(C2CCN(c3cc(Cl)ccc3-c3nn[n-]n3)CC2)cn1 ZINC000826285960 947825231 /nfs/dbraw/zinc/82/52/31/947825231.db2.gz PBDBFFCWCZOZAF-UHFFFAOYSA-N -1 3 354.845 3.608 20 0 FHADHM O=S(=O)([N-]c1ccsc1Cl)c1ccc(OCC(F)(F)F)nc1 ZINC000189729844 947826897 /nfs/dbraw/zinc/82/68/97/947826897.db2.gz BRFKBTCJICGWGD-UHFFFAOYSA-N -1 3 372.777 3.538 20 0 FHADHM Cc1ccc([C@@H]2CCCCCN2C(=O)c2ccc(-c3nnn[n-]3)cc2C)o1 ZINC000826286365 947827389 /nfs/dbraw/zinc/82/73/89/947827389.db2.gz ZJCVZVDUIQVKNF-KRWDZBQOSA-N -1 3 365.437 3.834 20 0 FHADHM Cc1ccc([C@@H]2CCCCCN2C(=O)c2ccc(-c3nn[n-]n3)cc2C)o1 ZINC000826286365 947827399 /nfs/dbraw/zinc/82/73/99/947827399.db2.gz ZJCVZVDUIQVKNF-KRWDZBQOSA-N -1 3 365.437 3.834 20 0 FHADHM Cc1ccc(CNc2ccn(-c3ccc(-c4nn[n-]n4)cc3Cl)n2)s1 ZINC000826288431 947839564 /nfs/dbraw/zinc/83/95/64/947839564.db2.gz GRYHJITYMHWCLT-UHFFFAOYSA-N -1 3 371.857 3.688 20 0 FHADHM Cc1ccc(CNc2ccn(-c3ccc(Cl)cc3-c3nnn[n-]3)n2)cc1 ZINC000826288711 947840589 /nfs/dbraw/zinc/84/05/89/947840589.db2.gz SVSQRAPBGNGVSH-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM Cc1ccc(CNc2ccn(-c3ccc(Cl)cc3-c3nn[n-]n3)n2)cc1 ZINC000826288711 947840597 /nfs/dbraw/zinc/84/05/97/947840597.db2.gz SVSQRAPBGNGVSH-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM Cc1ccnc(N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)c1-c1nnn[n-]1 ZINC000826310369 947895210 /nfs/dbraw/zinc/89/52/10/947895210.db2.gz TYAYAMSGOZXUAV-ZDUSSCGKSA-N -1 3 374.370 3.583 20 0 FHADHM Cc1ccnc(N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)c1-c1nn[n-]n1 ZINC000826310369 947895219 /nfs/dbraw/zinc/89/52/19/947895219.db2.gz TYAYAMSGOZXUAV-ZDUSSCGKSA-N -1 3 374.370 3.583 20 0 FHADHM Cc1nc(C(C)C)sc1[C@@H](C)OC(=O)c1sccc1-c1nnn[n-]1 ZINC000826323950 947947859 /nfs/dbraw/zinc/94/78/59/947947859.db2.gz YVHNZJKHBAKMCS-SECBINFHSA-N -1 3 363.468 3.735 20 0 FHADHM C[C@H](CCc1ccco1)[N-]S(=O)(=O)c1csc(-c2ccccc2)n1 ZINC000500444956 948014494 /nfs/dbraw/zinc/01/44/94/948014494.db2.gz DKWCSLOZRWIIAK-CYBMUJFWSA-N -1 3 362.476 3.703 20 0 FHADHM Clc1ccc(C=Cc2ccc(-c3nnn[n-]3)cn2)cc1Br ZINC000826351848 948099682 /nfs/dbraw/zinc/09/96/82/948099682.db2.gz DBBBBXWUGKTIBI-DAFODLJHSA-N -1 3 362.618 3.848 20 0 FHADHM Clc1ccc(C=Cc2ccc(-c3nn[n-]n3)cn2)cc1Br ZINC000826351848 948099693 /nfs/dbraw/zinc/09/96/93/948099693.db2.gz DBBBBXWUGKTIBI-DAFODLJHSA-N -1 3 362.618 3.848 20 0 FHADHM CC(C)(C)[C@H](NC(=O)Nc1ccc2c(c1)C(=O)[N-]C2=O)c1ccc(F)cc1 ZINC000520494179 948104797 /nfs/dbraw/zinc/10/47/97/948104797.db2.gz YGNBWOYWEIBQAL-MRXNPFEDSA-N -1 3 369.396 3.618 20 0 FHADHM FC(F)(F)CCCCN[C@@H](c1cccc(-c2nnn[n-]2)c1)C(F)(F)F ZINC000826367504 948145791 /nfs/dbraw/zinc/14/57/91/948145791.db2.gz BDBYRYGSGHRYHP-NSHDSACASA-N -1 3 367.297 3.792 20 0 FHADHM FC(F)(F)CCCCN[C@@H](c1cccc(-c2nn[n-]n2)c1)C(F)(F)F ZINC000826367504 948145796 /nfs/dbraw/zinc/14/57/96/948145796.db2.gz BDBYRYGSGHRYHP-NSHDSACASA-N -1 3 367.297 3.792 20 0 FHADHM FC(F)(F)c1cc(Sc2nc(C3CC3)ns2)ccc1-c1nnn[n-]1 ZINC000826368354 948148450 /nfs/dbraw/zinc/14/84/50/948148450.db2.gz MGGHLLVTMNFLKZ-UHFFFAOYSA-N -1 3 370.385 3.766 20 0 FHADHM FC(F)(F)c1cc(Sc2nc(C3CC3)ns2)ccc1-c1nn[n-]n1 ZINC000826368354 948148455 /nfs/dbraw/zinc/14/84/55/948148455.db2.gz MGGHLLVTMNFLKZ-UHFFFAOYSA-N -1 3 370.385 3.766 20 0 FHADHM FC(F)(F)c1cc(-c2nn[n-]n2)ccc1NCc1ccc(Cl)cn1 ZINC000826368081 948149311 /nfs/dbraw/zinc/14/93/11/948149311.db2.gz BAFJEDQIWPCGAU-UHFFFAOYSA-N -1 3 354.723 3.546 20 0 FHADHM Fc1ccc(-c2nc(CNc3ccc(F)c(-c4nnn[n-]4)c3)cs2)cc1 ZINC000826372602 948156031 /nfs/dbraw/zinc/15/60/31/948156031.db2.gz DZLQXLCLCHYWAN-UHFFFAOYSA-N -1 3 370.388 3.881 20 0 FHADHM Fc1ccc(-c2nc(CNc3ccc(F)c(-c4nn[n-]n4)c3)cs2)cc1 ZINC000826372602 948156037 /nfs/dbraw/zinc/15/60/37/948156037.db2.gz DZLQXLCLCHYWAN-UHFFFAOYSA-N -1 3 370.388 3.881 20 0 FHADHM Fc1ccc(CNc2ccc(Br)cc2-c2nnn[n-]2)c(F)c1 ZINC000826374805 948163427 /nfs/dbraw/zinc/16/34/27/948163427.db2.gz MXTUJROSVDOVRB-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1ccc(CNc2ccc(Br)cc2-c2nn[n-]n2)c(F)c1 ZINC000826374805 948163434 /nfs/dbraw/zinc/16/34/34/948163434.db2.gz MXTUJROSVDOVRB-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM CCCCOc1ccc(C(=O)N2CCO[C@H](c3cccs3)C2)c([O-])c1 ZINC000190643887 948220794 /nfs/dbraw/zinc/22/07/94/948220794.db2.gz MUECYRQDWCDBIB-KRWDZBQOSA-N -1 3 361.463 3.846 20 0 FHADHM COc1ccc(CN[C@@H](C(=O)[O-])c2ccc(Cl)c(C)c2)c(C)c1OC ZINC000417560820 948224748 /nfs/dbraw/zinc/22/47/48/948224748.db2.gz APQSLYLTOTXRQN-QGZVFWFLSA-N -1 3 363.841 3.890 20 0 FHADHM Cc1ccc(C(=O)N2C[C@H](O)C[C@@H]2c2cccc(C(F)(F)F)c2)c([O-])c1 ZINC000093242710 948277561 /nfs/dbraw/zinc/27/75/61/948277561.db2.gz NNCYFWPEFLWVRC-GDBMZVCRSA-N -1 3 365.351 3.668 20 0 FHADHM Cc1ccc(C(=O)N2C[C@H](O)C[C@H]2c2cccc(C(F)(F)F)c2)c([O-])c1 ZINC000093242712 948277700 /nfs/dbraw/zinc/27/77/00/948277700.db2.gz NNCYFWPEFLWVRC-ZBFHGGJFSA-N -1 3 365.351 3.668 20 0 FHADHM O=C(Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1)[C@H]1CCCCS1 ZINC000826460527 948344121 /nfs/dbraw/zinc/34/41/21/948344121.db2.gz GZPQFEMOAXXOKA-CYBMUJFWSA-N -1 3 371.491 3.819 20 0 FHADHM O=C(Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1)[C@H]1CCCCS1 ZINC000826460527 948344129 /nfs/dbraw/zinc/34/41/29/948344129.db2.gz GZPQFEMOAXXOKA-CYBMUJFWSA-N -1 3 371.491 3.819 20 0 FHADHM O=C(Nc1ncc(C2CCCCC2)s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000826459931 948345245 /nfs/dbraw/zinc/34/52/45/948345245.db2.gz GCLSYDCVIIVJSV-UHFFFAOYSA-N -1 3 354.439 3.623 20 0 FHADHM O=C(Nc1ncc(C2CCCCC2)s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000826459931 948345251 /nfs/dbraw/zinc/34/52/51/948345251.db2.gz GCLSYDCVIIVJSV-UHFFFAOYSA-N -1 3 354.439 3.623 20 0 FHADHM CC(C)(C)OC(=O)CC[C@@H](NCc1cccc(Cl)c1Cl)C(=O)[O-] ZINC000417632331 948370391 /nfs/dbraw/zinc/37/03/91/948370391.db2.gz YLAROSHIUNNUBZ-GFCCVEGCSA-N -1 3 362.253 3.658 20 0 FHADHM O=S(=O)([N-][C@@H]1C[C@@H]1c1ccccc1)c1c2ncsc2ccc1Cl ZINC001211699988 948374658 /nfs/dbraw/zinc/37/46/58/948374658.db2.gz QCMJPZXDAWWNPW-DGCLKSJQSA-N -1 3 364.879 3.784 20 0 FHADHM CC[C@H](CCNCc1csc(COc2ccc(Cl)cc2)n1)C(=O)[O-] ZINC000417645257 948387235 /nfs/dbraw/zinc/38/72/35/948387235.db2.gz DDHOTSVHKSEBOY-GFCCVEGCSA-N -1 3 368.886 3.966 20 0 FHADHM CC(C)[C@@H](CC(=O)Nc1cc(-c2nnn[n-]2)ccc1F)c1ccccc1 ZINC001275483034 948496309 /nfs/dbraw/zinc/49/63/09/948496309.db2.gz GKTPJTOPFNAURB-OAHLLOKOSA-N -1 3 353.401 3.774 20 0 FHADHM CC(C)[C@@H](CC(=O)Nc1cc(-c2nn[n-]n2)ccc1F)c1ccccc1 ZINC001275483034 948496313 /nfs/dbraw/zinc/49/63/13/948496313.db2.gz GKTPJTOPFNAURB-OAHLLOKOSA-N -1 3 353.401 3.774 20 0 FHADHM CC(C)(Cc1ccc(Cl)cc1)C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC001290405370 948497607 /nfs/dbraw/zinc/49/76/07/948497607.db2.gz QLUAQHRMCTXDSO-UHFFFAOYSA-N -1 3 355.829 3.728 20 0 FHADHM CC(C)(Cc1ccc(Cl)cc1)C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC001290405370 948497611 /nfs/dbraw/zinc/49/76/11/948497611.db2.gz QLUAQHRMCTXDSO-UHFFFAOYSA-N -1 3 355.829 3.728 20 0 FHADHM CCCc1ccc(S(=O)(=O)[N-]c2cccc3c2OCC[C@@H]3N(C)C)cc1 ZINC000432474248 948529702 /nfs/dbraw/zinc/52/97/02/948529702.db2.gz BFUZTADIFWENNO-IBGZPJMESA-N -1 3 374.506 3.825 20 0 FHADHM Cc1cccc(C[N-]S(=O)(=O)c2c(Cl)cc(Cl)cc2Cl)n1 ZINC000055277002 948530279 /nfs/dbraw/zinc/53/02/79/948530279.db2.gz SCINBXLLVVMVNV-UHFFFAOYSA-N -1 3 365.669 3.829 20 0 FHADHM CC(C)c1ccccc1S(=O)(=O)[N-]c1cccc2c1OCC[C@H]2N(C)C ZINC000432488947 948564178 /nfs/dbraw/zinc/56/41/78/948564178.db2.gz MMVGUKCBSCGQIX-GOSISDBHSA-N -1 3 374.506 3.996 20 0 FHADHM CCOC(=O)c1nc([C@H](CC(C)C)NCc2cc3cc(F)ccc3o2)n[n-]1 ZINC000895104342 948580932 /nfs/dbraw/zinc/58/09/32/948580932.db2.gz JSLFEPAPNFAMBC-HNNXBMFYSA-N -1 3 374.416 3.744 20 0 FHADHM CCOC(=O)c1nnc([C@H](CC(C)C)NCc2cc3cc(F)ccc3o2)[n-]1 ZINC000895104342 948580938 /nfs/dbraw/zinc/58/09/38/948580938.db2.gz JSLFEPAPNFAMBC-HNNXBMFYSA-N -1 3 374.416 3.744 20 0 FHADHM CCOC(=O)c1n[n-]c([C@H](CC(C)C)NCc2cc3cc(F)ccc3o2)n1 ZINC000895104342 948580953 /nfs/dbraw/zinc/58/09/53/948580953.db2.gz JSLFEPAPNFAMBC-HNNXBMFYSA-N -1 3 374.416 3.744 20 0 FHADHM COc1ccc(Cl)cc1-c1cc(=NC(=O)C2Cc3ccccc3C2)[nH][n-]1 ZINC000432503738 948623780 /nfs/dbraw/zinc/62/37/80/948623780.db2.gz FUDHDCNMORNFFI-UHFFFAOYSA-N -1 3 367.836 3.514 20 0 FHADHM Cc1c[nH]cc1C(=O)Nc1ccc([N-]S(=O)(=O)c2ccc(C)cc2)cc1 ZINC000512175388 948655088 /nfs/dbraw/zinc/65/50/88/948655088.db2.gz LOUKKHNFRDZDKV-UHFFFAOYSA-N -1 3 369.446 3.685 20 0 FHADHM Cc1ccccc1-c1cc(=NC(=O)c2ccc3[nH]c(C(F)F)nc3c2)[nH][n-]1 ZINC000520716980 948687888 /nfs/dbraw/zinc/68/78/88/948687888.db2.gz MWJWSPVXSMCPNU-UHFFFAOYSA-N -1 3 367.359 3.873 20 0 FHADHM O=C(N=c1cc(-c2ccccc2)[n-][nH]1)c1ccc(OCc2ccccc2)nc1 ZINC000512188389 948741659 /nfs/dbraw/zinc/74/16/59/948741659.db2.gz AWNGZPSAKSMYPS-UHFFFAOYSA-N -1 3 370.412 3.725 20 0 FHADHM Cc1ccc2nc(C(=O)Nc3ccc(-c4nc(C)cc(=O)[n-]4)cc3)ccc2c1 ZINC000549641447 948783819 /nfs/dbraw/zinc/78/38/19/948783819.db2.gz QITLMXJGYQGAPB-UHFFFAOYSA-N -1 3 370.412 3.854 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)c3ccc(Cl)s3)c2)n1 ZINC000107750947 209278377 /nfs/dbraw/zinc/27/83/77/209278377.db2.gz UKSIOURJPRGXBV-UHFFFAOYSA-N -1 3 359.838 3.967 20 0 FHADHM CCOc1ccc(S(=O)(=O)[N-]c2cc(F)ccc2F)cc1OCC ZINC000007927759 207211909 /nfs/dbraw/zinc/21/19/09/207211909.db2.gz NWVOTWVGIRUOCZ-UHFFFAOYSA-N -1 3 357.378 3.563 20 0 FHADHM Cc1ccc(NC(=O)[C@H](C)Oc2ccc(Br)cc2)c([O-])c1 ZINC000015922863 207575247 /nfs/dbraw/zinc/57/52/47/207575247.db2.gz PNJJZCCJHVRTSW-NSHDSACASA-N -1 3 350.212 3.869 20 0 FHADHM O=C(Nc1ccn(-c2ccccc2Cl)n1)c1c[n-]nc1-c1ccncc1 ZINC000489075095 514697338 /nfs/dbraw/zinc/69/73/38/514697338.db2.gz LNSZEAWFQRXNMV-UHFFFAOYSA-N -1 3 364.796 3.563 20 0 FHADHM O=C(Nc1ccn(-c2ccccc2Cl)n1)c1cn[n-]c1-c1ccncc1 ZINC000489075095 514697348 /nfs/dbraw/zinc/69/73/48/514697348.db2.gz LNSZEAWFQRXNMV-UHFFFAOYSA-N -1 3 364.796 3.563 20 0 FHADHM Cn1[n-]c(=NC(=O)Cc2cc(Cl)ccc2Cl)cc1OC(F)F ZINC000491042266 515362288 /nfs/dbraw/zinc/36/22/88/515362288.db2.gz ZCYNXWSAWTYBFH-UHFFFAOYSA-N -1 3 350.152 3.510 20 0 FHADHM O=C(Cc1cccc(F)c1F)N=c1cc2ccc(Br)cn2[n-]1 ZINC000511384041 515885252 /nfs/dbraw/zinc/88/52/52/515885252.db2.gz OYCLYERBHBIQGK-UHFFFAOYSA-N -1 3 366.165 3.556 20 0 FHADHM Cc1nc(-c2ccccn2)sc1C(=O)N=c1cc(-c2ccncc2)[n-][nH]1 ZINC000512288199 516225575 /nfs/dbraw/zinc/22/55/75/516225575.db2.gz AOCTUGXVBWLUNF-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM C[C@@H]1[C@H](NC(=O)N=c2[n-]nc(-c3cc4ccccc4o3)s2)CCCN1C ZINC000470508076 516274270 /nfs/dbraw/zinc/27/42/70/516274270.db2.gz AGKVTZFIHBGVOG-DGCLKSJQSA-N -1 3 371.466 3.556 20 0 FHADHM CC(C)(C)c1noc2ncc(C(=O)N=c3cc(-c4cccnc4)[n-][nH]3)cc21 ZINC000535880756 516542519 /nfs/dbraw/zinc/54/25/19/516542519.db2.gz WBOLKKNXRWZNAP-UHFFFAOYSA-N -1 3 362.393 3.558 20 0 FHADHM O=C(N=c1cc([C@H]2CCCO2)[n-][nH]1)c1cc(Br)c(F)cc1F ZINC000526959857 517411544 /nfs/dbraw/zinc/41/15/44/517411544.db2.gz MBUOBBCJOCQZBS-GFCCVEGCSA-N -1 3 372.169 3.554 20 0 FHADHM Cc1[n-][nH]c(=NC(=O)[C@H]2CCN(CC(F)(F)F)C2)c1-c1ccc(C)cc1 ZINC000530272536 517670581 /nfs/dbraw/zinc/67/05/81/517670581.db2.gz LFLMAYNJEFZQMC-AWEZNQCLSA-N -1 3 366.387 3.516 20 0 FHADHM Cc1ccccc1-c1cc(=NC(=O)[C@@H](NCC(F)(F)F)C(C)C)[nH][n-]1 ZINC000613249341 520410919 /nfs/dbraw/zinc/41/09/19/520410919.db2.gz MIQTXVJLJNWPBX-HNNXBMFYSA-N -1 3 354.376 3.500 20 0 FHADHM Cc1csc(=O)n1CCC(=O)N=c1cc(-c2cc(C)c(C)cc2C)[n-][nH]1 ZINC000617357336 520453752 /nfs/dbraw/zinc/45/37/52/520453752.db2.gz IYSWNEMABZXTIS-UHFFFAOYSA-N -1 3 370.478 3.562 20 0 FHADHM C[C@@H](NC(=O)c1cccs1)C(=O)N=c1cc(-c2cccc(Cl)c2)[n-][nH]1 ZINC000622892297 523534425 /nfs/dbraw/zinc/53/44/25/523534425.db2.gz KFOGUNXWKXBDIN-SNVBAGLBSA-N -1 3 374.853 3.549 20 0 FHADHM O=C(c1ccc2c(c1[O-])CCCC2)N(Cc1ccncc1)Cc1cccnc1 ZINC000185940685 567870186 /nfs/dbraw/zinc/87/01/86/567870186.db2.gz XNTMVWICIDKKQE-UHFFFAOYSA-N -1 3 373.456 3.904 20 0 FHADHM C[C@H]1CCN(C(=O)c2ccc3c(c2)NC(=O)[C@H](C)S3)c2c([O-])cccc21 ZINC000186311675 567904400 /nfs/dbraw/zinc/90/44/00/567904400.db2.gz LOJSGOCJCFKIDX-RYUDHWBXSA-N -1 3 368.458 3.979 20 0 FHADHM Cc1cc(C(=O)[N-]c2ccc(F)c(C(=O)OC(C)(C)C)c2Cl)on1 ZINC000602407471 567976631 /nfs/dbraw/zinc/97/66/31/567976631.db2.gz YHTLFAYNTCBXHL-UHFFFAOYSA-N -1 3 354.765 3.983 20 0 FHADHM C[C@@H]1COC2(CCC2)CN1C(=O)c1cc(OCc2ccccc2)ccc1[O-] ZINC000617945251 568012397 /nfs/dbraw/zinc/01/23/97/568012397.db2.gz NAPRXGCCKYRCKM-MRXNPFEDSA-N -1 3 367.445 3.755 20 0 FHADHM CSC1CCN(Cc2nc(=O)c3c(-c4ccco4)csc3[n-]2)CC1 ZINC000602924365 568018216 /nfs/dbraw/zinc/01/82/16/568018216.db2.gz VQLAKLUAZNDYAA-UHFFFAOYSA-N -1 3 361.492 3.984 20 0 FHADHM Cc1cccc(CNC(=O)c2cc(=O)c3cc(Br)ccc3[n-]2)c1 ZINC000602745917 568021986 /nfs/dbraw/zinc/02/19/86/568021986.db2.gz YENXNUVCDRVULY-UHFFFAOYSA-N -1 3 371.234 3.529 20 0 FHADHM Cc1cc(F)cc2c(=O)c(C(=O)Nc3ccc(-c4cc[nH]n4)cc3)c[n-]c12 ZINC000162481970 568029038 /nfs/dbraw/zinc/02/90/38/568029038.db2.gz BRAIBTWBFIMTOS-UHFFFAOYSA-N -1 3 362.364 3.618 20 0 FHADHM CCC[C@@H](C)N(C)C(=O)c1cc(=O)c2cc(Br)ccc2[n-]1 ZINC000602753393 568030615 /nfs/dbraw/zinc/03/06/15/568030615.db2.gz MBBCSROWYDMPDH-SNVBAGLBSA-N -1 3 351.244 3.551 20 0 FHADHM O=C([O-])c1ccccc1CCNCc1ccc(F)cc1Br ZINC000228493207 568086810 /nfs/dbraw/zinc/08/68/10/568086810.db2.gz GHXSBISIANROFA-UHFFFAOYSA-N -1 3 352.203 3.619 20 0 FHADHM C[C@H](CC1CCCCC1)C(=O)NC1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000603901361 568180110 /nfs/dbraw/zinc/18/01/10/568180110.db2.gz TVHLXGFSNMBXPD-MRXNPFEDSA-N -1 3 372.509 3.720 20 0 FHADHM CC(C)(C[N-]S(=O)(=O)c1cccc(Cl)c1F)Oc1ccccc1 ZINC000604059435 568204432 /nfs/dbraw/zinc/20/44/32/568204432.db2.gz AJNRAQCFVMTZOD-UHFFFAOYSA-N -1 3 357.834 3.615 20 0 FHADHM O=C(N=c1cc(-c2cccc(Cl)c2)[n-][nH]1)c1cc(=O)[nH]c2ccccc21 ZINC000604082861 568209319 /nfs/dbraw/zinc/20/93/19/568209319.db2.gz MTGRPZYACXLXDQ-UHFFFAOYSA-N -1 3 364.792 3.658 20 0 FHADHM COC(=O)c1sc2[n-]c(CSc3ccc(C)c(C)c3)nc(=O)c2c1C ZINC000007487120 568236076 /nfs/dbraw/zinc/23/60/76/568236076.db2.gz CSXYWLFPSNEFMH-UHFFFAOYSA-N -1 3 374.487 3.989 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2cccc(-c3nccc(C)n3)c2)c(C)c1 ZINC000604304923 568247200 /nfs/dbraw/zinc/24/72/00/568247200.db2.gz SELQPCYGIDZENX-UHFFFAOYSA-N -1 3 369.446 3.570 20 0 FHADHM O=C(Nc1nccn1Cc1ccccc1Cl)c1cc(-c2ccco2)[n-]n1 ZINC000604349758 568265854 /nfs/dbraw/zinc/26/58/54/568265854.db2.gz NCMYOUIKDXKXLB-UHFFFAOYSA-N -1 3 367.796 3.820 20 0 FHADHM O=C(Nc1nccn1Cc1ccccc1Cl)c1cc(-c2ccco2)n[n-]1 ZINC000604349758 568265855 /nfs/dbraw/zinc/26/58/55/568265855.db2.gz NCMYOUIKDXKXLB-UHFFFAOYSA-N -1 3 367.796 3.820 20 0 FHADHM CC[C@H]([N-]S(=O)(=O)c1ccc(F)c(F)c1F)c1cc(F)ccc1F ZINC000303859047 568282472 /nfs/dbraw/zinc/28/24/72/568282472.db2.gz PHQZTNSUBLLXTC-LBPRGKRZSA-N -1 3 365.323 3.812 20 0 FHADHM COC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(Cl)cc2Cl)c1 ZINC000024256577 568290464 /nfs/dbraw/zinc/29/04/64/568290464.db2.gz XATYKLLDUNORGJ-UHFFFAOYSA-N -1 3 360.218 3.581 20 0 FHADHM CC(C)[C@@H](CC1CCCC1)C(=O)Nc1ccc(F)c([N-]S(C)(=O)=O)c1 ZINC000604739345 568359237 /nfs/dbraw/zinc/35/92/37/568359237.db2.gz LIWXNEISCDJIIB-OAHLLOKOSA-N -1 3 370.490 3.988 20 0 FHADHM O=S(=O)([N-][C@@H]1C[C@H]1c1c(F)cccc1F)c1ccc(Cl)cc1F ZINC000604771904 568363298 /nfs/dbraw/zinc/36/32/98/568363298.db2.gz KLEBUVUWYDVQND-NOZJJQNGSA-N -1 3 361.772 3.592 20 0 FHADHM O=S(=O)([N-][C@H]1C[C@@H]1c1c(F)cccc1F)c1ccc(F)cc1Cl ZINC000604772923 568363608 /nfs/dbraw/zinc/36/36/08/568363608.db2.gz WMMQDAOYAHHDBD-ZANVPECISA-N -1 3 361.772 3.592 20 0 FHADHM CC[C@@H](CS(=O)(=O)[N-]c1ccc(C(F)(F)C(F)(F)F)cc1)OC ZINC000643269331 568449849 /nfs/dbraw/zinc/44/98/49/568449849.db2.gz SNVJRTOFKBPDJA-NSHDSACASA-N -1 3 361.332 3.507 20 0 FHADHM O=C(c1csc(=O)[n-]1)N1CCSC[C@H]1c1cccc(C(F)(F)F)c1 ZINC000365323680 568503767 /nfs/dbraw/zinc/50/37/67/568503767.db2.gz ZLLVSAGXEBCEOO-LBPRGKRZSA-N -1 3 374.409 3.798 20 0 FHADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(F)cc2F)c(Br)c1 ZINC000028196522 568524686 /nfs/dbraw/zinc/52/46/86/568524686.db2.gz PGIUCAZREARLRG-UHFFFAOYSA-N -1 3 362.195 3.837 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2ccc(-c3cncnc3)cc2)c(C)c1C ZINC000605118676 568573520 /nfs/dbraw/zinc/57/35/20/568573520.db2.gz CQJCGFOZLGCKFP-UHFFFAOYSA-N -1 3 369.446 3.570 20 0 FHADHM Cc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@H]3C[C@H]3c3cccc(O)c3)c2)n1 ZINC000365422441 568650884 /nfs/dbraw/zinc/65/08/84/568650884.db2.gz SOSRKCOOEOWMHZ-ROUUACIJSA-N -1 3 361.401 3.605 20 0 FHADHM Cc1cc(=O)[n-]c(-c2cccc(NC(=O)c3c[nH]c(-c4ccccc4)n3)c2)n1 ZINC000365439994 568675082 /nfs/dbraw/zinc/67/50/82/568675082.db2.gz YSTFPLZANRZVLN-UHFFFAOYSA-N -1 3 371.400 3.800 20 0 FHADHM CC(C)c1cc(C(=O)N2C[C@@H](C)O[C@@]3(CCOC3)C2)c([O-])c(C(C)C)c1 ZINC000408329768 568693593 /nfs/dbraw/zinc/69/35/93/568693593.db2.gz ZTHRVCYEXZBTMP-VFNWGFHPSA-N -1 3 361.482 3.659 20 0 FHADHM CSCCCCC(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCCC2 ZINC000737180686 598829909 /nfs/dbraw/zinc/82/99/09/598829909.db2.gz BJZVOBBVOIRLOT-UHFFFAOYSA-N -1 3 365.528 3.669 20 0 FHADHM CSCCCCC(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCCC2 ZINC000737180686 598829911 /nfs/dbraw/zinc/82/99/11/598829911.db2.gz BJZVOBBVOIRLOT-UHFFFAOYSA-N -1 3 365.528 3.669 20 0 FHADHM O=C(CC1CCCC1)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000737815605 598834484 /nfs/dbraw/zinc/83/44/84/598834484.db2.gz YWCXJSKCWFSDII-UHFFFAOYSA-N -1 3 367.478 3.792 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H]1CC[C@H](C)C[C@@H]1C ZINC000736478748 598840117 /nfs/dbraw/zinc/84/01/17/598840117.db2.gz BHNWHEFQBNELOU-RLFYNMQTSA-N -1 3 370.501 3.613 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H]1CC[C@H](C)C[C@@H]1C ZINC000736478748 598840118 /nfs/dbraw/zinc/84/01/18/598840118.db2.gz BHNWHEFQBNELOU-RLFYNMQTSA-N -1 3 370.501 3.613 20 0 FHADHM CC[C@H](OC(=O)CSc1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000736380398 598844805 /nfs/dbraw/zinc/84/48/05/598844805.db2.gz FYLARMQQVJBRIF-INIZCTEOSA-N -1 3 354.435 3.653 20 0 FHADHM CC[C@H](OC(=O)CSc1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000736380398 598844806 /nfs/dbraw/zinc/84/48/06/598844806.db2.gz FYLARMQQVJBRIF-INIZCTEOSA-N -1 3 354.435 3.653 20 0 FHADHM CCc1ccc(-c2noc([C@@H](C)Oc3ccc(-c4nn[n-]n4)cc3)n2)cc1 ZINC000736677425 598859877 /nfs/dbraw/zinc/85/98/77/598859877.db2.gz KHNOODCEZRLXRJ-GFCCVEGCSA-N -1 3 362.393 3.619 20 0 FHADHM CCc1c(C)sc(NC(=O)c2sccc2C2CC2)c1-c1nnn[n-]1 ZINC000736679540 598864225 /nfs/dbraw/zinc/86/42/25/598864225.db2.gz WQUIITSYEZHHKQ-UHFFFAOYSA-N -1 3 359.480 3.990 20 0 FHADHM CCc1c(C)sc(NC(=O)c2sccc2C2CC2)c1-c1nn[n-]n1 ZINC000736679540 598864227 /nfs/dbraw/zinc/86/42/27/598864227.db2.gz WQUIITSYEZHHKQ-UHFFFAOYSA-N -1 3 359.480 3.990 20 0 FHADHM Cc1noc(C)c1[C@H](C)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000737538855 598870670 /nfs/dbraw/zinc/87/06/70/598870670.db2.gz QGFCORQCQGWFOJ-ZETCQYMHSA-N -1 3 352.320 3.663 20 0 FHADHM Cc1noc(C)c1[C@H](C)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000737538855 598870672 /nfs/dbraw/zinc/87/06/72/598870672.db2.gz QGFCORQCQGWFOJ-ZETCQYMHSA-N -1 3 352.320 3.663 20 0 FHADHM CC(C)[C@@H](Cc1ccccc1)C(=O)OCc1cc(-c2nnn[n-]2)ccc1F ZINC000735710293 598901814 /nfs/dbraw/zinc/90/18/14/598901814.db2.gz NQIZVWBSIDJOOI-QGZVFWFLSA-N -1 3 368.412 3.564 20 0 FHADHM CC(C)[C@@H](Cc1ccccc1)C(=O)OCc1cc(-c2nn[n-]n2)ccc1F ZINC000735710293 598901816 /nfs/dbraw/zinc/90/18/16/598901816.db2.gz NQIZVWBSIDJOOI-QGZVFWFLSA-N -1 3 368.412 3.564 20 0 FHADHM CCN(C(=O)[C@H](C)CC1CCCC1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736502890 598903257 /nfs/dbraw/zinc/90/32/57/598903257.db2.gz QLKGLUZKXYOZAY-CABCVRRESA-N -1 3 355.486 3.993 20 0 FHADHM CCN(C(=O)[C@H](C)CC1CCCC1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736502890 598903259 /nfs/dbraw/zinc/90/32/59/598903259.db2.gz QLKGLUZKXYOZAY-CABCVRRESA-N -1 3 355.486 3.993 20 0 FHADHM CC[C@@H]1CCCCCN1C(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(C)C ZINC000736399820 598904380 /nfs/dbraw/zinc/90/43/80/598904380.db2.gz KGTNECNTOVOIQJ-OAHLLOKOSA-N -1 3 372.473 3.840 20 0 FHADHM CC[C@@H]1CCCCCN1C(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(C)C ZINC000736399820 598904381 /nfs/dbraw/zinc/90/43/81/598904381.db2.gz KGTNECNTOVOIQJ-OAHLLOKOSA-N -1 3 372.473 3.840 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@@H]2C(=O)N(C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000735924808 598911137 /nfs/dbraw/zinc/91/11/37/598911137.db2.gz VGFNTNRJPGPELQ-MOPGFXCFSA-N -1 3 361.449 3.757 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@@H]2C(=O)N(C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000735924808 598911139 /nfs/dbraw/zinc/91/11/39/598911139.db2.gz VGFNTNRJPGPELQ-MOPGFXCFSA-N -1 3 361.449 3.757 20 0 FHADHM Cc1ccc([C@@H]2CCC[C@@H]2OC(=O)Cc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000737328159 598925130 /nfs/dbraw/zinc/92/51/30/598925130.db2.gz DIWKWEMMHNELPF-OALUTQOASA-N -1 3 362.433 3.597 20 0 FHADHM Cc1ccc([C@@H]2CCC[C@@H]2OC(=O)Cc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000737328159 598925132 /nfs/dbraw/zinc/92/51/32/598925132.db2.gz DIWKWEMMHNELPF-OALUTQOASA-N -1 3 362.433 3.597 20 0 FHADHM C[C@@H](Nc1ncc(-c2nnn[n-]2)cc1Cl)c1ccc(OC(F)F)cc1 ZINC000736135578 598936674 /nfs/dbraw/zinc/93/66/74/598936674.db2.gz BUIIUWPUOBDTFF-MRVPVSSYSA-N -1 3 366.759 3.690 20 0 FHADHM C[C@@H](Nc1ncc(-c2nn[n-]n2)cc1Cl)c1ccc(OC(F)F)cc1 ZINC000736135578 598936675 /nfs/dbraw/zinc/93/66/75/598936675.db2.gz BUIIUWPUOBDTFF-MRVPVSSYSA-N -1 3 366.759 3.690 20 0 FHADHM Cc1ccc([C@H]2CCCN2c2ncc(-c3nnn[n-]3)cc2Cl)cc1C ZINC000737330803 598938470 /nfs/dbraw/zinc/93/84/70/598938470.db2.gz KOMKWEMEOGNDON-MRXNPFEDSA-N -1 3 354.845 3.873 20 0 FHADHM Cc1ccc([C@H]2CCCN2c2ncc(-c3nn[n-]n3)cc2Cl)cc1C ZINC000737330803 598938471 /nfs/dbraw/zinc/93/84/71/598938471.db2.gz KOMKWEMEOGNDON-MRXNPFEDSA-N -1 3 354.845 3.873 20 0 FHADHM c1ccc(COC[C@@H](Nc2ncccc2-c2nnn[n-]2)c2ccccc2)cc1 ZINC000738432456 598975532 /nfs/dbraw/zinc/97/55/32/598975532.db2.gz HGZGDMHRECHNAL-LJQANCHMSA-N -1 3 372.432 3.632 20 0 FHADHM c1ccc(COC[C@@H](Nc2ncccc2-c2nn[n-]n2)c2ccccc2)cc1 ZINC000738432456 598975533 /nfs/dbraw/zinc/97/55/33/598975533.db2.gz HGZGDMHRECHNAL-LJQANCHMSA-N -1 3 372.432 3.632 20 0 FHADHM Cc1cc(C)cc(CCNc2nc(C(F)(F)F)ccc2-c2nnn[n-]2)c1 ZINC000737252770 598975637 /nfs/dbraw/zinc/97/56/37/598975637.db2.gz KOZIBKNKOWELHR-UHFFFAOYSA-N -1 3 362.359 3.552 20 0 FHADHM Cc1cc(C)cc(CCNc2nc(C(F)(F)F)ccc2-c2nn[n-]n2)c1 ZINC000737252770 598975639 /nfs/dbraw/zinc/97/56/39/598975639.db2.gz KOZIBKNKOWELHR-UHFFFAOYSA-N -1 3 362.359 3.552 20 0 FHADHM c1ccc(COC[C@H](Nc2ncccc2-c2nnn[n-]2)c2ccccc2)cc1 ZINC000738432454 598975737 /nfs/dbraw/zinc/97/57/37/598975737.db2.gz HGZGDMHRECHNAL-IBGZPJMESA-N -1 3 372.432 3.632 20 0 FHADHM c1ccc(COC[C@H](Nc2ncccc2-c2nn[n-]n2)c2ccccc2)cc1 ZINC000738432454 598975739 /nfs/dbraw/zinc/97/57/39/598975739.db2.gz HGZGDMHRECHNAL-IBGZPJMESA-N -1 3 372.432 3.632 20 0 FHADHM CC[C@@H](Nc1c(F)cc(-c2nnn[n-]2)cc1F)c1cc(F)ccc1F ZINC000736369439 598974928 /nfs/dbraw/zinc/97/49/28/598974928.db2.gz MQEHTKHPXBVXFV-CQSZACIVSA-N -1 3 351.307 3.986 20 0 FHADHM CC[C@@H](Nc1c(F)cc(-c2nn[n-]n2)cc1F)c1cc(F)ccc1F ZINC000736369439 598974930 /nfs/dbraw/zinc/97/49/30/598974930.db2.gz MQEHTKHPXBVXFV-CQSZACIVSA-N -1 3 351.307 3.986 20 0 FHADHM c1ccc(COC[C@H](Nc2ccc(-c3nnn[n-]3)cn2)c2ccccc2)cc1 ZINC000738433875 598976493 /nfs/dbraw/zinc/97/64/93/598976493.db2.gz XQJCXELXRRNMIK-IBGZPJMESA-N -1 3 372.432 3.632 20 0 FHADHM c1ccc(COC[C@H](Nc2ccc(-c3nn[n-]n3)cn2)c2ccccc2)cc1 ZINC000738433875 598976495 /nfs/dbraw/zinc/97/64/95/598976495.db2.gz XQJCXELXRRNMIK-IBGZPJMESA-N -1 3 372.432 3.632 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1OCCSC/C=C/c1ccccc1 ZINC000737032827 599009863 /nfs/dbraw/zinc/00/98/63/599009863.db2.gz PFXVHFJYLRDFQL-VMPITWQZSA-N -1 3 368.462 3.701 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1OCCSC/C=C/c1ccccc1 ZINC000737032827 599009865 /nfs/dbraw/zinc/00/98/65/599009865.db2.gz PFXVHFJYLRDFQL-VMPITWQZSA-N -1 3 368.462 3.701 20 0 FHADHM CC(C)(C)Oc1ccccc1NC(=O)C=Cc1ccccc1-c1nnn[n-]1 ZINC000735639622 599017908 /nfs/dbraw/zinc/01/79/08/599017908.db2.gz KDDVXQJNISFLOG-SEYXRHQNSA-N -1 3 363.421 3.696 20 0 FHADHM CC(C)(C)Oc1ccccc1NC(=O)C=Cc1ccccc1-c1nn[n-]n1 ZINC000735639622 599017910 /nfs/dbraw/zinc/01/79/10/599017910.db2.gz KDDVXQJNISFLOG-SEYXRHQNSA-N -1 3 363.421 3.696 20 0 FHADHM CC(C)C[C@@H](C(=O)OCc1ccccc1-c1nnn[n-]1)c1ccccc1 ZINC000735755076 599018838 /nfs/dbraw/zinc/01/88/38/599018838.db2.gz BHNKLKISSJGPRF-GOSISDBHSA-N -1 3 350.422 3.740 20 0 FHADHM CC(C)C[C@@H](C(=O)OCc1ccccc1-c1nn[n-]n1)c1ccccc1 ZINC000735755076 599018840 /nfs/dbraw/zinc/01/88/40/599018840.db2.gz BHNKLKISSJGPRF-GOSISDBHSA-N -1 3 350.422 3.740 20 0 FHADHM CC[C@@H](OC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1cccc(OC)c1 ZINC000736379707 599027891 /nfs/dbraw/zinc/02/78/91/599027891.db2.gz CVYRBBKVRQUKOV-IENJSVCTSA-N -1 3 364.405 3.583 20 0 FHADHM CC[C@@H](OC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1cccc(OC)c1 ZINC000736379707 599027893 /nfs/dbraw/zinc/02/78/93/599027893.db2.gz CVYRBBKVRQUKOV-IENJSVCTSA-N -1 3 364.405 3.583 20 0 FHADHM C[C@H](CCc1ccccc1)Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000735992990 599036969 /nfs/dbraw/zinc/03/69/69/599036969.db2.gz NROHVUUCHFINKW-LLVKDONJSA-N -1 3 362.359 3.714 20 0 FHADHM C[C@H](CCc1ccccc1)Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000735992990 599036973 /nfs/dbraw/zinc/03/69/73/599036973.db2.gz NROHVUUCHFINKW-LLVKDONJSA-N -1 3 362.359 3.714 20 0 FHADHM CO[C@H](CNc1cc(Cl)ccc1-c1nnn[n-]1)c1ccc(Cl)cc1 ZINC000821677390 599044448 /nfs/dbraw/zinc/04/44/48/599044448.db2.gz WBEJOLDHXHCECD-OAHLLOKOSA-N -1 3 364.236 3.973 20 0 FHADHM CO[C@H](CNc1cc(Cl)ccc1-c1nn[n-]n1)c1ccc(Cl)cc1 ZINC000821677390 599044451 /nfs/dbraw/zinc/04/44/51/599044451.db2.gz WBEJOLDHXHCECD-OAHLLOKOSA-N -1 3 364.236 3.973 20 0 FHADHM CO[C@H](CNc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccc(Cl)cc1 ZINC000821676800 599046036 /nfs/dbraw/zinc/04/60/36/599046036.db2.gz HIVAVMHMGXCMJQ-OAHLLOKOSA-N -1 3 364.236 3.973 20 0 FHADHM CO[C@H](CNc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccc(Cl)cc1 ZINC000821676800 599046039 /nfs/dbraw/zinc/04/60/39/599046039.db2.gz HIVAVMHMGXCMJQ-OAHLLOKOSA-N -1 3 364.236 3.973 20 0 FHADHM Cc1ccccc1C[C@H](C)Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000737425912 599046382 /nfs/dbraw/zinc/04/63/82/599046382.db2.gz GWMVIMMSCUEWIB-NSHDSACASA-N -1 3 362.359 3.632 20 0 FHADHM Cc1ccccc1C[C@H](C)Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000737425912 599046385 /nfs/dbraw/zinc/04/63/85/599046385.db2.gz GWMVIMMSCUEWIB-NSHDSACASA-N -1 3 362.359 3.632 20 0 FHADHM C[C@H](CN(C)c1nc(C(F)(F)F)ccc1-c1nnn[n-]1)c1ccccc1 ZINC000736000218 599050591 /nfs/dbraw/zinc/05/05/91/599050591.db2.gz FUHSFCPDQRPWBP-LLVKDONJSA-N -1 3 362.359 3.520 20 0 FHADHM C[C@H](CN(C)c1nc(C(F)(F)F)ccc1-c1nn[n-]n1)c1ccccc1 ZINC000736000218 599050594 /nfs/dbraw/zinc/05/05/94/599050594.db2.gz FUHSFCPDQRPWBP-LLVKDONJSA-N -1 3 362.359 3.520 20 0 FHADHM Cc1ccccc1[C@@H]1CCN(c2nc(C(F)(F)F)ccc2-c2nnn[n-]2)C1 ZINC000737422654 599051871 /nfs/dbraw/zinc/05/18/71/599051871.db2.gz NGQJMKZMONCLNX-GFCCVEGCSA-N -1 3 374.370 3.583 20 0 FHADHM Cc1ccccc1[C@@H]1CCN(c2nc(C(F)(F)F)ccc2-c2nn[n-]n2)C1 ZINC000737422654 599051874 /nfs/dbraw/zinc/05/18/74/599051874.db2.gz NGQJMKZMONCLNX-GFCCVEGCSA-N -1 3 374.370 3.583 20 0 FHADHM Cc1cccc2c1CC[C@H]2Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000737408130 599054596 /nfs/dbraw/zinc/05/45/96/599054596.db2.gz GKANOKKTMPMZAR-CYBMUJFWSA-N -1 3 360.343 3.688 20 0 FHADHM Cc1cccc2c1CC[C@H]2Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000737408130 599054599 /nfs/dbraw/zinc/05/45/99/599054599.db2.gz GKANOKKTMPMZAR-CYBMUJFWSA-N -1 3 360.343 3.688 20 0 FHADHM C[C@H](CCc1cccn1C)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000820254700 599054761 /nfs/dbraw/zinc/05/47/61/599054761.db2.gz VDMLEVAENUYVDB-LLVKDONJSA-N -1 3 364.375 3.657 20 0 FHADHM C[C@H](CCc1cccn1C)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000820254700 599054764 /nfs/dbraw/zinc/05/47/64/599054764.db2.gz VDMLEVAENUYVDB-LLVKDONJSA-N -1 3 364.375 3.657 20 0 FHADHM Cc1cccc2c1CC[C@@H]2Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000737408131 599055075 /nfs/dbraw/zinc/05/50/75/599055075.db2.gz GKANOKKTMPMZAR-ZDUSSCGKSA-N -1 3 360.343 3.688 20 0 FHADHM Cc1cccc2c1CC[C@@H]2Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000737408131 599055078 /nfs/dbraw/zinc/05/50/78/599055078.db2.gz GKANOKKTMPMZAR-ZDUSSCGKSA-N -1 3 360.343 3.688 20 0 FHADHM Cc1nnc(N[C@H](c2ccc(Cl)cc2)[C@H]2C[C@H]2C)c(-c2nnn[n-]2)c1C ZINC000822510117 599055164 /nfs/dbraw/zinc/05/51/64/599055164.db2.gz JMSCHOIDRFFRSH-WKFLNTIRSA-N -1 3 369.860 3.736 20 0 FHADHM Cc1nnc(N[C@H](c2ccc(Cl)cc2)[C@H]2C[C@H]2C)c(-c2nn[n-]n2)c1C ZINC000822510117 599055166 /nfs/dbraw/zinc/05/51/66/599055166.db2.gz JMSCHOIDRFFRSH-WKFLNTIRSA-N -1 3 369.860 3.736 20 0 FHADHM CC[C@@H]1c2ccccc2CCN1c1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000736411467 599056126 /nfs/dbraw/zinc/05/61/26/599056126.db2.gz OFFMFSPUQLUKEB-CQSZACIVSA-N -1 3 374.370 3.794 20 0 FHADHM CC[C@@H]1c2ccccc2CCN1c1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000736411467 599056129 /nfs/dbraw/zinc/05/61/29/599056129.db2.gz OFFMFSPUQLUKEB-CQSZACIVSA-N -1 3 374.370 3.794 20 0 FHADHM Cc1ccc2c(CSc3ccc(-c4nnn[n-]4)cc3F)cc(=O)oc2c1 ZINC000737372028 599066533 /nfs/dbraw/zinc/06/65/33/599066533.db2.gz UOWUYWMPXIWLIK-UHFFFAOYSA-N -1 3 368.393 3.713 20 0 FHADHM Cc1ccc2c(CSc3ccc(-c4nn[n-]n4)cc3F)cc(=O)oc2c1 ZINC000737372028 599066536 /nfs/dbraw/zinc/06/65/36/599066536.db2.gz UOWUYWMPXIWLIK-UHFFFAOYSA-N -1 3 368.393 3.713 20 0 FHADHM Cc1ccc(O[C@@H](C)CNc2cc(-c3nnn[n-]3)c3ccccc3n2)cc1 ZINC000822259351 599068331 /nfs/dbraw/zinc/06/83/31/599068331.db2.gz VPOSYRPASYBDJN-AWEZNQCLSA-N -1 3 360.421 3.603 20 0 FHADHM Cc1ccc(O[C@@H](C)CNc2cc(-c3nn[n-]n3)c3ccccc3n2)cc1 ZINC000822259351 599068334 /nfs/dbraw/zinc/06/83/34/599068334.db2.gz VPOSYRPASYBDJN-AWEZNQCLSA-N -1 3 360.421 3.603 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@@H]1C[C@H]1C1CCCCC1 ZINC000735903962 599071128 /nfs/dbraw/zinc/07/11/28/599071128.db2.gz JKFUQIHSVNFWPF-JKSUJKDBSA-N -1 3 369.469 3.809 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@@H]1C[C@H]1C1CCCCC1 ZINC000735903962 599071131 /nfs/dbraw/zinc/07/11/31/599071131.db2.gz JKFUQIHSVNFWPF-JKSUJKDBSA-N -1 3 369.469 3.809 20 0 FHADHM CCc1ccc(CC(=O)N(CC(C)C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000736682245 599071620 /nfs/dbraw/zinc/07/16/20/599071620.db2.gz JGYWOTMSSALARR-UHFFFAOYSA-N -1 3 363.465 3.661 20 0 FHADHM CCc1ccc(CC(=O)N(CC(C)C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000736682245 599071623 /nfs/dbraw/zinc/07/16/23/599071623.db2.gz JGYWOTMSSALARR-UHFFFAOYSA-N -1 3 363.465 3.661 20 0 FHADHM C[C@@H]1C[C@H](c2ccccc2F)N(c2ncc(-c3nnn[n-]3)cc2Cl)C1 ZINC000820668473 599077606 /nfs/dbraw/zinc/07/76/06/599077606.db2.gz SZJCAYCHJGWQAA-MEBBXXQBSA-N -1 3 358.808 3.642 20 0 FHADHM C[C@@H]1C[C@H](c2ccccc2F)N(c2ncc(-c3nn[n-]n3)cc2Cl)C1 ZINC000820668473 599077608 /nfs/dbraw/zinc/07/76/08/599077608.db2.gz SZJCAYCHJGWQAA-MEBBXXQBSA-N -1 3 358.808 3.642 20 0 FHADHM CC(C)(C)OC(=O)c1ccc(CNc2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000819946490 599082135 /nfs/dbraw/zinc/08/21/35/599082135.db2.gz MAJLWWFZKNFAEU-UHFFFAOYSA-N -1 3 369.400 3.573 20 0 FHADHM Cc1ccc([C@H]2CCCCN2C(=O)c2sccc2-c2nnn[n-]2)cc1 ZINC000737332874 599083463 /nfs/dbraw/zinc/08/34/63/599083463.db2.gz WYZVLZQJEVTEHO-OAHLLOKOSA-N -1 3 353.451 3.604 20 0 FHADHM Cc1ccc([C@H]2CCCCN2C(=O)c2sccc2-c2nn[n-]n2)cc1 ZINC000737332874 599083465 /nfs/dbraw/zinc/08/34/65/599083465.db2.gz WYZVLZQJEVTEHO-OAHLLOKOSA-N -1 3 353.451 3.604 20 0 FHADHM CO[C@@H](CNc1cc(Cl)ccc1-c1nnn[n-]1)c1cccc(Cl)c1 ZINC000821677469 599090421 /nfs/dbraw/zinc/09/04/21/599090421.db2.gz XRAUCQWFDPGEHU-HNNXBMFYSA-N -1 3 364.236 3.973 20 0 FHADHM CO[C@@H](CNc1cc(Cl)ccc1-c1nn[n-]n1)c1cccc(Cl)c1 ZINC000821677469 599090423 /nfs/dbraw/zinc/09/04/23/599090423.db2.gz XRAUCQWFDPGEHU-HNNXBMFYSA-N -1 3 364.236 3.973 20 0 FHADHM Cc1cccc([C@H](C)NC(=O)N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1C ZINC000737390256 599105106 /nfs/dbraw/zinc/10/51/06/599105106.db2.gz RXWCQOOVFPGGIO-CABCVRRESA-N -1 3 364.453 3.605 20 0 FHADHM Cc1cccc([C@H](C)NC(=O)N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1C ZINC000737390256 599105107 /nfs/dbraw/zinc/10/51/07/599105107.db2.gz RXWCQOOVFPGGIO-CABCVRRESA-N -1 3 364.453 3.605 20 0 FHADHM C[C@@H](Sc1ccccc1-c1nnn[n-]1)c1nc(-c2ccccc2)no1 ZINC000736192908 599109076 /nfs/dbraw/zinc/10/90/76/599109076.db2.gz OQNFCHJBBBNVDK-LLVKDONJSA-N -1 3 350.407 3.770 20 0 FHADHM C[C@@H](Sc1ccccc1-c1nn[n-]n1)c1nc(-c2ccccc2)no1 ZINC000736192908 599109077 /nfs/dbraw/zinc/10/90/77/599109077.db2.gz OQNFCHJBBBNVDK-LLVKDONJSA-N -1 3 350.407 3.770 20 0 FHADHM Cc1cccc(-c2noc(CSc3ccccc3-c3nnn[n-]3)n2)c1 ZINC000737381128 599110176 /nfs/dbraw/zinc/11/01/76/599110176.db2.gz UFGAONKVGJTFDF-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM Cc1cccc(-c2noc(CSc3ccccc3-c3nn[n-]n3)n2)c1 ZINC000737381128 599110178 /nfs/dbraw/zinc/11/01/78/599110178.db2.gz UFGAONKVGJTFDF-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM CCc1ccc(-c2noc(CSc3ccccc3-c3nnn[n-]3)n2)cc1 ZINC000736676877 599110208 /nfs/dbraw/zinc/11/02/08/599110208.db2.gz HBWKVXRYRSYBFV-UHFFFAOYSA-N -1 3 364.434 3.771 20 0 FHADHM CCc1ccc(-c2noc(CSc3ccccc3-c3nn[n-]n3)n2)cc1 ZINC000736676877 599110209 /nfs/dbraw/zinc/11/02/09/599110209.db2.gz HBWKVXRYRSYBFV-UHFFFAOYSA-N -1 3 364.434 3.771 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1NCc1ccc(-c2cccnc2)cc1 ZINC000822567968 599111602 /nfs/dbraw/zinc/11/16/02/599111602.db2.gz JPMMEJYNUGRGIB-UHFFFAOYSA-N -1 3 363.812 3.589 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1NCc1ccc(-c2cccnc2)cc1 ZINC000822567968 599111604 /nfs/dbraw/zinc/11/16/04/599111604.db2.gz JPMMEJYNUGRGIB-UHFFFAOYSA-N -1 3 363.812 3.589 20 0 FHADHM Cc1cc(Nc2ccc(Oc3ccccc3-c3nnn[n-]3)c(F)c2)ncn1 ZINC000822210774 599111791 /nfs/dbraw/zinc/11/17/91/599111791.db2.gz QPYQJJUANBCRII-UHFFFAOYSA-N -1 3 363.356 3.640 20 0 FHADHM Cc1cc(Nc2ccc(Oc3ccccc3-c3nn[n-]n3)c(F)c2)ncn1 ZINC000822210774 599111795 /nfs/dbraw/zinc/11/17/95/599111795.db2.gz QPYQJJUANBCRII-UHFFFAOYSA-N -1 3 363.356 3.640 20 0 FHADHM Cc1c(Cl)cccc1NC(=O)[C@@H](C)Sc1ccccc1-c1nnn[n-]1 ZINC000737216534 599112138 /nfs/dbraw/zinc/11/21/38/599112138.db2.gz SQOVGNWUXSWTDS-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM Cc1c(Cl)cccc1NC(=O)[C@@H](C)Sc1ccccc1-c1nn[n-]n1 ZINC000737216534 599112139 /nfs/dbraw/zinc/11/21/39/599112139.db2.gz SQOVGNWUXSWTDS-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N[C@@H]2C[C@H]2C2CCCCC2)n1 ZINC000737632204 599120260 /nfs/dbraw/zinc/12/02/60/599120260.db2.gz LHKDPTQCZFURID-NWDGAFQWSA-N -1 3 352.364 3.661 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N[C@@H]2C[C@H]2C2CCCCC2)n1 ZINC000737632204 599120262 /nfs/dbraw/zinc/12/02/62/599120262.db2.gz LHKDPTQCZFURID-NWDGAFQWSA-N -1 3 352.364 3.661 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N[C@H]2C[C@H]2C2CCCCC2)n1 ZINC000737632206 599120732 /nfs/dbraw/zinc/12/07/32/599120732.db2.gz LHKDPTQCZFURID-RYUDHWBXSA-N -1 3 352.364 3.661 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N[C@H]2C[C@H]2C2CCCCC2)n1 ZINC000737632206 599120733 /nfs/dbraw/zinc/12/07/33/599120733.db2.gz LHKDPTQCZFURID-RYUDHWBXSA-N -1 3 352.364 3.661 20 0 FHADHM CSc1ccc(OCCSc2ccc(-c3nnn[n-]3)cc2F)cc1 ZINC000821984790 599127876 /nfs/dbraw/zinc/12/78/76/599127876.db2.gz SVDWRYXMNJTOSG-UHFFFAOYSA-N -1 3 362.455 3.899 20 0 FHADHM CSc1ccc(OCCSc2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000821984790 599127878 /nfs/dbraw/zinc/12/78/78/599127878.db2.gz SVDWRYXMNJTOSG-UHFFFAOYSA-N -1 3 362.455 3.899 20 0 FHADHM Cc1nc(C2CCCC2)sc1C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000079379895 599131644 /nfs/dbraw/zinc/13/16/44/599131644.db2.gz WFHGMBHFTAXFTN-UHFFFAOYSA-N -1 3 354.439 3.542 20 0 FHADHM CC(C)[C@H](C)S[C@H](C)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820550766 599130764 /nfs/dbraw/zinc/13/07/64/599130764.db2.gz YRROZZQCTSRPQR-VHSXEESVSA-N -1 3 353.879 3.625 20 0 FHADHM CC(C)[C@H](C)S[C@H](C)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820550766 599130766 /nfs/dbraw/zinc/13/07/66/599130766.db2.gz YRROZZQCTSRPQR-VHSXEESVSA-N -1 3 353.879 3.625 20 0 FHADHM Cc1nc(C2CCCC2)sc1C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000079379895 599131646 /nfs/dbraw/zinc/13/16/46/599131646.db2.gz WFHGMBHFTAXFTN-UHFFFAOYSA-N -1 3 354.439 3.542 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1cccc2cc[nH]c21 ZINC000820086583 599145992 /nfs/dbraw/zinc/14/59/92/599145992.db2.gz AWTLCQVQMJGUKX-UHFFFAOYSA-N -1 3 374.448 3.646 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1cccc2cc[nH]c21 ZINC000820086583 599145993 /nfs/dbraw/zinc/14/59/93/599145993.db2.gz AWTLCQVQMJGUKX-UHFFFAOYSA-N -1 3 374.448 3.646 20 0 FHADHM Cc1cncc(C(=O)Nc2ccc(Oc3cccc(-c4nnn[n-]4)c3)cc2)c1 ZINC000822399856 599153326 /nfs/dbraw/zinc/15/33/26/599153326.db2.gz NWTLCFIZWBDDOA-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1cncc(C(=O)Nc2ccc(Oc3cccc(-c4nn[n-]n4)c3)cc2)c1 ZINC000822399856 599153329 /nfs/dbraw/zinc/15/33/29/599153329.db2.gz NWTLCFIZWBDDOA-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccc(SCc2nnc(-c3ccc(-c4nnn[n-]4)cc3)o2)cc1C ZINC000737368308 599159086 /nfs/dbraw/zinc/15/90/86/599159086.db2.gz IBNQZTJAMUCTJZ-UHFFFAOYSA-N -1 3 364.434 3.826 20 0 FHADHM Cc1ccc(SCc2nnc(-c3ccc(-c4nn[n-]n4)cc3)o2)cc1C ZINC000737368308 599159087 /nfs/dbraw/zinc/15/90/87/599159087.db2.gz IBNQZTJAMUCTJZ-UHFFFAOYSA-N -1 3 364.434 3.826 20 0 FHADHM Cc1ccc([C@H]2CCC[C@H]2N(C)C(=O)c2sccc2-c2nnn[n-]2)cc1 ZINC000822232848 599162032 /nfs/dbraw/zinc/16/20/32/599162032.db2.gz CGDRWHLMKCVTED-GDBMZVCRSA-N -1 3 367.478 3.645 20 0 FHADHM Cc1ccc([C@H]2CCC[C@H]2N(C)C(=O)c2sccc2-c2nn[n-]n2)cc1 ZINC000822232848 599162035 /nfs/dbraw/zinc/16/20/35/599162035.db2.gz CGDRWHLMKCVTED-GDBMZVCRSA-N -1 3 367.478 3.645 20 0 FHADHM CCOc1ccc(OCCSc2ccc(-c3nnn[n-]3)cc2F)cc1 ZINC000736650966 599169622 /nfs/dbraw/zinc/16/96/22/599169622.db2.gz KCQNVWDXNJNXSS-UHFFFAOYSA-N -1 3 360.414 3.576 20 0 FHADHM CCOc1ccc(OCCSc2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000736650966 599169623 /nfs/dbraw/zinc/16/96/23/599169623.db2.gz KCQNVWDXNJNXSS-UHFFFAOYSA-N -1 3 360.414 3.576 20 0 FHADHM COc1ccc2sc(C(=O)Nc3ccc(-c4nnn[n-]4)cc3)c(C)c2c1 ZINC000514728118 599177334 /nfs/dbraw/zinc/17/73/34/599177334.db2.gz ACPNEMLRBFEIPQ-UHFFFAOYSA-N -1 3 365.418 3.651 20 0 FHADHM COc1ccc2sc(C(=O)Nc3ccc(-c4nn[n-]n4)cc3)c(C)c2c1 ZINC000514728118 599177338 /nfs/dbraw/zinc/17/73/38/599177338.db2.gz ACPNEMLRBFEIPQ-UHFFFAOYSA-N -1 3 365.418 3.651 20 0 FHADHM CC(C)=CCOc1cccc(C(=O)Nc2sccc2-c2nnn[n-]2)c1 ZINC000735683835 599179049 /nfs/dbraw/zinc/17/90/49/599179049.db2.gz FQUYWKDMJQIQDU-UHFFFAOYSA-N -1 3 355.423 3.526 20 0 FHADHM CC(C)=CCOc1cccc(C(=O)Nc2sccc2-c2nn[n-]n2)c1 ZINC000735683835 599179050 /nfs/dbraw/zinc/17/90/50/599179050.db2.gz FQUYWKDMJQIQDU-UHFFFAOYSA-N -1 3 355.423 3.526 20 0 FHADHM CC[C@H](Cc1ccc(Cl)cc1)NC(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000736351801 599181022 /nfs/dbraw/zinc/18/10/22/599181022.db2.gz HGZANXIZQHAQPV-OAHLLOKOSA-N -1 3 370.844 3.663 20 0 FHADHM CC[C@H](Cc1ccc(Cl)cc1)NC(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000736351801 599181025 /nfs/dbraw/zinc/18/10/25/599181025.db2.gz HGZANXIZQHAQPV-OAHLLOKOSA-N -1 3 370.844 3.663 20 0 FHADHM C[C@H](CC(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1cccc(F)c1 ZINC000735974876 599189893 /nfs/dbraw/zinc/18/98/93/599189893.db2.gz CUXYZALYFRLHHZ-OLZOCXBDSA-N -1 3 354.385 3.804 20 0 FHADHM C[C@H](CC(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1cccc(F)c1 ZINC000735974876 599189895 /nfs/dbraw/zinc/18/98/95/599189895.db2.gz CUXYZALYFRLHHZ-OLZOCXBDSA-N -1 3 354.385 3.804 20 0 FHADHM CC(C)=CCOc1cccc(C(=O)Nc2cc(-c3nnn[n-]3)ccc2C)c1 ZINC000735679751 599186267 /nfs/dbraw/zinc/18/62/67/599186267.db2.gz NFOWEDSUSBZFJR-UHFFFAOYSA-N -1 3 363.421 3.772 20 0 FHADHM CC(C)=CCOc1cccc(C(=O)Nc2cc(-c3nn[n-]n3)ccc2C)c1 ZINC000735679751 599186269 /nfs/dbraw/zinc/18/62/69/599186269.db2.gz NFOWEDSUSBZFJR-UHFFFAOYSA-N -1 3 363.421 3.772 20 0 FHADHM Cc1noc(-c2cccc(Oc3cccc(Cl)c3-c3nnn[n-]3)c2)n1 ZINC000737535223 599193237 /nfs/dbraw/zinc/19/32/37/599193237.db2.gz XEIAFSWGVGBSBT-UHFFFAOYSA-N -1 3 354.757 3.671 20 0 FHADHM CCCC[C@H](CC)CC(=O)Nc1ccnn1-c1ccc(-c2nn[n-]n2)cc1 ZINC000736439196 599224625 /nfs/dbraw/zinc/22/46/25/599224625.db2.gz SBIXIIUYOGXFDY-AWEZNQCLSA-N -1 3 367.457 3.597 20 0 FHADHM O=C(c1ccccc1-c1ccccc1-c1nnn[n-]1)N1CCC[C@@H]2CCC[C@H]21 ZINC000738277893 599225930 /nfs/dbraw/zinc/22/59/30/599225930.db2.gz HAUOPFHGVMWRST-MGPUTAFESA-N -1 3 373.460 3.938 20 0 FHADHM O=C(c1ccccc1-c1ccccc1-c1nn[n-]n1)N1CCC[C@@H]2CCC[C@H]21 ZINC000738277893 599225933 /nfs/dbraw/zinc/22/59/33/599225933.db2.gz HAUOPFHGVMWRST-MGPUTAFESA-N -1 3 373.460 3.938 20 0 FHADHM C[C@@H](CCSc1ccccc1)OC(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000820249160 607260972 /nfs/dbraw/zinc/26/09/72/607260972.db2.gz SPZRSVOTOXPHFY-ZDUSSCGKSA-N -1 3 354.435 3.594 20 0 FHADHM C[C@@H](CCSc1ccccc1)OC(=O)c1cccc(-c2nn[n-]n2)c1 ZINC000820249160 607260973 /nfs/dbraw/zinc/26/09/73/607260973.db2.gz SPZRSVOTOXPHFY-ZDUSSCGKSA-N -1 3 354.435 3.594 20 0 FHADHM CC[C@H]1CCCN(c2c(-c3nnn[n-]3)cnc3c(F)cc(F)cc32)CC1 ZINC000736403355 599230564 /nfs/dbraw/zinc/23/05/64/599230564.db2.gz UOBPLXZTAMVFER-NSHDSACASA-N -1 3 358.396 3.710 20 0 FHADHM CC[C@H]1CCCN(c2c(-c3nn[n-]n3)cnc3c(F)cc(F)cc32)CC1 ZINC000736403355 599230566 /nfs/dbraw/zinc/23/05/66/599230566.db2.gz UOBPLXZTAMVFER-NSHDSACASA-N -1 3 358.396 3.710 20 0 FHADHM O=C(CCc1ccc(-c2nnn[n-]2)cc1)N1CCCCCc2ccccc21 ZINC000737851428 599231737 /nfs/dbraw/zinc/23/17/37/599231737.db2.gz HILONOYOTAGYER-UHFFFAOYSA-N -1 3 361.449 3.559 20 0 FHADHM O=C(CCc1ccc(-c2nn[n-]n2)cc1)N1CCCCCc2ccccc21 ZINC000737851428 599231738 /nfs/dbraw/zinc/23/17/38/599231738.db2.gz HILONOYOTAGYER-UHFFFAOYSA-N -1 3 361.449 3.559 20 0 FHADHM CCc1cccc(C)c1NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821492108 599235950 /nfs/dbraw/zinc/23/59/50/599235950.db2.gz HIUVVYGZWMDBGO-ZDUSSCGKSA-N -1 3 350.426 3.620 20 0 FHADHM CCc1cccc(C)c1NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821492108 599235952 /nfs/dbraw/zinc/23/59/52/599235952.db2.gz HIUVVYGZWMDBGO-ZDUSSCGKSA-N -1 3 350.426 3.620 20 0 FHADHM Cc1cc(C)c(NC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c(C)c1 ZINC000822194253 599236224 /nfs/dbraw/zinc/23/62/24/599236224.db2.gz PJNNGMJMYDFHCM-AWEZNQCLSA-N -1 3 350.426 3.675 20 0 FHADHM Cc1cc(C)c(NC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c(C)c1 ZINC000822194253 599236226 /nfs/dbraw/zinc/23/62/26/599236226.db2.gz PJNNGMJMYDFHCM-AWEZNQCLSA-N -1 3 350.426 3.675 20 0 FHADHM C[C@H](NC(=S)Nc1cccc(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820403964 599237975 /nfs/dbraw/zinc/23/79/75/599237975.db2.gz NZNWSQQPVIYJFY-JTQLQIEISA-N -1 3 358.858 3.568 20 0 FHADHM C[C@H](NC(=S)Nc1cccc(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820403964 599237977 /nfs/dbraw/zinc/23/79/77/599237977.db2.gz NZNWSQQPVIYJFY-JTQLQIEISA-N -1 3 358.858 3.568 20 0 FHADHM Cc1ccc(NC(=S)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c(C)c1 ZINC000822254667 599239389 /nfs/dbraw/zinc/23/93/89/599239389.db2.gz OEGZAFXGXOBCPM-ZDUSSCGKSA-N -1 3 352.467 3.531 20 0 FHADHM Cc1ccc(NC(=S)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c(C)c1 ZINC000822254667 599239391 /nfs/dbraw/zinc/23/93/91/599239391.db2.gz OEGZAFXGXOBCPM-ZDUSSCGKSA-N -1 3 352.467 3.531 20 0 FHADHM Cc1ccc(SCCC(=O)Nc2cccc(-c3nnn[n-]3)c2C)cc1 ZINC000822266603 607271244 /nfs/dbraw/zinc/27/12/44/607271244.db2.gz FCUPOJDEPYDYSC-UHFFFAOYSA-N -1 3 353.451 3.604 20 0 FHADHM Cc1ccc(SCCC(=O)Nc2cccc(-c3nn[n-]n3)c2C)cc1 ZINC000822266603 607271245 /nfs/dbraw/zinc/27/12/45/607271245.db2.gz FCUPOJDEPYDYSC-UHFFFAOYSA-N -1 3 353.451 3.604 20 0 FHADHM C[C@H]1C[C@H](c2cccc(F)c2)N(C(=O)Nc2ccc(-c3nnn[n-]3)cc2)C1 ZINC000820668305 599243043 /nfs/dbraw/zinc/24/30/43/599243043.db2.gz RJJZDOLBVQBORO-YVEFUNNKSA-N -1 3 366.400 3.621 20 0 FHADHM C[C@H]1C[C@H](c2cccc(F)c2)N(C(=O)Nc2ccc(-c3nn[n-]n3)cc2)C1 ZINC000820668305 599243046 /nfs/dbraw/zinc/24/30/46/599243046.db2.gz RJJZDOLBVQBORO-YVEFUNNKSA-N -1 3 366.400 3.621 20 0 FHADHM Cc1c(NC(=O)c2ccc(Oc3ccccc3)o2)cccc1-c1nnn[n-]1 ZINC000822108433 607269149 /nfs/dbraw/zinc/26/91/49/607269149.db2.gz JPHNBJDEHMUFOK-UHFFFAOYSA-N -1 3 361.361 3.813 20 0 FHADHM Cc1c(NC(=O)c2ccc(Oc3ccccc3)o2)cccc1-c1nn[n-]n1 ZINC000822108433 607269150 /nfs/dbraw/zinc/26/91/50/607269150.db2.gz JPHNBJDEHMUFOK-UHFFFAOYSA-N -1 3 361.361 3.813 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)N1CC[C@@H]1c1ccc(Cl)cc1 ZINC000737796001 599251644 /nfs/dbraw/zinc/25/16/44/599251644.db2.gz DMTROVUQWFROND-PYUISTEWSA-N -1 3 365.824 3.507 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)N1CC[C@@H]1c1ccc(Cl)cc1 ZINC000737796001 599251647 /nfs/dbraw/zinc/25/16/47/599251647.db2.gz DMTROVUQWFROND-PYUISTEWSA-N -1 3 365.824 3.507 20 0 FHADHM Cc1c(NC(=O)N(Cc2ccccc2)C(C)C)cccc1-c1nnn[n-]1 ZINC000822083821 607281326 /nfs/dbraw/zinc/28/13/26/607281326.db2.gz DTCDDACNLYBHBF-UHFFFAOYSA-N -1 3 350.426 3.618 20 0 FHADHM Cc1c(NC(=O)N(Cc2ccccc2)C(C)C)cccc1-c1nn[n-]n1 ZINC000822083821 607281327 /nfs/dbraw/zinc/28/13/27/607281327.db2.gz DTCDDACNLYBHBF-UHFFFAOYSA-N -1 3 350.426 3.618 20 0 FHADHM Cc1cc([C@@H](C)NC(=O)Nc2cccc(-c3nnn[n-]3)c2C)c(C)s1 ZINC000822190833 607283582 /nfs/dbraw/zinc/28/35/82/607283582.db2.gz BWIXMJNYJAMTOW-LLVKDONJSA-N -1 3 356.455 3.736 20 0 FHADHM Cc1cc([C@@H](C)NC(=O)Nc2cccc(-c3nn[n-]n3)c2C)c(C)s1 ZINC000822190833 607283583 /nfs/dbraw/zinc/28/35/83/607283583.db2.gz BWIXMJNYJAMTOW-LLVKDONJSA-N -1 3 356.455 3.736 20 0 FHADHM CCC[C@@H](NC(=O)Nc1cccc(-c2nnn[n-]2)c1C)c1ccccc1 ZINC000821020571 607286847 /nfs/dbraw/zinc/28/68/47/607286847.db2.gz FFWHMLBZFRQDGA-QGZVFWFLSA-N -1 3 350.426 3.838 20 0 FHADHM CCC[C@@H](NC(=O)Nc1cccc(-c2nn[n-]n2)c1C)c1ccccc1 ZINC000821020571 607286848 /nfs/dbraw/zinc/28/68/48/607286848.db2.gz FFWHMLBZFRQDGA-QGZVFWFLSA-N -1 3 350.426 3.838 20 0 FHADHM Cc1c(NC(=O)N(CC2CC2)C2CCCCC2)cccc1-c1nnn[n-]1 ZINC000822077808 607292185 /nfs/dbraw/zinc/29/21/85/607292185.db2.gz YKLISVLZUCFLKK-UHFFFAOYSA-N -1 3 354.458 3.752 20 0 FHADHM Cc1c(NC(=O)N(CC2CC2)C2CCCCC2)cccc1-c1nn[n-]n1 ZINC000822077808 607292186 /nfs/dbraw/zinc/29/21/86/607292186.db2.gz YKLISVLZUCFLKK-UHFFFAOYSA-N -1 3 354.458 3.752 20 0 FHADHM Cc1ccc(CN(C(=O)Nc2cccc(-c3nnn[n-]3)c2C)C(C)C)s1 ZINC000822236228 607292710 /nfs/dbraw/zinc/29/27/10/607292710.db2.gz PIHHYUMMWLSNDS-UHFFFAOYSA-N -1 3 370.482 3.988 20 0 FHADHM Cc1ccc(CN(C(=O)Nc2cccc(-c3nn[n-]n3)c2C)C(C)C)s1 ZINC000822236228 607292711 /nfs/dbraw/zinc/29/27/11/607292711.db2.gz PIHHYUMMWLSNDS-UHFFFAOYSA-N -1 3 370.482 3.988 20 0 FHADHM Cc1cccc([C@@H](C)NC(=O)Nc2cccc(-c3nnn[n-]3)c2C)c1C ZINC000822289291 607292801 /nfs/dbraw/zinc/29/28/01/607292801.db2.gz VOYAGTBOPVBCLK-CQSZACIVSA-N -1 3 350.426 3.675 20 0 FHADHM Cc1cccc([C@@H](C)NC(=O)Nc2cccc(-c3nn[n-]n3)c2C)c1C ZINC000822289291 607292802 /nfs/dbraw/zinc/29/28/02/607292802.db2.gz VOYAGTBOPVBCLK-CQSZACIVSA-N -1 3 350.426 3.675 20 0 FHADHM Cc1cc(Cl)ccc1O[C@@H](C)C(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000822202248 607295155 /nfs/dbraw/zinc/29/51/55/607295155.db2.gz SCXRLXPLWMAMAA-LBPRGKRZSA-N -1 3 371.828 3.543 20 0 FHADHM Cc1cc(Cl)ccc1O[C@@H](C)C(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000822202248 607295156 /nfs/dbraw/zinc/29/51/56/607295156.db2.gz SCXRLXPLWMAMAA-LBPRGKRZSA-N -1 3 371.828 3.543 20 0 FHADHM O[C@H]1CCCC[C@@H]1CCCNc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000823706933 607306687 /nfs/dbraw/zinc/30/66/87/607306687.db2.gz RVUDSWQYUJCNLA-ABAIWWIYSA-N -1 3 369.391 3.629 20 0 FHADHM O[C@H]1CCCC[C@@H]1CCCNc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000823706933 607306688 /nfs/dbraw/zinc/30/66/88/607306688.db2.gz RVUDSWQYUJCNLA-ABAIWWIYSA-N -1 3 369.391 3.629 20 0 FHADHM CCC[C@@]1(C)CCCN(C(=O)Nc2cc(-c3nnn[n-]3)ccc2OCC)C1 ZINC000821026842 599264561 /nfs/dbraw/zinc/26/45/61/599264561.db2.gz DVVBMQQMSMBBCW-IBGZPJMESA-N -1 3 372.473 3.700 20 0 FHADHM CCC[C@@]1(C)CCCN(C(=O)Nc2cc(-c3nn[n-]n3)ccc2OCC)C1 ZINC000821026842 599264563 /nfs/dbraw/zinc/26/45/63/599264563.db2.gz DVVBMQQMSMBBCW-IBGZPJMESA-N -1 3 372.473 3.700 20 0 FHADHM CC(C)(C)OC(=O)Nc1ccc(NCc2cc(-c3nnn[n-]3)cs2)cc1 ZINC000819945695 607311205 /nfs/dbraw/zinc/31/12/05/607311205.db2.gz AHNQTEVSTHNDDT-UHFFFAOYSA-N -1 3 372.454 3.887 20 0 FHADHM CC(C)(C)OC(=O)Nc1ccc(NCc2cc(-c3nn[n-]n3)cs2)cc1 ZINC000819945695 607311206 /nfs/dbraw/zinc/31/12/06/607311206.db2.gz AHNQTEVSTHNDDT-UHFFFAOYSA-N -1 3 372.454 3.887 20 0 FHADHM FC(F)(F)c1nc2cc(NCc3cc(-c4nnn[n-]4)cs3)ccc2o1 ZINC000822728792 607314603 /nfs/dbraw/zinc/31/46/03/607314603.db2.gz MUKWRWUHEMAKOG-UHFFFAOYSA-N -1 3 366.328 3.700 20 0 FHADHM FC(F)(F)c1nc2cc(NCc3cc(-c4nn[n-]n4)cs3)ccc2o1 ZINC000822728792 607314604 /nfs/dbraw/zinc/31/46/04/607314604.db2.gz MUKWRWUHEMAKOG-UHFFFAOYSA-N -1 3 366.328 3.700 20 0 FHADHM CCC[C@@H]1[C@H](C)CCCN1C(=O)Nc1cc(-c2nnn[n-]2)ccc1OCC ZINC000821034405 599266181 /nfs/dbraw/zinc/26/61/81/599266181.db2.gz LVNCDYYIWJAQMP-CZUORRHYSA-N -1 3 372.473 3.698 20 0 FHADHM CCC[C@@H]1[C@H](C)CCCN1C(=O)Nc1cc(-c2nn[n-]n2)ccc1OCC ZINC000821034405 599266183 /nfs/dbraw/zinc/26/61/83/599266183.db2.gz LVNCDYYIWJAQMP-CZUORRHYSA-N -1 3 372.473 3.698 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)c1nc(C(F)(F)F)cs1 ZINC000821109889 607305461 /nfs/dbraw/zinc/30/54/61/607305461.db2.gz RNTAMFLPCUZGQB-UHFFFAOYSA-N -1 3 368.388 3.759 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)c1nc(C(F)(F)F)cs1 ZINC000821109889 607305462 /nfs/dbraw/zinc/30/54/62/607305462.db2.gz RNTAMFLPCUZGQB-UHFFFAOYSA-N -1 3 368.388 3.759 20 0 FHADHM O[C@H]1CCCC[C@H]1CCCNc1ccc(C(F)(F)F)cc1-c1nnn[n-]1 ZINC000823704562 607306205 /nfs/dbraw/zinc/30/62/05/607306205.db2.gz CBUZXMVSDNPKEE-NHYWBVRUSA-N -1 3 369.391 3.629 20 0 FHADHM O[C@H]1CCCC[C@H]1CCCNc1ccc(C(F)(F)F)cc1-c1nn[n-]n1 ZINC000823704562 607306206 /nfs/dbraw/zinc/30/62/06/607306206.db2.gz CBUZXMVSDNPKEE-NHYWBVRUSA-N -1 3 369.391 3.629 20 0 FHADHM Cc1cccc2c1ncc(-c1nnn[n-]1)c2N(C)Cc1ccc(F)c(F)c1 ZINC000737409304 599268512 /nfs/dbraw/zinc/26/85/12/599268512.db2.gz MDKWLKZLNISTRH-UHFFFAOYSA-N -1 3 366.375 3.638 20 0 FHADHM Cc1cccc2c1ncc(-c1nn[n-]n1)c2N(C)Cc1ccc(F)c(F)c1 ZINC000737409304 599268514 /nfs/dbraw/zinc/26/85/14/599268514.db2.gz MDKWLKZLNISTRH-UHFFFAOYSA-N -1 3 366.375 3.638 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)Nc1cc(C)cc(F)c1 ZINC000821105014 607319426 /nfs/dbraw/zinc/31/94/26/607319426.db2.gz VFQKPZCSOBBDIN-UHFFFAOYSA-N -1 3 368.416 3.758 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)Nc1cc(C)cc(F)c1 ZINC000821105014 607319427 /nfs/dbraw/zinc/31/94/27/607319427.db2.gz VFQKPZCSOBBDIN-UHFFFAOYSA-N -1 3 368.416 3.758 20 0 FHADHM O=C(Nc1ccc(F)cc1OC1CCCC1)c1sccc1-c1nnn[n-]1 ZINC000823347563 607320607 /nfs/dbraw/zinc/32/06/07/607320607.db2.gz ZSSYYSXRUIHRLA-UHFFFAOYSA-N -1 3 373.413 3.641 20 0 FHADHM O=C(Nc1ccc(F)cc1OC1CCCC1)c1sccc1-c1nn[n-]n1 ZINC000823347563 607320608 /nfs/dbraw/zinc/32/06/08/607320608.db2.gz ZSSYYSXRUIHRLA-UHFFFAOYSA-N -1 3 373.413 3.641 20 0 FHADHM C[C@H](Sc1ccc(Br)cn1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736191340 599289344 /nfs/dbraw/zinc/28/93/44/599289344.db2.gz ICIHLYCXHXMBSI-VIFPVBQESA-N -1 3 362.256 3.878 20 0 FHADHM C[C@H](Sc1ccc(Br)cn1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736191340 599289346 /nfs/dbraw/zinc/28/93/46/599289346.db2.gz ICIHLYCXHXMBSI-VIFPVBQESA-N -1 3 362.256 3.878 20 0 FHADHM CCC(CC)n1ccc(CSCc2ccc(-c3nnn[n-]3)cc2F)n1 ZINC000820897735 607325610 /nfs/dbraw/zinc/32/56/10/607325610.db2.gz NRORGJXIPRYEKQ-UHFFFAOYSA-N -1 3 360.462 3.997 20 0 FHADHM CCC(CC)n1ccc(CSCc2ccc(-c3nn[n-]n3)cc2F)n1 ZINC000820897735 607325611 /nfs/dbraw/zinc/32/56/11/607325611.db2.gz NRORGJXIPRYEKQ-UHFFFAOYSA-N -1 3 360.462 3.997 20 0 FHADHM CCC(CC)n1ccc(CSCc2ccc(F)cc2-c2nnn[n-]2)n1 ZINC000820897500 607325779 /nfs/dbraw/zinc/32/57/79/607325779.db2.gz HKSYLHMVSUZVRR-UHFFFAOYSA-N -1 3 360.462 3.997 20 0 FHADHM CCC(CC)n1ccc(CSCc2ccc(F)cc2-c2nn[n-]n2)n1 ZINC000820897500 607325780 /nfs/dbraw/zinc/32/57/80/607325780.db2.gz HKSYLHMVSUZVRR-UHFFFAOYSA-N -1 3 360.462 3.997 20 0 FHADHM c1c2ccccc2[nH]c1CCNc1nc2ccccc2cc1-c1nnn[n-]1 ZINC000823802404 607330017 /nfs/dbraw/zinc/33/00/17/607330017.db2.gz MDVBOSZQDVCJSD-UHFFFAOYSA-N -1 3 355.405 3.551 20 0 FHADHM c1c2ccccc2[nH]c1CCNc1nc2ccccc2cc1-c1nn[n-]n1 ZINC000823802404 607330018 /nfs/dbraw/zinc/33/00/18/607330018.db2.gz MDVBOSZQDVCJSD-UHFFFAOYSA-N -1 3 355.405 3.551 20 0 FHADHM c1c2ccccc2[nH]c1CCNc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000823791996 607330020 /nfs/dbraw/zinc/33/00/20/607330020.db2.gz MCVKEOZEUHRPLT-UHFFFAOYSA-N -1 3 355.405 3.551 20 0 FHADHM c1c2ccccc2[nH]c1CCNc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000823791996 607330021 /nfs/dbraw/zinc/33/00/21/607330021.db2.gz MCVKEOZEUHRPLT-UHFFFAOYSA-N -1 3 355.405 3.551 20 0 FHADHM COc1cc([C@@H](C)NCc2cccc(C(=O)[O-])c2)ccc1OC(F)F ZINC000820759222 598192657 /nfs/dbraw/zinc/19/26/57/598192657.db2.gz IPFLYXJZEBRNEA-LLVKDONJSA-N -1 3 351.349 3.846 20 0 FHADHM CCCSCC(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736498673 598231812 /nfs/dbraw/zinc/23/18/12/598231812.db2.gz WVPINLNEXOBYDR-UHFFFAOYSA-N -1 3 369.450 3.741 20 0 FHADHM CCCSCC(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736498673 598231813 /nfs/dbraw/zinc/23/18/13/598231813.db2.gz WVPINLNEXOBYDR-UHFFFAOYSA-N -1 3 369.450 3.741 20 0 FHADHM CCCCSc1nnc(Sc2cccc(F)c2-c2nnn[n-]2)s1 ZINC000736464108 598235900 /nfs/dbraw/zinc/23/59/00/598235900.db2.gz UYBRVWQJWILCGY-UHFFFAOYSA-N -1 3 368.488 3.901 20 0 FHADHM Fc1cccc(NCc2csc(-c3ccccc3)n2)c1-c1nnn[n-]1 ZINC000737665769 598236096 /nfs/dbraw/zinc/23/60/96/598236096.db2.gz VEAUHCOQZFLVBW-UHFFFAOYSA-N -1 3 352.398 3.741 20 0 FHADHM Fc1cccc(NCc2csc(-c3ccccc3)n2)c1-c1nn[n-]n1 ZINC000737665769 598236098 /nfs/dbraw/zinc/23/60/98/598236098.db2.gz VEAUHCOQZFLVBW-UHFFFAOYSA-N -1 3 352.398 3.741 20 0 FHADHM C[C@@H](Nc1ccc(-c2nn[n-]n2)cc1F)c1ccc(NC(=O)C2CC2)cc1 ZINC000736136164 598236899 /nfs/dbraw/zinc/23/68/99/598236899.db2.gz DMXSQQNMDQOXST-LLVKDONJSA-N -1 3 366.400 3.527 20 0 FHADHM Oc1ccc(CCC2CCN(c3cccc(F)c3-c3nnn[n-]3)CC2)cc1 ZINC000738396000 598236923 /nfs/dbraw/zinc/23/69/23/598236923.db2.gz BMTNUKMZSGDXAU-UHFFFAOYSA-N -1 3 367.428 3.561 20 0 FHADHM Oc1ccc(CCC2CCN(c3cccc(F)c3-c3nn[n-]n3)CC2)cc1 ZINC000738396000 598236925 /nfs/dbraw/zinc/23/69/25/598236925.db2.gz BMTNUKMZSGDXAU-UHFFFAOYSA-N -1 3 367.428 3.561 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1N[C@@H]1CCc2cc(Br)ccc21 ZINC000737640789 598240729 /nfs/dbraw/zinc/24/07/29/598240729.db2.gz QJTHKCKPGCZVIE-CQSZACIVSA-N -1 3 374.217 3.868 20 0 FHADHM CN(C[C@@H]1CCCO[C@H]1c1ccccc1)c1ccc(-c2nn[n-]n2)cc1F ZINC000736793387 598243011 /nfs/dbraw/zinc/24/30/11/598243011.db2.gz WSMNNXGJQYYJFY-LPHOPBHVSA-N -1 3 367.428 3.610 20 0 FHADHM COc1c(Cl)cc(NCc2ccc(-c3nnn[n-]3)cc2F)cc1Cl ZINC000737024331 598249960 /nfs/dbraw/zinc/24/99/60/598249960.db2.gz GGEKVHRVVUOYOK-UHFFFAOYSA-N -1 3 368.199 3.933 20 0 FHADHM COc1c(Cl)cc(NCc2ccc(-c3nn[n-]n3)cc2F)cc1Cl ZINC000737024331 598249961 /nfs/dbraw/zinc/24/99/61/598249961.db2.gz GGEKVHRVVUOYOK-UHFFFAOYSA-N -1 3 368.199 3.933 20 0 FHADHM CC(=O)Nc1cccc(-c2nc(-c3ccc(-c4nnn[n-]4)cc3)cs2)c1 ZINC000735488817 598272987 /nfs/dbraw/zinc/27/29/87/598272987.db2.gz OLDWUGREZWGJSV-UHFFFAOYSA-N -1 3 362.418 3.616 20 0 FHADHM CC(=O)Nc1cccc(-c2nc(-c3ccc(-c4nn[n-]n4)cc3)cs2)c1 ZINC000735488817 598272989 /nfs/dbraw/zinc/27/29/89/598272989.db2.gz OLDWUGREZWGJSV-UHFFFAOYSA-N -1 3 362.418 3.616 20 0 FHADHM CC[C@H](NC(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C)c1ccccc1 ZINC000736366171 598281097 /nfs/dbraw/zinc/28/10/97/598281097.db2.gz ZUCWNNWNLHSTKC-HNNXBMFYSA-N -1 3 367.457 3.696 20 0 FHADHM CC[C@H](NC(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C)c1ccccc1 ZINC000736366171 598281098 /nfs/dbraw/zinc/28/10/98/598281098.db2.gz ZUCWNNWNLHSTKC-HNNXBMFYSA-N -1 3 367.457 3.696 20 0 FHADHM CC[C@H](C)Oc1ccccc1C=CC(=O)Nc1ccccc1-c1nnn[n-]1 ZINC000736323549 598296979 /nfs/dbraw/zinc/29/69/79/598296979.db2.gz BCKTZVFIRWUOHO-DINCDJDBSA-N -1 3 363.421 3.696 20 0 FHADHM CC[C@H](C)Oc1ccccc1C=CC(=O)Nc1ccccc1-c1nn[n-]n1 ZINC000736323549 598296980 /nfs/dbraw/zinc/29/69/80/598296980.db2.gz BCKTZVFIRWUOHO-DINCDJDBSA-N -1 3 363.421 3.696 20 0 FHADHM CCCCC1CCC(C(=O)NCc2ccc(-c3nnn[n-]3)cc2F)CC1 ZINC000736436236 598304598 /nfs/dbraw/zinc/30/45/98/598304598.db2.gz BSARQRSVRFYXOO-UHFFFAOYSA-N -1 3 359.449 3.619 20 0 FHADHM CCCCC1CCC(C(=O)NCc2ccc(-c3nn[n-]n3)cc2F)CC1 ZINC000736436236 598304600 /nfs/dbraw/zinc/30/46/00/598304600.db2.gz BSARQRSVRFYXOO-UHFFFAOYSA-N -1 3 359.449 3.619 20 0 FHADHM Clc1cc(CSCc2cccc(-c3nnn[n-]3)c2)cc2c1OCCO2 ZINC000737565701 598313759 /nfs/dbraw/zinc/31/37/59/598313759.db2.gz OSEQYDWQVNNFJO-UHFFFAOYSA-N -1 3 374.853 3.725 20 0 FHADHM Clc1cc(CSCc2cccc(-c3nn[n-]n3)c2)cc2c1OCCO2 ZINC000737565701 598313760 /nfs/dbraw/zinc/31/37/60/598313760.db2.gz OSEQYDWQVNNFJO-UHFFFAOYSA-N -1 3 374.853 3.725 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1CSCc1ccn(-c2ccccc2)n1 ZINC000737641100 598315840 /nfs/dbraw/zinc/31/58/40/598315840.db2.gz RKBVBGQDIVNNCU-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CSCc1ccn(-c2ccccc2)n1 ZINC000737641100 598315841 /nfs/dbraw/zinc/31/58/41/598315841.db2.gz RKBVBGQDIVNNCU-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM C[C@@H]1CCC[C@H](NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)[C@H]1C ZINC000736249118 598317073 /nfs/dbraw/zinc/31/70/73/598317073.db2.gz FDQRFAIOCIZMAI-BFVZDQMLSA-N -1 3 364.906 3.631 20 0 FHADHM C[C@@H]1CCC[C@H](NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)[C@H]1C ZINC000736249118 598317074 /nfs/dbraw/zinc/31/70/74/598317074.db2.gz FDQRFAIOCIZMAI-BFVZDQMLSA-N -1 3 364.906 3.631 20 0 FHADHM C[C@@H](c1ccco1)N(C)C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736203417 598324065 /nfs/dbraw/zinc/32/40/65/598324065.db2.gz NRJYINLQTDYMPE-VIFPVBQESA-N -1 3 362.846 3.503 20 0 FHADHM C[C@@H](c1ccco1)N(C)C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736203417 598324068 /nfs/dbraw/zinc/32/40/68/598324068.db2.gz NRJYINLQTDYMPE-VIFPVBQESA-N -1 3 362.846 3.503 20 0 FHADHM CCN(C(=O)c1csc(C(C)C)n1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736508842 598327539 /nfs/dbraw/zinc/32/75/39/598327539.db2.gz OSLOBQJUDSDSKO-LBPRGKRZSA-N -1 3 370.482 3.670 20 0 FHADHM CCN(C(=O)c1csc(C(C)C)n1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736508842 598327541 /nfs/dbraw/zinc/32/75/41/598327541.db2.gz OSLOBQJUDSDSKO-LBPRGKRZSA-N -1 3 370.482 3.670 20 0 FHADHM CCN(C(=O)c1nccc2ccccc21)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736507210 598330160 /nfs/dbraw/zinc/33/01/60/598330160.db2.gz BRSNGHURXULVOX-AWEZNQCLSA-N -1 3 372.432 3.638 20 0 FHADHM CCN(C(=O)c1nccc2ccccc21)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736507210 598330162 /nfs/dbraw/zinc/33/01/62/598330162.db2.gz BRSNGHURXULVOX-AWEZNQCLSA-N -1 3 372.432 3.638 20 0 FHADHM CCN(C(=O)c1ccc(F)cc1C)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821160194 607350902 /nfs/dbraw/zinc/35/09/02/607350902.db2.gz GSBRFEKWFIPQDW-ZDUSSCGKSA-N -1 3 353.401 3.538 20 0 FHADHM CCN(C(=O)c1ccc(F)cc1C)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821160194 607350905 /nfs/dbraw/zinc/35/09/05/607350905.db2.gz GSBRFEKWFIPQDW-ZDUSSCGKSA-N -1 3 353.401 3.538 20 0 FHADHM C[C@@H](CC(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2)c1ccccc1F ZINC000735976316 598364933 /nfs/dbraw/zinc/36/49/33/598364933.db2.gz LCSKXJWMQNDNJN-JTQLQIEISA-N -1 3 371.441 3.688 20 0 FHADHM C[C@@H](CC(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2)c1ccccc1F ZINC000735976316 598364935 /nfs/dbraw/zinc/36/49/35/598364935.db2.gz LCSKXJWMQNDNJN-JTQLQIEISA-N -1 3 371.441 3.688 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)C[C@H](C)c1ccccc1F ZINC000736638063 598365398 /nfs/dbraw/zinc/36/53/98/598365398.db2.gz XLPBHTUEFBRYEI-LBPRGKRZSA-N -1 3 369.400 3.537 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)C[C@H](C)c1ccccc1F ZINC000736638063 598365400 /nfs/dbraw/zinc/36/54/00/598365400.db2.gz XLPBHTUEFBRYEI-LBPRGKRZSA-N -1 3 369.400 3.537 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1NCCOc1ccc2ccccc2c1 ZINC000737558108 598388240 /nfs/dbraw/zinc/38/82/40/598388240.db2.gz KPLGHVRUPAFVHV-UHFFFAOYSA-N -1 3 366.812 3.559 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1NCCOc1ccc2ccccc2c1 ZINC000737558108 598388241 /nfs/dbraw/zinc/38/82/41/598388241.db2.gz KPLGHVRUPAFVHV-UHFFFAOYSA-N -1 3 366.812 3.559 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1NCCc1ccc2ccccc2c1 ZINC000737557102 598390413 /nfs/dbraw/zinc/39/04/13/598390413.db2.gz BQNUQMKDCBUWLG-UHFFFAOYSA-N -1 3 350.813 3.723 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1NCCc1ccc2ccccc2c1 ZINC000737557102 598390414 /nfs/dbraw/zinc/39/04/14/598390414.db2.gz BQNUQMKDCBUWLG-UHFFFAOYSA-N -1 3 350.813 3.723 20 0 FHADHM CCCCOc1cccc(CNc2ncc(-c3nnn[n-]3)cc2Cl)c1 ZINC000736463947 598390785 /nfs/dbraw/zinc/39/07/85/598390785.db2.gz TWMIDBBKHZGOND-UHFFFAOYSA-N -1 3 358.833 3.706 20 0 FHADHM CCCCOc1cccc(CNc2ncc(-c3nn[n-]n3)cc2Cl)c1 ZINC000736463947 598390786 /nfs/dbraw/zinc/39/07/86/598390786.db2.gz TWMIDBBKHZGOND-UHFFFAOYSA-N -1 3 358.833 3.706 20 0 FHADHM Cc1ccc(C)c(CS[C@@H](C)C(=O)Nc2cccc(-c3nnn[n-]3)c2)c1 ZINC000737322732 598393212 /nfs/dbraw/zinc/39/32/12/598393212.db2.gz MPSMCAHUQHVCGP-AWEZNQCLSA-N -1 3 367.478 3.744 20 0 FHADHM Cc1ccc(C)c(CS[C@@H](C)C(=O)Nc2cccc(-c3nn[n-]n3)c2)c1 ZINC000737322732 598393214 /nfs/dbraw/zinc/39/32/14/598393214.db2.gz MPSMCAHUQHVCGP-AWEZNQCLSA-N -1 3 367.478 3.744 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1OCc1cccc(OCC(F)(F)F)c1 ZINC000737221802 598394712 /nfs/dbraw/zinc/39/47/12/598394712.db2.gz OZKLDDYOEADSAB-UHFFFAOYSA-N -1 3 364.327 3.695 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1OCc1ncc(-c2ccc(F)cc2)o1 ZINC000737222168 598395223 /nfs/dbraw/zinc/39/52/23/598395223.db2.gz UFILZFFLLHJOQJ-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM Cc1c(Br)cccc1NCc1ccc(-c2nnn[n-]2)cc1F ZINC000737204003 598395854 /nfs/dbraw/zinc/39/58/54/598395854.db2.gz XCGKXWUWWGFSLB-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Cc1c(Br)cccc1NCc1ccc(-c2nn[n-]n2)cc1F ZINC000737204003 598395856 /nfs/dbraw/zinc/39/58/56/598395856.db2.gz XCGKXWUWWGFSLB-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Cc1cccc(NC(=O)[C@H](C)Sc2ccc(-c3nnn[n-]3)cc2)c1C ZINC000737398155 598414633 /nfs/dbraw/zinc/41/46/33/598414633.db2.gz DJMHXPHUYWAUTK-ZDUSSCGKSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1cccc(NC(=O)[C@H](C)Sc2ccc(-c3nn[n-]n3)cc2)c1C ZINC000737398155 598414636 /nfs/dbraw/zinc/41/46/36/598414636.db2.gz DJMHXPHUYWAUTK-ZDUSSCGKSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1nn(-c2ccccc2)c(Cl)c1CNc1ccc(-c2nn[n-]n2)cc1 ZINC000737504092 598416192 /nfs/dbraw/zinc/41/61/92/598416192.db2.gz NUXWAIRXJIXXAR-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM Cc1nn(-c2ccccc2)c(Cl)c1CNc1cccc(-c2nnn[n-]2)c1 ZINC000737503767 598419903 /nfs/dbraw/zinc/41/99/03/598419903.db2.gz KYULVFXMEQRKKV-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM Cc1nn(-c2ccccc2)c(Cl)c1CNc1cccc(-c2nn[n-]n2)c1 ZINC000737503767 598419905 /nfs/dbraw/zinc/41/99/05/598419905.db2.gz KYULVFXMEQRKKV-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM CC(C)CC[C@H](C)NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C(C)C ZINC000735797351 598427496 /nfs/dbraw/zinc/42/74/96/598427496.db2.gz NRFKWUHEDJEIQT-HNNXBMFYSA-N -1 3 358.490 3.611 20 0 FHADHM CC(C)CC[C@H](C)NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C(C)C ZINC000735797351 598427498 /nfs/dbraw/zinc/42/74/98/598427498.db2.gz NRFKWUHEDJEIQT-HNNXBMFYSA-N -1 3 358.490 3.611 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)NC[C@H]1CCCC[C@@H]1C ZINC000736271837 598429885 /nfs/dbraw/zinc/42/98/85/598429885.db2.gz OTWWQICOEISXDM-MAUKXSAKSA-N -1 3 370.501 3.613 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)NC[C@H]1CCCC[C@@H]1C ZINC000736271837 598429887 /nfs/dbraw/zinc/42/98/87/598429887.db2.gz OTWWQICOEISXDM-MAUKXSAKSA-N -1 3 370.501 3.613 20 0 FHADHM Cc1cc(C)cc([C@H](C)NC(=O)N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737253956 598430566 /nfs/dbraw/zinc/43/05/66/598430566.db2.gz VKOQRFVRHLUPPZ-CABCVRRESA-N -1 3 364.453 3.605 20 0 FHADHM Cc1cc(C)cc([C@H](C)NC(=O)N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737253956 598430569 /nfs/dbraw/zinc/43/05/69/598430569.db2.gz VKOQRFVRHLUPPZ-CABCVRRESA-N -1 3 364.453 3.605 20 0 FHADHM Clc1cc2c(cc1SCc1cccc(-c3nnn[n-]3)c1)OCCO2 ZINC000737565742 598440016 /nfs/dbraw/zinc/44/00/16/598440016.db2.gz PWHBDFGYKLMUFK-UHFFFAOYSA-N -1 3 360.826 3.584 20 0 FHADHM Clc1cc2c(cc1SCc1cccc(-c3nn[n-]n3)c1)OCCO2 ZINC000737565742 598440017 /nfs/dbraw/zinc/44/00/17/598440017.db2.gz PWHBDFGYKLMUFK-UHFFFAOYSA-N -1 3 360.826 3.584 20 0 FHADHM Cc1cccc(C2(NC(=O)C=Cc3ccccc3-c3nnn[n-]3)CCCC2)c1 ZINC000737391075 598447513 /nfs/dbraw/zinc/44/75/13/598447513.db2.gz XRABKPXQTJKJQW-VAWYXSNFSA-N -1 3 373.460 3.774 20 0 FHADHM Cc1cccc(C2(NC(=O)C=Cc3ccccc3-c3nn[n-]n3)CCCC2)c1 ZINC000737391075 598447514 /nfs/dbraw/zinc/44/75/14/598447514.db2.gz XRABKPXQTJKJQW-VAWYXSNFSA-N -1 3 373.460 3.774 20 0 FHADHM Cc1ccc(NC(=O)c2cccc(Oc3ccc(-c4nnn[n-]4)cn3)c2)cc1 ZINC000737361160 598457382 /nfs/dbraw/zinc/45/73/82/598457382.db2.gz UTPUCINCCDPWFL-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccc(NC(=O)c2cccc(Oc3ccc(-c4nn[n-]n4)cn3)c2)cc1 ZINC000737361160 598457383 /nfs/dbraw/zinc/45/73/83/598457383.db2.gz UTPUCINCCDPWFL-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1cccc(C2(NC(=O)Nc3ccc(-c4nnn[n-]4)cc3)CCCC2)c1 ZINC000737390692 598468173 /nfs/dbraw/zinc/46/81/73/598468173.db2.gz VIPUFHSJUSWMQI-UHFFFAOYSA-N -1 3 362.437 3.766 20 0 FHADHM Cc1cccc(C2(NC(=O)Nc3ccc(-c4nn[n-]n4)cc3)CCCC2)c1 ZINC000737390692 598468174 /nfs/dbraw/zinc/46/81/74/598468174.db2.gz VIPUFHSJUSWMQI-UHFFFAOYSA-N -1 3 362.437 3.766 20 0 FHADHM COc1ccccc1C(C)=CC(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000737143289 598481724 /nfs/dbraw/zinc/48/17/24/598481724.db2.gz TYUDPUUTNVPUTL-YBEMTRGBSA-N -1 3 364.405 3.583 20 0 FHADHM COc1ccccc1C(C)=CC(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000737143289 598481726 /nfs/dbraw/zinc/48/17/26/598481726.db2.gz TYUDPUUTNVPUTL-YBEMTRGBSA-N -1 3 364.405 3.583 20 0 FHADHM CC[C@@](C)(NC(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000736312902 598483852 /nfs/dbraw/zinc/48/38/52/598483852.db2.gz DEZRLCDMNULMIS-VBKZILBWSA-N -1 3 364.453 3.552 20 0 FHADHM CC[C@@](C)(NC(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000736312902 598483854 /nfs/dbraw/zinc/48/38/54/598483854.db2.gz DEZRLCDMNULMIS-VBKZILBWSA-N -1 3 364.453 3.552 20 0 FHADHM C[C@@H](SCc1ccccc1)C(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000736190048 598486727 /nfs/dbraw/zinc/48/67/27/598486727.db2.gz FHDXNVFZPPDLBQ-UONOGXRCSA-N -1 3 368.462 3.793 20 0 FHADHM C[C@@H](SCc1ccccc1)C(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000736190048 598486728 /nfs/dbraw/zinc/48/67/28/598486728.db2.gz FHDXNVFZPPDLBQ-UONOGXRCSA-N -1 3 368.462 3.793 20 0 FHADHM Cc1cccc(OCCCC(=O)O[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000737402264 598487315 /nfs/dbraw/zinc/48/73/15/598487315.db2.gz UMHWHQAOFNJULV-HNNXBMFYSA-N -1 3 366.421 3.639 20 0 FHADHM Cc1cccc(OCCCC(=O)O[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000737402264 598487317 /nfs/dbraw/zinc/48/73/17/598487317.db2.gz UMHWHQAOFNJULV-HNNXBMFYSA-N -1 3 366.421 3.639 20 0 FHADHM Cc1ccccc1OCCCC(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000737431150 598488554 /nfs/dbraw/zinc/48/85/54/598488554.db2.gz FLOVHHLUFJALMU-OAHLLOKOSA-N -1 3 366.421 3.639 20 0 FHADHM Cc1ccccc1OCCCC(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000737431150 598488555 /nfs/dbraw/zinc/48/85/55/598488555.db2.gz FLOVHHLUFJALMU-OAHLLOKOSA-N -1 3 366.421 3.639 20 0 FHADHM Cc1ccc2oc(C(=O)Nc3cc(-c4nnn[n-]4)cn3C(C)(C)C)cc2c1 ZINC000737373371 598490746 /nfs/dbraw/zinc/49/07/46/598490746.db2.gz GWEAOVZYKRKXDY-UHFFFAOYSA-N -1 3 364.409 3.730 20 0 FHADHM Cc1ccc2oc(C(=O)Nc3cc(-c4nn[n-]n4)cn3C(C)(C)C)cc2c1 ZINC000737373371 598490747 /nfs/dbraw/zinc/49/07/47/598490747.db2.gz GWEAOVZYKRKXDY-UHFFFAOYSA-N -1 3 364.409 3.730 20 0 FHADHM CC[C@@H](Sc1ccc(-c2nnn[n-]2)cc1)C(=O)c1ccc(OC)cc1 ZINC000736392249 598493014 /nfs/dbraw/zinc/49/30/14/598493014.db2.gz PURVOTXXFXMXRS-MRXNPFEDSA-N -1 3 354.435 3.629 20 0 FHADHM CC[C@@H](Sc1ccc(-c2nn[n-]n2)cc1)C(=O)c1ccc(OC)cc1 ZINC000736392249 598493016 /nfs/dbraw/zinc/49/30/16/598493016.db2.gz PURVOTXXFXMXRS-MRXNPFEDSA-N -1 3 354.435 3.629 20 0 FHADHM CSCCc1ccc(NC(=S)Nc2ccccc2-c2nnn[n-]2)cc1 ZINC000737181031 598495180 /nfs/dbraw/zinc/49/51/80/598495180.db2.gz GESGSDFULOAUJM-UHFFFAOYSA-N -1 3 370.507 3.581 20 0 FHADHM CSCCc1ccc(NC(=S)Nc2ccccc2-c2nn[n-]n2)cc1 ZINC000737181031 598495181 /nfs/dbraw/zinc/49/51/81/598495181.db2.gz GESGSDFULOAUJM-UHFFFAOYSA-N -1 3 370.507 3.581 20 0 FHADHM CCc1c(C)sc(NC(=O)CSc2ccccc2)c1-c1nnn[n-]1 ZINC000736675179 598518559 /nfs/dbraw/zinc/51/85/59/598518559.db2.gz FTXFTDHTPCFXIF-UHFFFAOYSA-N -1 3 359.480 3.530 20 0 FHADHM CCc1c(C)sc(NC(=O)CSc2ccccc2)c1-c1nn[n-]n1 ZINC000736675179 598518560 /nfs/dbraw/zinc/51/85/60/598518560.db2.gz FTXFTDHTPCFXIF-UHFFFAOYSA-N -1 3 359.480 3.530 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccc(Cl)s2)c1-c1nnn[n-]1 ZINC000736675757 598518583 /nfs/dbraw/zinc/51/85/83/598518583.db2.gz LXWDBVZIGKUEBM-UHFFFAOYSA-N -1 3 353.860 3.766 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccc(Cl)s2)c1-c1nn[n-]n1 ZINC000736675757 598518584 /nfs/dbraw/zinc/51/85/84/598518584.db2.gz LXWDBVZIGKUEBM-UHFFFAOYSA-N -1 3 353.860 3.766 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cc3c(s2)CCCC3)c1-c1nnn[n-]1 ZINC000736674607 598518736 /nfs/dbraw/zinc/51/87/36/598518736.db2.gz DVLPHIHYCJDCAI-UHFFFAOYSA-N -1 3 373.507 3.992 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cc3c(s2)CCCC3)c1-c1nn[n-]n1 ZINC000736674607 598518738 /nfs/dbraw/zinc/51/87/38/598518738.db2.gz DVLPHIHYCJDCAI-UHFFFAOYSA-N -1 3 373.507 3.992 20 0 FHADHM O=C(C=CSc1ccccc1)Nc1sc2c(c1-c1nn[n-]n1)CCC2 ZINC000737793886 598537091 /nfs/dbraw/zinc/53/70/91/598537091.db2.gz AAPKWGUHFCGFKA-MDZDMXLPSA-N -1 3 369.475 3.661 20 0 FHADHM O=C(/C=C/Sc1ccccc1)Nc1sc2c(c1-c1nn[n-]n1)CCC2 ZINC000737793886 598537092 /nfs/dbraw/zinc/53/70/92/598537092.db2.gz AAPKWGUHFCGFKA-MDZDMXLPSA-N -1 3 369.475 3.661 20 0 FHADHM CCC(CC)C(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736338212 598543653 /nfs/dbraw/zinc/54/36/53/598543653.db2.gz PXPKEXUBTDGRRO-UHFFFAOYSA-N -1 3 365.437 3.820 20 0 FHADHM CCC(CC)C(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736338212 598543654 /nfs/dbraw/zinc/54/36/54/598543654.db2.gz PXPKEXUBTDGRRO-UHFFFAOYSA-N -1 3 365.437 3.820 20 0 FHADHM Cc1ccc(-c2nc(COc3ccc(-c4nnn[n-]4)c(F)c3)co2)cc1 ZINC000737289554 598552258 /nfs/dbraw/zinc/55/22/58/598552258.db2.gz VFCOQFWKKHRSJP-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM Cc1ccc(-c2nc(COc3ccc(-c4nn[n-]n4)c(F)c3)co2)cc1 ZINC000737289554 598552260 /nfs/dbraw/zinc/55/22/60/598552260.db2.gz VFCOQFWKKHRSJP-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM Fc1ccc(C(F)(F)F)cc1NCc1ccc(-c2nnn[n-]2)cc1F ZINC000737639849 598553348 /nfs/dbraw/zinc/55/33/48/598553348.db2.gz UGFMIKRBOJILIE-UHFFFAOYSA-N -1 3 355.270 3.776 20 0 FHADHM Fc1ccc(C(F)(F)F)cc1NCc1ccc(-c2nn[n-]n2)cc1F ZINC000737639849 598553349 /nfs/dbraw/zinc/55/33/49/598553349.db2.gz UGFMIKRBOJILIE-UHFFFAOYSA-N -1 3 355.270 3.776 20 0 FHADHM CSC[C@@H](C)C(=O)Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1 ZINC000737178857 598553727 /nfs/dbraw/zinc/55/37/27/598553727.db2.gz FNHXGFMVZMGLMR-SNVBAGLBSA-N -1 3 359.480 3.533 20 0 FHADHM CSC[C@@H](C)C(=O)Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1 ZINC000737178857 598553728 /nfs/dbraw/zinc/55/37/28/598553728.db2.gz FNHXGFMVZMGLMR-SNVBAGLBSA-N -1 3 359.480 3.533 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(Oc3cccc(-c4nnn[n-]4)c3)cc2)cn1 ZINC000737316167 598555309 /nfs/dbraw/zinc/55/53/09/598555309.db2.gz UWGNDXNAPVFMQG-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(Oc3cccc(-c4nn[n-]n4)c3)cc2)cn1 ZINC000737316167 598555311 /nfs/dbraw/zinc/55/53/11/598555311.db2.gz UWGNDXNAPVFMQG-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM CCN(C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1)C(C)C ZINC000736506038 598565078 /nfs/dbraw/zinc/56/50/78/598565078.db2.gz OYUBOCZOUPNGES-UHFFFAOYSA-N -1 3 366.425 3.921 20 0 FHADHM CCN(C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1)C(C)C ZINC000736506038 598565080 /nfs/dbraw/zinc/56/50/80/598565080.db2.gz OYUBOCZOUPNGES-UHFFFAOYSA-N -1 3 366.425 3.921 20 0 FHADHM O=C(Cc1ccc(-c2nnn[n-]2)cc1)O[C@@H](c1ccccc1)C1CCCC1 ZINC000737955979 598585375 /nfs/dbraw/zinc/58/53/75/598585375.db2.gz QRVOIXCXBQZGQA-FQEVSTJZSA-N -1 3 362.433 3.884 20 0 FHADHM O=C(Cc1ccc(-c2nn[n-]n2)cc1)O[C@@H](c1ccccc1)C1CCCC1 ZINC000737955979 598585376 /nfs/dbraw/zinc/58/53/76/598585376.db2.gz QRVOIXCXBQZGQA-FQEVSTJZSA-N -1 3 362.433 3.884 20 0 FHADHM Cc1c(C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)sc2cccc(F)c12 ZINC000737209119 598589189 /nfs/dbraw/zinc/58/91/89/598589189.db2.gz KQJIVVMZNGZCKZ-UHFFFAOYSA-N -1 3 371.372 3.920 20 0 FHADHM Cc1c(C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)sc2cccc(F)c12 ZINC000737209119 598589190 /nfs/dbraw/zinc/58/91/90/598589190.db2.gz KQJIVVMZNGZCKZ-UHFFFAOYSA-N -1 3 371.372 3.920 20 0 FHADHM Fc1ccc(CNc2ccc(F)c(-c3nnn[n-]3)c2)c(Br)c1 ZINC000737649427 598603473 /nfs/dbraw/zinc/60/34/73/598603473.db2.gz OCPMYDDMBFJOCY-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1ccc(CNc2ccc(F)c(-c3nn[n-]n3)c2)c(Br)c1 ZINC000737649427 598603474 /nfs/dbraw/zinc/60/34/74/598603474.db2.gz OCPMYDDMBFJOCY-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Clc1cccc(-c2noc(CSc3ccc(-c4nnn[n-]4)cc3)n2)c1 ZINC000737576100 598609107 /nfs/dbraw/zinc/60/91/07/598609107.db2.gz UXLUQEFBXJLPRK-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1cccc(-c2noc(CSc3ccc(-c4nn[n-]n4)cc3)n2)c1 ZINC000737576100 598609109 /nfs/dbraw/zinc/60/91/09/598609109.db2.gz UXLUQEFBXJLPRK-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccccc1Cl ZINC000736115893 598623703 /nfs/dbraw/zinc/62/37/03/598623703.db2.gz KULKKCQPBKDEEY-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccccc1Cl ZINC000736115893 598623704 /nfs/dbraw/zinc/62/37/04/598623704.db2.gz KULKKCQPBKDEEY-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM FC(F)Oc1ccc(CNc2cc(Cl)ccc2-c2nnn[n-]2)cc1 ZINC000737639048 598630567 /nfs/dbraw/zinc/63/05/67/598630567.db2.gz LRRNFSBFDMQKKH-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM FC(F)Oc1ccc(CNc2cc(Cl)ccc2-c2nn[n-]n2)cc1 ZINC000737639048 598630568 /nfs/dbraw/zinc/63/05/68/598630568.db2.gz LRRNFSBFDMQKKH-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM CCCCN(CC)C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736457397 598650267 /nfs/dbraw/zinc/65/02/67/598650267.db2.gz TYDHPBYNSRUUJH-UHFFFAOYSA-N -1 3 365.437 3.921 20 0 FHADHM CCCCN(CC)C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736457397 598650269 /nfs/dbraw/zinc/65/02/69/598650269.db2.gz TYDHPBYNSRUUJH-UHFFFAOYSA-N -1 3 365.437 3.921 20 0 FHADHM CCC(CC)N(C(=O)CCCCOc1cccc(-c2nnn[n-]2)c1)C1CC1 ZINC000736344564 598652642 /nfs/dbraw/zinc/65/26/42/598652642.db2.gz AUPFBNUPNIIYEV-UHFFFAOYSA-N -1 3 371.485 3.595 20 0 FHADHM CCC(CC)N(C(=O)CCCCOc1cccc(-c2nn[n-]n2)c1)C1CC1 ZINC000736344564 598652644 /nfs/dbraw/zinc/65/26/44/598652644.db2.gz AUPFBNUPNIIYEV-UHFFFAOYSA-N -1 3 371.485 3.595 20 0 FHADHM O=C(CSc1ccc(-c2nnn[n-]2)cc1)N(CC1CCCCC1)C1CC1 ZINC000737944195 598656327 /nfs/dbraw/zinc/65/63/27/598656327.db2.gz WZERFMTYHPQVMB-UHFFFAOYSA-N -1 3 371.510 3.530 20 0 FHADHM O=C(CSc1ccc(-c2nn[n-]n2)cc1)N(CC1CCCCC1)C1CC1 ZINC000737944195 598656329 /nfs/dbraw/zinc/65/63/29/598656329.db2.gz WZERFMTYHPQVMB-UHFFFAOYSA-N -1 3 371.510 3.530 20 0 FHADHM CCCCOc1ncccc1CNc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736464415 598657625 /nfs/dbraw/zinc/65/76/25/598657625.db2.gz ZFHUMXLENOXFPN-UHFFFAOYSA-N -1 3 358.833 3.706 20 0 FHADHM CCCCOc1ncccc1CNc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736464415 598657626 /nfs/dbraw/zinc/65/76/26/598657626.db2.gz ZFHUMXLENOXFPN-UHFFFAOYSA-N -1 3 358.833 3.706 20 0 FHADHM CC(C)[C@H](CC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccccc1 ZINC000735708669 598660037 /nfs/dbraw/zinc/66/00/37/598660037.db2.gz NGYLQSBUHYDUKH-HNNXBMFYSA-N -1 3 353.401 3.774 20 0 FHADHM CC(C)[C@H](CC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccccc1 ZINC000735708669 598660038 /nfs/dbraw/zinc/66/00/38/598660038.db2.gz NGYLQSBUHYDUKH-HNNXBMFYSA-N -1 3 353.401 3.774 20 0 FHADHM Cc1ccc2c(Cl)c(C(=O)Nc3ccc(-c4nnn[n-]4)cn3)sc2c1 ZINC000737371729 598662887 /nfs/dbraw/zinc/66/28/87/598662887.db2.gz KDQCBEKAPGUDBA-UHFFFAOYSA-N -1 3 370.825 3.691 20 0 FHADHM Cc1ccc2c(Cl)c(C(=O)Nc3ccc(-c4nn[n-]n4)cn3)sc2c1 ZINC000737371729 598662889 /nfs/dbraw/zinc/66/28/89/598662889.db2.gz KDQCBEKAPGUDBA-UHFFFAOYSA-N -1 3 370.825 3.691 20 0 FHADHM C[C@H](NCc1csc(-c2cccs2)n1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736132856 598697133 /nfs/dbraw/zinc/69/71/33/598697133.db2.gz XZZDQVDYHOGEOV-NSHDSACASA-N -1 3 368.491 3.903 20 0 FHADHM C[C@@H](NCc1csc(-c2cccs2)n1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736132853 598697478 /nfs/dbraw/zinc/69/74/78/598697478.db2.gz XZZDQVDYHOGEOV-LLVKDONJSA-N -1 3 368.491 3.903 20 0 FHADHM O=C(CCc1ccc(-c2nnn[n-]2)cc1)Nc1ccnc(-c2ccccc2)c1 ZINC000737854763 598697820 /nfs/dbraw/zinc/69/78/20/598697820.db2.gz VZGGSITVORAEDZ-UHFFFAOYSA-N -1 3 370.416 3.500 20 0 FHADHM O=C(CCc1ccc(-c2nn[n-]n2)cc1)Nc1ccnc(-c2ccccc2)c1 ZINC000737854763 598697821 /nfs/dbraw/zinc/69/78/21/598697821.db2.gz VZGGSITVORAEDZ-UHFFFAOYSA-N -1 3 370.416 3.500 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nnn[n-]1)C1(c2ccccc2)CCCC1 ZINC000738232181 598705513 /nfs/dbraw/zinc/70/55/13/598705513.db2.gz QFQWKUZQOLORPZ-UHFFFAOYSA-N -1 3 366.396 3.561 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nn[n-]n1)C1(c2ccccc2)CCCC1 ZINC000738232181 598705515 /nfs/dbraw/zinc/70/55/15/598705515.db2.gz QFQWKUZQOLORPZ-UHFFFAOYSA-N -1 3 366.396 3.561 20 0 FHADHM CCN(C(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(C)C)C1CCCCC1 ZINC000736506063 598729076 /nfs/dbraw/zinc/72/90/76/598729076.db2.gz PSDFPHLTPUQZRZ-UHFFFAOYSA-N -1 3 372.473 3.840 20 0 FHADHM CCN(C(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(C)C)C1CCCCC1 ZINC000736506063 598729077 /nfs/dbraw/zinc/72/90/77/598729077.db2.gz PSDFPHLTPUQZRZ-UHFFFAOYSA-N -1 3 372.473 3.840 20 0 FHADHM Cc1cc(C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)CC(C)C)ccc1F ZINC000737233398 598736792 /nfs/dbraw/zinc/73/67/92/598736792.db2.gz FEWIHOGGBPQRHJ-UHFFFAOYSA-N -1 3 367.428 3.613 20 0 FHADHM Cc1cc(C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)CC(C)C)ccc1F ZINC000737233398 598736793 /nfs/dbraw/zinc/73/67/93/598736793.db2.gz FEWIHOGGBPQRHJ-UHFFFAOYSA-N -1 3 367.428 3.613 20 0 FHADHM O=C(C[C@@H]1CCc2ccccc2C1)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000737821015 598742296 /nfs/dbraw/zinc/74/22/96/598742296.db2.gz UIEHDNKTTAPUCE-GFCCVEGCSA-N -1 3 367.840 3.654 20 0 FHADHM O=C(C[C@@H]1CCc2ccccc2C1)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000737821015 598742297 /nfs/dbraw/zinc/74/22/97/598742297.db2.gz UIEHDNKTTAPUCE-GFCCVEGCSA-N -1 3 367.840 3.654 20 0 FHADHM C[C@H](SC1CCCC1)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736190526 598762892 /nfs/dbraw/zinc/76/28/92/598762892.db2.gz SZBAPNBUWZJMFG-VIFPVBQESA-N -1 3 351.863 3.523 20 0 FHADHM C[C@H](SC1CCCC1)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736190526 598762893 /nfs/dbraw/zinc/76/28/93/598762893.db2.gz SZBAPNBUWZJMFG-VIFPVBQESA-N -1 3 351.863 3.523 20 0 FHADHM CCSc1ccc([C@@H](C)NC(=O)Nc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000736665912 598769181 /nfs/dbraw/zinc/76/91/81/598769181.db2.gz JHXGSBDPLVTOOP-GFCCVEGCSA-N -1 3 368.466 3.861 20 0 FHADHM CCSc1ccc([C@@H](C)NC(=O)Nc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000736665912 598769183 /nfs/dbraw/zinc/76/91/83/598769183.db2.gz JHXGSBDPLVTOOP-GFCCVEGCSA-N -1 3 368.466 3.861 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1N[C@@H](C)c1ccc(Br)cc1 ZINC000737062401 598776765 /nfs/dbraw/zinc/77/67/65/598776765.db2.gz KLPCMXLDMVMYDZ-JTQLQIEISA-N -1 3 374.242 3.811 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1N[C@@H](C)c1ccc(Br)cc1 ZINC000737062401 598776767 /nfs/dbraw/zinc/77/67/67/598776767.db2.gz KLPCMXLDMVMYDZ-JTQLQIEISA-N -1 3 374.242 3.811 20 0 FHADHM CC[C@@H](CC(=O)OCc1ccc(-c2nnn[n-]2)cc1F)c1ccccc1 ZINC000736334058 598780872 /nfs/dbraw/zinc/78/08/72/598780872.db2.gz DXTPATCSNAVWKF-ZDUSSCGKSA-N -1 3 354.385 3.633 20 0 FHADHM CC[C@@H](CC(=O)OCc1ccc(-c2nn[n-]n2)cc1F)c1ccccc1 ZINC000736334058 598780873 /nfs/dbraw/zinc/78/08/73/598780873.db2.gz DXTPATCSNAVWKF-ZDUSSCGKSA-N -1 3 354.385 3.633 20 0 FHADHM CCN(C(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)cc1)C(C)C ZINC000736505065 598782011 /nfs/dbraw/zinc/78/20/11/598782011.db2.gz GKBCADRHVFISEF-UHFFFAOYSA-N -1 3 366.425 3.921 20 0 FHADHM CCN(C(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)cc1)C(C)C ZINC000736505065 598782012 /nfs/dbraw/zinc/78/20/12/598782012.db2.gz GKBCADRHVFISEF-UHFFFAOYSA-N -1 3 366.425 3.921 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N[C@@H](c1ccccc1C)C1CC1 ZINC000737290165 598782799 /nfs/dbraw/zinc/78/27/99/598782799.db2.gz CJQKQBLUOCWDTK-GOSISDBHSA-N -1 3 362.437 3.756 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N[C@@H](c1ccccc1C)C1CC1 ZINC000737290165 598782800 /nfs/dbraw/zinc/78/28/00/598782800.db2.gz CJQKQBLUOCWDTK-GOSISDBHSA-N -1 3 362.437 3.756 20 0 FHADHM CC(C)CN(C(=O)[C@H]1CCc2ccccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000735819554 598790149 /nfs/dbraw/zinc/79/01/49/598790149.db2.gz XUZVXRRVCKVYEP-IBGZPJMESA-N -1 3 361.449 3.586 20 0 FHADHM CC(C)CN(C(=O)[C@H]1CCc2ccccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000735819554 598790151 /nfs/dbraw/zinc/79/01/51/598790151.db2.gz XUZVXRRVCKVYEP-IBGZPJMESA-N -1 3 361.449 3.586 20 0 FHADHM CC(C)[C@@H](c1ccccc1)N(C)C(=O)C=Cc1ccccc1-c1nnn[n-]1 ZINC000735736378 598791080 /nfs/dbraw/zinc/79/10/80/598791080.db2.gz UBCGIWIUHCNZTL-AIGDTVQASA-N -1 3 361.449 3.736 20 0 FHADHM CC(C)[C@@H](c1ccccc1)N(C)C(=O)C=Cc1ccccc1-c1nn[n-]n1 ZINC000735736378 598791082 /nfs/dbraw/zinc/79/10/82/598791082.db2.gz UBCGIWIUHCNZTL-AIGDTVQASA-N -1 3 361.449 3.736 20 0 FHADHM Fc1ccc([C@H]2CCCN2Cc2ccc(-c3nnn[n-]3)cc2F)cc1F ZINC000737648682 598797564 /nfs/dbraw/zinc/79/75/64/598797564.db2.gz IPQVBHGTUDVRKA-QGZVFWFLSA-N -1 3 359.355 3.621 20 0 FHADHM Fc1ccc([C@H]2CCCN2Cc2ccc(-c3nn[n-]n3)cc2F)cc1F ZINC000737648682 598797565 /nfs/dbraw/zinc/79/75/65/598797565.db2.gz IPQVBHGTUDVRKA-QGZVFWFLSA-N -1 3 359.355 3.621 20 0 FHADHM COc1ccc2[nH]cc(CCNc3ccc(-c4nnn[n-]4)c(Cl)c3)c2c1 ZINC000737116569 598817896 /nfs/dbraw/zinc/81/78/96/598817896.db2.gz UJHZPFQTDWSUEN-UHFFFAOYSA-N -1 3 368.828 3.665 20 0 FHADHM COc1ccc2[nH]cc(CCNc3ccc(-c4nn[n-]n4)c(Cl)c3)c2c1 ZINC000737116569 598817897 /nfs/dbraw/zinc/81/78/97/598817897.db2.gz UJHZPFQTDWSUEN-UHFFFAOYSA-N -1 3 368.828 3.665 20 0 FHADHM CCOc1cc(C(=O)Nc2sc(C)c(CC)c2-c2nnn[n-]2)ccc1C ZINC000736628876 598822659 /nfs/dbraw/zinc/82/26/59/598822659.db2.gz YNEQCSNJIFUCRD-UHFFFAOYSA-N -1 3 371.466 3.758 20 0 FHADHM CCOc1cc(C(=O)Nc2sc(C)c(CC)c2-c2nn[n-]n2)ccc1C ZINC000736628876 598822660 /nfs/dbraw/zinc/82/26/60/598822660.db2.gz YNEQCSNJIFUCRD-UHFFFAOYSA-N -1 3 371.466 3.758 20 0 FHADHM CSc1ccc(Cl)c(C(=O)N(C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737191593 599308503 /nfs/dbraw/zinc/30/85/03/599308503.db2.gz SHKALPQRFPIWDN-UHFFFAOYSA-N -1 3 359.842 3.519 20 0 FHADHM CSc1ccc(Cl)c(C(=O)N(C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737191593 599308506 /nfs/dbraw/zinc/30/85/06/599308506.db2.gz SHKALPQRFPIWDN-UHFFFAOYSA-N -1 3 359.842 3.519 20 0 FHADHM CC(=O)c1ccccc1OCCS[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000735505677 599324750 /nfs/dbraw/zinc/32/47/50/599324750.db2.gz UVBTYCRHZXCWOD-CQSZACIVSA-N -1 3 368.462 3.943 20 0 FHADHM CC(=O)c1ccccc1OCCS[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000735505677 599324754 /nfs/dbraw/zinc/32/47/54/599324754.db2.gz UVBTYCRHZXCWOD-CQSZACIVSA-N -1 3 368.462 3.943 20 0 FHADHM C[C@@H](SCc1noc(-c2ccsc2)n1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736192818 599325810 /nfs/dbraw/zinc/32/58/10/599325810.db2.gz MNIICCFPRKOODL-SNVBAGLBSA-N -1 3 370.463 3.973 20 0 FHADHM C[C@@H](SCc1noc(-c2ccsc2)n1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736192818 599325812 /nfs/dbraw/zinc/32/58/12/599325812.db2.gz MNIICCFPRKOODL-SNVBAGLBSA-N -1 3 370.463 3.973 20 0 FHADHM C[C@@H](S[C@@H](C)C(=O)NC1CCC(C)CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736243691 599328317 /nfs/dbraw/zinc/32/83/17/599328317.db2.gz YHMVRTKBMOZGST-DLOXAQCQSA-N -1 3 373.526 3.744 20 0 FHADHM C[C@@H](S[C@@H](C)C(=O)NC1CCC(C)CC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736243691 599328319 /nfs/dbraw/zinc/32/83/19/599328319.db2.gz YHMVRTKBMOZGST-DLOXAQCQSA-N -1 3 373.526 3.744 20 0 FHADHM C[C@@H](S[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)C(=O)NC1CCC(C)CC1 ZINC000736243692 599328405 /nfs/dbraw/zinc/32/84/05/599328405.db2.gz YHMVRTKBMOZGST-YRTQGLMCSA-N -1 3 373.526 3.744 20 0 FHADHM C[C@@H](S[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)C(=O)NC1CCC(C)CC1 ZINC000736243692 599328406 /nfs/dbraw/zinc/32/84/06/599328406.db2.gz YHMVRTKBMOZGST-YRTQGLMCSA-N -1 3 373.526 3.744 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NCc1cc(Cl)ccc1Cl ZINC000737062837 599328461 /nfs/dbraw/zinc/32/84/61/599328461.db2.gz QOAHGNCBILYBBS-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NCc1cc(Cl)ccc1Cl ZINC000737062837 599328462 /nfs/dbraw/zinc/32/84/62/599328462.db2.gz QOAHGNCBILYBBS-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM Cc1ccccc1NC(=O)[C@H](C)S[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000737433728 599329175 /nfs/dbraw/zinc/32/91/75/599329175.db2.gz BSEWRRKWFWQQMJ-KGLIPLIRSA-N -1 3 367.478 3.997 20 0 FHADHM Cc1ccccc1NC(=O)[C@H](C)S[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000737433728 599329177 /nfs/dbraw/zinc/32/91/77/599329177.db2.gz BSEWRRKWFWQQMJ-KGLIPLIRSA-N -1 3 367.478 3.997 20 0 FHADHM Cc1cc(Cl)ccc1NC(=O)[C@@H](C)Sc1ccccc1-c1nnn[n-]1 ZINC000822201973 599347686 /nfs/dbraw/zinc/34/76/86/599347686.db2.gz DXAARMWHLAXRST-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM Cc1cc(Cl)ccc1NC(=O)[C@@H](C)Sc1ccccc1-c1nn[n-]n1 ZINC000822201973 599347689 /nfs/dbraw/zinc/34/76/89/599347689.db2.gz DXAARMWHLAXRST-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM CCc1ccc2c(CSc3ccccc3-c3nnn[n-]3)cc(=O)oc2c1 ZINC000821487471 599349883 /nfs/dbraw/zinc/34/98/83/599349883.db2.gz UPWOHEATPCKFSO-UHFFFAOYSA-N -1 3 364.430 3.828 20 0 FHADHM CCc1ccc2c(CSc3ccccc3-c3nn[n-]n3)cc(=O)oc2c1 ZINC000821487471 599349885 /nfs/dbraw/zinc/34/98/85/599349885.db2.gz UPWOHEATPCKFSO-UHFFFAOYSA-N -1 3 364.430 3.828 20 0 FHADHM COC(=O)[C@@H](Sc1ccccc1-c1nnn[n-]1)c1cccc(Cl)c1 ZINC000821650038 599349889 /nfs/dbraw/zinc/34/98/89/599349889.db2.gz ITYWXEFJQJBQIP-AWEZNQCLSA-N -1 3 360.826 3.527 20 0 FHADHM COC(=O)[C@@H](Sc1ccccc1-c1nn[n-]n1)c1cccc(Cl)c1 ZINC000821650038 599349890 /nfs/dbraw/zinc/34/98/90/599349890.db2.gz ITYWXEFJQJBQIP-AWEZNQCLSA-N -1 3 360.826 3.527 20 0 FHADHM C[C@@H](Nc1c(F)cc(-c2nnn[n-]2)cc1F)c1ccc(-n2cccn2)cc1 ZINC000820449735 599357253 /nfs/dbraw/zinc/35/72/53/599357253.db2.gz BJSHCUUELCLQOT-LLVKDONJSA-N -1 3 367.363 3.504 20 0 FHADHM C[C@@H](Nc1c(F)cc(-c2nn[n-]n2)cc1F)c1ccc(-n2cccn2)cc1 ZINC000820449735 599357256 /nfs/dbraw/zinc/35/72/56/599357256.db2.gz BJSHCUUELCLQOT-LLVKDONJSA-N -1 3 367.363 3.504 20 0 FHADHM C[C@H](NCc1csc(-c2ccsc2)n1)c1cccc(-c2nn[n-]n2)c1 ZINC000820437684 599392871 /nfs/dbraw/zinc/39/28/71/599392871.db2.gz BFSUCOBMVCKOPT-NSHDSACASA-N -1 3 368.491 3.903 20 0 FHADHM COc1ccc(Cl)cc1CNc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000737099645 599412059 /nfs/dbraw/zinc/41/20/59/599412059.db2.gz MDCWFONNZLROSQ-UHFFFAOYSA-N -1 3 366.812 3.689 20 0 FHADHM COc1ccc(Cl)cc1CNc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000737099645 599412062 /nfs/dbraw/zinc/41/20/62/599412062.db2.gz MDCWFONNZLROSQ-UHFFFAOYSA-N -1 3 366.812 3.689 20 0 FHADHM Fc1ccc(C(NCc2ccc(-c3nn[n-]n3)o2)c2ccc(F)cc2)cc1 ZINC000822767045 599415791 /nfs/dbraw/zinc/41/57/91/599415791.db2.gz UNGZWHRZXDGMHW-UHFFFAOYSA-N -1 3 367.359 3.617 20 0 FHADHM c1ccc([C@H](Nc2cc(-c3nnn[n-]3)c3ccccc3n2)[C@H]2CCCO2)cc1 ZINC000738426572 599426002 /nfs/dbraw/zinc/42/60/02/599426002.db2.gz FLNTUFWLTJBVJV-QUCCMNQESA-N -1 3 372.432 3.747 20 0 FHADHM c1ccc([C@H](Nc2cc(-c3nn[n-]n3)c3ccccc3n2)[C@H]2CCCO2)cc1 ZINC000738426572 599426005 /nfs/dbraw/zinc/42/60/05/599426005.db2.gz FLNTUFWLTJBVJV-QUCCMNQESA-N -1 3 372.432 3.747 20 0 FHADHM Cc1ccc(CSc2nc(C)cc(C(F)(F)F)c2-c2nnn[n-]2)nc1 ZINC000822239907 607377810 /nfs/dbraw/zinc/37/78/10/607377810.db2.gz JZWPNLZQVUGFNQ-UHFFFAOYSA-N -1 3 366.372 3.585 20 0 FHADHM C[C@@H](NC(=O)N[C@@H](C)CCC1CCCCC1)c1cccc(-c2nnn[n-]2)c1 ZINC000820243015 599441317 /nfs/dbraw/zinc/44/13/17/599441317.db2.gz SXIMFZDKQAYCEF-LSDHHAIUSA-N -1 3 370.501 3.976 20 0 FHADHM C[C@@H](NC(=O)N[C@@H](C)CCC1CCCCC1)c1cccc(-c2nn[n-]n2)c1 ZINC000820243015 599441319 /nfs/dbraw/zinc/44/13/19/599441319.db2.gz SXIMFZDKQAYCEF-LSDHHAIUSA-N -1 3 370.501 3.976 20 0 FHADHM C[C@@H](NC(=O)Nc1cccc(-c2nnn[n-]2)c1)c1ccc(F)cc1Cl ZINC000736119311 599451478 /nfs/dbraw/zinc/45/14/78/599451478.db2.gz XJXVSKNEKZFHBY-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM C[C@@H](NC(=O)Nc1cccc(-c2nn[n-]n2)c1)c1ccc(F)cc1Cl ZINC000736119311 599451481 /nfs/dbraw/zinc/45/14/81/599451481.db2.gz XJXVSKNEKZFHBY-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM Fc1ccc(-c2ccc(CNCc3cc(-c4nn[n-]n4)ccc3F)o2)cc1 ZINC000822753034 599456896 /nfs/dbraw/zinc/45/68/96/599456896.db2.gz ADCDLCNHRHFRAO-UHFFFAOYSA-N -1 3 367.359 3.695 20 0 FHADHM c1ccc(-c2ccc(-c3nnn[n-]3)c(SCCc3cccnc3)n2)cc1 ZINC000738422434 599465165 /nfs/dbraw/zinc/46/51/65/599465165.db2.gz YYUBVIFTWXFZFB-UHFFFAOYSA-N -1 3 360.446 3.659 20 0 FHADHM c1ccc(-c2ccc(-c3nn[n-]n3)c(SCCc3cccnc3)n2)cc1 ZINC000738422434 599465166 /nfs/dbraw/zinc/46/51/66/599465166.db2.gz YYUBVIFTWXFZFB-UHFFFAOYSA-N -1 3 360.446 3.659 20 0 FHADHM C[C@H](Nc1ccc(F)cc1-c1nnn[n-]1)c1cccc(Br)c1 ZINC000820455454 599468718 /nfs/dbraw/zinc/46/87/18/599468718.db2.gz IQAIYOIBRYTYOH-VIFPVBQESA-N -1 3 362.206 3.941 20 0 FHADHM C[C@H](Nc1ccc(F)cc1-c1nn[n-]n1)c1cccc(Br)c1 ZINC000820455454 599468721 /nfs/dbraw/zinc/46/87/21/599468721.db2.gz IQAIYOIBRYTYOH-VIFPVBQESA-N -1 3 362.206 3.941 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)N1CCCCC[C@H]1c1ccco1 ZINC000737801809 599468784 /nfs/dbraw/zinc/46/87/84/599468784.db2.gz UPJAOQKIPIFFAA-FLVLSHQESA-N -1 3 363.421 3.617 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)N1CCCCC[C@H]1c1ccco1 ZINC000737801809 599468787 /nfs/dbraw/zinc/46/87/87/599468787.db2.gz UPJAOQKIPIFFAA-FLVLSHQESA-N -1 3 363.421 3.617 20 0 FHADHM Fc1ccc(NCc2ccc(OCC(F)(F)F)cc2)c(-c2nnn[n-]2)c1 ZINC000822782870 599469977 /nfs/dbraw/zinc/46/99/77/599469977.db2.gz KGLNIBFIGRXIOZ-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM Fc1ccc(NCc2ccc(OCC(F)(F)F)cc2)c(-c2nn[n-]n2)c1 ZINC000822782870 599469979 /nfs/dbraw/zinc/46/99/79/599469979.db2.gz KGLNIBFIGRXIOZ-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N[C@H](Cc2ccccc2)C2CC2)n1 ZINC000737631557 599473223 /nfs/dbraw/zinc/47/32/23/599473223.db2.gz GMBZHYQPCYLJHD-CQSZACIVSA-N -1 3 374.370 3.714 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N[C@H](Cc2ccccc2)C2CC2)n1 ZINC000737631557 599473225 /nfs/dbraw/zinc/47/32/25/599473225.db2.gz GMBZHYQPCYLJHD-CQSZACIVSA-N -1 3 374.370 3.714 20 0 FHADHM Cc1cccc([C@@H](C)NC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1C ZINC000822288546 599482300 /nfs/dbraw/zinc/48/23/00/599482300.db2.gz BBTPYLVFQAFKHI-HUUCEWRRSA-N -1 3 364.453 3.605 20 0 FHADHM Cc1cccc([C@@H](C)NC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1C ZINC000822288546 599482302 /nfs/dbraw/zinc/48/23/02/599482302.db2.gz BBTPYLVFQAFKHI-HUUCEWRRSA-N -1 3 364.453 3.605 20 0 FHADHM Cc1cccc(N[C@H](C)C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c1C ZINC000737398592 599504399 /nfs/dbraw/zinc/50/43/99/599504399.db2.gz CFOVIMOEDVWYFT-GFCCVEGCSA-N -1 3 370.844 3.576 20 0 FHADHM Cc1cccc(N[C@H](C)C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c1C ZINC000737398592 599504402 /nfs/dbraw/zinc/50/44/02/599504402.db2.gz CFOVIMOEDVWYFT-GFCCVEGCSA-N -1 3 370.844 3.576 20 0 FHADHM Cc1csc([C@@H]2CCCN(c3c(Cl)cccc3-c3nnn[n-]3)C2)n1 ZINC000822409121 599509404 /nfs/dbraw/zinc/50/94/04/599509404.db2.gz MLZVQQJSRAVOIO-LLVKDONJSA-N -1 3 360.874 3.669 20 0 FHADHM Cc1csc([C@@H]2CCCN(c3c(Cl)cccc3-c3nn[n-]n3)C2)n1 ZINC000822409121 599509405 /nfs/dbraw/zinc/50/94/05/599509405.db2.gz MLZVQQJSRAVOIO-LLVKDONJSA-N -1 3 360.874 3.669 20 0 FHADHM C[C@@H](NC(=O)C[C@H]1C[C@@H](C)CC(C)(C)C1)c1cccc(-c2nnn[n-]2)c1 ZINC000820655260 599514942 /nfs/dbraw/zinc/51/49/42/599514942.db2.gz ALHHGIMDOQEYAO-RBSFLKMASA-N -1 3 355.486 3.896 20 0 FHADHM C[C@@H](NC(=O)C[C@H]1C[C@@H](C)CC(C)(C)C1)c1cccc(-c2nn[n-]n2)c1 ZINC000820655260 599514943 /nfs/dbraw/zinc/51/49/43/599514943.db2.gz ALHHGIMDOQEYAO-RBSFLKMASA-N -1 3 355.486 3.896 20 0 FHADHM CC(=CC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1Cl ZINC000819764148 599520401 /nfs/dbraw/zinc/52/04/01/599520401.db2.gz FWKCPFCTARKSIX-XSNHNAGMSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=CC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1Cl ZINC000819764148 599520403 /nfs/dbraw/zinc/52/04/03/599520403.db2.gz FWKCPFCTARKSIX-XSNHNAGMSA-N -1 3 367.840 3.801 20 0 FHADHM C[C@H](NC(=O)c1ccc(Cl)c(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820397817 599526031 /nfs/dbraw/zinc/52/60/31/599526031.db2.gz UUXPQWCSLNVQRE-VIFPVBQESA-N -1 3 362.220 3.665 20 0 FHADHM C[C@H](NC(=O)c1ccc(Cl)c(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820397817 599526033 /nfs/dbraw/zinc/52/60/33/599526033.db2.gz UUXPQWCSLNVQRE-VIFPVBQESA-N -1 3 362.220 3.665 20 0 FHADHM CCSCc1ccc(C(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000821461138 599537081 /nfs/dbraw/zinc/53/70/81/599537081.db2.gz KGXUNNWXYCPUJK-CYBMUJFWSA-N -1 3 367.478 3.611 20 0 FHADHM CCSCc1ccc(C(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000821461138 599537083 /nfs/dbraw/zinc/53/70/83/599537083.db2.gz KGXUNNWXYCPUJK-CYBMUJFWSA-N -1 3 367.478 3.611 20 0 FHADHM COc1cc(Cl)ccc1CNc1c(Cl)cccc1-c1nnn[n-]1 ZINC000821719377 599544340 /nfs/dbraw/zinc/54/43/40/599544340.db2.gz CWZVXPYRPOGHCQ-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM COc1cc(Cl)ccc1CNc1c(Cl)cccc1-c1nn[n-]n1 ZINC000821719377 599544343 /nfs/dbraw/zinc/54/43/43/599544343.db2.gz CWZVXPYRPOGHCQ-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM CCc1ccc([C@@H](C)CC(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)cc1 ZINC000736692162 599545042 /nfs/dbraw/zinc/54/50/42/599545042.db2.gz ZOBWRXSATOVNTQ-LBPRGKRZSA-N -1 3 353.401 3.701 20 0 FHADHM CCc1ccc([C@@H](C)CC(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)cc1 ZINC000736692162 599545045 /nfs/dbraw/zinc/54/50/45/599545045.db2.gz ZOBWRXSATOVNTQ-LBPRGKRZSA-N -1 3 353.401 3.701 20 0 FHADHM CCc1ccc([C@@H](C)CC(=O)Nc2cc(-c3nnn[n-]3)ccc2OC)cc1 ZINC000736685555 599545243 /nfs/dbraw/zinc/54/52/43/599545243.db2.gz GHQZKXRAAWLMRE-ZDUSSCGKSA-N -1 3 365.437 3.570 20 0 FHADHM CCc1ccc([C@@H](C)CC(=O)Nc2cc(-c3nn[n-]n3)ccc2OC)cc1 ZINC000736685555 599545246 /nfs/dbraw/zinc/54/52/46/599545246.db2.gz GHQZKXRAAWLMRE-ZDUSSCGKSA-N -1 3 365.437 3.570 20 0 FHADHM Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)C=Cc2ccccc2-c2nnn[n-]2)C1 ZINC000737424416 599549042 /nfs/dbraw/zinc/54/90/42/599549042.db2.gz YDNKULVHMMUJDN-XBOKISCZSA-N -1 3 373.460 3.593 20 0 FHADHM Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)C=Cc2ccccc2-c2nn[n-]n2)C1 ZINC000737424416 599549044 /nfs/dbraw/zinc/54/90/44/599549044.db2.gz YDNKULVHMMUJDN-XBOKISCZSA-N -1 3 373.460 3.593 20 0 FHADHM Cc1ccc([C@H]2C[C@@H](C)CCN2C(=O)Nc2cccc(-c3nnn[n-]3)c2)o1 ZINC000822233703 599556088 /nfs/dbraw/zinc/55/60/88/599556088.db2.gz TWHBFVZWFDPCIG-BLLLJJGKSA-N -1 3 366.425 3.773 20 0 FHADHM Cc1ccc([C@H]2C[C@@H](C)CCN2C(=O)Nc2cccc(-c3nn[n-]n3)c2)o1 ZINC000822233703 599556089 /nfs/dbraw/zinc/55/60/89/599556089.db2.gz TWHBFVZWFDPCIG-BLLLJJGKSA-N -1 3 366.425 3.773 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)Nc1cccc(Oc2ccccn2)c1 ZINC000823308985 599556361 /nfs/dbraw/zinc/55/63/61/599556361.db2.gz ONNJQFAAAZLGPD-UHFFFAOYSA-N -1 3 373.376 3.698 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)Nc1cccc(Oc2ccccn2)c1 ZINC000823308985 599556362 /nfs/dbraw/zinc/55/63/62/599556362.db2.gz ONNJQFAAAZLGPD-UHFFFAOYSA-N -1 3 373.376 3.698 20 0 FHADHM Cc1cc(NC(=O)C=Cc2ccccc2-c2nnn[n-]2)ccc1C(F)(F)F ZINC000822207004 599558477 /nfs/dbraw/zinc/55/84/77/599558477.db2.gz HTWNPUUHJBURLN-RMKNXTFCSA-N -1 3 373.338 3.846 20 0 FHADHM Cc1cc(NC(=O)C=Cc2ccccc2-c2nn[n-]n2)ccc1C(F)(F)F ZINC000822207004 599558480 /nfs/dbraw/zinc/55/84/80/599558480.db2.gz HTWNPUUHJBURLN-RMKNXTFCSA-N -1 3 373.338 3.846 20 0 FHADHM O=C(c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1)N1CCCCCC1 ZINC000738274680 599563620 /nfs/dbraw/zinc/56/36/20/599563620.db2.gz VPIOTTQQVQBESO-UHFFFAOYSA-N -1 3 362.437 3.627 20 0 FHADHM O=C(NC[C@@H]1CC=CCC1)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000738046680 599568375 /nfs/dbraw/zinc/56/83/75/599568375.db2.gz VXBPQDWOUHFQSW-OAHLLOKOSA-N -1 3 374.448 3.696 20 0 FHADHM Clc1ccc(NCc2coc(-c3ccccc3)n2)c(-c2nnn[n-]2)c1 ZINC000822578596 599586150 /nfs/dbraw/zinc/58/61/50/599586150.db2.gz LJGHPPCDRCTHIF-UHFFFAOYSA-N -1 3 352.785 3.787 20 0 FHADHM Clc1ccc(NCc2coc(-c3ccccc3)n2)c(-c2nn[n-]n2)c1 ZINC000822578596 599586152 /nfs/dbraw/zinc/58/61/52/599586152.db2.gz LJGHPPCDRCTHIF-UHFFFAOYSA-N -1 3 352.785 3.787 20 0 FHADHM CC[C@H](SCC(=O)Nc1ccc(-c2nnn[n-]2)cc1)c1ccc(F)cc1 ZINC000736390568 599598828 /nfs/dbraw/zinc/59/88/28/599598828.db2.gz IBXSLSZTTULZHL-INIZCTEOSA-N -1 3 371.441 3.829 20 0 FHADHM CC[C@H](SCC(=O)Nc1ccc(-c2nn[n-]n2)cc1)c1ccc(F)cc1 ZINC000736390568 599598830 /nfs/dbraw/zinc/59/88/30/599598830.db2.gz IBXSLSZTTULZHL-INIZCTEOSA-N -1 3 371.441 3.829 20 0 FHADHM Cc1ccc(C[C@@H](C)N(C)C(=O)Nc2cc(-c3nnn[n-]3)ccc2C)cc1 ZINC000737334654 599610749 /nfs/dbraw/zinc/61/07/49/599610749.db2.gz KNABHYOCRIJRPR-OAHLLOKOSA-N -1 3 364.453 3.578 20 0 FHADHM Cc1ccc(C[C@@H](C)N(C)C(=O)Nc2cc(-c3nn[n-]n3)ccc2C)cc1 ZINC000737334654 599610750 /nfs/dbraw/zinc/61/07/50/599610750.db2.gz KNABHYOCRIJRPR-OAHLLOKOSA-N -1 3 364.453 3.578 20 0 FHADHM Cc1sc(NC(=O)[C@H](c2ccccc2)C(C)C)c(-c2nnn[n-]2)c1C ZINC000822557921 599628749 /nfs/dbraw/zinc/62/87/49/599628749.db2.gz KUSJWDUDTDCISA-AWEZNQCLSA-N -1 3 355.467 3.923 20 0 FHADHM Cc1sc(NC(=O)[C@H](c2ccccc2)C(C)C)c(-c2nn[n-]n2)c1C ZINC000822557921 599628750 /nfs/dbraw/zinc/62/87/50/599628750.db2.gz KUSJWDUDTDCISA-AWEZNQCLSA-N -1 3 355.467 3.923 20 0 FHADHM C[C@@]1(C(=O)Nc2ccc(Cl)c(-c3nnn[n-]3)c2)CCc2ccccc2C1 ZINC000820577590 599629432 /nfs/dbraw/zinc/62/94/32/599629432.db2.gz RLMLVUPLIQSKKP-LJQANCHMSA-N -1 3 367.840 3.654 20 0 FHADHM C[C@@]1(C(=O)Nc2ccc(Cl)c(-c3nn[n-]n3)c2)CCc2ccccc2C1 ZINC000820577590 599629433 /nfs/dbraw/zinc/62/94/33/599629433.db2.gz RLMLVUPLIQSKKP-LJQANCHMSA-N -1 3 367.840 3.654 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@@H](c1ccccc1)C(C)C ZINC000821400217 599630520 /nfs/dbraw/zinc/63/05/20/599630520.db2.gz HFLDOMIRRHHPII-GOSISDBHSA-N -1 3 365.437 3.644 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@@H](c1ccccc1)C(C)C ZINC000821400217 599630521 /nfs/dbraw/zinc/63/05/21/599630521.db2.gz HFLDOMIRRHHPII-GOSISDBHSA-N -1 3 365.437 3.644 20 0 FHADHM C[C@H](C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)c1ccsc1 ZINC000819865814 599633345 /nfs/dbraw/zinc/63/33/45/599633345.db2.gz IAYVVENLSCJBKU-QMMMGPOBSA-N -1 3 367.356 3.689 20 0 FHADHM C[C@H](C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)c1ccsc1 ZINC000819865814 599633346 /nfs/dbraw/zinc/63/33/46/599633346.db2.gz IAYVVENLSCJBKU-QMMMGPOBSA-N -1 3 367.356 3.689 20 0 FHADHM O=C(OCCSc1ccc(Cl)cc1)c1sccc1-c1nnn[n-]1 ZINC000823409338 599659845 /nfs/dbraw/zinc/65/98/45/599659845.db2.gz FEQPLHYJCPXKDN-UHFFFAOYSA-N -1 3 366.855 3.531 20 0 FHADHM Cc1c(F)cccc1NC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000822035331 599664123 /nfs/dbraw/zinc/66/41/23/599664123.db2.gz STBQEPUYUVTRCX-UHFFFAOYSA-N -1 3 362.821 3.777 20 0 FHADHM Cc1c(F)cccc1NC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000822035331 599664124 /nfs/dbraw/zinc/66/41/24/599664124.db2.gz STBQEPUYUVTRCX-UHFFFAOYSA-N -1 3 362.821 3.777 20 0 FHADHM C[C@H](NC(=O)N[C@@H]1CC[C@H]2CCCC[C@H]2C1)c1cccc(-c2nnn[n-]2)c1 ZINC000820356683 599667021 /nfs/dbraw/zinc/66/70/21/599667021.db2.gz ASXSHRLTHOBHLN-JSSFPYSZSA-N -1 3 368.485 3.586 20 0 FHADHM C[C@H](NC(=O)N[C@@H]1CC[C@H]2CCCC[C@H]2C1)c1cccc(-c2nn[n-]n2)c1 ZINC000820356683 599667022 /nfs/dbraw/zinc/66/70/22/599667022.db2.gz ASXSHRLTHOBHLN-JSSFPYSZSA-N -1 3 368.485 3.586 20 0 FHADHM Cc1ccc(-c2cnc(CNc3ccc(F)c(-c4nnn[n-]4)c3)o2)cc1 ZINC000822213881 599691787 /nfs/dbraw/zinc/69/17/87/599691787.db2.gz FGUNDUDCSVFVND-UHFFFAOYSA-N -1 3 350.357 3.581 20 0 FHADHM Cc1ccc(-c2cnc(CNc3ccc(F)c(-c4nn[n-]n4)c3)o2)cc1 ZINC000822213881 599691788 /nfs/dbraw/zinc/69/17/88/599691788.db2.gz FGUNDUDCSVFVND-UHFFFAOYSA-N -1 3 350.357 3.581 20 0 FHADHM C[C@H](C(=O)Oc1ccc(-c2ccc(-c3nnn[n-]3)cc2)cc1)c1cccnc1 ZINC000819883768 599695844 /nfs/dbraw/zinc/69/58/44/599695844.db2.gz MSJBMIZDFIOAGT-AWEZNQCLSA-N -1 3 371.400 3.638 20 0 FHADHM C[C@H](C(=O)Oc1ccc(-c2ccc(-c3nn[n-]n3)cc2)cc1)c1cccnc1 ZINC000819883768 599695845 /nfs/dbraw/zinc/69/58/45/599695845.db2.gz MSJBMIZDFIOAGT-AWEZNQCLSA-N -1 3 371.400 3.638 20 0 FHADHM O=C([O-])c1cccc(NC(=O)CN[C@H](c2ccc(F)cc2)C2CCC2)c1 ZINC000739306641 599793357 /nfs/dbraw/zinc/79/33/57/599793357.db2.gz GVHSVMIREIJNOU-IBGZPJMESA-N -1 3 356.397 3.593 20 0 FHADHM Cc1cc(Cl)ccc1C(=O)Nc1ccc(OC(C)C)c(-c2nnn[n-]2)c1 ZINC000822202127 607397841 /nfs/dbraw/zinc/39/78/41/607397841.db2.gz MMNZTQKKRPMTJJ-UHFFFAOYSA-N -1 3 371.828 3.868 20 0 FHADHM Cc1cc(Cl)ccc1C(=O)Nc1ccc(OC(C)C)c(-c2nn[n-]n2)c1 ZINC000822202127 607397843 /nfs/dbraw/zinc/39/78/43/607397843.db2.gz MMNZTQKKRPMTJJ-UHFFFAOYSA-N -1 3 371.828 3.868 20 0 FHADHM CN(CCCc1cc(-c2ccc(F)cc2)n[nH]1)Cc1cc(C(=O)[O-])co1 ZINC000516776949 599849946 /nfs/dbraw/zinc/84/99/46/599849946.db2.gz GFPQOKUGKKHVEY-UHFFFAOYSA-N -1 3 357.385 3.572 20 0 FHADHM COc1ccc([C@@H](NCc2ccccc2Oc2cccnc2)C(=O)[O-])cc1 ZINC000737973172 599864198 /nfs/dbraw/zinc/86/41/98/599864198.db2.gz YHZCGHLBNFJRDG-HXUWFJFHSA-N -1 3 364.401 3.798 20 0 FHADHM O=C([O-])CN(Cc1cccc(Br)c1)Cc1ccc(F)c(F)c1 ZINC000739796536 599878771 /nfs/dbraw/zinc/87/87/71/599878771.db2.gz SDWVBGTUYAOKEO-UHFFFAOYSA-N -1 3 370.193 3.814 20 0 FHADHM O=C([O-])Nc1cccc(C(=O)NC[C@H]2CCCCN2Cc2ccccc2)c1 ZINC000740029184 599910883 /nfs/dbraw/zinc/91/08/83/599910883.db2.gz PYPFNIMUPQSUDG-LJQANCHMSA-N -1 3 367.449 3.561 20 0 FHADHM O=C([O-])CC[C@@H](NC(=O)c1cccc(CN2CCCC2)c1)c1ccccc1 ZINC000739662806 599951876 /nfs/dbraw/zinc/95/18/76/599951876.db2.gz ZYYRFPWDJKVDPA-HXUWFJFHSA-N -1 3 366.461 3.618 20 0 FHADHM O=C([O-])c1c(CN2CCC[C@H](O)C2)nc2ccccc2c1-c1ccccc1 ZINC000740065841 600010975 /nfs/dbraw/zinc/01/09/75/600010975.db2.gz GNOVASRYVQIFHD-INIZCTEOSA-N -1 3 362.429 3.557 20 0 FHADHM Cc1cc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)ccc1C(=O)[O-] ZINC000738443764 600018395 /nfs/dbraw/zinc/01/83/95/600018395.db2.gz XZPKSEKDDBPPFV-MRXNPFEDSA-N -1 3 373.478 3.713 20 0 FHADHM CC[C@H](C)c1ccc([C@@H](NCC(=O)N2CCC(C(=O)[O-])CC2)C(C)C)cc1 ZINC000736891289 600049745 /nfs/dbraw/zinc/04/97/45/600049745.db2.gz MOXVQCACHHBGOD-KKSFZXQISA-N -1 3 374.525 3.810 20 0 FHADHM C[C@@](NCc1ccnc(Cl)c1)(C(=O)[O-])c1cccc(Br)c1 ZINC000736664654 600076852 /nfs/dbraw/zinc/07/68/52/600076852.db2.gz PXRCAASODAMLHZ-HNNXBMFYSA-N -1 3 369.646 3.587 20 0 FHADHM CC[C@@H](CC(=O)NC1(c2cccc(-c3nnn[n-]3)c2)CC1)c1ccccc1 ZINC000825082089 607419071 /nfs/dbraw/zinc/41/90/71/607419071.db2.gz QEAAESONJPKCRX-HNNXBMFYSA-N -1 3 361.449 3.556 20 0 FHADHM CC[C@@H](CC(=O)NC1(c2cccc(-c3nn[n-]n3)c2)CC1)c1ccccc1 ZINC000825082089 607419073 /nfs/dbraw/zinc/41/90/73/607419073.db2.gz QEAAESONJPKCRX-HNNXBMFYSA-N -1 3 361.449 3.556 20 0 FHADHM C[C@@H]1CCCC[C@]1(CNC(=O)OC(C)(C)C)NCc1occc1C(=O)[O-] ZINC000736779602 600146986 /nfs/dbraw/zinc/14/69/86/600146986.db2.gz JCFZIDGOBFGILY-BFUOFWGJSA-N -1 3 366.458 3.541 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@@H]1C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000826316547 607428791 /nfs/dbraw/zinc/42/87/91/607428791.db2.gz ROSYBGPBMIOCEZ-NEPJUHHUSA-N -1 3 359.842 3.632 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@@H]1C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000826316547 607428792 /nfs/dbraw/zinc/42/87/92/607428792.db2.gz ROSYBGPBMIOCEZ-NEPJUHHUSA-N -1 3 359.842 3.632 20 0 FHADHM Cc1ccsc1[C@H]1C[C@H]1C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000826316548 607428843 /nfs/dbraw/zinc/42/88/43/607428843.db2.gz ROSYBGPBMIOCEZ-NWDGAFQWSA-N -1 3 359.842 3.632 20 0 FHADHM Cc1ccsc1[C@H]1C[C@H]1C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000826316548 607428844 /nfs/dbraw/zinc/42/88/44/607428844.db2.gz ROSYBGPBMIOCEZ-NWDGAFQWSA-N -1 3 359.842 3.632 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@@H]1C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2 ZINC000826316481 607429031 /nfs/dbraw/zinc/42/90/31/607429031.db2.gz POGCNDYUKXUGHJ-MNOVXSKESA-N -1 3 371.491 3.529 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@@H]1C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2 ZINC000826316481 607429033 /nfs/dbraw/zinc/42/90/33/607429033.db2.gz POGCNDYUKXUGHJ-MNOVXSKESA-N -1 3 371.491 3.529 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H]2C[C@H]2c2sccc2C)c1-c1nnn[n-]1 ZINC000825688254 607431425 /nfs/dbraw/zinc/43/14/25/607431425.db2.gz VPOZMCOKIBQDSN-NEPJUHHUSA-N -1 3 373.507 3.911 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H]2C[C@H]2c2sccc2C)c1-c1nn[n-]n1 ZINC000825688254 607431427 /nfs/dbraw/zinc/43/14/27/607431427.db2.gz VPOZMCOKIBQDSN-NEPJUHHUSA-N -1 3 373.507 3.911 20 0 FHADHM Cc1oc(C(=O)[O-])cc1CN1CCC(CN2CCc3ccccc32)CC1 ZINC000738957127 600334966 /nfs/dbraw/zinc/33/49/66/600334966.db2.gz HNMJDLSLRFCVSD-UHFFFAOYSA-N -1 3 354.450 3.561 20 0 FHADHM CN(C)Cc1c2ccccc2oc1C(=O)Nc1ccc(F)c(NC(=O)[O-])c1 ZINC000737368582 600388989 /nfs/dbraw/zinc/38/89/89/600388989.db2.gz TYHNJQJXRXDKHV-UHFFFAOYSA-N -1 3 371.368 3.976 20 0 FHADHM CCCCCC(=O)NC1CCN([C@H](C(=O)[O-])c2cccc(Cl)c2)CC1 ZINC000736984510 600402899 /nfs/dbraw/zinc/40/28/99/600402899.db2.gz KZBNEADTMGRVHK-SFHVURJKSA-N -1 3 366.889 3.627 20 0 FHADHM C[C@H](N[C@@H](C(=O)[O-])c1ccc(F)cc1)c1ccc(NC(=O)C2CC2)cc1 ZINC000736661271 600421654 /nfs/dbraw/zinc/42/16/54/600421654.db2.gz DPKJLQIQDCZVJQ-KPZWWZAWSA-N -1 3 356.397 3.651 20 0 FHADHM C[C@H](N[C@@H](C(=O)[O-])c1ccc(F)cc1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000736662053 600423794 /nfs/dbraw/zinc/42/37/94/600423794.db2.gz KXXOMVXXGOELCR-KPZWWZAWSA-N -1 3 371.412 3.586 20 0 FHADHM C[C@@H](N[C@@H](C(=O)[O-])c1ccc(F)cc1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000736662054 600424092 /nfs/dbraw/zinc/42/40/92/600424092.db2.gz KXXOMVXXGOELCR-KZULUSFZSA-N -1 3 371.412 3.586 20 0 FHADHM CC1CCN(c2ccc(CN[C@@H](C(=O)[O-])c3cccc(Cl)c3)cn2)CC1 ZINC000736799010 600424182 /nfs/dbraw/zinc/42/41/82/600424182.db2.gz LMLDJFDQMMVPPA-LJQANCHMSA-N -1 3 373.884 3.887 20 0 FHADHM CCOc1cc(CN[C@H](C(=O)[O-])c2ccccc2)ccc1OC(F)F ZINC000262703924 600425473 /nfs/dbraw/zinc/42/54/73/600425473.db2.gz LSPCAXWMEBRLJW-INIZCTEOSA-N -1 3 351.349 3.602 20 0 FHADHM O=C([O-])[C@H](c1ccc(F)cc1)N1CCC[C@H](C(=O)c2ccc(F)cc2)C1 ZINC000580456708 600440694 /nfs/dbraw/zinc/44/06/94/600440694.db2.gz NQQDEECYYWMWSE-YJBOKZPZSA-N -1 3 359.372 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Cc1sc(NC(=O)CN[C@H](c2ccccc2)[C@H](C)C(=O)[O-])c(C)c1C ZINC000833036017 601206844 /nfs/dbraw/zinc/20/68/44/601206844.db2.gz HRNFPXURTJMGQI-GUYCJALGSA-N -1 3 360.479 3.663 20 0 FHADHM CCc1oc(C(=O)[O-])cc1CN1CCC[C@@H](c2cc(C(F)(F)F)n[nH]2)C1 ZINC000830369963 601422833 /nfs/dbraw/zinc/42/28/33/601422833.db2.gz WDGZOXWZNNZIKK-SNVBAGLBSA-N -1 3 371.359 3.662 20 0 FHADHM Cc1ccc(CN[C@H](C(=O)[O-])c2ccccc2)c(OCC(F)(F)F)c1 ZINC000832933460 601497504 /nfs/dbraw/zinc/49/75/04/601497504.db2.gz CWCBWXYBUMTUQB-INIZCTEOSA-N -1 3 353.340 3.852 20 0 FHADHM O=C([O-])[C@H]1c2ccccc2CCN1Cc1cnc(-c2ccccc2)s1 ZINC000833195891 601542308 /nfs/dbraw/zinc/54/23/08/601542308.db2.gz TXYNSYOPTIGISD-GOSISDBHSA-N -1 3 350.443 3.994 20 0 FHADHM C[C@H](CCC(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2)c1ccccc1 ZINC000824402381 607530023 /nfs/dbraw/zinc/53/00/23/607530023.db2.gz WFVZYHFMIXBDAW-GFCCVEGCSA-N -1 3 367.478 3.939 20 0 FHADHM C[C@H](CCC(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2)c1ccccc1 ZINC000824402381 607530024 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COCc1cccc(CSc2nc3c(cc2-c2nn[n-]n2)CCCC3)c1 ZINC000826164603 607542340 /nfs/dbraw/zinc/54/23/40/607542340.db2.gz IMWQDAHXGKRQTK-UHFFFAOYSA-N -1 3 367.478 3.579 20 0 FHADHM COc1cc(OC)cc([C@@H](N[C@@H]2CCSc3ccccc32)C(=O)[O-])c1 ZINC000832050949 602164237 /nfs/dbraw/zinc/16/42/37/602164237.db2.gz TYSAPXJETXGXSH-SJLPKXTDSA-N -1 3 359.447 3.656 20 0 FHADHM CC[C@](C)(CC(=O)[O-])NCc1csc(-c2ccc(OC)cc2OC)n1 ZINC000828672448 602215488 /nfs/dbraw/zinc/21/54/88/602215488.db2.gz SCFUYWSWQGJVRM-GOSISDBHSA-N -1 3 364.467 3.560 20 0 FHADHM CC[C@@](C)(CC(=O)[O-])NCc1csc(-c2ccc(OC)cc2OC)n1 ZINC000828672450 602215672 /nfs/dbraw/zinc/21/56/72/602215672.db2.gz SCFUYWSWQGJVRM-SFHVURJKSA-N -1 3 364.467 3.560 20 0 FHADHM C[C@H](c1nnc(-c2ccc(Cl)c(Cl)c2)o1)N1C[C@@H](C)[C@H](C(=O)[O-])C1 ZINC000828425360 602222830 /nfs/dbraw/zinc/22/28/30/602222830.db2.gz ZIXRIMZEOHBPIT-FXPVBKGRSA-N -1 3 370.236 3.757 20 0 FHADHM C[C@H](C(=O)Nc1ccc(OCC(=O)[O-])c2ccccc12)N1CCCCCC1 ZINC000826021020 602261046 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Cc1ccsc1[C@@H]1C[C@H]1C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000826316321 607655938 /nfs/dbraw/zinc/65/59/38/607655938.db2.gz KJOYMDGMGQYQJD-GHMZBOCLSA-N -1 3 359.842 3.632 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@H]1C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000826316321 607655939 /nfs/dbraw/zinc/65/59/39/607655939.db2.gz KJOYMDGMGQYQJD-GHMZBOCLSA-N -1 3 359.842 3.632 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1cc(Cl)cc2cccnc21 ZINC000826249531 607658904 /nfs/dbraw/zinc/65/89/04/607658904.db2.gz HIZMOOGFQRIIEM-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1cc(Cl)cc2cccnc21 ZINC000826249531 607658906 /nfs/dbraw/zinc/65/89/06/607658906.db2.gz HIZMOOGFQRIIEM-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1cccnc1Oc1ccccc1 ZINC000826250936 607664401 /nfs/dbraw/zinc/66/44/01/607664401.db2.gz ZVHPQBWOJNATQB-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1cccnc1Oc1ccccc1 ZINC000826250936 607664403 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Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)c2ccc(-c3nnn[n-]3)cc2C)o1 ZINC000826285436 607699160 /nfs/dbraw/zinc/69/91/60/607699160.db2.gz ZUIFKIMFCKFVNH-SJCJKPOMSA-N -1 3 365.437 3.690 20 0 FHADHM Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)c2ccc(-c3nn[n-]n3)cc2C)o1 ZINC000826285436 607699162 /nfs/dbraw/zinc/69/91/62/607699162.db2.gz ZUIFKIMFCKFVNH-SJCJKPOMSA-N -1 3 365.437 3.690 20 0 FHADHM Cc1c(CN(C)Cc2ccc(C(=O)[O-])cc2)sc2nc(C)nc(C)c12 ZINC000833754672 604577813 /nfs/dbraw/zinc/57/78/13/604577813.db2.gz BLPRLFPRFHRDPX-UHFFFAOYSA-N -1 3 355.463 3.947 20 0 FHADHM CC(C)(C)OC(=O)N1CCC(CCN2Cc3ccc(C(=O)[O-])cc3C2)CC1 ZINC000833435468 604636013 /nfs/dbraw/zinc/63/60/13/604636013.db2.gz JZNWYTPSLLPPNX-UHFFFAOYSA-N -1 3 374.481 3.738 20 0 FHADHM O=C([O-])c1cc(CN2CCC[C@@H](c3nc(C(F)(F)F)cs3)C2)c[nH]1 ZINC000833779093 604675887 /nfs/dbraw/zinc/67/58/87/604675887.db2.gz IILPWHBKOFEQHM-SNVBAGLBSA-N -1 3 359.373 3.568 20 0 FHADHM COc1ccccc1[C@@H](CN[C@H](C)c1ccc2ccccc2n1)NC(=O)[O-] ZINC000829599366 604761059 /nfs/dbraw/zinc/76/10/59/604761059.db2.gz USXXZQITHZXXIM-AUUYWEPGSA-N -1 3 365.433 3.903 20 0 FHADHM Fc1cccc(F)c1-n1ccc(CSc2cccc(-c3nnn[n-]3)c2)n1 ZINC000826377601 607713667 /nfs/dbraw/zinc/71/36/67/607713667.db2.gz YLCYRXMSUBDALU-UHFFFAOYSA-N -1 3 370.388 3.623 20 0 FHADHM Fc1cccc(F)c1-n1ccc(CSc2cccc(-c3nn[n-]n3)c2)n1 ZINC000826377601 607713669 /nfs/dbraw/zinc/71/36/69/607713669.db2.gz YLCYRXMSUBDALU-UHFFFAOYSA-N -1 3 370.388 3.623 20 0 FHADHM CC[C@@H](CC(=O)OCc1ccccc1-c1nnn[n-]1)c1ccc(OC)cc1 ZINC000825082185 607714695 /nfs/dbraw/zinc/71/46/95/607714695.db2.gz QYSKJENCXNCVIB-AWEZNQCLSA-N -1 3 366.421 3.502 20 0 FHADHM CC[C@@H](CC(=O)OCc1ccccc1-c1nn[n-]n1)c1ccc(OC)cc1 ZINC000825082185 607714697 /nfs/dbraw/zinc/71/46/97/607714697.db2.gz QYSKJENCXNCVIB-AWEZNQCLSA-N -1 3 366.421 3.502 20 0 FHADHM C[C@@H](c1ccccc1)N1CC[C@H](Nc2nc(Cl)c(C(=O)[O-])s2)C1 ZINC000833548500 604825978 /nfs/dbraw/zinc/82/59/78/604825978.db2.gz LDDLQNZJBVFFHH-JQWIXIFHSA-N -1 3 351.859 3.742 20 0 FHADHM Cc1ccccc1-c1noc([C@@H](C)N2CCC[C@@H](C(C)(C)C(=O)[O-])C2)n1 ZINC000652499841 604931969 /nfs/dbraw/zinc/93/19/69/604931969.db2.gz ORJASZSHVSIUPI-HUUCEWRRSA-N -1 3 357.454 3.929 20 0 FHADHM CC[C@H](CC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccc(OC)cc1 ZINC000825082289 607723881 /nfs/dbraw/zinc/72/38/81/607723881.db2.gz RQMZTUQQSCABOJ-GFCCVEGCSA-N -1 3 369.400 3.537 20 0 FHADHM CC[C@H](CC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccc(OC)cc1 ZINC000825082289 607723882 /nfs/dbraw/zinc/72/38/82/607723882.db2.gz RQMZTUQQSCABOJ-GFCCVEGCSA-N -1 3 369.400 3.537 20 0 FHADHM CC(C)N(C(=O)CN[C@H](c1ccccc1)C(C)(C)C(=O)[O-])C1CCCC1 ZINC000833495586 605175743 /nfs/dbraw/zinc/17/57/43/605175743.db2.gz JNMYCJFSNWPTGT-LJQANCHMSA-N -1 3 360.498 3.608 20 0 FHADHM CC(C)(C(=O)[O-])[C@@H](NCc1cncc(Br)c1)c1ccccc1 ZINC000833412851 605180323 /nfs/dbraw/zinc/18/03/23/605180323.db2.gz DBPAMIYLHSYYLW-HNNXBMFYSA-N -1 3 363.255 3.786 20 0 FHADHM CC(C)COC1CCN([C@@H](C(=O)[O-])c2ccccc2C(F)(F)F)CC1 ZINC000582425871 605262115 /nfs/dbraw/zinc/26/21/15/605262115.db2.gz SEJRWVVHNZKNCA-MRXNPFEDSA-N -1 3 359.388 3.968 20 0 FHADHM O=C([O-])c1ccc(F)c(CN[C@@H](CN2CCCCC2)c2ccccc2)c1 ZINC000833780935 605269407 /nfs/dbraw/zinc/26/94/07/605269407.db2.gz JYQFRUVXTLLSRF-FQEVSTJZSA-N -1 3 356.441 3.841 20 0 FHADHM CC1=C(C(=O)[O-])C[C@H](CN[C@@H](Cc2ccc(Cl)cc2)c2ccccn2)O1 ZINC000833579710 605270327 /nfs/dbraw/zinc/27/03/27/605270327.db2.gz OPMIIGYDJKPSPE-APWZRJJASA-N -1 3 372.852 3.756 20 0 FHADHM CC1CCC(OC2CCN(Cc3ccc(OCC(=O)[O-])cc3)CC2)CC1 ZINC000833608693 605296748 /nfs/dbraw/zinc/29/67/48/605296748.db2.gz CDLAQHWJBCJWRS-UHFFFAOYSA-N -1 3 361.482 3.710 20 0 FHADHM Cc1cc(-c2nc(-c3ccc(CN(C)C)cc3)no2)ccc1NC(=O)[O-] ZINC000829888647 605458126 /nfs/dbraw/zinc/45/81/26/605458126.db2.gz HWOPROBTBNPBST-UHFFFAOYSA-N -1 3 352.394 3.864 20 0 FHADHM C[C@@H](NC(=O)[O-])[C@H]1CCCN(Cc2ccccc2OCc2ccncc2)C1 ZINC000833812303 605597327 /nfs/dbraw/zinc/59/73/27/605597327.db2.gz IRXBNMHEOFKHSN-AEFFLSMTSA-N -1 3 369.465 3.529 20 0 FHADHM C[C@@H](C(=O)Nc1nc(-c2cccc(-c3nnn[n-]3)c2)cs1)C(C)(C)C ZINC000824045097 607770236 /nfs/dbraw/zinc/77/02/36/607770236.db2.gz GFZCUQBNTVNDFT-JTQLQIEISA-N -1 3 356.455 3.611 20 0 FHADHM C[C@@H](C(=O)Nc1nc(-c2cccc(-c3nn[n-]n3)c2)cs1)C(C)(C)C ZINC000824045097 607770237 /nfs/dbraw/zinc/77/02/37/607770237.db2.gz GFZCUQBNTVNDFT-JTQLQIEISA-N -1 3 356.455 3.611 20 0 FHADHM C[C@@H]1CCC[C@@H](C(=O)Nc2nc(-c3cccc(-c4nnn[n-]4)c3)cs2)C1 ZINC000824928432 607770302 /nfs/dbraw/zinc/77/03/02/607770302.db2.gz SLHVKVCIRBNMFH-BXUZGUMPSA-N -1 3 368.466 3.755 20 0 FHADHM C[C@@H]1CCC[C@@H](C(=O)Nc2nc(-c3cccc(-c4nn[n-]n4)c3)cs2)C1 ZINC000824928432 607770303 /nfs/dbraw/zinc/77/03/03/607770303.db2.gz SLHVKVCIRBNMFH-BXUZGUMPSA-N -1 3 368.466 3.755 20 0 FHADHM C[C@@H]1CC[C@@H](NC(=O)C=Cc2ccccc2-c2nnn[n-]2)c2ccccc21 ZINC000824919524 607771901 /nfs/dbraw/zinc/77/19/01/607771901.db2.gz VZUBZYWCKWZDQM-VGBYHEHXSA-N -1 3 359.433 3.635 20 0 FHADHM C[C@@H]1CC[C@@H](NC(=O)C=Cc2ccccc2-c2nn[n-]n2)c2ccccc21 ZINC000824919524 607771902 /nfs/dbraw/zinc/77/19/02/607771902.db2.gz VZUBZYWCKWZDQM-VGBYHEHXSA-N -1 3 359.433 3.635 20 0 FHADHM O=C([O-])N[C@H]1C[C@@H](NCc2cccc(OCC(F)F)c2)c2ccccc21 ZINC000834158101 605802207 /nfs/dbraw/zinc/80/22/07/605802207.db2.gz MEIZYQCUDUUWPK-SJORKVTESA-N -1 3 362.376 3.874 20 0 FHADHM Cn1cc(CN[C@@H]2CCc3cc(NC(=O)[O-])ccc32)c(-c2ccccc2)n1 ZINC000833946724 605984052 /nfs/dbraw/zinc/98/40/52/605984052.db2.gz LOIGABGGUNDQNE-LJQANCHMSA-N -1 3 362.433 3.954 20 0 FHADHM O=C([O-])N1CCC[C@@H]1[C@H]1CCC[C@H]1NCc1coc(-c2ccccc2)n1 ZINC000834108865 605990365 /nfs/dbraw/zinc/99/03/65/605990365.db2.gz RUKLJRVUTQOTAJ-RCCFBDPRSA-N -1 3 355.438 3.742 20 0 FHADHM O=C([O-])N1CCC[C@@H]1[C@@H]1CCC[C@H]1NCc1csc(-c2ccco2)n1 ZINC000834111091 605990862 /nfs/dbraw/zinc/99/08/62/605990862.db2.gz ZINIHRFCGIJILB-RBSFLKMASA-N -1 3 361.467 3.804 20 0 FHADHM CC[C@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)cc2)CC[C@@H]1c1ccccc1 ZINC000820989301 606029726 /nfs/dbraw/zinc/02/97/26/606029726.db2.gz QCMZNAHMQBALSL-KXBFYZLASA-N -1 3 361.449 3.523 20 0 FHADHM CC[C@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)cc2)CC[C@@H]1c1ccccc1 ZINC000820989301 606029727 /nfs/dbraw/zinc/02/97/27/606029727.db2.gz QCMZNAHMQBALSL-KXBFYZLASA-N -1 3 361.449 3.523 20 0 FHADHM Fc1ccc(C2=CCN(c3nc4ccccc4cc3-c3nnn[n-]3)CC2)cc1 ZINC000822766461 606031638 /nfs/dbraw/zinc/03/16/38/606031638.db2.gz JQESGBDIBIXGGK-UHFFFAOYSA-N -1 3 372.407 3.848 20 0 FHADHM Fc1ccc(C2=CCN(c3nc4ccccc4cc3-c3nn[n-]n3)CC2)cc1 ZINC000822766461 606031642 /nfs/dbraw/zinc/03/16/42/606031642.db2.gz JQESGBDIBIXGGK-UHFFFAOYSA-N -1 3 372.407 3.848 20 0 FHADHM O=C([O-])N1CCC(CCN[C@@H](c2cccc(F)c2)c2ccccn2)CC1 ZINC000834071619 606046053 /nfs/dbraw/zinc/04/60/53/606046053.db2.gz APZNCPGUFACXLU-IBGZPJMESA-N -1 3 357.429 3.680 20 0 FHADHM C[C@H](C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccc(Cl)s1 ZINC000819866745 606122159 /nfs/dbraw/zinc/12/21/59/606122159.db2.gz PIUPCQXMBQEDJF-ZETCQYMHSA-N -1 3 368.249 3.977 20 0 FHADHM C[C@H](C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccc(Cl)s1 ZINC000819866745 606122162 /nfs/dbraw/zinc/12/21/62/606122162.db2.gz PIUPCQXMBQEDJF-ZETCQYMHSA-N -1 3 368.249 3.977 20 0 FHADHM C[C@@H](OC(=O)C/C=C\c1cccc(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488794 606127342 /nfs/dbraw/zinc/12/73/42/606127342.db2.gz UJLOWUGEEFCKGP-HSBHDXMMSA-N -1 3 352.369 3.714 20 0 FHADHM C[C@@H](OC(=O)C/C=C\c1cccc(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488794 606127343 /nfs/dbraw/zinc/12/73/43/606127343.db2.gz UJLOWUGEEFCKGP-HSBHDXMMSA-N -1 3 352.369 3.714 20 0 FHADHM C[C@H]1CCc2c(sc(NC(=O)[C@H]3CC34CCCC4)c2-c2nnn[n-]2)C1 ZINC000820727457 606146085 /nfs/dbraw/zinc/14/60/85/606146085.db2.gz MBVZUXKBDDKYFS-CMPLNLGQSA-N -1 3 357.483 3.572 20 0 FHADHM C[C@H]1CCc2c(sc(NC(=O)[C@H]3CC34CCCC4)c2-c2nn[n-]n2)C1 ZINC000820727457 606146087 /nfs/dbraw/zinc/14/60/87/606146087.db2.gz MBVZUXKBDDKYFS-CMPLNLGQSA-N -1 3 357.483 3.572 20 0 FHADHM C[C@H](c1ccc(Cl)cc1)[C@H](C)N(C)C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000820563591 606149327 /nfs/dbraw/zinc/14/93/27/606149327.db2.gz RWCOTHFLQVVPIC-STQMWFEESA-N -1 3 369.856 3.784 20 0 FHADHM C[C@H](c1ccc(Cl)cc1)[C@H](C)N(C)C(=O)c1cccc(-c2nn[n-]n2)c1 ZINC000820563591 606149329 /nfs/dbraw/zinc/14/93/29/606149329.db2.gz RWCOTHFLQVVPIC-STQMWFEESA-N -1 3 369.856 3.784 20 0 FHADHM Cc1c(COC(C)(C)C)cccc1NC(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000822029000 606151198 /nfs/dbraw/zinc/15/11/98/606151198.db2.gz UFVLPIHSPADUCR-UHFFFAOYSA-N -1 3 365.437 3.743 20 0 FHADHM Cc1c(COC(C)(C)C)cccc1NC(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC000822029000 606151200 /nfs/dbraw/zinc/15/12/00/606151200.db2.gz UFVLPIHSPADUCR-UHFFFAOYSA-N -1 3 365.437 3.743 20 0 FHADHM C[C@@H](OC(=O)[C@H](C)c1ccc(Cl)s1)c1cccc(-c2nnn[n-]2)c1 ZINC000820481534 606177323 /nfs/dbraw/zinc/17/73/23/606177323.db2.gz XDMFDPNFYQOYKR-NXEZZACHSA-N -1 3 362.842 3.990 20 0 FHADHM C[C@@H](OC(=O)[C@H](C)c1ccc(Cl)s1)c1cccc(-c2nn[n-]n2)c1 ZINC000820481534 606177325 /nfs/dbraw/zinc/17/73/25/606177325.db2.gz XDMFDPNFYQOYKR-NXEZZACHSA-N -1 3 362.842 3.990 20 0 FHADHM COc1ccc([C@@H](C)CC(=O)O[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000821778238 606177650 /nfs/dbraw/zinc/17/76/50/606177650.db2.gz XCRSAYUKZRIDKL-KBPBESRZSA-N -1 3 366.421 3.673 20 0 FHADHM COc1ccc([C@@H](C)CC(=O)O[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000821778238 606177651 /nfs/dbraw/zinc/17/76/51/606177651.db2.gz XCRSAYUKZRIDKL-KBPBESRZSA-N -1 3 366.421 3.673 20 0 FHADHM CO[C@H](C)c1nc(CSCc2cc(-c3nnn[n-]3)ccc2F)cs1 ZINC000821675573 606179808 /nfs/dbraw/zinc/17/98/08/606179808.db2.gz OPUQRFZKOOKUAM-SECBINFHSA-N -1 3 365.459 3.603 20 0 FHADHM CO[C@H](C)c1nc(CSCc2cc(-c3nn[n-]n3)ccc2F)cs1 ZINC000821675573 606179809 /nfs/dbraw/zinc/17/98/09/606179809.db2.gz OPUQRFZKOOKUAM-SECBINFHSA-N -1 3 365.459 3.603 20 0 FHADHM CCOc1cccc([C@H](CC)OC(=O)Cc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000821426689 606182259 /nfs/dbraw/zinc/18/22/59/606182259.db2.gz GDEHZRFPOXXTDW-SFHVURJKSA-N -1 3 366.421 3.502 20 0 FHADHM CCOc1cccc([C@H](CC)OC(=O)Cc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000821426689 606182260 /nfs/dbraw/zinc/18/22/60/606182260.db2.gz GDEHZRFPOXXTDW-SFHVURJKSA-N -1 3 366.421 3.502 20 0 FHADHM O=C(c1cccc(-c2nnn[n-]2)c1)N1CCCSc2ccc(Cl)cc21 ZINC000823487538 606193807 /nfs/dbraw/zinc/19/38/07/606193807.db2.gz DPUNNASBBAXSMH-UHFFFAOYSA-N -1 3 371.853 3.663 20 0 FHADHM O=C(c1cccc(-c2nn[n-]n2)c1)N1CCCSc2ccc(Cl)cc21 ZINC000823487538 606193808 /nfs/dbraw/zinc/19/38/08/606193808.db2.gz DPUNNASBBAXSMH-UHFFFAOYSA-N -1 3 371.853 3.663 20 0 FHADHM COc1cccc(C(C)=CC(=O)Nc2sc(C)c(C)c2-c2nnn[n-]2)c1 ZINC000821859372 606208802 /nfs/dbraw/zinc/20/88/02/606208802.db2.gz NNWOJOBDBDOKJU-NTMALXAHSA-N -1 3 369.450 3.596 20 0 FHADHM COc1cccc(C(C)=CC(=O)Nc2sc(C)c(C)c2-c2nn[n-]n2)c1 ZINC000821859372 606208804 /nfs/dbraw/zinc/20/88/04/606208804.db2.gz NNWOJOBDBDOKJU-NTMALXAHSA-N -1 3 369.450 3.596 20 0 FHADHM CC(C)(C)n1ncc2c1CCC[C@H]2Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000819976148 606223747 /nfs/dbraw/zinc/22/37/47/606223747.db2.gz ONFKNDHRPWMMAH-OAHLLOKOSA-N -1 3 371.876 3.961 20 0 FHADHM CC(C)(C)n1ncc2c1CCC[C@H]2Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000819976148 606223748 /nfs/dbraw/zinc/22/37/48/606223748.db2.gz ONFKNDHRPWMMAH-OAHLLOKOSA-N -1 3 371.876 3.961 20 0 FHADHM O=C(Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1)[C@H]1C[C@H]1C1CC1 ZINC000823383805 606231508 /nfs/dbraw/zinc/23/15/08/606231508.db2.gz ZZHJIGXTTTWXRA-STQMWFEESA-N -1 3 351.435 3.580 20 0 FHADHM O=C(Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1)[C@H]1C[C@H]1C1CC1 ZINC000823383805 606231509 /nfs/dbraw/zinc/23/15/09/606231509.db2.gz ZZHJIGXTTTWXRA-STQMWFEESA-N -1 3 351.435 3.580 20 0 FHADHM C[C@H]1[C@@H](c2ccccc2)CCN1c1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000820643652 606233987 /nfs/dbraw/zinc/23/39/87/606233987.db2.gz YCYPNXRITZIUKT-AAEUAGOBSA-N -1 3 374.370 3.663 20 0 FHADHM C[C@H]1[C@@H](c2ccccc2)CCN1c1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000820643652 606233989 /nfs/dbraw/zinc/23/39/89/606233989.db2.gz YCYPNXRITZIUKT-AAEUAGOBSA-N -1 3 374.370 3.663 20 0 FHADHM CCCN1C(=O)c2ccc(Cl)cc2N[C@@H]1c1cc(-c2nnn[n-]2)cs1 ZINC000821110274 606243711 /nfs/dbraw/zinc/24/37/11/606243711.db2.gz ZBXNWZNWXDKEIR-HNNXBMFYSA-N -1 3 374.857 3.558 20 0 FHADHM CCCN1C(=O)c2ccc(Cl)cc2N[C@@H]1c1cc(-c2nn[n-]n2)cs1 ZINC000821110274 606243713 /nfs/dbraw/zinc/24/37/13/606243713.db2.gz ZBXNWZNWXDKEIR-HNNXBMFYSA-N -1 3 374.857 3.558 20 0 FHADHM CC[C@@H](C)NC(=O)c1ccc(Sc2ccccc2-c2nnn[n-]2)cc1 ZINC000820876069 606244675 /nfs/dbraw/zinc/24/46/75/606244675.db2.gz LCOQGDGFNBPWCZ-GFCCVEGCSA-N -1 3 353.451 3.546 20 0 FHADHM CC[C@@H](C)NC(=O)c1ccc(Sc2ccccc2-c2nn[n-]n2)cc1 ZINC000820876069 606244676 /nfs/dbraw/zinc/24/46/76/606244676.db2.gz LCOQGDGFNBPWCZ-GFCCVEGCSA-N -1 3 353.451 3.546 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1)[C@@H]1C[C@H]1C1CC1 ZINC000823350387 606252652 /nfs/dbraw/zinc/25/26/52/606252652.db2.gz LDKPQDDNTMGTMN-ZWKOTPCHSA-N -1 3 361.405 3.644 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1)[C@@H]1C[C@H]1C1CC1 ZINC000823350387 606252654 /nfs/dbraw/zinc/25/26/54/606252654.db2.gz LDKPQDDNTMGTMN-ZWKOTPCHSA-N -1 3 361.405 3.644 20 0 FHADHM Cc1c2cc(Cl)ccc2oc1C(=O)Nc1ccc(F)cc1-c1nnn[n-]1 ZINC000822020779 606262204 /nfs/dbraw/zinc/26/22/04/606262204.db2.gz JAFFTFZUOLUKKB-UHFFFAOYSA-N -1 3 371.759 3.966 20 0 FHADHM Cc1c2cc(Cl)ccc2oc1C(=O)Nc1ccc(F)cc1-c1nn[n-]n1 ZINC000822020779 606262205 /nfs/dbraw/zinc/26/22/05/606262205.db2.gz JAFFTFZUOLUKKB-UHFFFAOYSA-N -1 3 371.759 3.966 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)c1cc(Cl)ccc1Cl ZINC000823343622 606262355 /nfs/dbraw/zinc/26/23/55/606262355.db2.gz BHUIXCBYXAOFCP-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)c1cc(Cl)ccc1Cl ZINC000823343622 606262356 /nfs/dbraw/zinc/26/23/56/606262356.db2.gz BHUIXCBYXAOFCP-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)c1cc(F)c(Cl)cc1Cl ZINC000823343628 606272211 /nfs/dbraw/zinc/27/22/11/606272211.db2.gz BXEZSKQRGGGLML-UHFFFAOYSA-N -1 3 370.146 3.704 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)c1cc(F)c(Cl)cc1Cl ZINC000823343628 606272212 /nfs/dbraw/zinc/27/22/12/606272212.db2.gz BXEZSKQRGGGLML-UHFFFAOYSA-N -1 3 370.146 3.704 20 0 FHADHM Fc1cc2nc(C(Cl)=Cc3cc(-c4nnn[n-]4)cs3)[nH]c2cc1F ZINC000822753585 606305942 /nfs/dbraw/zinc/30/59/42/606305942.db2.gz OMGPQJWQZUFAJO-WAPJZHGLSA-N -1 3 364.768 3.820 20 0 FHADHM Fc1cc2nc(C(Cl)=Cc3cc(-c4nn[n-]n4)cs3)[nH]c2cc1F ZINC000822753585 606305945 /nfs/dbraw/zinc/30/59/45/606305945.db2.gz OMGPQJWQZUFAJO-WAPJZHGLSA-N -1 3 364.768 3.820 20 0 FHADHM Cc1ccc(NC(=O)[C@H](C)Sc2cccc(-c3nnn[n-]3)c2)c(C)c1 ZINC000822242802 606324378 /nfs/dbraw/zinc/32/43/78/606324378.db2.gz YCRVONBBGWINED-ZDUSSCGKSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1ccc(NC(=O)[C@H](C)Sc2cccc(-c3nn[n-]n3)c2)c(C)c1 ZINC000822242802 606324380 /nfs/dbraw/zinc/32/43/80/606324380.db2.gz YCRVONBBGWINED-ZDUSSCGKSA-N -1 3 353.451 3.603 20 0 FHADHM CCc1ccc(NC(=O)[C@@H](C)Sc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000821486285 606325577 /nfs/dbraw/zinc/32/55/77/606325577.db2.gz BLUCCZZTUAKRMU-GFCCVEGCSA-N -1 3 353.451 3.548 20 0 FHADHM CCc1ccc(NC(=O)[C@@H](C)Sc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000821486285 606325579 /nfs/dbraw/zinc/32/55/79/606325579.db2.gz BLUCCZZTUAKRMU-GFCCVEGCSA-N -1 3 353.451 3.548 20 0 FHADHM C[C@H](CCOc1ccccc1)C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820249560 606341924 /nfs/dbraw/zinc/34/19/24/606341924.db2.gz WSHOBPLKWUFNBE-CABCVRRESA-N -1 3 366.421 3.576 20 0 FHADHM C[C@H](CCOc1ccccc1)C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820249560 606341926 /nfs/dbraw/zinc/34/19/26/606341926.db2.gz WSHOBPLKWUFNBE-CABCVRRESA-N -1 3 366.421 3.576 20 0 FHADHM CCc1ccc([C@H]2CCCN2C(=O)Nc2ccc(F)cc2-c2nnn[n-]2)o1 ZINC000821482800 606345922 /nfs/dbraw/zinc/34/59/22/606345922.db2.gz VDXVCDLBHOZUIQ-OAHLLOKOSA-N -1 3 370.388 3.530 20 0 FHADHM CCc1ccc([C@H]2CCCN2C(=O)Nc2ccc(F)cc2-c2nn[n-]n2)o1 ZINC000821482800 606345924 /nfs/dbraw/zinc/34/59/24/606345924.db2.gz VDXVCDLBHOZUIQ-OAHLLOKOSA-N -1 3 370.388 3.530 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)N1CCC[C@@H]1c1cccc(F)c1 ZINC000823344351 606348336 /nfs/dbraw/zinc/34/83/36/606348336.db2.gz WCYXXADRJIYOSK-MRXNPFEDSA-N -1 3 370.363 3.514 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)N1CCC[C@@H]1c1cccc(F)c1 ZINC000823344351 606348338 /nfs/dbraw/zinc/34/83/38/606348338.db2.gz WCYXXADRJIYOSK-MRXNPFEDSA-N -1 3 370.363 3.514 20 0 FHADHM CCCc1nc(C)c(C(=O)O[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)s1 ZINC000821141997 606349950 /nfs/dbraw/zinc/34/99/50/606349950.db2.gz BDSMOZJRLPIXFD-NSHDSACASA-N -1 3 357.439 3.502 20 0 FHADHM CCCc1nc(C)c(C(=O)O[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)s1 ZINC000821141997 606349952 /nfs/dbraw/zinc/34/99/52/606349952.db2.gz BDSMOZJRLPIXFD-NSHDSACASA-N -1 3 357.439 3.502 20 0 FHADHM C[C@H](OC(=O)CCOc1cccc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820498197 606355826 /nfs/dbraw/zinc/35/58/26/606355826.db2.gz ZJJQFEQIGYEAAE-LBPRGKRZSA-N -1 3 372.812 3.593 20 0 FHADHM C[C@H](OC(=O)CCOc1cccc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820498197 606355828 /nfs/dbraw/zinc/35/58/28/606355828.db2.gz ZJJQFEQIGYEAAE-LBPRGKRZSA-N -1 3 372.812 3.593 20 0 FHADHM CN(C(=O)c1ccc(Oc2ccccc2)o1)c1cccc(-c2nnn[n-]2)c1 ZINC000821574504 606362951 /nfs/dbraw/zinc/36/29/51/606362951.db2.gz JKUZHTYTPLNJQR-UHFFFAOYSA-N -1 3 361.361 3.529 20 0 FHADHM CN(C(=O)c1ccc(Oc2ccccc2)o1)c1cccc(-c2nn[n-]n2)c1 ZINC000821574504 606362952 /nfs/dbraw/zinc/36/29/52/606362952.db2.gz JKUZHTYTPLNJQR-UHFFFAOYSA-N -1 3 361.361 3.529 20 0 FHADHM O=C(Nc1ccc(Oc2ccccc2-c2nnn[n-]2)cc1)[C@H]1[C@@H]2CCC[C@@H]21 ZINC000823357669 606379272 /nfs/dbraw/zinc/37/92/72/606379272.db2.gz XQAAWFFSQWJVRV-HWWDLCQESA-N -1 3 361.405 3.644 20 0 FHADHM O=C(Nc1ccc(Oc2ccccc2-c2nn[n-]n2)cc1)[C@H]1[C@@H]2CCC[C@@H]21 ZINC000823357669 606379273 /nfs/dbraw/zinc/37/92/73/606379273.db2.gz XQAAWFFSQWJVRV-HWWDLCQESA-N -1 3 361.405 3.644 20 0 FHADHM CCS[C@@H]1CCC[C@@H](Nc2nc(C(F)(F)F)ccc2-c2nnn[n-]2)C1 ZINC000821455363 606400901 /nfs/dbraw/zinc/40/09/01/606400901.db2.gz JUFQMKLIUGLXQI-NXEZZACHSA-N -1 3 372.420 3.757 20 0 FHADHM CCS[C@@H]1CCC[C@@H](Nc2nc(C(F)(F)F)ccc2-c2nn[n-]n2)C1 ZINC000821455363 606400902 /nfs/dbraw/zinc/40/09/02/606400902.db2.gz JUFQMKLIUGLXQI-NXEZZACHSA-N -1 3 372.420 3.757 20 0 FHADHM CC(C)CC(=O)Nc1ccc(NCc2ccc(-c3nnn[n-]3)s2)cc1 ZINC000820051316 606410488 /nfs/dbraw/zinc/41/04/88/606410488.db2.gz MXBGFDOCXLPQCP-UHFFFAOYSA-N -1 3 356.455 3.525 20 0 FHADHM Cc1ccc(CCC(=O)N(C)c2cc(Cl)ccc2-c2nnn[n-]2)c(C)c1 ZINC000822235035 606413280 /nfs/dbraw/zinc/41/32/80/606413280.db2.gz PKRFDYXJUNLBST-UHFFFAOYSA-N -1 3 369.856 3.733 20 0 FHADHM Cc1ccc(CCC(=O)N(C)c2cc(Cl)ccc2-c2nn[n-]n2)c(C)c1 ZINC000822235035 606413282 /nfs/dbraw/zinc/41/32/82/606413282.db2.gz PKRFDYXJUNLBST-UHFFFAOYSA-N -1 3 369.856 3.733 20 0 FHADHM C[C@@H]1CCN(C(=O)c2cccc(Oc3ccc(-c4nnn[n-]4)cc3)c2)[C@H]1C ZINC000820715685 606445894 /nfs/dbraw/zinc/44/58/94/606445894.db2.gz CIKDUAXHHYALIB-KGLIPLIRSA-N -1 3 363.421 3.530 20 0 FHADHM C[C@@H]1CCN(C(=O)c2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)[C@H]1C ZINC000820715685 606445896 /nfs/dbraw/zinc/44/58/96/606445896.db2.gz CIKDUAXHHYALIB-KGLIPLIRSA-N -1 3 363.421 3.530 20 0 FHADHM Cc1c(Br)cccc1NCc1cc(-c2nnn[n-]2)ccc1F ZINC000822015487 606455670 /nfs/dbraw/zinc/45/56/70/606455670.db2.gz KODUABJIGNMTGY-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Cc1c(Br)cccc1NCc1cc(-c2nn[n-]n2)ccc1F ZINC000822015487 606455671 /nfs/dbraw/zinc/45/56/71/606455671.db2.gz KODUABJIGNMTGY-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM C[C@@H](OC(=O)c1cc(-c2nnn[n-]2)cs1)c1ccccc1C(F)(F)F ZINC000820507996 606462481 /nfs/dbraw/zinc/46/24/81/606462481.db2.gz KYGNSFBVLZOGCG-MRVPVSSYSA-N -1 3 368.340 3.865 20 0 FHADHM C[C@@H](OC(=O)c1cc(-c2nn[n-]n2)cs1)c1ccccc1C(F)(F)F ZINC000820507996 606462484 /nfs/dbraw/zinc/46/24/84/606462484.db2.gz KYGNSFBVLZOGCG-MRVPVSSYSA-N -1 3 368.340 3.865 20 0 FHADHM O=C(Nc1ccc(Cl)c(C(F)(F)F)c1)c1cc(-c2nnn[n-]2)cs1 ZINC000823331465 606477592 /nfs/dbraw/zinc/47/75/92/606477592.db2.gz DLLUOAXKKHSQGM-UHFFFAOYSA-N -1 3 373.747 3.853 20 0 FHADHM O=C(Nc1ccc(Cl)c(C(F)(F)F)c1)c1cc(-c2nn[n-]n2)cs1 ZINC000823331465 606477593 /nfs/dbraw/zinc/47/75/93/606477593.db2.gz DLLUOAXKKHSQGM-UHFFFAOYSA-N -1 3 373.747 3.853 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)c1cscc1C ZINC000821389939 606493424 /nfs/dbraw/zinc/49/34/24/606493424.db2.gz RMXAABIQZSFOPS-UHFFFAOYSA-N -1 3 364.814 3.508 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)c1cscc1C ZINC000821389939 606493425 /nfs/dbraw/zinc/49/34/25/606493425.db2.gz RMXAABIQZSFOPS-UHFFFAOYSA-N -1 3 364.814 3.508 20 0 FHADHM O=C(N[C@H](c1ccc(F)cc1)C1CCCC1)c1cc(-c2nnn[n-]2)cs1 ZINC000823140359 606495108 /nfs/dbraw/zinc/49/51/08/606495108.db2.gz TXLFMSLNZPOPJP-INIZCTEOSA-N -1 3 371.441 3.729 20 0 FHADHM O=C(N[C@H](c1ccc(F)cc1)C1CCCC1)c1cc(-c2nn[n-]n2)cs1 ZINC000823140359 606495109 /nfs/dbraw/zinc/49/51/09/606495109.db2.gz TXLFMSLNZPOPJP-INIZCTEOSA-N -1 3 371.441 3.729 20 0 FHADHM CCC(CC)[C@H](NC(=O)Cc1cccc(-c2nnn[n-]2)c1)c1cccs1 ZINC000820893327 606530885 /nfs/dbraw/zinc/53/08/85/606530885.db2.gz NLZCRFMVGVJCLW-SFHVURJKSA-N -1 3 369.494 3.764 20 0 FHADHM CCC(CC)[C@H](NC(=O)Cc1cccc(-c2nn[n-]n2)c1)c1cccs1 ZINC000820893327 606530887 /nfs/dbraw/zinc/53/08/87/606530887.db2.gz NLZCRFMVGVJCLW-SFHVURJKSA-N -1 3 369.494 3.764 20 0 FHADHM O=C(CCC1CCC1)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000822950482 606569728 /nfs/dbraw/zinc/56/97/28/606569728.db2.gz PFMZGDWPLJKDMX-UHFFFAOYSA-N -1 3 367.478 3.792 20 0 FHADHM Cc1cccc([C@@H](NC(=O)Cc2ccc(-c3nnn[n-]3)cc2)C(C)(C)C)c1 ZINC000822288785 606590394 /nfs/dbraw/zinc/59/03/94/606590394.db2.gz JLPHPSWEJCKQEJ-LJQANCHMSA-N -1 3 363.465 3.621 20 0 FHADHM Cc1cccc([C@@H](NC(=O)Cc2ccc(-c3nn[n-]n3)cc2)C(C)(C)C)c1 ZINC000822288785 606590396 /nfs/dbraw/zinc/59/03/96/606590396.db2.gz JLPHPSWEJCKQEJ-LJQANCHMSA-N -1 3 363.465 3.621 20 0 FHADHM C[C@@H](Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1)c1ccc(F)cc1F ZINC000736138985 606593114 /nfs/dbraw/zinc/59/31/14/606593114.db2.gz TUVVCTPUYMZNAO-SSDOTTSWSA-N -1 3 370.285 3.732 20 0 FHADHM C[C@@H](Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1)c1ccc(F)cc1F ZINC000736138985 606593116 /nfs/dbraw/zinc/59/31/16/606593116.db2.gz TUVVCTPUYMZNAO-SSDOTTSWSA-N -1 3 370.285 3.732 20 0 FHADHM FC(F)(F)[C@H]1CCC[C@H](CNc2nc3c(cc2-c2nnn[n-]2)CCC3)C1 ZINC000822714955 606595311 /nfs/dbraw/zinc/59/53/11/606595311.db2.gz XOZKOSRAQWBJPG-JQWIXIFHSA-N -1 3 366.391 3.531 20 0 FHADHM FC(F)(F)[C@H]1CCC[C@H](CNc2nc3c(cc2-c2nn[n-]n2)CCC3)C1 ZINC000822714955 606595313 /nfs/dbraw/zinc/59/53/13/606595313.db2.gz XOZKOSRAQWBJPG-JQWIXIFHSA-N -1 3 366.391 3.531 20 0 FHADHM Cc1cccnc1C(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000822370481 606628094 /nfs/dbraw/zinc/62/80/94/606628094.db2.gz ZDCCWXCUKZSYLV-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM CCCC[C@H](CCC)CNC(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000821041136 606632765 /nfs/dbraw/zinc/63/27/65/606632765.db2.gz ZQWCASBNXXFPSN-HNNXBMFYSA-N -1 3 358.490 3.615 20 0 FHADHM CCCC[C@H](CCC)CNC(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000821041136 606632766 /nfs/dbraw/zinc/63/27/66/606632766.db2.gz ZQWCASBNXXFPSN-HNNXBMFYSA-N -1 3 358.490 3.615 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)N(CC(C)C)C1CCCC1 ZINC000821407308 606657337 /nfs/dbraw/zinc/65/73/37/606657337.db2.gz QXFQGLRDVHALSN-UHFFFAOYSA-N -1 3 372.473 3.698 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)N(CC(C)C)C1CCCC1 ZINC000821407308 606657338 /nfs/dbraw/zinc/65/73/38/606657338.db2.gz QXFQGLRDVHALSN-UHFFFAOYSA-N -1 3 372.473 3.698 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)NC1[C@@H](C)CCC[C@@H]1C ZINC000820691392 606658748 /nfs/dbraw/zinc/65/87/48/606658748.db2.gz WYGVCIIOSBFYTI-GJZGRUSLSA-N -1 3 370.501 3.611 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)NC1[C@@H](C)CCC[C@@H]1C ZINC000820691392 606658749 /nfs/dbraw/zinc/65/87/49/606658749.db2.gz WYGVCIIOSBFYTI-GJZGRUSLSA-N -1 3 370.501 3.611 20 0 FHADHM CCCCc1ccc(NC(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)cc1 ZINC000821077362 606661266 /nfs/dbraw/zinc/66/12/66/606661266.db2.gz CEWPSDMUEFKVKT-UHFFFAOYSA-N -1 3 357.364 3.740 20 0 FHADHM CCCCc1ccc(NC(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)cc1 ZINC000821077362 606661267 /nfs/dbraw/zinc/66/12/67/606661267.db2.gz CEWPSDMUEFKVKT-UHFFFAOYSA-N -1 3 357.364 3.740 20 0 FHADHM CC(C)C[C@@H](NC(=O)c1c(F)cc(-c2nnn[n-]2)cc1F)c1ccccc1 ZINC000820054576 606665932 /nfs/dbraw/zinc/66/59/32/606665932.db2.gz BUHPYCOEEFDIEY-MRXNPFEDSA-N -1 3 371.391 3.662 20 0 FHADHM CC(C)C[C@@H](NC(=O)c1c(F)cc(-c2nn[n-]n2)cc1F)c1ccccc1 ZINC000820054576 606665933 /nfs/dbraw/zinc/66/59/33/606665933.db2.gz BUHPYCOEEFDIEY-MRXNPFEDSA-N -1 3 371.391 3.662 20 0 FHADHM Cc1ccc([C@@H](C)N(C)C(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)c(C)c1 ZINC000822228905 606669823 /nfs/dbraw/zinc/66/98/23/606669823.db2.gz IOPUMIKCINYKMM-GFCCVEGCSA-N -1 3 371.391 3.595 20 0 FHADHM Cc1ccc([C@@H](C)N(C)C(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)c(C)c1 ZINC000822228905 606669824 /nfs/dbraw/zinc/66/98/24/606669824.db2.gz IOPUMIKCINYKMM-GFCCVEGCSA-N -1 3 371.391 3.595 20 0 FHADHM CC[C@@H](C)Oc1ccc(NC(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)cc1 ZINC000820876432 606672640 /nfs/dbraw/zinc/67/26/40/606672640.db2.gz QERPWDPUGUWLNT-SNVBAGLBSA-N -1 3 373.363 3.575 20 0 FHADHM CC[C@@H](C)Oc1ccc(NC(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)cc1 ZINC000820876432 606672641 /nfs/dbraw/zinc/67/26/41/606672641.db2.gz QERPWDPUGUWLNT-SNVBAGLBSA-N -1 3 373.363 3.575 20 0 FHADHM Cc1ccccc1N(C(=O)c1c(F)cc(-c2nnn[n-]2)cc1F)C(C)C ZINC000822361666 606678580 /nfs/dbraw/zinc/67/85/80/606678580.db2.gz FIAIOPVRUAFQOP-UHFFFAOYSA-N -1 3 357.364 3.509 20 0 FHADHM Cc1ccccc1N(C(=O)c1c(F)cc(-c2nn[n-]n2)cc1F)C(C)C ZINC000822361666 606678581 /nfs/dbraw/zinc/67/85/81/606678581.db2.gz FIAIOPVRUAFQOP-UHFFFAOYSA-N -1 3 357.364 3.509 20 0 FHADHM CCCN(CC1CCCCC1)C(=O)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000821094262 606685120 /nfs/dbraw/zinc/68/51/20/606685120.db2.gz FLWJEFWKGCRWGU-UHFFFAOYSA-N -1 3 363.412 3.577 20 0 FHADHM CCCN(CC1CCCCC1)C(=O)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000821094262 606685121 /nfs/dbraw/zinc/68/51/21/606685121.db2.gz FLWJEFWKGCRWGU-UHFFFAOYSA-N -1 3 363.412 3.577 20 0 FHADHM CN(C(=O)CSCc1ccc(-c2nnn[n-]2)cc1)C1CCC(C)(C)CC1 ZINC000821570923 606691334 /nfs/dbraw/zinc/69/13/34/606691334.db2.gz RAYWKGIWTUSELK-UHFFFAOYSA-N -1 3 373.526 3.527 20 0 FHADHM CN(C(=O)CSCc1ccc(-c2nn[n-]n2)cc1)C1CCC(C)(C)CC1 ZINC000821570923 606691335 /nfs/dbraw/zinc/69/13/35/606691335.db2.gz RAYWKGIWTUSELK-UHFFFAOYSA-N -1 3 373.526 3.527 20 0 FHADHM O=C(N[C@@H](c1ccccc1)c1cccc(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000823139487 606694301 /nfs/dbraw/zinc/69/43/01/606694301.db2.gz GCDXREADEDKMPP-IBGZPJMESA-N -1 3 373.391 3.525 20 0 FHADHM O=C(N[C@@H](c1ccccc1)c1cccc(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000823139487 606694302 /nfs/dbraw/zinc/69/43/02/606694302.db2.gz GCDXREADEDKMPP-IBGZPJMESA-N -1 3 373.391 3.525 20 0 FHADHM C[C@@H](Nc1ccc(-c2nn[n-]n2)cc1F)c1cccc(N2CCCC2)c1 ZINC000820455718 606733016 /nfs/dbraw/zinc/73/30/16/606733016.db2.gz MNMTVOJOMQTHDL-CYBMUJFWSA-N -1 3 352.417 3.779 20 0 FHADHM C[C@@H](OC(=O)[C@H](C)OC1CCCCCC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820518677 606735807 /nfs/dbraw/zinc/73/58/07/606735807.db2.gz IWYYBXZFFTWULE-KGLIPLIRSA-N -1 3 358.442 3.599 20 0 FHADHM C[C@@H](OC(=O)[C@H](C)OC1CCCCCC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820518677 606735808 /nfs/dbraw/zinc/73/58/08/606735808.db2.gz IWYYBXZFFTWULE-KGLIPLIRSA-N -1 3 358.442 3.599 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccc(-n2cccc2)cc1 ZINC000823308732 606762221 /nfs/dbraw/zinc/76/22/21/606762221.db2.gz IUGMTIHLAYNOOO-UHFFFAOYSA-N -1 3 364.796 3.563 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccc(-n2cccc2)cc1 ZINC000823308732 606762223 /nfs/dbraw/zinc/76/22/23/606762223.db2.gz IUGMTIHLAYNOOO-UHFFFAOYSA-N -1 3 364.796 3.563 20 0 FHADHM CN(c1ccccc1NCc1ccc(F)c(-c2nnn[n-]2)c1)C1CCCC1 ZINC000821618909 606776722 /nfs/dbraw/zinc/77/67/22/606776722.db2.gz AVPCHYBCYJNNKK-UHFFFAOYSA-N -1 3 366.444 3.997 20 0 FHADHM CN(c1ccccc1NCc1ccc(F)c(-c2nn[n-]n2)c1)C1CCCC1 ZINC000821618909 606776724 /nfs/dbraw/zinc/77/67/24/606776724.db2.gz AVPCHYBCYJNNKK-UHFFFAOYSA-N -1 3 366.444 3.997 20 0 FHADHM Cc1ccc(C)c([C@H]2CCCN2C(=O)Nc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000822230319 606783372 /nfs/dbraw/zinc/78/33/72/606783372.db2.gz CMSFMEBQMUYIOW-GOSISDBHSA-N -1 3 362.437 3.853 20 0 FHADHM Cc1ccc(C)c([C@H]2CCCN2C(=O)Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000822230319 606783374 /nfs/dbraw/zinc/78/33/74/606783374.db2.gz CMSFMEBQMUYIOW-GOSISDBHSA-N -1 3 362.437 3.853 20 0 FHADHM CCn1c(COc2cc(Cl)ccc2-c2nnn[n-]2)nc2c1cccc2F ZINC000821563809 606784722 /nfs/dbraw/zinc/78/47/22/606784722.db2.gz GOXZUNDPAIZQMJ-UHFFFAOYSA-N -1 3 372.791 3.608 20 0 FHADHM CCn1c(COc2cc(Cl)ccc2-c2nn[n-]n2)nc2c1cccc2F ZINC000821563809 606784724 /nfs/dbraw/zinc/78/47/24/606784724.db2.gz GOXZUNDPAIZQMJ-UHFFFAOYSA-N -1 3 372.791 3.608 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1cc(F)cc(Cl)c1 ZINC000820120648 606786936 /nfs/dbraw/zinc/78/69/36/606786936.db2.gz HODVVWXKVFYCCV-UHFFFAOYSA-N -1 3 373.819 3.710 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1cc(F)cc(Cl)c1 ZINC000820120648 606786938 /nfs/dbraw/zinc/78/69/38/606786938.db2.gz HODVVWXKVFYCCV-UHFFFAOYSA-N -1 3 373.819 3.710 20 0 FHADHM CC[C@H](C)CS[C@H](C)C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2 ZINC000820870755 606795965 /nfs/dbraw/zinc/79/59/65/606795965.db2.gz YYIMFKQBLVLENP-VHSXEESVSA-N -1 3 365.528 3.523 20 0 FHADHM CC[C@H](C)CS[C@H](C)C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2 ZINC000820870755 606795967 /nfs/dbraw/zinc/79/59/67/606795967.db2.gz YYIMFKQBLVLENP-VHSXEESVSA-N -1 3 365.528 3.523 20 0 FHADHM CC[C@@H](C)CS[C@H](C)C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2 ZINC000820870753 606796127 /nfs/dbraw/zinc/79/61/27/606796127.db2.gz YYIMFKQBLVLENP-NXEZZACHSA-N -1 3 365.528 3.523 20 0 FHADHM CC[C@@H](C)CS[C@H](C)C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2 ZINC000820870753 606796129 /nfs/dbraw/zinc/79/61/29/606796129.db2.gz YYIMFKQBLVLENP-NXEZZACHSA-N -1 3 365.528 3.523 20 0 FHADHM C[C@H](SCC(=O)N(C)[C@@H]1CCCC[C@@H]1C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820549113 606827912 /nfs/dbraw/zinc/82/79/12/606827912.db2.gz KLRVRXQCQQKKHF-GRDNDAEWSA-N -1 3 373.526 3.698 20 0 FHADHM C[C@H](SCC(=O)N(C)[C@@H]1CCCC[C@@H]1C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820549113 606827914 /nfs/dbraw/zinc/82/79/14/606827914.db2.gz KLRVRXQCQQKKHF-GRDNDAEWSA-N -1 3 373.526 3.698 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)Nc1ccsc1 ZINC000820086853 606829462 /nfs/dbraw/zinc/82/94/62/606829462.db2.gz HBTURSIQJSULIT-UHFFFAOYSA-N -1 3 356.455 3.618 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)Nc1ccsc1 ZINC000820086853 606829463 /nfs/dbraw/zinc/82/94/63/606829463.db2.gz HBTURSIQJSULIT-UHFFFAOYSA-N -1 3 356.455 3.618 20 0 FHADHM Cc1ccc(-c2cncc(C(=O)Nc3ccc(F)cc3-c3nnn[n-]3)c2)cc1 ZINC000822213855 606867625 /nfs/dbraw/zinc/86/76/25/606867625.db2.gz DILGGIFAOBYZOE-UHFFFAOYSA-N -1 3 374.379 3.629 20 0 FHADHM Cc1ccc(-c2cncc(C(=O)Nc3ccc(F)cc3-c3nn[n-]n3)c2)cc1 ZINC000822213855 606867627 /nfs/dbraw/zinc/86/76/27/606867627.db2.gz DILGGIFAOBYZOE-UHFFFAOYSA-N -1 3 374.379 3.629 20 0 FHADHM CCC[C@H]1CCCN(C(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(C)C)C1 ZINC000821041124 606906077 /nfs/dbraw/zinc/90/60/77/606906077.db2.gz ZJTZWXBBXRDOIE-AWEZNQCLSA-N -1 3 372.473 3.698 20 0 FHADHM CCC[C@H]1CCCN(C(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(C)C)C1 ZINC000821041124 606906079 /nfs/dbraw/zinc/90/60/79/606906079.db2.gz ZJTZWXBBXRDOIE-AWEZNQCLSA-N -1 3 372.473 3.698 20 0 FHADHM COc1ccc(CNc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)cc1F ZINC000821821569 606919503 /nfs/dbraw/zinc/91/95/03/606919503.db2.gz LFFUTMCBIMRBMA-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM COc1ccc(CNc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)cc1F ZINC000821821569 606919504 /nfs/dbraw/zinc/91/95/04/606919504.db2.gz LFFUTMCBIMRBMA-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM CC[C@]1(C)CCN(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)C1 ZINC000820951023 606955020 /nfs/dbraw/zinc/95/50/20/606955020.db2.gz VCYXDASYWPKNRT-OAHLLOKOSA-N -1 3 368.363 3.539 20 0 FHADHM CC[C@]1(C)CCN(C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)C1 ZINC000820951023 606955022 /nfs/dbraw/zinc/95/50/22/606955022.db2.gz VCYXDASYWPKNRT-OAHLLOKOSA-N -1 3 368.363 3.539 20 0 FHADHM C[C@H](CC(=O)N(C)c1cc(Cl)ccc1-c1nnn[n-]1)c1ccccc1F ZINC000820219726 606960473 /nfs/dbraw/zinc/96/04/73/606960473.db2.gz JUCIETUOQCZHTB-LLVKDONJSA-N -1 3 373.819 3.816 20 0 FHADHM C[C@H](CC(=O)N(C)c1cc(Cl)ccc1-c1nn[n-]n1)c1ccccc1F ZINC000820219726 606960475 /nfs/dbraw/zinc/96/04/75/606960475.db2.gz JUCIETUOQCZHTB-LLVKDONJSA-N -1 3 373.819 3.816 20 0 FHADHM CN(C(=O)c1ccc2c(c1)CCCC2)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821574767 606963323 /nfs/dbraw/zinc/96/33/23/606963323.db2.gz WGSGLJKQNHATBH-UHFFFAOYSA-N -1 3 367.840 3.676 20 0 FHADHM CN(C(=O)c1ccc2c(c1)CCCC2)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821574767 606963324 /nfs/dbraw/zinc/96/33/24/606963324.db2.gz WGSGLJKQNHATBH-UHFFFAOYSA-N -1 3 367.840 3.676 20 0 FHADHM CC[C@H](Cc1ccccc1)C(=O)N(C)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000820913847 606964142 /nfs/dbraw/zinc/96/41/42/606964142.db2.gz KRAAEHSWKOXBTI-CQSZACIVSA-N -1 3 369.856 3.752 20 0 FHADHM CC[C@H](Cc1ccccc1)C(=O)N(C)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000820913847 606964143 /nfs/dbraw/zinc/96/41/43/606964143.db2.gz KRAAEHSWKOXBTI-CQSZACIVSA-N -1 3 369.856 3.752 20 0 FHADHM CC[C@@H](Cc1ccccc1)C(=O)N(C)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000820913846 606964185 /nfs/dbraw/zinc/96/41/85/606964185.db2.gz KRAAEHSWKOXBTI-AWEZNQCLSA-N -1 3 369.856 3.752 20 0 FHADHM CC[C@@H](Cc1ccccc1)C(=O)N(C)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000820913846 606964187 /nfs/dbraw/zinc/96/41/87/606964187.db2.gz KRAAEHSWKOXBTI-AWEZNQCLSA-N -1 3 369.856 3.752 20 0 FHADHM CCCNc1ccc(Cl)cc1NC(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000821128203 606969356 /nfs/dbraw/zinc/96/93/56/606969356.db2.gz RNTFHBBKCKSIAE-UHFFFAOYSA-N -1 3 356.817 3.594 20 0 FHADHM CCCNc1ccc(Cl)cc1NC(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC000821128203 606969358 /nfs/dbraw/zinc/96/93/58/606969358.db2.gz RNTFHBBKCKSIAE-UHFFFAOYSA-N -1 3 356.817 3.594 20 0 FHADHM O=C(CC/C=C/c1ccccc1)OCc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000822955305 607000533 /nfs/dbraw/zinc/00/05/33/607000533.db2.gz PHTWWDIJGOPINB-XBXARRHUSA-N -1 3 352.369 3.543 20 0 FHADHM O=C(CC/C=C/c1ccccc1)OCc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000822955305 607000534 /nfs/dbraw/zinc/00/05/34/607000534.db2.gz PHTWWDIJGOPINB-XBXARRHUSA-N -1 3 352.369 3.543 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NC(=O)Nc1cc(F)cc(F)c1 ZINC000820152301 607009248 /nfs/dbraw/zinc/00/92/48/607009248.db2.gz XJRRCVWXJQMSEN-UHFFFAOYSA-N -1 3 374.351 3.576 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NC(=O)Nc1cc(F)cc(F)c1 ZINC000820152301 607009249 /nfs/dbraw/zinc/00/92/49/607009249.db2.gz XJRRCVWXJQMSEN-UHFFFAOYSA-N -1 3 374.351 3.576 20 0 FHADHM Cc1cccc(NC(=O)[C@H](C)Sc2cccc(-c3nnn[n-]3)c2)c1C ZINC000822323651 607012397 /nfs/dbraw/zinc/01/23/97/607012397.db2.gz LPSCGLJABADBBA-ZDUSSCGKSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1cccc(NC(=O)[C@H](C)Sc2cccc(-c3nn[n-]n3)c2)c1C ZINC000822323651 607012398 /nfs/dbraw/zinc/01/23/98/607012398.db2.gz LPSCGLJABADBBA-ZDUSSCGKSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1cc(Cl)ccc1C(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C(C)C ZINC000822202251 607013033 /nfs/dbraw/zinc/01/30/33/607013033.db2.gz SHBJKJOKIJRLCY-UHFFFAOYSA-N -1 3 369.856 3.879 20 0 FHADHM Cc1cc(Cl)ccc1C(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C(C)C ZINC000822202251 607013034 /nfs/dbraw/zinc/01/30/34/607013034.db2.gz SHBJKJOKIJRLCY-UHFFFAOYSA-N -1 3 369.856 3.879 20 0 FHADHM Cc1cc(Cl)ccc1NC(=O)[C@H](C)Sc1cccc(-c2nnn[n-]2)c1 ZINC000822202397 607013965 /nfs/dbraw/zinc/01/39/65/607013965.db2.gz YJSAZLUXPQNOCM-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM Cc1cc(Cl)ccc1NC(=O)[C@H](C)Sc1cccc(-c2nn[n-]n2)c1 ZINC000822202397 607013967 /nfs/dbraw/zinc/01/39/67/607013967.db2.gz YJSAZLUXPQNOCM-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM Cc1ccc(-c2nnc(CSc3cccc(-c4nnn[n-]4)c3)o2)cc1 ZINC000822214087 607014141 /nfs/dbraw/zinc/01/41/41/607014141.db2.gz OWFKWXDPJJASEC-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM Cc1ccc(-c2nnc(CSc3cccc(-c4nn[n-]n4)c3)o2)cc1 ZINC000822214087 607014143 /nfs/dbraw/zinc/01/41/43/607014143.db2.gz OWFKWXDPJJASEC-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM Cc1sc(NC(=O)CSc2cccc(-c3nnn[n-]3)c2)c(C)c1C ZINC000822563791 607015642 /nfs/dbraw/zinc/01/56/42/607015642.db2.gz OXKAVAHFVBBUGY-UHFFFAOYSA-N -1 3 359.480 3.584 20 0 FHADHM Cc1sc(NC(=O)CSc2cccc(-c3nn[n-]n3)c2)c(C)c1C ZINC000822563791 607015644 /nfs/dbraw/zinc/01/56/44/607015644.db2.gz OXKAVAHFVBBUGY-UHFFFAOYSA-N -1 3 359.480 3.584 20 0 FHADHM CCOc1cc(Cl)ccc1NC(=S)Nc1ccccc1-c1nnn[n-]1 ZINC000821394822 607023324 /nfs/dbraw/zinc/02/33/24/607023324.db2.gz OCHNKLWBXRPMEL-UHFFFAOYSA-N -1 3 374.857 3.728 20 0 FHADHM CCOc1cc(Cl)ccc1NC(=S)Nc1ccccc1-c1nn[n-]n1 ZINC000821394822 607023325 /nfs/dbraw/zinc/02/33/25/607023325.db2.gz OCHNKLWBXRPMEL-UHFFFAOYSA-N -1 3 374.857 3.728 20 0 FHADHM Cc1ccc(-c2nc(COc3cc(-c4nnn[n-]4)ccc3C)cs2)o1 ZINC000822213813 607027574 /nfs/dbraw/zinc/02/75/74/607027574.db2.gz BLIIXRMDJGEBJP-UHFFFAOYSA-N -1 3 353.407 3.779 20 0 FHADHM Cc1ccc(-c2nc(COc3cc(-c4nn[n-]n4)ccc3C)cs2)o1 ZINC000822213813 607027576 /nfs/dbraw/zinc/02/75/76/607027576.db2.gz BLIIXRMDJGEBJP-UHFFFAOYSA-N -1 3 353.407 3.779 20 0 FHADHM Cc1cc(C(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(C)C)ccc1Cl ZINC000822175964 607032956 /nfs/dbraw/zinc/03/29/56/607032956.db2.gz CIKTVYQYAIDSTN-UHFFFAOYSA-N -1 3 371.828 3.868 20 0 FHADHM Cc1cc(C(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(C)C)ccc1Cl ZINC000822175964 607032958 /nfs/dbraw/zinc/03/29/58/607032958.db2.gz CIKTVYQYAIDSTN-UHFFFAOYSA-N -1 3 371.828 3.868 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)c(CSC[C@H]2OCCc3ccccc32)c1 ZINC000822758482 607035829 /nfs/dbraw/zinc/03/58/29/607035829.db2.gz PPWHZLHFYKPBEL-QGZVFWFLSA-N -1 3 356.426 3.553 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)c(CSC[C@H]2OCCc3ccccc32)c1 ZINC000822758482 607035830 /nfs/dbraw/zinc/03/58/30/607035830.db2.gz PPWHZLHFYKPBEL-QGZVFWFLSA-N -1 3 356.426 3.553 20 0 FHADHM COc1ccc(Cl)cc1[C@@H](C)NCc1ccc(-c2nnn[n-]2)cc1F ZINC000821824138 607059341 /nfs/dbraw/zinc/05/93/41/607059341.db2.gz HXCOGXJBFPJQCF-SNVBAGLBSA-N -1 3 361.808 3.519 20 0 FHADHM COc1ccc(Cl)cc1[C@@H](C)NCc1ccc(-c2nn[n-]n2)cc1F ZINC000821824138 607059343 /nfs/dbraw/zinc/05/93/43/607059343.db2.gz HXCOGXJBFPJQCF-SNVBAGLBSA-N -1 3 361.808 3.519 20 0 FHADHM C[C@@H](Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccccc1-n1cccn1 ZINC000820456321 607118849 /nfs/dbraw/zinc/11/88/49/607118849.db2.gz SLZPGTJOERGMKH-GFCCVEGCSA-N -1 3 365.828 3.879 20 0 FHADHM C[C@@H](Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccccc1-n1cccn1 ZINC000820456321 607118851 /nfs/dbraw/zinc/11/88/51/607118851.db2.gz SLZPGTJOERGMKH-GFCCVEGCSA-N -1 3 365.828 3.879 20 0 FHADHM COc1cccc2c1CC[C@@H]2Nc1nc2ccccc2cc1-c1nnn[n-]1 ZINC000821877647 607119784 /nfs/dbraw/zinc/11/97/84/607119784.db2.gz ORODLXFRXIWFCB-KRWDZBQOSA-N -1 3 358.405 3.523 20 0 FHADHM COc1cccc2c1CC[C@@H]2Nc1nc2ccccc2cc1-c1nn[n-]n1 ZINC000821877647 607119786 /nfs/dbraw/zinc/11/97/86/607119786.db2.gz ORODLXFRXIWFCB-KRWDZBQOSA-N -1 3 358.405 3.523 20 0 FHADHM C[C@@H](OC(=O)/C=C\SCc1ccco1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488897 607131481 /nfs/dbraw/zinc/13/14/81/607131481.db2.gz WGLDHCNHTQLKSP-VPUINMBXSA-N -1 3 356.407 3.511 20 0 FHADHM C[C@@H](OC(=O)/C=C\SCc1ccco1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488897 607131483 /nfs/dbraw/zinc/13/14/83/607131483.db2.gz WGLDHCNHTQLKSP-VPUINMBXSA-N -1 3 356.407 3.511 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)c2cc(C)c(F)cc2Cl)s1 ZINC000821465300 607144426 /nfs/dbraw/zinc/14/44/26/607144426.db2.gz FHDATYWLHAYODI-UHFFFAOYSA-N -1 3 365.821 3.844 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)c2cc(C)c(F)cc2Cl)s1 ZINC000821465300 607144428 /nfs/dbraw/zinc/14/44/28/607144428.db2.gz FHDATYWLHAYODI-UHFFFAOYSA-N -1 3 365.821 3.844 20 0 FHADHM CC(C)CC[C@@H]1CCCN1C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820072290 607152786 /nfs/dbraw/zinc/15/27/86/607152786.db2.gz DTVGFJPZZWAPGT-PBHICJAKSA-N -1 3 356.474 3.538 20 0 FHADHM CC(C)CC[C@@H]1CCCN1C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820072290 607152788 /nfs/dbraw/zinc/15/27/88/607152788.db2.gz DTVGFJPZZWAPGT-PBHICJAKSA-N -1 3 356.474 3.538 20 0 FHADHM CCC[C@H](C)[C@@H]1CCCN1C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821014206 607152941 /nfs/dbraw/zinc/15/29/41/607152941.db2.gz BTHPAJHDVGHHAA-VBQJREDUSA-N -1 3 356.474 3.538 20 0 FHADHM CCC[C@H](C)[C@@H]1CCCN1C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821014206 607152942 /nfs/dbraw/zinc/15/29/42/607152942.db2.gz BTHPAJHDVGHHAA-VBQJREDUSA-N -1 3 356.474 3.538 20 0 FHADHM COC(=O)c1oc([C@H](C)Sc2ccc(-c3nnn[n-]3)cc2F)cc1C ZINC000821671411 607169986 /nfs/dbraw/zinc/16/99/86/607169986.db2.gz VDQBZOPUQYJLGS-VIFPVBQESA-N -1 3 362.386 3.547 20 0 FHADHM COC(=O)c1oc([C@H](C)Sc2ccc(-c3nn[n-]n3)cc2F)cc1C ZINC000821671411 607169987 /nfs/dbraw/zinc/16/99/87/607169987.db2.gz VDQBZOPUQYJLGS-VIFPVBQESA-N -1 3 362.386 3.547 20 0 FHADHM FC(F)(F)c1ccc(N[C@@H]2CCOc3ccccc32)c(-c2nnn[n-]2)c1 ZINC000822723795 607173120 /nfs/dbraw/zinc/17/31/20/607173120.db2.gz ONPAAKIYMBADHM-CQSZACIVSA-N -1 3 361.327 3.821 20 0 FHADHM FC(F)(F)c1ccc(N[C@@H]2CCOc3ccccc32)c(-c2nn[n-]n2)c1 ZINC000822723795 607173121 /nfs/dbraw/zinc/17/31/21/607173121.db2.gz ONPAAKIYMBADHM-CQSZACIVSA-N -1 3 361.327 3.821 20 0 FHADHM Cc1cccc(-c2cncc(C(=O)Nc3cc(-c4nnn[n-]4)ccc3C)c2)c1 ZINC000822284091 607177490 /nfs/dbraw/zinc/17/74/90/607177490.db2.gz JHONLSBRJDVFBB-UHFFFAOYSA-N -1 3 370.416 3.798 20 0 FHADHM Cc1cccc(-c2cncc(C(=O)Nc3cc(-c4nn[n-]n4)ccc3C)c2)c1 ZINC000822284091 607177491 /nfs/dbraw/zinc/17/74/91/607177491.db2.gz JHONLSBRJDVFBB-UHFFFAOYSA-N -1 3 370.416 3.798 20 0 FHADHM Cc1ccc(OCCC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)c(C)c1 ZINC000822262922 607190127 /nfs/dbraw/zinc/19/01/27/607190127.db2.gz GPCNSJQDVWDXFI-UHFFFAOYSA-N -1 3 371.828 3.545 20 0 FHADHM Cc1ccc(OCCC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)c(C)c1 ZINC000822262922 607190128 /nfs/dbraw/zinc/19/01/28/607190128.db2.gz GPCNSJQDVWDXFI-UHFFFAOYSA-N -1 3 371.828 3.545 20 0 FHADHM CC(=CC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccc(F)cc1 ZINC000819766232 607191286 /nfs/dbraw/zinc/19/12/86/607191286.db2.gz WEIXYGFUTINJEU-NTMALXAHSA-N -1 3 357.776 3.701 20 0 FHADHM CC(=CC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccc(F)cc1 ZINC000819766232 607191287 /nfs/dbraw/zinc/19/12/87/607191287.db2.gz WEIXYGFUTINJEU-NTMALXAHSA-N -1 3 357.776 3.701 20 0 FHADHM O=C(Cc1ccc(-c2nnn[n-]2)cc1)Nc1cc(C(F)F)ccc1Cl ZINC000823077938 607192841 /nfs/dbraw/zinc/19/28/41/607192841.db2.gz CUSHKTGTFMZOBA-UHFFFAOYSA-N -1 3 363.755 3.639 20 0 FHADHM O=C(Cc1ccc(-c2nn[n-]n2)cc1)Nc1cc(C(F)F)ccc1Cl ZINC000823077938 607192842 /nfs/dbraw/zinc/19/28/42/607192842.db2.gz CUSHKTGTFMZOBA-UHFFFAOYSA-N -1 3 363.755 3.639 20 0 FHADHM CC[C@@](C)(NC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccccc1 ZINC000820852371 607194660 /nfs/dbraw/zinc/19/46/60/607194660.db2.gz ACFBNHOLKJWCHH-GOSISDBHSA-N -1 3 370.844 3.967 20 0 FHADHM CC[C@@](C)(NC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccccc1 ZINC000820852371 607194661 /nfs/dbraw/zinc/19/46/61/607194661.db2.gz ACFBNHOLKJWCHH-GOSISDBHSA-N -1 3 370.844 3.967 20 0 FHADHM CC(C)(C)C[C@@H]1CCCN1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000819906084 607195612 /nfs/dbraw/zinc/19/56/12/607195612.db2.gz CJPXYUOTNQUPOO-LBPRGKRZSA-N -1 3 362.865 3.953 20 0 FHADHM CC(C)(C)C[C@@H]1CCCN1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000819906084 607195613 /nfs/dbraw/zinc/19/56/13/607195613.db2.gz CJPXYUOTNQUPOO-LBPRGKRZSA-N -1 3 362.865 3.953 20 0 FHADHM CCC[C@]1(C)CCCN(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)C1 ZINC000821026803 607199227 /nfs/dbraw/zinc/19/92/27/607199227.db2.gz CNEHHRYSZBOFTG-QGZVFWFLSA-N -1 3 362.865 3.954 20 0 FHADHM CCC[C@]1(C)CCCN(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)C1 ZINC000821026803 607199228 /nfs/dbraw/zinc/19/92/28/607199228.db2.gz CNEHHRYSZBOFTG-QGZVFWFLSA-N -1 3 362.865 3.954 20 0 FHADHM CCN(CCc1ccccc1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000821215819 607199993 /nfs/dbraw/zinc/19/99/93/607199993.db2.gz VQVSDBGPXWDMNR-UHFFFAOYSA-N -1 3 370.844 3.617 20 0 FHADHM CCN(CCc1ccccc1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000821215819 607199994 /nfs/dbraw/zinc/19/99/94/607199994.db2.gz VQVSDBGPXWDMNR-UHFFFAOYSA-N -1 3 370.844 3.617 20 0 FHADHM CCCCCN(C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)C(C)C ZINC000821055721 607201418 /nfs/dbraw/zinc/20/14/18/607201418.db2.gz FESMZFQJUQTLFE-UHFFFAOYSA-N -1 3 350.854 3.953 20 0 FHADHM CCCCCN(C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)C(C)C ZINC000821055721 607201419 /nfs/dbraw/zinc/20/14/19/607201419.db2.gz FESMZFQJUQTLFE-UHFFFAOYSA-N -1 3 350.854 3.953 20 0 FHADHM CCc1cc(C(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(C)C)oc1CC ZINC000821470424 607210190 /nfs/dbraw/zinc/21/01/90/607210190.db2.gz OUMFMDNSZYLQMX-UHFFFAOYSA-N -1 3 369.425 3.624 20 0 FHADHM CCc1cc(C(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(C)C)oc1CC ZINC000821470424 607210191 /nfs/dbraw/zinc/21/01/91/607210191.db2.gz OUMFMDNSZYLQMX-UHFFFAOYSA-N -1 3 369.425 3.624 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)cc1NCc1cc2ccccc2[nH]1 ZINC000822723312 607228559 /nfs/dbraw/zinc/22/85/59/607228559.db2.gz DEMXONNKNFOFBQ-UHFFFAOYSA-N -1 3 358.327 3.979 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)cc1NCc1cc2ccccc2[nH]1 ZINC000822723312 607228560 /nfs/dbraw/zinc/22/85/60/607228560.db2.gz DEMXONNKNFOFBQ-UHFFFAOYSA-N -1 3 358.327 3.979 20 0 FHADHM O=C(C=Cc1ccc(Cl)s1)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822929439 607242512 /nfs/dbraw/zinc/24/25/12/607242512.db2.gz UJIVOPPMFMJPPK-ZZXKWVIFSA-N -1 3 366.233 3.887 20 0 FHADHM O=C(C=Cc1ccc(Cl)s1)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822929439 607242513 /nfs/dbraw/zinc/24/25/13/607242513.db2.gz UJIVOPPMFMJPPK-ZZXKWVIFSA-N -1 3 366.233 3.887 20 0 FHADHM CC[C@@H](Oc1ccccc1C)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820939542 607243474 /nfs/dbraw/zinc/24/34/74/607243474.db2.gz WCZGQTIBAZYWHK-OAHLLOKOSA-N -1 3 371.828 3.625 20 0 FHADHM CC[C@@H](Oc1ccccc1C)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820939542 607243475 /nfs/dbraw/zinc/24/34/75/607243475.db2.gz WCZGQTIBAZYWHK-OAHLLOKOSA-N -1 3 371.828 3.625 20 0 FHADHM CCc1c(C)sc(NC(=O)Cc2cccc(CC)c2)c1-c1nnn[n-]1 ZINC000825723005 607785743 /nfs/dbraw/zinc/78/57/43/607785743.db2.gz QJNJMOLCNJSMQD-UHFFFAOYSA-N -1 3 355.467 3.543 20 0 FHADHM CCc1c(C)sc(NC(=O)Cc2cccc(CC)c2)c1-c1nn[n-]n1 ZINC000825723005 607785744 /nfs/dbraw/zinc/78/57/44/607785744.db2.gz QJNJMOLCNJSMQD-UHFFFAOYSA-N -1 3 355.467 3.543 20 0 FHADHM CCCc1sc(C(=O)N(C)c2ccccc2-c2nnn[n-]2)cc1CC ZINC000825351395 607786402 /nfs/dbraw/zinc/78/64/02/607786402.db2.gz CVYPQBJAFVXZAR-UHFFFAOYSA-N -1 3 355.467 3.720 20 0 FHADHM CCCc1sc(C(=O)N(C)c2ccccc2-c2nn[n-]n2)cc1CC ZINC000825351395 607786403 /nfs/dbraw/zinc/78/64/03/607786403.db2.gz CVYPQBJAFVXZAR-UHFFFAOYSA-N -1 3 355.467 3.720 20 0 FHADHM C[C@@H](Sc1ccc(Cl)cc1)C(=O)N(C)c1ccccc1-c1nnn[n-]1 ZINC000824753144 607788618 /nfs/dbraw/zinc/78/86/18/607788618.db2.gz CPOLNORZXAIVCB-LLVKDONJSA-N -1 3 373.869 3.664 20 0 FHADHM C[C@@H](Sc1ccc(Cl)cc1)C(=O)N(C)c1ccccc1-c1nn[n-]n1 ZINC000824753144 607788619 /nfs/dbraw/zinc/78/86/19/607788619.db2.gz CPOLNORZXAIVCB-LLVKDONJSA-N -1 3 373.869 3.664 20 0 FHADHM CN(C(=O)[C@H]1C[C@H]1c1ccc2ccccc2c1)c1ccccc1-c1nnn[n-]1 ZINC000825812847 607789114 /nfs/dbraw/zinc/78/91/14/607789114.db2.gz VXFUEHUYCZVRIQ-OALUTQOASA-N -1 3 369.428 3.786 20 0 FHADHM CN(C(=O)[C@H]1C[C@H]1c1ccc2ccccc2c1)c1ccccc1-c1nn[n-]n1 ZINC000825812847 607789115 /nfs/dbraw/zinc/78/91/15/607789115.db2.gz VXFUEHUYCZVRIQ-OALUTQOASA-N -1 3 369.428 3.786 20 0 FHADHM Cc1ccc(Cl)cc1C(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(C)C ZINC000826288993 607794860 /nfs/dbraw/zinc/79/48/60/607794860.db2.gz FYNIZEOXVZZBSN-UHFFFAOYSA-N -1 3 371.828 3.868 20 0 FHADHM Cc1ccc(Cl)cc1C(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(C)C ZINC000826288993 607794861 /nfs/dbraw/zinc/79/48/61/607794861.db2.gz FYNIZEOXVZZBSN-UHFFFAOYSA-N -1 3 371.828 3.868 20 0 FHADHM CCN(C(=O)C[C@@H](C)c1ccccc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000825367985 607796460 /nfs/dbraw/zinc/79/64/60/607796460.db2.gz YYXJNNZHWUMAME-CYBMUJFWSA-N -1 3 353.401 3.553 20 0 FHADHM CCN(C(=O)C[C@@H](C)c1ccccc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000825367985 607796461 /nfs/dbraw/zinc/79/64/61/607796461.db2.gz YYXJNNZHWUMAME-CYBMUJFWSA-N -1 3 353.401 3.553 20 0 FHADHM CCN(C(=O)c1oc2c(cccc2C)c1C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825390758 607796967 /nfs/dbraw/zinc/79/69/67/607796967.db2.gz LTPPLZGGQWLNGT-UHFFFAOYSA-N -1 3 361.405 3.896 20 0 FHADHM CCN(C(=O)c1oc2c(cccc2C)c1C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825390758 607796968 /nfs/dbraw/zinc/79/69/68/607796968.db2.gz LTPPLZGGQWLNGT-UHFFFAOYSA-N -1 3 361.405 3.896 20 0 FHADHM CCN(C(=O)c1cncc(-c2ccccc2)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825390198 607798558 /nfs/dbraw/zinc/79/85/58/607798558.db2.gz AMPBHWKHIOANLM-UHFFFAOYSA-N -1 3 370.416 3.595 20 0 FHADHM CCN(C(=O)c1cncc(-c2ccccc2)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825390198 607798559 /nfs/dbraw/zinc/79/85/59/607798559.db2.gz AMPBHWKHIOANLM-UHFFFAOYSA-N -1 3 370.416 3.595 20 0 FHADHM CC(C)Oc1ccc(NCc2cnoc2-c2ccco2)cc1-c1nnn[n-]1 ZINC000824329676 607813754 /nfs/dbraw/zinc/81/37/54/607813754.db2.gz UFMFCEGLTMEZTQ-UHFFFAOYSA-N -1 3 366.381 3.514 20 0 FHADHM CC(C)Oc1ccc(NCc2cnoc2-c2ccco2)cc1-c1nn[n-]n1 ZINC000824329676 607813755 /nfs/dbraw/zinc/81/37/55/607813755.db2.gz UFMFCEGLTMEZTQ-UHFFFAOYSA-N -1 3 366.381 3.514 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)CCCSC(C)(C)C ZINC000825621688 607816793 /nfs/dbraw/zinc/81/67/93/607816793.db2.gz XLRMSRZITWOFIC-UHFFFAOYSA-N -1 3 363.487 3.516 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)CCCSC(C)(C)C ZINC000825621688 607816794 /nfs/dbraw/zinc/81/67/94/607816794.db2.gz XLRMSRZITWOFIC-UHFFFAOYSA-N -1 3 363.487 3.516 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1N1CCC(Oc2ccccc2Cl)CC1 ZINC000826372409 607820440 /nfs/dbraw/zinc/82/04/40/607820440.db2.gz UVWLEYCXQMBKCT-UHFFFAOYSA-N -1 3 373.819 3.707 20 0 FHADHM CC[C@@H](Nc1ccc2cc(-c3nnn[n-]3)ccc2n1)c1ccc(OC)cc1 ZINC000825146537 607838635 /nfs/dbraw/zinc/83/86/35/607838635.db2.gz CRCKYBUUOHZQIH-QGZVFWFLSA-N -1 3 360.421 3.987 20 0 FHADHM CC[C@@H](Nc1ccc2cc(-c3nn[n-]n3)ccc2n1)c1ccc(OC)cc1 ZINC000825146537 607838636 /nfs/dbraw/zinc/83/86/36/607838636.db2.gz CRCKYBUUOHZQIH-QGZVFWFLSA-N -1 3 360.421 3.987 20 0 FHADHM C[C@H](Sc1ccc(-c2nnn[n-]2)cc1Cl)C(=O)Nc1ccccc1 ZINC000824754657 607844498 /nfs/dbraw/zinc/84/44/98/607844498.db2.gz JAKDEJSQFQSNPI-JTQLQIEISA-N -1 3 359.842 3.639 20 0 FHADHM C[C@H](Sc1ccc(-c2nn[n-]n2)cc1Cl)C(=O)Nc1ccccc1 ZINC000824754657 607844499 /nfs/dbraw/zinc/84/44/99/607844499.db2.gz JAKDEJSQFQSNPI-JTQLQIEISA-N -1 3 359.842 3.639 20 0 FHADHM CC1(NC(=O)Nc2ccc(Oc3ccccc3-c3nnn[n-]3)cc2)CCC1 ZINC000824831556 607856363 /nfs/dbraw/zinc/85/63/63/607856363.db2.gz PJUGWWSSYDFTSA-UHFFFAOYSA-N -1 3 364.409 3.723 20 0 FHADHM CC1(NC(=O)Nc2ccc(Oc3ccccc3-c3nn[n-]n3)cc2)CCC1 ZINC000824831556 607856364 /nfs/dbraw/zinc/85/63/64/607856364.db2.gz PJUGWWSSYDFTSA-UHFFFAOYSA-N -1 3 364.409 3.723 20 0 FHADHM CCN(C(=O)c1cccc(Cl)c1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825386172 607879109 /nfs/dbraw/zinc/87/91/09/607879109.db2.gz ZVWKPWMXPKWQIE-UHFFFAOYSA-N -1 3 362.220 3.840 20 0 FHADHM CCN(C(=O)c1cccc(Cl)c1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825386172 607879110 /nfs/dbraw/zinc/87/91/10/607879110.db2.gz ZVWKPWMXPKWQIE-UHFFFAOYSA-N -1 3 362.220 3.840 20 0 FHADHM CCN(C(=O)c1cc(C)cc(C)c1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825379937 607879235 /nfs/dbraw/zinc/87/92/35/607879235.db2.gz MPDPBBMXKUMAFS-UHFFFAOYSA-N -1 3 355.829 3.804 20 0 FHADHM CCN(C(=O)c1cc(C)cc(C)c1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825379937 607879236 /nfs/dbraw/zinc/87/92/36/607879236.db2.gz MPDPBBMXKUMAFS-UHFFFAOYSA-N -1 3 355.829 3.804 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000823943921 607881036 /nfs/dbraw/zinc/88/10/36/607881036.db2.gz VFAOMYIMLWIBSF-XZHRJIJLSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000823943921 607881037 /nfs/dbraw/zinc/88/10/37/607881037.db2.gz VFAOMYIMLWIBSF-XZHRJIJLSA-N -1 3 367.840 3.801 20 0 FHADHM CC(C)[C@@H](C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(F)cc1 ZINC000824470333 607905882 /nfs/dbraw/zinc/90/58/82/607905882.db2.gz HPXNIUKLBQJUAE-FZKQIMNGSA-N -1 3 367.428 3.623 20 0 FHADHM CC(C)[C@@H](C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(F)cc1 ZINC000824470333 607905883 /nfs/dbraw/zinc/90/58/83/607905883.db2.gz HPXNIUKLBQJUAE-FZKQIMNGSA-N -1 3 367.428 3.623 20 0 FHADHM CC(C)c1cc(C(=O)Nc2cc(C(C)(C)C)sc2-c2nnn[n-]2)on1 ZINC000824341789 607929244 /nfs/dbraw/zinc/92/92/44/607929244.db2.gz CHWFRIBUIVLZNQ-UHFFFAOYSA-N -1 3 360.443 3.589 20 0 FHADHM CC(C)(C)OC(=O)Nc1ccc(Sc2ccc(-c3nnn[n-]3)cn2)cc1 ZINC000824113970 607936379 /nfs/dbraw/zinc/93/63/79/607936379.db2.gz HIRXPWFURISVDE-UHFFFAOYSA-N -1 3 370.438 3.760 20 0 FHADHM CC(C)(C)OC(=O)Nc1ccc(Sc2ccc(-c3nn[n-]n3)cn2)cc1 ZINC000824113970 607936380 /nfs/dbraw/zinc/93/63/80/607936380.db2.gz HIRXPWFURISVDE-UHFFFAOYSA-N -1 3 370.438 3.760 20 0 FHADHM CC[C@@H](CC(=O)N1CCc2ccc(-c3nnn[n-]3)cc21)c1ccc(C)cc1 ZINC000825080861 607946155 /nfs/dbraw/zinc/94/61/55/607946155.db2.gz CDIUPZRZHVSPHL-HNNXBMFYSA-N -1 3 361.449 3.648 20 0 FHADHM CC[C@@H](CC(=O)N1CCc2ccc(-c3nn[n-]n3)cc21)c1ccc(C)cc1 ZINC000825080861 607946156 /nfs/dbraw/zinc/94/61/56/607946156.db2.gz CDIUPZRZHVSPHL-HNNXBMFYSA-N -1 3 361.449 3.648 20 0 FHADHM CCC(=O)c1cc(C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)ccc1F ZINC000825034000 607962232 /nfs/dbraw/zinc/96/22/32/607962232.db2.gz CEKIGGZDBGFVPL-UHFFFAOYSA-N -1 3 373.775 3.504 20 0 FHADHM CCC(=O)c1cc(C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)ccc1F ZINC000825034000 607962233 /nfs/dbraw/zinc/96/22/33/607962233.db2.gz CEKIGGZDBGFVPL-UHFFFAOYSA-N -1 3 373.775 3.504 20 0 FHADHM CCC(=O)c1cc(C(=O)Nc2sc(C)c(C)c2-c2nnn[n-]2)ccc1F ZINC000825035235 607962241 /nfs/dbraw/zinc/96/22/41/607962241.db2.gz YNUGWPDWSULVND-UHFFFAOYSA-N -1 3 373.413 3.529 20 0 FHADHM CCC(=O)c1cc(C(=O)Nc2sc(C)c(C)c2-c2nn[n-]n2)ccc1F ZINC000825035235 607962242 /nfs/dbraw/zinc/96/22/42/607962242.db2.gz YNUGWPDWSULVND-UHFFFAOYSA-N -1 3 373.413 3.529 20 0 FHADHM CC(C)C[C@H]1CCN(C(=O)c2c(Cl)cc(-c3nnn[n-]3)cc2Cl)C1 ZINC000824244860 607963994 /nfs/dbraw/zinc/96/39/94/607963994.db2.gz VIAWLQHJLINVMC-SNVBAGLBSA-N -1 3 368.268 3.682 20 0 FHADHM CC(C)C[C@H]1CCN(C(=O)c2c(Cl)cc(-c3nn[n-]n3)cc2Cl)C1 ZINC000824244860 607963995 /nfs/dbraw/zinc/96/39/95/607963995.db2.gz VIAWLQHJLINVMC-SNVBAGLBSA-N -1 3 368.268 3.682 20 0 FHADHM Cc1c2c(nc(SCc3csc(C4CC4)n3)c1-c1nnn[n-]1)CCC2 ZINC000826243004 607965798 /nfs/dbraw/zinc/96/57/98/607965798.db2.gz PNIXDJUUDUFUOX-UHFFFAOYSA-N -1 3 370.507 3.685 20 0 FHADHM Cc1c2c(nc(SCc3csc(C4CC4)n3)c1-c1nn[n-]n1)CCC2 ZINC000826243004 607965799 /nfs/dbraw/zinc/96/57/99/607965799.db2.gz PNIXDJUUDUFUOX-UHFFFAOYSA-N -1 3 370.507 3.685 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000823944207 607969411 /nfs/dbraw/zinc/96/94/11/607969411.db2.gz ZXFFXCJOHKZTTJ-RSKUSDAESA-N -1 3 367.840 3.801 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000823944207 607969412 /nfs/dbraw/zinc/96/94/12/607969412.db2.gz ZXFFXCJOHKZTTJ-RSKUSDAESA-N -1 3 367.840 3.801 20 0 FHADHM CCn1c2ccc(-c3nnn[n-]3)cc2nc1-c1coc(-c2ccccc2)n1 ZINC000825782718 607975733 /nfs/dbraw/zinc/97/57/33/607975733.db2.gz MTFXMQJWEHYZET-UHFFFAOYSA-N -1 3 357.377 3.558 20 0 FHADHM CCn1c2ccc(-c3nn[n-]n3)cc2nc1-c1coc(-c2ccccc2)n1 ZINC000825782718 607975734 /nfs/dbraw/zinc/97/57/34/607975734.db2.gz MTFXMQJWEHYZET-UHFFFAOYSA-N -1 3 357.377 3.558 20 0 FHADHM CCn1c2ccc(-c3nnn[n-]3)cc2nc1-c1ccc(OC)c(Cl)c1 ZINC000825782811 607975968 /nfs/dbraw/zinc/97/59/68/607975968.db2.gz QJWYTXDZESHBPC-UHFFFAOYSA-N -1 3 354.801 3.565 20 0 FHADHM CCn1c2ccc(-c3nn[n-]n3)cc2nc1-c1ccc(OC)c(Cl)c1 ZINC000825782811 607975969 /nfs/dbraw/zinc/97/59/69/607975969.db2.gz QJWYTXDZESHBPC-UHFFFAOYSA-N -1 3 354.801 3.565 20 0 FHADHM c1ccc(CCn2c3ccccc3nc2-c2ccc(-c3nnn[n-]3)cc2)nc1 ZINC000826521506 607976057 /nfs/dbraw/zinc/97/60/57/607976057.db2.gz PMVGIWGLBHGBNT-UHFFFAOYSA-N -1 3 367.416 3.521 20 0 FHADHM c1ccc(CCn2c3ccccc3nc2-c2ccc(-c3nn[n-]n3)cc2)nc1 ZINC000826521506 607976058 /nfs/dbraw/zinc/97/60/58/607976058.db2.gz PMVGIWGLBHGBNT-UHFFFAOYSA-N -1 3 367.416 3.521 20 0 FHADHM CC(C)CN(Cc1csc(C2CC2)n1)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000824261141 607983255 /nfs/dbraw/zinc/98/32/55/607983255.db2.gz BPWVUSSLEABFDQ-UHFFFAOYSA-N -1 3 368.510 3.859 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)Nc1ccc(F)cc1-c1nnn[n-]1 ZINC000823943121 608005997 /nfs/dbraw/zinc/00/59/97/608005997.db2.gz NXLATEHDJNUTPF-YFHOEESVSA-N -1 3 357.776 3.701 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)Nc1ccc(F)cc1-c1nn[n-]n1 ZINC000823943121 608005998 /nfs/dbraw/zinc/00/59/98/608005998.db2.gz NXLATEHDJNUTPF-YFHOEESVSA-N -1 3 357.776 3.701 20 0 FHADHM C[C@@H](NC(=O)c1cccc(-c2ccoc2)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824523153 608023314 /nfs/dbraw/zinc/02/33/14/608023314.db2.gz YEGMNGKMDYVZDE-CYBMUJFWSA-N -1 3 359.389 3.618 20 0 FHADHM C[C@@H](NC(=O)c1cccc(-c2ccoc2)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824523153 608023315 /nfs/dbraw/zinc/02/33/15/608023315.db2.gz YEGMNGKMDYVZDE-CYBMUJFWSA-N -1 3 359.389 3.618 20 0 FHADHM CC(C)(C)OC(=O)Nc1cccc(OCc2cccc(-c3nnn[n-]3)c2)c1 ZINC000824114653 608151761 /nfs/dbraw/zinc/15/17/61/608151761.db2.gz ZCOHEODLSQQTDF-UHFFFAOYSA-N -1 3 367.409 3.793 20 0 FHADHM CC(C)(C)OC(=O)Nc1cccc(OCc2cccc(-c3nn[n-]n3)c2)c1 ZINC000824114653 608151762 /nfs/dbraw/zinc/15/17/62/608151762.db2.gz ZCOHEODLSQQTDF-UHFFFAOYSA-N -1 3 367.409 3.793 20 0 FHADHM C[C@@H](OC(=O)[C@H]1SCCc2sccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000824716605 608181760 /nfs/dbraw/zinc/18/17/60/608181760.db2.gz YUIZSWCGOFSIQH-BMIGLBTASA-N -1 3 372.475 3.563 20 0 FHADHM C[C@@H](OC(=O)[C@H]1SCCc2sccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000824716605 608181763 /nfs/dbraw/zinc/18/17/63/608181763.db2.gz YUIZSWCGOFSIQH-BMIGLBTASA-N -1 3 372.475 3.563 20 0 FHADHM C[C@@H](OC(=O)[C@@H]1SCCc2ccccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000824716661 608181775 /nfs/dbraw/zinc/18/17/75/608181775.db2.gz ZWJPTLYZKUATET-SJKOYZFVSA-N -1 3 366.446 3.502 20 0 FHADHM C[C@@H](OC(=O)[C@@H]1SCCc2ccccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000824716661 608181776 /nfs/dbraw/zinc/18/17/76/608181776.db2.gz ZWJPTLYZKUATET-SJKOYZFVSA-N -1 3 366.446 3.502 20 0 FHADHM C[C@H](OC(=O)[C@@H](C)c1c(F)cccc1F)c1cccc(-c2nnn[n-]2)c1 ZINC000824705495 608182786 /nfs/dbraw/zinc/18/27/86/608182786.db2.gz BXJOOLQYGNRSMD-QWRGUYRKSA-N -1 3 358.348 3.553 20 0 FHADHM C[C@H](OC(=O)[C@@H](C)c1c(F)cccc1F)c1cccc(-c2nn[n-]n2)c1 ZINC000824705495 608182787 /nfs/dbraw/zinc/18/27/87/608182787.db2.gz BXJOOLQYGNRSMD-QWRGUYRKSA-N -1 3 358.348 3.553 20 0 FHADHM C[C@@H](OC(=O)C(C)(C)c1cccc(F)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824706211 608183104 /nfs/dbraw/zinc/18/31/04/608183104.db2.gz HNMPGCMMDDOEMK-GFCCVEGCSA-N -1 3 354.385 3.588 20 0 FHADHM C[C@@H](OC(=O)C(C)(C)c1cccc(F)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824706211 608183106 /nfs/dbraw/zinc/18/31/06/608183106.db2.gz HNMPGCMMDDOEMK-GFCCVEGCSA-N -1 3 354.385 3.588 20 0 FHADHM CCCCc1noc(CSc2cccc(Cl)c2-c2nnn[n-]2)n1 ZINC000825296832 608205823 /nfs/dbraw/zinc/20/58/23/608205823.db2.gz WZJLRSPUYIKABO-UHFFFAOYSA-N -1 3 350.835 3.538 20 0 FHADHM CCCCc1noc(CSc2cccc(Cl)c2-c2nn[n-]n2)n1 ZINC000825296832 608205825 /nfs/dbraw/zinc/20/58/25/608205825.db2.gz WZJLRSPUYIKABO-UHFFFAOYSA-N -1 3 350.835 3.538 20 0 FHADHM CC(C)Oc1ccc(CNc2ccc3cc(-c4nnn[n-]4)ccc3n2)cc1 ZINC000824324956 608220945 /nfs/dbraw/zinc/22/09/45/608220945.db2.gz XEWRQLDDGSZYLW-UHFFFAOYSA-N -1 3 360.421 3.814 20 0 FHADHM CC(C)Oc1ccc(CNc2ccc3cc(-c4nn[n-]n4)ccc3n2)cc1 ZINC000824324956 608220947 /nfs/dbraw/zinc/22/09/47/608220947.db2.gz XEWRQLDDGSZYLW-UHFFFAOYSA-N -1 3 360.421 3.814 20 0 FHADHM C[C@H](Nc1ccc2cc(-c3nnn[n-]3)ccc2n1)c1ccc(F)c(F)c1 ZINC000824658269 608221487 /nfs/dbraw/zinc/22/14/87/608221487.db2.gz VIKCKEZORCSEBE-JTQLQIEISA-N -1 3 352.348 3.866 20 0 FHADHM C[C@H](Nc1ccc2cc(-c3nn[n-]n3)ccc2n1)c1ccc(F)c(F)c1 ZINC000824658269 608221489 /nfs/dbraw/zinc/22/14/89/608221489.db2.gz VIKCKEZORCSEBE-JTQLQIEISA-N -1 3 352.348 3.866 20 0 FHADHM c1ccc2nc(CCNc3ccc4cc(-c5nnn[n-]5)ccc4n3)ccc2c1 ZINC000826524248 608225995 /nfs/dbraw/zinc/22/59/95/608225995.db2.gz OANFGEKYYBBAJL-UHFFFAOYSA-N -1 3 367.416 3.618 20 0 FHADHM c1ccc2nc(CCNc3ccc4cc(-c5nn[n-]n5)ccc4n3)ccc2c1 ZINC000826524248 608225997 /nfs/dbraw/zinc/22/59/97/608225997.db2.gz OANFGEKYYBBAJL-UHFFFAOYSA-N -1 3 367.416 3.618 20 0 FHADHM CSc1ccc(F)cc1CNc1ccc2cc(-c3nnn[n-]3)ccc2n1 ZINC000826230610 608231052 /nfs/dbraw/zinc/23/10/52/608231052.db2.gz BHNWAPOLXIFHMA-UHFFFAOYSA-N -1 3 366.425 3.888 20 0 FHADHM CSc1ccc(F)cc1CNc1ccc2cc(-c3nn[n-]n3)ccc2n1 ZINC000826230610 608231054 /nfs/dbraw/zinc/23/10/54/608231054.db2.gz BHNWAPOLXIFHMA-UHFFFAOYSA-N -1 3 366.425 3.888 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1COc1ccc2cc(C(C)=O)ccc2c1 ZINC000826172916 608265758 /nfs/dbraw/zinc/26/57/58/608265758.db2.gz DKROYZUSWSNYOE-UHFFFAOYSA-N -1 3 374.400 3.810 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1COc1ccc2cc(C(C)=O)ccc2c1 ZINC000826172916 608265759 /nfs/dbraw/zinc/26/57/59/608265759.db2.gz DKROYZUSWSNYOE-UHFFFAOYSA-N -1 3 374.400 3.810 20 0 FHADHM CSc1cc(C(=O)Nc2ccc(Cl)c(-c3nnn[n-]3)c2)ccc1F ZINC000826229578 608267443 /nfs/dbraw/zinc/26/74/43/608267443.db2.gz JKIDGFJTNJFBQO-UHFFFAOYSA-N -1 3 363.805 3.633 20 0 FHADHM CSc1cc(C(=O)Nc2ccc(Cl)c(-c3nn[n-]n3)c2)ccc1F ZINC000826229578 608267445 /nfs/dbraw/zinc/26/74/45/608267445.db2.gz JKIDGFJTNJFBQO-UHFFFAOYSA-N -1 3 363.805 3.633 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CNc1cc(C)ccc1Br ZINC000826170889 608320641 /nfs/dbraw/zinc/32/06/41/608320641.db2.gz SUGXJDGZQFFZSB-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CNc1cc(C)ccc1Br ZINC000826170889 608320643 /nfs/dbraw/zinc/32/06/43/608320643.db2.gz SUGXJDGZQFFZSB-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CNc1ccc(CC(F)(F)F)cc1 ZINC000826170938 608321163 /nfs/dbraw/zinc/32/11/63/608321163.db2.gz WCISLDFXVLOACQ-UHFFFAOYSA-N -1 3 363.343 3.592 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CNc1ccc(CC(F)(F)F)cc1 ZINC000826170938 608321165 /nfs/dbraw/zinc/32/11/65/608321165.db2.gz WCISLDFXVLOACQ-UHFFFAOYSA-N -1 3 363.343 3.592 20 0 FHADHM Cc1cc(C)c(CC(=O)N(C)c2cc(Cl)ccc2-c2nnn[n-]2)c(C)c1 ZINC000826262890 608342317 /nfs/dbraw/zinc/34/23/17/608342317.db2.gz BYNOPLXTDGWTHM-UHFFFAOYSA-N -1 3 369.856 3.651 20 0 FHADHM Cc1cc(C)c(CC(=O)N(C)c2cc(Cl)ccc2-c2nn[n-]n2)c(C)c1 ZINC000826262890 608342319 /nfs/dbraw/zinc/34/23/19/608342319.db2.gz BYNOPLXTDGWTHM-UHFFFAOYSA-N -1 3 369.856 3.651 20 0 FHADHM C[C@H](NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1)c1nccs1 ZINC000824612650 608362709 /nfs/dbraw/zinc/36/27/09/608362709.db2.gz OBHKGQDXOQOCQQ-ZDUSSCGKSA-N -1 3 362.462 3.841 20 0 FHADHM C[C@H](NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1)c1nccs1 ZINC000824612650 608362711 /nfs/dbraw/zinc/36/27/11/608362711.db2.gz OBHKGQDXOQOCQQ-ZDUSSCGKSA-N -1 3 362.462 3.841 20 0 FHADHM CCCCc1noc([C@@H](C)SCc2cccc(-c3nnn[n-]3)c2F)n1 ZINC000825296669 608404388 /nfs/dbraw/zinc/40/43/88/608404388.db2.gz RPEXRRHSJVBFEQ-SNVBAGLBSA-N -1 3 362.434 3.726 20 0 FHADHM CCCCc1noc([C@@H](C)SCc2cccc(-c3nn[n-]n3)c2F)n1 ZINC000825296669 608404390 /nfs/dbraw/zinc/40/43/90/608404390.db2.gz RPEXRRHSJVBFEQ-SNVBAGLBSA-N -1 3 362.434 3.726 20 0 FHADHM CCc1nc2c(s1)[C@H](N(C)Cc1cccc(-c3nnn[n-]3)c1F)CCC2 ZINC000825749378 608407408 /nfs/dbraw/zinc/40/74/08/608407408.db2.gz CMYLFMWFDOJBKP-CQSZACIVSA-N -1 3 372.473 3.534 20 0 FHADHM CC(C)Cn1ncc(NCc2ccc(-c3nnn[n-]3)cc2F)c1C(C)C ZINC000824284823 608427210 /nfs/dbraw/zinc/42/72/10/608427210.db2.gz NUWPTBXQGDUCKO-UHFFFAOYSA-N -1 3 357.437 3.594 20 0 FHADHM CC(C)Cn1ncc(NCc2ccc(-c3nn[n-]n3)cc2F)c1C(C)C ZINC000824284823 608427212 /nfs/dbraw/zinc/42/72/12/608427212.db2.gz NUWPTBXQGDUCKO-UHFFFAOYSA-N -1 3 357.437 3.594 20 0 FHADHM Cc1ccccc1[C@H](C)CC(=O)OCc1cccc(-c2nnn[n-]2)c1F ZINC000826305923 608448004 /nfs/dbraw/zinc/44/80/04/608448004.db2.gz LWZLGUZRSLRJCF-CYBMUJFWSA-N -1 3 354.385 3.551 20 0 FHADHM Cc1ccccc1[C@H](C)CC(=O)OCc1cccc(-c2nn[n-]n2)c1F ZINC000826305923 608448006 /nfs/dbraw/zinc/44/80/06/608448006.db2.gz LWZLGUZRSLRJCF-CYBMUJFWSA-N -1 3 354.385 3.551 20 0 FHADHM C[C@H](C(=O)OCc1cccc(-c2nnn[n-]2)c1F)c1cccc(Cl)c1 ZINC000824052030 608448987 /nfs/dbraw/zinc/44/89/87/608448987.db2.gz KNWFWOUCYMVYCB-JTQLQIEISA-N -1 3 360.776 3.506 20 0 FHADHM C[C@H](C(=O)OCc1cccc(-c2nn[n-]n2)c1F)c1cccc(Cl)c1 ZINC000824052030 608448989 /nfs/dbraw/zinc/44/89/89/608448989.db2.gz KNWFWOUCYMVYCB-JTQLQIEISA-N -1 3 360.776 3.506 20 0 FHADHM CC(C)Oc1ccccc1[C@@H](C)NCc1cccc(-c2nnn[n-]2)c1F ZINC000824332999 608452228 /nfs/dbraw/zinc/45/22/28/608452228.db2.gz CHCGLYONAJGEKM-CYBMUJFWSA-N -1 3 355.417 3.644 20 0 FHADHM Clc1ccc(CN2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)s1 ZINC000826352217 608462859 /nfs/dbraw/zinc/46/28/59/608462859.db2.gz SNFXSQLAONZSIK-UHFFFAOYSA-N -1 3 357.870 3.871 20 0 FHADHM Cc1oc(-c2ccccc2)nc1CN[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000826340060 608464825 /nfs/dbraw/zinc/46/48/25/608464825.db2.gz GCNNLIMJIBFMFP-CYBMUJFWSA-N -1 3 360.421 3.681 20 0 FHADHM C[C@@H]1C[C@H]1c1ccc(CN(Cc2cc(-c3nnn[n-]3)cs2)C2CC2)o1 ZINC000824897811 608518343 /nfs/dbraw/zinc/51/83/43/608518343.db2.gz BHMRZSHWBRMUPN-BDJLRTHQSA-N -1 3 355.467 3.809 20 0 FHADHM C[C@@H]1C[C@H]1c1ccc(CN(Cc2cc(-c3nn[n-]n3)cs2)C2CC2)o1 ZINC000824897811 608518345 /nfs/dbraw/zinc/51/83/45/608518345.db2.gz BHMRZSHWBRMUPN-BDJLRTHQSA-N -1 3 355.467 3.809 20 0 FHADHM CN(Cc1nc(-c2ccccc2)cs1)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000825962408 608526708 /nfs/dbraw/zinc/52/67/08/608526708.db2.gz ZIKQVRPULOSNBM-UHFFFAOYSA-N -1 3 362.462 3.622 20 0 FHADHM CC(C)(C)CN(CC(C)(C)C)C(=O)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000824086460 608546666 /nfs/dbraw/zinc/54/66/66/608546666.db2.gz MJAATOHNAHSHQB-UHFFFAOYSA-N -1 3 365.428 3.679 20 0 FHADHM CC(C)(C)CN(CC(C)(C)C)C(=O)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000824086460 608546667 /nfs/dbraw/zinc/54/66/67/608546667.db2.gz MJAATOHNAHSHQB-UHFFFAOYSA-N -1 3 365.428 3.679 20 0 FHADHM Fc1ccc(CN(Cc2ccc(-c3nnn[n-]3)o2)Cc2ccccc2)cc1 ZINC000826374449 608571975 /nfs/dbraw/zinc/57/19/75/608571975.db2.gz ZGLJWIYWWUXYIL-UHFFFAOYSA-N -1 3 363.396 3.801 20 0 FHADHM Fc1ccc(CN(Cc2ccc(-c3nn[n-]n3)o2)Cc2ccccc2)cc1 ZINC000826374449 608571977 /nfs/dbraw/zinc/57/19/77/608571977.db2.gz ZGLJWIYWWUXYIL-UHFFFAOYSA-N -1 3 363.396 3.801 20 0 FHADHM CCCOc1ccc(NC(=O)Nc2cc(-c3nnn[n-]3)ccc2C)cc1 ZINC000825338697 608600345 /nfs/dbraw/zinc/60/03/45/608600345.db2.gz FJBVIDWKWHIQNV-UHFFFAOYSA-N -1 3 352.398 3.608 20 0 FHADHM CCCOc1ccc(NC(=O)Nc2cc(-c3nn[n-]n3)ccc2C)cc1 ZINC000825338697 608600347 /nfs/dbraw/zinc/60/03/47/608600347.db2.gz FJBVIDWKWHIQNV-UHFFFAOYSA-N -1 3 352.398 3.608 20 0 FHADHM CN(Cc1cc(-c2nnn[n-]2)cs1)[C@@H](c1ccccc1)C(F)(F)F ZINC000825953970 608677542 /nfs/dbraw/zinc/67/75/42/608677542.db2.gz UHKIYHIYMWBAOB-ZDUSSCGKSA-N -1 3 353.373 3.664 20 0 FHADHM CN(Cc1cc(-c2nn[n-]n2)cs1)[C@@H](c1ccccc1)C(F)(F)F ZINC000825953970 608677544 /nfs/dbraw/zinc/67/75/44/608677544.db2.gz UHKIYHIYMWBAOB-ZDUSSCGKSA-N -1 3 353.373 3.664 20 0 FHADHM c1cc(-c2nnn[n-]2)oc1CN1Cc2ccccc2C[C@@H]1c1ccccc1 ZINC000826520360 608726579 /nfs/dbraw/zinc/72/65/79/608726579.db2.gz HOAORZMCNUGMSV-LJQANCHMSA-N -1 3 357.417 3.759 20 0 FHADHM COc1cc(F)cc(CNc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)c1 ZINC000826180772 608799123 /nfs/dbraw/zinc/79/91/23/608799123.db2.gz WMWYDRUIZDCBOF-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM COc1cc(F)cc(CNc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)c1 ZINC000826180772 608799125 /nfs/dbraw/zinc/79/91/25/608799125.db2.gz WMWYDRUIZDCBOF-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM O=C(O[C@H](C1CCCCC1)C(F)(F)F)c1cccc(-c2nnn[n-]2)c1 ZINC000826461641 608827368 /nfs/dbraw/zinc/82/73/68/608827368.db2.gz BXENDRMFVSDADP-CYBMUJFWSA-N -1 3 354.332 3.535 20 0 FHADHM O=C(O[C@H](C1CCCCC1)C(F)(F)F)c1cccc(-c2nn[n-]n2)c1 ZINC000826461641 608827370 /nfs/dbraw/zinc/82/73/70/608827370.db2.gz BXENDRMFVSDADP-CYBMUJFWSA-N -1 3 354.332 3.535 20 0 FHADHM COc1ccc(F)cc1[C@@H](C)N[C@H](C)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000826209049 609134190 /nfs/dbraw/zinc/13/41/90/609134190.db2.gz KOUSQSBUVYIAEY-GHMZBOCLSA-N -1 3 359.380 3.565 20 0 FHADHM CCC(CC)c1cc(CN[C@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)on1 ZINC000825114083 609146911 /nfs/dbraw/zinc/14/69/11/609146911.db2.gz JMNKAGMWAFZDCM-LLVKDONJSA-N -1 3 358.421 3.748 20 0 FHADHM CCC(CC)c1cc(CN[C@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)on1 ZINC000825114083 609146913 /nfs/dbraw/zinc/14/69/13/609146913.db2.gz JMNKAGMWAFZDCM-LLVKDONJSA-N -1 3 358.421 3.748 20 0 FHADHM Fc1cccc(F)c1[C@H](NCc1cccc(-c2nnn[n-]2)c1)C(F)(F)F ZINC000826377602 609152573 /nfs/dbraw/zinc/15/25/73/609152573.db2.gz YMAYFFSSYMDJMO-AWEZNQCLSA-N -1 3 369.297 3.538 20 0 FHADHM Fc1cccc(F)c1[C@H](NCc1cccc(-c2nn[n-]n2)c1)C(F)(F)F ZINC000826377602 609152574 /nfs/dbraw/zinc/15/25/74/609152574.db2.gz YMAYFFSSYMDJMO-AWEZNQCLSA-N -1 3 369.297 3.538 20 0 FHADHM COCCOc1cc(C)ccc1N[C@H](C)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000826160760 609157757 /nfs/dbraw/zinc/15/77/57/609157757.db2.gz FFUJIEZELRULMQ-CYBMUJFWSA-N -1 3 371.416 3.513 20 0 FHADHM COCCOc1cc(C)ccc1N[C@H](C)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000826160760 609157758 /nfs/dbraw/zinc/15/77/58/609157758.db2.gz FFUJIEZELRULMQ-CYBMUJFWSA-N -1 3 371.416 3.513 20 0 FHADHM CC(C)C(=O)Nc1ccc(N[C@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)cc1 ZINC000824185325 609161771 /nfs/dbraw/zinc/16/17/71/609161771.db2.gz VZZJHPMSKCDCFU-GFCCVEGCSA-N -1 3 368.416 3.773 20 0 FHADHM CC(C)C(=O)Nc1ccc(N[C@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)cc1 ZINC000824185325 609161773 /nfs/dbraw/zinc/16/17/73/609161773.db2.gz VZZJHPMSKCDCFU-GFCCVEGCSA-N -1 3 368.416 3.773 20 0 FHADHM CC(C)C(=O)Nc1cccc(N[C@@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)c1 ZINC000824184966 609164067 /nfs/dbraw/zinc/16/40/67/609164067.db2.gz OUYRWZCVEIYQQZ-LBPRGKRZSA-N -1 3 368.416 3.773 20 0 FHADHM CC(C)C(=O)Nc1cccc(N[C@@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)c1 ZINC000824184966 609164068 /nfs/dbraw/zinc/16/40/68/609164068.db2.gz OUYRWZCVEIYQQZ-LBPRGKRZSA-N -1 3 368.416 3.773 20 0 FHADHM CC(C)C[C@@H]1C[C@@H](Nc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)CCO1 ZINC000824245423 609171615 /nfs/dbraw/zinc/17/16/15/609171615.db2.gz ZMVCKDGTLCYNQX-QWHCGFSZSA-N -1 3 369.391 3.891 20 0 FHADHM CC(C)C[C@@H]1C[C@@H](Nc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)CCO1 ZINC000824245423 609171617 /nfs/dbraw/zinc/17/16/17/609171617.db2.gz ZMVCKDGTLCYNQX-QWHCGFSZSA-N -1 3 369.391 3.891 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NCc1ccc(OC)c(Cl)c1 ZINC000825481046 609178198 /nfs/dbraw/zinc/17/81/98/609178198.db2.gz SJTITSBQFPESCP-UHFFFAOYSA-N -1 3 358.833 3.573 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NCc1ccccc1C(F)(F)F ZINC000825481463 609179650 /nfs/dbraw/zinc/17/96/50/609179650.db2.gz ZZOCRSHGLNLBHD-UHFFFAOYSA-N -1 3 362.359 3.929 20 0 FHADHM C[C@@H](Nc1ccc(N2CCCC2)c(F)c1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824655429 609180434 /nfs/dbraw/zinc/18/04/34/609180434.db2.gz COWICRPIFBMVDP-GFCCVEGCSA-N -1 3 370.407 3.918 20 0 FHADHM C[C@@H](Nc1ccc(N2CCCC2)c(F)c1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824655429 609180435 /nfs/dbraw/zinc/18/04/35/609180435.db2.gz COWICRPIFBMVDP-GFCCVEGCSA-N -1 3 370.407 3.918 20 0 FHADHM COCCOc1ccc(N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1Cl ZINC000826162478 609180679 /nfs/dbraw/zinc/18/06/79/609180679.db2.gz DFSGJTCJIUQLGW-LBPRGKRZSA-N -1 3 373.844 3.718 20 0 FHADHM COCCOc1ccc(N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1Cl ZINC000826162478 609180681 /nfs/dbraw/zinc/18/06/81/609180681.db2.gz DFSGJTCJIUQLGW-LBPRGKRZSA-N -1 3 373.844 3.718 20 0 FHADHM Clc1ccc(NCc2c[nH]nc2-c2cccs2)cc1-c1nnn[n-]1 ZINC000826352851 609199844 /nfs/dbraw/zinc/19/98/44/609199844.db2.gz QIQQXTZEIRWONP-UHFFFAOYSA-N -1 3 357.830 3.584 20 0 FHADHM Clc1ccc(NCc2c[nH]nc2-c2cccs2)cc1-c1nn[n-]n1 ZINC000826352851 609199845 /nfs/dbraw/zinc/19/98/45/609199845.db2.gz QIQQXTZEIRWONP-UHFFFAOYSA-N -1 3 357.830 3.584 20 0 FHADHM C[C@H](c1ccccc1)N(Cc1ccccc1)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC000824773020 609203847 /nfs/dbraw/zinc/20/38/47/609203847.db2.gz XQAVAXJAIIQRRF-OAHLLOKOSA-N -1 3 372.432 3.598 20 0 FHADHM C[C@H](c1ccccc1)N(Cc1ccccc1)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC000824773020 609203849 /nfs/dbraw/zinc/20/38/49/609203849.db2.gz XQAVAXJAIIQRRF-OAHLLOKOSA-N -1 3 372.432 3.598 20 0 FHADHM O=C(Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)c1cccc(O)c1 ZINC000826457240 609224787 /nfs/dbraw/zinc/22/47/87/609224787.db2.gz SMSJNBONRURLLW-UHFFFAOYSA-N -1 3 373.372 3.617 20 0 FHADHM C[C@@H](Cc1nnc(NCc2ccc(-c3nnn[n-]3)s2)o1)CC(C)(C)C ZINC000824464734 609265912 /nfs/dbraw/zinc/26/59/12/609265912.db2.gz JAIPPYXIDLSRHK-JTQLQIEISA-N -1 3 361.475 3.538 20 0 FHADHM C[C@H](Cc1nnc(NCc2ccc(-c3nnn[n-]3)cc2F)o1)CC(C)(C)C ZINC000824465673 609265976 /nfs/dbraw/zinc/26/59/76/609265976.db2.gz RHDHMXMOUUVTEH-LLVKDONJSA-N -1 3 373.436 3.616 20 0 FHADHM C[C@H](Cc1nnc(NCc2ccc(-c3nn[n-]n3)cc2F)o1)CC(C)(C)C ZINC000824465673 609265977 /nfs/dbraw/zinc/26/59/77/609265977.db2.gz RHDHMXMOUUVTEH-LLVKDONJSA-N -1 3 373.436 3.616 20 0 FHADHM CC(=O)Nc1ccc(N[C@@H]2CCCc3cc(-c4nnn[n-]4)ccc32)cc1C ZINC000823999517 609267073 /nfs/dbraw/zinc/26/70/73/609267073.db2.gz DOLFSRLDYIXQQX-LJQANCHMSA-N -1 3 362.437 3.623 20 0 FHADHM CC(=O)Nc1ccc(N[C@@H]2CCCc3cc(-c4nn[n-]n4)ccc32)cc1C ZINC000823999517 609267075 /nfs/dbraw/zinc/26/70/75/609267075.db2.gz DOLFSRLDYIXQQX-LJQANCHMSA-N -1 3 362.437 3.623 20 0 FHADHM CCOc1cc2c(cc1N[C@@H](C)c1ccc(-c3nnn[n-]3)cc1)O[C@@H](C)C2 ZINC000825621506 609274039 /nfs/dbraw/zinc/27/40/39/609274039.db2.gz VFVGRDWTRVDBBL-STQMWFEESA-N -1 3 365.437 3.762 20 0 FHADHM CCOc1cc2c(cc1N[C@@H](C)c1ccc(-c3nn[n-]n3)cc1)O[C@@H](C)C2 ZINC000825621506 609274040 /nfs/dbraw/zinc/27/40/40/609274040.db2.gz VFVGRDWTRVDBBL-STQMWFEESA-N -1 3 365.437 3.762 20 0 FHADHM COc1ccc(OC(F)F)c(N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000826210943 609275465 /nfs/dbraw/zinc/27/54/65/609275465.db2.gz KKDSEEZVKVUJDC-SNVBAGLBSA-N -1 3 361.352 3.650 20 0 FHADHM COc1ccc(OC(F)F)c(N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000826210943 609275467 /nfs/dbraw/zinc/27/54/67/609275467.db2.gz KKDSEEZVKVUJDC-SNVBAGLBSA-N -1 3 361.352 3.650 20 0 FHADHM C[C@@H](Nc1ccc(N2CCCCC2)nc1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824656445 609279458 /nfs/dbraw/zinc/27/94/58/609279458.db2.gz JZOLLKMULVBCQC-CYBMUJFWSA-N -1 3 367.432 3.564 20 0 FHADHM C[C@@H](Nc1ccc(N2CCCCC2)nc1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824656445 609279460 /nfs/dbraw/zinc/27/94/60/609279460.db2.gz JZOLLKMULVBCQC-CYBMUJFWSA-N -1 3 367.432 3.564 20 0 FHADHM Cc1cnn(-c2ccc(N[C@H](C)c3ccc(-c4nnn[n-]4)cc3)cc2F)c1 ZINC000826319859 609280402 /nfs/dbraw/zinc/28/04/02/609280402.db2.gz WLMFGPGEYFHNAL-CYBMUJFWSA-N -1 3 363.400 3.673 20 0 FHADHM Cc1cnn(-c2ccc(N[C@H](C)c3ccc(-c4nn[n-]n4)cc3)cc2F)c1 ZINC000826319859 609280403 /nfs/dbraw/zinc/28/04/03/609280403.db2.gz WLMFGPGEYFHNAL-CYBMUJFWSA-N -1 3 363.400 3.673 20 0 FHADHM CCN(C(=O)c1cc(C)c(C)cc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000825379554 609281922 /nfs/dbraw/zinc/28/19/22/609281922.db2.gz ILKVEMJLZDTKPG-UHFFFAOYSA-N -1 3 355.829 3.804 20 0 FHADHM CCN(C(=O)c1cc(C)c(C)cc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000825379554 609281924 /nfs/dbraw/zinc/28/19/24/609281924.db2.gz ILKVEMJLZDTKPG-UHFFFAOYSA-N -1 3 355.829 3.804 20 0 FHADHM Cc1cc(Cl)c(C(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1C ZINC000826267751 609283067 /nfs/dbraw/zinc/28/30/67/609283067.db2.gz URLVOTVAELITLQ-LBPRGKRZSA-N -1 3 355.829 3.628 20 0 FHADHM Cc1cc(Cl)c(C(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1C ZINC000826267751 609283069 /nfs/dbraw/zinc/28/30/69/609283069.db2.gz URLVOTVAELITLQ-LBPRGKRZSA-N -1 3 355.829 3.628 20 0 FHADHM CCN(CC)c1ccc(NC(=O)c2ccc(Cl)c(-c3nnn[n-]3)c2)cc1 ZINC000825418181 609286711 /nfs/dbraw/zinc/28/67/11/609286711.db2.gz YDCGTQNXLVASCG-UHFFFAOYSA-N -1 3 370.844 3.619 20 0 FHADHM CCN(CC)c1ccc(NC(=O)c2ccc(Cl)c(-c3nn[n-]n3)c2)cc1 ZINC000825418181 609286712 /nfs/dbraw/zinc/28/67/12/609286712.db2.gz YDCGTQNXLVASCG-UHFFFAOYSA-N -1 3 370.844 3.619 20 0 FHADHM O=C(c1ccc(Cl)c(-c2nnn[n-]2)c1)N(CC1CCCCC1)C1CC1 ZINC000826472625 609298724 /nfs/dbraw/zinc/29/87/24/609298724.db2.gz QXUPOWFXDNHUKT-UHFFFAOYSA-N -1 3 359.861 3.705 20 0 FHADHM O=C(c1ccc(Cl)c(-c2nn[n-]n2)c1)N(CC1CCCCC1)C1CC1 ZINC000826472625 609298725 /nfs/dbraw/zinc/29/87/25/609298725.db2.gz QXUPOWFXDNHUKT-UHFFFAOYSA-N -1 3 359.861 3.705 20 0 FHADHM Cc1cccnc1NC(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000826308553 609308073 /nfs/dbraw/zinc/30/80/73/609308073.db2.gz FHWNALMPTCCJFJ-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1cccnc1NC(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000826308553 609308074 /nfs/dbraw/zinc/30/80/74/609308074.db2.gz FHWNALMPTCCJFJ-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cc(C)n([C@@H](C)CC)n2)c1-c1nnn[n-]1 ZINC000825687344 609316353 /nfs/dbraw/zinc/31/63/53/609316353.db2.gz HGVQALYKZOGCPH-VIFPVBQESA-N -1 3 373.486 3.527 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cc(C)n([C@@H](C)CC)n2)c1-c1nn[n-]n1 ZINC000825687344 609316355 /nfs/dbraw/zinc/31/63/55/609316355.db2.gz HGVQALYKZOGCPH-VIFPVBQESA-N -1 3 373.486 3.527 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cc(C)n([C@H](C)CC)n2)c1-c1nnn[n-]1 ZINC000825687342 609316473 /nfs/dbraw/zinc/31/64/73/609316473.db2.gz HGVQALYKZOGCPH-SECBINFHSA-N -1 3 373.486 3.527 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cc(C)n([C@H](C)CC)n2)c1-c1nn[n-]n1 ZINC000825687342 609316475 /nfs/dbraw/zinc/31/64/75/609316475.db2.gz HGVQALYKZOGCPH-SECBINFHSA-N -1 3 373.486 3.527 20 0 FHADHM C[C@H]1CCN(C(=O)c2ccccc2Oc2ccccc2-c2nnn[n-]2)[C@H]1C ZINC000824956459 609327205 /nfs/dbraw/zinc/32/72/05/609327205.db2.gz RKIYUYMANZQZPU-KBPBESRZSA-N -1 3 363.421 3.530 20 0 FHADHM C[C@H]1CCN(C(=O)c2ccccc2Oc2ccccc2-c2nn[n-]n2)[C@H]1C ZINC000824956459 609327207 /nfs/dbraw/zinc/32/72/07/609327207.db2.gz RKIYUYMANZQZPU-KBPBESRZSA-N -1 3 363.421 3.530 20 0 FHADHM COc1ccc(F)cc1[C@H](C)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1F ZINC000826209155 609328269 /nfs/dbraw/zinc/32/82/69/609328269.db2.gz PBVFSHAKWQUWCB-QWRGUYRKSA-N -1 3 359.380 3.565 20 0 FHADHM COc1ccc(F)cc1[C@H](C)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000826209155 609328271 /nfs/dbraw/zinc/32/82/71/609328271.db2.gz PBVFSHAKWQUWCB-QWRGUYRKSA-N -1 3 359.380 3.565 20 0 FHADHM C[C@H](N[C@@H](c1ccccc1)c1cccnc1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824540298 609332892 /nfs/dbraw/zinc/33/28/92/609332892.db2.gz VNACIGQTNPVRIV-XOBRGWDASA-N -1 3 374.423 3.841 20 0 FHADHM C[C@H](N[C@@H](c1ccccc1)c1cccnc1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824540298 609332894 /nfs/dbraw/zinc/33/28/94/609332894.db2.gz VNACIGQTNPVRIV-XOBRGWDASA-N -1 3 374.423 3.841 20 0 FHADHM CCCc1ccc(NCc2cn(C)nc2-c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000825348757 609337005 /nfs/dbraw/zinc/33/70/05/609337005.db2.gz ZENKHZIDOOVLHC-UHFFFAOYSA-N -1 3 373.464 3.832 20 0 FHADHM CCCc1ccc(NCc2cn(C)nc2-c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000825348757 609337007 /nfs/dbraw/zinc/33/70/07/609337007.db2.gz ZENKHZIDOOVLHC-UHFFFAOYSA-N -1 3 373.464 3.832 20 0 FHADHM CCc1ccc(NCc2cn(C)nc2-c2ccc(-c3nnn[n-]3)cc2)cc1C ZINC000825717473 609344673 /nfs/dbraw/zinc/34/46/73/609344673.db2.gz MOUGZIOXCCSZPE-UHFFFAOYSA-N -1 3 373.464 3.750 20 0 FHADHM CCc1ccc(NCc2cn(C)nc2-c2ccc(-c3nn[n-]n3)cc2)cc1C ZINC000825717473 609344675 /nfs/dbraw/zinc/34/46/75/609344675.db2.gz MOUGZIOXCCSZPE-UHFFFAOYSA-N -1 3 373.464 3.750 20 0 FHADHM CCOc1cc(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2F)ccc1OC ZINC000825615806 609346101 /nfs/dbraw/zinc/34/61/01/609346101.db2.gz LNUPSLYNVYKMBS-LLVKDONJSA-N -1 3 357.389 3.586 20 0 FHADHM CCOc1cc(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2F)ccc1OC ZINC000825615806 609346102 /nfs/dbraw/zinc/34/61/02/609346102.db2.gz LNUPSLYNVYKMBS-LLVKDONJSA-N -1 3 357.389 3.586 20 0 FHADHM C[C@@H](N[C@H]1CCCOc2c(F)cccc21)c1ccc(-c2nn[n-]n2)cc1F ZINC000824546920 609348250 /nfs/dbraw/zinc/34/82/50/609348250.db2.gz LUAUUUIZKJCVSH-DIFFPNOSSA-N -1 3 371.391 3.709 20 0 FHADHM O=C(N[C@H](CC1CCC1)c1ccccc1)c1cc(-c2nnn[n-]2)cs1 ZINC000826426784 609350522 /nfs/dbraw/zinc/35/05/22/609350522.db2.gz WLNZCHKDNIYIEP-OAHLLOKOSA-N -1 3 353.451 3.590 20 0 FHADHM O=C(N[C@H](CC1CCC1)c1ccccc1)c1cc(-c2nn[n-]n2)cs1 ZINC000826426784 609350524 /nfs/dbraw/zinc/35/05/24/609350524.db2.gz WLNZCHKDNIYIEP-OAHLLOKOSA-N -1 3 353.451 3.590 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@H]1CCC(C)(C)C1 ZINC000824255775 609377546 /nfs/dbraw/zinc/37/75/46/609377546.db2.gz XKQPCZYCJJIKBL-KRWDZBQOSA-N -1 3 355.486 3.678 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@H]1CCC(C)(C)C1 ZINC000824255775 609377549 /nfs/dbraw/zinc/37/75/49/609377549.db2.gz XKQPCZYCJJIKBL-KRWDZBQOSA-N -1 3 355.486 3.678 20 0 FHADHM Cc1ccc(Oc2ccc(NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)cc2)cc1 ZINC000826292898 609409058 /nfs/dbraw/zinc/40/90/58/609409058.db2.gz REPUIMLCRNQBNO-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM Cc1ccc(Oc2ccc(NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)cc2)cc1 ZINC000826292898 609409061 /nfs/dbraw/zinc/40/90/61/609409061.db2.gz REPUIMLCRNQBNO-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM Cc1cc(Oc2ccccc2)ccc1NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC000826272002 609459625 /nfs/dbraw/zinc/45/96/25/609459625.db2.gz QMXUJOFWSPDQTM-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM Cc1cc(Oc2ccccc2)ccc1NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC000826272002 609459627 /nfs/dbraw/zinc/45/96/27/609459627.db2.gz QMXUJOFWSPDQTM-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM C[C@H](Oc1ccccc1NC(=O)c1c[nH]c(-c2nnn[n-]2)c1)c1ccccc1 ZINC000824753451 609462682 /nfs/dbraw/zinc/46/26/82/609462682.db2.gz DDOQYZWWVMBFAO-ZDUSSCGKSA-N -1 3 374.404 3.587 20 0 FHADHM C[C@H](Oc1ccccc1NC(=O)c1c[nH]c(-c2nn[n-]n2)c1)c1ccccc1 ZINC000824753451 609462684 /nfs/dbraw/zinc/46/26/84/609462684.db2.gz DDOQYZWWVMBFAO-ZDUSSCGKSA-N -1 3 374.404 3.587 20 0 FHADHM C[C@H](NC(=O)c1ccc(-c2ccccc2)o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824514579 609477050 /nfs/dbraw/zinc/47/70/50/609477050.db2.gz ORGIUIFHPKBIIN-ZDUSSCGKSA-N -1 3 359.389 3.618 20 0 FHADHM C[C@H](NC(=O)c1ccc(-c2ccccc2)o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824514579 609477053 /nfs/dbraw/zinc/47/70/53/609477053.db2.gz ORGIUIFHPKBIIN-ZDUSSCGKSA-N -1 3 359.389 3.618 20 0 FHADHM C[C@@H](NC(=O)c1ccc(-c2ccccc2)o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824514578 609477664 /nfs/dbraw/zinc/47/76/64/609477664.db2.gz ORGIUIFHPKBIIN-CYBMUJFWSA-N -1 3 359.389 3.618 20 0 FHADHM C[C@@H](NC(=O)c1ccc(-c2ccccc2)o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824514578 609477665 /nfs/dbraw/zinc/47/76/65/609477665.db2.gz ORGIUIFHPKBIIN-CYBMUJFWSA-N -1 3 359.389 3.618 20 0 FHADHM Fc1cc(NCc2ccoc2)ccc1OCc1cccc(-c2nnn[n-]2)c1 ZINC000826372832 609484285 /nfs/dbraw/zinc/48/42/85/609484285.db2.gz NKVIINWAOCMDOO-UHFFFAOYSA-N -1 3 365.368 3.790 20 0 FHADHM Fc1cc(NCc2ccoc2)ccc1OCc1cccc(-c2nn[n-]n2)c1 ZINC000826372832 609484286 /nfs/dbraw/zinc/48/42/86/609484286.db2.gz NKVIINWAOCMDOO-UHFFFAOYSA-N -1 3 365.368 3.790 20 0 FHADHM C[C@@H]1CCC[C@H]1C(=O)NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000824929482 609511670 /nfs/dbraw/zinc/51/16/70/609511670.db2.gz XWQASRQZZARIAK-RHSMWYFYSA-N -1 3 361.449 3.586 20 0 FHADHM C[C@@H]1CCC[C@H]1C(=O)NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000824929482 609511671 /nfs/dbraw/zinc/51/16/71/609511671.db2.gz XWQASRQZZARIAK-RHSMWYFYSA-N -1 3 361.449 3.586 20 0 FHADHM C[C@H]1CCC[C@@H]1C(=O)NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000824929484 609511789 /nfs/dbraw/zinc/51/17/89/609511789.db2.gz XWQASRQZZARIAK-YOEHRIQHSA-N -1 3 361.449 3.586 20 0 FHADHM C[C@H]1CCC[C@@H]1C(=O)NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000824929484 609511791 /nfs/dbraw/zinc/51/17/91/609511791.db2.gz XWQASRQZZARIAK-YOEHRIQHSA-N -1 3 361.449 3.586 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)[C@H](C)[C@H](C)CC ZINC000825605545 609511871 /nfs/dbraw/zinc/51/18/71/609511871.db2.gz XDOOCUWXVSQUDS-NXEZZACHSA-N -1 3 352.822 3.506 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)[C@H](C)[C@H](C)CC ZINC000825605545 609511873 /nfs/dbraw/zinc/51/18/73/609511873.db2.gz XDOOCUWXVSQUDS-NXEZZACHSA-N -1 3 352.822 3.506 20 0 FHADHM Cc1cc(NCc2ccc(-c3nnn[n-]3)s2)cnc1N1CCCC[C@@H]1C ZINC000826271193 609513090 /nfs/dbraw/zinc/51/30/90/609513090.db2.gz HHYYKHUNKPXMNF-ZDUSSCGKSA-N -1 3 369.498 3.623 20 0 FHADHM Cc1cc(NCc2ccc(-c3nn[n-]n3)s2)cnc1N1CCCC[C@@H]1C ZINC000826271193 609513091 /nfs/dbraw/zinc/51/30/91/609513091.db2.gz HHYYKHUNKPXMNF-ZDUSSCGKSA-N -1 3 369.498 3.623 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1CNc1ccc(Cl)c(OC(F)F)c1 ZINC000826371935 609513673 /nfs/dbraw/zinc/51/36/73/609513673.db2.gz ZQLHWCUURYIROB-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CNc1ccc(Cl)c(OC(F)F)c1 ZINC000826371935 609513674 /nfs/dbraw/zinc/51/36/74/609513674.db2.gz ZQLHWCUURYIROB-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM COc1ccc([C@@H](C)Nc2ncc(Cl)c(C)c2-c2nnn[n-]2)cc1F ZINC000826189238 609524076 /nfs/dbraw/zinc/52/40/76/609524076.db2.gz QPUAHKIGRQHPIX-SECBINFHSA-N -1 3 362.796 3.544 20 0 FHADHM COc1ccc([C@@H](C)Nc2ncc(Cl)c(C)c2-c2nn[n-]n2)cc1F ZINC000826189238 609524078 /nfs/dbraw/zinc/52/40/78/609524078.db2.gz QPUAHKIGRQHPIX-SECBINFHSA-N -1 3 362.796 3.544 20 0 FHADHM Cc1ccnc(N[C@@H]2CCSc3ccc(Cl)cc32)c1-c1nnn[n-]1 ZINC000826313212 609525813 /nfs/dbraw/zinc/52/58/13/609525813.db2.gz YJYPRYPMKGULFZ-GFCCVEGCSA-N -1 3 358.858 3.873 20 0 FHADHM Cc1ccnc(N[C@@H]2CCSc3ccc(Cl)cc32)c1-c1nn[n-]n1 ZINC000826313212 609525815 /nfs/dbraw/zinc/52/58/15/609525815.db2.gz YJYPRYPMKGULFZ-GFCCVEGCSA-N -1 3 358.858 3.873 20 0 FHADHM COc1cccc([C@@H]2CCCN2c2ncc(Cl)c(C)c2-c2nnn[n-]2)c1 ZINC000826215452 609526647 /nfs/dbraw/zinc/52/66/47/609526647.db2.gz PFMMHBRTCLHXKM-HNNXBMFYSA-N -1 3 370.844 3.574 20 0 FHADHM COc1cccc([C@@H]2CCCN2c2ncc(Cl)c(C)c2-c2nn[n-]n2)c1 ZINC000826215452 609526649 /nfs/dbraw/zinc/52/66/49/609526649.db2.gz PFMMHBRTCLHXKM-HNNXBMFYSA-N -1 3 370.844 3.574 20 0 FHADHM Cc1c(Cl)cnc(N2CCC[C@@H]2c2ccc(F)cc2)c1-c1nnn[n-]1 ZINC000826238058 609528636 /nfs/dbraw/zinc/52/86/36/609528636.db2.gz VDHIYQQTRLEAPG-CQSZACIVSA-N -1 3 358.808 3.704 20 0 FHADHM Cc1c(Cl)cnc(N2CCC[C@@H]2c2ccc(F)cc2)c1-c1nn[n-]n1 ZINC000826238058 609528637 /nfs/dbraw/zinc/52/86/37/609528637.db2.gz VDHIYQQTRLEAPG-CQSZACIVSA-N -1 3 358.808 3.704 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)C(F)(F)c2ccc(C)cc2)s1 ZINC000825694527 609532782 /nfs/dbraw/zinc/53/27/82/609532782.db2.gz RZKJJIRPOOGSSD-UHFFFAOYSA-N -1 3 363.393 3.530 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)C(F)(F)c2ccc(C)cc2)s1 ZINC000825694527 609532784 /nfs/dbraw/zinc/53/27/84/609532784.db2.gz RZKJJIRPOOGSSD-UHFFFAOYSA-N -1 3 363.393 3.530 20 0 FHADHM Cc1ccc([C@H]2CCCCN2c2ncc(Cl)c(C)c2-c2nnn[n-]2)o1 ZINC000826285944 609559378 /nfs/dbraw/zinc/55/93/78/609559378.db2.gz OONNDTFVAYEWJH-CYBMUJFWSA-N -1 3 358.833 3.857 20 0 FHADHM Cc1ccc([C@H]2CCCCN2c2ncc(Cl)c(C)c2-c2nn[n-]n2)o1 ZINC000826285944 609559380 /nfs/dbraw/zinc/55/93/80/609559380.db2.gz OONNDTFVAYEWJH-CYBMUJFWSA-N -1 3 358.833 3.857 20 0 FHADHM Cc1c(Cl)cnc(N[C@@H]2CCOC3(CCCCC3)C2)c1-c1nnn[n-]1 ZINC000826239745 609578584 /nfs/dbraw/zinc/57/85/84/609578584.db2.gz PCUKFIRAKSZLBN-GFCCVEGCSA-N -1 3 362.865 3.517 20 0 FHADHM Cc1c(Cl)cnc(N[C@@H]2CCOC3(CCCCC3)C2)c1-c1nn[n-]n1 ZINC000826239745 609578586 /nfs/dbraw/zinc/57/85/86/609578586.db2.gz PCUKFIRAKSZLBN-GFCCVEGCSA-N -1 3 362.865 3.517 20 0 FHADHM COc1cccc([C@@H]2C[C@@H](C)CN2c2ccc(F)cc2-c2nnn[n-]2)c1 ZINC000826214977 609592784 /nfs/dbraw/zinc/59/27/84/609592784.db2.gz CHPOZFMXKCHWAY-XIKOKIGWSA-N -1 3 353.401 3.602 20 0 FHADHM COc1cccc([C@@H]2C[C@@H](C)CN2c2ccc(F)cc2-c2nn[n-]n2)c1 ZINC000826214977 609592787 /nfs/dbraw/zinc/59/27/87/609592787.db2.gz CHPOZFMXKCHWAY-XIKOKIGWSA-N -1 3 353.401 3.602 20 0 FHADHM C[C@@H]1C[C@@H](CCNc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)CCO1 ZINC000824885323 609596308 /nfs/dbraw/zinc/59/63/08/609596308.db2.gz RTSXFRYQOHXFNI-MNOVXSKESA-N -1 3 355.364 3.503 20 0 FHADHM C[C@@H]1C[C@@H](CCNc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)CCO1 ZINC000824885323 609596311 /nfs/dbraw/zinc/59/63/11/609596311.db2.gz RTSXFRYQOHXFNI-MNOVXSKESA-N -1 3 355.364 3.503 20 0 FHADHM C[C@@H]1C[C@H](CCNc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)CCO1 ZINC000824885568 609596551 /nfs/dbraw/zinc/59/65/51/609596551.db2.gz SVBXVEADZJEMTJ-GHMZBOCLSA-N -1 3 355.364 3.503 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)N1CCC[C@H]1/C=C/c1ccccc1 ZINC000826456294 609607765 /nfs/dbraw/zinc/60/77/65/609607765.db2.gz XTHNPCDEXJLEBT-DXRVJIQQSA-N -1 3 360.421 3.576 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)N1CCC[C@H]1/C=C/c1ccccc1 ZINC000826456294 609607766 /nfs/dbraw/zinc/60/77/66/609607766.db2.gz XTHNPCDEXJLEBT-DXRVJIQQSA-N -1 3 360.421 3.576 20 0 FHADHM C[C@@H](C(=O)OCc1ccc(Cl)cc1-c1nnn[n-]1)c1ccccc1F ZINC000824052599 609612943 /nfs/dbraw/zinc/61/29/43/609612943.db2.gz PYRRHAUURNEPFP-SNVBAGLBSA-N -1 3 360.776 3.506 20 0 FHADHM C[C@@H](C(=O)OCc1ccc(Cl)cc1-c1nn[n-]n1)c1ccccc1F ZINC000824052599 609612944 /nfs/dbraw/zinc/61/29/44/609612944.db2.gz PYRRHAUURNEPFP-SNVBAGLBSA-N -1 3 360.776 3.506 20 0 FHADHM CC(C)(C(=O)OCc1ccc(Cl)cc1-c1nnn[n-]1)c1cccs1 ZINC000824064973 609614568 /nfs/dbraw/zinc/61/45/68/609614568.db2.gz QVFQJBRUUPLNLT-UHFFFAOYSA-N -1 3 362.842 3.603 20 0 FHADHM CC(C)(C(=O)OCc1ccc(Cl)cc1-c1nn[n-]n1)c1cccs1 ZINC000824064973 609614569 /nfs/dbraw/zinc/61/45/69/609614569.db2.gz QVFQJBRUUPLNLT-UHFFFAOYSA-N -1 3 362.842 3.603 20 0 FHADHM COc1ccc2c(c1)CCC[C@]2(NCc1cc(F)c(F)c(F)c1)C(=O)[O-] ZINC000582978587 936342786 /nfs/dbraw/zinc/34/27/86/936342786.db2.gz BFJOEUNBKPJRJZ-LJQANCHMSA-N -1 3 365.351 3.519 20 0 FHADHM O=S(=O)([N-][C@H]1CCC[C@@H]1c1ccccc1)c1cccnc1C(F)(F)F ZINC000583042099 936388312 /nfs/dbraw/zinc/38/83/12/936388312.db2.gz HVITYNRHVGCBEL-KGLIPLIRSA-N -1 3 370.396 3.715 20 0 FHADHM CCCN(C)[C@H](CNC(=O)C(C)(C)CCC(=O)[O-])c1ccc(Cl)cc1 ZINC000634835501 937113776 /nfs/dbraw/zinc/11/37/76/937113776.db2.gz GLPUDZHXTYQFDU-MRXNPFEDSA-N -1 3 368.905 3.730 20 0 FHADHM Cc1ccc2c(CC[N-]S(=O)(=O)c3cc(F)c(C)cc3F)c[nH]c2c1 ZINC001211567017 937139497 /nfs/dbraw/zinc/13/94/97/937139497.db2.gz ODNYRPFLRQYIEO-UHFFFAOYSA-N -1 3 364.417 3.584 20 0 FHADHM O=C(NC12CCC(C(F)(F)F)(CC1)CC2)c1cc(=O)c2ccccc2[n-]1 ZINC000583120094 937142686 /nfs/dbraw/zinc/14/26/86/937142686.db2.gz RYWRYTGMQNXVGN-UHFFFAOYSA-N -1 3 364.367 3.913 20 0 FHADHM Fc1cc(Br)c(F)c(-c2noc(-c3cc(Cl)n[n-]3)n2)c1 ZINC001213500455 927215225 /nfs/dbraw/zinc/21/52/25/927215225.db2.gz IWIBHJSVNYHXBO-UHFFFAOYSA-N -1 3 361.533 3.821 20 0 FHADHM CCS(=O)(=O)[N-]c1ccc(NC(=O)C[C@@H]2CCC[C@@H](C)C2)cc1OC ZINC000153911128 937147361 /nfs/dbraw/zinc/14/73/61/937147361.db2.gz IXTFBEFPQUQMGY-ZIAGYGMSSA-N -1 3 368.499 3.612 20 0 FHADHM O=C(N=c1cc2ccc(Br)cn2[n-]1)c1csc2ccccc12 ZINC000430145241 927286604 /nfs/dbraw/zinc/28/66/04/927286604.db2.gz IOINAQLPGCREMZ-UHFFFAOYSA-N -1 3 372.247 3.986 20 0 FHADHM CSc1nc(=O)[n-]c(C)c1C(=O)Nc1cc(C)cc(C(F)(F)F)c1 ZINC000683138495 927408303 /nfs/dbraw/zinc/40/83/03/927408303.db2.gz SULIMJTZDTZVNV-UHFFFAOYSA-N -1 3 357.357 3.792 20 0 FHADHM C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1[O-])c1cccc(Cl)c1 ZINC000044821449 927451131 /nfs/dbraw/zinc/45/11/31/927451131.db2.gz AHFQURBGBGCKBH-CXAGYDPISA-N -1 3 372.852 3.528 20 0 FHADHM C[C@@H](NC(=O)[C@@H]1CCCN1C(=O)c1ccccc1[O-])c1cccc(Cl)c1 ZINC000044821447 927451473 /nfs/dbraw/zinc/45/14/73/927451473.db2.gz AHFQURBGBGCKBH-DYVFJYSZSA-N -1 3 372.852 3.528 20 0 FHADHM CCCCc1cc(NC(=O)Nc2ccc(-c3cc(=O)[n-]c(C)n3)cc2)n[nH]1 ZINC000683147896 927469821 /nfs/dbraw/zinc/46/98/21/927469821.db2.gz PBLHXNDHDCZXQZ-UHFFFAOYSA-N -1 3 366.425 3.867 20 0 FHADHM O=C(NCc1ncccc1[O-])Nc1ncc(Cc2ccccc2Cl)s1 ZINC000471123324 927573681 /nfs/dbraw/zinc/57/36/81/927573681.db2.gz FEBCHYUVFLEPOU-UHFFFAOYSA-N -1 3 374.853 3.810 20 0 FHADHM Cc1c2cc(F)ccc2oc1S(=O)(=O)[N-]CC[C@@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000583156031 937182686 /nfs/dbraw/zinc/18/26/86/937182686.db2.gz DFVWDLOSLBPFMT-DABQJJPHSA-N -1 3 369.458 3.752 20 0 FHADHM CC(C)[C@H](CNC(=O)c1cc(=O)[n-]c(C2CC2)n1)c1ccc(Cl)cc1 ZINC000655075412 928039880 /nfs/dbraw/zinc/03/98/80/928039880.db2.gz NIXLBAIICFHBIB-HNNXBMFYSA-N -1 3 359.857 3.883 20 0 FHADHM COC(=O)c1cc2c([n-]1)nc(Cl)nc2N1CC[C@@H](C2CCCCC2)C1 ZINC001167067299 928064076 /nfs/dbraw/zinc/06/40/76/928064076.db2.gz DFPBNCLICLDUEY-GFCCVEGCSA-N -1 3 362.861 3.805 20 0 FHADHM Cc1ccccc1C(=O)N[N-]C(=O)c1sccc1-c1ccc(F)cc1 ZINC000065835676 928107390 /nfs/dbraw/zinc/10/73/90/928107390.db2.gz FJBJCZQTXNUVKZ-UHFFFAOYSA-N -1 3 354.406 3.937 20 0 FHADHM CN(c1ncc(C(=O)[O-])cc1Cl)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000388173512 928432363 /nfs/dbraw/zinc/43/23/63/928432363.db2.gz KYNINWDJDQHHDR-MRXNPFEDSA-N -1 3 359.857 3.534 20 0 FHADHM O=C(Nc1ccc(NC(=O)C2CC2)cc1)c1cc2c(cc1[O-])CCCC2 ZINC000109190426 928573029 /nfs/dbraw/zinc/57/30/29/928573029.db2.gz OSFDKCAUVYMFQU-UHFFFAOYSA-N -1 3 350.418 3.872 20 0 FHADHM Cc1sc2[n-]c([C@H](C)OC(=O)CCc3ccccc3F)nc(=O)c2c1C ZINC000021583382 928643139 /nfs/dbraw/zinc/64/31/39/928643139.db2.gz PEANHLBNPVCWQR-NSHDSACASA-N -1 3 374.437 3.978 20 0 FHADHM COc1cc(C(=O)NCCc2csc3ccccc23)cc(OC)c1[O-] ZINC000179537280 928819369 /nfs/dbraw/zinc/81/93/69/928819369.db2.gz VFUQKZPLPQPAJH-UHFFFAOYSA-N -1 3 357.431 3.597 20 0 FHADHM CSc1ccccc1S(=O)(=O)[N-][C@@H](c1ccccc1)C(F)(F)F ZINC000547714279 928828054 /nfs/dbraw/zinc/82/80/54/928828054.db2.gz RJQPGDDHVUIBGQ-AWEZNQCLSA-N -1 3 361.410 3.990 20 0 FHADHM O=C(Nc1cccc(NC([O-])=NO[C@H]2CCCCO2)c1)c1ccccc1 ZINC000274893677 928987914 /nfs/dbraw/zinc/98/79/14/928987914.db2.gz JXFMSWBEESGAMS-KRWDZBQOSA-N -1 3 355.394 3.519 20 0 FHADHM O=C([N-]O[C@H]1CCCCO1)Nc1cccc(NC(=O)c2ccccc2)c1 ZINC000274893677 928987918 /nfs/dbraw/zinc/98/79/18/928987918.db2.gz JXFMSWBEESGAMS-KRWDZBQOSA-N -1 3 355.394 3.519 20 0 FHADHM CCC[C@H](C)NC(=O)c1c[n-]c2c(Cl)cc(Br)cc2c1=O ZINC000683262302 929000319 /nfs/dbraw/zinc/00/03/19/929000319.db2.gz RBLNZGLMHCSXOI-QMMMGPOBSA-N -1 3 371.662 3.862 20 0 FHADHM Cc1oc(-c2ccccc2)nc1C(=O)[N-]c1n[nH]c(-c2cccs2)n1 ZINC000077043633 929385826 /nfs/dbraw/zinc/38/58/26/929385826.db2.gz WEHJNQMRKGMOSS-UHFFFAOYSA-N -1 3 351.391 3.749 20 0 FHADHM Cc1cc(C(F)(F)C(=O)[N-][C@H](C)COc2cccc(F)c2)cnc1Cl ZINC001125311823 929466410 /nfs/dbraw/zinc/46/64/10/929466410.db2.gz VTIXYFBIGASZFL-LLVKDONJSA-N -1 3 372.774 3.858 20 0 FHADHM Cn1c(SCc2nc3c4ccccc4oc3c(=O)[n-]2)nnc1C1CCC1 ZINC000579968071 929660533 /nfs/dbraw/zinc/66/05/33/929660533.db2.gz GWHOSMQRWWDABV-UHFFFAOYSA-N -1 3 367.434 3.770 20 0 FHADHM Cc1cc(=O)[n-]c(-c2cccc(NC(=O)c3cccc(OC(F)F)c3)c2)n1 ZINC000047318212 929866906 /nfs/dbraw/zinc/86/69/06/929866906.db2.gz UFBFQGCAQGTRGH-UHFFFAOYSA-N -1 3 371.343 3.599 20 0 FHADHM C[C@H](C(=O)OC(C)(C)C)N(C(=O)CCCc1ccc([O-])c(F)c1)C1CC1 ZINC000412506563 929924220 /nfs/dbraw/zinc/92/42/20/929924220.db2.gz LTVIQGQDFFZDCU-CYBMUJFWSA-N -1 3 365.445 3.575 20 0 FHADHM Cc1cccc(OC[C@H](C)[N-]S(=O)(=O)c2ccc(Cl)cc2F)c1 ZINC000064952257 929956074 /nfs/dbraw/zinc/95/60/74/929956074.db2.gz KJTVFLSDRIMOQO-LBPRGKRZSA-N -1 3 357.834 3.533 20 0 FHADHM CC(C)[C@H]1CN(Cc2ccccc2)CCN1C(=O)c1cccc([O-])c1F ZINC001167371713 930410310 /nfs/dbraw/zinc/41/03/10/930410310.db2.gz CWXZGCAAMRQDEK-GOSISDBHSA-N -1 3 356.441 3.514 20 0 FHADHM Cc1cc(=O)[n-]c(C(C)(C)NC(=O)c2cc(Cl)cc(C(F)(F)F)c2)n1 ZINC000622739434 930525567 /nfs/dbraw/zinc/52/55/67/930525567.db2.gz JFZIJDJXJYFSLH-UHFFFAOYSA-N -1 3 373.762 3.828 20 0 FHADHM 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935256365 /nfs/dbraw/zinc/25/63/65/935256365.db2.gz WHWDZABAXGKFHO-UHFFFAOYSA-N -1 3 368.840 3.575 20 0 FHADHM CCCO[C@H]1CCCN(Cc2cc(Br)ccc2C(=O)[O-])CC1 ZINC000563278259 935389544 /nfs/dbraw/zinc/38/95/44/935389544.db2.gz UREZZYUDTQXLFG-HNNXBMFYSA-N -1 3 370.287 3.928 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NS(=O)(=O)CCC(C)(C)C)c2)n1 ZINC000582213464 935407642 /nfs/dbraw/zinc/40/76/42/935407642.db2.gz KCUUQVTUYJGRBT-UHFFFAOYSA-N -1 3 363.483 3.590 20 0 FHADHM CCc1n[nH]c(=O)c(-c2nc(-c3ccc4nc([O-])oc4c3)cs2)c1CC ZINC000582216009 935411036 /nfs/dbraw/zinc/41/10/36/935411036.db2.gz WPZMJHJEWAYSMN-UHFFFAOYSA-N -1 3 368.418 3.944 20 0 FHADHM O=C([O-])CCCCCCCNCc1cn(-c2ccc(F)c(Cl)c2)nn1 ZINC000277522248 935436060 /nfs/dbraw/zinc/43/60/60/935436060.db2.gz YUKMFDCWWTWTDB-UHFFFAOYSA-N -1 3 368.840 3.575 20 0 FHADHM C[C@H](c1ccc(Cl)cc1)[C@H](C)N(C)C(=O)c1nnc2ccccc2c1[O-] ZINC000176669635 935671024 /nfs/dbraw/zinc/67/10/24/935671024.db2.gz IKAFKTNYVIDSMI-STQMWFEESA-N -1 3 369.852 3.841 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)C=Cc3scnc3C)c2)n1 ZINC000588517479 935697623 /nfs/dbraw/zinc/69/76/23/935697623.db2.gz JIDYJAMSRNPXBR-FPLPWBNLSA-N -1 3 366.446 3.828 20 0 FHADHM CN(C)[C@@H](CNC(=O)c1ccc(C(F)(F)F)c([O-])c1)c1cccs1 ZINC000684870182 935697812 /nfs/dbraw/zinc/69/78/12/935697812.db2.gz RAAPPFXTNATIQY-LBPRGKRZSA-N -1 3 358.385 3.505 20 0 FHADHM CCCOc1ccc(-c2noc(-c3ccc([N-]S(C)(=O)=O)cc3)n2)cc1 ZINC000582457884 935734407 /nfs/dbraw/zinc/73/44/07/935734407.db2.gz KEGMFYCZHVOLIV-UHFFFAOYSA-N -1 3 373.434 3.564 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2cccc(-n3nc(C)cc3C)c2)c(C)c1 ZINC000511148610 935799346 /nfs/dbraw/zinc/79/93/46/935799346.db2.gz ZRPKZWZJEMZXHS-UHFFFAOYSA-N -1 3 371.462 3.607 20 0 FHADHM CCC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(N3CCCC3)c(C)c2)c1 ZINC000158443919 935808336 /nfs/dbraw/zinc/80/83/36/935808336.db2.gz RRGYSRYLKPDLEF-UHFFFAOYSA-N -1 3 372.490 3.989 20 0 FHADHM CN(CCCN(C)C(=O)c1cccc(C(F)(F)F)c1[O-])Cc1ccco1 ZINC000563397431 935838947 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COc1cccc([C@@H]([N-]c2nnc(C(F)(F)F)s2)c2nccn2C)c1 ZINC000153379456 936144522 /nfs/dbraw/zinc/14/45/22/936144522.db2.gz BFZKVRUCBMJYEW-LLVKDONJSA-N -1 3 369.372 3.501 20 0 FHADHM COc1ccc([C@H]([N-]c2nnc(C(F)(F)F)s2)c2nccn2C)cc1 ZINC000153395559 936153480 /nfs/dbraw/zinc/15/34/80/936153480.db2.gz NHVDIJQYIHULFF-NSHDSACASA-N -1 3 369.372 3.501 20 0 FHADHM CC(C)[C@H](Cc1ccc(F)cc1)N(C)C(=O)N=c1cc2ccccn2[n-]1 ZINC000582864053 936232992 /nfs/dbraw/zinc/23/29/92/936232992.db2.gz QJONTFDYANOLQO-SFHVURJKSA-N -1 3 354.429 3.626 20 0 FHADHM CC(C)[C@@H](Cc1ccc(F)cc1)N(C)C(=O)N=c1cc2ccccn2[n-]1 ZINC000582864052 936233245 /nfs/dbraw/zinc/23/32/45/936233245.db2.gz QJONTFDYANOLQO-GOSISDBHSA-N -1 3 354.429 3.626 20 0 FHADHM CCCOc1ccc(-n2c([O-])c(CC(F)(F)F)[nH]c2=O)cc1OCCC ZINC000277978697 936301711 /nfs/dbraw/zinc/30/17/11/936301711.db2.gz HCPQDGHZWGCLFO-LBPRGKRZSA-N -1 3 374.359 3.641 20 0 FHADHM O=C(CNC(=O)c1ccc([O-])cc1)N1CCCC[C@@H]1c1ccc(Cl)cc1 ZINC000583739544 938386427 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C[C@H](C(=O)NCc1ccc([O-])c(Br)c1)c1ccccc1F ZINC000151576575 938586342 /nfs/dbraw/zinc/58/63/42/938586342.db2.gz IPXWMRHTEMZOGH-JTQLQIEISA-N -1 3 352.203 3.714 20 0 FHADHM CO[C@](C)(C(=O)Nc1cc(Br)ccc1[O-])c1ccccc1 ZINC000536210367 938587699 /nfs/dbraw/zinc/58/76/99/938587699.db2.gz YYZBDGFPFJTBKA-INIZCTEOSA-N -1 3 350.212 3.655 20 0 FHADHM O=C(Cc1ccccc1Cl)NCc1ccc([O-])c(Br)c1 ZINC000151583170 938588061 /nfs/dbraw/zinc/58/80/61/938588061.db2.gz QEZRRLNWZPBDFD-UHFFFAOYSA-N -1 3 354.631 3.667 20 0 FHADHM CC[C@@H](C)c1cc(C(=O)NCc2ccc([O-])c(Br)c2)on1 ZINC000151648535 938613317 /nfs/dbraw/zinc/61/33/17/938613317.db2.gz RGDISXCVMJBSDX-SECBINFHSA-N -1 3 353.216 3.586 20 0 FHADHM O=C(Nc1cc(Cl)ccc1[O-])c1n[nH]c2ccc(Br)cc21 ZINC000600967647 938622846 /nfs/dbraw/zinc/62/28/46/938622846.db2.gz RXVSVINYFAGMBA-UHFFFAOYSA-N -1 3 366.602 3.937 20 0 FHADHM O=C(Nc1c([O-])cccc1Cl)[C@H]1CCc2[nH]nc(C(F)(F)F)c2C1 ZINC000519180423 945196115 /nfs/dbraw/zinc/19/61/15/945196115.db2.gz SDVMRSZFJNIROJ-ZETCQYMHSA-N 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O=C(NC[C@@H]1CCN(c2ccc(Cl)cc2)C1)c1cc([O-])ccc1Cl ZINC000685650156 939008430 /nfs/dbraw/zinc/00/84/30/939008430.db2.gz UBRDBEOTJIJYFN-LBPRGKRZSA-N -1 3 365.260 3.955 20 0 FHADHM C[C@@H](C[N-]S(=O)(=O)c1cccc(Cl)c1Cl)c1nccs1 ZINC000186694235 939015183 /nfs/dbraw/zinc/01/51/83/939015183.db2.gz OOLOHXZQEBCCJB-QMMMGPOBSA-N -1 3 351.280 3.532 20 0 FHADHM O=C(Nc1cnc(-c2cccc(O)c2)nc1)c1cc([O-])c2ccccc2c1 ZINC000685696736 939020690 /nfs/dbraw/zinc/02/06/90/939020690.db2.gz BUTZOCOSTOFMSO-UHFFFAOYSA-N -1 3 357.369 3.960 20 0 FHADHM CSc1ccc([O-])c(C(=O)N2CC[C@@H](OCCCc3ccccc3)C2)c1 ZINC000612048865 939026957 /nfs/dbraw/zinc/02/69/57/939026957.db2.gz FMIUIDDPZQYPSS-QGZVFWFLSA-N -1 3 371.502 3.978 20 0 FHADHM Cc1nn(-c2ccc(C)c(Cl)c2)c(C)c1CC(=O)Nc1ncccc1[O-] ZINC000612072979 939037653 /nfs/dbraw/zinc/03/76/53/939037653.db2.gz ZSANFNXASRJICN-UHFFFAOYSA-N -1 3 370.840 3.733 20 0 FHADHM CC(C)[C@@H](C[N-]S(=O)(=O)c1cnc(Cl)c(Cl)c1)c1cccnc1 ZINC000177020007 939044567 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O=C(Nc1cc(I)ccc1[O-])C12CCC(CC1)C2 ZINC000612313686 939992078 /nfs/dbraw/zinc/99/20/78/939992078.db2.gz KEGSMSIDJLTGOO-UHFFFAOYSA-N -1 3 357.191 3.516 20 0 FHADHM O=C(Nc1ccc(Cl)cc1[O-])[C@@H]1Cc2cc(Br)ccc2O1 ZINC000472439151 940137961 /nfs/dbraw/zinc/13/79/61/940137961.db2.gz KXAJVISEVGTOQE-AWEZNQCLSA-N -1 3 368.614 3.750 20 0 FHADHM COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)c1cc([O-])c2ccccc2c1 ZINC000472444020 940165874 /nfs/dbraw/zinc/16/58/74/940165874.db2.gz YXYOKNDOMDXKRO-HNNXBMFYSA-N -1 3 363.413 3.749 20 0 FHADHM O=S(=O)([N-]c1ccc(F)cc1F)c1cccc(OC(F)(F)F)c1 ZINC000024241964 940366220 /nfs/dbraw/zinc/36/62/20/940366220.db2.gz FDWWGFGHHBTGEZ-UHFFFAOYSA-N -1 3 353.268 3.664 20 0 FHADHM CC(=O)Nc1cc([N-]S(=O)(=O)c2cccc(Cl)c2C)c(F)cc1F ZINC000066306473 940403315 /nfs/dbraw/zinc/40/33/15/940403315.db2.gz RXCSAICQODRKBB-UHFFFAOYSA-N -1 3 374.796 3.686 20 0 FHADHM CCc1cc([N-]S(=O)(=O)c2cc(OC)c(OC)cc2C)ccc1F ZINC000507572139 945324420 /nfs/dbraw/zinc/32/44/20/945324420.db2.gz XSJBAHPMUYPMFW-UHFFFAOYSA-N -1 3 353.415 3.515 20 0 FHADHM CC(=O)N(c1nc(C=Cc2cc(=O)[n-]c(C(C)(C)C)n2)cs1)C1CC1 ZINC000414087061 940491956 /nfs/dbraw/zinc/49/19/56/940491956.db2.gz ZXYVUUWTYUZGCJ-AATRIKPKSA-N -1 3 358.467 3.622 20 0 FHADHM O=C(NNc1ccncc1Cl)c1cn[n-]c1-c1ccc(Cl)s1 ZINC000188246124 940495556 /nfs/dbraw/zinc/49/55/56/940495556.db2.gz SJKZIRSWQTXWCN-UHFFFAOYSA-N -1 3 354.222 3.597 20 0 FHADHM O=C(NNc1ccncc1Cl)c1c[n-]nc1-c1ccc(Cl)s1 ZINC000188246124 940495557 /nfs/dbraw/zinc/49/55/57/940495557.db2.gz SJKZIRSWQTXWCN-UHFFFAOYSA-N -1 3 354.222 3.597 20 0 FHADHM O=C(Nc1ccc2nc(C3CC3)sc2c1)c1cc(F)cc2n[n-]nc21 ZINC000431794291 940509418 /nfs/dbraw/zinc/50/94/18/940509418.db2.gz KGSCFYFXKOGLGX-UHFFFAOYSA-N -1 3 353.382 3.836 20 0 FHADHM CC(C)[C@H](Cc1ccccc1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820021620 945330379 /nfs/dbraw/zinc/33/03/79/945330379.db2.gz XEUNSBGRFKJCIT-HNNXBMFYSA-N -1 3 369.856 3.974 20 0 FHADHM CC(C)[C@H](Cc1ccccc1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820021620 945330387 /nfs/dbraw/zinc/33/03/87/945330387.db2.gz XEUNSBGRFKJCIT-HNNXBMFYSA-N -1 3 369.856 3.974 20 0 FHADHM Cc1nc(C[N-]S(=O)(=O)c2cccc(Cl)c2Cl)sc1C ZINC000173226305 940597394 /nfs/dbraw/zinc/59/73/94/940597394.db2.gz LWLXFHTYKYNPCR-UHFFFAOYSA-N -1 3 351.280 3.545 20 0 FHADHM Cc1c2cc(F)ccc2oc1C(=O)NCc1cc(=O)[n-]c(C2CCC2)n1 ZINC000636317886 940601436 /nfs/dbraw/zinc/60/14/36/940601436.db2.gz KEZWHCCPBGHTJR-UHFFFAOYSA-N -1 3 355.369 3.573 20 0 FHADHM C[C@@H](Oc1cccc(C(C)(C)C)c1)C(=O)Nc1n[n-]c(-c2ccco2)n1 ZINC000613341040 940612691 /nfs/dbraw/zinc/61/26/91/940612691.db2.gz DNUMVQJSFLDJLP-GFCCVEGCSA-N -1 3 354.410 3.768 20 0 FHADHM COC(=O)c1cc(S(=O)(=O)[N-][C@H](CC(C)C)c2cccs2)oc1C ZINC000431817023 940640180 /nfs/dbraw/zinc/64/01/80/940640180.db2.gz BIDSIGCYXUULSG-CYBMUJFWSA-N -1 3 371.480 3.502 20 0 FHADHM COC[C@H]([N-]S(=O)(=O)c1c(Cl)cccc1Cl)c1ccccc1 ZINC000170735925 940799271 /nfs/dbraw/zinc/79/92/71/940799271.db2.gz TZDRYASTRGDZSQ-AWEZNQCLSA-N -1 3 360.262 3.659 20 0 FHADHM 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CCOc1ccc(S(=O)(=O)[N-]c2ccc(OC)cc2C)cc1OCC ZINC000589148776 941223346 /nfs/dbraw/zinc/22/33/46/941223346.db2.gz CRLXNBQORXVOHK-UHFFFAOYSA-N -1 3 365.451 3.602 20 0 FHADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@@H]3CCC(C)(C)O3)nc(=O)c2c1C ZINC000785244652 941288129 /nfs/dbraw/zinc/28/81/29/941288129.db2.gz RRYWWMSZIWRBAV-ONGXEEELSA-N -1 3 350.440 3.576 20 0 FHADHM CCOC(=O)c1ncc(NC(=O)c2cc(-c3ccccn3)ccc2Cl)[n-]1 ZINC000617873693 941334437 /nfs/dbraw/zinc/33/44/37/941334437.db2.gz JCLZLIDNAVVCHJ-UHFFFAOYSA-N -1 3 370.796 3.554 20 0 FHADHM CCOC(=O)c1nc(NC(=O)c2cc(-c3ccccn3)ccc2Cl)c[n-]1 ZINC000617873693 941334439 /nfs/dbraw/zinc/33/44/39/941334439.db2.gz JCLZLIDNAVVCHJ-UHFFFAOYSA-N -1 3 370.796 3.554 20 0 FHADHM O=C(NC[C@H](c1cccc(Cl)c1)N1CCCC1)c1ccc([O-])cc1F ZINC000181129390 941359448 /nfs/dbraw/zinc/35/94/48/941359448.db2.gz LJAGFBGQINJLIY-GOSISDBHSA-N -1 3 362.832 3.752 20 0 FHADHM CC(C)Oc1ccc(Cl)cc1C(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000590001014 941380358 /nfs/dbraw/zinc/38/03/58/941380358.db2.gz 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20 0 FHADHM CCS[C@@H](C)c1noc(CSCc2cc(=O)[n-]c(C3CC3)n2)n1 ZINC000419444904 942266140 /nfs/dbraw/zinc/26/61/40/942266140.db2.gz UJNSMMOYAVZZNZ-VIFPVBQESA-N -1 3 352.485 3.690 20 0 FHADHM COC(=O)c1csc(S(=O)(=O)[N-][C@@H](CC(C)C)c2ccccc2)c1 ZINC000502197604 942286156 /nfs/dbraw/zinc/28/61/56/942286156.db2.gz RWQAAHPQBRKDFB-HNNXBMFYSA-N -1 3 367.492 3.600 20 0 FHADHM Cc1ccccc1CN(C)C(=O)[C@@H](C)SCc1cc(=O)[n-]c(C2CC2)n1 ZINC000419599419 942327357 /nfs/dbraw/zinc/32/73/57/942327357.db2.gz FCGCNEWHQSQTPQ-CQSZACIVSA-N -1 3 371.506 3.648 20 0 FHADHM CCOc1ccccc1NC(=O)[C@H](C)SCc1cc(=O)[n-]c(C2CC2)n1 ZINC000419599445 942327396 /nfs/dbraw/zinc/32/73/96/942327396.db2.gz FEQNBPKMKWNKOG-LBPRGKRZSA-N -1 3 373.478 3.719 20 0 FHADHM CO[C@@H](CC(C)C)CS(=O)(=O)[N-]c1cccc(Oc2ccncc2)c1 ZINC000421153215 942375311 /nfs/dbraw/zinc/37/53/11/942375311.db2.gz LNFFEQGZGYJRKD-SFHVURJKSA-N -1 3 364.467 3.677 20 0 FHADHM O=C([N-]OCc1cccnc1)C12C[C@H]3C[C@@H](C1)CC(C(F)(F)F)(C3)C2 ZINC000378223174 942417735 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CC(=CC(=O)N1CCCc2c(=O)[n-]cnc21)c1cccc(C(F)(F)F)c1 ZINC000893216449 942669820 /nfs/dbraw/zinc/66/98/20/942669820.db2.gz RIDASCLRDWVTFD-FLIBITNWSA-N -1 3 363.339 3.584 20 0 FHADHM O=C(CC1CCC(c2ccccc2)CC1)N1CCCc2c(=O)[n-]cnc21 ZINC000893215699 942673664 /nfs/dbraw/zinc/67/36/64/942673664.db2.gz JIFQWMKKXDPRDM-UHFFFAOYSA-N -1 3 351.450 3.826 20 0 FHADHM CC(=O)Nc1ccc(-c2csc([N-]c3ncnc4ccncc43)n2)cc1 ZINC000502726570 942696891 /nfs/dbraw/zinc/69/68/91/942696891.db2.gz LFEBXMWCJGZGFR-UHFFFAOYSA-N -1 3 362.418 3.850 20 0 FHADHM CC[C@@H](CC(C)C)C(=O)N=c1[n-]n(CC(F)(F)F)cc1Br ZINC000421678747 942754491 /nfs/dbraw/zinc/75/44/91/942754491.db2.gz CZHYOIGFTKLKDR-VIFPVBQESA-N -1 3 370.213 3.641 20 0 FHADHM CCC(CC)c1cc(C[N-]S(=O)(=O)c2ccc(Cl)c(OC)c2)on1 ZINC000416410900 942796098 /nfs/dbraw/zinc/79/60/98/942796098.db2.gz YGWZPDODEAYJCZ-UHFFFAOYSA-N -1 3 372.874 3.719 20 0 FHADHM C[C@H]1CCCC[C@H]1NC(=O)Cc1nc(=O)c2cc(C(F)(F)F)sc2[n-]1 ZINC000416418354 942807814 /nfs/dbraw/zinc/80/78/14/942807814.db2.gz 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ZINC000280766743 942966632 /nfs/dbraw/zinc/96/66/32/942966632.db2.gz BJEQQIMNFJTLJK-UHFFFAOYSA-N -1 3 350.378 3.529 20 0 FHADHM CC(C)(C)c1ccc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2[O-])cc1 ZINC000048015622 943071904 /nfs/dbraw/zinc/07/19/04/943071904.db2.gz JHSBPZFTBKIJJI-GOSISDBHSA-N -1 3 366.461 3.933 20 0 FHADHM O=C([N-]c1c2nsnc2ccc1Cl)c1csc([C@@H]2CCCO2)n1 ZINC000271982878 943078310 /nfs/dbraw/zinc/07/83/10/943078310.db2.gz KDNFYXVTRNYLRL-JTQLQIEISA-N -1 3 366.855 3.905 20 0 FHADHM Cc1cc(Br)c([O-])c(NC(=O)c2sccc2CN(C)C)c1 ZINC000272508418 943168082 /nfs/dbraw/zinc/16/80/82/943168082.db2.gz QFHFYWHUMHOMRE-UHFFFAOYSA-N -1 3 369.284 3.839 20 0 FHADHM COc1ccc(/C=C/C(=O)Nc2cc(Br)ccc2[O-])cc1O ZINC000185623230 943194660 /nfs/dbraw/zinc/19/46/60/943194660.db2.gz VBIKRKJJOLAVKR-XVNBXDOJSA-N -1 3 364.195 3.521 20 0 FHADHM O=C(NC1(c2ccc(Cl)c(Cl)c2)CC1)c1cc(F)cc2n[n-]nc21 ZINC000503494426 943218419 /nfs/dbraw/zinc/21/84/19/943218419.db2.gz QTWOOMBHQMGMNS-UHFFFAOYSA-N -1 3 365.195 3.823 20 0 FHADHM CC(=O)[C@@H]1C[C@H](CC(=O)Nc2cccc(-c3nc(C)cc(=O)[n-]3)c2)C1(C)C ZINC000363962841 943224681 /nfs/dbraw/zinc/22/46/81/943224681.db2.gz IRQKEFMIAZMPSK-WBVHZDCISA-N -1 3 367.449 3.738 20 0 FHADHM C[C@H](NC(=O)N=c1cc2ccccn2[n-]1)c1nc(-c2ccccc2)cs1 ZINC000514723474 943247820 /nfs/dbraw/zinc/24/78/20/943247820.db2.gz PDQDMLXRJSMOGR-ZDUSSCGKSA-N -1 3 363.446 3.762 20 0 FHADHM O=S(=O)([N-][C@H]1CCCc2occc21)c1cc(F)ccc1Br ZINC000435216128 943252559 /nfs/dbraw/zinc/25/25/59/943252559.db2.gz XYEIEZSVPPGEDA-LBPRGKRZSA-N -1 3 374.231 3.537 20 0 FHADHM COc1ccc([C@@H](C)Nc2ccc(OC)c([N-]S(C)(=O)=O)c2)cc1C ZINC000272990295 943256598 /nfs/dbraw/zinc/25/65/98/943256598.db2.gz VZUTUNUSDBDIHI-CYBMUJFWSA-N -1 3 364.467 3.557 20 0 FHADHM COc1cc(C)c(Br)cc1NCc1cc(=O)[n-]c(C2CC2)n1 ZINC000417019813 943294065 /nfs/dbraw/zinc/29/40/65/943294065.db2.gz FAJVKIWQECGTAM-UHFFFAOYSA-N -1 3 364.243 3.751 20 0 FHADHM CO[C@H](CS(=O)(=O)[N-]c1ccc(-c2ccc(Cl)s2)nc1)C1CC1 ZINC000584593585 943310640 /nfs/dbraw/zinc/31/06/40/943310640.db2.gz FSVNBCQVBABKOC-CYBMUJFWSA-N -1 3 372.899 3.630 20 0 FHADHM O=C(Nc1nnc(C(F)(F)F)[n-]1)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F ZINC000514823161 943312461 /nfs/dbraw/zinc/31/24/61/943312461.db2.gz YYFCMXRSWBWZRM-VXNVDRBHSA-N -1 3 362.714 3.748 20 0 FHADHM O=C(Nc1nc(C(F)(F)F)n[n-]1)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F ZINC000514823161 943312463 /nfs/dbraw/zinc/31/24/63/943312463.db2.gz YYFCMXRSWBWZRM-VXNVDRBHSA-N -1 3 362.714 3.748 20 0 FHADHM CCCc1cc(=O)[n-]c(C(=Cc2ccc(O[C@@H](C)C(=O)OC)cc2)CC)n1 ZINC000435338613 943340045 /nfs/dbraw/zinc/34/00/45/943340045.db2.gz HIJIYBLRNSPXJX-AOHITCTBSA-N -1 3 370.449 3.613 20 0 FHADHM Cc1coc(-c2ccc(C)c(NC(=O)c3cc(F)cc4n[n-]nc43)c2)n1 ZINC000503713950 943342692 /nfs/dbraw/zinc/34/26/92/943342692.db2.gz BGAGFLGTJBAYHK-UHFFFAOYSA-N -1 3 351.341 3.621 20 0 FHADHM CCOc1ccc([C@@H]2C[C@H]2[N-]S(=O)(=O)c2cc(F)ccc2Cl)cc1 ZINC000435431419 943409703 /nfs/dbraw/zinc/40/97/03/943409703.db2.gz IKQNOBTXRAEUQH-GOEBONIOSA-N -1 3 369.845 3.712 20 0 FHADHM Cc1ccc(Cl)c(S(=O)(=O)[N-]CC[C@@H]2CCCCO2)c1Cl ZINC000503994225 943458086 /nfs/dbraw/zinc/45/80/86/943458086.db2.gz NHMSXPPSLCADSQ-NSHDSACASA-N -1 3 352.283 3.539 20 0 FHADHM CC1(C)CC[C@H](C[N-]S(=O)(=O)c2cc(Cl)ccc2C(F)(F)F)O1 ZINC000509975852 943501150 /nfs/dbraw/zinc/50/11/50/943501150.db2.gz ZPDVRCLJKZVVQI-SNVBAGLBSA-N -1 3 371.808 3.595 20 0 FHADHM COc1ccc(Cl)c(S(=O)(=O)[N-]CC(C)(C)CC(F)(F)F)c1 ZINC000660197178 943527703 /nfs/dbraw/zinc/52/77/03/943527703.db2.gz CSBPLOHSXSLDQK-UHFFFAOYSA-N -1 3 359.797 3.606 20 0 FHADHM CSCc1cnc(CNC[C@H](Cc2ccc(Cl)cc2)C(=O)[O-])s1 ZINC000417542272 943681455 /nfs/dbraw/zinc/68/14/55/943681455.db2.gz DKEAZYSZOJWSQE-LBPRGKRZSA-N -1 3 370.927 3.693 20 0 FHADHM Cc1ncsc1CN[C@@H](CC(=O)[O-])c1cccc(Br)c1 ZINC000417557774 943704205 /nfs/dbraw/zinc/70/42/05/943704205.db2.gz SLVSXEGXAZWXNQ-LBPRGKRZSA-N -1 3 355.257 3.520 20 0 FHADHM O=c1cc(CS[C@@H]2C[C@@H]3CCCC[C@H]3NC2=O)nc(-c2ccccc2)[n-]1 ZINC000584829832 943708428 /nfs/dbraw/zinc/70/84/28/943708428.db2.gz NJHDWHAMHHFIDB-USXIJHARSA-N -1 3 369.490 3.530 20 0 FHADHM CC(C)[C@H]1C[C@](NCc2cnc(C(C)(C)C)nc2)(C(=O)[O-])c2ccccc21 ZINC000417562650 943713848 /nfs/dbraw/zinc/71/38/48/943713848.db2.gz CHYZOUPJUIFCIF-VGOFRKELSA-N -1 3 367.493 3.987 20 0 FHADHM COc1cccc(C[C@@H](NCc2cc(Cl)sc2Cl)C(=O)[O-])c1 ZINC000417582884 943729622 /nfs/dbraw/zinc/72/96/22/943729622.db2.gz KDSJCLUWOKWYJP-GFCCVEGCSA-N -1 3 360.262 3.849 20 0 FHADHM CCOc1c(OC)cc(CN[C@@H]2C[C@@H](C(=O)[O-])c3ccccc32)cc1OC ZINC000417618524 943754483 /nfs/dbraw/zinc/75/44/83/943754483.db2.gz CYNNDTDCPUHGOS-IAGOWNOFSA-N -1 3 371.433 3.505 20 0 FHADHM CC(C)(C)OC(=O)CC[C@@H](NCc1cc(Cl)ccc1Cl)C(=O)[O-] ZINC000417613652 943763572 /nfs/dbraw/zinc/76/35/72/943763572.db2.gz AANMDCVKBDSYHL-CYBMUJFWSA-N -1 3 362.253 3.658 20 0 FHADHM CCCc1csc(CNC[C@H](Cc2cc(F)c(F)c(F)c2)C(=O)[O-])n1 ZINC000417631976 943769779 /nfs/dbraw/zinc/76/97/79/943769779.db2.gz FOONXZJGBNTYCJ-NSHDSACASA-N -1 3 372.412 3.546 20 0 FHADHM O=C([O-])C[C@@H](CNCc1cc(Cl)ccc1Br)C(F)F ZINC000417633760 943771723 /nfs/dbraw/zinc/77/17/23/943771723.db2.gz ZUPLADYXIYEPIL-QMMMGPOBSA-N -1 3 356.594 3.548 20 0 FHADHM COc1cc2ccccc2cc1CN[C@H](CCC(=O)OC(C)(C)C)C(=O)[O-] ZINC000417625921 943775713 /nfs/dbraw/zinc/77/57/13/943775713.db2.gz QLAQJCZWNRKXJE-QGZVFWFLSA-N -1 3 373.449 3.513 20 0 FHADHM CCOC(=O)c1ccc(NC(=O)CO[C@H]2CCCc3ccccc32)c([O-])c1 ZINC000435805131 943780398 /nfs/dbraw/zinc/78/03/98/943780398.db2.gz WWFPQAIBUHLARQ-IBGZPJMESA-N -1 3 369.417 3.602 20 0 FHADHM O=C([O-])CC[C@H]1CCCCN1Cc1coc(-c2ccc(F)c(F)c2)n1 ZINC000424250354 943805618 /nfs/dbraw/zinc/80/56/18/943805618.db2.gz BNABMJBJPLGGJX-CQSZACIVSA-N -1 3 350.365 3.839 20 0 FHADHM O=C([O-])CC[C@@H]1CCCCN1Cc1nn(-c2ccccc2)c2c1CCC2 ZINC000424255975 943808452 /nfs/dbraw/zinc/80/84/52/943808452.db2.gz IPCVMSTYRMQOMX-INIZCTEOSA-N -1 3 353.466 3.580 20 0 FHADHM COc1cc(CNCc2ccc(C(=O)[O-])c(C)c2)ccc1OC(F)F ZINC000417665931 943808806 /nfs/dbraw/zinc/80/88/06/943808806.db2.gz FCBXUGHQOZYDAM-UHFFFAOYSA-N -1 3 351.349 3.593 20 0 FHADHM Cc1cccc(CN(CC(C)C)C(=O)CCc2c(C)nc(C)[n-]c2=O)c1 ZINC000515370993 943816421 /nfs/dbraw/zinc/81/64/21/943816421.db2.gz WXIAPGRWGYBQID-UHFFFAOYSA-N -1 3 355.482 3.725 20 0 FHADHM C/C=C\c1ccc(OCC(=O)Nc2cccc(C(C)=O)c2[O-])c(OC)c1 ZINC000515399600 943848789 /nfs/dbraw/zinc/84/87/89/943848789.db2.gz OIWCUNPGHWEUSN-XQRVVYSFSA-N -1 3 355.390 3.654 20 0 FHADHM O=C(N[C@@H]1C[C@H]1c1cccc2ccccc21)c1cc(=O)c2ccccc2[n-]1 ZINC000435958709 943881563 /nfs/dbraw/zinc/88/15/63/943881563.db2.gz BAXPUVINGXJVHG-AZUAARDMSA-N -1 3 354.409 3.967 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NCc3cc(COC)cs3)nc2)n1 ZINC000664385581 943885449 /nfs/dbraw/zinc/88/54/49/943885449.db2.gz XFVFMUAMFCKKNB-UHFFFAOYSA-N -1 3 356.451 3.627 20 0 FHADHM C[C@H](NC(=O)NN=c1ccc(Cl)n[n-]1)c1cc(Cl)ccc1Cl ZINC000188296474 943886608 /nfs/dbraw/zinc/88/66/08/943886608.db2.gz LWKQXBHKQXNOIX-ZETCQYMHSA-N -1 3 360.632 3.824 20 0 FHADHM CSc1cc(Br)ccc1CN1CCC[C@H](C)[C@@H]1C(=O)[O-] ZINC000424423648 943900062 /nfs/dbraw/zinc/90/00/62/943900062.db2.gz VFJIWFIGSUUONE-IINYFYTJSA-N -1 3 358.301 3.856 20 0 FHADHM O=C(N=c1cc(-c2ccccc2)[n-][nH]1)c1cnccc1Oc1ccccc1 ZINC000506127526 944092638 /nfs/dbraw/zinc/09/26/38/944092638.db2.gz PRQGGSGEGKKSIN-UHFFFAOYSA-N -1 3 356.385 3.938 20 0 FHADHM O=C(NCCc1nc(-c2ccncc2)cs1)c1cc([O-])ccc1Cl ZINC000517249566 944145711 /nfs/dbraw/zinc/14/57/11/944145711.db2.gz KAPJQQPZZHOXLW-UHFFFAOYSA-N -1 3 359.838 3.537 20 0 FHADHM COc1cc(Cl)c(Cl)cc1NC(=O)NN=c1nc(C)cc(C)[n-]1 ZINC000191264016 944152670 /nfs/dbraw/zinc/15/26/70/944152670.db2.gz VWKFSXMFQXPHAM-UHFFFAOYSA-N -1 3 356.213 3.557 20 0 FHADHM Cc1cc(C(=O)N=c2cc(-c3cc(F)cc(Br)c3)[n-][nH]2)co1 ZINC000436352376 944233759 /nfs/dbraw/zinc/23/37/59/944233759.db2.gz NGKZBIWFSAXACV-UHFFFAOYSA-N -1 3 364.174 3.554 20 0 FHADHM O=C(NCc1ccc([O-])c(F)c1)N[C@@H]1C[C@H]1c1ccc(Cl)c(F)c1 ZINC000437935950 944238674 /nfs/dbraw/zinc/23/86/74/944238674.db2.gz QZFFKCNEBWNZJI-XHDPSFHLSA-N -1 3 352.768 3.679 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N3CC4CC3(c3ccccc3)C4)nc2)n1 ZINC000664668213 944246681 /nfs/dbraw/zinc/24/66/81/944246681.db2.gz XPLOFAKLLUWCPE-UHFFFAOYSA-N -1 3 358.445 3.932 20 0 FHADHM O=C(Nc1cccc(-n2cc(C(F)(F)F)cn2)c1)c1c([O-])cccc1O ZINC000439061720 944291226 /nfs/dbraw/zinc/29/12/26/944291226.db2.gz VAINVYWOSNGHKT-UHFFFAOYSA-N -1 3 363.295 3.555 20 0 FHADHM C[C@]1(c2ccccc2)C[C@@H]1[N-]S(=O)(=O)c1ccc(Br)s1 ZINC000608031448 944312921 /nfs/dbraw/zinc/31/29/21/944312921.db2.gz OQHDBAUHCCRRNO-SMDDNHRTSA-N -1 3 372.309 3.519 20 0 FHADHM O=C(NCc1ccc([O-])c(F)c1)c1csc(Cc2cccc(F)c2)n1 ZINC000506484629 944344183 /nfs/dbraw/zinc/34/41/83/944344183.db2.gz YZDUTMJIRHXEMX-UHFFFAOYSA-N -1 3 360.385 3.648 20 0 FHADHM Cc1ccc(C(=O)NCCC(=O)Nc2cccc3ccsc32)c([O-])c1 ZINC000436481570 944346935 /nfs/dbraw/zinc/34/69/35/944346935.db2.gz CIVWXHNRGPUXRZ-UHFFFAOYSA-N -1 3 354.431 3.674 20 0 FHADHM O=S(=O)([N-]c1ccc(-c2nc[nH]n2)cc1F)c1cccc2ccccc21 ZINC000436473666 944353843 /nfs/dbraw/zinc/35/38/43/944353843.db2.gz BJTSGKIYWZPFSE-UHFFFAOYSA-N -1 3 368.393 3.565 20 0 FHADHM Cc1noc(C)c1CCNC(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436483252 944368147 /nfs/dbraw/zinc/36/81/47/944368147.db2.gz KBFIPGDVGIHGQA-UHFFFAOYSA-N -1 3 364.445 3.755 20 0 FHADHM COCc1nc(CNC(=O)c2ccccc2[O-])c(-c2ccccc2)s1 ZINC000436522642 944391191 /nfs/dbraw/zinc/39/11/91/944391191.db2.gz WAQMPOXFTDXGTL-UHFFFAOYSA-N -1 3 354.431 3.592 20 0 FHADHM O=C(NC1CCN(C(=O)c2ccccc2[O-])CC1)c1ccc2ccccc2c1 ZINC000436527556 944394974 /nfs/dbraw/zinc/39/49/74/944394974.db2.gz LZHVDDKGZQOUNM-UHFFFAOYSA-N -1 3 374.440 3.580 20 0 FHADHM O=C(COC(F)F)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000436529078 944396910 /nfs/dbraw/zinc/39/69/10/944396910.db2.gz ZJBHPUMAVUHXOW-UHFFFAOYSA-N -1 3 350.346 3.847 20 0 FHADHM CCN(C(=O)c1cc(F)c([O-])c(F)c1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000436533853 944400047 /nfs/dbraw/zinc/40/00/47/944400047.db2.gz WERMHSVMFCZPGG-PBHICJAKSA-N -1 3 374.431 3.968 20 0 FHADHM CCCC(O)(CCC)CC(=O)Nc1cccc(-c2nc(C)cc(=O)[n-]2)c1 ZINC000366688515 944404857 /nfs/dbraw/zinc/40/48/57/944404857.db2.gz JSDRCQWWNAPKAY-UHFFFAOYSA-N -1 3 357.454 3.818 20 0 FHADHM COCc1c(Br)cccc1NC(=O)c1cc(C)ccc1[O-] ZINC000436546137 944406361 /nfs/dbraw/zinc/40/63/61/944406361.db2.gz PADNJZRUVGZMIE-UHFFFAOYSA-N -1 3 350.212 3.862 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc3[nH]c([C@@H]4CCCO4)nc3c2)c([O-])c1C ZINC000436537892 944414555 /nfs/dbraw/zinc/41/45/55/944414555.db2.gz GQTPYITZPLOPAP-KRWDZBQOSA-N -1 3 351.406 3.989 20 0 FHADHM CCCN(C(=O)c1cc(CC)ccc1[O-])[C@@H](C)C(=O)Nc1ccccc1 ZINC000436537435 944415397 /nfs/dbraw/zinc/41/53/97/944415397.db2.gz RIPYMRPDAFYSRA-HNNXBMFYSA-N -1 3 354.450 3.834 20 0 FHADHM COc1ccc(C(=O)N[C@@H](C)c2nc3ccccc3n2C(C)C)c([O-])c1 ZINC000436539385 944417051 /nfs/dbraw/zinc/41/70/51/944417051.db2.gz SWZXOOJIDAPWMR-ZDUSSCGKSA-N -1 3 353.422 3.822 20 0 FHADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1CCC[C@@H](n2cccn2)C1 ZINC000436540343 944418806 /nfs/dbraw/zinc/41/88/06/944418806.db2.gz YKKGEUAPANHWAK-MRXNPFEDSA-N -1 3 363.417 3.858 20 0 FHADHM CCc1cc(NC(=O)c2cc(OCc3ccccc3)ccc2[O-])n(C)n1 ZINC000436542326 944420357 /nfs/dbraw/zinc/42/03/57/944420357.db2.gz FWERRSAFWFQOIS-UHFFFAOYSA-N -1 3 351.406 3.519 20 0 FHADHM CCOC(=O)C(C)(C)N(C)C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436544061 944423050 /nfs/dbraw/zinc/42/30/50/944423050.db2.gz IFRSKIAPXUDGJV-UHFFFAOYSA-N -1 3 369.461 3.591 20 0 FHADHM CCOc1ccc([C@H](C)NC(=O)c2ccc(C(C)=O)c([O-])c2)cc1OCC ZINC000436560976 944427016 /nfs/dbraw/zinc/42/70/16/944427016.db2.gz AEZWHLYMJBNEDD-ZDUSSCGKSA-N -1 3 371.433 3.883 20 0 FHADHM O=C(Nc1ccc(OCc2ccccn2)c(Cl)c1)c1cccc(O)c1[O-] ZINC000192991989 944434969 /nfs/dbraw/zinc/43/49/69/944434969.db2.gz ZFPHKKDIZYUFCG-UHFFFAOYSA-N -1 3 370.792 3.978 20 0 FHADHM COc1ccc(C(=O)N2CCC[C@@]3(CCCc4ccccc43)C2)c([O-])c1 ZINC000436591236 944437849 /nfs/dbraw/zinc/43/78/49/944437849.db2.gz WALBGUYGYDPMFQ-QFIPXVFZSA-N -1 3 351.446 3.911 20 0 FHADHM CCOC(=O)[C@@H]1CCCN(C(=O)c2cc(Oc3ccccc3)ccc2[O-])C1 ZINC000436594968 944440257 /nfs/dbraw/zinc/44/02/57/944440257.db2.gz HDYVQXTTZMEDLD-OAHLLOKOSA-N -1 3 369.417 3.600 20 0 FHADHM Cc1cccc(C(=O)Nc2cnn(-c3ncc(Cl)cc3Cl)c2)c1[O-] ZINC000436596213 944441289 /nfs/dbraw/zinc/44/12/89/944441289.db2.gz PLKHYPOPLVTWMP-UHFFFAOYSA-N -1 3 363.204 3.840 20 0 FHADHM CC(C)c1ccc(C(=O)N2CCOC[C@H]2CC(=O)c2cccs2)c([O-])c1 ZINC000436579759 944444433 /nfs/dbraw/zinc/44/44/33/944444433.db2.gz ANBDVTWINQBFNA-OAHLLOKOSA-N -1 3 373.474 3.691 20 0 FHADHM CC[C@H]1C[C@H](C(=O)N=c2cc(-c3cc(Cl)cc(Cl)c3)[n-][nH]2)CCO1 ZINC000506196081 944446009 /nfs/dbraw/zinc/44/60/09/944446009.db2.gz WDBDPNCIXUKDHO-YGRLFVJLSA-N -1 3 368.264 3.949 20 0 FHADHM Cn1cc(NC(=O)c2cc(Cc3ccccc3)ccc2[O-])cc(Cl)c1=O ZINC000436585358 944448130 /nfs/dbraw/zinc/44/81/30/944448130.db2.gz LVAFANBFSNFCCT-UHFFFAOYSA-N -1 3 368.820 3.587 20 0 FHADHM CC[C@H](C(=O)N1CCN(C(=O)c2ccc([O-])cc2)CC1)C1CCC(C)CC1 ZINC000436612664 944461881 /nfs/dbraw/zinc/46/18/81/944461881.db2.gz RHXVJXBFPQVURP-UHYCVJNDSA-N -1 3 372.509 3.529 20 0 FHADHM CC(=O)c1ccc([O-])c(NC(=O)C2(C)CCN(Cc3ccccc3)CC2)c1 ZINC000436615377 944463662 /nfs/dbraw/zinc/46/36/62/944463662.db2.gz AJTRROGQOOXOLK-UHFFFAOYSA-N -1 3 366.461 3.836 20 0 FHADHM CC(C)[C@H](NC(=O)c1cc(Oc2ccccc2)ccc1[O-])c1ncon1 ZINC000436650212 944481728 /nfs/dbraw/zinc/48/17/28/944481728.db2.gz VIFXIGQWDVXTRK-KRWDZBQOSA-N -1 3 353.378 3.695 20 0 FHADHM CCCCC1CCC(C(=O)N2CCN(C(=O)c3ccc([O-])cc3)CC2)CC1 ZINC000436657874 944488513 /nfs/dbraw/zinc/48/85/13/944488513.db2.gz RRYWZUYLWWFPDH-UHFFFAOYSA-N -1 3 372.509 3.673 20 0 FHADHM O=C(Nc1ccc2nc(N3CCCC3)sc2c1)c1c([O-])cccc1O ZINC000436645966 944494427 /nfs/dbraw/zinc/49/44/27/944494427.db2.gz FMRIRUJDYGXPTA-UHFFFAOYSA-N -1 3 355.419 3.560 20 0 FHADHM CCC(=O)c1ccc([O-])c(NC(=O)[C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000436648261 944497248 /nfs/dbraw/zinc/49/72/48/944497248.db2.gz SPPYYMLLXYENME-GOSISDBHSA-N -1 3 366.461 3.836 20 0 FHADHM COc1ccc(-c2csc(NC(=O)c3cc(OC)ccc3[O-])n2)cc1 ZINC000436667010 944500780 /nfs/dbraw/zinc/50/07/80/944500780.db2.gz WLQBGYIABHTZMG-UHFFFAOYSA-N -1 3 356.403 3.785 20 0 FHADHM CCCOc1ccc(-c2noc(-c3cc(OC)c([O-])c(OC)c3)n2)cc1 ZINC000436688765 944527527 /nfs/dbraw/zinc/52/75/27/944527527.db2.gz LSZZJVXAQHPYAH-UHFFFAOYSA-N -1 3 356.378 3.915 20 0 FHADHM COc1cc(-c2nc(-c3cccc(OC(C)C)c3)no2)cc(OC)c1[O-] ZINC000436690171 944530160 /nfs/dbraw/zinc/53/01/60/944530160.db2.gz OTMKXGUZDFVSNB-UHFFFAOYSA-N -1 3 356.378 3.914 20 0 FHADHM Cc1nnc(CC(=O)Nc2ccc([O-])c(-c3nc4ccccc4s3)c2)o1 ZINC000436708608 944531922 /nfs/dbraw/zinc/53/19/22/944531922.db2.gz VRAKYLHXFZZWRL-UHFFFAOYSA-N -1 3 366.402 3.542 20 0 FHADHM O=C(c1ccccc1[O-])N1CCN(Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000436695479 944535214 /nfs/dbraw/zinc/53/52/14/944535214.db2.gz LGBZPOXQGSZXPX-UHFFFAOYSA-N -1 3 365.260 3.657 20 0 FHADHM CCN(CC)[C@@H](CNC(=O)c1ccc2ccccc2c1[O-])c1ccco1 ZINC000436695735 944535274 /nfs/dbraw/zinc/53/52/74/944535274.db2.gz FRWFYGJVSDZJAL-SFHVURJKSA-N -1 3 352.434 3.951 20 0 FHADHM COCCC[C@H](CNC(=O)c1c([O-])cccc1O)c1ccc(Cl)cc1 ZINC000436706373 944546591 /nfs/dbraw/zinc/54/65/91/944546591.db2.gz CNMZWWVUZQGWQL-CQSZACIVSA-N -1 3 363.841 3.691 20 0 FHADHM O=C(NC[C@H](OCC1CC1)c1ccc(Cl)cc1)c1c([O-])cccc1O ZINC000436710832 944550317 /nfs/dbraw/zinc/55/03/17/944550317.db2.gz ZSCPAUIGCATNQM-KRWDZBQOSA-N -1 3 361.825 3.649 20 0 FHADHM CCCCOc1ccc(C(=O)N[C@H](C)c2c(F)cncc2F)c([O-])c1 ZINC000436715363 944554496 /nfs/dbraw/zinc/55/44/96/944554496.db2.gz OTXZOKKWYGZOQT-LLVKDONJSA-N -1 3 350.365 3.735 20 0 FHADHM CC(C)(NC(=O)c1ccc(O)cc1[O-])c1ccccc1Br ZINC000436719118 944556685 /nfs/dbraw/zinc/55/66/85/944556685.db2.gz NFFDCPUVCJVWBD-UHFFFAOYSA-N -1 3 350.212 3.525 20 0 FHADHM CC[C@H](C)N[C@H](CNC(=O)c1cc(F)cc(Cl)c1[O-])c1ccco1 ZINC000436721012 944559720 /nfs/dbraw/zinc/55/97/20/944559720.db2.gz KUQQEHGPPKSREF-IINYFYTJSA-N -1 3 354.809 3.637 20 0 FHADHM COc1ccc(C(=O)N[C@@H](CC(F)(F)F)c2ccc(F)cc2)c([O-])c1 ZINC000436728095 944574683 /nfs/dbraw/zinc/57/46/83/944574683.db2.gz HRPQBACQIFTHCJ-AWEZNQCLSA-N -1 3 357.303 3.963 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(C)c(C(=O)N3CCCCC3)c2)c([O-])c1 ZINC000436728983 944575280 /nfs/dbraw/zinc/57/52/80/944575280.db2.gz OUUMCMJSDMCMMI-UHFFFAOYSA-N -1 3 352.434 3.887 20 0 FHADHM CN1CCN(C(=O)c2cc3ccccc3cc2[O-])C[C@H]1Cc1ccccc1 ZINC000436729101 944575478 /nfs/dbraw/zinc/57/54/78/944575478.db2.gz FJUPMFAXFYNAEP-HXUWFJFHSA-N -1 3 360.457 3.544 20 0 FHADHM CC(=O)c1ccc(CNC(=O)c2cc(Cc3ccccc3)ccc2[O-])nc1C ZINC000436730163 944576349 /nfs/dbraw/zinc/57/63/49/944576349.db2.gz JUHJFWWINPNTMP-UHFFFAOYSA-N -1 3 374.440 3.819 20 0 FHADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CC[C@@]2(C1)CCCOC2 ZINC000436729567 944576435 /nfs/dbraw/zinc/57/64/35/944576435.db2.gz RWMGDYXXHBYWPW-JOCHJYFZSA-N -1 3 351.446 3.626 20 0 FHADHM COc1cc(C(=O)NCCc2cc3ccccc3s2)cc(OC)c1[O-] ZINC000506564654 944585912 /nfs/dbraw/zinc/58/59/12/944585912.db2.gz RQBMNLJGRHDTKS-UHFFFAOYSA-N -1 3 357.431 3.597 20 0 FHADHM CCN(Cc1ccc(C(=O)N(C)C)cc1)C(=O)c1ccc(C(C)C)cc1[O-] ZINC000436775340 944606202 /nfs/dbraw/zinc/60/62/02/944606202.db2.gz WNLNENGCFIUNFN-UHFFFAOYSA-N -1 3 368.477 3.880 20 0 FHADHM CC(C)Oc1cc(C(=O)Nc2cc(Br)ccc2[O-])ccn1 ZINC000436798413 944622690 /nfs/dbraw/zinc/62/26/90/944622690.db2.gz LIUOUEHWYBXNHV-UHFFFAOYSA-N -1 3 351.200 3.589 20 0 FHADHM C[C@H](Cc1ccccc1C(F)(F)F)N(C)C(=O)c1ccc(O)cc1[O-] ZINC000436788046 944635287 /nfs/dbraw/zinc/63/52/87/944635287.db2.gz AOWXOMUQZXDPGZ-LLVKDONJSA-N -1 3 353.340 3.820 20 0 FHADHM CO[C@@H]1CCOc2c(NC(=O)c3ccc4c(c3[O-])OC(C)(C)C4)cccc21 ZINC000436805955 944660209 /nfs/dbraw/zinc/66/02/09/944660209.db2.gz GOGUPNIIKUTLLV-MRXNPFEDSA-N -1 3 369.417 3.828 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(C(=O)N3CCCCCC3)cc2)c([O-])c1 ZINC000436808341 944665023 /nfs/dbraw/zinc/66/50/23/944665023.db2.gz OQBFKRTZKKOFIY-UHFFFAOYSA-N -1 3 352.434 3.969 20 0 FHADHM Cc1ccc(-n2nc(C(=O)Nc3cc(F)ccc3[O-])c3c2CCC3)cc1 ZINC000436812884 944668582 /nfs/dbraw/zinc/66/85/82/944668582.db2.gz ODPGSLYSTJKOCQ-UHFFFAOYSA-N -1 3 351.381 3.766 20 0 FHADHM Cc1nn(-c2ccccc2)c2nc(C(=O)Nc3cc(F)ccc3[O-])ccc12 ZINC000436812342 944670083 /nfs/dbraw/zinc/67/00/83/944670083.db2.gz MGULGBCNUGLADH-UHFFFAOYSA-N -1 3 362.364 3.826 20 0 FHADHM CC(C)(C(=O)N=c1cc([C@H]2CCCO2)[n-][nH]1)c1cccc(C(F)(F)F)c1 ZINC000473847038 944672141 /nfs/dbraw/zinc/67/21/41/944672141.db2.gz LKLBBLVUNQVEBK-CQSZACIVSA-N -1 3 367.371 3.618 20 0 FHADHM O=C(CCCOc1cccc2ccccc21)N=c1cc([C@@H]2CCCO2)[n-][nH]1 ZINC000473848574 944678013 /nfs/dbraw/zinc/67/80/13/944678013.db2.gz SJRIDDYKTUBTGF-IBGZPJMESA-N -1 3 365.433 3.634 20 0 FHADHM O=C(N=c1cc([C@@H]2CCCO2)[n-][nH]1)c1ccc(Cl)c(C(F)(F)F)c1 ZINC000473848754 944680592 /nfs/dbraw/zinc/68/05/92/944680592.db2.gz UBCCRVOFRWOORC-LBPRGKRZSA-N -1 3 359.735 3.608 20 0 FHADHM Cc1cnn(Cc2ccccc2F)c1NC(=O)c1ccc(C)c(C)c1[O-] ZINC000436823957 944693184 /nfs/dbraw/zinc/69/31/84/944693184.db2.gz XZWMSVHEVWZBNN-UHFFFAOYSA-N -1 3 353.397 3.954 20 0 FHADHM CO[C@@H]1CN(C(=O)c2cc(CCc3ccccc3)ccc2[O-])CC[C@H]1C ZINC000436842469 944709792 /nfs/dbraw/zinc/70/97/92/944709792.db2.gz WPKOMOGRJBYNCM-IIBYNOLFSA-N -1 3 353.462 3.674 20 0 FHADHM CC(C)OCCCSc1nc(-c2ccccc2)ccc1-c1nnn[n-]1 ZINC000735904055 944710963 /nfs/dbraw/zinc/71/09/63/944710963.db2.gz KPLSMWBACPKGCF-UHFFFAOYSA-N -1 3 355.467 3.836 20 0 FHADHM CC(C)OCCCSc1nc(-c2ccccc2)ccc1-c1nn[n-]n1 ZINC000735904055 944710974 /nfs/dbraw/zinc/71/09/74/944710974.db2.gz KPLSMWBACPKGCF-UHFFFAOYSA-N -1 3 355.467 3.836 20 0 FHADHM C[C@H](C(=O)[O-])[C@H](NCc1cnn(Cc2ccc(F)cc2)c1)c1ccccc1 ZINC000426714699 944714674 /nfs/dbraw/zinc/71/46/74/944714674.db2.gz DVUWVIGTAVFKTN-YWZLYKJASA-N -1 3 367.424 3.622 20 0 FHADHM C[C@@H](C(=O)[O-])[C@@H](NCc1cnn(Cc2ccc(F)cc2)c1)c1ccccc1 ZINC000426714696 944715253 /nfs/dbraw/zinc/71/52/53/944715253.db2.gz DVUWVIGTAVFKTN-FOIQADDNSA-N -1 3 367.424 3.622 20 0 FHADHM COC(=O)c1ccc(-c2nc(-c3ccc(C)cc3Br)no2)[n-]1 ZINC000426407960 944716437 /nfs/dbraw/zinc/71/64/37/944716437.db2.gz AFZVJRAHAZTSMH-UHFFFAOYSA-N -1 3 362.183 3.589 20 0 FHADHM C[C@@H](C(=O)[O-])[C@H](NCc1cnn(-c2ccc(F)cc2)c1)c1ccccc1 ZINC000426722537 944724881 /nfs/dbraw/zinc/72/48/81/944724881.db2.gz HWZZCVRZIDKQPY-KUHUBIRLSA-N -1 3 353.397 3.563 20 0 FHADHM CCN(Cc1ccccc1Br)C(=O)c1c([O-])cccc1O ZINC000439554321 944740294 /nfs/dbraw/zinc/74/02/94/944740294.db2.gz XVPPVPSXOOINQH-UHFFFAOYSA-N -1 3 350.212 3.523 20 0 FHADHM CCc1ccc([C@@H](CNC(=O)c2cc(F)c([O-])c(Cl)c2)N(C)C)cc1 ZINC000436858243 944745698 /nfs/dbraw/zinc/74/56/98/944745698.db2.gz MTFPXIVERUQVNB-QGZVFWFLSA-N -1 3 364.848 3.780 20 0 FHADHM CCc1ccc(-c2nc(CC(=O)NCc3cccc(Cl)c3)no2)c([O-])c1 ZINC000436881336 944753542 /nfs/dbraw/zinc/75/35/42/944753542.db2.gz SCPZQSXPYOCWMC-UHFFFAOYSA-N -1 3 371.824 3.517 20 0 FHADHM CCc1ccc(-c2nc(CC(=O)N[C@@H](CC)c3ccccc3)no2)c([O-])c1 ZINC000436882210 944754532 /nfs/dbraw/zinc/75/45/32/944754532.db2.gz YCCLQAKPONZOES-KRWDZBQOSA-N -1 3 365.433 3.815 20 0 FHADHM CCc1cc(C(=O)[N-]c2nnc(C(F)F)s2)c2c(n1)onc2C(C)C ZINC000509610266 944756959 /nfs/dbraw/zinc/75/69/59/944756959.db2.gz UZUTUAHLULTGJA-UHFFFAOYSA-N -1 3 367.381 3.950 20 0 FHADHM CC(C)c1ccc(-c2nc(CC(=O)Nc3ccc(F)cc3)no2)c([O-])c1 ZINC000436894417 944763925 /nfs/dbraw/zinc/76/39/25/944763925.db2.gz SOIYDBARGQAHRU-UHFFFAOYSA-N -1 3 355.369 3.886 20 0 FHADHM COc1ccnc(CNC(=O)c2cc(Oc3ccccc3)ccc2[O-])c1 ZINC000436892288 944767520 /nfs/dbraw/zinc/76/75/20/944767520.db2.gz ITWHSHVOAMPVJX-UHFFFAOYSA-N -1 3 350.374 3.518 20 0 FHADHM O=C(N[C@@H]1CCSc2ccc(Cl)cc21)c1cc(=O)[n-]c(C2CC2)n1 ZINC000518792378 944775107 /nfs/dbraw/zinc/77/51/07/944775107.db2.gz HCZRWTPOIGGJBL-GFCCVEGCSA-N -1 3 361.854 3.680 20 0 FHADHM CC[C@H]1CCCN1C(=O)C[C@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436932325 944794152 /nfs/dbraw/zinc/79/41/52/944794152.db2.gz NGKIDYAZBBBKNI-ICSRJNTNSA-N -1 3 366.461 3.654 20 0 FHADHM COc1cccc(C[C@@H](NCc2csc(-c3ccsc3)n2)C(=O)[O-])c1 ZINC000426778734 944795931 /nfs/dbraw/zinc/79/59/31/944795931.db2.gz AGQJKTDSUXCZFH-MRXNPFEDSA-N -1 3 374.487 3.666 20 0 FHADHM O=C(N[C@@H](CO)c1ccsc1)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436916825 944799449 /nfs/dbraw/zinc/79/94/49/944799449.db2.gz VKCCMGQCSASYGV-SFHVURJKSA-N -1 3 353.443 3.508 20 0 FHADHM CCOc1ccc(CN[C@H](C(=O)[O-])c2ccc(Cl)c(C)c2)cc1OC ZINC000426784498 944801346 /nfs/dbraw/zinc/80/13/46/944801346.db2.gz MVQDGKVZZOXTDH-SFHVURJKSA-N -1 3 363.841 3.971 20 0 FHADHM CCCCOc1ccc(CN[C@H](C(=O)[O-])c2ccc(F)cc2)cc1OC ZINC000426805764 944806779 /nfs/dbraw/zinc/80/67/79/944806779.db2.gz FMVDEBYPQHEEHG-IBGZPJMESA-N -1 3 361.413 3.929 20 0 FHADHM COc1cccc([C@H](CC(=O)[O-])NCc2cc(C)c(C)cc2C)c1OC ZINC000426807083 944808144 /nfs/dbraw/zinc/80/81/44/944808144.db2.gz MCJNTHAMZWMBLR-SFHVURJKSA-N -1 3 357.450 3.935 20 0 FHADHM CS[C@@H]1C(=O)Nc2ccc(-c3noc(-c4ccc(C)cc4[O-])n3)cc21 ZINC000436923772 944809468 /nfs/dbraw/zinc/80/94/68/944809468.db2.gz AFQRITKKCMSGBF-HNNXBMFYSA-N -1 3 353.403 3.774 20 0 FHADHM CCc1ccc([C@H](NCc2cc(Cl)c3c(c2)OCCO3)C(=O)[O-])cc1 ZINC000426797634 944819925 /nfs/dbraw/zinc/81/99/25/944819925.db2.gz BPQBJYPTESEFOW-KRWDZBQOSA-N -1 3 361.825 3.589 20 0 FHADHM O=C([O-])[C@H](NCc1ccc(OCC(F)(F)F)c(F)c1)c1ccccc1 ZINC000426804009 944825983 /nfs/dbraw/zinc/82/59/83/944825983.db2.gz REEGRHJHARYOKK-OAHLLOKOSA-N -1 3 357.303 3.682 20 0 FHADHM Cc1ccc([O-])c(C(=O)Nc2cccc(CN3C[C@@H](C)O[C@@H](C)C3)c2)c1 ZINC000436940447 944828196 /nfs/dbraw/zinc/82/81/96/944828196.db2.gz AFNYIMAATAMATC-IYBDPMFKSA-N -1 3 354.450 3.562 20 0 FHADHM CCC[C@@H](NC(=O)c1ccccc1)c1noc(-c2cccc(OC)c2[O-])n1 ZINC000436942838 944830877 /nfs/dbraw/zinc/83/08/77/944830877.db2.gz JHGZMBCLGOEAKM-OAHLLOKOSA-N -1 3 367.405 3.722 20 0 FHADHM CC[C@H]1CCCC[C@H]1NC(=O)c1cc(NC(=O)c2cnoc2C)ccc1[O-] ZINC000436947369 944834669 /nfs/dbraw/zinc/83/46/69/944834669.db2.gz DLSDEHZEKOTSBQ-SUMWQHHRSA-N -1 3 371.437 3.640 20 0 FHADHM COc1ccc([C@H](NCc2ccc(OCC3CC3)cc2)C(=O)[O-])cc1F ZINC000426817937 944840287 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ZINC001573365161 947730131 /nfs/dbraw/zinc/73/01/31/947730131.db2.gz LJSRGMVHYDREOH-CMPYXILNSA-N -1 3 365.412 3.629 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)N(C)[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC001573365161 947730143 /nfs/dbraw/zinc/73/01/43/947730143.db2.gz LJSRGMVHYDREOH-CMPYXILNSA-N -1 3 365.412 3.629 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)N(C)c1ccc(-c2nnn[n-]2)cc1 ZINC001573366888 947749915 /nfs/dbraw/zinc/74/99/15/947749915.db2.gz UUJVEWTXPOQKGC-VAWYXSNFSA-N -1 3 353.813 3.586 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)N(C)c1ccc(-c2nn[n-]n2)cc1 ZINC001573366888 947749924 /nfs/dbraw/zinc/74/99/24/947749924.db2.gz UUJVEWTXPOQKGC-VAWYXSNFSA-N -1 3 353.813 3.586 20 0 FHADHM CC(C)Cn1ncc(NC(=O)c2c[n-]c3ccccc3c2=O)c1C(F)F ZINC000536365354 947772704 /nfs/dbraw/zinc/77/27/04/947772704.db2.gz KOOBKKSDNXNJPH-UHFFFAOYSA-N -1 3 360.364 3.571 20 0 FHADHM Cc1ccc(C2CCN(c3c(Cl)cccc3-c3nnn[n-]3)CC2)cn1 ZINC000826285833 947824755 /nfs/dbraw/zinc/82/47/55/947824755.db2.gz KYSNWWWAOACVAS-UHFFFAOYSA-N -1 3 354.845 3.608 20 0 FHADHM Cc1ccc(C2CCN(c3c(Cl)cccc3-c3nn[n-]n3)CC2)cn1 ZINC000826285833 947824766 /nfs/dbraw/zinc/82/47/66/947824766.db2.gz KYSNWWWAOACVAS-UHFFFAOYSA-N -1 3 354.845 3.608 20 0 FHADHM Cc1ccc(C[C@@H](C)C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCC3)cc1 ZINC000826286898 947829126 /nfs/dbraw/zinc/82/91/26/947829126.db2.gz VEYSRTKYMQSAPO-GFCCVEGCSA-N -1 3 367.478 3.543 20 0 FHADHM Cc1ccc(C[C@@H](C)C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCC3)cc1 ZINC000826286898 947829128 /nfs/dbraw/zinc/82/91/28/947829128.db2.gz VEYSRTKYMQSAPO-GFCCVEGCSA-N -1 3 367.478 3.543 20 0 FHADHM Cc1ccc(C[C@@H](C)C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000826286882 947830974 /nfs/dbraw/zinc/83/09/74/947830974.db2.gz URLODERVFXYVKN-GFCCVEGCSA-N -1 3 355.829 3.646 20 0 FHADHM Cc1ccc(C[C@@H](C)C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000826286882 947830983 /nfs/dbraw/zinc/83/09/83/947830983.db2.gz URLODERVFXYVKN-GFCCVEGCSA-N -1 3 355.829 3.646 20 0 FHADHM Cc1sc(NC(=O)[C@H](C)Cc2ccc(C)cc2)c(-c2nnn[n-]2)c1C ZINC000826286939 947832827 /nfs/dbraw/zinc/83/28/27/947832827.db2.gz WJNKDTLOIJBMQL-LLVKDONJSA-N -1 3 355.467 3.671 20 0 FHADHM Cc1sc(NC(=O)[C@H](C)Cc2ccc(C)cc2)c(-c2nn[n-]n2)c1C ZINC000826286939 947832834 /nfs/dbraw/zinc/83/28/34/947832834.db2.gz WJNKDTLOIJBMQL-LLVKDONJSA-N -1 3 355.467 3.671 20 0 FHADHM CC[C@@H](c1nnc([N-]C(=O)c2cn(C(C)C)nn2)s1)c1ccccc1 ZINC000550412882 947869672 /nfs/dbraw/zinc/86/96/72/947869672.db2.gz VEZCQIPFEICKJT-CYBMUJFWSA-N -1 3 356.455 3.505 20 0 FHADHM Cc1ccnc(N[C@H]2CCCOc3cc(Cl)ccc32)c1-c1nnn[n-]1 ZINC000826313107 947909578 /nfs/dbraw/zinc/90/95/78/947909578.db2.gz WIRSPWBRCUTULI-ZDUSSCGKSA-N -1 3 356.817 3.549 20 0 FHADHM Cc1ccnc(N[C@H]2CCCOc3cc(Cl)ccc32)c1-c1nn[n-]n1 ZINC000826313107 947909583 /nfs/dbraw/zinc/90/95/83/947909583.db2.gz WIRSPWBRCUTULI-ZDUSSCGKSA-N -1 3 356.817 3.549 20 0 FHADHM Cc1ccsc1CNc1ccn(-c2ccc(Cl)cc2-c2nnn[n-]2)n1 ZINC000826316178 947923538 /nfs/dbraw/zinc/92/35/38/947923538.db2.gz GGMAJSFDTJQFMY-UHFFFAOYSA-N -1 3 371.857 3.688 20 0 FHADHM Cc1ccsc1CNc1ccn(-c2ccc(Cl)cc2-c2nn[n-]n2)n1 ZINC000826316178 947923542 /nfs/dbraw/zinc/92/35/42/947923542.db2.gz GGMAJSFDTJQFMY-UHFFFAOYSA-N -1 3 371.857 3.688 20 0 FHADHM CCOC(=O)c1csc([C@H]2CCCN2C(=O)c2cc(CC)ccc2[O-])n1 ZINC000190241283 947951622 /nfs/dbraw/zinc/95/16/22/947951622.db2.gz HROYXYWAKMKHER-OAHLLOKOSA-N -1 3 374.462 3.565 20 0 FHADHM C[C@H](Cc1ccc(Br)cc1)N[C@H](C)c1ncc(C(=O)[O-])s1 ZINC000314653352 948009336 /nfs/dbraw/zinc/00/93/36/948009336.db2.gz MVYSQPZVCSVTES-NXEZZACHSA-N -1 3 369.284 3.886 20 0 FHADHM Clc1cccc(SCc2nc(C3CCCC3)no2)c1-c1nnn[n-]1 ZINC000826353493 948104561 /nfs/dbraw/zinc/10/45/61/948104561.db2.gz RHCTVPRNURUKDE-UHFFFAOYSA-N -1 3 362.846 3.853 20 0 FHADHM Clc1cccc(SCc2nc(C3CCCC3)no2)c1-c1nn[n-]n1 ZINC000826353493 948104568 /nfs/dbraw/zinc/10/45/68/948104568.db2.gz RHCTVPRNURUKDE-UHFFFAOYSA-N -1 3 362.846 3.853 20 0 FHADHM Cc1ccccc1[C@@H](NC(=O)Nc1ccc2c(c1)C(=O)[N-]C2=O)C(C)(C)C ZINC000432342247 948167692 /nfs/dbraw/zinc/16/76/92/948167692.db2.gz HVJYPVGLRLAMRT-QGZVFWFLSA-N -1 3 365.433 3.788 20 0 FHADHM O=C(CC1CCC(C(F)(F)F)CC1)OCc1ccccc1-c1nnn[n-]1 ZINC000826404030 948228879 /nfs/dbraw/zinc/22/88/79/948228879.db2.gz LXTVJUUCDBPEPB-UHFFFAOYSA-N -1 3 368.359 3.669 20 0 FHADHM O=C(CC1CCC(C(F)(F)F)CC1)OCc1ccccc1-c1nn[n-]n1 ZINC000826404030 948228888 /nfs/dbraw/zinc/22/88/88/948228888.db2.gz LXTVJUUCDBPEPB-UHFFFAOYSA-N -1 3 368.359 3.669 20 0 FHADHM O=C(CCc1ccc2[nH]ccc2c1)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000826409289 948244034 /nfs/dbraw/zinc/24/40/34/948244034.db2.gz QMHSCBASDCNJKQ-UHFFFAOYSA-N -1 3 366.812 3.573 20 0 FHADHM O=C(CCc1ccc2[nH]ccc2c1)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000826409289 948244048 /nfs/dbraw/zinc/24/40/48/948244048.db2.gz QMHSCBASDCNJKQ-UHFFFAOYSA-N -1 3 366.812 3.573 20 0 FHADHM CCOc1ccc(CN[C@H](CCC(=O)[O-])c2ccc(OC)cc2)cc1F ZINC000417577516 948281210 /nfs/dbraw/zinc/28/12/10/948281210.db2.gz LVPQQPGJBXGGOT-GOSISDBHSA-N -1 3 361.413 3.929 20 0 FHADHM O=S(=O)([N-][C@H](C1CC1)[C@H]1CCCCO1)c1c(Cl)cccc1Cl ZINC000655628544 948331256 /nfs/dbraw/zinc/33/12/56/948331256.db2.gz YEVWYUAEXRSQJQ-ZIAGYGMSSA-N -1 3 364.294 3.619 20 0 FHADHM CCO[C@@H](CC[N-]S(=O)(=O)c1cccc(Cl)c1Cl)C(C)C ZINC000467787041 948342380 /nfs/dbraw/zinc/34/23/80/948342380.db2.gz MNHPSXCPDPRAIC-LBPRGKRZSA-N -1 3 354.299 3.723 20 0 FHADHM CO[C@H](C[N-]S(=O)(=O)c1c(Cl)ccc(C)c1Cl)c1ccccc1 ZINC000614605542 948354038 /nfs/dbraw/zinc/35/40/38/948354038.db2.gz OOIBKLOWKQNVGP-CQSZACIVSA-N -1 3 374.289 3.968 20 0 FHADHM O=C([O-])[C@@H](CNCc1c(Cl)cccc1N1CCCC1)Oc1ccccc1 ZINC000417642609 948391429 /nfs/dbraw/zinc/39/14/29/948391429.db2.gz WDTKBBXNIZAFMI-LJQANCHMSA-N -1 3 374.868 3.562 20 0 FHADHM c1sc(CNc2cc(CCc3ccccc3)ccn2)cc1-c1nnn[n-]1 ZINC000826521276 948451240 /nfs/dbraw/zinc/45/12/40/948451240.db2.gz GWMFSVBIQYOMLZ-UHFFFAOYSA-N -1 3 362.462 3.721 20 0 FHADHM c1sc(CNc2cc(CCc3ccccc3)ccn2)cc1-c1nn[n-]n1 ZINC000826521276 948451245 /nfs/dbraw/zinc/45/12/45/948451245.db2.gz GWMFSVBIQYOMLZ-UHFFFAOYSA-N -1 3 362.462 3.721 20 0 FHADHM c1ccc2c(c1)cccc2-c1nnc(COc2ccc(-c3nn[n-]n3)cc2)o1 ZINC000826522799 948457593 /nfs/dbraw/zinc/45/75/93/948457593.db2.gz OVENKUQAPQJZPM-UHFFFAOYSA-N -1 3 370.372 3.649 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N2C[C@H](c3ccc(C)cc3)C[C@H]2C)c1 ZINC000279087614 948485113 /nfs/dbraw/zinc/48/51/13/948485113.db2.gz UACAIMNECHIMPS-RHSMWYFYSA-N -1 3 352.434 3.677 20 0 FHADHM C[C@@H]1CC[C@](C)(/C=C\C(=O)NCc2ccc(-c3nnn[n-]3)cc2)C1(C)C ZINC001464879554 948529992 /nfs/dbraw/zinc/52/99/92/948529992.db2.gz IARSHWQEYPNTAA-NQOLIQJVSA-N -1 3 353.470 3.502 20 0 FHADHM C[C@@H]1CC[C@](C)(/C=C\C(=O)NCc2ccc(-c3nn[n-]n3)cc2)C1(C)C ZINC001464879554 948529994 /nfs/dbraw/zinc/52/99/94/948529994.db2.gz IARSHWQEYPNTAA-NQOLIQJVSA-N -1 3 353.470 3.502 20 0 FHADHM CC(C)(C)c1ccc(C=CC(=O)Nc2cc(-c3nnn[n-]3)ccc2F)cc1 ZINC001525064192 948538872 /nfs/dbraw/zinc/53/88/72/948538872.db2.gz QNNARZGGCXJIAH-IZZDOVSWSA-N -1 3 365.412 3.955 20 0 FHADHM CC(C)(C)c1ccc(C=CC(=O)Nc2cc(-c3nn[n-]n3)ccc2F)cc1 ZINC001525064192 948538877 /nfs/dbraw/zinc/53/88/77/948538877.db2.gz QNNARZGGCXJIAH-IZZDOVSWSA-N -1 3 365.412 3.955 20 0 FHADHM Cc1nc2c(Cl)cccc2cc1C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC001539569860 948548253 /nfs/dbraw/zinc/54/82/53/948548253.db2.gz OKZFDDGQKPUVGH-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1nc2c(Cl)cccc2cc1C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC001539569860 948548258 /nfs/dbraw/zinc/54/82/58/948548258.db2.gz OKZFDDGQKPUVGH-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM C[C@@H](C(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1)C1CCC1 ZINC001573729136 948565311 /nfs/dbraw/zinc/56/53/11/948565311.db2.gz HHVQTEUQJIXXGZ-GFCCVEGCSA-N -1 3 367.478 3.648 20 0 FHADHM O=C(CCOc1ccccc1Br)Nc1cccc([O-])c1F ZINC000536461965 948675129 /nfs/dbraw/zinc/67/51/29/948675129.db2.gz AZUNQDXXCYWDHS-UHFFFAOYSA-N -1 3 354.175 3.701 20 0 FHADHM C[C@H]1CN(Cc2nc(=O)c3c(-c4ccco4)csc3[n-]2)C[C@H](C2CC2)O1 ZINC000279302097 948752010 /nfs/dbraw/zinc/75/20/10/948752010.db2.gz MIAIWPYCJSKPKP-XHDPSFHLSA-N -1 3 371.462 3.656 20 0 FHADHM CC(C)(C)[C@H]1OCCC[C@@H]1C[N-]S(=O)(=O)c1cc(F)ccc1Cl ZINC000524020448 948787380 /nfs/dbraw/zinc/78/73/80/948787380.db2.gz SWROAWUQRFSTOC-ABAIWWIYSA-N -1 3 363.882 3.599 20 0 FHADHM CC(C)c1ccc(S(=O)(=O)[N-]c2ccc(-n3ccnc3)c(F)c2)cc1 ZINC000524023562 948792490 /nfs/dbraw/zinc/79/24/90/948792490.db2.gz BPSZMRKMSGUHHT-UHFFFAOYSA-N -1 3 359.426 3.936 20 0 FHADHM CC(C)(C)c1nc2ccc([N-]S(=O)(=O)c3ccc(F)c(F)c3)cc2[nH]1 ZINC000098068705 209203286 /nfs/dbraw/zinc/20/32/86/209203286.db2.gz FQBPHOYZDQCGTK-UHFFFAOYSA-N -1 3 365.405 3.939 20 0 FHADHM Cn1[n-]c(=NC(=O)c2cnc(-c3ccccc3F)s2)cc1OC(F)F ZINC000490941366 515338248 /nfs/dbraw/zinc/33/82/48/515338248.db2.gz PAYUVSIMEOYZAZ-UHFFFAOYSA-N -1 3 368.340 3.536 20 0 FHADHM CCN=c1[n-]c(C(=O)N(Cc2ccnc(OC(C)C)c2)C2CC2)cs1 ZINC000506112784 515785764 /nfs/dbraw/zinc/78/57/64/515785764.db2.gz LALRZIZOGQZHDZ-UHFFFAOYSA-N -1 3 360.483 3.562 20 0 FHADHM CCCc1ccc(-c2cc(=NC(=O)CCOC[C@@H]3CCCO3)[nH][n-]2)cc1 ZINC000511626978 515966788 /nfs/dbraw/zinc/96/67/88/515966788.db2.gz JVUUPUYSCFNFMB-KRWDZBQOSA-N -1 3 357.454 3.553 20 0 FHADHM CN(C(=O)N=c1[n-]nc(C(C)(C)C)s1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474731091 516174691 /nfs/dbraw/zinc/17/46/91/516174691.db2.gz UDFSOLNLWXBXNY-OAHLLOKOSA-N -1 3 373.526 3.574 20 0 FHADHM C[C@H]1[C@H](NC(=O)N=c2[n-]nc(-c3cc4ccccc4o3)s2)CCCN1C ZINC000470508077 516274241 /nfs/dbraw/zinc/27/42/41/516274241.db2.gz AGKVTZFIHBGVOG-WCQYABFASA-N -1 3 371.466 3.556 20 0 FHADHM Cc1cc(NC(=O)c2cc(-c3ccco3)[n-]n2)nn1-c1cccc(F)c1 ZINC000537376652 517164095 /nfs/dbraw/zinc/16/40/95/517164095.db2.gz OYEUUYKNVZSKRZ-UHFFFAOYSA-N -1 3 351.341 3.555 20 0 FHADHM Cc1cc(NC(=O)c2cc(-c3ccco3)n[n-]2)nn1-c1cccc(F)c1 ZINC000537376652 517164099 /nfs/dbraw/zinc/16/40/99/517164099.db2.gz OYEUUYKNVZSKRZ-UHFFFAOYSA-N -1 3 351.341 3.555 20 0 FHADHM CCN=c1[n-]c(C(=O)N2CCC[C@@]3(CCc4ccccc4O3)C2)cs1 ZINC000529903446 517428857 /nfs/dbraw/zinc/42/88/57/517428857.db2.gz IZDJWXKAHNCBEU-LJQANCHMSA-N -1 3 357.479 3.575 20 0 FHADHM CCC[C@@H](OCC)C(=O)N=c1[nH][n-]c(CC)c1-c1ccc2c(c1)OCO2 ZINC000530263309 517667398 /nfs/dbraw/zinc/66/73/98/517667398.db2.gz OYZBZNDALRGYLB-OAHLLOKOSA-N -1 3 359.426 3.512 20 0 FHADHM CCCC(=O)N1CCC[C@H](C(=O)N=c2[nH][n-]c(C)c2-c2ccc(F)cc2)C1 ZINC000530274003 517670731 /nfs/dbraw/zinc/67/07/31/517670731.db2.gz MPBMMWHWSVHZCY-HNNXBMFYSA-N -1 3 372.444 3.501 20 0 FHADHM Cc1[n-][nH]c(=NC(=O)c2cnn3c2C[C@H](C)CC3)c1-c1ccc(F)cc1 ZINC000530277471 517674547 /nfs/dbraw/zinc/67/45/47/517674547.db2.gz SRBWBPFVUGYPHA-LLVKDONJSA-N -1 3 353.401 3.555 20 0 FHADHM COc1cc(=NC(=O)NCC(C)(C)c2ccc(C(F)(F)F)cc2)[n-]n1C ZINC000530344149 517716243 /nfs/dbraw/zinc/71/62/43/517716243.db2.gz ZPVRQNMMAOEBQP-UHFFFAOYSA-N -1 3 370.375 3.547 20 0 FHADHM CCN1CCCC[C@H]1C(=O)N=c1cc(-c2cc(Cl)ccc2OC)[n-][nH]1 ZINC000522671194 518144182 /nfs/dbraw/zinc/14/41/82/518144182.db2.gz ZUCHOQFIKRBZOU-HNNXBMFYSA-N -1 3 362.861 3.552 20 0 FHADHM O=C(N=c1cc(-c2cccc(Cl)c2)[n-][nH]1)c1cccc(-n2cncn2)c1 ZINC000604601344 520615629 /nfs/dbraw/zinc/61/56/29/520615629.db2.gz DKMYOLSUERBMHW-UHFFFAOYSA-N -1 3 364.796 3.563 20 0 FHADHM CCN(CC)[C@@H](CNC(=O)c1csc(=NC2CC2)[n-]1)c1ccccc1 ZINC000607052938 521247201 /nfs/dbraw/zinc/24/72/01/521247201.db2.gz FAXPBIJXJCBIGC-KRWDZBQOSA-N -1 3 358.511 3.530 20 0 FHADHM O=S(=O)([N-]c1ccc(Cl)c2cccnc12)N1CCc2ccccc2C1 ZINC000602051951 567913390 /nfs/dbraw/zinc/91/33/90/567913390.db2.gz REELUXLXXCMNKG-UHFFFAOYSA-N -1 3 373.865 3.603 20 0 FHADHM CSCc1c2ccccc2oc1C(=O)NC(C)(C)c1nc(C)cc(=O)[n-]1 ZINC000602170484 567947276 /nfs/dbraw/zinc/94/72/76/567947276.db2.gz GDSJQXYOZBISJP-UHFFFAOYSA-N -1 3 371.462 3.765 20 0 FHADHM O=C([N-]c1cc(F)c(F)cc1F)c1cn(-c2cccc(Cl)c2)nn1 ZINC000186649348 567962467 /nfs/dbraw/zinc/96/24/67/567962467.db2.gz CNMDAQFKIPOWBM-UHFFFAOYSA-N -1 3 352.703 3.590 20 0 FHADHM Cc1cc(C(F)(F)F)ccc1CNC(=O)NCc1ccc([O-])c(F)c1 ZINC000188602904 567980252 /nfs/dbraw/zinc/98/02/52/567980252.db2.gz BKCMAJSCVHQUJE-UHFFFAOYSA-N -1 3 356.319 3.858 20 0 FHADHM C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCN2C(=O)c2cc([O-])c3ccccc3c2)C1 ZINC000408223650 568032242 /nfs/dbraw/zinc/03/22/42/568032242.db2.gz CDMSHCUVQYMVJE-DMSXTEQDSA-N -1 3 353.462 3.947 20 0 FHADHM C[C@H](c1ccc(F)c(F)c1)S(=O)(=O)c1nc(CCC2CCCC2)n[n-]1 ZINC000605986908 568065068 /nfs/dbraw/zinc/06/50/68/568065068.db2.gz BYXJMKQYDPCUEO-LLVKDONJSA-N -1 3 369.437 3.741 20 0 FHADHM C[C@H](c1ccc(F)c(F)c1)S(=O)(=O)c1nnc(CCC2CCCC2)[n-]1 ZINC000605986908 568065069 /nfs/dbraw/zinc/06/50/69/568065069.db2.gz BYXJMKQYDPCUEO-LLVKDONJSA-N -1 3 369.437 3.741 20 0 FHADHM CSC[C@H](C)C(=O)N=c1[nH][n-]c(C)c1-c1ccc(Br)cc1 ZINC000603202606 568073157 /nfs/dbraw/zinc/07/31/57/568073157.db2.gz LGDBVARURZPXBQ-VIFPVBQESA-N -1 3 368.300 3.507 20 0 FHADHM COc1ccccc1-c1cc(=NC(=O)[C@H]2C[C@@H]2c2ccc(F)cc2F)[nH][n-]1 ZINC000603547008 568118030 /nfs/dbraw/zinc/11/80/30/568118030.db2.gz FUNBZACRLORZAA-CABCVRRESA-N -1 3 369.371 3.528 20 0 FHADHM O=C1CCCN1c1cc(-c2nc(-c3ccc([O-])cc3)no2)ccc1Cl ZINC000603631371 568127971 /nfs/dbraw/zinc/12/79/71/568127971.db2.gz NYGVEGAXXJUVBU-UHFFFAOYSA-N -1 3 355.781 3.889 20 0 FHADHM Cc1oc(S(C)(=O)=O)cc1C(=O)[N-]c1sccc1C(=O)C(C)(C)C ZINC000636870783 568163194 /nfs/dbraw/zinc/16/31/94/568163194.db2.gz CRLOMJZXAHHTHZ-UHFFFAOYSA-N -1 3 369.464 3.534 20 0 FHADHM CCOC(=O)c1cc([N-]S(=O)(=O)CCc2ccccc2)ccc1Cl ZINC000603987104 568195173 /nfs/dbraw/zinc/19/51/73/568195173.db2.gz JDPZXODVARRDCA-UHFFFAOYSA-N -1 3 367.854 3.501 20 0 FHADHM CCc1cccc(C(=O)N2C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C2)c1[O-] ZINC000674604954 568228427 /nfs/dbraw/zinc/22/84/27/568228427.db2.gz HFWIWMPVKJPEKM-PHIMTYICSA-N -1 3 355.278 3.767 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)C[C@H](C)c3cccnc3)c2)n1 ZINC000604314018 568249022 /nfs/dbraw/zinc/24/90/22/568249022.db2.gz KNDBVESBFPCILR-AWEZNQCLSA-N -1 3 362.433 3.939 20 0 FHADHM Cc1cc(C)cc(-c2cc(=NC(=O)C[C@@H]3OCCc4ccccc43)[nH][n-]2)c1 ZINC000604601432 568323525 /nfs/dbraw/zinc/32/35/25/568323525.db2.gz KOFWUOAYQXGIJQ-FQEVSTJZSA-N -1 3 361.445 3.758 20 0 FHADHM CCc1ccc([O-])c(C(=O)NCc2nc(-c3cccc(Cl)c3)no2)c1 ZINC000604604442 568324167 /nfs/dbraw/zinc/32/41/67/568324167.db2.gz IWHPJFFMOXRKAH-UHFFFAOYSA-N -1 3 357.797 3.588 20 0 FHADHM CC[C@@H](Cc1ccc(Cl)cc1)NC(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000604755516 568364771 /nfs/dbraw/zinc/36/47/71/568364771.db2.gz BJUZWNINIGCLDG-HNNXBMFYSA-N -1 3 354.837 3.933 20 0 FHADHM COc1ccccc1-c1cc(=NC(=O)[C@H]2C[C@@H]2c2c(F)cccc2F)[nH][n-]1 ZINC000604789401 568367256 /nfs/dbraw/zinc/36/72/56/568367256.db2.gz ZAVPUQHUPZKBEF-STQMWFEESA-N -1 3 369.371 3.528 20 0 FHADHM Cc1cc(Cl)cc(NC(=O)[C@H](C)NC(=O)CC2CCCCC2)c1[O-] ZINC000604901890 568384973 /nfs/dbraw/zinc/38/49/73/568384973.db2.gz AUMBGVISEWYXEG-LBPRGKRZSA-N -1 3 352.862 3.768 20 0 FHADHM Cc1ccccc1-c1noc(CSc2n[n-]c(-c3ccccn3)n2)n1 ZINC000604932902 568395306 /nfs/dbraw/zinc/39/53/06/568395306.db2.gz ZPNXQLKGFOVPEV-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM C[C@H](Sc1n[n-]c(-c2ccccn2)n1)C(=O)c1ccc2c(c1)CCC2 ZINC000604933260 568395400 /nfs/dbraw/zinc/39/54/00/568395400.db2.gz RWUPJNVJPHSMIG-LBPRGKRZSA-N -1 3 350.447 3.719 20 0 FHADHM COc1cccc(C(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)c1[O-] ZINC000365388618 568592039 /nfs/dbraw/zinc/59/20/39/568592039.db2.gz GCNCDUBZYDEZMT-CQSZACIVSA-N -1 3 359.426 3.665 20 0 FHADHM O=C(c1cc(OCc2ccccc2)ccc1[O-])N1CC[C@H]1C(F)(F)F ZINC000647753947 568709474 /nfs/dbraw/zinc/70/94/74/568709474.db2.gz ZBJPUVFTVSVEHV-INIZCTEOSA-N -1 3 351.324 3.748 20 0 FHADHM CS[C@@H](C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccccc1 ZINC000737170402 598829506 /nfs/dbraw/zinc/82/95/06/598829506.db2.gz JWWCFCSBRJDNBP-CQSZACIVSA-N -1 3 359.842 3.563 20 0 FHADHM CS[C@@H](C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccccc1 ZINC000737170402 598829508 /nfs/dbraw/zinc/82/95/08/598829508.db2.gz JWWCFCSBRJDNBP-CQSZACIVSA-N -1 3 359.842 3.563 20 0 FHADHM c1ccc(OCC2CC2)c(CNc2cc(-c3nnn[n-]3)c3ccccc3n2)c1 ZINC000738436612 598856430 /nfs/dbraw/zinc/85/64/30/598856430.db2.gz UAAYKRSWKHCFHJ-UHFFFAOYSA-N -1 3 372.432 3.816 20 0 FHADHM c1ccc(OCC2CC2)c(CNc2cc(-c3nn[n-]n3)c3ccccc3n2)c1 ZINC000738436612 598856432 /nfs/dbraw/zinc/85/64/32/598856432.db2.gz UAAYKRSWKHCFHJ-UHFFFAOYSA-N -1 3 372.432 3.816 20 0 FHADHM CC(C)[C@@H](Cc1ccccc1)C(=O)OCc1ccc(-c2nnn[n-]2)cc1F ZINC000735714200 598901867 /nfs/dbraw/zinc/90/18/67/598901867.db2.gz ZZIRACDBMLNBSA-QGZVFWFLSA-N -1 3 368.412 3.564 20 0 FHADHM CC(C)[C@@H](Cc1ccccc1)C(=O)OCc1ccc(-c2nn[n-]n2)cc1F ZINC000735714200 598901869 /nfs/dbraw/zinc/90/18/69/598901869.db2.gz ZZIRACDBMLNBSA-QGZVFWFLSA-N -1 3 368.412 3.564 20 0 FHADHM C[C@H](CC1CCCC1)C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCC2 ZINC000735986984 598902665 /nfs/dbraw/zinc/90/26/65/598902665.db2.gz VIYASTBBKCRBJK-LLVKDONJSA-N -1 3 359.499 3.962 20 0 FHADHM C[C@H](CC1CCCC1)C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCC2 ZINC000735986984 598902667 /nfs/dbraw/zinc/90/26/67/598902667.db2.gz VIYASTBBKCRBJK-LLVKDONJSA-N -1 3 359.499 3.962 20 0 FHADHM CC[C@@H](CC1CCCCC1)C(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000736349399 598903245 /nfs/dbraw/zinc/90/32/45/598903245.db2.gz GKMXKPHJLZLLQB-KRWDZBQOSA-N -1 3 355.486 3.822 20 0 FHADHM CC[C@@H](CC1CCCCC1)C(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000736349399 598903246 /nfs/dbraw/zinc/90/32/46/598903246.db2.gz GKMXKPHJLZLLQB-KRWDZBQOSA-N -1 3 355.486 3.822 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@@H](C)CC1CCCC1 ZINC000735905199 598904295 /nfs/dbraw/zinc/90/42/95/598904295.db2.gz YGQAHGRDVSIJCE-ZDUSSCGKSA-N -1 3 357.458 3.809 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@@H](C)CC1CCCC1 ZINC000735905199 598904296 /nfs/dbraw/zinc/90/42/96/598904296.db2.gz YGQAHGRDVSIJCE-ZDUSSCGKSA-N -1 3 357.458 3.809 20 0 FHADHM O=C(Cc1ccc(-c2nnn[n-]2)cc1)Nc1cccc(Nc2ccccc2)c1 ZINC000737955203 598911111 /nfs/dbraw/zinc/91/11/11/598911111.db2.gz AZYRNCHBJYWZDY-UHFFFAOYSA-N -1 3 370.416 3.792 20 0 FHADHM O=C(Cc1ccc(-c2nn[n-]n2)cc1)Nc1cccc(Nc2ccccc2)c1 ZINC000737955203 598911112 /nfs/dbraw/zinc/91/11/12/598911112.db2.gz AZYRNCHBJYWZDY-UHFFFAOYSA-N -1 3 370.416 3.792 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)Nc1cc(-c2ccccc2)ns1 ZINC000737796925 598913279 /nfs/dbraw/zinc/91/32/79/598913279.db2.gz CFVLJFVYBHJULB-ZHACJKMWSA-N -1 3 374.429 3.642 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)Nc1cc(-c2ccccc2)ns1 ZINC000737796925 598913281 /nfs/dbraw/zinc/91/32/81/598913281.db2.gz CFVLJFVYBHJULB-ZHACJKMWSA-N -1 3 374.429 3.642 20 0 FHADHM Cc1ccc2cccc(NC(=O)N[C@H](C)c3ccc(-c4nnn[n-]4)cc3)c2n1 ZINC000737374059 598923358 /nfs/dbraw/zinc/92/33/58/598923358.db2.gz JPMAAKHIVWGNLE-CYBMUJFWSA-N -1 3 373.420 3.606 20 0 FHADHM Cc1ccc2cccc(NC(=O)N[C@H](C)c3ccc(-c4nn[n-]n4)cc3)c2n1 ZINC000737374059 598923360 /nfs/dbraw/zinc/92/33/60/598923360.db2.gz JPMAAKHIVWGNLE-CYBMUJFWSA-N -1 3 373.420 3.606 20 0 FHADHM CCN(C(=O)C=C1CCC(C)CC1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736501309 598926494 /nfs/dbraw/zinc/92/64/94/598926494.db2.gz CJJXKSVASFEIIM-YSSOQSIOSA-N -1 3 353.470 3.913 20 0 FHADHM CCN(C(=O)C=C1CCC(C)CC1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736501309 598926496 /nfs/dbraw/zinc/92/64/96/598926496.db2.gz CJJXKSVASFEIIM-YSSOQSIOSA-N -1 3 353.470 3.913 20 0 FHADHM CCCCN(C(=O)c1ccc(-c2nnn[n-]2)cn1)[C@H](CC)c1ccccc1 ZINC000736451858 598927823 /nfs/dbraw/zinc/92/78/23/598927823.db2.gz QCIHECLMNADNKU-GOSISDBHSA-N -1 3 364.453 3.655 20 0 FHADHM CCCCN(C(=O)c1ccc(-c2nn[n-]n2)cn1)[C@H](CC)c1ccccc1 ZINC000736451858 598927824 /nfs/dbraw/zinc/92/78/24/598927824.db2.gz QCIHECLMNADNKU-GOSISDBHSA-N -1 3 364.453 3.655 20 0 FHADHM Cc1cc2c(o1)CC(C)(C)C[C@@H]2Nc1ncc(-c2nnn[n-]2)cc1Cl ZINC000737283345 598937398 /nfs/dbraw/zinc/93/73/98/598937398.db2.gz CWVKDPQZQJPJPC-ZDUSSCGKSA-N -1 3 358.833 3.942 20 0 FHADHM Cc1cc2c(o1)CC(C)(C)C[C@@H]2Nc1ncc(-c2nn[n-]n2)cc1Cl ZINC000737283345 598937399 /nfs/dbraw/zinc/93/73/99/598937399.db2.gz CWVKDPQZQJPJPC-ZDUSSCGKSA-N -1 3 358.833 3.942 20 0 FHADHM Cc1ccc([C@@H]2CCCN2c2ncc(-c3nnn[n-]3)cc2Cl)cc1C ZINC000737330796 598938635 /nfs/dbraw/zinc/93/86/35/598938635.db2.gz KOMKWEMEOGNDON-INIZCTEOSA-N -1 3 354.845 3.873 20 0 FHADHM Cc1ccc([C@@H]2CCCN2c2ncc(-c3nn[n-]n3)cc2Cl)cc1C ZINC000737330796 598938637 /nfs/dbraw/zinc/93/86/37/598938637.db2.gz KOMKWEMEOGNDON-INIZCTEOSA-N -1 3 354.845 3.873 20 0 FHADHM CC(C)C[C@H]1CCCCCN1C(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000735794679 598941861 /nfs/dbraw/zinc/94/18/61/598941861.db2.gz AEZGZJGDVOMLNY-MRXNPFEDSA-N -1 3 373.526 3.776 20 0 FHADHM CC(C)C[C@H]1CCCCCN1C(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000735794679 598941862 /nfs/dbraw/zinc/94/18/62/598941862.db2.gz AEZGZJGDVOMLNY-MRXNPFEDSA-N -1 3 373.526 3.776 20 0 FHADHM CC(C)(C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCC2)c1cccs1 ZINC000735581705 598979704 /nfs/dbraw/zinc/97/97/04/598979704.db2.gz AWKNCTFGJSAVCT-UHFFFAOYSA-N -1 3 373.507 3.785 20 0 FHADHM CC(C)(C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCC2)c1cccs1 ZINC000735581705 598979706 /nfs/dbraw/zinc/97/97/06/598979706.db2.gz AWKNCTFGJSAVCT-UHFFFAOYSA-N -1 3 373.507 3.785 20 0 FHADHM Clc1ccc(Br)cc1CNc1cccc(-c2nnn[n-]2)c1 ZINC000227663864 599325283 /nfs/dbraw/zinc/32/52/83/599325283.db2.gz BDYUKGSNTSIGOH-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM Clc1ccc(Br)cc1CNc1cccc(-c2nn[n-]n2)c1 ZINC000227663864 599325285 /nfs/dbraw/zinc/32/52/85/599325285.db2.gz BDYUKGSNTSIGOH-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM O=C(C[C@@H]1CCc2ccccc21)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000737818651 599016424 /nfs/dbraw/zinc/01/64/24/599016424.db2.gz JNJZLXGKUBODOJ-LBPRGKRZSA-N -1 3 353.813 3.579 20 0 FHADHM O=C(C[C@@H]1CCc2ccccc21)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000737818651 599016426 /nfs/dbraw/zinc/01/64/26/599016426.db2.gz JNJZLXGKUBODOJ-LBPRGKRZSA-N -1 3 353.813 3.579 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@H]2C(=O)OCc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000735924051 599016433 /nfs/dbraw/zinc/01/64/33/599016433.db2.gz ORQKAXDIUPLRHP-RBUKOAKNSA-N -1 3 362.433 3.837 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@H]2C(=O)OCc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000735924051 599016434 /nfs/dbraw/zinc/01/64/34/599016434.db2.gz ORQKAXDIUPLRHP-RBUKOAKNSA-N -1 3 362.433 3.837 20 0 FHADHM CC(C)C[C@H](C(=O)OCc1ccc(-c2nnn[n-]2)cc1F)c1ccccc1 ZINC000735758196 599019168 /nfs/dbraw/zinc/01/91/68/599019168.db2.gz XYIACLUVPFSIIY-KRWDZBQOSA-N -1 3 368.412 3.879 20 0 FHADHM CC(C)C[C@H](C(=O)OCc1ccc(-c2nn[n-]n2)cc1F)c1ccccc1 ZINC000735758196 599019169 /nfs/dbraw/zinc/01/91/69/599019169.db2.gz XYIACLUVPFSIIY-KRWDZBQOSA-N -1 3 368.412 3.879 20 0 FHADHM CC[C@@H](NC(=O)Nc1cc(-c2nnn[n-]2)ccc1C)c1cc(F)ccc1F ZINC000736361665 599020600 /nfs/dbraw/zinc/02/06/00/599020600.db2.gz HGKUMGVIRNAHTP-OAHLLOKOSA-N -1 3 372.379 3.726 20 0 FHADHM CC[C@@H](NC(=O)Nc1cc(-c2nn[n-]n2)ccc1C)c1cc(F)ccc1F ZINC000736361665 599020602 /nfs/dbraw/zinc/02/06/02/599020602.db2.gz HGKUMGVIRNAHTP-OAHLLOKOSA-N -1 3 372.379 3.726 20 0 FHADHM CC[C@H](OC(=O)CCc1ccc(-c2nnn[n-]2)cc1)c1cccc(OC)c1 ZINC000736383705 599027729 /nfs/dbraw/zinc/02/77/29/599027729.db2.gz UAPJTWYVJYZJHI-SFHVURJKSA-N -1 3 366.421 3.502 20 0 FHADHM CC[C@H](OC(=O)CCc1ccc(-c2nn[n-]n2)cc1)c1cccc(OC)c1 ZINC000736383705 599027731 /nfs/dbraw/zinc/02/77/31/599027731.db2.gz UAPJTWYVJYZJHI-SFHVURJKSA-N -1 3 366.421 3.502 20 0 FHADHM CCc1nc(C)c([C@H](C)OC(=O)C=Cc2ccccc2-c2nnn[n-]2)s1 ZINC000736699528 599029801 /nfs/dbraw/zinc/02/98/01/599029801.db2.gz KYRXCMWIFFPMCJ-PRDAAYKISA-N -1 3 369.450 3.512 20 0 FHADHM CCc1nc(C)c([C@H](C)OC(=O)C=Cc2ccccc2-c2nn[n-]n2)s1 ZINC000736699528 599029803 /nfs/dbraw/zinc/02/98/03/599029803.db2.gz KYRXCMWIFFPMCJ-PRDAAYKISA-N -1 3 369.450 3.512 20 0 FHADHM C[C@H]1CN(c2cc(Cl)ccc2-c2nnn[n-]2)C[C@H](c2ccc(F)cc2)O1 ZINC000820769681 599035264 /nfs/dbraw/zinc/03/52/64/599035264.db2.gz VPRNXLOABAUZSY-APPDUMDISA-N -1 3 373.819 3.626 20 0 FHADHM C[C@H]1CN(c2cc(Cl)ccc2-c2nn[n-]n2)C[C@H](c2ccc(F)cc2)O1 ZINC000820769681 599035267 /nfs/dbraw/zinc/03/52/67/599035267.db2.gz VPRNXLOABAUZSY-APPDUMDISA-N -1 3 373.819 3.626 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N2CCC[C@H]2c2cccs2)n1 ZINC000737631034 599040025 /nfs/dbraw/zinc/04/00/25/599040025.db2.gz BTTFEDHCBMWFPV-JTQLQIEISA-N -1 3 366.372 3.684 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N2CCC[C@H]2c2cccs2)n1 ZINC000737631034 599040028 /nfs/dbraw/zinc/04/00/28/599040028.db2.gz BTTFEDHCBMWFPV-JTQLQIEISA-N -1 3 366.372 3.684 20 0 FHADHM CC[C@@H](Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1)c1nc(C)cs1 ZINC000736367818 599054039 /nfs/dbraw/zinc/05/40/39/599054039.db2.gz CTSSFVHEXREJBO-SECBINFHSA-N -1 3 369.376 3.609 20 0 FHADHM CC[C@@H](Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1)c1nc(C)cs1 ZINC000736367818 599054042 /nfs/dbraw/zinc/05/40/42/599054042.db2.gz CTSSFVHEXREJBO-SECBINFHSA-N -1 3 369.376 3.609 20 0 FHADHM Fc1ccc2c(c1)[C@@H](Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1)CC2 ZINC000737667925 599055287 /nfs/dbraw/zinc/05/52/87/599055287.db2.gz RXAQMRNUFWLTJG-LBPRGKRZSA-N -1 3 364.306 3.519 20 0 FHADHM Fc1ccc2c(c1)[C@@H](Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1)CC2 ZINC000737667925 599055290 /nfs/dbraw/zinc/05/52/90/599055290.db2.gz RXAQMRNUFWLTJG-LBPRGKRZSA-N -1 3 364.306 3.519 20 0 FHADHM CC(C)N(C(=O)CSc1ccc(-c2nnn[n-]2)cc1F)c1ccccc1 ZINC000735851496 599062883 /nfs/dbraw/zinc/06/28/83/599062883.db2.gz XQXMLYHFVODQNG-UHFFFAOYSA-N -1 3 371.441 3.540 20 0 FHADHM CC(C)N(C(=O)CSc1ccc(-c2nn[n-]n2)cc1F)c1ccccc1 ZINC000735851496 599062885 /nfs/dbraw/zinc/06/28/85/599062885.db2.gz XQXMLYHFVODQNG-UHFFFAOYSA-N -1 3 371.441 3.540 20 0 FHADHM C[C@@H]1CCC[C@H](C(=O)N(Cc2ccco2)c2ccccc2-c2nnn[n-]2)C1 ZINC000736244663 599070800 /nfs/dbraw/zinc/07/08/00/599070800.db2.gz LSRNBSMFJFBNBQ-CABCVRRESA-N -1 3 365.437 3.819 20 0 FHADHM C[C@@H]1CCC[C@H](C(=O)N(Cc2ccco2)c2ccccc2-c2nn[n-]n2)C1 ZINC000736244663 599070805 /nfs/dbraw/zinc/07/08/05/599070805.db2.gz LSRNBSMFJFBNBQ-CABCVRRESA-N -1 3 365.437 3.819 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@H]1C[C@@H]1C1CCCCC1 ZINC000736481155 599071119 /nfs/dbraw/zinc/07/11/19/599071119.db2.gz UYCSZANLFZUQQQ-MOPGFXCFSA-N -1 3 367.497 3.822 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@H]1C[C@@H]1C1CCCCC1 ZINC000736481155 599071122 /nfs/dbraw/zinc/07/11/22/599071122.db2.gz UYCSZANLFZUQQQ-MOPGFXCFSA-N -1 3 367.497 3.822 20 0 FHADHM Cc1ccc([C@@H]2CCCCN2C(=O)C=Cc2ccccc2-c2nnn[n-]2)o1 ZINC000737330392 599083669 /nfs/dbraw/zinc/08/36/69/599083669.db2.gz NLGODTAVNZTGIA-JICACKBISA-N -1 3 363.421 3.535 20 0 FHADHM Cc1ccc([C@@H]2CCCCN2C(=O)C=Cc2ccccc2-c2nn[n-]n2)o1 ZINC000737330392 599083671 /nfs/dbraw/zinc/08/36/71/599083671.db2.gz NLGODTAVNZTGIA-JICACKBISA-N -1 3 363.421 3.535 20 0 FHADHM C[C@@H]1C[C@H](c2ccccc2)[C@H](C)N1C(=O)C=Cc1ccccc1-c1nnn[n-]1 ZINC000736235681 599091527 /nfs/dbraw/zinc/09/15/27/599091527.db2.gz PLAIXLZHMRYMBV-WKDOOVODSA-N -1 3 373.460 3.673 20 0 FHADHM C[C@@H]1C[C@H](c2ccccc2)[C@H](C)N1C(=O)C=Cc1ccccc1-c1nn[n-]n1 ZINC000736235681 599091530 /nfs/dbraw/zinc/09/15/30/599091530.db2.gz PLAIXLZHMRYMBV-WKDOOVODSA-N -1 3 373.460 3.673 20 0 FHADHM C[C@H](Nc1c(F)cc(-c2nn[n-]n2)cc1F)c1cccc(-n2ccnc2)c1 ZINC000820450104 599094876 /nfs/dbraw/zinc/09/48/76/599094876.db2.gz HAVGGNNWXIRVBK-NSHDSACASA-N -1 3 367.363 3.504 20 0 FHADHM Fc1ccc(CSC[C@H]2OCCc3ccccc32)c(-c2nnn[n-]2)c1 ZINC000737648128 599100792 /nfs/dbraw/zinc/10/07/92/599100792.db2.gz GAHJPYCPALTTMK-QGZVFWFLSA-N -1 3 356.426 3.553 20 0 FHADHM Fc1ccc(CSC[C@H]2OCCc3ccccc32)c(-c2nn[n-]n2)c1 ZINC000737648128 599100794 /nfs/dbraw/zinc/10/07/94/599100794.db2.gz GAHJPYCPALTTMK-QGZVFWFLSA-N -1 3 356.426 3.553 20 0 FHADHM CC(C)[C@H](C)SCCC(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820020933 599129815 /nfs/dbraw/zinc/12/98/15/599129815.db2.gz MSWPILONWVKERM-JTQLQIEISA-N -1 3 353.879 3.626 20 0 FHADHM CC(C)[C@H](C)SCCC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820020933 599129817 /nfs/dbraw/zinc/12/98/17/599129817.db2.gz MSWPILONWVKERM-JTQLQIEISA-N -1 3 353.879 3.626 20 0 FHADHM Cc1nc(-c2cccc(C(=O)Nc3cccc(-c4nnn[n-]4)c3)c2)cs1 ZINC000079379991 599131666 /nfs/dbraw/zinc/13/16/66/599131666.db2.gz GHGDJNSSGABCRB-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1nc(-c2cccc(C(=O)Nc3cccc(-c4nn[n-]n4)c3)c2)cs1 ZINC000079379991 599131667 /nfs/dbraw/zinc/13/16/67/599131667.db2.gz GHGDJNSSGABCRB-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N1C[C@@H](c2ccccc2)C[C@@H]1C ZINC000737293069 599146399 /nfs/dbraw/zinc/14/63/99/599146399.db2.gz ZUBZWOVXVQXVCW-YOEHRIQHSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N1C[C@@H](c2ccccc2)C[C@@H]1C ZINC000737293069 599146402 /nfs/dbraw/zinc/14/64/02/599146402.db2.gz ZUBZWOVXVQXVCW-YOEHRIQHSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)C=Cc1cnc(C(C)(C)C)s1 ZINC000822216652 599149165 /nfs/dbraw/zinc/14/91/65/599149165.db2.gz VWVFDJTXJQVLLQ-BQYQJAHWSA-N -1 3 368.466 3.581 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)C=Cc1cnc(C(C)(C)C)s1 ZINC000822216652 599149167 /nfs/dbraw/zinc/14/91/67/599149167.db2.gz VWVFDJTXJQVLLQ-BQYQJAHWSA-N -1 3 368.466 3.581 20 0 FHADHM Cc1sc(NC(=O)C[C@H](C)c2cccc(F)c2)c(-c2nnn[n-]2)c1C ZINC000737563697 599158905 /nfs/dbraw/zinc/15/89/05/599158905.db2.gz SDMDMUIJEBUNGN-VIFPVBQESA-N -1 3 359.430 3.816 20 0 FHADHM Cc1sc(NC(=O)C[C@H](C)c2cccc(F)c2)c(-c2nn[n-]n2)c1C ZINC000737563697 599158907 /nfs/dbraw/zinc/15/89/07/599158907.db2.gz SDMDMUIJEBUNGN-VIFPVBQESA-N -1 3 359.430 3.816 20 0 FHADHM Cc1ccc(SCc2nnc(-c3ccc(-c4nnn[n-]4)cc3)o2)cc1 ZINC000737368255 599159152 /nfs/dbraw/zinc/15/91/52/599159152.db2.gz GYEHQTKOEBHFCF-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM Cc1ccc(SCc2nnc(-c3ccc(-c4nn[n-]n4)cc3)o2)cc1 ZINC000737368255 599159154 /nfs/dbraw/zinc/15/91/54/599159154.db2.gz GYEHQTKOEBHFCF-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM C[C@H](CC(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C)c1cccc(F)c1 ZINC000735975358 599159513 /nfs/dbraw/zinc/15/95/13/599159513.db2.gz LWAUZJGASREIES-GFCCVEGCSA-N -1 3 370.432 3.695 20 0 FHADHM C[C@H](CC(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C)c1cccc(F)c1 ZINC000735975358 599159515 /nfs/dbraw/zinc/15/95/15/599159515.db2.gz LWAUZJGASREIES-GFCCVEGCSA-N -1 3 370.432 3.695 20 0 FHADHM S=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)N1CCC[C@@H]1c1ccco1 ZINC000738401694 599159819 /nfs/dbraw/zinc/15/98/19/599159819.db2.gz RQQNBOCUFMRAOL-CYBMUJFWSA-N -1 3 374.857 3.647 20 0 FHADHM S=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)N1CCC[C@@H]1c1ccco1 ZINC000738401694 599159821 /nfs/dbraw/zinc/15/98/21/599159821.db2.gz RQQNBOCUFMRAOL-CYBMUJFWSA-N -1 3 374.857 3.647 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)ccc1OC(=O)C[C@H](C)c1cccc(F)c1 ZINC000736626365 599160622 /nfs/dbraw/zinc/16/06/22/599160622.db2.gz GVWRPDBSYRUCOZ-LBPRGKRZSA-N -1 3 370.384 3.504 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)ccc1OC(=O)C[C@H](C)c1cccc(F)c1 ZINC000736626365 599160624 /nfs/dbraw/zinc/16/06/24/599160624.db2.gz GVWRPDBSYRUCOZ-LBPRGKRZSA-N -1 3 370.384 3.504 20 0 FHADHM Cc1nc(C)c(-c2nnn[n-]2)c(SCc2cc(Cl)ccc2Cl)n1 ZINC000737470722 599162089 /nfs/dbraw/zinc/16/20/89/599162089.db2.gz LAHNBRQRXXVKRO-UHFFFAOYSA-N -1 3 367.265 3.873 20 0 FHADHM Cc1nc(C)c(-c2nn[n-]n2)c(SCc2cc(Cl)ccc2Cl)n1 ZINC000737470722 599162092 /nfs/dbraw/zinc/16/20/92/599162092.db2.gz LAHNBRQRXXVKRO-UHFFFAOYSA-N -1 3 367.265 3.873 20 0 FHADHM CC(C)(C)[C@@H]1CCCN(C(=O)C=Cc2ccccc2-c2nnn[n-]2)CC1 ZINC000735597961 599162140 /nfs/dbraw/zinc/16/21/40/599162140.db2.gz UYDCHZZWALTZLQ-SIFUEBAJSA-N -1 3 353.470 3.555 20 0 FHADHM CC(C)(C)[C@@H]1CCCN(C(=O)C=Cc2ccccc2-c2nn[n-]n2)CC1 ZINC000735597961 599162143 /nfs/dbraw/zinc/16/21/43/599162143.db2.gz UYDCHZZWALTZLQ-SIFUEBAJSA-N -1 3 353.470 3.555 20 0 FHADHM CC(C)(C)[C@H]1CCCN(C(=O)C=Cc2ccccc2-c2nnn[n-]2)CC1 ZINC000735597962 599162222 /nfs/dbraw/zinc/16/22/22/599162222.db2.gz UYDCHZZWALTZLQ-SNGWPZLWSA-N -1 3 353.470 3.555 20 0 FHADHM CC(C)(C)[C@H]1CCCN(C(=O)C=Cc2ccccc2-c2nn[n-]n2)CC1 ZINC000735597962 599162224 /nfs/dbraw/zinc/16/22/24/599162224.db2.gz UYDCHZZWALTZLQ-SNGWPZLWSA-N -1 3 353.470 3.555 20 0 FHADHM Fc1ccccc1-c1cnc(CSc2ccc(-c3nnn[n-]3)cc2)o1 ZINC000737663166 599165188 /nfs/dbraw/zinc/16/51/88/599165188.db2.gz HCJQADWQTAPLSF-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM Fc1ccccc1-c1cnc(CSc2ccc(-c3nn[n-]n3)cc2)o1 ZINC000737663166 599165190 /nfs/dbraw/zinc/16/51/90/599165190.db2.gz HCJQADWQTAPLSF-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1SCc1cccc(OC(F)F)c1 ZINC000737643118 599167766 /nfs/dbraw/zinc/16/77/66/599167766.db2.gz ASZCDTPAEPQJHO-UHFFFAOYSA-N -1 3 352.341 3.900 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1SCc1cccc(OC(F)F)c1 ZINC000737643118 599167767 /nfs/dbraw/zinc/16/77/67/599167767.db2.gz ASZCDTPAEPQJHO-UHFFFAOYSA-N -1 3 352.341 3.900 20 0 FHADHM CC[C@H](Cc1ccccc1)N(C)C(=S)Nc1ccccc1-c1nnn[n-]1 ZINC000736351996 599173135 /nfs/dbraw/zinc/17/31/35/599173135.db2.gz RBROTPIMAMISDD-OAHLLOKOSA-N -1 3 366.494 3.517 20 0 FHADHM CC[C@H](Cc1ccccc1)N(C)C(=S)Nc1ccccc1-c1nn[n-]n1 ZINC000736351996 599173137 /nfs/dbraw/zinc/17/31/37/599173137.db2.gz RBROTPIMAMISDD-OAHLLOKOSA-N -1 3 366.494 3.517 20 0 FHADHM O=C(Nc1ccccc1-c1nnn[n-]1)[C@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1 ZINC000738190322 599178236 /nfs/dbraw/zinc/17/82/36/599178236.db2.gz CSUOFBDOTWXAMF-KGLIPLIRSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1ccccc1-c1nn[n-]n1)[C@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1 ZINC000738190322 599178240 /nfs/dbraw/zinc/17/82/40/599178240.db2.gz CSUOFBDOTWXAMF-KGLIPLIRSA-N -1 3 374.231 3.916 20 0 FHADHM CCCCCC[C@H](C)C(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000736445684 599179574 /nfs/dbraw/zinc/17/95/74/599179574.db2.gz MAUBYVAIXKDKTD-HNNXBMFYSA-N -1 3 355.486 3.964 20 0 FHADHM CCCCCC[C@H](C)C(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000736445684 599179575 /nfs/dbraw/zinc/17/95/75/599179575.db2.gz MAUBYVAIXKDKTD-HNNXBMFYSA-N -1 3 355.486 3.964 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nnn[n-]2)c1)c1cc2cccc(F)c2o1 ZINC000738162328 599181213 /nfs/dbraw/zinc/18/12/13/599181213.db2.gz AFEWCMXWAZEJMM-UHFFFAOYSA-N -1 3 357.732 3.658 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nn[n-]n2)c1)c1cc2cccc(F)c2o1 ZINC000738162328 599181215 /nfs/dbraw/zinc/18/12/15/599181215.db2.gz AFEWCMXWAZEJMM-UHFFFAOYSA-N -1 3 357.732 3.658 20 0 FHADHM Cc1ccccc1[C@@H](C)CC(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000737420350 599190595 /nfs/dbraw/zinc/19/05/95/599190595.db2.gz IGZIQDFAQAKIKG-GJZGRUSLSA-N -1 3 350.422 3.973 20 0 FHADHM Cc1ccccc1[C@@H](C)CC(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000737420350 599190598 /nfs/dbraw/zinc/19/05/98/599190598.db2.gz IGZIQDFAQAKIKG-GJZGRUSLSA-N -1 3 350.422 3.973 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)Nc1cccc(CC(F)(F)F)c1 ZINC000822936549 599197521 /nfs/dbraw/zinc/19/75/21/599197521.db2.gz VKKKKNXWLCWOOA-HJWRWDBZSA-N -1 3 373.338 3.623 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)Nc1cccc(CC(F)(F)F)c1 ZINC000822936549 599197523 /nfs/dbraw/zinc/19/75/23/599197523.db2.gz VKKKKNXWLCWOOA-HJWRWDBZSA-N -1 3 373.338 3.623 20 0 FHADHM Cc1cc(NC(=O)C=Cc2ccccc2-c2nnn[n-]2)c2cccnc2c1C ZINC000822206999 599197863 /nfs/dbraw/zinc/19/78/63/599197863.db2.gz HPFXCOBWVYKLJB-KTKRTIGZSA-N -1 3 370.416 3.684 20 0 FHADHM Cc1cc(NC(=O)C=Cc2ccccc2-c2nn[n-]n2)c2cccnc2c1C ZINC000822206999 599197865 /nfs/dbraw/zinc/19/78/65/599197865.db2.gz HPFXCOBWVYKLJB-KTKRTIGZSA-N -1 3 370.416 3.684 20 0 FHADHM COc1ccc([C@H]2CCCN2c2cccc(Cl)c2-c2nnn[n-]2)cc1 ZINC000821787012 599216276 /nfs/dbraw/zinc/21/62/76/599216276.db2.gz NGQZWOHCCDUEMX-OAHLLOKOSA-N -1 3 355.829 3.870 20 0 FHADHM COc1ccc([C@H]2CCCN2c2cccc(Cl)c2-c2nn[n-]n2)cc1 ZINC000821787012 599216278 /nfs/dbraw/zinc/21/62/78/599216278.db2.gz NGQZWOHCCDUEMX-OAHLLOKOSA-N -1 3 355.829 3.870 20 0 FHADHM O=C(CCC1CC1)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1 ZINC000822950699 599219009 /nfs/dbraw/zinc/21/90/09/599219009.db2.gz XUFGLVLPUOBXJY-UHFFFAOYSA-N -1 3 367.384 3.927 20 0 FHADHM O=C(CCC1CC1)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1 ZINC000822950699 599219012 /nfs/dbraw/zinc/21/90/12/599219012.db2.gz XUFGLVLPUOBXJY-UHFFFAOYSA-N -1 3 367.384 3.927 20 0 FHADHM Cc1cccc(C(C)C)c1NC(=O)c1ncc(-c2nnn[n-]2)cc1Cl ZINC000822288671 607262043 /nfs/dbraw/zinc/26/20/43/607262043.db2.gz FXZSRDAQAXFJPR-UHFFFAOYSA-N -1 3 356.817 3.599 20 0 FHADHM Cc1cccc(C(C)C)c1NC(=O)c1ncc(-c2nn[n-]n2)cc1Cl ZINC000822288671 607262044 /nfs/dbraw/zinc/26/20/44/607262044.db2.gz FXZSRDAQAXFJPR-UHFFFAOYSA-N -1 3 356.817 3.599 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)Nc1ccccc1CC(F)(F)F ZINC000737804173 599227817 /nfs/dbraw/zinc/22/78/17/599227817.db2.gz ZBUSUVSMHVLWPI-KTKRTIGZSA-N -1 3 373.338 3.623 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)Nc1ccccc1CC(F)(F)F ZINC000737804173 599227819 /nfs/dbraw/zinc/22/78/19/599227819.db2.gz ZBUSUVSMHVLWPI-KTKRTIGZSA-N -1 3 373.338 3.623 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NCc1cccc(F)c1Br ZINC000822221273 607265247 /nfs/dbraw/zinc/26/52/47/607265247.db2.gz IEVKMJYRFRIGPG-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NCc1cccc(F)c1Br ZINC000822221273 607265248 /nfs/dbraw/zinc/26/52/48/607265248.db2.gz IEVKMJYRFRIGPG-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Cc1ccc(NC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1Cl ZINC000822248947 599236636 /nfs/dbraw/zinc/23/66/36/599236636.db2.gz VSNMZNNUIXKVIL-NSHDSACASA-N -1 3 356.817 3.711 20 0 FHADHM Cc1ccc(NC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1Cl ZINC000822248947 599236637 /nfs/dbraw/zinc/23/66/37/599236637.db2.gz VSNMZNNUIXKVIL-NSHDSACASA-N -1 3 356.817 3.711 20 0 FHADHM CCCCc1ccc(NC(=O)NCc2cc(-c3nnn[n-]3)ccc2F)cc1 ZINC000821077983 599238762 /nfs/dbraw/zinc/23/87/62/599238762.db2.gz ZPSDFCXSVZYPTA-UHFFFAOYSA-N -1 3 368.416 3.670 20 0 FHADHM CCCCc1ccc(NC(=O)NCc2cc(-c3nn[n-]n3)ccc2F)cc1 ZINC000821077983 599238763 /nfs/dbraw/zinc/23/87/63/599238763.db2.gz ZPSDFCXSVZYPTA-UHFFFAOYSA-N -1 3 368.416 3.670 20 0 FHADHM Cc1c(NC(=O)c2ccc(-c3ccccc3F)o2)cccc1-c1nnn[n-]1 ZINC000822110145 607268054 /nfs/dbraw/zinc/26/80/54/607268054.db2.gz XLBNDIKCNGFZTE-UHFFFAOYSA-N -1 3 363.352 3.827 20 0 FHADHM Cc1c(NC(=O)c2ccc(-c3ccccc3F)o2)cccc1-c1nn[n-]n1 ZINC000822110145 607268055 /nfs/dbraw/zinc/26/80/55/607268055.db2.gz XLBNDIKCNGFZTE-UHFFFAOYSA-N -1 3 363.352 3.827 20 0 FHADHM C[C@@H]1CN(C(=O)Nc2ccc(-c3nnn[n-]3)cc2)CC[C@H]1c1ccccc1 ZINC000820742919 599240568 /nfs/dbraw/zinc/24/05/68/599240568.db2.gz NSTMVLFLSGJCAA-RDTXWAMCSA-N -1 3 362.437 3.524 20 0 FHADHM C[C@@H]1CN(C(=O)Nc2ccc(-c3nn[n-]n3)cc2)CC[C@H]1c1ccccc1 ZINC000820742919 599240570 /nfs/dbraw/zinc/24/05/70/599240570.db2.gz NSTMVLFLSGJCAA-RDTXWAMCSA-N -1 3 362.437 3.524 20 0 FHADHM C[C@@H](NC(=O)Nc1cccc2c1CCCC2)c1cccc(-c2nnn[n-]2)c1 ZINC000820380116 599243189 /nfs/dbraw/zinc/24/31/89/599243189.db2.gz LOYGYHKCJIXQDY-CYBMUJFWSA-N -1 3 362.437 3.628 20 0 FHADHM C[C@@H](NC(=O)Nc1cccc2c1CCCC2)c1cccc(-c2nn[n-]n2)c1 ZINC000820380116 599243191 /nfs/dbraw/zinc/24/31/91/599243191.db2.gz LOYGYHKCJIXQDY-CYBMUJFWSA-N -1 3 362.437 3.628 20 0 FHADHM C[C@H](NC(=O)Nc1cccc2c1CCCC2)c1cccc(-c2nnn[n-]2)c1 ZINC000820380117 599243322 /nfs/dbraw/zinc/24/33/22/599243322.db2.gz LOYGYHKCJIXQDY-ZDUSSCGKSA-N -1 3 362.437 3.628 20 0 FHADHM C[C@H](NC(=O)Nc1cccc2c1CCCC2)c1cccc(-c2nn[n-]n2)c1 ZINC000820380117 599243324 /nfs/dbraw/zinc/24/33/24/599243324.db2.gz LOYGYHKCJIXQDY-ZDUSSCGKSA-N -1 3 362.437 3.628 20 0 FHADHM C[C@@H](CC(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(F)cc1F ZINC000824384532 607777856 /nfs/dbraw/zinc/77/78/56/607777856.db2.gz CZCQRKNXXNEPPL-RYUDHWBXSA-N -1 3 372.375 3.943 20 0 FHADHM C[C@@H](CC(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(F)cc1F ZINC000824384532 607777857 /nfs/dbraw/zinc/77/78/57/607777857.db2.gz CZCQRKNXXNEPPL-RYUDHWBXSA-N -1 3 372.375 3.943 20 0 FHADHM Cc1c(NC(=O)N(C)[C@@H](C)c2ccccc2F)cccc1-c1nnn[n-]1 ZINC000822075839 607282938 /nfs/dbraw/zinc/28/29/38/607282938.db2.gz JMDWMWTVFRGUEZ-LBPRGKRZSA-N -1 3 354.389 3.539 20 0 FHADHM Cc1c(NC(=O)N(C)[C@@H](C)c2ccccc2F)cccc1-c1nn[n-]n1 ZINC000822075839 607282939 /nfs/dbraw/zinc/28/29/39/607282939.db2.gz JMDWMWTVFRGUEZ-LBPRGKRZSA-N -1 3 354.389 3.539 20 0 FHADHM Cc1c(NC(=O)N(C)Cc2c(F)cccc2Cl)cccc1-c1nnn[n-]1 ZINC000822076308 607279964 /nfs/dbraw/zinc/27/99/64/607279964.db2.gz NQFMKSGPAJYGCF-UHFFFAOYSA-N -1 3 374.807 3.632 20 0 FHADHM Cc1c(NC(=O)N(C)Cc2c(F)cccc2Cl)cccc1-c1nn[n-]n1 ZINC000822076308 607279965 /nfs/dbraw/zinc/27/99/65/607279965.db2.gz NQFMKSGPAJYGCF-UHFFFAOYSA-N -1 3 374.807 3.632 20 0 FHADHM Cc1c(NC(=O)N(Cc2ccco2)C2CCCC2)cccc1-c1nnn[n-]1 ZINC000822084314 607283083 /nfs/dbraw/zinc/28/30/83/607283083.db2.gz IJWSXFSCXFMAAP-UHFFFAOYSA-N -1 3 366.425 3.745 20 0 FHADHM Cc1c(NC(=O)N(Cc2ccco2)C2CCCC2)cccc1-c1nn[n-]n1 ZINC000822084314 607283084 /nfs/dbraw/zinc/28/30/84/607283084.db2.gz IJWSXFSCXFMAAP-UHFFFAOYSA-N -1 3 366.425 3.745 20 0 FHADHM Cc1c(NC(=O)N[C@@H](C)Cc2ccccc2Cl)cccc1-c1nnn[n-]1 ZINC000822089880 607281687 /nfs/dbraw/zinc/28/16/87/607281687.db2.gz HXOSBKPVMILTNA-NSHDSACASA-N -1 3 370.844 3.581 20 0 FHADHM Cc1c(NC(=O)N[C@@H](C)Cc2ccccc2Cl)cccc1-c1nn[n-]n1 ZINC000822089880 607281688 /nfs/dbraw/zinc/28/16/88/607281688.db2.gz HXOSBKPVMILTNA-NSHDSACASA-N -1 3 370.844 3.581 20 0 FHADHM Cc1cccc([C@H]2CCCN2C(=O)Nc2cccc(-c3nnn[n-]3)c2C)c1 ZINC000822299260 607287933 /nfs/dbraw/zinc/28/79/33/607287933.db2.gz CRASQOIOTUVTPT-GOSISDBHSA-N -1 3 362.437 3.853 20 0 FHADHM Cc1cccc([C@H]2CCCN2C(=O)Nc2cccc(-c3nn[n-]n3)c2C)c1 ZINC000822299260 607287934 /nfs/dbraw/zinc/28/79/34/607287934.db2.gz CRASQOIOTUVTPT-GOSISDBHSA-N -1 3 362.437 3.853 20 0 FHADHM Cc1c(NC(=O)N2CC(C)(C)[C@H]2c2ccccc2)cccc1-c1nnn[n-]1 ZINC000822085383 607284959 /nfs/dbraw/zinc/28/49/59/607284959.db2.gz YQUHOOKVRLHEKB-QGZVFWFLSA-N -1 3 362.437 3.790 20 0 FHADHM Cc1c(NC(=O)N2CC(C)(C)[C@H]2c2ccccc2)cccc1-c1nn[n-]n1 ZINC000822085383 607284960 /nfs/dbraw/zinc/28/49/60/607284960.db2.gz YQUHOOKVRLHEKB-QGZVFWFLSA-N -1 3 362.437 3.790 20 0 FHADHM CCN(Cc1cccc(Cl)c1)C(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000821220565 607286416 /nfs/dbraw/zinc/28/64/16/607286416.db2.gz BVMBPPRWMOGEGY-UHFFFAOYSA-N -1 3 370.844 3.883 20 0 FHADHM CCN(Cc1cccc(Cl)c1)C(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000821220565 607286417 /nfs/dbraw/zinc/28/64/17/607286417.db2.gz BVMBPPRWMOGEGY-UHFFFAOYSA-N -1 3 370.844 3.883 20 0 FHADHM CCN(Cc1ccc(Cl)cc1)C(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000821222132 607287109 /nfs/dbraw/zinc/28/71/09/607287109.db2.gz PGJNYEKHLUBMMG-UHFFFAOYSA-N -1 3 370.844 3.883 20 0 FHADHM CCN(Cc1ccc(Cl)cc1)C(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000821222132 607287110 /nfs/dbraw/zinc/28/71/10/607287110.db2.gz PGJNYEKHLUBMMG-UHFFFAOYSA-N -1 3 370.844 3.883 20 0 FHADHM Cc1c(NC(=O)N(C)[C@@H](C)c2ccc(F)c(F)c2)cccc1-c1nnn[n-]1 ZINC000822076010 607287357 /nfs/dbraw/zinc/28/73/57/607287357.db2.gz KWHTZIKURFRGSI-NSHDSACASA-N -1 3 372.379 3.678 20 0 FHADHM Cc1c(NC(=O)N(C)[C@@H](C)c2ccc(F)c(F)c2)cccc1-c1nn[n-]n1 ZINC000822076010 607287358 /nfs/dbraw/zinc/28/73/58/607287358.db2.gz KWHTZIKURFRGSI-NSHDSACASA-N -1 3 372.379 3.678 20 0 FHADHM Cc1c(NC(=O)N[C@H](CC2CC2)c2ccccc2)cccc1-c1nnn[n-]1 ZINC000822092155 607289989 /nfs/dbraw/zinc/28/99/89/607289989.db2.gz VKILCEQTBHQZCR-GOSISDBHSA-N -1 3 362.437 3.838 20 0 FHADHM Cc1c(NC(=O)N[C@H](CC2CC2)c2ccccc2)cccc1-c1nn[n-]n1 ZINC000822092155 607289990 /nfs/dbraw/zinc/28/99/90/607289990.db2.gz VKILCEQTBHQZCR-GOSISDBHSA-N -1 3 362.437 3.838 20 0 FHADHM Cc1ccc(Cl)c(O[C@@H](C)C(=O)Nc2cccc(-c3nnn[n-]3)c2C)c1 ZINC000822240143 607294442 /nfs/dbraw/zinc/29/44/42/607294442.db2.gz UIUIJKBOKBXAFM-LBPRGKRZSA-N -1 3 371.828 3.543 20 0 FHADHM Cc1ccc(Cl)c(O[C@@H](C)C(=O)Nc2cccc(-c3nn[n-]n3)c2C)c1 ZINC000822240143 607294443 /nfs/dbraw/zinc/29/44/43/607294443.db2.gz UIUIJKBOKBXAFM-LBPRGKRZSA-N -1 3 371.828 3.543 20 0 FHADHM CC[C@H](Oc1ccccc1Cl)C(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000820937651 607294709 /nfs/dbraw/zinc/29/47/09/607294709.db2.gz BESCZACVRMFBPP-HNNXBMFYSA-N -1 3 371.828 3.625 20 0 FHADHM CC[C@H](Oc1ccccc1Cl)C(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000820937651 607294710 /nfs/dbraw/zinc/29/47/10/607294710.db2.gz BESCZACVRMFBPP-HNNXBMFYSA-N -1 3 371.828 3.625 20 0 FHADHM CCSc1nnc(S[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)s1 ZINC000736667353 599285891 /nfs/dbraw/zinc/28/58/91/599285891.db2.gz OEEOLMOSPFLYPC-QMMMGPOBSA-N -1 3 350.498 3.684 20 0 FHADHM CCSc1nnc(S[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)s1 ZINC000736667353 599285893 /nfs/dbraw/zinc/28/58/93/599285893.db2.gz OEEOLMOSPFLYPC-QMMMGPOBSA-N -1 3 350.498 3.684 20 0 FHADHM CCC[C@@H](C)N(C)C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000821015292 599286714 /nfs/dbraw/zinc/28/67/14/599286714.db2.gz OORNFJWDPWMTBU-SECBINFHSA-N -1 3 356.352 3.538 20 0 FHADHM CCC[C@@H](C)N(C)C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000821015292 599286716 /nfs/dbraw/zinc/28/67/16/599286716.db2.gz OORNFJWDPWMTBU-SECBINFHSA-N -1 3 356.352 3.538 20 0 FHADHM O=C(NCC1CCCCC1)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000823175206 599287626 /nfs/dbraw/zinc/28/76/26/599287626.db2.gz BVWXUJCOPQCXED-UHFFFAOYSA-N -1 3 368.363 3.587 20 0 FHADHM O=C(NCC1CCCCC1)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000823175206 599287629 /nfs/dbraw/zinc/28/76/29/599287629.db2.gz BVWXUJCOPQCXED-UHFFFAOYSA-N -1 3 368.363 3.587 20 0 FHADHM CC(C)[C@@H]1CCCN1C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000820037816 599288235 /nfs/dbraw/zinc/28/82/35/599288235.db2.gz INZNHPZEXIZLGT-ZDUSSCGKSA-N -1 3 368.363 3.538 20 0 FHADHM CC(C)[C@@H]1CCCN1C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000820037816 599288237 /nfs/dbraw/zinc/28/82/37/599288237.db2.gz INZNHPZEXIZLGT-ZDUSSCGKSA-N -1 3 368.363 3.538 20 0 FHADHM COc1ccc(OCCS[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000737112670 599290091 /nfs/dbraw/zinc/29/00/91/599290091.db2.gz XOYWZXXGRNLXIM-ZDUSSCGKSA-N -1 3 356.451 3.749 20 0 FHADHM COc1ccc(OCCS[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000737112670 599290094 /nfs/dbraw/zinc/29/00/94/599290094.db2.gz XOYWZXXGRNLXIM-ZDUSSCGKSA-N -1 3 356.451 3.749 20 0 FHADHM CC(C)NC(=O)Nc1ccc([C@H](C)NCc2cccc(C(=O)[O-])c2)cc1 ZINC000820029876 598191977 /nfs/dbraw/zinc/19/19/77/598191977.db2.gz UZCDLEAMZNRODD-AWEZNQCLSA-N -1 3 355.438 3.766 20 0 FHADHM Cc1cccc(C(=O)Nc2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)n1 ZINC000737386606 598232117 /nfs/dbraw/zinc/23/21/17/598232117.db2.gz XWTUWGZZYAHPHF-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM CN(CCC1CCCCC1)C(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000736793289 598233213 /nfs/dbraw/zinc/23/32/13/598233213.db2.gz WCNDWQHRNQLZLT-UHFFFAOYSA-N -1 3 373.526 3.529 20 0 FHADHM CN(CCC1CCCCC1)C(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000736793289 598233215 /nfs/dbraw/zinc/23/32/15/598233215.db2.gz WCNDWQHRNQLZLT-UHFFFAOYSA-N -1 3 373.526 3.529 20 0 FHADHM O=C(N[C@@H](c1ccc(Cl)cc1)C1CCC1)c1cccc(-c2nnn[n-]2)c1 ZINC000737999377 598235430 /nfs/dbraw/zinc/23/54/30/598235430.db2.gz UHJTZZWHCGUINN-QGZVFWFLSA-N -1 3 367.840 3.791 20 0 FHADHM O=C(N[C@@H](c1ccc(Cl)cc1)C1CCC1)c1cccc(-c2nn[n-]n2)c1 ZINC000737999377 598235431 /nfs/dbraw/zinc/23/54/31/598235431.db2.gz UHJTZZWHCGUINN-QGZVFWFLSA-N -1 3 367.840 3.791 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1NCCc1ccc(N2CCCCC2)cc1 ZINC000737641869 598238440 /nfs/dbraw/zinc/23/84/40/598238440.db2.gz YTNWYGNADGRYLW-UHFFFAOYSA-N -1 3 366.444 3.651 20 0 FHADHM COCc1ccccc1CNc1ccc(C(F)(F)F)c(-c2nnn[n-]2)c1 ZINC000821696046 607346405 /nfs/dbraw/zinc/34/64/05/607346405.db2.gz TZRVLRLIGHCRQV-UHFFFAOYSA-N -1 3 363.343 3.644 20 0 FHADHM COCc1ccccc1CNc1ccc(C(F)(F)F)c(-c2nn[n-]n2)c1 ZINC000821696046 607346408 /nfs/dbraw/zinc/34/64/08/607346408.db2.gz TZRVLRLIGHCRQV-UHFFFAOYSA-N -1 3 363.343 3.644 20 0 FHADHM CN(CC1CC1)C(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736795830 598267198 /nfs/dbraw/zinc/26/71/98/598267198.db2.gz YWTVKCHFTUXBNT-UHFFFAOYSA-N -1 3 364.409 3.533 20 0 FHADHM CN(CC1CC1)C(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736795830 598267199 /nfs/dbraw/zinc/26/71/99/598267199.db2.gz YWTVKCHFTUXBNT-UHFFFAOYSA-N -1 3 364.409 3.533 20 0 FHADHM CCC[C@@H](C)NC(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736423238 598267370 /nfs/dbraw/zinc/26/73/70/598267370.db2.gz MPOWSKVLTXNBQE-CYBMUJFWSA-N -1 3 366.425 3.969 20 0 FHADHM CCC[C@@H](C)NC(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736423238 598267371 /nfs/dbraw/zinc/26/73/71/598267371.db2.gz MPOWSKVLTXNBQE-CYBMUJFWSA-N -1 3 366.425 3.969 20 0 FHADHM CCCCNC(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736460239 598267425 /nfs/dbraw/zinc/26/74/25/598267425.db2.gz FBZPTSPUVSMCRL-UHFFFAOYSA-N -1 3 352.398 3.581 20 0 FHADHM CCCCNC(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736460239 598267426 /nfs/dbraw/zinc/26/74/26/598267426.db2.gz FBZPTSPUVSMCRL-UHFFFAOYSA-N -1 3 352.398 3.581 20 0 FHADHM FC(F)(F)c1cc(N2CCC[C@@H](C(F)(F)F)C2)ccc1-c1nnn[n-]1 ZINC000737632871 598274023 /nfs/dbraw/zinc/27/40/23/598274023.db2.gz NVPNGXGWSCKGKK-MRVPVSSYSA-N -1 3 365.281 3.664 20 0 FHADHM FC(F)(F)c1cc(N2CCC[C@@H](C(F)(F)F)C2)ccc1-c1nn[n-]n1 ZINC000737632871 598274024 /nfs/dbraw/zinc/27/40/24/598274024.db2.gz NVPNGXGWSCKGKK-MRVPVSSYSA-N -1 3 365.281 3.664 20 0 FHADHM Cc1ccccc1N(C(=O)CSc1ccc(-c2nnn[n-]2)cc1)C(C)C ZINC000737427863 598297649 /nfs/dbraw/zinc/29/76/49/598297649.db2.gz HKXTYEQJGFQHBI-UHFFFAOYSA-N -1 3 367.478 3.709 20 0 FHADHM Cc1ccccc1N(C(=O)CSc1ccc(-c2nn[n-]n2)cc1)C(C)C ZINC000737427863 598297651 /nfs/dbraw/zinc/29/76/51/598297651.db2.gz HKXTYEQJGFQHBI-UHFFFAOYSA-N -1 3 367.478 3.709 20 0 FHADHM CN(C(=O)c1ccc(Cl)cc1Cl)c1ccc(-c2nnn[n-]2)cc1F ZINC000736741957 598311891 /nfs/dbraw/zinc/31/18/91/598311891.db2.gz JOEOQGRNTCJZSY-UHFFFAOYSA-N -1 3 366.183 3.589 20 0 FHADHM CN(C(=O)c1ccc(Cl)cc1Cl)c1ccc(-c2nn[n-]n2)cc1F ZINC000736741957 598311893 /nfs/dbraw/zinc/31/18/93/598311893.db2.gz JOEOQGRNTCJZSY-UHFFFAOYSA-N -1 3 366.183 3.589 20 0 FHADHM COc1ccc(C)cc1NC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000737078235 598316895 /nfs/dbraw/zinc/31/68/95/598316895.db2.gz WYXYUEQRJSYLGP-UHFFFAOYSA-N -1 3 374.857 3.646 20 0 FHADHM COc1ccc(C)cc1NC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000737078235 598316897 /nfs/dbraw/zinc/31/68/97/598316897.db2.gz WYXYUEQRJSYLGP-UHFFFAOYSA-N -1 3 374.857 3.646 20 0 FHADHM Cc1ccc(NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1F ZINC000737360549 598317458 /nfs/dbraw/zinc/31/74/58/598317458.db2.gz QFGIPKBTRIWLSO-UHFFFAOYSA-N -1 3 362.821 3.777 20 0 FHADHM Cc1ccc(NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1F ZINC000737360549 598317460 /nfs/dbraw/zinc/31/74/60/598317460.db2.gz QFGIPKBTRIWLSO-UHFFFAOYSA-N -1 3 362.821 3.777 20 0 FHADHM Cc1ccccc1CN(C)C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000737428179 598317681 /nfs/dbraw/zinc/31/76/81/598317681.db2.gz MCIUAYTULMKDDC-UHFFFAOYSA-N -1 3 372.885 3.657 20 0 FHADHM Cc1ccccc1CN(C)C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000737428179 598317682 /nfs/dbraw/zinc/31/76/82/598317682.db2.gz MCIUAYTULMKDDC-UHFFFAOYSA-N -1 3 372.885 3.657 20 0 FHADHM C[C@H]1CCC[C@H](CNC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)C1 ZINC000736248535 598322216 /nfs/dbraw/zinc/32/22/16/598322216.db2.gz JCFNOJBGZIZNPL-QWRGUYRKSA-N -1 3 364.906 3.633 20 0 FHADHM C[C@H]1CCC[C@H](CNC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)C1 ZINC000736248535 598322218 /nfs/dbraw/zinc/32/22/18/598322218.db2.gz JCFNOJBGZIZNPL-QWRGUYRKSA-N -1 3 364.906 3.633 20 0 FHADHM CCCCC1CCC(NC(=O)NCc2ccc(-c3nnn[n-]3)cc2F)CC1 ZINC000736442631 598325662 /nfs/dbraw/zinc/32/56/62/598325662.db2.gz XVRKCBZDAOGYNN-UHFFFAOYSA-N -1 3 374.464 3.554 20 0 FHADHM CCCCC1CCC(NC(=O)NCc2ccc(-c3nn[n-]n3)cc2F)CC1 ZINC000736442631 598325664 /nfs/dbraw/zinc/32/56/64/598325664.db2.gz XVRKCBZDAOGYNN-UHFFFAOYSA-N -1 3 374.464 3.554 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1ccc(F)cc1Cl ZINC000737194193 598331534 /nfs/dbraw/zinc/33/15/34/598331534.db2.gz DDJSHMZDJAJBHZ-DHHDDZJSSA-N -1 3 372.787 3.977 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1ccc(F)cc1Cl ZINC000737194193 598331536 /nfs/dbraw/zinc/33/15/36/598331536.db2.gz DDJSHMZDJAJBHZ-DHHDDZJSSA-N -1 3 372.787 3.977 20 0 FHADHM Cc1oc(-c2ccsc2)nc1CSc1cc(-c2nnn[n-]2)ccn1 ZINC000737547546 598363403 /nfs/dbraw/zinc/36/34/03/598363403.db2.gz KMZAHNOKMCQNRW-UHFFFAOYSA-N -1 3 356.436 3.579 20 0 FHADHM Cc1oc(-c2ccsc2)nc1CSc1cc(-c2nn[n-]n2)ccn1 ZINC000737547546 598363404 /nfs/dbraw/zinc/36/34/04/598363404.db2.gz KMZAHNOKMCQNRW-UHFFFAOYSA-N -1 3 356.436 3.579 20 0 FHADHM C[C@H](NC(=O)Nc1ccc(-c2nnn[n-]2)cc1)c1csc2ccccc21 ZINC000736116830 598369389 /nfs/dbraw/zinc/36/93/89/598369389.db2.gz NQYYCNWUROLIMN-NSHDSACASA-N -1 3 364.434 3.964 20 0 FHADHM C[C@H](NC(=O)Nc1ccc(-c2nn[n-]n2)cc1)c1csc2ccccc21 ZINC000736116830 598369390 /nfs/dbraw/zinc/36/93/90/598369390.db2.gz NQYYCNWUROLIMN-NSHDSACASA-N -1 3 364.434 3.964 20 0 FHADHM Cc1ccccc1Oc1ccccc1CNc1ccc(-c2nnn[n-]2)cn1 ZINC000737431308 598386386 /nfs/dbraw/zinc/38/63/86/598386386.db2.gz HKFNOWPFFUPKKR-UHFFFAOYSA-N -1 3 358.405 3.975 20 0 FHADHM Cc1ccccc1Oc1ccccc1CNc1ccc(-c2nn[n-]n2)cn1 ZINC000737431308 598386388 /nfs/dbraw/zinc/38/63/88/598386388.db2.gz HKFNOWPFFUPKKR-UHFFFAOYSA-N -1 3 358.405 3.975 20 0 FHADHM COc1ccc2ccccc2c1CNc1ncc(-c2nnn[n-]2)cc1Cl ZINC000737121471 598388048 /nfs/dbraw/zinc/38/80/48/598388048.db2.gz ZRMPPNLOECGFPI-UHFFFAOYSA-N -1 3 366.812 3.689 20 0 FHADHM COc1ccc2ccccc2c1CNc1ncc(-c2nn[n-]n2)cc1Cl ZINC000737121471 598388049 /nfs/dbraw/zinc/38/80/49/598388049.db2.gz ZRMPPNLOECGFPI-UHFFFAOYSA-N -1 3 366.812 3.689 20 0 FHADHM Cc1ccsc1-c1nnc(SCc2cc(-c3nnn[n-]3)ccc2F)o1 ZINC000737442801 598394340 /nfs/dbraw/zinc/39/43/40/598394340.db2.gz QIALCSPZUJPXDX-UHFFFAOYSA-N -1 3 374.426 3.718 20 0 FHADHM Cc1ccsc1-c1nnc(SCc2cc(-c3nn[n-]n3)ccc2F)o1 ZINC000737442801 598394341 /nfs/dbraw/zinc/39/43/41/598394341.db2.gz QIALCSPZUJPXDX-UHFFFAOYSA-N -1 3 374.426 3.718 20 0 FHADHM O=C(CC1=CCCCC1)N(Cc1ccco1)c1ccccc1-c1nnn[n-]1 ZINC000737807145 598396838 /nfs/dbraw/zinc/39/68/38/598396838.db2.gz LFSZPLLHDQWDEN-UHFFFAOYSA-N -1 3 363.421 3.883 20 0 FHADHM O=C(CC1=CCCCC1)N(Cc1ccco1)c1ccccc1-c1nn[n-]n1 ZINC000737807145 598396839 /nfs/dbraw/zinc/39/68/39/598396839.db2.gz LFSZPLLHDQWDEN-UHFFFAOYSA-N -1 3 363.421 3.883 20 0 FHADHM Clc1ccc(Nc2nc(-c3ccc(-c4nnn[n-]4)cc3)cs2)cn1 ZINC000737576192 598397574 /nfs/dbraw/zinc/39/75/74/598397574.db2.gz YCFQAHRPOIALEP-UHFFFAOYSA-N -1 3 355.814 3.782 20 0 FHADHM Clc1ccc(Nc2nc(-c3ccc(-c4nn[n-]n4)cc3)cs2)cn1 ZINC000737576192 598397575 /nfs/dbraw/zinc/39/75/75/598397575.db2.gz YCFQAHRPOIALEP-UHFFFAOYSA-N -1 3 355.814 3.782 20 0 FHADHM COc1ccccc1-c1nc(CNc2ccc(-c3nn[n-]n3)cc2)cs1 ZINC000737142635 598415776 /nfs/dbraw/zinc/41/57/76/598415776.db2.gz LLFNXFIEFALFPN-UHFFFAOYSA-N -1 3 364.434 3.611 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)[C@@H]1CCCc2sccc21 ZINC000823314843 607354595 /nfs/dbraw/zinc/35/45/95/607354595.db2.gz SIAYNVZEUSMOTG-LLVKDONJSA-N -1 3 359.842 3.640 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)[C@@H]1CCCc2sccc21 ZINC000823314843 607354597 /nfs/dbraw/zinc/35/45/97/607354597.db2.gz SIAYNVZEUSMOTG-LLVKDONJSA-N -1 3 359.842 3.640 20 0 FHADHM Cc1cc(C)cc([C@H](C)NC(=O)N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737253958 598430407 /nfs/dbraw/zinc/43/04/07/598430407.db2.gz VKOQRFVRHLUPPZ-GJZGRUSLSA-N -1 3 364.453 3.605 20 0 FHADHM Cc1cc(C)cc([C@H](C)NC(=O)N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737253958 598430409 /nfs/dbraw/zinc/43/04/09/598430409.db2.gz VKOQRFVRHLUPPZ-GJZGRUSLSA-N -1 3 364.453 3.605 20 0 FHADHM O=C(Oc1ccc(-c2nnn[n-]2)cc1)C1(c2cccc(C(F)(F)F)c2)CC1 ZINC000738252038 598441547 /nfs/dbraw/zinc/44/15/47/598441547.db2.gz VPHWSHMNVIOVPC-UHFFFAOYSA-N -1 3 374.322 3.523 20 0 FHADHM O=C(Oc1ccc(-c2nn[n-]n2)cc1)C1(c2cccc(C(F)(F)F)c2)CC1 ZINC000738252038 598441548 /nfs/dbraw/zinc/44/15/48/598441548.db2.gz VPHWSHMNVIOVPC-UHFFFAOYSA-N -1 3 374.322 3.523 20 0 FHADHM COc1ccccc1C(C)=CC(=O)Nc1sc(C)c(C)c1-c1nnn[n-]1 ZINC000737141125 598441963 /nfs/dbraw/zinc/44/19/63/598441963.db2.gz HCCRLKATXOSIQH-MDZDMXLPSA-N -1 3 369.450 3.596 20 0 FHADHM COc1ccccc1C(C)=CC(=O)Nc1sc(C)c(C)c1-c1nn[n-]n1 ZINC000737141125 598441965 /nfs/dbraw/zinc/44/19/65/598441965.db2.gz HCCRLKATXOSIQH-MDZDMXLPSA-N -1 3 369.450 3.596 20 0 FHADHM CC(C)Oc1ccc(F)cc1NCCCOc1ccc(-c2nn[n-]n2)cc1 ZINC000735913403 598459829 /nfs/dbraw/zinc/45/98/29/598459829.db2.gz CEUDQPAJHJNVBN-UHFFFAOYSA-N -1 3 371.416 3.674 20 0 FHADHM c1ccc([C@H]2CCCN(c3nc4c(cc3-c3nnn[n-]3)CCC4)CC2)cc1 ZINC000738429303 598460227 /nfs/dbraw/zinc/46/02/27/598460227.db2.gz WUGMSGRHICFEPT-INIZCTEOSA-N -1 3 360.465 3.525 20 0 FHADHM c1ccc([C@H]2CCCN(c3nc4c(cc3-c3nn[n-]n3)CCC4)CC2)cc1 ZINC000738429303 598460228 /nfs/dbraw/zinc/46/02/28/598460228.db2.gz WUGMSGRHICFEPT-INIZCTEOSA-N -1 3 360.465 3.525 20 0 FHADHM C[C@@H](Cc1nc(-c2ccc(-c3nnn[n-]3)cc2)cs1)n1cc(Cl)cn1 ZINC000736065323 598464333 /nfs/dbraw/zinc/46/43/33/598464333.db2.gz CLKBBLOBTYKFGZ-JTQLQIEISA-N -1 3 371.857 3.644 20 0 FHADHM C[C@@H](Cc1nc(-c2ccc(-c3nn[n-]n3)cc2)cs1)n1cc(Cl)cn1 ZINC000736065323 598464334 /nfs/dbraw/zinc/46/43/34/598464334.db2.gz CLKBBLOBTYKFGZ-JTQLQIEISA-N -1 3 371.857 3.644 20 0 FHADHM Fc1cc(-c2nnn[n-]2)cc(F)c1NCCCc1c[nH]c2ccccc12 ZINC000737640357 598467998 /nfs/dbraw/zinc/46/79/98/598467998.db2.gz VLNCQMVMFDDYOK-UHFFFAOYSA-N -1 3 354.364 3.671 20 0 FHADHM Fc1cc(-c2nn[n-]n2)cc(F)c1NCCCc1c[nH]c2ccccc12 ZINC000737640357 598467999 /nfs/dbraw/zinc/46/79/99/598467999.db2.gz VLNCQMVMFDDYOK-UHFFFAOYSA-N -1 3 354.364 3.671 20 0 FHADHM CCc1cccc(NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)c1 ZINC000736697438 598474640 /nfs/dbraw/zinc/47/46/40/598474640.db2.gz FCCMHKQVHACDHJ-UHFFFAOYSA-N -1 3 362.437 3.626 20 0 FHADHM CCc1cccc(NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)c1 ZINC000736697438 598474642 /nfs/dbraw/zinc/47/46/42/598474642.db2.gz FCCMHKQVHACDHJ-UHFFFAOYSA-N -1 3 362.437 3.626 20 0 FHADHM Cc1cc(C)cc(NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)c1 ZINC000737251579 598475343 /nfs/dbraw/zinc/47/53/43/598475343.db2.gz UFHJLJCPTMEHTD-UHFFFAOYSA-N -1 3 362.437 3.680 20 0 FHADHM Cc1cc(C)cc(NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)c1 ZINC000737251579 598475345 /nfs/dbraw/zinc/47/53/45/598475345.db2.gz UFHJLJCPTMEHTD-UHFFFAOYSA-N -1 3 362.437 3.680 20 0 FHADHM O=C(NCCC1CCCCC1)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000738054235 598478590 /nfs/dbraw/zinc/47/85/90/598478590.db2.gz DBIDKWIWNAMLJW-UHFFFAOYSA-N -1 3 368.485 3.511 20 0 FHADHM O=C(NCCC1CCCCC1)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000738054235 598478591 /nfs/dbraw/zinc/47/85/91/598478591.db2.gz DBIDKWIWNAMLJW-UHFFFAOYSA-N -1 3 368.485 3.511 20 0 FHADHM CCOc1ccc(CCC(=O)O[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736643349 598481291 /nfs/dbraw/zinc/48/12/91/598481291.db2.gz IAPUTFKTNOCKLA-AWEZNQCLSA-N -1 3 366.421 3.502 20 0 FHADHM CCOc1ccc(CCC(=O)O[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736643349 598481293 /nfs/dbraw/zinc/48/12/93/598481293.db2.gz IAPUTFKTNOCKLA-AWEZNQCLSA-N -1 3 366.421 3.502 20 0 FHADHM C[C@H](CC(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(F)cc1 ZINC000735977449 598482177 /nfs/dbraw/zinc/48/21/77/598482177.db2.gz OPYBIAVHPMZQDV-CHWSQXEVSA-N -1 3 354.385 3.804 20 0 FHADHM C[C@H](CC(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(F)cc1 ZINC000735977449 598482178 /nfs/dbraw/zinc/48/21/78/598482178.db2.gz OPYBIAVHPMZQDV-CHWSQXEVSA-N -1 3 354.385 3.804 20 0 FHADHM C[C@H](CC(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1F ZINC000735975448 598482312 /nfs/dbraw/zinc/48/23/12/598482312.db2.gz GUBXPDAFBTUVJC-OLZOCXBDSA-N -1 3 354.385 3.804 20 0 FHADHM C[C@H](CC(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1F ZINC000735975448 598482314 /nfs/dbraw/zinc/48/23/14/598482314.db2.gz GUBXPDAFBTUVJC-OLZOCXBDSA-N -1 3 354.385 3.804 20 0 FHADHM COc1ccc(CCCC(=O)O[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000737089164 598484626 /nfs/dbraw/zinc/48/46/26/598484626.db2.gz QHCOSQXRZABWPX-AWEZNQCLSA-N -1 3 366.421 3.502 20 0 FHADHM COc1ccc(CCCC(=O)O[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000737089164 598484627 /nfs/dbraw/zinc/48/46/27/598484627.db2.gz QHCOSQXRZABWPX-AWEZNQCLSA-N -1 3 366.421 3.502 20 0 FHADHM CC(C)OCc1ccc(C(=O)O[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000735903045 598485319 /nfs/dbraw/zinc/48/53/19/598485319.db2.gz CWFQYUNNYGPZFR-CQSZACIVSA-N -1 3 366.421 3.710 20 0 FHADHM CC(C)OCc1ccc(C(=O)O[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000735903045 598485321 /nfs/dbraw/zinc/48/53/21/598485321.db2.gz CWFQYUNNYGPZFR-CQSZACIVSA-N -1 3 366.421 3.710 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)c1cccc(C(F)F)c1 ZINC000735662168 598488422 /nfs/dbraw/zinc/48/84/22/598488422.db2.gz SAQOIHMAWSUTLK-UHFFFAOYSA-N -1 3 360.368 3.613 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)c1cccc(C(F)F)c1 ZINC000735662168 598488424 /nfs/dbraw/zinc/48/84/24/598488424.db2.gz SAQOIHMAWSUTLK-UHFFFAOYSA-N -1 3 360.368 3.613 20 0 FHADHM COc1cccc2cc(C(=O)O[C@H](C)c3cccc(-c4nnn[n-]4)c3)oc21 ZINC000737141389 598488496 /nfs/dbraw/zinc/48/84/96/598488496.db2.gz CQMYVWQASATUTO-LLVKDONJSA-N -1 3 364.361 3.540 20 0 FHADHM COc1cccc2cc(C(=O)O[C@H](C)c3cccc(-c4nn[n-]n4)c3)oc21 ZINC000737141389 598488498 /nfs/dbraw/zinc/48/84/98/598488498.db2.gz CQMYVWQASATUTO-LLVKDONJSA-N -1 3 364.361 3.540 20 0 FHADHM O=[S@](Cc1cccc(-c2nnn[n-]2)c1)Cc1c(Cl)cccc1Cl ZINC000738356947 598493085 /nfs/dbraw/zinc/49/30/85/598493085.db2.gz MSWKIEBZHQMLSX-HSZRJFAPSA-N -1 3 367.261 3.622 20 0 FHADHM O=[S@](Cc1cccc(-c2nn[n-]n2)c1)Cc1c(Cl)cccc1Cl ZINC000738356947 598493088 /nfs/dbraw/zinc/49/30/88/598493088.db2.gz MSWKIEBZHQMLSX-HSZRJFAPSA-N -1 3 367.261 3.622 20 0 FHADHM CCN(C(=O)Cc1cccc(Cl)c1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736504452 598494676 /nfs/dbraw/zinc/49/46/76/598494676.db2.gz DKRHSMOPKDJZKP-CYBMUJFWSA-N -1 3 369.856 3.672 20 0 FHADHM CCN(C(=O)Cc1cccc(Cl)c1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736504452 598494677 /nfs/dbraw/zinc/49/46/77/598494677.db2.gz DKRHSMOPKDJZKP-CYBMUJFWSA-N -1 3 369.856 3.672 20 0 FHADHM CC(C)(C)[C@H](Cc1ccccc1)OC(=O)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000735590383 598510458 /nfs/dbraw/zinc/51/04/58/598510458.db2.gz YBMCSTTXAYCKHD-SFHVURJKSA-N -1 3 364.449 3.610 20 0 FHADHM CC(C)(C)[C@H](Cc1ccccc1)OC(=O)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000735590383 598510460 /nfs/dbraw/zinc/51/04/60/598510460.db2.gz YBMCSTTXAYCKHD-SFHVURJKSA-N -1 3 364.449 3.610 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cncc3ccccc32)c1-c1nnn[n-]1 ZINC000736675753 598515955 /nfs/dbraw/zinc/51/59/55/598515955.db2.gz LVKVJQBXHMJZRR-UHFFFAOYSA-N -1 3 364.434 3.600 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cncc3ccccc32)c1-c1nn[n-]n1 ZINC000736675753 598515957 /nfs/dbraw/zinc/51/59/57/598515957.db2.gz LVKVJQBXHMJZRR-UHFFFAOYSA-N -1 3 364.434 3.600 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H]2C[C@H]2c2ccc(F)cc2)c1-c1nnn[n-]1 ZINC000736670804 598517093 /nfs/dbraw/zinc/51/70/93/598517093.db2.gz SHEHMMSNJBCALZ-KBPBESRZSA-N -1 3 371.441 3.680 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H]2C[C@H]2c2ccc(F)cc2)c1-c1nn[n-]n1 ZINC000736670804 598517095 /nfs/dbraw/zinc/51/70/95/598517095.db2.gz SHEHMMSNJBCALZ-KBPBESRZSA-N -1 3 371.441 3.680 20 0 FHADHM CCc1c(C)sc(NC(=O)C=Cc2ccccc2F)c1-c1nnn[n-]1 ZINC000736669360 598518767 /nfs/dbraw/zinc/51/87/67/598518767.db2.gz FUQYXLIRKDQGTM-CMDGGOBGSA-N -1 3 357.414 3.590 20 0 FHADHM CCc1c(C)sc(NC(=O)C=Cc2ccccc2F)c1-c1nn[n-]n1 ZINC000736669360 598518769 /nfs/dbraw/zinc/51/87/69/598518769.db2.gz FUQYXLIRKDQGTM-CMDGGOBGSA-N -1 3 357.414 3.590 20 0 FHADHM Brc1cccc2c1CC[C@H]2Nc1ccc(-c2nn[n-]n2)cc1 ZINC000735369800 598522266 /nfs/dbraw/zinc/52/22/66/598522266.db2.gz WXILMBJGKIMQBZ-OAHLLOKOSA-N -1 3 356.227 3.729 20 0 FHADHM CCCC[C@@H]1CCC[C@@H]1NC(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736442276 598528441 /nfs/dbraw/zinc/52/84/41/598528441.db2.gz WDYXBRAXRRWGPY-UNEWFSDZSA-N -1 3 356.474 3.586 20 0 FHADHM CCCC[C@@H]1CCC[C@@H]1NC(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736442276 598528443 /nfs/dbraw/zinc/52/84/43/598528443.db2.gz WDYXBRAXRRWGPY-UNEWFSDZSA-N -1 3 356.474 3.586 20 0 FHADHM O=C(C=CSc1ccccc1)Nc1sc2c(c1-c1nn[n-]n1)CCC2 ZINC000737793885 598536664 /nfs/dbraw/zinc/53/66/64/598536664.db2.gz AAPKWGUHFCGFKA-KTKRTIGZSA-N -1 3 369.475 3.661 20 0 FHADHM O=C(/C=C\Sc1ccccc1)Nc1sc2c(c1-c1nn[n-]n1)CCC2 ZINC000737793885 598536665 /nfs/dbraw/zinc/53/66/65/598536665.db2.gz AAPKWGUHFCGFKA-KTKRTIGZSA-N -1 3 369.475 3.661 20 0 FHADHM CCCC(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)c(Cl)c1 ZINC000736416461 598541428 /nfs/dbraw/zinc/54/14/28/598541428.db2.gz NWRQEHPGYORRSI-UHFFFAOYSA-N -1 3 371.828 3.838 20 0 FHADHM CCCC(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)c(Cl)c1 ZINC000736416461 598541431 /nfs/dbraw/zinc/54/14/31/598541431.db2.gz NWRQEHPGYORRSI-UHFFFAOYSA-N -1 3 371.828 3.838 20 0 FHADHM O=C(OCc1ccccc1-c1nnn[n-]1)[C@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000738235792 598544627 /nfs/dbraw/zinc/54/46/27/598544627.db2.gz WUTQCYHBPNAUDD-PMACEKPBSA-N -1 3 370.412 3.867 20 0 FHADHM O=C(OCc1ccccc1-c1nn[n-]n1)[C@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000738235792 598544629 /nfs/dbraw/zinc/54/46/29/598544629.db2.gz WUTQCYHBPNAUDD-PMACEKPBSA-N -1 3 370.412 3.867 20 0 FHADHM CC(C)c1ccc(C(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(F)F)cc1 ZINC000735921966 598546604 /nfs/dbraw/zinc/54/66/04/598546604.db2.gz BQLWLHSGQXMXJN-UHFFFAOYSA-N -1 3 373.363 3.844 20 0 FHADHM CC(C)c1ccc(C(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(F)F)cc1 ZINC000735921966 598546605 /nfs/dbraw/zinc/54/66/05/598546605.db2.gz BQLWLHSGQXMXJN-UHFFFAOYSA-N -1 3 373.363 3.844 20 0 FHADHM Fc1cc(OCc2cc(-c3ccc(Cl)cc3)no2)ccc1-c1nnn[n-]1 ZINC000737654024 598548172 /nfs/dbraw/zinc/54/81/72/598548172.db2.gz WCYANNATJBZYFJ-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM Fc1cc(OCc2cc(-c3ccc(Cl)cc3)no2)ccc1-c1nn[n-]n1 ZINC000737654024 598548173 /nfs/dbraw/zinc/54/81/73/598548173.db2.gz WCYANNATJBZYFJ-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM Cc1ccc(-c2cc(COc3ccc(-c4nnn[n-]4)c(F)c3)on2)cc1 ZINC000737290243 598548966 /nfs/dbraw/zinc/54/89/66/598548966.db2.gz YRXDVMVJBMFHJZ-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM Cc1ccc(-c2cc(COc3ccc(-c4nn[n-]n4)c(F)c3)on2)cc1 ZINC000737290243 598548968 /nfs/dbraw/zinc/54/89/68/598548968.db2.gz YRXDVMVJBMFHJZ-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM CC(C)COc1ccccc1C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000735845275 598551482 /nfs/dbraw/zinc/55/14/82/598551482.db2.gz VBVSSSRGETYMQP-UHFFFAOYSA-N -1 3 371.828 3.807 20 0 FHADHM CC(C)COc1ccccc1C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000735845275 598551483 /nfs/dbraw/zinc/55/14/83/598551483.db2.gz VBVSSSRGETYMQP-UHFFFAOYSA-N -1 3 371.828 3.807 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1)[C@H]1CC=CCC1 ZINC000738173815 598556178 /nfs/dbraw/zinc/55/61/78/598556178.db2.gz SESBZDHEMBLKQR-AWEZNQCLSA-N -1 3 361.405 3.954 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1)[C@H]1CC=CCC1 ZINC000738173815 598556179 /nfs/dbraw/zinc/55/61/79/598556179.db2.gz SESBZDHEMBLKQR-AWEZNQCLSA-N -1 3 361.405 3.954 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1)N1CCCCC1 ZINC000738171101 598562609 /nfs/dbraw/zinc/56/26/09/598562609.db2.gz ATIRLSMXFPLCEE-UHFFFAOYSA-N -1 3 364.409 3.677 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1)N1CCCCC1 ZINC000738171101 598562612 /nfs/dbraw/zinc/56/26/12/598562612.db2.gz ATIRLSMXFPLCEE-UHFFFAOYSA-N -1 3 364.409 3.677 20 0 FHADHM C[C@H](NC(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1)C1CC1 ZINC000736115275 598563395 /nfs/dbraw/zinc/56/33/95/598563395.db2.gz GURUIFCQKRQKBH-LBPRGKRZSA-N -1 3 364.409 3.579 20 0 FHADHM C[C@H](NC(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1)C1CC1 ZINC000736115275 598563397 /nfs/dbraw/zinc/56/33/97/598563397.db2.gz GURUIFCQKRQKBH-LBPRGKRZSA-N -1 3 364.409 3.579 20 0 FHADHM C[C@@H](Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)c1nc2ccccc2[nH]1 ZINC000736139940 598577237 /nfs/dbraw/zinc/57/72/37/598577237.db2.gz SBMGFYZOSVFCAK-SECBINFHSA-N -1 3 373.342 3.935 20 0 FHADHM C[C@@H](Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)c1nc2ccccc2[nH]1 ZINC000736139940 598577239 /nfs/dbraw/zinc/57/72/39/598577239.db2.gz SBMGFYZOSVFCAK-SECBINFHSA-N -1 3 373.342 3.935 20 0 FHADHM Cc1nc([C@@H](C)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)cs1 ZINC000737469877 598580130 /nfs/dbraw/zinc/58/01/30/598580130.db2.gz DGEFFDKRHRFJIA-SSDOTTSWSA-N -1 3 354.361 3.824 20 0 FHADHM Cc1nc([C@@H](C)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)cs1 ZINC000737469877 598580132 /nfs/dbraw/zinc/58/01/32/598580132.db2.gz DGEFFDKRHRFJIA-SSDOTTSWSA-N -1 3 354.361 3.824 20 0 FHADHM Fc1ccccc1-c1nc(COc2ccc(-c3nn[n-]n3)cc2)cs1 ZINC000737663087 598580972 /nfs/dbraw/zinc/58/09/72/598580972.db2.gz FSOYANNGIAUSOK-UHFFFAOYSA-N -1 3 353.382 3.708 20 0 FHADHM C[C@H](OC(=O)[C@H]1C[C@@H]1c1ccc(F)c(F)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000736149486 598582483 /nfs/dbraw/zinc/58/24/83/598582483.db2.gz GNOLEDMSDQVLIZ-VQISRLSMSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@H]1C[C@@H]1c1ccc(F)c(F)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000736149486 598582485 /nfs/dbraw/zinc/58/24/85/598582485.db2.gz GNOLEDMSDQVLIZ-VQISRLSMSA-N -1 3 370.359 3.553 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccc2c(c1)Cc1ccccc1-2 ZINC000738165310 598586864 /nfs/dbraw/zinc/58/68/64/598586864.db2.gz BRDUIOGPGVTVIO-UHFFFAOYSA-N -1 3 371.375 3.829 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccc2c(c1)Cc1ccccc1-2 ZINC000738165310 598586866 /nfs/dbraw/zinc/58/68/66/598586866.db2.gz BRDUIOGPGVTVIO-UHFFFAOYSA-N -1 3 371.375 3.829 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)c1cc2ccc(F)cc2s1 ZINC000738167297 598589900 /nfs/dbraw/zinc/58/99/00/598589900.db2.gz QSSWZJWNCAITOC-UHFFFAOYSA-N -1 3 357.345 3.612 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)c1cc2ccc(F)cc2s1 ZINC000738167297 598589901 /nfs/dbraw/zinc/58/99/01/598589901.db2.gz QSSWZJWNCAITOC-UHFFFAOYSA-N -1 3 357.345 3.612 20 0 FHADHM CSc1ccc(Cl)c(C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)c1 ZINC000737190453 598591902 /nfs/dbraw/zinc/59/19/02/598591902.db2.gz MIVVLODTUFHDCP-UHFFFAOYSA-N -1 3 363.805 3.633 20 0 FHADHM CSc1ccc(Cl)c(C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)c1 ZINC000737190453 598591904 /nfs/dbraw/zinc/59/19/04/598591904.db2.gz MIVVLODTUFHDCP-UHFFFAOYSA-N -1 3 363.805 3.633 20 0 FHADHM Cc1nc(-c2ccccn2)nc(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1C ZINC000737464699 598592640 /nfs/dbraw/zinc/59/26/40/598592640.db2.gz VLGLRXPKRPFQGO-CQSZACIVSA-N -1 3 372.436 3.509 20 0 FHADHM Cc1nc(-c2ccccn2)nc(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1C ZINC000737464699 598592642 /nfs/dbraw/zinc/59/26/42/598592642.db2.gz VLGLRXPKRPFQGO-CQSZACIVSA-N -1 3 372.436 3.509 20 0 FHADHM CCC[C@H](NC(=O)CCc1ccc(-c2nnn[n-]2)cc1)C1CCCCC1 ZINC000736429866 598593394 /nfs/dbraw/zinc/59/33/94/598593394.db2.gz HGTSCGYUGRKSOL-SFHVURJKSA-N -1 3 355.486 3.665 20 0 FHADHM CCC[C@H](NC(=O)CCc1ccc(-c2nn[n-]n2)cc1)C1CCCCC1 ZINC000736429866 598593395 /nfs/dbraw/zinc/59/33/95/598593395.db2.gz HGTSCGYUGRKSOL-SFHVURJKSA-N -1 3 355.486 3.665 20 0 FHADHM CC[C@@H](C)c1ccc(NC(=O)CNc2ccc(F)c(-c3nnn[n-]3)c2)cc1 ZINC000736329646 598603228 /nfs/dbraw/zinc/60/32/28/598603228.db2.gz UKVMXYKAEAELIY-GFCCVEGCSA-N -1 3 368.416 3.570 20 0 FHADHM CC[C@@H](C)c1ccc(NC(=O)CNc2ccc(F)c(-c3nn[n-]n3)c2)cc1 ZINC000736329646 598603229 /nfs/dbraw/zinc/60/32/29/598603229.db2.gz UKVMXYKAEAELIY-GFCCVEGCSA-N -1 3 368.416 3.570 20 0 FHADHM Fc1ccc(NCc2ccc(Br)cc2F)cc1-c1nnn[n-]1 ZINC000737643134 598603525 /nfs/dbraw/zinc/60/35/25/598603525.db2.gz BHMSGPUJSVHXMF-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1ccc(NCc2ccc(Br)cc2F)cc1-c1nn[n-]n1 ZINC000737643134 598603526 /nfs/dbraw/zinc/60/35/26/598603526.db2.gz BHMSGPUJSVHXMF-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM C[C@H](OC(=O)c1cccc(-c2nnn[n-]2)c1)c1ccc(C(F)(F)F)cc1 ZINC000736161047 598618612 /nfs/dbraw/zinc/61/86/12/598618612.db2.gz BNWXBRBJKYSOFQ-JTQLQIEISA-N -1 3 362.311 3.804 20 0 FHADHM C[C@H](OC(=O)c1cccc(-c2nn[n-]n2)c1)c1ccc(C(F)(F)F)cc1 ZINC000736161047 598618614 /nfs/dbraw/zinc/61/86/14/598618614.db2.gz BNWXBRBJKYSOFQ-JTQLQIEISA-N -1 3 362.311 3.804 20 0 FHADHM CCC[C@H](Cc1ccccc1)NC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000736426007 598626085 /nfs/dbraw/zinc/62/60/85/598626085.db2.gz MWNTZZHLCTXDJR-CQSZACIVSA-N -1 3 368.416 3.539 20 0 FHADHM CCC[C@H](Cc1ccccc1)NC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000736426007 598626086 /nfs/dbraw/zinc/62/60/86/598626086.db2.gz MWNTZZHLCTXDJR-CQSZACIVSA-N -1 3 368.416 3.539 20 0 FHADHM CC(C)N(Cc1cccc(F)c1)C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000735873598 598627604 /nfs/dbraw/zinc/62/76/04/598627604.db2.gz HVTUOAYOFDQBLY-UHFFFAOYSA-N -1 3 372.379 3.587 20 0 FHADHM CC(C)N(Cc1cccc(F)c1)C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000735873598 598627606 /nfs/dbraw/zinc/62/76/06/598627606.db2.gz HVTUOAYOFDQBLY-UHFFFAOYSA-N -1 3 372.379 3.587 20 0 FHADHM CC[C@H](NC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccc(Cl)cc1 ZINC000736363217 598630650 /nfs/dbraw/zinc/63/06/50/598630650.db2.gz MVYSPBSVSIPCAE-HNNXBMFYSA-N -1 3 374.807 3.932 20 0 FHADHM CC[C@H](NC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccc(Cl)cc1 ZINC000736363217 598630652 /nfs/dbraw/zinc/63/06/52/598630652.db2.gz MVYSPBSVSIPCAE-HNNXBMFYSA-N -1 3 374.807 3.932 20 0 FHADHM O=C(c1ccccc1)C1CCN(c2cc(Cl)ccc2-c2nnn[n-]2)CC1 ZINC000738277328 598634147 /nfs/dbraw/zinc/63/41/47/598634147.db2.gz BJNPDCNVPXDUFD-UHFFFAOYSA-N -1 3 367.840 3.619 20 0 FHADHM O=C(c1ccccc1)C1CCN(c2cc(Cl)ccc2-c2nn[n-]n2)CC1 ZINC000738277328 598634148 /nfs/dbraw/zinc/63/41/48/598634148.db2.gz BJNPDCNVPXDUFD-UHFFFAOYSA-N -1 3 367.840 3.619 20 0 FHADHM O=C(NCc1cc2ccccc2s1)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000738102523 598634760 /nfs/dbraw/zinc/63/47/60/598634760.db2.gz ULSNNMGVVCEFNU-UHFFFAOYSA-N -1 3 368.397 3.542 20 0 FHADHM O=C(NCc1cc2ccccc2s1)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000738102523 598634762 /nfs/dbraw/zinc/63/47/62/598634762.db2.gz ULSNNMGVVCEFNU-UHFFFAOYSA-N -1 3 368.397 3.542 20 0 FHADHM Cc1nc(SCc2ccc(F)cc2-c2nnn[n-]2)n(CC(C)C)c1C ZINC000737483502 598644738 /nfs/dbraw/zinc/64/47/38/598644738.db2.gz ORNUXWWSJHMPNN-UHFFFAOYSA-N -1 3 360.462 3.767 20 0 FHADHM Cc1nc(SCc2ccc(F)cc2-c2nn[n-]n2)n(CC(C)C)c1C ZINC000737483502 598644740 /nfs/dbraw/zinc/64/47/40/598644740.db2.gz ORNUXWWSJHMPNN-UHFFFAOYSA-N -1 3 360.462 3.767 20 0 FHADHM Cc1cc(Cl)ccc1OC(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000737265552 598647201 /nfs/dbraw/zinc/64/72/01/598647201.db2.gz WURPCAWGRPSXTL-UHFFFAOYSA-N -1 3 360.826 3.526 20 0 FHADHM Cc1cc(Cl)ccc1OC(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000737265552 598647203 /nfs/dbraw/zinc/64/72/03/598647203.db2.gz WURPCAWGRPSXTL-UHFFFAOYSA-N -1 3 360.826 3.526 20 0 FHADHM C[C@@H]1CCCCN1C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736269367 598647223 /nfs/dbraw/zinc/64/72/23/598647223.db2.gz WHKDTEIHYVTJPG-CQSZACIVSA-N -1 3 363.421 3.674 20 0 FHADHM C[C@@H]1CCCCN1C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736269367 598647225 /nfs/dbraw/zinc/64/72/25/598647225.db2.gz WHKDTEIHYVTJPG-CQSZACIVSA-N -1 3 363.421 3.674 20 0 FHADHM O=C(C[C@@H](c1ccccc1)C(F)(F)F)Nc1ccccc1-c1nnn[n-]1 ZINC000737807092 598647923 /nfs/dbraw/zinc/64/79/23/598647923.db2.gz JYWQGRWWQACRFQ-ZDUSSCGKSA-N -1 3 361.327 3.541 20 0 FHADHM O=C(C[C@@H](c1ccccc1)C(F)(F)F)Nc1ccccc1-c1nn[n-]n1 ZINC000737807092 598647924 /nfs/dbraw/zinc/64/79/24/598647924.db2.gz JYWQGRWWQACRFQ-ZDUSSCGKSA-N -1 3 361.327 3.541 20 0 FHADHM COc1ccccc1[C@H](C)CC(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000737142732 598649227 /nfs/dbraw/zinc/64/92/27/598649227.db2.gz PHVHOKZERXVBAG-LLVKDONJSA-N -1 3 371.828 3.661 20 0 FHADHM COc1ccccc1[C@H](C)CC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000737142732 598649229 /nfs/dbraw/zinc/64/92/29/598649229.db2.gz PHVHOKZERXVBAG-LLVKDONJSA-N -1 3 371.828 3.661 20 0 FHADHM CC[C@@H](Sc1ccccc1)C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736393414 598649558 /nfs/dbraw/zinc/64/95/58/598649558.db2.gz YIHZQLJYIKMBOZ-SUMWQHHRSA-N -1 3 367.478 3.615 20 0 FHADHM CC[C@@H](Sc1ccccc1)C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736393414 598649560 /nfs/dbraw/zinc/64/95/60/598649560.db2.gz YIHZQLJYIKMBOZ-SUMWQHHRSA-N -1 3 367.478 3.615 20 0 FHADHM CCOc1ccc(CNc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1OC ZINC000736644181 598651446 /nfs/dbraw/zinc/65/14/46/598651446.db2.gz GNJAJNITTBGIJV-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM CCOc1ccc(CNc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1OC ZINC000736644181 598651448 /nfs/dbraw/zinc/65/14/48/598651448.db2.gz GNJAJNITTBGIJV-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM C[C@@H](C1CC1)N(C)C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000735963098 598653366 /nfs/dbraw/zinc/65/33/66/598653366.db2.gz AGKAGVGYZXSPKQ-ZDUSSCGKSA-N -1 3 363.421 3.530 20 0 FHADHM C[C@@H](C1CC1)N(C)C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735963098 598653367 /nfs/dbraw/zinc/65/33/67/598653367.db2.gz AGKAGVGYZXSPKQ-ZDUSSCGKSA-N -1 3 363.421 3.530 20 0 FHADHM Clc1cc(NC2CCN(c3ccccc3)CC2)ccc1-c1nnn[n-]1 ZINC000737567097 598657062 /nfs/dbraw/zinc/65/70/62/598657062.db2.gz XNHKABRRDANBDQ-UHFFFAOYSA-N -1 3 354.845 3.601 20 0 FHADHM Clc1cc(NC2CCN(c3ccccc3)CC2)ccc1-c1nn[n-]n1 ZINC000737567097 598657063 /nfs/dbraw/zinc/65/70/63/598657063.db2.gz XNHKABRRDANBDQ-UHFFFAOYSA-N -1 3 354.845 3.601 20 0 FHADHM CCCC[C@H](NC(=O)c1sccc1-c1nnn[n-]1)c1ccc(OC)cc1 ZINC000736438984 598661524 /nfs/dbraw/zinc/66/15/24/598661524.db2.gz QIFWUOMRJXYIOT-HNNXBMFYSA-N -1 3 371.466 3.598 20 0 FHADHM CCCC[C@H](NC(=O)c1sccc1-c1nn[n-]n1)c1ccc(OC)cc1 ZINC000736438984 598661526 /nfs/dbraw/zinc/66/15/26/598661526.db2.gz QIFWUOMRJXYIOT-HNNXBMFYSA-N -1 3 371.466 3.598 20 0 FHADHM Cc1cccc2[nH]cc(CCNc3c(F)cc(-c4nnn[n-]4)cc3F)c21 ZINC000737407869 598674564 /nfs/dbraw/zinc/67/45/64/598674564.db2.gz IXQCUFZWOSJAIE-UHFFFAOYSA-N -1 3 354.364 3.589 20 0 FHADHM Cc1cccc2[nH]cc(CCNc3c(F)cc(-c4nn[n-]n4)cc3F)c21 ZINC000737407869 598674566 /nfs/dbraw/zinc/67/45/66/598674566.db2.gz IXQCUFZWOSJAIE-UHFFFAOYSA-N -1 3 354.364 3.589 20 0 FHADHM CCn1c(C)cc(C(=O)CSCc2ccc(F)cc2-c2nnn[n-]2)c1C ZINC000736720238 598697662 /nfs/dbraw/zinc/69/76/62/598697662.db2.gz NJXYCHCSAWNMNR-UHFFFAOYSA-N -1 3 373.457 3.560 20 0 FHADHM CCn1c(C)cc(C(=O)CSCc2ccc(F)cc2-c2nn[n-]n2)c1C ZINC000736720238 598697664 /nfs/dbraw/zinc/69/76/64/598697664.db2.gz NJXYCHCSAWNMNR-UHFFFAOYSA-N -1 3 373.457 3.560 20 0 FHADHM Cc1ccc(-c2cnn(CCCOc3ccc(-c4nn[n-]n4)cc3)c2)cc1 ZINC000737288404 598698705 /nfs/dbraw/zinc/69/87/05/598698705.db2.gz ODXIFKBJFWFMHU-UHFFFAOYSA-N -1 3 360.421 3.508 20 0 FHADHM C[C@H](OC(=O)CSc1ccc(-c2nnn[n-]2)cc1)c1ccccc1Cl ZINC000736156474 598713520 /nfs/dbraw/zinc/71/35/20/598713520.db2.gz WJZTZCGUJNISOK-NSHDSACASA-N -1 3 374.853 3.917 20 0 FHADHM C[C@H](OC(=O)CSc1ccc(-c2nn[n-]n2)cc1)c1ccccc1Cl ZINC000736156474 598713522 /nfs/dbraw/zinc/71/35/22/598713522.db2.gz WJZTZCGUJNISOK-NSHDSACASA-N -1 3 374.853 3.917 20 0 FHADHM CC(C)(C)CCOC(=O)c1ccc(Oc2ccc(-c3nnn[n-]3)cn2)cc1 ZINC000735602025 598726031 /nfs/dbraw/zinc/72/60/31/598726031.db2.gz KQZXROVTHWCNOC-UHFFFAOYSA-N -1 3 367.409 3.647 20 0 FHADHM CC(C)(C)CCOC(=O)c1ccc(Oc2ccc(-c3nn[n-]n3)cn2)cc1 ZINC000735602025 598726032 /nfs/dbraw/zinc/72/60/32/598726032.db2.gz KQZXROVTHWCNOC-UHFFFAOYSA-N -1 3 367.409 3.647 20 0 FHADHM O=C(CCCCOc1cccc(-c2nnn[n-]2)c1)OCCC1CCCC1 ZINC000737841595 598735918 /nfs/dbraw/zinc/73/59/18/598735918.db2.gz OIFLVQKYBNSNGY-UHFFFAOYSA-N -1 3 358.442 3.539 20 0 FHADHM O=C(CCCCOc1cccc(-c2nn[n-]n2)c1)OCCC1CCCC1 ZINC000737841595 598735919 /nfs/dbraw/zinc/73/59/19/598735919.db2.gz OIFLVQKYBNSNGY-UHFFFAOYSA-N -1 3 358.442 3.539 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)C[C@@H](CC)c1ccccc1 ZINC000736638274 598736071 /nfs/dbraw/zinc/73/60/71/598736071.db2.gz ZSAUMMYEBNARLV-CQSZACIVSA-N -1 3 365.437 3.788 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)C[C@@H](CC)c1ccccc1 ZINC000736638274 598736072 /nfs/dbraw/zinc/73/60/72/598736072.db2.gz ZSAUMMYEBNARLV-CQSZACIVSA-N -1 3 365.437 3.788 20 0 FHADHM Cc1ccccc1[C@@H](NC(=S)Nc1ccccc1-c1nnn[n-]1)C(C)C ZINC000737421103 598751915 /nfs/dbraw/zinc/75/19/15/598751915.db2.gz KDRYQFXICYYSSY-KRWDZBQOSA-N -1 3 366.494 3.859 20 0 FHADHM Cc1ccccc1[C@@H](NC(=S)Nc1ccccc1-c1nn[n-]n1)C(C)C ZINC000737421103 598751917 /nfs/dbraw/zinc/75/19/17/598751917.db2.gz KDRYQFXICYYSSY-KRWDZBQOSA-N -1 3 366.494 3.859 20 0 FHADHM Cc1ccccc1[C@@H](NC(=O)C=Cc1ccccc1-c1nnn[n-]1)C(C)C ZINC000737419167 598754886 /nfs/dbraw/zinc/75/48/86/598754886.db2.gz DDWFTCGCLBCFBV-CBUFDYBVSA-N -1 3 361.449 3.702 20 0 FHADHM Cc1ccccc1[C@@H](NC(=O)C=Cc1ccccc1-c1nn[n-]n1)C(C)C ZINC000737419167 598754888 /nfs/dbraw/zinc/75/48/88/598754888.db2.gz DDWFTCGCLBCFBV-CBUFDYBVSA-N -1 3 361.449 3.702 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1N[C@@H](c1nccs1)c1ccccc1 ZINC000737559448 598757838 /nfs/dbraw/zinc/75/78/38/598757838.db2.gz YDZMOTVZUILDIM-CYBMUJFWSA-N -1 3 369.841 3.573 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1N[C@@H](c1nccs1)c1ccccc1 ZINC000737559448 598757839 /nfs/dbraw/zinc/75/78/39/598757839.db2.gz YDZMOTVZUILDIM-CYBMUJFWSA-N -1 3 369.841 3.573 20 0 FHADHM COc1ccc([C@H](C)Nc2cc(-c3nnn[n-]3)ccc2OC)cc1Cl ZINC000737074000 598768005 /nfs/dbraw/zinc/76/80/05/598768005.db2.gz HBUKLXCFKNGJJG-JTQLQIEISA-N -1 3 359.817 3.710 20 0 FHADHM COc1ccc([C@H](C)Nc2cc(-c3nn[n-]n3)ccc2OC)cc1Cl ZINC000737074000 598768007 /nfs/dbraw/zinc/76/80/07/598768007.db2.gz HBUKLXCFKNGJJG-JTQLQIEISA-N -1 3 359.817 3.710 20 0 FHADHM C[C@@H](Nc1c(-c2nnn[n-]2)cnc2c(F)cc(F)cc21)c1cccs1 ZINC000736137897 598770208 /nfs/dbraw/zinc/77/02/08/598770208.db2.gz MOSAGLXDHJTURQ-MRVPVSSYSA-N -1 3 358.377 3.928 20 0 FHADHM C[C@@H](Nc1c(-c2nn[n-]n2)cnc2c(F)cc(F)cc21)c1cccs1 ZINC000736137897 598770209 /nfs/dbraw/zinc/77/02/09/598770209.db2.gz MOSAGLXDHJTURQ-MRVPVSSYSA-N -1 3 358.377 3.928 20 0 FHADHM Cc1cc(CNc2c(-c3nnn[n-]3)cnc3c(F)cc(F)cc32)ccc1F ZINC000737265061 598770835 /nfs/dbraw/zinc/77/08/35/598770835.db2.gz RMKWPEUGZWPLPI-UHFFFAOYSA-N -1 3 370.338 3.753 20 0 FHADHM Cc1cc(CNc2c(-c3nn[n-]n3)cnc3c(F)cc(F)cc32)ccc1F ZINC000737265061 598770836 /nfs/dbraw/zinc/77/08/36/598770836.db2.gz RMKWPEUGZWPLPI-UHFFFAOYSA-N -1 3 370.338 3.753 20 0 FHADHM CC(C)(CCCc1ccccc1)C(=O)NCc1cccc(-c2nnn[n-]2)c1 ZINC000735664005 598789813 /nfs/dbraw/zinc/78/98/13/598789813.db2.gz DBNJPYLGPQDIEB-UHFFFAOYSA-N -1 3 363.465 3.532 20 0 FHADHM CC(C)(CCCc1ccccc1)C(=O)NCc1cccc(-c2nn[n-]n2)c1 ZINC000735664005 598789814 /nfs/dbraw/zinc/78/98/14/598789814.db2.gz DBNJPYLGPQDIEB-UHFFFAOYSA-N -1 3 363.465 3.532 20 0 FHADHM COc1ccc(COCCCNc2ccc(Cl)cc2-c2nnn[n-]2)cc1 ZINC000737097463 598796021 /nfs/dbraw/zinc/79/60/21/598796021.db2.gz KIVVLGSXSLYBOE-UHFFFAOYSA-N -1 3 373.844 3.548 20 0 FHADHM COc1ccc(COCCCNc2ccc(Cl)cc2-c2nn[n-]n2)cc1 ZINC000737097463 598796022 /nfs/dbraw/zinc/79/60/22/598796022.db2.gz KIVVLGSXSLYBOE-UHFFFAOYSA-N -1 3 373.844 3.548 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)N1CCCCCCC1 ZINC000823303891 599295441 /nfs/dbraw/zinc/29/54/41/599295441.db2.gz XUMVXVZXJNDQCB-UHFFFAOYSA-N -1 3 368.363 3.684 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)N1CCCCCCC1 ZINC000823303891 599295443 /nfs/dbraw/zinc/29/54/43/599295443.db2.gz XUMVXVZXJNDQCB-UHFFFAOYSA-N -1 3 368.363 3.684 20 0 FHADHM CCCN(C)C(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1 ZINC000821088111 599296461 /nfs/dbraw/zinc/29/64/61/599296461.db2.gz JPZADRUDQRMRON-UHFFFAOYSA-N -1 3 370.388 3.672 20 0 FHADHM CCCN(C)C(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1 ZINC000821088111 599296464 /nfs/dbraw/zinc/29/64/64/599296464.db2.gz JPZADRUDQRMRON-UHFFFAOYSA-N -1 3 370.388 3.672 20 0 FHADHM CN(C(=O)c1ccc(Oc2ccccc2)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736741495 599306816 /nfs/dbraw/zinc/30/68/16/599306816.db2.gz DZJPGTRWLPBZPJ-UHFFFAOYSA-N -1 3 371.400 3.936 20 0 FHADHM CN(C(=O)c1ccc(Oc2ccccc2)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736741495 599306819 /nfs/dbraw/zinc/30/68/19/599306819.db2.gz DZJPGTRWLPBZPJ-UHFFFAOYSA-N -1 3 371.400 3.936 20 0 FHADHM C[C@@H](c1ccc(-c2nnn[n-]2)cc1)N1CCc2[nH]c3ccc(F)cc3c2C1 ZINC000736202005 599317013 /nfs/dbraw/zinc/31/70/13/599317013.db2.gz YWQNOXYZONLWLJ-LBPRGKRZSA-N -1 3 362.412 3.606 20 0 FHADHM C[C@@H](c1ccc(-c2nn[n-]n2)cc1)N1CCc2[nH]c3ccc(F)cc3c2C1 ZINC000736202005 599317016 /nfs/dbraw/zinc/31/70/16/599317016.db2.gz YWQNOXYZONLWLJ-LBPRGKRZSA-N -1 3 362.412 3.606 20 0 FHADHM Cc1nn(-c2ccccc2)c(C)c1N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000737504360 599325330 /nfs/dbraw/zinc/32/53/30/599325330.db2.gz VKKSITQRXRORKZ-CYBMUJFWSA-N -1 3 359.437 3.842 20 0 FHADHM Cc1nn(-c2ccccc2)c(C)c1N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000737504360 599325333 /nfs/dbraw/zinc/32/53/33/599325333.db2.gz VKKSITQRXRORKZ-CYBMUJFWSA-N -1 3 359.437 3.842 20 0 FHADHM C[C@H](SCc1cc(F)cc2c1OCOC2)c1ccc(-c2nnn[n-]2)cc1 ZINC000736189668 599325741 /nfs/dbraw/zinc/32/57/41/599325741.db2.gz QHFNVWXPHJFWNX-NSHDSACASA-N -1 3 372.425 3.867 20 0 FHADHM C[C@H](SCc1cc(F)cc2c1OCOC2)c1ccc(-c2nn[n-]n2)cc1 ZINC000736189668 599325742 /nfs/dbraw/zinc/32/57/42/599325742.db2.gz QHFNVWXPHJFWNX-NSHDSACASA-N -1 3 372.425 3.867 20 0 FHADHM Clc1cccc(NCCOc2cccc(-c3nnn[n-]3)c2)c1Cl ZINC000737574538 599326105 /nfs/dbraw/zinc/32/61/05/599326105.db2.gz LPKAMVGESCPSKJ-UHFFFAOYSA-N -1 3 350.209 3.664 20 0 FHADHM Clc1cccc(NCCOc2cccc(-c3nn[n-]n3)c2)c1Cl ZINC000737574538 599326108 /nfs/dbraw/zinc/32/61/08/599326108.db2.gz LPKAMVGESCPSKJ-UHFFFAOYSA-N -1 3 350.209 3.664 20 0 FHADHM C[C@@H](S[C@@H](C)C(=O)N[C@@H]1CCCC[C@H]1C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736189203 599327557 /nfs/dbraw/zinc/32/75/57/599327557.db2.gz OLMCSQQETPZMJG-VWPFQQQWSA-N -1 3 373.526 3.744 20 0 FHADHM C[C@@H](S[C@@H](C)C(=O)N[C@@H]1CCCC[C@H]1C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736189203 599327559 /nfs/dbraw/zinc/32/75/59/599327559.db2.gz OLMCSQQETPZMJG-VWPFQQQWSA-N -1 3 373.526 3.744 20 0 FHADHM CCCCc1nc(CNc2cc(-c3nnn[n-]3)ccc2OCC)cs1 ZINC000736466783 599327728 /nfs/dbraw/zinc/32/77/28/599327728.db2.gz NITZDGOWUVJVCT-UHFFFAOYSA-N -1 3 358.471 3.677 20 0 FHADHM CCCCc1nc(CNc2cc(-c3nn[n-]n3)ccc2OCC)cs1 ZINC000736466783 599327731 /nfs/dbraw/zinc/32/77/31/599327731.db2.gz NITZDGOWUVJVCT-UHFFFAOYSA-N -1 3 358.471 3.677 20 0 FHADHM C[C@@H](SCC(=O)N[C@@H](C)c1cccs1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736103793 599328023 /nfs/dbraw/zinc/32/80/23/599328023.db2.gz FEPWHSRZEXOTQK-NWDGAFQWSA-N -1 3 373.507 3.600 20 0 FHADHM C[C@@H](SCC(=O)N[C@@H](C)c1cccs1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736103793 599328026 /nfs/dbraw/zinc/32/80/26/599328026.db2.gz FEPWHSRZEXOTQK-NWDGAFQWSA-N -1 3 373.507 3.600 20 0 FHADHM Cc1ccccc1NC(=O)[C@H](C)S[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000737433726 599329497 /nfs/dbraw/zinc/32/94/97/599329497.db2.gz BSEWRRKWFWQQMJ-KBPBESRZSA-N -1 3 367.478 3.997 20 0 FHADHM Cc1ccccc1NC(=O)[C@H](C)S[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000737433726 599329498 /nfs/dbraw/zinc/32/94/98/599329498.db2.gz BSEWRRKWFWQQMJ-KBPBESRZSA-N -1 3 367.478 3.997 20 0 FHADHM Fc1cc(NCc2ccc(-c3nnn[n-]3)cc2)ccc1OC1CCCC1 ZINC000737650092 599331564 /nfs/dbraw/zinc/33/15/64/599331564.db2.gz FYXUWNWSWZRFNU-UHFFFAOYSA-N -1 3 353.401 3.939 20 0 FHADHM Fc1cc(NCc2ccc(-c3nn[n-]n3)cc2)ccc1OC1CCCC1 ZINC000737650092 599331567 /nfs/dbraw/zinc/33/15/67/599331567.db2.gz FYXUWNWSWZRFNU-UHFFFAOYSA-N -1 3 353.401 3.939 20 0 FHADHM Cc1cccc(C)c1NC(=O)CS[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000737390094 599332122 /nfs/dbraw/zinc/33/21/22/599332122.db2.gz OUPAEVOCMVUEEM-AWEZNQCLSA-N -1 3 367.478 3.916 20 0 FHADHM Cc1cccc(C)c1NC(=O)CS[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000737390094 599332125 /nfs/dbraw/zinc/33/21/25/599332125.db2.gz OUPAEVOCMVUEEM-AWEZNQCLSA-N -1 3 367.478 3.916 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1CNc1ccc(C)cc1Br ZINC000821737043 607369634 /nfs/dbraw/zinc/36/96/34/607369634.db2.gz QZHFZEMUAMGCMO-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CNc1ccc(C)cc1Br ZINC000821737043 607369635 /nfs/dbraw/zinc/36/96/35/607369635.db2.gz QZHFZEMUAMGCMO-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM Fc1ccccc1-c1cnc(CSc2ccccc2-c2nnn[n-]2)o1 ZINC000822791689 599345532 /nfs/dbraw/zinc/34/55/32/599345532.db2.gz LGNYEJJKBDMDSK-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM Fc1ccccc1-c1cnc(CSc2ccccc2-c2nn[n-]n2)o1 ZINC000822791689 599345534 /nfs/dbraw/zinc/34/55/34/599345534.db2.gz LGNYEJJKBDMDSK-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM CC(C)(C)c1ccccc1NC(=O)CSc1ccccc1-c1nnn[n-]1 ZINC000819958100 599348603 /nfs/dbraw/zinc/34/86/03/599348603.db2.gz IDOYBSVMSVYNIU-UHFFFAOYSA-N -1 3 367.478 3.895 20 0 FHADHM CC(C)(C)c1ccccc1NC(=O)CSc1ccccc1-c1nn[n-]n1 ZINC000819958100 599348606 /nfs/dbraw/zinc/34/86/06/599348606.db2.gz IDOYBSVMSVYNIU-UHFFFAOYSA-N -1 3 367.478 3.895 20 0 FHADHM CCCOc1cc(C)ccc1NCc1cc(-c2nnn[n-]2)ccc1OC ZINC000821127184 607370678 /nfs/dbraw/zinc/37/06/78/607370678.db2.gz CLQKJNCJQCENIN-UHFFFAOYSA-N -1 3 353.426 3.585 20 0 FHADHM CCCOc1cc(C)ccc1NCc1cc(-c2nn[n-]n2)ccc1OC ZINC000821127184 607370680 /nfs/dbraw/zinc/37/06/80/607370680.db2.gz CLQKJNCJQCENIN-UHFFFAOYSA-N -1 3 353.426 3.585 20 0 FHADHM C[C@@H](Nc1ccc(NC(=O)c2ccco2)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820456027 599365537 /nfs/dbraw/zinc/36/55/37/599365537.db2.gz PFMGSMIXWMJINP-CYBMUJFWSA-N -1 3 374.404 3.885 20 0 FHADHM C[C@@H](Nc1ccc(NC(=O)c2ccco2)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820456027 599365540 /nfs/dbraw/zinc/36/55/40/599365540.db2.gz PFMGSMIXWMJINP-CYBMUJFWSA-N -1 3 374.404 3.885 20 0 FHADHM CCc1c(C)sc(NC(=O)C2(c3ccccc3F)CC2)c1-c1nnn[n-]1 ZINC000736669834 599374064 /nfs/dbraw/zinc/37/40/64/599374064.db2.gz MHFZAIDJTOQKKM-UHFFFAOYSA-N -1 3 371.441 3.608 20 0 FHADHM CCc1c(C)sc(NC(=O)C2(c3ccccc3F)CC2)c1-c1nn[n-]n1 ZINC000736669834 599374066 /nfs/dbraw/zinc/37/40/66/599374066.db2.gz MHFZAIDJTOQKKM-UHFFFAOYSA-N -1 3 371.441 3.608 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cc3occc3s2)c1-c1nnn[n-]1 ZINC000736675299 599374343 /nfs/dbraw/zinc/37/43/43/599374343.db2.gz JSPOXAGMFJCEQG-UHFFFAOYSA-N -1 3 359.436 3.859 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cc3occc3s2)c1-c1nn[n-]n1 ZINC000736675299 599374345 /nfs/dbraw/zinc/37/43/45/599374345.db2.gz JSPOXAGMFJCEQG-UHFFFAOYSA-N -1 3 359.436 3.859 20 0 FHADHM CC(C)c1cccc(OCc2nnc(-c3cccc(-c4nnn[n-]4)c3)o2)c1 ZINC000820197772 599381253 /nfs/dbraw/zinc/38/12/53/599381253.db2.gz NNMKGCGBPDJCJA-UHFFFAOYSA-N -1 3 362.393 3.619 20 0 FHADHM CC(C)c1cccc(OCc2nnc(-c3cccc(-c4nn[n-]n4)c3)o2)c1 ZINC000820197772 599381256 /nfs/dbraw/zinc/38/12/56/599381256.db2.gz NNMKGCGBPDJCJA-UHFFFAOYSA-N -1 3 362.393 3.619 20 0 FHADHM CN(Cc1ccc(Cl)cc1)c1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000736817232 599395769 /nfs/dbraw/zinc/39/57/69/599395769.db2.gz UYCZFHDOEPLKJF-UHFFFAOYSA-N -1 3 350.813 3.705 20 0 FHADHM CN(Cc1ccc(Cl)cc1)c1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000736817232 599395773 /nfs/dbraw/zinc/39/57/73/599395773.db2.gz UYCZFHDOEPLKJF-UHFFFAOYSA-N -1 3 350.813 3.705 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1CNc1ccc(OC(C)C)c(Cl)c1 ZINC000821736720 607369269 /nfs/dbraw/zinc/36/92/69/607369269.db2.gz MZOMDBODVDARSJ-UHFFFAOYSA-N -1 3 373.844 3.928 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CNc1ccc(OC(C)C)c(Cl)c1 ZINC000821736720 607369271 /nfs/dbraw/zinc/36/92/71/607369271.db2.gz MZOMDBODVDARSJ-UHFFFAOYSA-N -1 3 373.844 3.928 20 0 FHADHM CC(C)C(=O)Nc1ccc(CNc2cc(Cl)ccc2-c2nn[n-]n2)cc1 ZINC000735684511 599402109 /nfs/dbraw/zinc/40/21/09/599402109.db2.gz DWJUJAZIGMTTTM-UHFFFAOYSA-N -1 3 370.844 3.727 20 0 FHADHM CC(C)C(=O)Nc1ccc(CNc2cc(Cl)ccc2-c2nnn[n-]2)cc1 ZINC000735684511 599402107 /nfs/dbraw/zinc/40/21/07/599402107.db2.gz DWJUJAZIGMTTTM-UHFFFAOYSA-N -1 3 370.844 3.727 20 0 FHADHM CCCOc1ccc(CNc2cc(Cl)ccc2-c2nnn[n-]2)cc1OC ZINC000736489963 599406071 /nfs/dbraw/zinc/40/60/71/599406071.db2.gz GNOUGNXLRXIAPH-UHFFFAOYSA-N -1 3 373.844 3.930 20 0 FHADHM CCCOc1ccc(CNc2cc(Cl)ccc2-c2nn[n-]n2)cc1OC ZINC000736489963 599406072 /nfs/dbraw/zinc/40/60/72/599406072.db2.gz GNOUGNXLRXIAPH-UHFFFAOYSA-N -1 3 373.844 3.930 20 0 FHADHM Clc1cccc(OCCNc2cc(-c3nnn[n-]3)c3ccccc3n2)c1 ZINC000737573193 599410267 /nfs/dbraw/zinc/41/02/67/599410267.db2.gz ALEVPATZUSZIDN-UHFFFAOYSA-N -1 3 366.812 3.559 20 0 FHADHM Clc1cccc(OCCNc2cc(-c3nn[n-]n3)c3ccccc3n2)c1 ZINC000737573193 599410270 /nfs/dbraw/zinc/41/02/70/599410270.db2.gz ALEVPATZUSZIDN-UHFFFAOYSA-N -1 3 366.812 3.559 20 0 FHADHM Cc1ccc(N2CCCN(c3cc(Cl)ccc3-c3nnn[n-]3)CC2)cc1 ZINC000737353234 599415109 /nfs/dbraw/zinc/41/51/09/599415109.db2.gz UEBTXVXPBIVTGM-UHFFFAOYSA-N -1 3 368.872 3.545 20 0 FHADHM Cc1ccc(N2CCCN(c3cc(Cl)ccc3-c3nn[n-]n3)CC2)cc1 ZINC000737353234 599415111 /nfs/dbraw/zinc/41/51/11/599415111.db2.gz UEBTXVXPBIVTGM-UHFFFAOYSA-N -1 3 368.872 3.545 20 0 FHADHM Cc1nc(-c2ccccc2)sc1[C@H](C)NCc1ccc(-c2nnn[n-]2)o1 ZINC000822423485 599421006 /nfs/dbraw/zinc/42/10/06/599421006.db2.gz LHLAPNUCPWQXEU-NSHDSACASA-N -1 3 366.450 3.742 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1C ZINC000822228900 599426555 /nfs/dbraw/zinc/42/65/55/599426555.db2.gz ILBSAERXMHVNGB-GJZGRUSLSA-N -1 3 364.453 3.605 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1C ZINC000822228900 599426559 /nfs/dbraw/zinc/42/65/59/599426559.db2.gz ILBSAERXMHVNGB-GJZGRUSLSA-N -1 3 364.453 3.605 20 0 FHADHM Cc1[nH]c2ccccc2c1CCNc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000737197711 599427180 /nfs/dbraw/zinc/42/71/80/599427180.db2.gz CVGMCDWWWPDUAA-UHFFFAOYSA-N -1 3 369.432 3.859 20 0 FHADHM Cc1[nH]c2ccccc2c1CCNc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000737197711 599427182 /nfs/dbraw/zinc/42/71/82/599427182.db2.gz CVGMCDWWWPDUAA-UHFFFAOYSA-N -1 3 369.432 3.859 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CSc1ccc(C(F)(F)F)cn1 ZINC000821751919 607377454 /nfs/dbraw/zinc/37/74/54/607377454.db2.gz DXLPLVLCNFZZRP-UHFFFAOYSA-N -1 3 367.356 3.581 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1CSc1c(F)cc(F)cc1F ZINC000821751691 607378961 /nfs/dbraw/zinc/37/89/61/607378961.db2.gz AEGSRAPORAOYNI-UHFFFAOYSA-N -1 3 352.341 3.585 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CSc1c(F)cc(F)cc1F ZINC000821751691 607378963 /nfs/dbraw/zinc/37/89/63/607378963.db2.gz AEGSRAPORAOYNI-UHFFFAOYSA-N -1 3 352.341 3.585 20 0 FHADHM COc1cc(CNc2c(Cl)cccc2-c2nn[n-]n2)ccc1OC(C)C ZINC000821716978 599471519 /nfs/dbraw/zinc/47/15/19/599471519.db2.gz ISNQPYBRPMAVMV-UHFFFAOYSA-N -1 3 373.844 3.928 20 0 FHADHM COc1cc(CNc2c(Cl)cccc2-c2nnn[n-]2)ccc1OC(C)C ZINC000821716978 599471516 /nfs/dbraw/zinc/47/15/16/599471516.db2.gz ISNQPYBRPMAVMV-UHFFFAOYSA-N -1 3 373.844 3.928 20 0 FHADHM COc1cc([C@@H](C)Nc2ccc(F)cc2-c2nnn[n-]2)ccc1OC(C)C ZINC000821708496 599471754 /nfs/dbraw/zinc/47/17/54/599471754.db2.gz RBLLZOINVPFGBD-GFCCVEGCSA-N -1 3 371.416 3.975 20 0 FHADHM COc1cc([C@@H](C)Nc2ccc(F)cc2-c2nn[n-]n2)ccc1OC(C)C ZINC000821708496 599471756 /nfs/dbraw/zinc/47/17/56/599471756.db2.gz RBLLZOINVPFGBD-GFCCVEGCSA-N -1 3 371.416 3.975 20 0 FHADHM C[C@H](Cc1ccc(Cl)cc1)N(C)c1ncc(-c2nnn[n-]2)cc1Cl ZINC000736055533 599472588 /nfs/dbraw/zinc/47/25/88/599472588.db2.gz GKMPIMDJTKTHGH-SNVBAGLBSA-N -1 3 363.252 3.636 20 0 FHADHM C[C@H](Cc1ccc(Cl)cc1)N(C)c1ncc(-c2nn[n-]n2)cc1Cl ZINC000736055533 599472590 /nfs/dbraw/zinc/47/25/90/599472590.db2.gz GKMPIMDJTKTHGH-SNVBAGLBSA-N -1 3 363.252 3.636 20 0 FHADHM Fc1cccc(Nc2ccc(OCC3CCOCC3)cc2)c1-c1nnn[n-]1 ZINC000737664689 599473499 /nfs/dbraw/zinc/47/34/99/599473499.db2.gz NFSMLEFWERDUFL-UHFFFAOYSA-N -1 3 369.400 3.555 20 0 FHADHM Fc1cccc(Nc2ccc(OCC3CCOCC3)cc2)c1-c1nn[n-]n1 ZINC000737664689 599473502 /nfs/dbraw/zinc/47/35/02/599473502.db2.gz NFSMLEFWERDUFL-UHFFFAOYSA-N -1 3 369.400 3.555 20 0 FHADHM Fc1ccc(NCCc2ccc(N3CCCCC3)cc2)c(-c2nnn[n-]2)c1 ZINC000822783074 599478732 /nfs/dbraw/zinc/47/87/32/599478732.db2.gz UESSMDWBHKJWTD-UHFFFAOYSA-N -1 3 366.444 3.651 20 0 FHADHM Fc1ccc(NCCc2ccc(N3CCCCC3)cc2)c(-c2nn[n-]n2)c1 ZINC000822783074 599478733 /nfs/dbraw/zinc/47/87/33/599478733.db2.gz UESSMDWBHKJWTD-UHFFFAOYSA-N -1 3 366.444 3.651 20 0 FHADHM CC[C@H](C)C(=O)Nc1cccc(CNc2ccc(F)cc2-c2nnn[n-]2)c1 ZINC000820861916 599480175 /nfs/dbraw/zinc/48/01/75/599480175.db2.gz ONECKLZNJINYMM-LBPRGKRZSA-N -1 3 368.416 3.603 20 0 FHADHM CC[C@H](C)C(=O)Nc1cccc(CNc2ccc(F)cc2-c2nn[n-]n2)c1 ZINC000820861916 599480178 /nfs/dbraw/zinc/48/01/78/599480178.db2.gz ONECKLZNJINYMM-LBPRGKRZSA-N -1 3 368.416 3.603 20 0 FHADHM Cc1cccc(CN(C)c2c(-c3nnn[n-]3)cnc3c(F)ccc(F)c32)c1 ZINC000822303798 599487958 /nfs/dbraw/zinc/48/79/58/599487958.db2.gz JQLVOWPRHIJMEV-UHFFFAOYSA-N -1 3 366.375 3.638 20 0 FHADHM Cc1cccc(CN(C)c2c(-c3nn[n-]n3)cnc3c(F)ccc(F)c32)c1 ZINC000822303798 599487961 /nfs/dbraw/zinc/48/79/61/599487961.db2.gz JQLVOWPRHIJMEV-UHFFFAOYSA-N -1 3 366.375 3.638 20 0 FHADHM Fc1ccc(NC[C@H]2CCCO[C@@H]2c2ccccc2)c(-c2nnn[n-]2)c1 ZINC000822778955 599497082 /nfs/dbraw/zinc/49/70/82/599497082.db2.gz PKFHNKLLPGQLGQ-RDTXWAMCSA-N -1 3 353.401 3.586 20 0 FHADHM Fc1ccc(NC[C@H]2CCCO[C@@H]2c2ccccc2)c(-c2nn[n-]n2)c1 ZINC000822778955 599497084 /nfs/dbraw/zinc/49/70/84/599497084.db2.gz PKFHNKLLPGQLGQ-RDTXWAMCSA-N -1 3 353.401 3.586 20 0 FHADHM CC(C)[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820313167 599498005 /nfs/dbraw/zinc/49/80/05/599498005.db2.gz BLFPLOCZVUSPDZ-BEFAXECRSA-N -1 3 363.465 3.559 20 0 FHADHM CC(C)[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820313167 599498008 /nfs/dbraw/zinc/49/80/08/599498008.db2.gz BLFPLOCZVUSPDZ-BEFAXECRSA-N -1 3 363.465 3.559 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CCCCC[C@H]1c1ccco1 ZINC000737292949 599502333 /nfs/dbraw/zinc/50/23/33/599502333.db2.gz XTJDNSMNHLYBFY-INIZCTEOSA-N -1 3 366.425 3.917 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CCCCC[C@H]1c1ccco1 ZINC000737292949 599502335 /nfs/dbraw/zinc/50/23/35/599502335.db2.gz XTJDNSMNHLYBFY-INIZCTEOSA-N -1 3 366.425 3.917 20 0 FHADHM C[C@@H](NC(=O)c1cc(Cl)sc1Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000820391841 599504234 /nfs/dbraw/zinc/50/42/34/599504234.db2.gz RQLHVGBNRJPZEE-SSDOTTSWSA-N -1 3 368.249 3.726 20 0 FHADHM C[C@@H](NC(=O)c1cc(Cl)sc1Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000820391841 599504237 /nfs/dbraw/zinc/50/42/37/599504237.db2.gz RQLHVGBNRJPZEE-SSDOTTSWSA-N -1 3 368.249 3.726 20 0 FHADHM Fc1ccc(NCc2ccnc(OC3CCCCC3)c2)c(-c2nnn[n-]2)c1 ZINC000822783156 599509081 /nfs/dbraw/zinc/50/90/81/599509081.db2.gz XQRYSRFMPBSZTI-UHFFFAOYSA-N -1 3 368.416 3.724 20 0 FHADHM Fc1ccc(NCc2ccnc(OC3CCCCC3)c2)c(-c2nn[n-]n2)c1 ZINC000822783156 599509083 /nfs/dbraw/zinc/50/90/83/599509083.db2.gz XQRYSRFMPBSZTI-UHFFFAOYSA-N -1 3 368.416 3.724 20 0 FHADHM Fc1ccc(NCc2ccc(Oc3ccccc3)nc2)c(-c2nnn[n-]2)c1 ZINC000822782813 599509399 /nfs/dbraw/zinc/50/93/99/599509399.db2.gz IATLOCSKSPQJJV-UHFFFAOYSA-N -1 3 362.368 3.805 20 0 FHADHM Fc1ccc(NCc2ccc(Oc3ccccc3)nc2)c(-c2nn[n-]n2)c1 ZINC000822782813 599509401 /nfs/dbraw/zinc/50/94/01/599509401.db2.gz IATLOCSKSPQJJV-UHFFFAOYSA-N -1 3 362.368 3.805 20 0 FHADHM CCC(CC)(C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000820882406 599509761 /nfs/dbraw/zinc/50/97/61/599509761.db2.gz QXEAOVYDUJWPRO-OAHLLOKOSA-N -1 3 363.465 3.802 20 0 FHADHM CCC(CC)(C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000820882406 599509763 /nfs/dbraw/zinc/50/97/63/599509763.db2.gz QXEAOVYDUJWPRO-OAHLLOKOSA-N -1 3 363.465 3.802 20 0 FHADHM Cc1c2cccc(C)c2oc1C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000822020774 599510678 /nfs/dbraw/zinc/51/06/78/599510678.db2.gz ISMNOUPOVTWDIW-ZDUSSCGKSA-N -1 3 361.405 3.721 20 0 FHADHM Cc1c2cccc(C)c2oc1C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000822020774 599510679 /nfs/dbraw/zinc/51/06/79/599510679.db2.gz ISMNOUPOVTWDIW-ZDUSSCGKSA-N -1 3 361.405 3.721 20 0 FHADHM CCc1nc2ccccc2n1CCNc1c(Cl)cccc1-c1nnn[n-]1 ZINC000821509965 599511002 /nfs/dbraw/zinc/51/10/02/599511002.db2.gz QXXJTRUYPDVNGK-UHFFFAOYSA-N -1 3 367.844 3.544 20 0 FHADHM CCc1nc2ccccc2n1CCNc1c(Cl)cccc1-c1nn[n-]n1 ZINC000821509965 599511003 /nfs/dbraw/zinc/51/10/03/599511003.db2.gz QXXJTRUYPDVNGK-UHFFFAOYSA-N -1 3 367.844 3.544 20 0 FHADHM CCCc1cc(C(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)sc1C ZINC000821138545 599517351 /nfs/dbraw/zinc/51/73/51/599517351.db2.gz AZTYVFKVCALQDG-NSHDSACASA-N -1 3 355.467 3.680 20 0 FHADHM CCCc1cc(C(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)sc1C ZINC000821138545 599517352 /nfs/dbraw/zinc/51/73/52/599517352.db2.gz AZTYVFKVCALQDG-NSHDSACASA-N -1 3 355.467 3.680 20 0 FHADHM C[C@H](NC(=O)c1cc2cc(F)ccc2s1)c1cccc(-c2nnn[n-]2)c1 ZINC000820391155 599528695 /nfs/dbraw/zinc/52/86/95/599528695.db2.gz OARHRFALEVKFIU-JTQLQIEISA-N -1 3 367.409 3.712 20 0 FHADHM C[C@H](NC(=O)c1cc2cc(F)ccc2s1)c1cccc(-c2nn[n-]n2)c1 ZINC000820391155 599528698 /nfs/dbraw/zinc/52/86/98/599528698.db2.gz OARHRFALEVKFIU-JTQLQIEISA-N -1 3 367.409 3.712 20 0 FHADHM Cc1ccc(CCC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1Cl ZINC000822235220 599537680 /nfs/dbraw/zinc/53/76/80/599537680.db2.gz XPWZQRAXKOEPGJ-CYBMUJFWSA-N -1 3 369.856 3.639 20 0 FHADHM Cc1ccc(CCC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1Cl ZINC000822235220 599537682 /nfs/dbraw/zinc/53/76/82/599537682.db2.gz XPWZQRAXKOEPGJ-CYBMUJFWSA-N -1 3 369.856 3.639 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCC2)c1ccsc1 ZINC000735571179 599539156 /nfs/dbraw/zinc/53/91/56/599539156.db2.gz UFMLAUOTYSSUMB-SECBINFHSA-N -1 3 359.480 3.611 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCC2)c1ccsc1 ZINC000735571179 599539160 /nfs/dbraw/zinc/53/91/60/599539160.db2.gz UFMLAUOTYSSUMB-SECBINFHSA-N -1 3 359.480 3.611 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H](C)Cc2ccccc2F)c1-c1nnn[n-]1 ZINC000736670815 599544405 /nfs/dbraw/zinc/54/44/05/599544405.db2.gz SLHFVJXKAXEJPV-JTQLQIEISA-N -1 3 373.457 3.755 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H](C)Cc2ccccc2F)c1-c1nn[n-]n1 ZINC000736670815 599544407 /nfs/dbraw/zinc/54/44/07/599544407.db2.gz SLHFVJXKAXEJPV-JTQLQIEISA-N -1 3 373.457 3.755 20 0 FHADHM CCc1ccc(N[C@H](C)C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1 ZINC000736691133 599558127 /nfs/dbraw/zinc/55/81/27/599558127.db2.gz OQOOYDZRHYYBAB-LLVKDONJSA-N -1 3 370.844 3.522 20 0 FHADHM CCc1ccc(N[C@H](C)C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1 ZINC000736691133 599558129 /nfs/dbraw/zinc/55/81/29/599558129.db2.gz OQOOYDZRHYYBAB-LLVKDONJSA-N -1 3 370.844 3.522 20 0 FHADHM Cc1ccc([C@H]2[C@@H](C)CCCN2C(=O)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000737330369 599558433 /nfs/dbraw/zinc/55/84/33/599558433.db2.gz NJJASKYQYZEOOL-HNAYVOBHSA-N -1 3 361.449 3.789 20 0 FHADHM Cc1ccc([C@H]2[C@@H](C)CCCN2C(=O)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000737330369 599558435 /nfs/dbraw/zinc/55/84/35/599558435.db2.gz NJJASKYQYZEOOL-HNAYVOBHSA-N -1 3 361.449 3.789 20 0 FHADHM Cc1ccc([C@H]2CCCCCN2C(=O)c2sccc2-c2nnn[n-]2)o1 ZINC000737330411 599561006 /nfs/dbraw/zinc/56/10/06/599561006.db2.gz NLSKSKKPJXGXKE-CYBMUJFWSA-N -1 3 357.439 3.587 20 0 FHADHM Cc1ccc([C@H]2CCCCCN2C(=O)c2sccc2-c2nn[n-]n2)o1 ZINC000737330411 599561007 /nfs/dbraw/zinc/56/10/07/599561007.db2.gz NLSKSKKPJXGXKE-CYBMUJFWSA-N -1 3 357.439 3.587 20 0 FHADHM O=C(NC(C1CC1)C1CC1)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737997381 599563024 /nfs/dbraw/zinc/56/30/24/599563024.db2.gz VCCKYTRMCVTOLR-UHFFFAOYSA-N -1 3 374.448 3.529 20 0 FHADHM O=C(c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1)N1CCC[C@@H]1C1CC1 ZINC000738273818 599568835 /nfs/dbraw/zinc/56/88/35/599568835.db2.gz NLVCVZSSJLOEFH-LJQANCHMSA-N -1 3 374.448 3.625 20 0 FHADHM Clc1cc(NCc2coc(-c3ccccc3)n2)ccc1-c1nnn[n-]1 ZINC000822567717 599586132 /nfs/dbraw/zinc/58/61/32/599586132.db2.gz FSWVSAMLHNIWLL-UHFFFAOYSA-N -1 3 352.785 3.787 20 0 FHADHM Clc1cc(NCc2coc(-c3ccccc3)n2)ccc1-c1nn[n-]n1 ZINC000822567717 599586134 /nfs/dbraw/zinc/58/61/34/599586134.db2.gz FSWVSAMLHNIWLL-UHFFFAOYSA-N -1 3 352.785 3.787 20 0 FHADHM Cc1ccccc1[C@H]1C[C@H](C)N(C(=O)Nc2cccc(-c3nnn[n-]3)c2)C1 ZINC000737421469 599600065 /nfs/dbraw/zinc/60/00/65/599600065.db2.gz NIQLTMFQXXYAAV-HOCLYGCPSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1ccccc1[C@H]1C[C@H](C)N(C(=O)Nc2cccc(-c3nn[n-]n3)c2)C1 ZINC000737421469 599600067 /nfs/dbraw/zinc/60/00/67/599600067.db2.gz NIQLTMFQXXYAAV-HOCLYGCPSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1sc(NC(=O)[C@@H]2SCCc3ccccc32)c(-c2nnn[n-]2)c1C ZINC000822557004 599628916 /nfs/dbraw/zinc/62/89/16/599628916.db2.gz DXIQCAMDPBKSKD-CQSZACIVSA-N -1 3 371.491 3.514 20 0 FHADHM Cc1sc(NC(=O)[C@@H]2SCCc3ccccc32)c(-c2nn[n-]n2)c1C ZINC000822557004 599628917 /nfs/dbraw/zinc/62/89/17/599628917.db2.gz DXIQCAMDPBKSKD-CQSZACIVSA-N -1 3 371.491 3.514 20 0 FHADHM C[C@]1(C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)CCc2ccccc2C1 ZINC000820578084 599629210 /nfs/dbraw/zinc/62/92/10/599629210.db2.gz XAHARXSFKCAAAP-IBGZPJMESA-N -1 3 367.840 3.654 20 0 FHADHM C[C@]1(C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)CCc2ccccc2C1 ZINC000820578084 599629211 /nfs/dbraw/zinc/62/92/11/599629211.db2.gz XAHARXSFKCAAAP-IBGZPJMESA-N -1 3 367.840 3.654 20 0 FHADHM CC[C@@H](NCc1cccc(-c2nn[n-]n2)c1)c1nc(C(F)(F)F)cs1 ZINC000820925347 599646960 /nfs/dbraw/zinc/64/69/60/599646960.db2.gz HQKRHASFWORFMO-LLVKDONJSA-N -1 3 368.388 3.583 20 0 FHADHM Cc1ncccc1NC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000822478407 599657269 /nfs/dbraw/zinc/65/72/69/599657269.db2.gz RPUALPAUIDFEEJ-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ncccc1NC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000822478407 599657270 /nfs/dbraw/zinc/65/72/70/599657270.db2.gz RPUALPAUIDFEEJ-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccc(-c2nc(CN[C@@H](C)c3ccc(-c4nn[n-]n4)cc3)co2)cc1 ZINC000822214085 599664775 /nfs/dbraw/zinc/66/47/75/599664775.db2.gz OVFFJWLGLWXOEG-AWEZNQCLSA-N -1 3 360.421 3.681 20 0 FHADHM C[C@H](NC(=O)N[C@@H]1CC[C@H]2CCCC[C@@H]2C1)c1cccc(-c2nnn[n-]2)c1 ZINC000820356679 599667036 /nfs/dbraw/zinc/66/70/36/599667036.db2.gz ASXSHRLTHOBHLN-GARXJVFOSA-N -1 3 368.485 3.586 20 0 FHADHM C[C@H](NC(=O)N[C@@H]1CC[C@H]2CCCC[C@@H]2C1)c1cccc(-c2nn[n-]n2)c1 ZINC000820356679 599667037 /nfs/dbraw/zinc/66/70/37/599667037.db2.gz ASXSHRLTHOBHLN-GARXJVFOSA-N -1 3 368.485 3.586 20 0 FHADHM Cc1cccc(NC(=O)N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1Cl ZINC000822323787 599694026 /nfs/dbraw/zinc/69/40/26/599694026.db2.gz OCQPTSNTXLTZPL-LLVKDONJSA-N -1 3 356.817 3.711 20 0 FHADHM Cc1cccc(NC(=O)N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1Cl ZINC000822323787 599694027 /nfs/dbraw/zinc/69/40/27/599694027.db2.gz OCQPTSNTXLTZPL-LLVKDONJSA-N -1 3 356.817 3.711 20 0 FHADHM CCOc1ccccc1[C@@H](CC(C)C)NCc1ccc(-c2nnn[n-]2)o1 ZINC000821430692 599695319 /nfs/dbraw/zinc/69/53/19/599695319.db2.gz DHEGZDSOUSPRLF-MRXNPFEDSA-N -1 3 355.442 3.735 20 0 FHADHM CCOc1ccccc1[C@@H](CC(C)C)NCc1ccc(-c2nn[n-]n2)o1 ZINC000821430692 599695320 /nfs/dbraw/zinc/69/53/20/599695320.db2.gz DHEGZDSOUSPRLF-MRXNPFEDSA-N -1 3 355.442 3.735 20 0 FHADHM C[C@H](c1ccc(C(=O)[O-])o1)N1CCC(C(=O)Nc2cccc(F)c2)CC1 ZINC000736715708 599716985 /nfs/dbraw/zinc/71/69/85/599716985.db2.gz VZYIVSVLYTVXIK-GFCCVEGCSA-N -1 3 360.385 3.529 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccc(C(C)C)nc2)c1-c1nnn[n-]1 ZINC000821465485 607393712 /nfs/dbraw/zinc/39/37/12/607393712.db2.gz JBXFAGXZJFCOQJ-UHFFFAOYSA-N -1 3 356.455 3.570 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccc(C(C)C)nc2)c1-c1nn[n-]n1 ZINC000821465485 607393714 /nfs/dbraw/zinc/39/37/14/607393714.db2.gz JBXFAGXZJFCOQJ-UHFFFAOYSA-N -1 3 356.455 3.570 20 0 FHADHM C[C@@H](N[C@H](c1ccccc1)C1CCC1)C(=O)NCc1ccc(C(=O)[O-])cc1 ZINC000736661637 599792746 /nfs/dbraw/zinc/79/27/46/599792746.db2.gz GOEHKCIXAVAHBB-FOIQADDNSA-N -1 3 366.461 3.521 20 0 FHADHM Cc1ccc(C(=O)[O-])cc1NC(=O)CN[C@@H](c1ccccc1)C1CCC1 ZINC000738533952 599793127 /nfs/dbraw/zinc/79/31/27/599793127.db2.gz WVJGHLPZSIYEDP-FQEVSTJZSA-N -1 3 352.434 3.763 20 0 FHADHM CC[C@@H](C(=O)Nc1ccc(OC(C)C)c(-c2nnn[n-]2)c1)c1ccccc1 ZINC000820843411 607400714 /nfs/dbraw/zinc/40/07/14/607400714.db2.gz YKGZZIOEVVXXNM-MRXNPFEDSA-N -1 3 365.437 3.786 20 0 FHADHM CC[C@@H](C(=O)Nc1ccc(OC(C)C)c(-c2nn[n-]n2)c1)c1ccccc1 ZINC000820843411 607400716 /nfs/dbraw/zinc/40/07/16/607400716.db2.gz YKGZZIOEVVXXNM-MRXNPFEDSA-N -1 3 365.437 3.786 20 0 FHADHM O=C([O-])c1ccc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)o1 ZINC000581197231 599851515 /nfs/dbraw/zinc/85/15/15/599851515.db2.gz YYMDTUWJYVKTDE-CYBMUJFWSA-N -1 3 371.368 3.547 20 0 FHADHM O=C([O-])c1coc(CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)c1 ZINC000566359375 599851828 /nfs/dbraw/zinc/85/18/28/599851828.db2.gz UWZWRGRWZVYRCB-ZDUSSCGKSA-N -1 3 371.368 3.547 20 0 FHADHM COc1ccc([C@H](NCc2cccc(OCC(F)(F)F)c2)C(=O)[O-])cc1 ZINC000737970653 599856918 /nfs/dbraw/zinc/85/69/18/599856918.db2.gz NMRZGNBGJZPNBN-INIZCTEOSA-N -1 3 369.339 3.552 20 0 FHADHM CC(C)Oc1ccc(NC(=O)c2cccc(Cl)c2)cc1-c1nnn[n-]1 ZINC000820174857 607402422 /nfs/dbraw/zinc/40/24/22/607402422.db2.gz ZKLGTOGITMATOC-UHFFFAOYSA-N -1 3 357.801 3.560 20 0 FHADHM CC(C)Oc1ccc(NC(=O)c2cccc(Cl)c2)cc1-c1nn[n-]n1 ZINC000820174857 607402424 /nfs/dbraw/zinc/40/24/24/607402424.db2.gz ZKLGTOGITMATOC-UHFFFAOYSA-N -1 3 357.801 3.560 20 0 FHADHM O=C([O-])Nc1cccc(C(=O)N[C@H](CN2CCCCC2)c2ccccc2)c1 ZINC000740029507 599936809 /nfs/dbraw/zinc/93/68/09/599936809.db2.gz ROMCYHGWQBZVTO-LJQANCHMSA-N -1 3 367.449 3.734 20 0 FHADHM Cc1cc(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)ccc1C(=O)[O-] ZINC000738441215 600012455 /nfs/dbraw/zinc/01/24/55/600012455.db2.gz JWENICLUIDUHOI-MAUKXSAKSA-N -1 3 367.449 3.650 20 0 FHADHM C[C@H](NCc1ccc(-c2ccc(C(=O)[O-])cc2)o1)[C@H](O)c1ccccc1 ZINC000020875546 600037874 /nfs/dbraw/zinc/03/78/74/600037874.db2.gz GTZDQPHUJRUZKY-XOBRGWDASA-N -1 3 351.402 3.857 20 0 FHADHM C[C@@H](c1ccc(C(=O)[O-])o1)N1CCC(c2nc(-c3ccccc3)no2)CC1 ZINC000652409934 600104607 /nfs/dbraw/zinc/10/46/07/600104607.db2.gz CMQHQUDIJOSOLF-ZDUSSCGKSA-N -1 3 367.405 3.968 20 0 FHADHM Cc1ccsc1[C@H]1C[C@H]1C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000826316121 607430988 /nfs/dbraw/zinc/43/09/88/607430988.db2.gz DGOYQIMEVIFXGL-QWHCGFSZSA-N -1 3 370.482 3.535 20 0 FHADHM Cc1ccsc1[C@H]1C[C@H]1C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000826316121 607430989 /nfs/dbraw/zinc/43/09/89/607430989.db2.gz DGOYQIMEVIFXGL-QWHCGFSZSA-N -1 3 370.482 3.535 20 0 FHADHM Cc1ccsc1CCCC(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000826316783 607431151 /nfs/dbraw/zinc/43/11/51/607431151.db2.gz YNHFXKVYWBBHBX-UHFFFAOYSA-N -1 3 372.498 3.755 20 0 FHADHM Cc1ccsc1CCCC(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000826316783 607431152 /nfs/dbraw/zinc/43/11/52/607431152.db2.gz YNHFXKVYWBBHBX-UHFFFAOYSA-N -1 3 372.498 3.755 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1[C@H](C)C[C@@H](c2ccccc2)[C@H]1C ZINC000826244614 607432032 /nfs/dbraw/zinc/43/20/32/607432032.db2.gz YRIGFQHWBDNJPQ-SPYBWZPUSA-N -1 3 361.449 3.582 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1[C@H](C)C[C@@H](c2ccccc2)[C@H]1C ZINC000826244614 607432034 /nfs/dbraw/zinc/43/20/34/607432034.db2.gz YRIGFQHWBDNJPQ-SPYBWZPUSA-N -1 3 361.449 3.582 20 0 FHADHM CC[C@](NCc1cc(=O)oc2c(C)c(C)ccc12)(C(=O)[O-])c1ccccc1 ZINC000736915057 600305691 /nfs/dbraw/zinc/30/56/91/600305691.db2.gz BXACIYGFWJUBSZ-JOCHJYFZSA-N -1 3 365.429 3.890 20 0 FHADHM O=C([O-])CCN(Cc1ccc(-n2ccnc2)cc1)Cc1ccc(F)c(F)c1 ZINC000739725131 600329429 /nfs/dbraw/zinc/32/94/29/600329429.db2.gz SWZSQYPXYRXUNT-UHFFFAOYSA-N -1 3 371.387 3.627 20 0 FHADHM O=C([O-])[C@H](NCc1ccccc1Cn1cccn1)c1cccc(Cl)c1 ZINC000739505566 600419817 /nfs/dbraw/zinc/41/98/17/600419817.db2.gz SDDGFFWMJGBONW-GOSISDBHSA-N -1 3 355.825 3.500 20 0 FHADHM O=C([O-])[C@@H](NCc1ccc(Cn2cccn2)cc1)c1cccc(Cl)c1 ZINC000739500547 600420911 /nfs/dbraw/zinc/42/09/11/600420911.db2.gz ORUTUSPMLQKXEF-SFHVURJKSA-N -1 3 355.825 3.500 20 0 FHADHM CC[C@@H](C)C(=O)Nc1cccc(CN[C@@H](C(=O)[O-])c2ccc(F)cc2)c1 ZINC000736870169 600424888 /nfs/dbraw/zinc/42/48/88/600424888.db2.gz JWZBTTCBKFQIEN-FZKQIMNGSA-N -1 3 358.413 3.726 20 0 FHADHM CN(C(=O)CCc1ccc2ccccc2c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825818057 607443578 /nfs/dbraw/zinc/44/35/78/607443578.db2.gz UNAFUOMLBIALPJ-UHFFFAOYSA-N -1 3 357.417 3.616 20 0 FHADHM CN(C(=O)CCc1ccc2ccccc2c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825818057 607443579 /nfs/dbraw/zinc/44/35/79/607443579.db2.gz UNAFUOMLBIALPJ-UHFFFAOYSA-N -1 3 357.417 3.616 20 0 FHADHM COc1ccc(CN[C@@H](C(=O)[O-])c2ccc(F)cc2)c(C(F)(F)F)c1 ZINC000738008555 600433215 /nfs/dbraw/zinc/43/32/15/600433215.db2.gz NWNBNCXPBBDHHX-OAHLLOKOSA-N -1 3 357.303 3.769 20 0 FHADHM O=C([O-])[C@@H](c1ccc(F)cc1)N1CCC[C@@H](C(=O)c2ccc(F)cc2)C1 ZINC000580456705 600440542 /nfs/dbraw/zinc/44/05/42/600440542.db2.gz NQQDEECYYWMWSE-CRAIPNDOSA-N -1 3 359.372 3.685 20 0 FHADHM Cc1ccc(C(=O)[O-])cc1NC(=O)[C@H](C)N1CCC[C@]2(CC=CCC2)C1 ZINC000738518665 600448959 /nfs/dbraw/zinc/44/89/59/600448959.db2.gz MPAJSEOISUTNFZ-HRAATJIYSA-N -1 3 356.466 3.843 20 0 FHADHM CC(C)[C@@H](c1ccccc1)N(C)CC(=O)NCc1ccc(NC(=O)[O-])cc1 ZINC000736389782 600540917 /nfs/dbraw/zinc/54/09/17/600540917.db2.gz DCXQHJLNRTWCLK-FQEVSTJZSA-N -1 3 369.465 3.722 20 0 FHADHM Cc1nc2ccc(Br)cc2c(N2CCC(C(=O)[O-])CC2)c1C ZINC000263533612 600671261 /nfs/dbraw/zinc/67/12/61/600671261.db2.gz XXNYDVVERLCWDL-UHFFFAOYSA-N -1 3 363.255 3.915 20 0 FHADHM Cc1cc(F)ccc1N(Cc1ccncc1)Cc1cccc(-c2nnn[n-]2)c1 ZINC000826269001 607465353 /nfs/dbraw/zinc/46/53/53/607465353.db2.gz XDLZBAHPEQKVHX-UHFFFAOYSA-N -1 3 374.423 3.916 20 0 FHADHM Cc1cc(F)ccc1N(Cc1ccncc1)Cc1cccc(-c2nn[n-]n2)c1 ZINC000826269001 607465354 /nfs/dbraw/zinc/46/53/54/607465354.db2.gz XDLZBAHPEQKVHX-UHFFFAOYSA-N -1 3 374.423 3.916 20 0 FHADHM Cc1ccc([C@H]2CCC[C@@H]2N(C)CC(=O)Nc2ccsc2C(=O)[O-])cc1 ZINC000832931267 600840143 /nfs/dbraw/zinc/84/01/43/600840143.db2.gz VFVRFYRPFVOOSV-WBVHZDCISA-N -1 3 372.490 3.961 20 0 FHADHM Cc1ccc(C(=O)[O-])cc1NC(=O)[C@H](C)N1CC[C@@H](Cc2ccccc2)C1 ZINC000738518446 600968029 /nfs/dbraw/zinc/96/80/29/600968029.db2.gz LHQBVVOUWYPYEE-WMZOPIPTSA-N -1 3 366.461 3.585 20 0 FHADHM O=C([O-])[C@H]1Cc2ccccc2CN1Cc1ccccc1OCC(F)(F)F ZINC000833193991 600982274 /nfs/dbraw/zinc/98/22/74/600982274.db2.gz WNQIGRJBBAVWHM-MRXNPFEDSA-N -1 3 365.351 3.639 20 0 FHADHM CN(c1nc(Cl)c(C(=O)[O-])s1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000388497334 600986959 /nfs/dbraw/zinc/98/69/59/600986959.db2.gz FLQWUTWEIUDUIH-CYBMUJFWSA-N -1 3 365.886 3.596 20 0 FHADHM O=C([O-])[C@H](c1ccccc1F)N1CCC([C@H](O)c2ccc(F)cc2)CC1 ZINC000833172574 601005879 /nfs/dbraw/zinc/00/58/79/601005879.db2.gz JQJIOIGBNSRDFL-RBUKOAKNSA-N -1 3 361.388 3.536 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1CNc1ccc(N2CCCC2)c(Cl)c1 ZINC000822744123 607489628 /nfs/dbraw/zinc/48/96/28/607489628.db2.gz MVAZUQRABVAIPE-UHFFFAOYSA-N -1 3 372.835 3.872 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CNc1ccc(N2CCCC2)c(Cl)c1 ZINC000822744123 607489630 /nfs/dbraw/zinc/48/96/30/607489630.db2.gz MVAZUQRABVAIPE-UHFFFAOYSA-N -1 3 372.835 3.872 20 0 FHADHM CCc1ccc2c(CN[C@H](c3ccccc3)[C@@H](C)C(=O)[O-])cc(=O)oc2c1 ZINC000830259687 601204227 /nfs/dbraw/zinc/20/42/27/601204227.db2.gz CQURMKZSJFOKQD-SZNDQCEHSA-N -1 3 365.429 3.907 20 0 FHADHM Cc1ccc(NC(=O)CN[C@H](c2ccccc2)[C@H](C)C(=O)[O-])cc1Cl ZINC000832943568 601205409 /nfs/dbraw/zinc/20/54/09/601205409.db2.gz GVFXOOSGJGFPJR-UGSOOPFHSA-N -1 3 360.841 3.639 20 0 FHADHM Cc1ccc2c(CN[C@@H](c3ccccc3)[C@H](C)C(=O)[O-])cc(=O)oc2c1C ZINC000832962625 601205559 /nfs/dbraw/zinc/20/55/59/601205559.db2.gz ZIJUUJKZDOFKNE-MGPUTAFESA-N -1 3 365.429 3.961 20 0 FHADHM O=C([O-])[C@H](c1ccc(Cl)cc1Cl)N1CCC[C@@H](c2ncc[nH]2)C1 ZINC000833172079 601382048 /nfs/dbraw/zinc/38/20/48/601382048.db2.gz RFIBJEPJMQJWEO-YGRLFVJLSA-N -1 3 354.237 3.722 20 0 FHADHM Cc1ccc(C)c(NC(=O)[C@H](c2ccccc2)N2C[C@H](C(=O)[O-])[C@H](C)C2)c1 ZINC000832926641 601538987 /nfs/dbraw/zinc/53/89/87/601538987.db2.gz XWRFFRCMDXCXLF-KPFFTGBYSA-N -1 3 366.461 3.636 20 0 FHADHM Cc1cc(C)c(NC(=O)CN[C@@H](c2ccccc2)[C@@H](C)C(=O)[O-])c(Cl)c1 ZINC000832875520 601655019 /nfs/dbraw/zinc/65/50/19/601655019.db2.gz YYARXAXWHCADSO-AUUYWEPGSA-N -1 3 374.868 3.947 20 0 FHADHM CN(C[C@@H]1CCCN(Cc2ccc(C(=O)[O-])s2)C1)C(=O)OC(C)(C)C ZINC000830718376 601947860 /nfs/dbraw/zinc/94/78/60/601947860.db2.gz QVOXMDOQAAZESC-ZDUSSCGKSA-N -1 3 368.499 3.525 20 0 FHADHM C[C@@H](c1nnc(-c2ccc(Cl)cc2Cl)o1)N1C[C@H](C(=O)[O-])[C@H](C)C1 ZINC000828421484 601963691 /nfs/dbraw/zinc/96/36/91/601963691.db2.gz GDADWBHLTXXLSC-PTRXPTGYSA-N -1 3 370.236 3.757 20 0 FHADHM COc1ccc(CSCc2ccn(C3CCCC3)n2)cc1-c1nnn[n-]1 ZINC000826207996 607536672 /nfs/dbraw/zinc/53/66/72/607536672.db2.gz NZAAGAZOBWGKCP-UHFFFAOYSA-N -1 3 370.482 3.620 20 0 FHADHM COc1ccc(CSCc2ccn(C3CCCC3)n2)cc1-c1nn[n-]n1 ZINC000826207996 607536673 /nfs/dbraw/zinc/53/66/73/607536673.db2.gz NZAAGAZOBWGKCP-UHFFFAOYSA-N -1 3 370.482 3.620 20 0 FHADHM CCOc1ccc([C@H](C)N[C@H](C(=O)[O-])c2cc(OC)cc(OC)c2)cc1 ZINC000830063887 602165586 /nfs/dbraw/zinc/16/55/86/602165586.db2.gz LUVHAPRTGHLFKC-DJJJIMSYSA-N -1 3 359.422 3.579 20 0 FHADHM COc1cc(OC)cc([C@@H](N[C@H](C)c2ccc(F)c(Cl)c2)C(=O)[O-])c1 ZINC000832049383 602168531 /nfs/dbraw/zinc/16/85/31/602168531.db2.gz HHKQQCIOOTUTJR-BMLIUANNSA-N -1 3 367.804 3.973 20 0 FHADHM COc1cc(OC)cc([C@@H](NCc2ccccc2C(F)(F)F)C(=O)[O-])c1 ZINC000832056514 602170241 /nfs/dbraw/zinc/17/02/41/602170241.db2.gz FJAKMHQEMBXJAH-MRXNPFEDSA-N -1 3 369.339 3.638 20 0 FHADHM Fc1cc(NCc2nccs2)ccc1Oc1ccccc1-c1nnn[n-]1 ZINC000826372674 607552822 /nfs/dbraw/zinc/55/28/22/607552822.db2.gz HPPUKZHKKSDCPA-UHFFFAOYSA-N -1 3 368.397 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CC(=CC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1cccc(Cl)c1 ZINC000819765321 606116674 /nfs/dbraw/zinc/11/66/74/606116674.db2.gz OHOHMPQGTZLGSA-SUIFULHWSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=CC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1cccc(Cl)c1 ZINC000819765321 606116675 /nfs/dbraw/zinc/11/66/75/606116675.db2.gz OHOHMPQGTZLGSA-SUIFULHWSA-N -1 3 367.840 3.801 20 0 FHADHM CC[C@H](C)[C@@H](C)N(C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)C1CC1 ZINC000820859353 606116916 /nfs/dbraw/zinc/11/69/16/606116916.db2.gz DIXQNXOEKQFXIX-MELADBBJSA-N -1 3 356.474 3.536 20 0 FHADHM CC[C@H](C)[C@@H](C)N(C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)C1CC1 ZINC000820859353 606116917 /nfs/dbraw/zinc/11/69/17/606116917.db2.gz DIXQNXOEKQFXIX-MELADBBJSA-N -1 3 356.474 3.536 20 0 FHADHM CC(C)(C)c1ncsc1C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000819971640 606121355 /nfs/dbraw/zinc/12/13/55/606121355.db2.gz PIRQPSNTUYQZKL-UHFFFAOYSA-N -1 3 362.846 3.526 20 0 FHADHM CC(C)(C)c1ncsc1C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000819971640 606121356 /nfs/dbraw/zinc/12/13/56/606121356.db2.gz PIRQPSNTUYQZKL-UHFFFAOYSA-N -1 3 362.846 3.526 20 0 FHADHM O=C(C/C=C/c1cccc(F)c1)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000822946169 606123491 /nfs/dbraw/zinc/12/34/91/606123491.db2.gz WLDSYTRHPHAOJY-DUXPYHPUSA-N -1 3 357.776 3.701 20 0 FHADHM O=C(C/C=C/c1cccc(F)c1)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000822946169 606123492 /nfs/dbraw/zinc/12/34/92/606123492.db2.gz WLDSYTRHPHAOJY-DUXPYHPUSA-N -1 3 357.776 3.701 20 0 FHADHM C[C@H](C(=O)N(Cc1ccco1)c1ccccc1-c1nnn[n-]1)C1CCCC1 ZINC000819856311 606126126 /nfs/dbraw/zinc/12/61/26/606126126.db2.gz HSTSBYQZTXSBMO-AWEZNQCLSA-N -1 3 365.437 3.819 20 0 FHADHM C[C@H](C(=O)N(Cc1ccco1)c1ccccc1-c1nn[n-]n1)C1CCCC1 ZINC000819856311 606126128 /nfs/dbraw/zinc/12/61/28/606126128.db2.gz HSTSBYQZTXSBMO-AWEZNQCLSA-N -1 3 365.437 3.819 20 0 FHADHM COCc1ccccc1CNc1ccc(C(F)(F)F)cc1-c1nnn[n-]1 ZINC000821696170 606174407 /nfs/dbraw/zinc/17/44/07/606174407.db2.gz ZMMCAPBYWCUEKZ-UHFFFAOYSA-N -1 3 363.343 3.644 20 0 FHADHM COCc1ccccc1CNc1ccc(C(F)(F)F)cc1-c1nn[n-]n1 ZINC000821696170 606174408 /nfs/dbraw/zinc/17/44/08/606174408.db2.gz ZMMCAPBYWCUEKZ-UHFFFAOYSA-N -1 3 363.343 3.644 20 0 FHADHM O=C(Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1)[C@@H]1C[C@@H]1C1CC1 ZINC000823350527 606237979 /nfs/dbraw/zinc/23/79/79/606237979.db2.gz QIVLLZYZMZAIKY-QZTJIDSGSA-N -1 3 361.405 3.644 20 0 FHADHM O=C(Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1)[C@@H]1C[C@@H]1C1CC1 ZINC000823350527 606237981 /nfs/dbraw/zinc/23/79/81/606237981.db2.gz QIVLLZYZMZAIKY-QZTJIDSGSA-N -1 3 361.405 3.644 20 0 FHADHM O=C(Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)[C@@H]1C[C@H]1C1CC1 ZINC000823368306 606247827 /nfs/dbraw/zinc/24/78/27/606247827.db2.gz UBJYFTPLHMLQRS-ZWKOTPCHSA-N -1 3 361.405 3.644 20 0 FHADHM O=C(Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)[C@@H]1C[C@H]1C1CC1 ZINC000823368306 606247829 /nfs/dbraw/zinc/24/78/29/606247829.db2.gz UBJYFTPLHMLQRS-ZWKOTPCHSA-N -1 3 361.405 3.644 20 0 FHADHM Cc1cc(Oc2ccccc2)ccc1NC(=O)c1cc(-c2nnn[n-]2)cn1C ZINC000822211863 606251337 /nfs/dbraw/zinc/25/13/37/606251337.db2.gz RKCXMWDRIKVYNO-UHFFFAOYSA-N -1 3 374.404 3.558 20 0 FHADHM Cc1cc(Oc2ccccc2)ccc1NC(=O)c1cc(-c2nn[n-]n2)cn1C ZINC000822211863 606251338 /nfs/dbraw/zinc/25/13/38/606251338.db2.gz RKCXMWDRIKVYNO-UHFFFAOYSA-N -1 3 374.404 3.558 20 0 FHADHM CCCN(C(=O)c1cc(-c2nnn[n-]2)c[nH]1)[C@H](C)c1cc2ccccc2o1 ZINC000821082503 606260412 /nfs/dbraw/zinc/26/04/12/606260412.db2.gz LVQLAQSFZCLCJU-GFCCVEGCSA-N -1 3 364.409 3.554 20 0 FHADHM CCCN(C(=O)c1cc(-c2nn[n-]n2)c[nH]1)[C@H](C)c1cc2ccccc2o1 ZINC000821082503 606260413 /nfs/dbraw/zinc/26/04/13/606260413.db2.gz LVQLAQSFZCLCJU-GFCCVEGCSA-N -1 3 364.409 3.554 20 0 FHADHM Cc1c2cc(F)ccc2sc1C(=O)Nc1ccc(F)cc1-c1nnn[n-]1 ZINC000822020863 606264899 /nfs/dbraw/zinc/26/48/99/606264899.db2.gz LKTKBMDTLGEBTK-UHFFFAOYSA-N -1 3 371.372 3.920 20 0 FHADHM Cc1c2cc(F)ccc2sc1C(=O)Nc1ccc(F)cc1-c1nn[n-]n1 ZINC000822020863 606264901 /nfs/dbraw/zinc/26/49/01/606264901.db2.gz LKTKBMDTLGEBTK-UHFFFAOYSA-N -1 3 371.372 3.920 20 0 FHADHM CC(C)c1cccc(O[C@@H](C)C(=O)Nc2ccc(F)cc2-c2nnn[n-]2)c1 ZINC000820536822 606269825 /nfs/dbraw/zinc/26/98/25/606269825.db2.gz XTEFCNYDCKJTJL-LBPRGKRZSA-N -1 3 369.400 3.535 20 0 FHADHM CC(C)c1cccc(O[C@@H](C)C(=O)Nc2ccc(F)cc2-c2nn[n-]n2)c1 ZINC000820536822 606269827 /nfs/dbraw/zinc/26/98/27/606269827.db2.gz XTEFCNYDCKJTJL-LBPRGKRZSA-N -1 3 369.400 3.535 20 0 FHADHM CCCCN(C(=O)c1cc(-c2nnn[n-]2)c[nH]1)[C@H](CC)c1ccccc1 ZINC000821061117 606275167 /nfs/dbraw/zinc/27/51/67/606275167.db2.gz NEEATXXYRFGAKP-QGZVFWFLSA-N -1 3 352.442 3.588 20 0 FHADHM CCCCN(C(=O)c1cc(-c2nn[n-]n2)c[nH]1)[C@H](CC)c1ccccc1 ZINC000821061117 606275169 /nfs/dbraw/zinc/27/51/69/606275169.db2.gz NEEATXXYRFGAKP-QGZVFWFLSA-N -1 3 352.442 3.588 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cccc(C(F)F)c1 ZINC000821123161 606282041 /nfs/dbraw/zinc/28/20/41/606282041.db2.gz LOROWDZRVMFFEX-UHFFFAOYSA-N -1 3 372.379 3.879 20 0 FHADHM Fc1ccccc1-c1nc(CNc2cccc(-c3nnn[n-]3)c2)cs1 ZINC000822792252 606309830 /nfs/dbraw/zinc/30/98/30/606309830.db2.gz SQIRORVQCBSRGY-UHFFFAOYSA-N -1 3 352.398 3.741 20 0 FHADHM Fc1ccccc1-c1nc(CNc2cccc(-c3nn[n-]n3)c2)cs1 ZINC000822792252 606309832 /nfs/dbraw/zinc/30/98/32/606309832.db2.gz SQIRORVQCBSRGY-UHFFFAOYSA-N -1 3 352.398 3.741 20 0 FHADHM C[C@@H](Sc1cccc(-c2nnn[n-]2)c1)C(=O)Nc1ccc(Cl)cc1 ZINC000820554898 606324888 /nfs/dbraw/zinc/32/48/88/606324888.db2.gz AYJKZXPRVFZEPN-SNVBAGLBSA-N -1 3 359.842 3.639 20 0 FHADHM C[C@@H](Sc1cccc(-c2nn[n-]n2)c1)C(=O)Nc1ccc(Cl)cc1 ZINC000820554898 606324889 /nfs/dbraw/zinc/32/48/89/606324889.db2.gz AYJKZXPRVFZEPN-SNVBAGLBSA-N -1 3 359.842 3.639 20 0 FHADHM CCC(CC)N(CC(C)C)C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820897697 606328947 /nfs/dbraw/zinc/32/89/47/606328947.db2.gz LZKPHEFQUWBSGZ-CQSZACIVSA-N -1 3 358.490 3.784 20 0 FHADHM CCC(CC)N(CC(C)C)C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820897697 606328949 /nfs/dbraw/zinc/32/89/49/606328949.db2.gz LZKPHEFQUWBSGZ-CQSZACIVSA-N -1 3 358.490 3.784 20 0 FHADHM C[C@@H](OC(=O)C(C)(C)c1ccc(F)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820479709 606339689 /nfs/dbraw/zinc/33/96/89/606339689.db2.gz BDXAZJYMXMEZBY-GFCCVEGCSA-N -1 3 354.385 3.588 20 0 FHADHM C[C@@H](OC(=O)C(C)(C)c1ccc(F)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820479709 606339691 /nfs/dbraw/zinc/33/96/91/606339691.db2.gz BDXAZJYMXMEZBY-GFCCVEGCSA-N -1 3 354.385 3.588 20 0 FHADHM C[C@H](OC(=O)c1cc2cc(F)ccc2o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820508260 606341168 /nfs/dbraw/zinc/34/11/68/606341168.db2.gz NGOYAJOKTAROOG-JTQLQIEISA-N -1 3 352.325 3.670 20 0 FHADHM C[C@H](OC(=O)c1cc2cc(F)ccc2o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820508260 606341170 /nfs/dbraw/zinc/34/11/70/606341170.db2.gz NGOYAJOKTAROOG-JTQLQIEISA-N -1 3 352.325 3.670 20 0 FHADHM Cc1cccc(CSCC(=O)O[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000822303712 606341527 /nfs/dbraw/zinc/34/15/27/606341527.db2.gz GNIPSYBKHMNSMN-CQSZACIVSA-N -1 3 368.462 3.713 20 0 FHADHM Cc1cccc(CSCC(=O)O[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000822303712 606341529 /nfs/dbraw/zinc/34/15/29/606341529.db2.gz GNIPSYBKHMNSMN-CQSZACIVSA-N -1 3 368.462 3.713 20 0 FHADHM C[C@H](OC(=O)C/C=C\c1ccc(F)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820489072 606342076 /nfs/dbraw/zinc/34/20/76/606342076.db2.gz ZAMJNHQCEMTHNX-ZRMMWKCHSA-N -1 3 352.369 3.714 20 0 FHADHM C[C@H](OC(=O)C/C=C\c1ccc(F)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820489072 606342077 /nfs/dbraw/zinc/34/20/77/606342077.db2.gz ZAMJNHQCEMTHNX-ZRMMWKCHSA-N -1 3 352.369 3.714 20 0 FHADHM C[C@H](OC(=O)c1cc2cccc(F)c2o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820508758 606346539 /nfs/dbraw/zinc/34/65/39/606346539.db2.gz XAXGEVOSRRIBAV-JTQLQIEISA-N -1 3 352.325 3.670 20 0 FHADHM C[C@H](OC(=O)c1cc2cccc(F)c2o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820508758 606346541 /nfs/dbraw/zinc/34/65/41/606346541.db2.gz XAXGEVOSRRIBAV-JTQLQIEISA-N -1 3 352.325 3.670 20 0 FHADHM C[C@@H](C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1cccc(Cl)c1 ZINC000820481728 606346781 /nfs/dbraw/zinc/34/67/81/606346781.db2.gz ZGGDHHWVKXFKQF-NEPJUHHUSA-N -1 3 356.813 3.928 20 0 FHADHM C[C@@H](C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1cccc(Cl)c1 ZINC000820481728 606346782 /nfs/dbraw/zinc/34/67/82/606346782.db2.gz ZGGDHHWVKXFKQF-NEPJUHHUSA-N -1 3 356.813 3.928 20 0 FHADHM C[C@@H](OC(=O)[C@H](C)c1cccc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820481731 606346865 /nfs/dbraw/zinc/34/68/65/606346865.db2.gz ZGGDHHWVKXFKQF-VXGBXAGGSA-N -1 3 356.813 3.928 20 0 FHADHM C[C@@H](OC(=O)[C@H](C)c1cccc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820481731 606346867 /nfs/dbraw/zinc/34/68/67/606346867.db2.gz ZGGDHHWVKXFKQF-VXGBXAGGSA-N -1 3 356.813 3.928 20 0 FHADHM C[C@H](OC(=O)[C@H]1SCCc2ccccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488142 606350425 /nfs/dbraw/zinc/35/04/25/606350425.db2.gz LOPQJKCFJRCUEZ-SJCJKPOMSA-N -1 3 366.446 3.502 20 0 FHADHM C[C@H](OC(=O)[C@H]1SCCc2ccccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488142 606350426 /nfs/dbraw/zinc/35/04/26/606350426.db2.gz LOPQJKCFJRCUEZ-SJCJKPOMSA-N -1 3 366.446 3.502 20 0 FHADHM Cc1cc(C(=O)O[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c2ccccc2n1 ZINC000822183820 606351992 /nfs/dbraw/zinc/35/19/92/606351992.db2.gz JSHRGYOBSABJKP-ZDUSSCGKSA-N -1 3 359.389 3.641 20 0 FHADHM Cc1cc(C(=O)O[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c2ccccc2n1 ZINC000822183820 606351994 /nfs/dbraw/zinc/35/19/94/606351994.db2.gz JSHRGYOBSABJKP-ZDUSSCGKSA-N -1 3 359.389 3.641 20 0 FHADHM COc1ccc(CCCC(=O)O[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000821790960 606359967 /nfs/dbraw/zinc/35/99/67/606359967.db2.gz XNBSFAJJRITTCX-AWEZNQCLSA-N -1 3 366.421 3.502 20 0 FHADHM COc1ccc(CCCC(=O)O[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000821790960 606359969 /nfs/dbraw/zinc/35/99/69/606359969.db2.gz XNBSFAJJRITTCX-AWEZNQCLSA-N -1 3 366.421 3.502 20 0 FHADHM CS/C=C/C(=O)Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1C ZINC000821955948 606360824 /nfs/dbraw/zinc/36/08/24/606360824.db2.gz CLAKJZKXHNPSDT-MDZDMXLPSA-N -1 3 367.434 3.783 20 0 FHADHM CS/C=C/C(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1C ZINC000821955948 606360826 /nfs/dbraw/zinc/36/08/26/606360826.db2.gz CLAKJZKXHNPSDT-MDZDMXLPSA-N -1 3 367.434 3.783 20 0 FHADHM CCN(C(=O)c1cc(C)c(F)cc1F)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821161004 606362887 /nfs/dbraw/zinc/36/28/87/606362887.db2.gz SUHGMFNSYIIHFD-LBPRGKRZSA-N -1 3 371.391 3.677 20 0 FHADHM CCN(C(=O)c1cc(C)c(F)cc1F)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821161004 606362888 /nfs/dbraw/zinc/36/28/88/606362888.db2.gz SUHGMFNSYIIHFD-LBPRGKRZSA-N -1 3 371.391 3.677 20 0 FHADHM CC(=O)c1ccc2cc(OCc3ccc(F)cc3-c3nnn[n-]3)ccc2c1 ZINC000819834029 606366937 /nfs/dbraw/zinc/36/69/37/606366937.db2.gz LBHYJDCPRYBVPR-UHFFFAOYSA-N -1 3 362.364 3.941 20 0 FHADHM CC(=O)c1ccc2cc(OCc3ccc(F)cc3-c3nn[n-]n3)ccc2c1 ZINC000819834029 606366938 /nfs/dbraw/zinc/36/69/38/606366938.db2.gz LBHYJDCPRYBVPR-UHFFFAOYSA-N -1 3 362.364 3.941 20 0 FHADHM Clc1ccc2[nH]c(Sc3ccc(Cl)c(-c4nnn[n-]4)n3)nc2c1 ZINC000822582063 606440591 /nfs/dbraw/zinc/44/05/91/606440591.db2.gz PPTBZHYVJJGCFW-UHFFFAOYSA-N -1 3 364.221 3.596 20 0 FHADHM Cc1cc(C)c(-c2nnn[n-]2)c(NCc2csc(-c3ccccc3)n2)n1 ZINC000822193290 606444542 /nfs/dbraw/zinc/44/45/42/606444542.db2.gz REUXLXCWIDEXCV-UHFFFAOYSA-N -1 3 363.450 3.614 20 0 FHADHM Cc1cc(C)c(-c2nn[n-]n2)c(NCc2csc(-c3ccccc3)n2)n1 ZINC000822193290 606444543 /nfs/dbraw/zinc/44/45/43/606444543.db2.gz REUXLXCWIDEXCV-UHFFFAOYSA-N -1 3 363.450 3.614 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NCc1cccc2cccnc21 ZINC000820155259 606449811 /nfs/dbraw/zinc/44/98/11/606449811.db2.gz MPPJJLLYGYWKRB-UHFFFAOYSA-N -1 3 360.421 3.814 20 0 FHADHM C[C@@H](OC(=O)c1cc(-c2nnn[n-]2)cs1)c1ccc(F)cc1Cl ZINC000822000716 606464788 /nfs/dbraw/zinc/46/47/88/606464788.db2.gz VBWKVWPCXHYAIT-SSDOTTSWSA-N -1 3 352.778 3.639 20 0 FHADHM C[C@@H](OC(=O)c1cc(-c2nn[n-]n2)cs1)c1ccc(F)cc1Cl ZINC000822000716 606464790 /nfs/dbraw/zinc/46/47/90/606464790.db2.gz VBWKVWPCXHYAIT-SSDOTTSWSA-N -1 3 352.778 3.639 20 0 FHADHM Cc1c2ccccc2oc1[C@@H](C)OC(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000822021356 606464852 /nfs/dbraw/zinc/46/48/52/606464852.db2.gz XXCLXWPZADMJTK-SNVBAGLBSA-N -1 3 354.391 3.901 20 0 FHADHM Cc1c2ccccc2oc1[C@@H](C)OC(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000822021356 606464853 /nfs/dbraw/zinc/46/48/53/606464853.db2.gz XXCLXWPZADMJTK-SNVBAGLBSA-N -1 3 354.391 3.901 20 0 FHADHM C[C@H](OC(=O)c1cc(-c2nnn[n-]2)cs1)c1c(F)cccc1Cl ZINC000820508473 606468033 /nfs/dbraw/zinc/46/80/33/606468033.db2.gz PJTPQPOOEUIUSP-ZETCQYMHSA-N -1 3 352.778 3.639 20 0 FHADHM C[C@H](OC(=O)c1cc(-c2nn[n-]n2)cs1)c1c(F)cccc1Cl ZINC000820508473 606468035 /nfs/dbraw/zinc/46/80/35/606468035.db2.gz PJTPQPOOEUIUSP-ZETCQYMHSA-N -1 3 352.778 3.639 20 0 FHADHM C[C@@H](OC(=O)c1cc(-c2nnn[n-]2)cs1)c1c(F)cccc1Cl ZINC000820508472 606468309 /nfs/dbraw/zinc/46/83/09/606468309.db2.gz PJTPQPOOEUIUSP-SSDOTTSWSA-N -1 3 352.778 3.639 20 0 FHADHM C[C@@H](OC(=O)c1cc(-c2nn[n-]n2)cs1)c1c(F)cccc1Cl ZINC000820508472 606468310 /nfs/dbraw/zinc/46/83/10/606468310.db2.gz PJTPQPOOEUIUSP-SSDOTTSWSA-N -1 3 352.778 3.639 20 0 FHADHM Fc1cccc(SCc2cccc(OC(F)F)c2)c1-c1nnn[n-]1 ZINC000822791895 606474752 /nfs/dbraw/zinc/47/47/52/606474752.db2.gz MINNWQXCVVENFC-UHFFFAOYSA-N -1 3 352.341 3.900 20 0 FHADHM CC(C)c1ccc(CN(C(=O)c2cc(-c3nnn[n-]3)cs2)C2CC2)cc1 ZINC000820192725 606485444 /nfs/dbraw/zinc/48/54/44/606485444.db2.gz WRAWUXCUHMGREI-UHFFFAOYSA-N -1 3 367.478 3.856 20 0 FHADHM CC(C)c1ccc(CN(C(=O)c2cc(-c3nn[n-]n3)cs2)C2CC2)cc1 ZINC000820192725 606485445 /nfs/dbraw/zinc/48/54/45/606485445.db2.gz WRAWUXCUHMGREI-UHFFFAOYSA-N -1 3 367.478 3.856 20 0 FHADHM CN(Cc1cc(Cl)cc(Cl)c1)C(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000821607153 606495377 /nfs/dbraw/zinc/49/53/77/606495377.db2.gz BEUMABRFZIGJJU-UHFFFAOYSA-N -1 3 368.249 3.507 20 0 FHADHM CN(Cc1cc(Cl)cc(Cl)c1)C(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000821607153 606495379 /nfs/dbraw/zinc/49/53/79/606495379.db2.gz BEUMABRFZIGJJU-UHFFFAOYSA-N -1 3 368.249 3.507 20 0 FHADHM CCCCOc1ccc(NC(=O)c2cc(-c3nnn[n-]3)cs2)c(C)c1 ZINC000821077478 606497467 /nfs/dbraw/zinc/49/74/67/606497467.db2.gz HKNLMNLASOYMGX-UHFFFAOYSA-N -1 3 357.439 3.668 20 0 FHADHM CCCCOc1ccc(NC(=O)c2cc(-c3nn[n-]n3)cs2)c(C)c1 ZINC000821077478 606497468 /nfs/dbraw/zinc/49/74/68/606497468.db2.gz HKNLMNLASOYMGX-UHFFFAOYSA-N -1 3 357.439 3.668 20 0 FHADHM CC(C)c1ccc2c(c1)CCCN2C(=O)Cc1cccc(-c2nnn[n-]2)c1 ZINC000820191911 606508289 /nfs/dbraw/zinc/50/82/89/606508289.db2.gz AKGBJLBPZOVCES-UHFFFAOYSA-N -1 3 361.449 3.512 20 0 FHADHM CC(C)c1ccc2c(c1)CCCN2C(=O)Cc1cccc(-c2nn[n-]n2)c1 ZINC000820191911 606508291 /nfs/dbraw/zinc/50/82/91/606508291.db2.gz AKGBJLBPZOVCES-UHFFFAOYSA-N -1 3 361.449 3.512 20 0 FHADHM Cc1cccc([C@H]2CCCCCN2C(=O)c2cc(-c3nnn[n-]3)cs2)c1 ZINC000822299885 606514659 /nfs/dbraw/zinc/51/46/59/606514659.db2.gz YHFCVQBESJJMMP-MRXNPFEDSA-N -1 3 367.478 3.994 20 0 FHADHM Cc1cccc([C@H]2CCCCCN2C(=O)c2cc(-c3nn[n-]n3)cs2)c1 ZINC000822299885 606514660 /nfs/dbraw/zinc/51/46/60/606514660.db2.gz YHFCVQBESJJMMP-MRXNPFEDSA-N -1 3 367.478 3.994 20 0 FHADHM CC[C@H](Cc1ccc(C)cc1)N(CC)C(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000820913331 606519483 /nfs/dbraw/zinc/51/94/83/606519483.db2.gz FSOYNNKHBAEQQY-MRXNPFEDSA-N -1 3 369.494 3.720 20 0 FHADHM CC[C@H](Cc1ccc(C)cc1)N(CC)C(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000820913331 606519485 /nfs/dbraw/zinc/51/94/85/606519485.db2.gz FSOYNNKHBAEQQY-MRXNPFEDSA-N -1 3 369.494 3.720 20 0 FHADHM FC(F)Oc1cc(-c2nnn[n-]2)ccc1CSCCC(F)(F)F ZINC000822733244 606598733 /nfs/dbraw/zinc/59/87/33/606598733.db2.gz VAFILPFKXKMUFO-UHFFFAOYSA-N -1 3 354.304 3.654 20 0 FHADHM FC(F)Oc1cc(-c2nn[n-]n2)ccc1CSCCC(F)(F)F ZINC000822733244 606598735 /nfs/dbraw/zinc/59/87/35/606598735.db2.gz VAFILPFKXKMUFO-UHFFFAOYSA-N -1 3 354.304 3.654 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(F)cc1-c1nnn[n-]1)c1ccc2ccccc2c1 ZINC000819866220 606603267 /nfs/dbraw/zinc/60/32/67/606603267.db2.gz KXYVIRAXMXVKRM-GFCCVEGCSA-N -1 3 361.380 3.901 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(F)cc1-c1nn[n-]n1)c1ccc2ccccc2c1 ZINC000819866220 606603269 /nfs/dbraw/zinc/60/32/69/606603269.db2.gz KXYVIRAXMXVKRM-GFCCVEGCSA-N -1 3 361.380 3.901 20 0 FHADHM O=C(Nc1ccc(CCC(F)(F)F)cc1)c1sccc1-c1nnn[n-]1 ZINC000823323108 606605762 /nfs/dbraw/zinc/60/57/62/606605762.db2.gz BRJNWOOFTMIRSO-UHFFFAOYSA-N -1 3 367.356 3.675 20 0 FHADHM O=C(Nc1ccc(CCC(F)(F)F)cc1)c1sccc1-c1nn[n-]n1 ZINC000823323108 606605763 /nfs/dbraw/zinc/60/57/63/606605763.db2.gz BRJNWOOFTMIRSO-UHFFFAOYSA-N -1 3 367.356 3.675 20 0 FHADHM Cc1cc(CCCC(=O)OCc2ccc(-c3nnn[n-]3)cc2)c(C)s1 ZINC000822200217 606612971 /nfs/dbraw/zinc/61/29/71/606612971.db2.gz YTWWITXGDNJVTI-UHFFFAOYSA-N -1 3 356.451 3.611 20 0 FHADHM Cc1cc(CCCC(=O)OCc2ccc(-c3nn[n-]n3)cc2)c(C)s1 ZINC000822200217 606612973 /nfs/dbraw/zinc/61/29/73/606612973.db2.gz YTWWITXGDNJVTI-UHFFFAOYSA-N -1 3 356.451 3.611 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)ccc1OC(=O)C/C=C\c1ccc(C)cc1 ZINC000821389584 606620594 /nfs/dbraw/zinc/62/05/94/606620594.db2.gz PHEZGYKFGYTKIC-PLNGDYQASA-N -1 3 364.405 3.583 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)ccc1OC(=O)C/C=C\c1ccc(C)cc1 ZINC000821389584 606620595 /nfs/dbraw/zinc/62/05/95/606620595.db2.gz PHEZGYKFGYTKIC-PLNGDYQASA-N -1 3 364.405 3.583 20 0 FHADHM O=C(Nc1cccc(CCC(F)(F)F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000823364092 606623993 /nfs/dbraw/zinc/62/39/93/606623993.db2.gz ZHSVDUPFVCEUIG-UHFFFAOYSA-N -1 3 361.327 3.614 20 0 FHADHM O=C(Nc1cccc(CCC(F)(F)F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000823364092 606623994 /nfs/dbraw/zinc/62/39/94/606623994.db2.gz ZHSVDUPFVCEUIG-UHFFFAOYSA-N -1 3 361.327 3.614 20 0 FHADHM CC(=CC(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1)c1cccc(Cl)c1 ZINC000819766030 606626109 /nfs/dbraw/zinc/62/61/09/606626109.db2.gz UOBTWLZGJQDAEO-KXXVWKPMSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=CC(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1)c1cccc(Cl)c1 ZINC000819766030 606626111 /nfs/dbraw/zinc/62/61/11/606626111.db2.gz UOBTWLZGJQDAEO-KXXVWKPMSA-N -1 3 367.840 3.801 20 0 FHADHM Cc1ccccc1NC(=O)[C@H](C)Sc1ccc(Cl)cc1-c1nnn[n-]1 ZINC000822361463 606628836 /nfs/dbraw/zinc/62/88/36/606628836.db2.gz BQMQOSFCDHPBJM-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM Cc1ccccc1NC(=O)[C@H](C)Sc1ccc(Cl)cc1-c1nn[n-]n1 ZINC000822361463 606628839 /nfs/dbraw/zinc/62/88/39/606628839.db2.gz BQMQOSFCDHPBJM-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM Fc1ccc(-c2nc(CNc3cccc(-c4nnn[n-]4)c3)cs2)cc1 ZINC000393562831 606659453 /nfs/dbraw/zinc/65/94/53/606659453.db2.gz XIQQPAPKHPUHCD-UHFFFAOYSA-N -1 3 352.398 3.741 20 0 FHADHM Fc1ccc(-c2nc(CNc3cccc(-c4nn[n-]n4)c3)cs2)cc1 ZINC000393562831 606659454 /nfs/dbraw/zinc/65/94/54/606659454.db2.gz XIQQPAPKHPUHCD-UHFFFAOYSA-N -1 3 352.398 3.741 20 0 FHADHM COCC[C@@H](C)Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1C ZINC000821685751 606661283 /nfs/dbraw/zinc/66/12/83/606661283.db2.gz OOASXUMGFHJZBF-CQSZACIVSA-N -1 3 353.426 3.804 20 0 FHADHM COCC[C@@H](C)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1C ZINC000821685751 606661284 /nfs/dbraw/zinc/66/12/84/606661284.db2.gz OOASXUMGFHJZBF-CQSZACIVSA-N -1 3 353.426 3.804 20 0 FHADHM Cc1cccc(C(C)C)c1NC(=O)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000822288680 606663768 /nfs/dbraw/zinc/66/37/68/606663768.db2.gz GEQOTORLNNZVDX-UHFFFAOYSA-N -1 3 357.364 3.829 20 0 FHADHM Cc1cccc(C(C)C)c1NC(=O)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000822288680 606663769 /nfs/dbraw/zinc/66/37/69/606663769.db2.gz GEQOTORLNNZVDX-UHFFFAOYSA-N -1 3 357.364 3.829 20 0 FHADHM O=C(Oc1ccc(Cl)cc1Cl)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000823454353 606664168 /nfs/dbraw/zinc/66/41/68/606664168.db2.gz OCIBQNMRKLSQBL-UHFFFAOYSA-N -1 3 371.130 3.671 20 0 FHADHM O=C(Oc1ccc(Cl)cc1Cl)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000823454353 606664169 /nfs/dbraw/zinc/66/41/69/606664169.db2.gz OCIBQNMRKLSQBL-UHFFFAOYSA-N -1 3 371.130 3.671 20 0 FHADHM CC(C)(C)c1csc(Cn2ccc(-c3ccc(-c4nnn[n-]4)cc3)n2)n1 ZINC000819965606 606706502 /nfs/dbraw/zinc/70/65/02/606706502.db2.gz JNLVROYSJBKIDH-UHFFFAOYSA-N -1 3 365.466 3.533 20 0 FHADHM CC(C)(C)c1csc(Cn2ccc(-c3ccc(-c4nn[n-]n4)cc3)n2)n1 ZINC000819965606 606706503 /nfs/dbraw/zinc/70/65/03/606706503.db2.gz JNLVROYSJBKIDH-UHFFFAOYSA-N -1 3 365.466 3.533 20 0 FHADHM CC1(C)C[C@@H](Nc2ncc(-c3nnn[n-]3)cc2Cl)c2ccccc2O1 ZINC000820590758 606725641 /nfs/dbraw/zinc/72/56/41/606725641.db2.gz ZIURZDZMJTYFKN-CYBMUJFWSA-N -1 3 356.817 3.629 20 0 FHADHM CC1(C)C[C@@H](Nc2ncc(-c3nn[n-]n3)cc2Cl)c2ccccc2O1 ZINC000820590758 606725642 /nfs/dbraw/zinc/72/56/42/606725642.db2.gz ZIURZDZMJTYFKN-CYBMUJFWSA-N -1 3 356.817 3.629 20 0 FHADHM CC(C)CC[C@@H]1CCCCN1C(=O)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000820072700 606748581 /nfs/dbraw/zinc/74/85/81/606748581.db2.gz KYMCHYGQUUMIPD-ZDUSSCGKSA-N -1 3 363.412 3.576 20 0 FHADHM CC(C)CC[C@@H]1CCCCN1C(=O)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000820072700 606748582 /nfs/dbraw/zinc/74/85/82/606748582.db2.gz KYMCHYGQUUMIPD-ZDUSSCGKSA-N -1 3 363.412 3.576 20 0 FHADHM CCO[C@@H](C)c1nc(COc2cc(Cl)ccc2-c2nnn[n-]2)cs1 ZINC000821345919 606781976 /nfs/dbraw/zinc/78/19/76/606781976.db2.gz AAUODHJRTWQZIM-VIFPVBQESA-N -1 3 365.846 3.653 20 0 FHADHM CCO[C@@H](C)c1nc(COc2cc(Cl)ccc2-c2nn[n-]n2)cs1 ZINC000821345919 606781978 /nfs/dbraw/zinc/78/19/78/606781978.db2.gz AAUODHJRTWQZIM-VIFPVBQESA-N -1 3 365.846 3.653 20 0 FHADHM ClC1(Cl)C[C@H]1CSCCCOc1cccc(-c2nnn[n-]2)c1 ZINC000822564264 606841302 /nfs/dbraw/zinc/84/13/02/606841302.db2.gz XYRFXZISQHUTJD-NSHDSACASA-N -1 3 359.282 3.563 20 0 FHADHM ClC1(Cl)C[C@H]1CSCCCOc1cccc(-c2nn[n-]n2)c1 ZINC000822564264 606841304 /nfs/dbraw/zinc/84/13/04/606841304.db2.gz XYRFXZISQHUTJD-NSHDSACASA-N -1 3 359.282 3.563 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)c2cc(F)cc(Cl)c2)s1 ZINC000821466475 606848376 /nfs/dbraw/zinc/84/83/76/606848376.db2.gz XQPCWOWLPPEUHW-UHFFFAOYSA-N -1 3 351.794 3.535 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)c2cc(F)cc(Cl)c2)s1 ZINC000821466475 606848377 /nfs/dbraw/zinc/84/83/77/606848377.db2.gz XQPCWOWLPPEUHW-UHFFFAOYSA-N -1 3 351.794 3.535 20 0 FHADHM CC(C)c1noc([C@H](C)Sc2ccc(-c3nnn[n-]3)cc2Cl)n1 ZINC000820211478 606851031 /nfs/dbraw/zinc/85/10/31/606851031.db2.gz OMQXWBLJBFMVDD-QMMMGPOBSA-N -1 3 350.835 3.880 20 0 FHADHM CC(C)c1noc([C@H](C)Sc2ccc(-c3nn[n-]n3)cc2Cl)n1 ZINC000820211478 606851032 /nfs/dbraw/zinc/85/10/32/606851032.db2.gz OMQXWBLJBFMVDD-QMMMGPOBSA-N -1 3 350.835 3.880 20 0 FHADHM CC(C)C[C@@H]1CCCCN1C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820063790 606863497 /nfs/dbraw/zinc/86/34/97/606863497.db2.gz ZCAKTWUPELTIQM-YOEHRIQHSA-N -1 3 356.474 3.538 20 0 FHADHM CC(C)C[C@@H]1CCCCN1C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820063790 606863498 /nfs/dbraw/zinc/86/34/98/606863498.db2.gz ZCAKTWUPELTIQM-YOEHRIQHSA-N -1 3 356.474 3.538 20 0 FHADHM Cc1ccc(-c2cncc(C(=O)Nc3cc(-c4nnn[n-]4)ccc3C)c2)cc1 ZINC000822213822 606865041 /nfs/dbraw/zinc/86/50/41/606865041.db2.gz BYRUHVKYIFWTNN-UHFFFAOYSA-N -1 3 370.416 3.798 20 0 FHADHM Cc1ccc(-c2cncc(C(=O)Nc3cc(-c4nn[n-]n4)ccc3C)c2)cc1 ZINC000822213822 606865042 /nfs/dbraw/zinc/86/50/42/606865042.db2.gz BYRUHVKYIFWTNN-UHFFFAOYSA-N -1 3 370.416 3.798 20 0 FHADHM CC(C)C[C@H]1CCCCN1C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820063228 606870386 /nfs/dbraw/zinc/87/03/86/606870386.db2.gz UMSKVGLMVCVJFM-RHSMWYFYSA-N -1 3 356.474 3.538 20 0 FHADHM CC(C)C[C@H]1CCCCN1C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820063228 606870388 /nfs/dbraw/zinc/87/03/88/606870388.db2.gz UMSKVGLMVCVJFM-RHSMWYFYSA-N -1 3 356.474 3.538 20 0 FHADHM Cc1cc(Oc2ccc(-c3nnn[n-]3)cc2)ccc1NC(=O)c1ccn(C)c1 ZINC000822211747 606872061 /nfs/dbraw/zinc/87/20/61/606872061.db2.gz MZTJTTGPXGYRLC-UHFFFAOYSA-N -1 3 374.404 3.558 20 0 FHADHM Cc1cc(Oc2ccc(-c3nn[n-]n3)cc2)ccc1NC(=O)c1ccn(C)c1 ZINC000822211747 606872063 /nfs/dbraw/zinc/87/20/63/606872063.db2.gz MZTJTTGPXGYRLC-UHFFFAOYSA-N -1 3 374.404 3.558 20 0 FHADHM CC1(C)CCCC[C@H]1NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000820594708 606873629 /nfs/dbraw/zinc/87/36/29/606873629.db2.gz BQJWNMDVYOSVCP-QGZVFWFLSA-N -1 3 368.485 3.510 20 0 FHADHM CC1(C)CCCC[C@H]1NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000820594708 606873630 /nfs/dbraw/zinc/87/36/30/606873630.db2.gz BQJWNMDVYOSVCP-QGZVFWFLSA-N -1 3 368.485 3.510 20 0 FHADHM CCN(Cc1ccn(C2CCCC2)n1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821230569 606887203 /nfs/dbraw/zinc/88/72/03/606887203.db2.gz NNTJQDCWKBWULX-OAHLLOKOSA-N -1 3 365.485 3.761 20 0 FHADHM CC(C)(C)NC(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1 ZINC000819922730 606907411 /nfs/dbraw/zinc/90/74/11/606907411.db2.gz NVUFXXHTEYZSFJ-UHFFFAOYSA-N -1 3 370.388 3.718 20 0 FHADHM CC(C)(C)NC(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1 ZINC000819922730 606907413 /nfs/dbraw/zinc/90/74/13/606907413.db2.gz NVUFXXHTEYZSFJ-UHFFFAOYSA-N -1 3 370.388 3.718 20 0 FHADHM Fc1ccc(CNc2ccc(OC(F)F)c(Cl)c2)cc1-c1nnn[n-]1 ZINC000822771974 606926276 /nfs/dbraw/zinc/92/62/76/606926276.db2.gz NLODQHNUWCGKDV-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM Fc1ccc(CNc2ccc(OC(F)F)c(Cl)c2)cc1-c1nn[n-]n1 ZINC000822771974 606926278 /nfs/dbraw/zinc/92/62/78/606926278.db2.gz NLODQHNUWCGKDV-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM CCCCOc1ccc(OC)cc1NCc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000821077686 606926913 /nfs/dbraw/zinc/92/69/13/606926913.db2.gz QBDOXZZBAHFSPL-UHFFFAOYSA-N -1 3 371.416 3.805 20 0 FHADHM CCCCOc1ccc(OC)cc1NCc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000821077686 606926915 /nfs/dbraw/zinc/92/69/15/606926915.db2.gz QBDOXZZBAHFSPL-UHFFFAOYSA-N -1 3 371.416 3.805 20 0 FHADHM Fc1ccc(CNc2ccccc2CC(F)(F)F)cc1-c1nnn[n-]1 ZINC000822772192 606931692 /nfs/dbraw/zinc/93/16/92/606931692.db2.gz SSESSUHTQMSHKA-UHFFFAOYSA-N -1 3 351.307 3.723 20 0 FHADHM Fc1ccc(CNc2ccccc2CC(F)(F)F)cc1-c1nn[n-]n1 ZINC000822772192 606931694 /nfs/dbraw/zinc/93/16/94/606931694.db2.gz SSESSUHTQMSHKA-UHFFFAOYSA-N -1 3 351.307 3.723 20 0 FHADHM COc1ccc(CNc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)c(F)c1 ZINC000821821577 606946679 /nfs/dbraw/zinc/94/66/79/606946679.db2.gz LWPLODSIBDXDSK-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM COc1ccc(CNc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)c(F)c1 ZINC000821821491 606946861 /nfs/dbraw/zinc/94/68/61/606946861.db2.gz IBKXITGUYPJWID-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM COc1ccc(CNc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)c(F)c1 ZINC000821821491 606946862 /nfs/dbraw/zinc/94/68/62/606946862.db2.gz IBKXITGUYPJWID-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM Fc1ccc(Cl)c2c1ncc(-c1nnn[n-]1)c2N1CCC2(CCC2)C1 ZINC000822774599 606948017 /nfs/dbraw/zinc/94/80/17/606948017.db2.gz MZBAGZGOJSXENV-UHFFFAOYSA-N -1 3 358.808 3.588 20 0 FHADHM Fc1ccc(Cl)c2c1ncc(-c1nn[n-]n1)c2N1CCC2(CCC2)C1 ZINC000822774599 606948019 /nfs/dbraw/zinc/94/80/19/606948019.db2.gz MZBAGZGOJSXENV-UHFFFAOYSA-N -1 3 358.808 3.588 20 0 FHADHM CN(C(=O)C/C=C/c1cccc(F)c1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821569630 606958822 /nfs/dbraw/zinc/95/88/22/606958822.db2.gz QEUQJUAFTWJNSM-HWKANZROSA-N -1 3 371.803 3.726 20 0 FHADHM CN(C(=O)C/C=C/c1cccc(F)c1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821569630 606958824 /nfs/dbraw/zinc/95/88/24/606958824.db2.gz QEUQJUAFTWJNSM-HWKANZROSA-N -1 3 371.803 3.726 20 0 FHADHM CC(C)n1nccc1C(=O)Oc1ccc(-c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000820219508 606985228 /nfs/dbraw/zinc/98/52/28/606985228.db2.gz HLCPWJGCIAZEMQ-UHFFFAOYSA-N -1 3 374.404 3.530 20 0 FHADHM CC(C)n1nccc1C(=O)Oc1ccc(-c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000820219508 606985230 /nfs/dbraw/zinc/98/52/30/606985230.db2.gz HLCPWJGCIAZEMQ-UHFFFAOYSA-N -1 3 374.404 3.530 20 0 FHADHM C[C@H](C(=O)OCc1ccc(F)c(-c2nnn[n-]2)c1)c1cccc(Cl)c1 ZINC000819884210 607001589 /nfs/dbraw/zinc/00/15/89/607001589.db2.gz UHVTYPPCEJYWKE-JTQLQIEISA-N -1 3 360.776 3.506 20 0 FHADHM C[C@H](C(=O)OCc1ccc(F)c(-c2nn[n-]n2)c1)c1cccc(Cl)c1 ZINC000819884210 607001590 /nfs/dbraw/zinc/00/15/90/607001590.db2.gz UHVTYPPCEJYWKE-JTQLQIEISA-N -1 3 360.776 3.506 20 0 FHADHM O=C(CCSc1cccc(-c2nnn[n-]2)c1)Nc1cccc(Cl)c1 ZINC000822974364 607011027 /nfs/dbraw/zinc/01/10/27/607011027.db2.gz JATNVWVBIPVZRQ-UHFFFAOYSA-N -1 3 359.842 3.641 20 0 FHADHM O=C(CCSc1cccc(-c2nn[n-]n2)c1)Nc1cccc(Cl)c1 ZINC000822974364 607011029 /nfs/dbraw/zinc/01/10/29/607011029.db2.gz JATNVWVBIPVZRQ-UHFFFAOYSA-N -1 3 359.842 3.641 20 0 FHADHM Cc1cc(Cl)ccc1NC(=O)[C@@H](C)Sc1cccc(-c2nnn[n-]2)c1 ZINC000822202396 607014006 /nfs/dbraw/zinc/01/40/06/607014006.db2.gz YJSAZLUXPQNOCM-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM Cc1cc(Cl)ccc1NC(=O)[C@@H](C)Sc1cccc(-c2nn[n-]n2)c1 ZINC000822202396 607014008 /nfs/dbraw/zinc/01/40/08/607014008.db2.gz YJSAZLUXPQNOCM-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM Cc1ccc(-c2noc(CSc3cccc(-c4nnn[n-]4)c3)n2)cc1 ZINC000822224194 607015482 /nfs/dbraw/zinc/01/54/82/607015482.db2.gz ZDEKPOQQEXBYPG-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM Cc1ccc(-c2noc(CSc3cccc(-c4nn[n-]n4)c3)n2)cc1 ZINC000822224194 607015483 /nfs/dbraw/zinc/01/54/83/607015483.db2.gz ZDEKPOQQEXBYPG-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM Cc1ccc2oc(Oc3ccc(Br)cc3-c3nnn[n-]3)nc2c1 ZINC000822284431 607045918 /nfs/dbraw/zinc/04/59/18/607045918.db2.gz RSVZYXYJPFCIEU-UHFFFAOYSA-N -1 3 372.182 3.871 20 0 FHADHM Cc1ccc2oc(Oc3ccc(Br)cc3-c3nn[n-]n3)nc2c1 ZINC000822284431 607045919 /nfs/dbraw/zinc/04/59/19/607045919.db2.gz RSVZYXYJPFCIEU-UHFFFAOYSA-N -1 3 372.182 3.871 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NC(=O)C[C@@H](C)c1cccc(F)c1 ZINC000821293598 607100439 /nfs/dbraw/zinc/10/04/39/607100439.db2.gz LQJSOHNQNOEUPA-GFCCVEGCSA-N -1 3 368.416 3.570 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NC(=O)Cc1cccc2ccccc21 ZINC000821304843 607102327 /nfs/dbraw/zinc/10/23/27/607102327.db2.gz RXMISMLBZAVITM-UHFFFAOYSA-N -1 3 372.432 3.633 20 0 FHADHM Clc1cccc(Cl)c1C1(NCc2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000822586269 607130957 /nfs/dbraw/zinc/13/09/57/607130957.db2.gz VYZQCMHXUNIGJX-UHFFFAOYSA-N -1 3 360.248 3.952 20 0 FHADHM Clc1cccc(Cl)c1C1(NCc2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000822586269 607130958 /nfs/dbraw/zinc/13/09/58/607130958.db2.gz VYZQCMHXUNIGJX-UHFFFAOYSA-N -1 3 360.248 3.952 20 0 FHADHM C[C@H](OC(=O)/C=C/SCc1ccco1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488896 607131446 /nfs/dbraw/zinc/13/14/46/607131446.db2.gz WGLDHCNHTQLKSP-OANVXVOSSA-N -1 3 356.407 3.511 20 0 FHADHM C[C@H](OC(=O)/C=C/SCc1ccco1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488896 607131448 /nfs/dbraw/zinc/13/14/48/607131448.db2.gz WGLDHCNHTQLKSP-OANVXVOSSA-N -1 3 356.407 3.511 20 0 FHADHM Cc1ccc(-c2nnc([C@@H](C)Oc3ccc(-c4nnn[n-]4)cc3F)o2)cc1 ZINC000822213843 607132777 /nfs/dbraw/zinc/13/27/77/607132777.db2.gz CVCNXLJEMVHXIO-LLVKDONJSA-N -1 3 366.356 3.504 20 0 FHADHM Cc1ccc(-c2nnc([C@@H](C)Oc3ccc(-c4nn[n-]n4)cc3F)o2)cc1 ZINC000822213843 607132778 /nfs/dbraw/zinc/13/27/78/607132778.db2.gz CVCNXLJEMVHXIO-LLVKDONJSA-N -1 3 366.356 3.504 20 0 FHADHM Cc1ccc(-c2cnc(COc3ccc(-c4nnn[n-]4)cc3F)o2)cc1 ZINC000822214302 607134743 /nfs/dbraw/zinc/13/47/43/607134743.db2.gz ZGRKZUKPOGZNNI-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM Cc1ccc(-c2cnc(COc3ccc(-c4nn[n-]n4)cc3F)o2)cc1 ZINC000822214302 607134745 /nfs/dbraw/zinc/13/47/45/607134745.db2.gz ZGRKZUKPOGZNNI-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM C[C@@H](Oc1ccc(-c2nnn[n-]2)cc1F)c1ncc(-c2ccccc2)o1 ZINC000820536187 607135979 /nfs/dbraw/zinc/13/59/79/607135979.db2.gz SUJYAEPREDWWRM-LLVKDONJSA-N -1 3 351.341 3.801 20 0 FHADHM C[C@@H](Oc1ccc(-c2nn[n-]n2)cc1F)c1ncc(-c2ccccc2)o1 ZINC000820536187 607135981 /nfs/dbraw/zinc/13/59/81/607135981.db2.gz SUJYAEPREDWWRM-LLVKDONJSA-N -1 3 351.341 3.801 20 0 FHADHM CCN(C(=O)c1cccc(C)c1F)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821160244 607153707 /nfs/dbraw/zinc/15/37/07/607153707.db2.gz HYCJWAJREQKFTD-ZDUSSCGKSA-N -1 3 353.401 3.538 20 0 FHADHM CCN(C(=O)c1cccc(C)c1F)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821160244 607153708 /nfs/dbraw/zinc/15/37/08/607153708.db2.gz HYCJWAJREQKFTD-ZDUSSCGKSA-N -1 3 353.401 3.538 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@H](CC)OC2CCCCC2)s1 ZINC000821466343 607157306 /nfs/dbraw/zinc/15/73/06/607157306.db2.gz VYVJMWXIOSTCNV-AWEZNQCLSA-N -1 3 363.487 3.557 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@H](CC)OC2CCCCC2)s1 ZINC000821466343 607157308 /nfs/dbraw/zinc/15/73/08/607157308.db2.gz VYVJMWXIOSTCNV-AWEZNQCLSA-N -1 3 363.487 3.557 20 0 FHADHM O=C(c1cc(-c2nnn[n-]2)cs1)N1CCC[C@@H]1CCCc1ccccc1 ZINC000823472337 607165778 /nfs/dbraw/zinc/16/57/78/607165778.db2.gz IRGSALHQSDLVHN-INIZCTEOSA-N -1 3 367.478 3.556 20 0 FHADHM O=C(c1cc(-c2nn[n-]n2)cs1)N1CCC[C@@H]1CCCc1ccccc1 ZINC000823472337 607165779 /nfs/dbraw/zinc/16/57/79/607165779.db2.gz IRGSALHQSDLVHN-INIZCTEOSA-N -1 3 367.478 3.556 20 0 FHADHM c1cc(N2CCC[C@@H](c3nc4c(s3)CCCC4)C2)ccc1-c1nn[n-]n1 ZINC000823757061 607175188 /nfs/dbraw/zinc/17/51/88/607175188.db2.gz KLKQCUXQZPFHAW-CQSZACIVSA-N -1 3 366.494 3.586 20 0 FHADHM COc1ccccc1C(C)=CC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000821882948 607189087 /nfs/dbraw/zinc/18/90/87/607189087.db2.gz OEBMFXCPXCBRAC-PKNBQFBNSA-N -1 3 369.812 3.571 20 0 FHADHM COc1ccccc1C(C)=CC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000821882948 607189088 /nfs/dbraw/zinc/18/90/88/607189088.db2.gz OEBMFXCPXCBRAC-PKNBQFBNSA-N -1 3 369.812 3.571 20 0 FHADHM CSc1ccc(C)c(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)c1 ZINC000821979732 607190002 /nfs/dbraw/zinc/19/00/02/607190002.db2.gz VRTNKQCRMXDOPM-UHFFFAOYSA-N -1 3 359.842 3.803 20 0 FHADHM CSc1ccc(C)c(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)c1 ZINC000821979732 607190003 /nfs/dbraw/zinc/19/00/03/607190003.db2.gz VRTNKQCRMXDOPM-UHFFFAOYSA-N -1 3 359.842 3.803 20 0 FHADHM Cc1cc(C)cc(OCCC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)c1 ZINC000822197743 607190005 /nfs/dbraw/zinc/19/00/05/607190005.db2.gz NMGCENLGCKEKNV-UHFFFAOYSA-N -1 3 371.828 3.545 20 0 FHADHM Cc1cc(C)cc(OCCC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)c1 ZINC000822197743 607190006 /nfs/dbraw/zinc/19/00/06/607190006.db2.gz NMGCENLGCKEKNV-UHFFFAOYSA-N -1 3 371.828 3.545 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000823315626 607190392 /nfs/dbraw/zinc/19/03/92/607190392.db2.gz ZUEXTIDWIUKPDP-UWVGGRQHSA-N -1 3 373.766 3.827 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000823315626 607190393 /nfs/dbraw/zinc/19/03/93/607190393.db2.gz ZUEXTIDWIUKPDP-UWVGGRQHSA-N -1 3 373.766 3.827 20 0 FHADHM CCc1cc(C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)oc1CC ZINC000821470742 607192406 /nfs/dbraw/zinc/19/24/06/607192406.db2.gz SSCXWMSVRIELEZ-UHFFFAOYSA-N -1 3 367.453 3.635 20 0 FHADHM CCc1cc(C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)oc1CC ZINC000821470742 607192407 /nfs/dbraw/zinc/19/24/07/607192407.db2.gz SSCXWMSVRIELEZ-UHFFFAOYSA-N -1 3 367.453 3.635 20 0 FHADHM C[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820675215 607196335 /nfs/dbraw/zinc/19/63/35/607196335.db2.gz ILFMIEVKTBFXJG-HFAKWTLXSA-N -1 3 360.849 3.705 20 0 FHADHM C[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820675215 607196336 /nfs/dbraw/zinc/19/63/36/607196336.db2.gz ILFMIEVKTBFXJG-HFAKWTLXSA-N -1 3 360.849 3.705 20 0 FHADHM Cc1ccc([C@@H](C)NC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1F ZINC000822229181 607197553 /nfs/dbraw/zinc/19/75/53/607197553.db2.gz OKQMEDIOFVBPQB-SNVBAGLBSA-N -1 3 374.807 3.850 20 0 FHADHM Cc1ccc([C@@H](C)NC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1F ZINC000822229181 607197554 /nfs/dbraw/zinc/19/75/54/607197554.db2.gz OKQMEDIOFVBPQB-SNVBAGLBSA-N -1 3 374.807 3.850 20 0 FHADHM C[C@H](CNC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccc(F)cc1 ZINC000820270039 607197851 /nfs/dbraw/zinc/19/78/51/607197851.db2.gz SVSNTCYJGHNWGP-SNVBAGLBSA-N -1 3 374.807 3.584 20 0 FHADHM C[C@H](CNC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccc(F)cc1 ZINC000820270039 607197852 /nfs/dbraw/zinc/19/78/52/607197852.db2.gz SVSNTCYJGHNWGP-SNVBAGLBSA-N -1 3 374.807 3.584 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N[C@@H](c1cccs1)C1CC1 ZINC000823318292 607198861 /nfs/dbraw/zinc/19/88/61/607198861.db2.gz BNBYAJPFOADYRZ-CQSZACIVSA-N -1 3 374.857 3.854 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N[C@@H](c1cccs1)C1CC1 ZINC000823318292 607198862 /nfs/dbraw/zinc/19/88/62/607198862.db2.gz BNBYAJPFOADYRZ-CQSZACIVSA-N -1 3 374.857 3.854 20 0 FHADHM CCN(Cc1ccccc1C)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000821230485 607200174 /nfs/dbraw/zinc/20/01/74/607200174.db2.gz LJBMEZADDKQULM-UHFFFAOYSA-N -1 3 370.844 3.883 20 0 FHADHM CCN(Cc1ccccc1C)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000821230485 607200175 /nfs/dbraw/zinc/20/01/75/607200175.db2.gz LJBMEZADDKQULM-UHFFFAOYSA-N -1 3 370.844 3.883 20 0 FHADHM CCc1ccc(CN(C)C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000821487521 607200879 /nfs/dbraw/zinc/20/08/79/607200879.db2.gz VRKFAQOSBJEYMY-UHFFFAOYSA-N -1 3 370.844 3.746 20 0 FHADHM CCc1ccc(CN(C)C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000821487521 607200880 /nfs/dbraw/zinc/20/08/80/607200880.db2.gz VRKFAQOSBJEYMY-UHFFFAOYSA-N -1 3 370.844 3.746 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)c(N[C@H](C)c2ccccc2Br)n1 ZINC000822215075 607226818 /nfs/dbraw/zinc/22/68/18/607226818.db2.gz KUXJNXVCRZQOOV-SNVBAGLBSA-N -1 3 359.231 3.506 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)c(N[C@H](C)c2ccccc2Br)n1 ZINC000822215075 607226819 /nfs/dbraw/zinc/22/68/19/607226819.db2.gz KUXJNXVCRZQOOV-SNVBAGLBSA-N -1 3 359.231 3.506 20 0 FHADHM Cc1cc(Cl)ccc1C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000822202126 607237476 /nfs/dbraw/zinc/23/74/76/607237476.db2.gz MMHAEKCTTYPZFT-UHFFFAOYSA-N -1 3 358.833 3.637 20 0 FHADHM Cc1cc(Cl)ccc1C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000822202126 607237477 /nfs/dbraw/zinc/23/74/77/607237477.db2.gz MMHAEKCTTYPZFT-UHFFFAOYSA-N -1 3 358.833 3.637 20 0 FHADHM CCc1cc(C)c(C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)o1 ZINC000821471340 607238960 /nfs/dbraw/zinc/23/89/60/607238960.db2.gz ZYAOMSVTAKGBRM-UHFFFAOYSA-N -1 3 365.315 3.602 20 0 FHADHM CCc1cc(C)c(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)o1 ZINC000821471340 607238959 /nfs/dbraw/zinc/23/89/59/607238959.db2.gz ZYAOMSVTAKGBRM-UHFFFAOYSA-N -1 3 365.315 3.602 20 0 FHADHM Cc1cccc(-c2cncc(C(=O)Nc3ccc(F)cc3-c3nnn[n-]3)c2)c1 ZINC000822283836 607239187 /nfs/dbraw/zinc/23/91/87/607239187.db2.gz FGWSJZJYIGRZPF-UHFFFAOYSA-N -1 3 374.379 3.629 20 0 FHADHM Cc1cccc(-c2cncc(C(=O)Nc3ccc(F)cc3-c3nn[n-]n3)c2)c1 ZINC000822283836 607239188 /nfs/dbraw/zinc/23/91/88/607239188.db2.gz FGWSJZJYIGRZPF-UHFFFAOYSA-N -1 3 374.379 3.629 20 0 FHADHM Cc1c(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cnc2ccccc12 ZINC000822020801 607241433 /nfs/dbraw/zinc/24/14/33/607241433.db2.gz JSHBCXYHADHPOT-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1c(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cnc2ccccc12 ZINC000822020801 607241434 /nfs/dbraw/zinc/24/14/34/607241434.db2.gz JSHBCXYHADHPOT-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1ccc(SCCC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000822267030 607241472 /nfs/dbraw/zinc/24/14/72/607241472.db2.gz MGSSACMYYRRBMC-UHFFFAOYSA-N -1 3 373.869 3.949 20 0 FHADHM Cc1ccc(SCCC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000822267030 607241473 /nfs/dbraw/zinc/24/14/73/607241473.db2.gz MGSSACMYYRRBMC-UHFFFAOYSA-N -1 3 373.869 3.949 20 0 FHADHM CC[C@@H](Oc1cccc(C)c1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820939761 607242045 /nfs/dbraw/zinc/24/20/45/607242045.db2.gz XUGLNAZPKGGHPC-MRXNPFEDSA-N -1 3 371.828 3.625 20 0 FHADHM CC[C@@H](Oc1cccc(C)c1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820939761 607242046 /nfs/dbraw/zinc/24/20/46/607242046.db2.gz XUGLNAZPKGGHPC-MRXNPFEDSA-N -1 3 371.828 3.625 20 0 FHADHM CSc1ccsc1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000821990909 607242884 /nfs/dbraw/zinc/24/28/84/607242884.db2.gz YLFKEMZXQAYALF-UHFFFAOYSA-N -1 3 351.844 3.556 20 0 FHADHM CSc1ccsc1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000821990909 607242885 /nfs/dbraw/zinc/24/28/85/607242885.db2.gz YLFKEMZXQAYALF-UHFFFAOYSA-N -1 3 351.844 3.556 20 0 FHADHM COc1cc(-c2nnn[n-]2)cc(Cl)c1OCCCSCC(C)C ZINC000826167742 607783171 /nfs/dbraw/zinc/78/31/71/607783171.db2.gz PFYZBFSROUYZPV-UHFFFAOYSA-N -1 3 356.879 3.687 20 0 FHADHM COc1cc(-c2nn[n-]n2)cc(Cl)c1OCCCSCC(C)C ZINC000826167742 607783172 /nfs/dbraw/zinc/78/31/72/607783172.db2.gz PFYZBFSROUYZPV-UHFFFAOYSA-N -1 3 356.879 3.687 20 0 FHADHM CN(C(=O)CCc1ccc2ccccc2c1)c1ccccc1-c1nnn[n-]1 ZINC000825817308 607786312 /nfs/dbraw/zinc/78/63/12/607786312.db2.gz GQGXJALQHOCFDH-UHFFFAOYSA-N -1 3 357.417 3.616 20 0 FHADHM CN(C(=O)CCc1ccc2ccccc2c1)c1ccccc1-c1nn[n-]n1 ZINC000825817308 607786313 /nfs/dbraw/zinc/78/63/13/607786313.db2.gz GQGXJALQHOCFDH-UHFFFAOYSA-N -1 3 357.417 3.616 20 0 FHADHM CC(C)Sc1ccc(C(=O)N(C)c2ccccc2-c2nnn[n-]2)cc1 ZINC000824338230 607789513 /nfs/dbraw/zinc/78/95/13/607789513.db2.gz UFRQMEOAXSNRCE-UHFFFAOYSA-N -1 3 353.451 3.644 20 0 FHADHM CC(C)Sc1ccc(C(=O)N(C)c2ccccc2-c2nn[n-]n2)cc1 ZINC000824338230 607789514 /nfs/dbraw/zinc/78/95/14/607789514.db2.gz UFRQMEOAXSNRCE-UHFFFAOYSA-N -1 3 353.451 3.644 20 0 FHADHM CC(C)Oc1ccc(Cl)cc1C(=O)N(C)c1ccccc1-c1nnn[n-]1 ZINC000824324983 607789702 /nfs/dbraw/zinc/78/97/02/607789702.db2.gz XOBORSQHYRFLLV-UHFFFAOYSA-N -1 3 371.828 3.584 20 0 FHADHM CC(C)Oc1ccc(Cl)cc1C(=O)N(C)c1ccccc1-c1nn[n-]n1 ZINC000824324983 607789703 /nfs/dbraw/zinc/78/97/03/607789703.db2.gz XOBORSQHYRFLLV-UHFFFAOYSA-N -1 3 371.828 3.584 20 0 FHADHM O=C(c1sccc1-c1nnn[n-]1)N(CC1CCCCC1)c1ccccn1 ZINC000826476048 607792039 /nfs/dbraw/zinc/79/20/39/607792039.db2.gz ZSRLYKFOCUKESG-UHFFFAOYSA-N -1 3 368.466 3.550 20 0 FHADHM O=C(c1sccc1-c1nn[n-]n1)N(CC1CCCCC1)c1ccccn1 ZINC000826476048 607792040 /nfs/dbraw/zinc/79/20/40/607792040.db2.gz ZSRLYKFOCUKESG-UHFFFAOYSA-N -1 3 368.466 3.550 20 0 FHADHM CCN(C(=O)CCc1c[nH]c2c1cccc2C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825371491 607797460 /nfs/dbraw/zinc/79/74/60/607797460.db2.gz HJLBYBLQQPYRBT-UHFFFAOYSA-N -1 3 374.448 3.642 20 0 FHADHM CCN(C(=O)CCc1c[nH]c2c1cccc2C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825371491 607797461 /nfs/dbraw/zinc/79/74/61/607797461.db2.gz HJLBYBLQQPYRBT-UHFFFAOYSA-N -1 3 374.448 3.642 20 0 FHADHM CCN(C(=O)c1cccc(OCC(C)C)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825386129 607797618 /nfs/dbraw/zinc/79/76/18/607797618.db2.gz YLHKWWRRKBZKJE-UHFFFAOYSA-N -1 3 365.437 3.568 20 0 FHADHM CCN(C(=O)c1cccc(OCC(C)C)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825386129 607797619 /nfs/dbraw/zinc/79/76/19/607797619.db2.gz YLHKWWRRKBZKJE-UHFFFAOYSA-N -1 3 365.437 3.568 20 0 FHADHM CC[C@H](O[C@@H]1CCC[C@@H](C)C1)C(=O)N(CC)c1ccc(-c2nnn[n-]2)cc1 ZINC000825153604 607797734 /nfs/dbraw/zinc/79/77/34/607797734.db2.gz ISULDHJLSBWHQY-OLMNPRSZSA-N -1 3 371.485 3.594 20 0 FHADHM CC[C@H](O[C@@H]1CCC[C@@H](C)C1)C(=O)N(CC)c1ccc(-c2nn[n-]n2)cc1 ZINC000825153604 607797735 /nfs/dbraw/zinc/79/77/35/607797735.db2.gz ISULDHJLSBWHQY-OLMNPRSZSA-N -1 3 371.485 3.594 20 0 FHADHM CCN(C(=O)CSc1ccc(C)cc1C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825376740 607798228 /nfs/dbraw/zinc/79/82/28/607798228.db2.gz NGJOPJNLWMKCOA-UHFFFAOYSA-N -1 3 367.478 3.629 20 0 FHADHM CCN(C(=O)CSc1ccc(C)cc1C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825376740 607798229 /nfs/dbraw/zinc/79/82/29/607798229.db2.gz NGJOPJNLWMKCOA-UHFFFAOYSA-N -1 3 367.478 3.629 20 0 FHADHM CCN(C(=O)[C@@H]1C[C@@]12CCCc1ccccc12)c1ccc(-c2nnn[n-]2)cc1 ZINC000825367362 607799962 /nfs/dbraw/zinc/79/99/62/607799962.db2.gz OEHZDUMEAAGOMG-SIKLNZKXSA-N -1 3 373.460 3.514 20 0 FHADHM CCN(C(=O)[C@@H]1C[C@@]12CCCc1ccccc12)c1ccc(-c2nn[n-]n2)cc1 ZINC000825367362 607799963 /nfs/dbraw/zinc/79/99/63/607799963.db2.gz OEHZDUMEAAGOMG-SIKLNZKXSA-N -1 3 373.460 3.514 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cc(Cl)ccc1C ZINC000825332195 607806523 /nfs/dbraw/zinc/80/65/23/607806523.db2.gz FNOOXKTWUXNGTC-UHFFFAOYSA-N -1 3 370.844 3.903 20 0 FHADHM CC(C)(C)SCCCC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000824123594 607815971 /nfs/dbraw/zinc/81/59/71/607815971.db2.gz HBVGWZYIJUUCIH-UHFFFAOYSA-N -1 3 373.526 3.670 20 0 FHADHM CC(C)(C)SCCCC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000824123594 607815972 /nfs/dbraw/zinc/81/59/72/607815972.db2.gz HBVGWZYIJUUCIH-UHFFFAOYSA-N -1 3 373.526 3.670 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@@H](OC(C)(C)C)c1ccccc1 ZINC000826277137 607817878 /nfs/dbraw/zinc/81/78/78/607817878.db2.gz KQUQNNOVXDSAMK-KRWDZBQOSA-N -1 3 365.437 3.670 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@@H](OC(C)(C)C)c1ccccc1 ZINC000826277137 607817879 /nfs/dbraw/zinc/81/78/79/607817879.db2.gz KQUQNNOVXDSAMK-KRWDZBQOSA-N -1 3 365.437 3.670 20 0 FHADHM FC(F)(F)c1cc(N2CCC(c3ccccn3)CC2)ccc1-c1nnn[n-]1 ZINC000826368651 607820511 /nfs/dbraw/zinc/82/05/11/607820511.db2.gz XQOPVNMZIXIQKB-UHFFFAOYSA-N -1 3 374.370 3.665 20 0 FHADHM FC(F)(F)c1cc(N2CCC(c3ccccn3)CC2)ccc1-c1nn[n-]n1 ZINC000826368651 607820512 /nfs/dbraw/zinc/82/05/12/607820512.db2.gz XQOPVNMZIXIQKB-UHFFFAOYSA-N -1 3 374.370 3.665 20 0 FHADHM Cc1ccc(CC(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCCCC3)o1 ZINC000826286991 607827552 /nfs/dbraw/zinc/82/75/52/607827552.db2.gz YHJRBKSCJDDJNL-UHFFFAOYSA-N -1 3 371.466 3.670 20 0 FHADHM Cc1ccc(CC(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCCCC3)o1 ZINC000826286991 607827553 /nfs/dbraw/zinc/82/75/53/607827553.db2.gz YHJRBKSCJDDJNL-UHFFFAOYSA-N -1 3 371.466 3.670 20 0 FHADHM O=C(Nc1ccc(F)cc1F)c1c(Cl)cc(-c2nnn[n-]2)cc1Cl ZINC000826455058 607832790 /nfs/dbraw/zinc/83/27/90/607832790.db2.gz XGKUCOIUYDTCTH-UHFFFAOYSA-N -1 3 370.146 3.704 20 0 FHADHM O=C(Nc1ccc(F)cc1F)c1c(Cl)cc(-c2nn[n-]n2)cc1Cl ZINC000826455058 607832791 /nfs/dbraw/zinc/83/27/91/607832791.db2.gz XGKUCOIUYDTCTH-UHFFFAOYSA-N -1 3 370.146 3.704 20 0 FHADHM CN(Cn1ccc(=S)c2ccccc21)c1ccc(-c2nn[n-]n2)cc1F ZINC000825999364 607848408 /nfs/dbraw/zinc/84/84/08/607848408.db2.gz YETUGGIEXPNBFS-UHFFFAOYSA-N -1 3 366.425 3.784 20 0 FHADHM Cc1cccc(C(=O)Nc2cc(-c3nnn[n-]3)cn2C(C)(C)C)c1Cl ZINC000826295941 607861668 /nfs/dbraw/zinc/86/16/68/607861668.db2.gz DSTXYDCNNIRZRU-UHFFFAOYSA-N -1 3 358.833 3.637 20 0 FHADHM Cc1cccc(C(=O)Nc2cc(-c3nn[n-]n3)cn2C(C)(C)C)c1Cl ZINC000826295941 607861669 /nfs/dbraw/zinc/86/16/69/607861669.db2.gz DSTXYDCNNIRZRU-UHFFFAOYSA-N -1 3 358.833 3.637 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1Oc1ccc(C(=O)NC2(C)CCC2)cc1 ZINC000826255263 607862013 /nfs/dbraw/zinc/86/20/13/607862013.db2.gz QPKYBCXINXVBFE-UHFFFAOYSA-N -1 3 363.421 3.640 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1Oc1ccc(C(=O)NC2(C)CCC2)cc1 ZINC000826255263 607862014 /nfs/dbraw/zinc/86/20/14/607862014.db2.gz QPKYBCXINXVBFE-UHFFFAOYSA-N -1 3 363.421 3.640 20 0 FHADHM CCN(C(=O)c1cc(F)ccc1C)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825379231 607879133 /nfs/dbraw/zinc/87/91/33/607879133.db2.gz CYMTWEPRHVLLOI-UHFFFAOYSA-N -1 3 359.792 3.634 20 0 FHADHM CCN(C(=O)c1cc(F)ccc1C)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825379231 607879134 /nfs/dbraw/zinc/87/91/34/607879134.db2.gz CYMTWEPRHVLLOI-UHFFFAOYSA-N -1 3 359.792 3.634 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000823944045 607881144 /nfs/dbraw/zinc/88/11/44/607881144.db2.gz XJGMCNKGHQOUFE-ACCUITESSA-N -1 3 367.840 3.582 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000823944045 607881145 /nfs/dbraw/zinc/88/11/45/607881145.db2.gz XJGMCNKGHQOUFE-ACCUITESSA-N -1 3 367.840 3.582 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000823942323 607905921 /nfs/dbraw/zinc/90/59/21/607905921.db2.gz BCGKUKJAXDOICD-XSNHNAGMSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000823942323 607905922 /nfs/dbraw/zinc/90/59/22/607905922.db2.gz BCGKUKJAXDOICD-XSNHNAGMSA-N -1 3 367.840 3.801 20 0 FHADHM CC(C)[C@@H](C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(F)cc1 ZINC000824470336 607906068 /nfs/dbraw/zinc/90/60/68/607906068.db2.gz HPXNIUKLBQJUAE-SCLBCKFNSA-N -1 3 367.428 3.623 20 0 FHADHM CC(C)[C@@H](C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(F)cc1 ZINC000824470336 607906069 /nfs/dbraw/zinc/90/60/69/607906069.db2.gz HPXNIUKLBQJUAE-SCLBCKFNSA-N -1 3 367.428 3.623 20 0 FHADHM CS[C@@H](C)CC(=O)Oc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000826224604 607945361 /nfs/dbraw/zinc/94/53/61/607945361.db2.gz INVVZLBZORQCAT-LBPRGKRZSA-N -1 3 370.434 3.706 20 0 FHADHM CS[C@@H](C)CC(=O)Oc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000826224604 607945362 /nfs/dbraw/zinc/94/53/62/607945362.db2.gz INVVZLBZORQCAT-LBPRGKRZSA-N -1 3 370.434 3.706 20 0 FHADHM Cc1nnc(SCc2ccccc2-c2nnn[n-]2)n1[C@@H]1CCC[C@@H](C)C1 ZINC000826337321 607965653 /nfs/dbraw/zinc/96/56/53/607965653.db2.gz KJODEMHKRMVHMC-IUODEOHRSA-N -1 3 369.498 3.810 20 0 FHADHM Cc1nnc(SCc2ccccc2-c2nn[n-]n2)n1[C@@H]1CCC[C@@H](C)C1 ZINC000826337321 607965654 /nfs/dbraw/zinc/96/56/54/607965654.db2.gz KJODEMHKRMVHMC-IUODEOHRSA-N -1 3 369.498 3.810 20 0 FHADHM Cc1cc(N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)ncc1Br ZINC000826270568 607965808 /nfs/dbraw/zinc/96/58/08/607965808.db2.gz FSTKZOSSUDVPDP-JTQLQIEISA-N -1 3 359.231 3.506 20 0 FHADHM Cc1cc(N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)ncc1Br ZINC000826270568 607965809 /nfs/dbraw/zinc/96/58/09/607965809.db2.gz FSTKZOSSUDVPDP-JTQLQIEISA-N -1 3 359.231 3.506 20 0 FHADHM Cc1nnc(SCc2cccc(-c3nnn[n-]3)c2)n1[C@@H]1CCC[C@H](C)C1 ZINC000826337721 607966146 /nfs/dbraw/zinc/96/61/46/607966146.db2.gz YWYRBVFRFZANRP-BLLLJJGKSA-N -1 3 369.498 3.810 20 0 FHADHM Cc1nnc(SCc2cccc(-c3nn[n-]n3)c2)n1[C@@H]1CCC[C@H](C)C1 ZINC000826337721 607966147 /nfs/dbraw/zinc/96/61/47/607966147.db2.gz YWYRBVFRFZANRP-BLLLJJGKSA-N -1 3 369.498 3.810 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1N1CCc2c3ccccc3[nH]c2C1 ZINC000826353065 607968980 /nfs/dbraw/zinc/96/89/80/607968980.db2.gz ZPNBGFQEDNNVSG-UHFFFAOYSA-N -1 3 350.813 3.564 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1N1CCc2c3ccccc3[nH]c2C1 ZINC000826353065 607968981 /nfs/dbraw/zinc/96/89/81/607968981.db2.gz ZPNBGFQEDNNVSG-UHFFFAOYSA-N -1 3 350.813 3.564 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000823943145 607969326 /nfs/dbraw/zinc/96/93/26/607969326.db2.gz ONCKMIIXHVSYIA-YLSINNKHSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000823943145 607969327 /nfs/dbraw/zinc/96/93/27/607969327.db2.gz ONCKMIIXHVSYIA-YLSINNKHSA-N -1 3 367.840 3.801 20 0 FHADHM CCCn1c2ccc(-c3nnn[n-]3)cc2nc1-c1csc(C2CC2)n1 ZINC000825352346 607974917 /nfs/dbraw/zinc/97/49/17/607974917.db2.gz MJYOWJCKUGIXHF-UHFFFAOYSA-N -1 3 351.439 3.627 20 0 FHADHM CCCn1c2ccc(-c3nn[n-]n3)cc2nc1-c1csc(C2CC2)n1 ZINC000825352346 607974918 /nfs/dbraw/zinc/97/49/18/607974918.db2.gz MJYOWJCKUGIXHF-UHFFFAOYSA-N -1 3 351.439 3.627 20 0 FHADHM CC(=O)c1ccc(NCc2ccc(-c3nnn[n-]3)cc2OC(F)F)cc1C ZINC000824024324 607982551 /nfs/dbraw/zinc/98/25/51/607982551.db2.gz ACHPXFGUYJBHTA-UHFFFAOYSA-N -1 3 373.363 3.591 20 0 FHADHM CC(=O)c1ccc(NCc2ccc(-c3nn[n-]n3)cc2OC(F)F)cc1C ZINC000824024324 607982552 /nfs/dbraw/zinc/98/25/52/607982552.db2.gz ACHPXFGUYJBHTA-UHFFFAOYSA-N -1 3 373.363 3.591 20 0 FHADHM c1sc(C2CC2)nc1CSCCCOc1cccc(-c2nnn[n-]2)c1 ZINC000826517761 607983897 /nfs/dbraw/zinc/98/38/97/607983897.db2.gz NULMCEQWLIRXPA-UHFFFAOYSA-N -1 3 373.507 3.903 20 0 FHADHM c1sc(C2CC2)nc1CSCCCOc1cccc(-c2nn[n-]n2)c1 ZINC000826517761 607983898 /nfs/dbraw/zinc/98/38/98/607983898.db2.gz NULMCEQWLIRXPA-UHFFFAOYSA-N -1 3 373.507 3.903 20 0 FHADHM CC(C)CN(C(=O)c1scnc1C1CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824255506 608024752 /nfs/dbraw/zinc/02/47/52/608024752.db2.gz MFCJVNJPLJNNAS-UHFFFAOYSA-N -1 3 368.466 3.503 20 0 FHADHM CC(C)CN(C(=O)c1scnc1C1CC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824255506 608024753 /nfs/dbraw/zinc/02/47/53/608024753.db2.gz MFCJVNJPLJNNAS-UHFFFAOYSA-N -1 3 368.466 3.503 20 0 FHADHM CC1(C)CCCN(C(=O)c2sccc2-c2nnn[n-]2)c2ccccc21 ZINC000824802027 608030287 /nfs/dbraw/zinc/03/02/87/608030287.db2.gz JWJFPZFAIKJOQS-UHFFFAOYSA-N -1 3 353.451 3.646 20 0 FHADHM CC1(C)CCCN(C(=O)c2sccc2-c2nn[n-]n2)c2ccccc21 ZINC000824802027 608030288 /nfs/dbraw/zinc/03/02/88/608030288.db2.gz JWJFPZFAIKJOQS-UHFFFAOYSA-N -1 3 353.451 3.646 20 0 FHADHM Cc1cc2c(ncnc2SCc2ccc(F)c(-c3nnn[n-]3)c2)s1 ZINC000826272949 608056681 /nfs/dbraw/zinc/05/66/81/608056681.db2.gz IFVQGMZZCCXTLH-UHFFFAOYSA-N -1 3 358.427 3.611 20 0 FHADHM Cc1cc2c(ncnc2SCc2ccc(F)c(-c3nn[n-]n3)c2)s1 ZINC000826272949 608056682 /nfs/dbraw/zinc/05/66/82/608056682.db2.gz IFVQGMZZCCXTLH-UHFFFAOYSA-N -1 3 358.427 3.611 20 0 FHADHM CC(C)Cc1ccc([C@@H](C)C(=O)Nc2sccc2-c2nnn[n-]2)cc1 ZINC000824280414 608058817 /nfs/dbraw/zinc/05/88/17/608058817.db2.gz MOTIXRLXKLBHHP-GFCCVEGCSA-N -1 3 355.467 3.869 20 0 FHADHM CC(C)Cc1ccc([C@@H](C)C(=O)Nc2sccc2-c2nn[n-]n2)cc1 ZINC000824280414 608058818 /nfs/dbraw/zinc/05/88/18/608058818.db2.gz MOTIXRLXKLBHHP-GFCCVEGCSA-N -1 3 355.467 3.869 20 0 FHADHM Cc1nc(C)c(-c2nnn[n-]2)c(SCCCSCc2ccccc2)n1 ZINC000826324505 608077158 /nfs/dbraw/zinc/07/71/58/608077158.db2.gz USKRTNIEIGWJGV-UHFFFAOYSA-N -1 3 372.523 3.689 20 0 FHADHM Cc1nc(C)c(-c2nn[n-]n2)c(SCCCSCc2ccccc2)n1 ZINC000826324505 608077159 /nfs/dbraw/zinc/07/71/59/608077159.db2.gz USKRTNIEIGWJGV-UHFFFAOYSA-N -1 3 372.523 3.689 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1cccn1C(C)C ZINC000824255156 608119600 /nfs/dbraw/zinc/11/96/00/608119600.db2.gz APFBFCPACNSGCL-UHFFFAOYSA-N -1 3 366.469 3.548 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1cccn1C(C)C ZINC000824255156 608119601 /nfs/dbraw/zinc/11/96/01/608119601.db2.gz APFBFCPACNSGCL-UHFFFAOYSA-N -1 3 366.469 3.548 20 0 FHADHM CC(C)(C)[C@H]1C[C@H](Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)CCO1 ZINC000824079360 608149981 /nfs/dbraw/zinc/14/99/81/608149981.db2.gz PAAHGNSLYAXXIH-BXUZGUMPSA-N -1 3 369.391 3.891 20 0 FHADHM CC(C)(C)[C@H]1C[C@H](Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)CCO1 ZINC000824079360 608149982 /nfs/dbraw/zinc/14/99/82/608149982.db2.gz PAAHGNSLYAXXIH-BXUZGUMPSA-N -1 3 369.391 3.891 20 0 FHADHM Cc1cc([C@H]2CN(c3ccc(-c4nnn[n-]4)c(Cl)c3)CCO2)ccc1F ZINC000826266158 608153459 /nfs/dbraw/zinc/15/34/59/608153459.db2.gz DWXWUEKNNLBMOQ-QGZVFWFLSA-N -1 3 373.819 3.546 20 0 FHADHM Cc1cc([C@H]2CN(c3ccc(-c4nn[n-]n4)c(Cl)c3)CCO2)ccc1F ZINC000826266158 608153460 /nfs/dbraw/zinc/15/34/60/608153460.db2.gz DWXWUEKNNLBMOQ-QGZVFWFLSA-N -1 3 373.819 3.546 20 0 FHADHM Cc1cc(C(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(C)C)cc(C)c1F ZINC000826260347 608155220 /nfs/dbraw/zinc/15/52/20/608155220.db2.gz JWCGXDUWXYXFNH-UHFFFAOYSA-N -1 3 369.400 3.662 20 0 FHADHM Cc1cc(C(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(C)C)cc(C)c1F ZINC000826260347 608155222 /nfs/dbraw/zinc/15/52/22/608155222.db2.gz JWCGXDUWXYXFNH-UHFFFAOYSA-N -1 3 369.400 3.662 20 0 FHADHM Cc1cc(C(=O)N(C)c2cc(Cl)ccc2-c2nnn[n-]2)cc(C)c1F ZINC000826256788 608160523 /nfs/dbraw/zinc/16/05/23/608160523.db2.gz AGCYSCYWGJBFIR-UHFFFAOYSA-N -1 3 359.792 3.553 20 0 FHADHM Cc1cc(C(=O)N(C)c2cc(Cl)ccc2-c2nn[n-]n2)cc(C)c1F ZINC000826256788 608160524 /nfs/dbraw/zinc/16/05/24/608160524.db2.gz AGCYSCYWGJBFIR-UHFFFAOYSA-N -1 3 359.792 3.553 20 0 FHADHM Cc1cccc(C2=CCN(C(=O)C=Cc3ccccc3-c3nnn[n-]3)CC2)c1 ZINC000826297222 608163543 /nfs/dbraw/zinc/16/35/43/608163543.db2.gz ZEEJFRKLECQDQI-MDZDMXLPSA-N -1 3 371.444 3.504 20 0 FHADHM Cc1cccc(C2=CCN(C(=O)C=Cc3ccccc3-c3nn[n-]n3)CC2)c1 ZINC000826297222 608163545 /nfs/dbraw/zinc/16/35/45/608163545.db2.gz ZEEJFRKLECQDQI-MDZDMXLPSA-N -1 3 371.444 3.504 20 0 FHADHM C[C@@H](OC(=O)[C@H]1CCSc2ccccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000824715941 608182087 /nfs/dbraw/zinc/18/20/87/608182087.db2.gz VKZBINLGAZPESJ-WBMJQRKESA-N -1 3 366.446 3.751 20 0 FHADHM C[C@@H](OC(=O)[C@H]1CCSc2ccccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000824715941 608182088 /nfs/dbraw/zinc/18/20/88/608182088.db2.gz VKZBINLGAZPESJ-WBMJQRKESA-N -1 3 366.446 3.751 20 0 FHADHM CC(=O)CCCCCCC(=O)Nc1ccc(OC(C)C)c(-c2nnn[n-]2)c1 ZINC000823967835 608194852 /nfs/dbraw/zinc/19/48/52/608194852.db2.gz QGLCLDKABOTYOQ-UHFFFAOYSA-N -1 3 373.457 3.522 20 0 FHADHM CC(=O)CCCCCCC(=O)Nc1ccc(OC(C)C)c(-c2nn[n-]n2)c1 ZINC000823967835 608194854 /nfs/dbraw/zinc/19/48/54/608194854.db2.gz QGLCLDKABOTYOQ-UHFFFAOYSA-N -1 3 373.457 3.522 20 0 FHADHM Fc1cccc([C@H](Nc2ccc(F)cc2-c2nnn[n-]2)c2ccccn2)c1 ZINC000826376903 608234230 /nfs/dbraw/zinc/23/42/30/608234230.db2.gz XROAHOXUIAQNHK-SFHVURJKSA-N -1 3 364.359 3.741 20 0 FHADHM Fc1cccc([C@H](Nc2ccc(F)cc2-c2nn[n-]n2)c2ccccn2)c1 ZINC000826376903 608234232 /nfs/dbraw/zinc/23/42/32/608234232.db2.gz XROAHOXUIAQNHK-SFHVURJKSA-N -1 3 364.359 3.741 20 0 FHADHM Cc1cccc([C@H](NCc2cc(-c3nnn[n-]3)cs2)c2ccccn2)c1 ZINC000826296545 608242019 /nfs/dbraw/zinc/24/20/19/608242019.db2.gz AQASSNKANTYFES-SFHVURJKSA-N -1 3 362.462 3.511 20 0 FHADHM Cc1cccc([C@H](NCc2cc(-c3nn[n-]n3)cs2)c2ccccn2)c1 ZINC000826296545 608242020 /nfs/dbraw/zinc/24/20/20/608242020.db2.gz AQASSNKANTYFES-SFHVURJKSA-N -1 3 362.462 3.511 20 0 FHADHM C[C@@H](CC(=O)N(C)c1ccccc1-c1nnn[n-]1)Cc1ccc(Cl)cc1 ZINC000824384345 608261364 /nfs/dbraw/zinc/26/13/64/608261364.db2.gz AUAGXGAMECXLFC-CYBMUJFWSA-N -1 3 369.856 3.752 20 0 FHADHM C[C@@H](CC(=O)N(C)c1ccccc1-c1nn[n-]n1)Cc1ccc(Cl)cc1 ZINC000824384345 608261365 /nfs/dbraw/zinc/26/13/65/608261365.db2.gz AUAGXGAMECXLFC-CYBMUJFWSA-N -1 3 369.856 3.752 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)[C@H](c1ccccc1)C1CC1 ZINC000826452209 608266066 /nfs/dbraw/zinc/26/60/66/608266066.db2.gz LEHPEWBPEZDFAX-MRXNPFEDSA-N -1 3 353.813 3.652 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)[C@H](c1ccccc1)C1CC1 ZINC000826452209 608266068 /nfs/dbraw/zinc/26/60/68/608266068.db2.gz LEHPEWBPEZDFAX-MRXNPFEDSA-N -1 3 353.813 3.652 20 0 FHADHM O=C(C=Cc1ccc2[nH]ccc2c1)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000826400546 608266289 /nfs/dbraw/zinc/26/62/89/608266289.db2.gz BDJGUMLVDLBITR-KXFIGUGUSA-N -1 3 364.796 3.653 20 0 FHADHM O=C(C=Cc1ccc2[nH]ccc2c1)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000826400546 608266291 /nfs/dbraw/zinc/26/62/91/608266291.db2.gz BDJGUMLVDLBITR-KXFIGUGUSA-N -1 3 364.796 3.653 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)c(NCc2cccc(COc3ccccc3)c2)n1 ZINC000826277463 608277084 /nfs/dbraw/zinc/27/70/84/608277084.db2.gz VORWGTFLOUCCTL-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)c(NCc2cccc(COc3ccccc3)c2)n1 ZINC000826277463 608277085 /nfs/dbraw/zinc/27/70/85/608277085.db2.gz VORWGTFLOUCCTL-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1csc(C)c1C ZINC000825319119 608292161 /nfs/dbraw/zinc/29/21/61/608292161.db2.gz YYXQAOBGUASWRS-UHFFFAOYSA-N -1 3 355.467 3.597 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1csc(C)c1C ZINC000825319119 608292163 /nfs/dbraw/zinc/29/21/63/608292163.db2.gz YYXQAOBGUASWRS-UHFFFAOYSA-N -1 3 355.467 3.597 20 0 FHADHM Cc1ccc(CNc2nc(C)ccc2-c2nnn[n-]2)c(OC(C)(C)C)c1 ZINC000826288479 608295557 /nfs/dbraw/zinc/29/55/57/608295557.db2.gz IURHGBCQNSHYSU-UHFFFAOYSA-N -1 3 352.442 3.668 20 0 FHADHM Cc1ccc(CNc2nc(C)ccc2-c2nn[n-]n2)c(OC(C)(C)C)c1 ZINC000826288479 608295558 /nfs/dbraw/zinc/29/55/58/608295558.db2.gz IURHGBCQNSHYSU-UHFFFAOYSA-N -1 3 352.442 3.668 20 0 FHADHM FC(F)(F)c1ccc(C2CCN(c3cnccc3-c3nnn[n-]3)CC2)cc1 ZINC000826368418 608298117 /nfs/dbraw/zinc/29/81/17/608298117.db2.gz ORVKZELCDVQESL-UHFFFAOYSA-N -1 3 374.370 3.665 20 0 FHADHM FC(F)(F)c1ccc(C2CCN(c3cnccc3-c3nn[n-]n3)CC2)cc1 ZINC000826368418 608298119 /nfs/dbraw/zinc/29/81/19/608298119.db2.gz ORVKZELCDVQESL-UHFFFAOYSA-N -1 3 374.370 3.665 20 0 FHADHM O=C(NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1)c1ccccc1F ZINC000826441126 608304210 /nfs/dbraw/zinc/30/42/10/608304210.db2.gz OWIMWNZBMHKQJR-UHFFFAOYSA-N -1 3 373.391 3.603 20 0 FHADHM O=C(NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1)c1ccccc1F ZINC000826441126 608304211 /nfs/dbraw/zinc/30/42/11/608304211.db2.gz OWIMWNZBMHKQJR-UHFFFAOYSA-N -1 3 373.391 3.603 20 0 FHADHM CC(F)(F)CCC(=O)NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000824466554 608327346 /nfs/dbraw/zinc/32/73/46/608327346.db2.gz YCYABZLLJHKBTB-UHFFFAOYSA-N -1 3 371.391 3.585 20 0 FHADHM CC(F)(F)CCC(=O)NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000824466554 608327347 /nfs/dbraw/zinc/32/73/47/608327347.db2.gz YCYABZLLJHKBTB-UHFFFAOYSA-N -1 3 371.391 3.585 20 0 FHADHM CC(=O)c1c(F)cccc1N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000824011042 608441264 /nfs/dbraw/zinc/44/12/64/608441264.db2.gz WYPDGQZUDFYEGR-UHFFFAOYSA-N -1 3 363.396 3.502 20 0 FHADHM CC(=O)c1c(F)cccc1N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000824011042 608441266 /nfs/dbraw/zinc/44/12/66/608441266.db2.gz WYPDGQZUDFYEGR-UHFFFAOYSA-N -1 3 363.396 3.502 20 0 FHADHM FC(F)(F)c1ccnc(N2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)c1 ZINC000826369208 608442371 /nfs/dbraw/zinc/44/23/71/608442371.db2.gz SALSXCBPNIGUMY-UHFFFAOYSA-N -1 3 372.354 3.574 20 0 FHADHM FC(F)(F)c1ccnc(N2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)c1 ZINC000826369208 608442373 /nfs/dbraw/zinc/44/23/73/608442373.db2.gz SALSXCBPNIGUMY-UHFFFAOYSA-N -1 3 372.354 3.574 20 0 FHADHM CCCCCn1cc(CNc2ccc(-c3nnn[n-]3)c(Cl)c2)c(C)n1 ZINC000825281382 608444785 /nfs/dbraw/zinc/44/47/85/608444785.db2.gz CBSLCXOWVMCOON-UHFFFAOYSA-N -1 3 359.865 3.827 20 0 FHADHM CCCCCn1cc(CNc2ccc(-c3nn[n-]n3)c(Cl)c2)c(C)n1 ZINC000825281382 608444788 /nfs/dbraw/zinc/44/47/88/608444788.db2.gz CBSLCXOWVMCOON-UHFFFAOYSA-N -1 3 359.865 3.827 20 0 FHADHM C[C@H](NCc1ncc(-c2ccc(F)cc2)o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824632532 608460889 /nfs/dbraw/zinc/46/08/89/608460889.db2.gz AYSVVKYLAGDFFY-LBPRGKRZSA-N -1 3 364.384 3.512 20 0 FHADHM C[C@H](NCc1ncc(-c2ccc(F)cc2)o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824632532 608460890 /nfs/dbraw/zinc/46/08/90/608460890.db2.gz AYSVVKYLAGDFFY-LBPRGKRZSA-N -1 3 364.384 3.512 20 0 FHADHM CC(C)(C)CCCC(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000824087518 608477793 /nfs/dbraw/zinc/47/77/93/608477793.db2.gz WFYFLZORYXLLQX-UHFFFAOYSA-N -1 3 353.470 3.699 20 0 FHADHM CC(C)(C)CCCC(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000824087518 608477794 /nfs/dbraw/zinc/47/77/94/608477794.db2.gz WFYFLZORYXLLQX-UHFFFAOYSA-N -1 3 353.470 3.699 20 0 FHADHM CCC[C@@H](C(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1)C(C)C ZINC000825224826 608478059 /nfs/dbraw/zinc/47/80/59/608478059.db2.gz CRZRWWVFLKBEFB-GOSISDBHSA-N -1 3 353.470 3.555 20 0 FHADHM CCC[C@@H](C(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1)C(C)C ZINC000825224826 608478060 /nfs/dbraw/zinc/47/80/60/608478060.db2.gz CRZRWWVFLKBEFB-GOSISDBHSA-N -1 3 353.470 3.555 20 0 FHADHM Fc1c(CNc2ccccc2N2CCCCC2)cccc1-c1nnn[n-]1 ZINC000826371042 608479536 /nfs/dbraw/zinc/47/95/36/608479536.db2.gz QBOUUDQATYSTJP-UHFFFAOYSA-N -1 3 352.417 3.608 20 0 FHADHM Fc1c(CNc2ccccc2N2CCCCC2)cccc1-c1nn[n-]n1 ZINC000826371042 608479537 /nfs/dbraw/zinc/47/95/37/608479537.db2.gz QBOUUDQATYSTJP-UHFFFAOYSA-N -1 3 352.417 3.608 20 0 FHADHM O=C(c1ccc(Cl)s1)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000826473414 608481183 /nfs/dbraw/zinc/48/11/83/608481183.db2.gz XLVZQPPYRZZDBI-UHFFFAOYSA-N -1 3 371.853 3.511 20 0 FHADHM O=C(c1ccc(Cl)s1)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000826473414 608481184 /nfs/dbraw/zinc/48/11/84/608481184.db2.gz XLVZQPPYRZZDBI-UHFFFAOYSA-N -1 3 371.853 3.511 20 0 FHADHM CC1(C)CCC[C@@H](C(=O)N2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)C1 ZINC000824801464 608484395 /nfs/dbraw/zinc/48/43/95/608484395.db2.gz FTSAPAUCVRXHJZ-GOSISDBHSA-N -1 3 365.481 3.699 20 0 FHADHM CC1(C)CCC[C@@H](C(=O)N2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)C1 ZINC000824801464 608484396 /nfs/dbraw/zinc/48/43/96/608484396.db2.gz FTSAPAUCVRXHJZ-GOSISDBHSA-N -1 3 365.481 3.699 20 0 FHADHM CSc1cccc(NC(=O)N(C)Cc2cccc(-c3nnn[n-]3)c2)c1C ZINC000826231004 608517918 /nfs/dbraw/zinc/51/79/18/608517918.db2.gz SLMIBSYZMBGMON-UHFFFAOYSA-N -1 3 368.466 3.561 20 0 FHADHM CSc1cccc(NC(=O)N(C)Cc2cccc(-c3nn[n-]n3)c2)c1C ZINC000826231004 608517919 /nfs/dbraw/zinc/51/79/19/608517919.db2.gz SLMIBSYZMBGMON-UHFFFAOYSA-N -1 3 368.466 3.561 20 0 FHADHM CCC[C@H](NCc1cccc(-c2nnn[n-]2)c1F)c1ccc(F)cc1F ZINC000825242755 608553461 /nfs/dbraw/zinc/55/34/61/608553461.db2.gz ZYNOQMMLVDRNDP-INIZCTEOSA-N -1 3 361.371 3.915 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CN[C@H](C)c1c(F)cccc1Cl ZINC000826170345 608553765 /nfs/dbraw/zinc/55/37/65/608553765.db2.gz XCBRCLMVGKGCAY-SNVBAGLBSA-N -1 3 361.808 3.519 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CN[C@H](C)c1c(F)cccc1Cl ZINC000826170345 608553766 /nfs/dbraw/zinc/55/37/66/608553766.db2.gz XCBRCLMVGKGCAY-SNVBAGLBSA-N -1 3 361.808 3.519 20 0 FHADHM Fc1c(CNC(c2ccccc2)c2ccccc2)cccc1-c1nnn[n-]1 ZINC000826370921 608651326 /nfs/dbraw/zinc/65/13/26/608651326.db2.gz LPWOXVKHZBPOFF-UHFFFAOYSA-N -1 3 359.408 3.885 20 0 FHADHM Fc1c(CNC(c2ccccc2)c2ccccc2)cccc1-c1nn[n-]n1 ZINC000826370921 608651327 /nfs/dbraw/zinc/65/13/27/608651327.db2.gz LPWOXVKHZBPOFF-UHFFFAOYSA-N -1 3 359.408 3.885 20 0 FHADHM FC(F)(F)c1ccccc1[C@H]1CCCN1Cc1ccc(-c2nnn[n-]2)o1 ZINC000826369215 608675335 /nfs/dbraw/zinc/67/53/35/608675335.db2.gz SGPQBZHZASJIFI-CQSZACIVSA-N -1 3 363.343 3.816 20 0 FHADHM FC(F)(F)c1ccccc1[C@H]1CCCN1Cc1ccc(-c2nn[n-]n2)o1 ZINC000826369215 608675337 /nfs/dbraw/zinc/67/53/37/608675337.db2.gz SGPQBZHZASJIFI-CQSZACIVSA-N -1 3 363.343 3.816 20 0 FHADHM Cc1ccc(C)c([C@H]2CN(Cc3ccc(-c4nnn[n-]4)s3)[C@@H](C)CO2)c1 ZINC000826284843 608729398 /nfs/dbraw/zinc/72/93/98/608729398.db2.gz HTRGOZBZPLNXKP-WMLDXEAASA-N -1 3 369.494 3.507 20 0 FHADHM Cc1ccc(C)c([C@H]2CN(Cc3ccc(-c4nn[n-]n4)s3)[C@@H](C)CO2)c1 ZINC000826284843 608729402 /nfs/dbraw/zinc/72/94/02/608729402.db2.gz HTRGOZBZPLNXKP-WMLDXEAASA-N -1 3 369.494 3.507 20 0 FHADHM c1ccc(COCc2ccc(CNc3cnccc3-c3nnn[n-]3)cc2)cc1 ZINC000826521618 608776339 /nfs/dbraw/zinc/77/63/39/608776339.db2.gz SJVIKVITTKFJGO-UHFFFAOYSA-N -1 3 372.432 3.591 20 0 FHADHM c1ccc(COCc2ccc(CNc3cnccc3-c3nn[n-]n3)cc2)cc1 ZINC000826521618 608776343 /nfs/dbraw/zinc/77/63/43/608776343.db2.gz SJVIKVITTKFJGO-UHFFFAOYSA-N -1 3 372.432 3.591 20 0 FHADHM FC(F)(F)c1ccccc1C1CCN(c2cnccc2-c2nnn[n-]2)CC1 ZINC000826369374 608791825 /nfs/dbraw/zinc/79/18/25/608791825.db2.gz ZXQUBODFCYEPEO-UHFFFAOYSA-N -1 3 374.370 3.665 20 0 FHADHM FC(F)(F)c1ccccc1C1CCN(c2cnccc2-c2nn[n-]n2)CC1 ZINC000826369374 608791826 /nfs/dbraw/zinc/79/18/26/608791826.db2.gz ZXQUBODFCYEPEO-UHFFFAOYSA-N -1 3 374.370 3.665 20 0 FHADHM O=C(O[C@@H](C1CCCCC1)C(F)(F)F)c1cccc(-c2nnn[n-]2)c1 ZINC000826461642 608827574 /nfs/dbraw/zinc/82/75/74/608827574.db2.gz BXENDRMFVSDADP-ZDUSSCGKSA-N -1 3 354.332 3.535 20 0 FHADHM O=C(O[C@@H](C1CCCCC1)C(F)(F)F)c1cccc(-c2nn[n-]n2)c1 ZINC000826461642 608827575 /nfs/dbraw/zinc/82/75/75/608827575.db2.gz BXENDRMFVSDADP-ZDUSSCGKSA-N -1 3 354.332 3.535 20 0 FHADHM O=C(CCc1ccc(-c2nnn[n-]2)cc1)N1CCC[C@H]1/C=C\c1ccccc1 ZINC000826408549 609137963 /nfs/dbraw/zinc/13/79/63/609137963.db2.gz LIGBAHIENASJKF-JYHGAKRHSA-N -1 3 373.460 3.504 20 0 FHADHM O=C(CCc1ccc(-c2nn[n-]n2)cc1)N1CCC[C@H]1/C=C\c1ccccc1 ZINC000826408549 609137966 /nfs/dbraw/zinc/13/79/66/609137966.db2.gz LIGBAHIENASJKF-JYHGAKRHSA-N -1 3 373.460 3.504 20 0 FHADHM COc1ccc(Cl)cc1CN[C@H](C)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000826208709 609139243 /nfs/dbraw/zinc/13/92/43/609139243.db2.gz WXUXYMYRWIRTEE-SNVBAGLBSA-N -1 3 361.808 3.519 20 0 FHADHM C[C@H](N[C@H](c1ccccc1)c1cccnc1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824537418 609139477 /nfs/dbraw/zinc/13/94/77/609139477.db2.gz DXKYXNQJWFUKPR-VBKZILBWSA-N -1 3 374.423 3.841 20 0 FHADHM C[C@H](N[C@H](c1ccccc1)c1cccnc1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824537418 609139478 /nfs/dbraw/zinc/13/94/78/609139478.db2.gz DXKYXNQJWFUKPR-VBKZILBWSA-N -1 3 374.423 3.841 20 0 FHADHM C[C@@H](NCc1cc(-c2ccccc2)on1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824605839 609139706 /nfs/dbraw/zinc/13/97/06/609139706.db2.gz MFWOERFSXYDZPJ-GFCCVEGCSA-N -1 3 364.384 3.512 20 0 FHADHM C[C@@H](NCc1cc(-c2ccccc2)on1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824605839 609139708 /nfs/dbraw/zinc/13/97/08/609139708.db2.gz MFWOERFSXYDZPJ-GFCCVEGCSA-N -1 3 364.384 3.512 20 0 FHADHM Fc1cccc(F)c1[C@H](NCc1ccc(-c2nnn[n-]2)cc1)C(F)(F)F ZINC000826377136 609152606 /nfs/dbraw/zinc/15/26/06/609152606.db2.gz GNCGSPXLRUUJIA-AWEZNQCLSA-N -1 3 369.297 3.538 20 0 FHADHM Fc1cccc(F)c1[C@H](NCc1ccc(-c2nn[n-]n2)cc1)C(F)(F)F ZINC000826377136 609152607 /nfs/dbraw/zinc/15/26/07/609152607.db2.gz GNCGSPXLRUUJIA-AWEZNQCLSA-N -1 3 369.297 3.538 20 0 FHADHM COc1cc(C)c(N[C@@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)cc1OC ZINC000826178034 609158702 /nfs/dbraw/zinc/15/87/02/609158702.db2.gz HCLIWMPMVNELEJ-NSHDSACASA-N -1 3 357.389 3.505 20 0 FHADHM COc1cc(C)c(N[C@@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)cc1OC ZINC000826178034 609158704 /nfs/dbraw/zinc/15/87/04/609158704.db2.gz HCLIWMPMVNELEJ-NSHDSACASA-N -1 3 357.389 3.505 20 0 FHADHM C[C@@H](Nc1ccc(N2CCCC2)cc1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824655902 609162156 /nfs/dbraw/zinc/16/21/56/609162156.db2.gz GTJKNTIDLMMPAF-CYBMUJFWSA-N -1 3 352.417 3.779 20 0 FHADHM C[C@@H](Nc1ccc(N2CCCC2)cc1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824655902 609162158 /nfs/dbraw/zinc/16/21/58/609162158.db2.gz GTJKNTIDLMMPAF-CYBMUJFWSA-N -1 3 352.417 3.779 20 0 FHADHM C[C@H]1CCN(c2cc(-c3nnn[n-]3)c3ccccc3n2)[C@@H](c2ccco2)C1 ZINC000824961894 609164507 /nfs/dbraw/zinc/16/45/07/609164507.db2.gz KPFOABVCODHSGT-SUMWQHHRSA-N -1 3 360.421 3.986 20 0 FHADHM C[C@H]1CCN(c2cc(-c3nn[n-]n3)c3ccccc3n2)[C@@H](c2ccco2)C1 ZINC000824961894 609164508 /nfs/dbraw/zinc/16/45/08/609164508.db2.gz KPFOABVCODHSGT-SUMWQHHRSA-N -1 3 360.421 3.986 20 0 FHADHM Cc1c(C)n(-c2ccccc2)c(NC(=O)C[C@@H]2C=CCC2)c1-c1nnn[n-]1 ZINC000826233860 609168154 /nfs/dbraw/zinc/16/81/54/609168154.db2.gz YDZZVBCOKYXAAM-OAHLLOKOSA-N -1 3 362.437 3.569 20 0 FHADHM Cc1c(C)n(-c2ccccc2)c(NC(=O)C[C@@H]2C=CCC2)c1-c1nn[n-]n1 ZINC000826233860 609168155 /nfs/dbraw/zinc/16/81/55/609168155.db2.gz YDZZVBCOKYXAAM-OAHLLOKOSA-N -1 3 362.437 3.569 20 0 FHADHM CN(Cc1ccc(Oc2ccccc2)o1)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000825962130 609171995 /nfs/dbraw/zinc/17/19/95/609171995.db2.gz RRQAOSRYQOHHOT-UHFFFAOYSA-N -1 3 361.405 3.884 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NCc1ccccc1OC(F)F ZINC000825481316 609179453 /nfs/dbraw/zinc/17/94/53/609179453.db2.gz WPKYDQWSSGINHK-UHFFFAOYSA-N -1 3 360.368 3.512 20 0 FHADHM COCCOc1c(Cl)cccc1N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000826160664 609247877 /nfs/dbraw/zinc/24/78/77/609247877.db2.gz AKWITYYWDMMGBS-LBPRGKRZSA-N -1 3 373.844 3.718 20 0 FHADHM COCCOc1c(Cl)cccc1N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000826160664 609247879 /nfs/dbraw/zinc/24/78/79/609247879.db2.gz AKWITYYWDMMGBS-LBPRGKRZSA-N -1 3 373.844 3.718 20 0 FHADHM C[C@H](Nc1cnn(-c2ccccc2Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824662405 609251692 /nfs/dbraw/zinc/25/16/92/609251692.db2.gz JJXFPLYACURQAY-LBPRGKRZSA-N -1 3 365.828 3.879 20 0 FHADHM C[C@H](Nc1cnn(-c2ccccc2Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824662405 609251693 /nfs/dbraw/zinc/25/16/93/609251693.db2.gz JJXFPLYACURQAY-LBPRGKRZSA-N -1 3 365.828 3.879 20 0 FHADHM Fc1ccc(Oc2ccc(NCc3ccc(-c4nnn[n-]4)s3)cn2)cc1 ZINC000826376294 609266535 /nfs/dbraw/zinc/26/65/35/609266535.db2.gz WRYIJFNPHQVRJC-UHFFFAOYSA-N -1 3 368.397 3.867 20 0 FHADHM CC1(C)Oc2ccc(N[C@H]3CCCc4cc(-c5nnn[n-]5)ccc43)cc2O1 ZINC000824818711 609274960 /nfs/dbraw/zinc/27/49/60/609274960.db2.gz VIWOXZVTOJABNF-INIZCTEOSA-N -1 3 363.421 3.864 20 0 FHADHM CC1(C)Oc2ccc(N[C@H]3CCCc4cc(-c5nn[n-]n5)ccc43)cc2O1 ZINC000824818711 609274962 /nfs/dbraw/zinc/27/49/62/609274962.db2.gz VIWOXZVTOJABNF-INIZCTEOSA-N -1 3 363.421 3.864 20 0 FHADHM COc1ccc(N[C@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)c2cccnc12 ZINC000826209677 609276829 /nfs/dbraw/zinc/27/68/29/609276829.db2.gz LUWAOYXFIRBQGK-LLVKDONJSA-N -1 3 364.384 3.736 20 0 FHADHM COc1ccc(N[C@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)c2cccnc12 ZINC000826209677 609276831 /nfs/dbraw/zinc/27/68/31/609276831.db2.gz LUWAOYXFIRBQGK-LLVKDONJSA-N -1 3 364.384 3.736 20 0 FHADHM CCOc1ccc(OC)cc1N[C@@H](C)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000825643923 609278201 /nfs/dbraw/zinc/27/82/01/609278201.db2.gz WLWBTNUNBAJQMQ-NSHDSACASA-N -1 3 357.389 3.586 20 0 FHADHM CCOc1ccc(OC)cc1N[C@@H](C)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000825643923 609278202 /nfs/dbraw/zinc/27/82/02/609278202.db2.gz WLWBTNUNBAJQMQ-NSHDSACASA-N -1 3 357.389 3.586 20 0 FHADHM COc1cc(N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c(OC)cc1Cl ZINC000826180790 609280049 /nfs/dbraw/zinc/28/00/49/609280049.db2.gz XETNYBZVBKDKQR-JTQLQIEISA-N -1 3 359.817 3.710 20 0 FHADHM COc1cc(N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c(OC)cc1Cl ZINC000826180790 609280051 /nfs/dbraw/zinc/28/00/51/609280051.db2.gz XETNYBZVBKDKQR-JTQLQIEISA-N -1 3 359.817 3.710 20 0 FHADHM O=C(c1ccc(Cl)c(-c2nnn[n-]2)c1)N1CCC[C@@H]1c1cccc(F)c1 ZINC000826473421 609290916 /nfs/dbraw/zinc/29/09/16/609290916.db2.gz XPUJJUCGRJGKLM-MRXNPFEDSA-N -1 3 371.803 3.637 20 0 FHADHM O=C(c1ccc(Cl)c(-c2nn[n-]n2)c1)N1CCC[C@@H]1c1cccc(F)c1 ZINC000826473421 609290917 /nfs/dbraw/zinc/29/09/17/609290917.db2.gz XPUJJUCGRJGKLM-MRXNPFEDSA-N -1 3 371.803 3.637 20 0 FHADHM O=C(NCC1CCCC1)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000826434366 609313785 /nfs/dbraw/zinc/31/37/85/609313785.db2.gz LBZSXBOWVCHREO-UHFFFAOYSA-N -1 3 363.421 3.579 20 0 FHADHM O=C(NCC1CCCC1)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000826434366 609313786 /nfs/dbraw/zinc/31/37/86/609313786.db2.gz LBZSXBOWVCHREO-UHFFFAOYSA-N -1 3 363.421 3.579 20 0 FHADHM C[C@H]1CCC[C@H]1NC(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000824937186 609317662 /nfs/dbraw/zinc/31/76/62/609317662.db2.gz ODUCMGWJKLPZGR-XJKSGUPXSA-N -1 3 363.421 3.577 20 0 FHADHM C[C@H]1CCC[C@H]1NC(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000824937186 609317663 /nfs/dbraw/zinc/31/76/63/609317663.db2.gz ODUCMGWJKLPZGR-XJKSGUPXSA-N -1 3 363.421 3.577 20 0 FHADHM CCC(CC)[C@@H]1C[C@@H](Nc2nc3ccccc3cc2-c2nnn[n-]2)CCO1 ZINC000825108336 609322375 /nfs/dbraw/zinc/32/23/75/609322375.db2.gz VVWBCRVJWLJTBF-YJBOKZPZSA-N -1 3 366.469 3.811 20 0 FHADHM CCC(CC)[C@@H]1C[C@@H](Nc2nc3ccccc3cc2-c2nn[n-]n2)CCO1 ZINC000825108336 609322377 /nfs/dbraw/zinc/32/23/77/609322377.db2.gz VVWBCRVJWLJTBF-YJBOKZPZSA-N -1 3 366.469 3.811 20 0 FHADHM C[C@H](N[C@H](c1ccccc1)c1ccccn1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824539310 609322807 /nfs/dbraw/zinc/32/28/07/609322807.db2.gz MSKQTECMVYCXQE-VBKZILBWSA-N -1 3 374.423 3.841 20 0 FHADHM C[C@H](N[C@H](c1ccccc1)c1ccccn1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824539310 609322810 /nfs/dbraw/zinc/32/28/10/609322810.db2.gz MSKQTECMVYCXQE-VBKZILBWSA-N -1 3 374.423 3.841 20 0 FHADHM C[C@H](Nc1cccc(Br)c1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824662391 609346423 /nfs/dbraw/zinc/34/64/23/609346423.db2.gz JDHLRXUJFLGMBE-VIFPVBQESA-N -1 3 362.206 3.941 20 0 FHADHM C[C@H](Nc1cccc(Br)c1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824662391 609346425 /nfs/dbraw/zinc/34/64/25/609346425.db2.gz JDHLRXUJFLGMBE-VIFPVBQESA-N -1 3 362.206 3.941 20 0 FHADHM COc1ccc(OC(C)C)c(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2F)c1 ZINC000826210135 609349563 /nfs/dbraw/zinc/34/95/63/609349563.db2.gz GBBWADVOCAHQLQ-GFCCVEGCSA-N -1 3 371.416 3.975 20 0 FHADHM COc1ccc(OC(C)C)c(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2F)c1 ZINC000826210135 609349565 /nfs/dbraw/zinc/34/95/65/609349565.db2.gz GBBWADVOCAHQLQ-GFCCVEGCSA-N -1 3 371.416 3.975 20 0 FHADHM C[C@H]1CC[C@]2(CCN(C(=O)Nc3ccc(-c4nnn[n-]4)c(Cl)c3)C2)C1 ZINC000824915735 609403289 /nfs/dbraw/zinc/40/32/89/609403289.db2.gz HXFXONZRHPTXRG-GTNSWQLSSA-N -1 3 360.849 3.564 20 0 FHADHM C[C@H]1CC[C@]2(CCN(C(=O)Nc3ccc(-c4nn[n-]n4)c(Cl)c3)C2)C1 ZINC000824915735 609403291 /nfs/dbraw/zinc/40/32/91/609403291.db2.gz HXFXONZRHPTXRG-GTNSWQLSSA-N -1 3 360.849 3.564 20 0 FHADHM CC(=Cc1ccc(C)cc1)C(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000823943917 609424103 /nfs/dbraw/zinc/42/41/03/609424103.db2.gz VCULDHRKUWQMPV-SSZFMOIBSA-N -1 3 373.460 3.770 20 0 FHADHM CC(=Cc1ccc(C)cc1)C(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000823943917 609424104 /nfs/dbraw/zinc/42/41/04/609424104.db2.gz VCULDHRKUWQMPV-SSZFMOIBSA-N -1 3 373.460 3.770 20 0 FHADHM O=C(Nc1ccc(CCCc2ccccc2)cc1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC000826453374 609455318 /nfs/dbraw/zinc/45/53/18/609455318.db2.gz IRRCMCNNDIEYMP-UHFFFAOYSA-N -1 3 372.432 3.622 20 0 FHADHM O=C(Nc1ccc(CCCc2ccccc2)cc1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC000826453374 609455321 /nfs/dbraw/zinc/45/53/21/609455321.db2.gz IRRCMCNNDIEYMP-UHFFFAOYSA-N -1 3 372.432 3.622 20 0 FHADHM FC(F)Oc1cccc(Cl)c1CNc1cccc(-c2nnn[n-]2)c1 ZINC000826370450 609474773 /nfs/dbraw/zinc/47/47/73/609474773.db2.gz TUEHJMNRNWNGAF-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM FC(F)Oc1cccc(Cl)c1CNc1cccc(-c2nn[n-]n2)c1 ZINC000826370450 609474774 /nfs/dbraw/zinc/47/47/74/609474774.db2.gz TUEHJMNRNWNGAF-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM Fc1ccc(C(F)(F)F)cc1NCc1cccc(-c2nnn[n-]2)c1F ZINC000826373651 609479212 /nfs/dbraw/zinc/47/92/12/609479212.db2.gz UZEAKQXGHZMMJQ-UHFFFAOYSA-N -1 3 355.270 3.776 20 0 FHADHM Fc1ccc(C(F)(F)F)cc1NCc1cccc(-c2nn[n-]n2)c1F ZINC000826373651 609479214 /nfs/dbraw/zinc/47/92/14/609479214.db2.gz UZEAKQXGHZMMJQ-UHFFFAOYSA-N -1 3 355.270 3.776 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NCc1cnc(-c2cccs2)s1 ZINC000826278791 609479719 /nfs/dbraw/zinc/47/97/19/609479719.db2.gz TUBBQTAQKUZOID-UHFFFAOYSA-N -1 3 354.464 3.972 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NCc1cnc(-c2cccs2)s1 ZINC000826278791 609479720 /nfs/dbraw/zinc/47/97/20/609479720.db2.gz TUBBQTAQKUZOID-UHFFFAOYSA-N -1 3 354.464 3.972 20 0 FHADHM Fc1c(CNc2ccc(Cl)c(OC(F)F)c2)cccc1-c1nnn[n-]1 ZINC000826371178 609481629 /nfs/dbraw/zinc/48/16/29/609481629.db2.gz VXBKWKMTNDJUOD-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM Fc1c(CNc2ccc(Cl)c(OC(F)F)c2)cccc1-c1nn[n-]n1 ZINC000826371178 609481630 /nfs/dbraw/zinc/48/16/30/609481630.db2.gz VXBKWKMTNDJUOD-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM C[C@@H]1CCC[C@H]1C(=O)N(Cc1ccccc1)c1ccccc1-c1nnn[n-]1 ZINC000824927272 609482342 /nfs/dbraw/zinc/48/23/42/609482342.db2.gz NKSLJHNLLQGDLQ-NVXWUHKLSA-N -1 3 361.449 3.836 20 0 FHADHM C[C@@H]1CCC[C@H]1C(=O)N(Cc1ccccc1)c1ccccc1-c1nn[n-]n1 ZINC000824927272 609482344 /nfs/dbraw/zinc/48/23/44/609482344.db2.gz NKSLJHNLLQGDLQ-NVXWUHKLSA-N -1 3 361.449 3.836 20 0 FHADHM C[C@@H]1CCC[C@@H]1C(=O)N(Cc1ccccc1)c1ccccc1-c1nnn[n-]1 ZINC000824927274 609482601 /nfs/dbraw/zinc/48/26/01/609482601.db2.gz NKSLJHNLLQGDLQ-WBVHZDCISA-N -1 3 361.449 3.836 20 0 FHADHM C[C@@H]1CCC[C@@H]1C(=O)N(Cc1ccccc1)c1ccccc1-c1nn[n-]n1 ZINC000824927274 609482602 /nfs/dbraw/zinc/48/26/02/609482602.db2.gz NKSLJHNLLQGDLQ-WBVHZDCISA-N -1 3 361.449 3.836 20 0 FHADHM Fc1cc(NCc2ccco2)ccc1OCc1cccc(-c2nnn[n-]2)c1 ZINC000826372570 609484191 /nfs/dbraw/zinc/48/41/91/609484191.db2.gz CPTYUDVVSHOICT-UHFFFAOYSA-N -1 3 365.368 3.790 20 0 FHADHM Fc1cc(NCc2ccco2)ccc1OCc1cccc(-c2nn[n-]n2)c1 ZINC000826372570 609484193 /nfs/dbraw/zinc/48/41/93/609484193.db2.gz CPTYUDVVSHOICT-UHFFFAOYSA-N -1 3 365.368 3.790 20 0 FHADHM C[C@H](C(=O)N(Cc1ccco1)c1ccccc1-c1nnn[n-]1)c1ccccc1 ZINC000826232119 609484462 /nfs/dbraw/zinc/48/44/62/609484462.db2.gz PDOUWIDYEKJGML-HNNXBMFYSA-N -1 3 373.416 3.797 20 0 FHADHM C[C@H](C(=O)N(Cc1ccco1)c1ccccc1-c1nn[n-]n1)c1ccccc1 ZINC000826232119 609484466 /nfs/dbraw/zinc/48/44/66/609484466.db2.gz PDOUWIDYEKJGML-HNNXBMFYSA-N -1 3 373.416 3.797 20 0 FHADHM CC[C@H](C)[C@H](C)C(=O)Nc1ncc(Cc2ccc(-c3nnn[n-]3)cc2)s1 ZINC000825052145 609517007 /nfs/dbraw/zinc/51/70/07/609517007.db2.gz VANAKBVDOHVJMJ-RYUDHWBXSA-N -1 3 370.482 3.535 20 0 FHADHM CC[C@H](C)[C@H](C)C(=O)Nc1ncc(Cc2ccc(-c3nn[n-]n3)cc2)s1 ZINC000825052145 609517008 /nfs/dbraw/zinc/51/70/08/609517008.db2.gz VANAKBVDOHVJMJ-RYUDHWBXSA-N -1 3 370.482 3.535 20 0 FHADHM Cc1ccnc(N2CCC[C@@H]2c2nc3ccccc3s2)c1-c1nnn[n-]1 ZINC000826310679 609520771 /nfs/dbraw/zinc/52/07/71/609520771.db2.gz FAFOAKDZAFZSDQ-CYBMUJFWSA-N -1 3 363.450 3.521 20 0 FHADHM Cc1ccnc(N2CCC[C@@H]2c2nc3ccccc3s2)c1-c1nn[n-]n1 ZINC000826310679 609520772 /nfs/dbraw/zinc/52/07/72/609520772.db2.gz FAFOAKDZAFZSDQ-CYBMUJFWSA-N -1 3 363.450 3.521 20 0 FHADHM CC[C@@H](Nc1ncc(Cl)c(C)c1-c1nnn[n-]1)c1ccc(OC)cc1 ZINC000825149122 609521700 /nfs/dbraw/zinc/52/17/00/609521700.db2.gz VIDGMORNASLPPM-CQSZACIVSA-N -1 3 358.833 3.795 20 0 FHADHM CC[C@@H](Nc1ncc(Cl)c(C)c1-c1nn[n-]n1)c1ccc(OC)cc1 ZINC000825149122 609521701 /nfs/dbraw/zinc/52/17/01/609521701.db2.gz VIDGMORNASLPPM-CQSZACIVSA-N -1 3 358.833 3.795 20 0 FHADHM Cc1c(Cl)cnc(NCc2cccc(OC(C)C)c2)c1-c1nnn[n-]1 ZINC000826240483 609537565 /nfs/dbraw/zinc/53/75/65/609537565.db2.gz VMXWJWWVJZQRFJ-UHFFFAOYSA-N -1 3 358.833 3.623 20 0 FHADHM Cc1c(Cl)cnc(NCc2cccc(OC(C)C)c2)c1-c1nn[n-]n1 ZINC000826240483 609537566 /nfs/dbraw/zinc/53/75/66/609537566.db2.gz VMXWJWWVJZQRFJ-UHFFFAOYSA-N -1 3 358.833 3.623 20 0 FHADHM Cc1csc([C@H](Nc2ncc(Cl)c(C)c2-c2nnn[n-]2)C2CC2)n1 ZINC000826320293 609560542 /nfs/dbraw/zinc/56/05/42/609560542.db2.gz LWNYGOOOQAKOQK-GFCCVEGCSA-N -1 3 361.862 3.552 20 0 FHADHM Cc1csc([C@H](Nc2ncc(Cl)c(C)c2-c2nn[n-]n2)C2CC2)n1 ZINC000826320293 609560545 /nfs/dbraw/zinc/56/05/45/609560545.db2.gz LWNYGOOOQAKOQK-GFCCVEGCSA-N -1 3 361.862 3.552 20 0 FHADHM CC[C@@H](Nc1nccc(C)c1-c1nnn[n-]1)c1nc(C(F)(F)F)cs1 ZINC000825147566 609564869 /nfs/dbraw/zinc/56/48/69/609564869.db2.gz JLDQNXYMZBMNEA-MRVPVSSYSA-N -1 3 369.376 3.609 20 0 FHADHM CC[C@@H](Nc1nccc(C)c1-c1nn[n-]n1)c1nc(C(F)(F)F)cs1 ZINC000825147566 609564870 /nfs/dbraw/zinc/56/48/70/609564870.db2.gz JLDQNXYMZBMNEA-MRVPVSSYSA-N -1 3 369.376 3.609 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1N1CCC[C@@H]1/C=C/c1ccccc1 ZINC000826350954 609579857 /nfs/dbraw/zinc/57/98/57/609579857.db2.gz RGEIDWWYJJXXRZ-XVJNWHFHSA-N -1 3 352.829 3.597 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1N1CCC[C@@H]1/C=C/c1ccccc1 ZINC000826350954 609579859 /nfs/dbraw/zinc/57/98/59/609579859.db2.gz RGEIDWWYJJXXRZ-XVJNWHFHSA-N -1 3 352.829 3.597 20 0 FHADHM CCC(CC)[C@H]1C[C@@H](Nc2ncc(Cl)c(C)c2-c2nnn[n-]2)CCO1 ZINC000825106661 609585298 /nfs/dbraw/zinc/58/52/98/609585298.db2.gz HTBZJTSMCISGRY-GXTWGEPZSA-N -1 3 364.881 3.619 20 0 FHADHM CCC(CC)[C@H]1C[C@@H](Nc2ncc(Cl)c(C)c2-c2nn[n-]n2)CCO1 ZINC000825106661 609585300 /nfs/dbraw/zinc/58/53/00/609585300.db2.gz HTBZJTSMCISGRY-GXTWGEPZSA-N -1 3 364.881 3.619 20 0 FHADHM COc1cccc([C@H]2C[C@@H](C)CN2c2ccc(F)cc2-c2nnn[n-]2)c1 ZINC000826214975 609593120 /nfs/dbraw/zinc/59/31/20/609593120.db2.gz CHPOZFMXKCHWAY-KZULUSFZSA-N -1 3 353.401 3.602 20 0 FHADHM COc1cccc([C@H]2C[C@@H](C)CN2c2ccc(F)cc2-c2nn[n-]n2)c1 ZINC000826214975 609593121 /nfs/dbraw/zinc/59/31/21/609593121.db2.gz CHPOZFMXKCHWAY-KZULUSFZSA-N -1 3 353.401 3.602 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)N1CCC[C@@H]1/C=C/c1ccccc1 ZINC000826452437 609606989 /nfs/dbraw/zinc/60/69/89/609606989.db2.gz TZCJVFPTEWGWJD-INMULRNOSA-N -1 3 360.421 3.576 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)N1CCC[C@@H]1/C=C/c1ccccc1 ZINC000826452437 609606991 /nfs/dbraw/zinc/60/69/91/609606991.db2.gz TZCJVFPTEWGWJD-INMULRNOSA-N -1 3 360.421 3.576 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)N1CCC[C@@H]1/C=C\c1ccccc1 ZINC000826456297 609607954 /nfs/dbraw/zinc/60/79/54/609607954.db2.gz XTHNPCDEXJLEBT-YUIUBULTSA-N -1 3 360.421 3.576 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)N1CCC[C@@H]1/C=C\c1ccccc1 ZINC000826456297 609607955 /nfs/dbraw/zinc/60/79/55/609607955.db2.gz XTHNPCDEXJLEBT-YUIUBULTSA-N -1 3 360.421 3.576 20 0 FHADHM Fc1cccc([C@H](NCc2ccc(-c3nnn[n-]3)cc2)C(F)(F)F)c1F ZINC000826376603 609608796 /nfs/dbraw/zinc/60/87/96/609608796.db2.gz KTXADASDUAXRCI-AWEZNQCLSA-N -1 3 369.297 3.538 20 0 FHADHM Fc1cccc([C@H](NCc2ccc(-c3nn[n-]n3)cc2)C(F)(F)F)c1F ZINC000826376603 609608797 /nfs/dbraw/zinc/60/87/97/609608797.db2.gz KTXADASDUAXRCI-AWEZNQCLSA-N -1 3 369.297 3.538 20 0 FHADHM O=C(OCc1ccc(Cl)cc1-c1nnn[n-]1)c1cccc(C(F)F)c1 ZINC000826465237 609616288 /nfs/dbraw/zinc/61/62/88/609616288.db2.gz FDHSNQLFFZLQGJ-UHFFFAOYSA-N -1 3 364.739 3.815 20 0 FHADHM O=C(OCc1ccc(Cl)cc1-c1nn[n-]n1)c1cccc(C(F)F)c1 ZINC000826465237 609616289 /nfs/dbraw/zinc/61/62/89/609616289.db2.gz FDHSNQLFFZLQGJ-UHFFFAOYSA-N -1 3 364.739 3.815 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@@H]1C(=O)OCc1ccc(Cl)cc1-c1nnn[n-]1 ZINC000826316471 609616312 /nfs/dbraw/zinc/61/63/12/609616312.db2.gz PGHXEFKIMNEQCU-KGLIPLIRSA-N -1 3 374.853 3.737 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@@H]1C(=O)OCc1ccc(Cl)cc1-c1nn[n-]n1 ZINC000826316471 609616313 /nfs/dbraw/zinc/61/63/13/609616313.db2.gz PGHXEFKIMNEQCU-KGLIPLIRSA-N -1 3 374.853 3.737 20 0 FHADHM O=C(/C=C\c1cccc(F)c1)NCc1ccc([O-])c(Br)c1 ZINC000255558417 936325577 /nfs/dbraw/zinc/32/55/77/936325577.db2.gz UUFWTOAXQBGFBP-ALCCZGGFSA-N -1 3 350.187 3.623 20 0 FHADHM O=S(=O)([N-]Cc1cc(C2CC2)ccc1F)c1cccnc1C(F)(F)F ZINC000583066064 937096275 /nfs/dbraw/zinc/09/62/75/937096275.db2.gz WKJLBBMAKHRGHH-UHFFFAOYSA-N -1 3 374.359 3.595 20 0 FHADHM Cc1nc(-c2ccccn2)sc1C(=O)[N-]c1nnc(C(C)(C)C)s1 ZINC001125274940 927283883 /nfs/dbraw/zinc/28/38/83/927283883.db2.gz IINBFIAANZTGIF-UHFFFAOYSA-N -1 3 359.480 3.915 20 0 FHADHM Fc1cc(Br)c(-c2noc(-c3cc(Cl)n[n-]3)n2)cc1F ZINC001213501000 927286891 /nfs/dbraw/zinc/28/68/91/927286891.db2.gz WJLZQURCNWHYHX-UHFFFAOYSA-N -1 3 361.533 3.821 20 0 FHADHM O=C(N=c1cc2ccccn2[n-]1)N1CCC[C@H]1Cc1c(F)cccc1Cl ZINC000579750013 927288034 /nfs/dbraw/zinc/28/80/34/927288034.db2.gz UQWPDFDSETXTSC-ZDUSSCGKSA-N -1 3 372.831 3.788 20 0 FHADHM [O-]C(=NO[C@H]1CCCCO1)Nc1ccc2nc(Cc3ccccc3)oc2c1 ZINC000162523201 937154476 /nfs/dbraw/zinc/15/44/76/937154476.db2.gz KMSYETYLRSOSDM-IBGZPJMESA-N -1 3 367.405 3.998 20 0 FHADHM O=C([N-]O[C@H]1CCCCO1)Nc1ccc2nc(Cc3ccccc3)oc2c1 ZINC000162523201 937154478 /nfs/dbraw/zinc/15/44/78/937154478.db2.gz KMSYETYLRSOSDM-IBGZPJMESA-N -1 3 367.405 3.998 20 0 FHADHM CC[C@H]([N-]S(=O)(=O)c1cc(Cl)ccc1C(F)(F)F)[C@H]1CCCO1 ZINC000510047540 927404379 /nfs/dbraw/zinc/40/43/79/927404379.db2.gz AGQLRDBVZJBJIU-NWDGAFQWSA-N -1 3 371.808 3.595 20 0 FHADHM O=C(CSc1ccc2ccccc2c1)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000123591429 927699933 /nfs/dbraw/zinc/69/99/33/927699933.db2.gz ROBWEBZPHUNAMY-UHFFFAOYSA-N -1 3 361.430 3.751 20 0 FHADHM O=C(CSc1ccc2ccccc2c1)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000123591429 927699944 /nfs/dbraw/zinc/69/99/44/927699944.db2.gz ROBWEBZPHUNAMY-UHFFFAOYSA-N -1 3 361.430 3.751 20 0 FHADHM O=C(c1cc(=O)[n-]c(C2CC2)n1)N1CCCC[C@@H]1CCc1ccccc1 ZINC000654970567 927709194 /nfs/dbraw/zinc/70/91/94/927709194.db2.gz YGTYXOIGNOHOQL-QGZVFWFLSA-N -1 3 351.450 3.687 20 0 FHADHM Cc1ccc(F)cc1CN[C@H](C(=O)[O-])c1cccc(Br)c1 ZINC000683175627 927770966 /nfs/dbraw/zinc/77/09/66/927770966.db2.gz ZBTMHTZQTGYCEN-HNNXBMFYSA-N -1 3 352.203 3.812 20 0 FHADHM O=C([O-])[C@H](NCc1ccc2ncccc2c1)c1cccc(Br)c1 ZINC000683174885 927777890 /nfs/dbraw/zinc/77/78/90/927777890.db2.gz RHXMKYIQEJEOJO-QGZVFWFLSA-N -1 3 371.234 3.913 20 0 FHADHM CSc1cc(C(=O)Nc2ccc(Cl)cc2[O-])ccc1NC(C)=O ZINC000153604521 928078324 /nfs/dbraw/zinc/07/83/24/928078324.db2.gz VOJDNYOYWXDLDI-UHFFFAOYSA-N -1 3 350.827 3.978 20 0 FHADHM O=C(NCc1ccc([O-])c(F)c1)N1CC2(CCOCC2)[C@H]1c1ccccc1 ZINC000583190759 937221197 /nfs/dbraw/zinc/22/11/97/937221197.db2.gz BMDYYXARTSDNPG-LJQANCHMSA-N -1 3 370.424 3.595 20 0 FHADHM CCOc1ccc(-c2nc(CN3[C@H](C)[C@H](C(=O)[O-])CC[C@@H]3C)co2)cc1 ZINC000579854419 928581839 /nfs/dbraw/zinc/58/18/39/928581839.db2.gz YHGJLSKURPVLRK-PMUMKWKESA-N -1 3 358.438 3.814 20 0 FHADHM CC(C)(C)OC(=O)Nc1ccc(CC(=O)[N-]OCCC(F)(F)F)cc1 ZINC000162713274 937260609 /nfs/dbraw/zinc/26/06/09/937260609.db2.gz DJPXSFOCYRKKSV-UHFFFAOYSA-N -1 3 362.348 3.576 20 0 FHADHM COc1ccc(NC(=O)NCc2ncccc2[O-])cc1Cc1ccccc1 ZINC000471184225 928698814 /nfs/dbraw/zinc/69/88/14/928698814.db2.gz ZPWSQNFYSKQQQZ-UHFFFAOYSA-N -1 3 363.417 3.708 20 0 FHADHM O=C(Cc1cccc(OC(F)F)c1)Nc1cc(Br)ccc1[O-] ZINC000126434873 937270387 /nfs/dbraw/zinc/27/03/87/937270387.db2.gz FVNQWPSQIRQLMH-UHFFFAOYSA-N -1 3 372.165 3.937 20 0 FHADHM O=C(NCc1ncccc1[O-])Nc1ccccc1N1CCc2ccccc21 ZINC000471188443 928766051 /nfs/dbraw/zinc/76/60/51/928766051.db2.gz 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20 0 FHADHM O=C([O-])c1nc(-c2ccccc2)oc1CN1CCC[C@H](OC2CCC2)C1 ZINC000656191216 930566235 /nfs/dbraw/zinc/56/62/35/930566235.db2.gz GBGSZDUCPMIJBG-INIZCTEOSA-N -1 3 356.422 3.573 20 0 FHADHM O=c1cc(C[S@](=O)Cc2c(Cl)cccc2Cl)nc(C2CC2)[n-]1 ZINC000580416563 930655653 /nfs/dbraw/zinc/65/56/53/930655653.db2.gz NUSBXFISBSYFFN-QFIPXVFZSA-N -1 3 357.262 3.815 20 0 FHADHM CCO[C@H]1C[C@@H](N(C)C(=O)c2cc(NC(C)=O)ccc2[O-])C12CCCCC2 ZINC000122784164 930721330 /nfs/dbraw/zinc/72/13/30/930721330.db2.gz WIVNMQSKIWUVDV-MOPGFXCFSA-N -1 3 374.481 3.551 20 0 FHADHM C[C@H](c1ccc2c(c1)CCC2)[S@@](=O)Cc1nc(C(F)(F)F)cc(=O)[n-]1 ZINC000580532075 930814703 /nfs/dbraw/zinc/81/47/03/930814703.db2.gz GXGYIIYVSVXYIX-JUTIIYIPSA-N -1 3 370.396 3.700 20 0 FHADHM C[C@@H](c1ccc(OC(F)F)cc1)N1CC[C@@](C(=O)[O-])(C(F)(F)F)C1 ZINC000325586056 930833507 /nfs/dbraw/zinc/83/35/07/930833507.db2.gz PRIKIKFLQVUUBP-LKFCYVNXSA-N -1 3 353.287 3.688 20 0 FHADHM Cc1cccc(C)c1NC(=O)Cc1nc(=O)c2c3ccccc3sc2[n-]1 ZINC000077251858 930891070 /nfs/dbraw/zinc/89/10/70/930891070.db2.gz SFOYNVSEEAQBTK-UHFFFAOYSA-N -1 3 363.442 3.936 20 0 FHADHM Cc1nn(C(C)(C)C)cc1C(=O)Nc1nnc(-c2cc3ccccc3o2)[n-]1 ZINC000580611187 930925313 /nfs/dbraw/zinc/92/53/13/930925313.db2.gz QMFKGVHBYGEVTL-UHFFFAOYSA-N -1 3 364.409 3.730 20 0 FHADHM Cc1nn(C(C)(C)C)cc1C(=O)Nc1n[n-]c(-c2cc3ccccc3o2)n1 ZINC000580611187 930925315 /nfs/dbraw/zinc/92/53/15/930925315.db2.gz QMFKGVHBYGEVTL-UHFFFAOYSA-N -1 3 364.409 3.730 20 0 FHADHM CCC1([N-]S(=O)(=O)c2c(Cl)cccc2Br)CCC1 ZINC000310650337 930935774 /nfs/dbraw/zinc/93/57/74/930935774.db2.gz GHJZGTHAYCXIGR-UHFFFAOYSA-N -1 3 352.681 3.714 20 0 FHADHM CCc1ccc(S(=O)(=O)[N-]c2ccc(OC[C@H]3CCCO3)cc2)cc1 ZINC000055631566 931165786 /nfs/dbraw/zinc/16/57/86/931165786.db2.gz SEDSWZGCHCNIRH-GOSISDBHSA-N -1 3 361.463 3.608 20 0 FHADHM Cn1nccc1C1=C[C@H]2CC[C@@H](C1)N2[C@@H](C(=O)[O-])c1cccc(Cl)c1 ZINC000580838412 931249693 /nfs/dbraw/zinc/24/96/93/931249693.db2.gz IDTISNNSPCHFQE-SOLBZPMBSA-N -1 3 357.841 3.520 20 0 FHADHM CC[C@@](C)([N-]S(=O)(=O)c1nc(C)sc1-c1ccccc1)C1CC1 ZINC001213150039 931319200 /nfs/dbraw/zinc/31/92/00/931319200.db2.gz HFSKXGCBYSQHRJ-QGZVFWFLSA-N -1 3 350.509 3.976 20 0 FHADHM Cc1cc([N-]S(=O)(=O)c2ccc3c(c2)CCCC(=O)N3)ccc1C1CC1 ZINC000548150254 931428863 /nfs/dbraw/zinc/42/88/63/931428863.db2.gz UOYUMPQVANRVDB-UHFFFAOYSA-N -1 3 370.474 3.948 20 0 FHADHM CCOc1cc(CN2CCC([C@H](O)C(F)(F)F)CC2)cc(Cl)c1[O-] ZINC000581057311 931531376 /nfs/dbraw/zinc/53/13/76/931531376.db2.gz PKGOCXIFHHVZNV-HNNXBMFYSA-N -1 3 367.795 3.580 20 0 FHADHM CC(=O)c1cccc(NC(=O)[C@]2(Cc3cccc(Cl)c3)CCOC2)c1[O-] ZINC000581252963 931742652 /nfs/dbraw/zinc/74/26/52/931742652.db2.gz PMTNMGMMMPFCMN-FQEVSTJZSA-N -1 3 373.836 3.836 20 0 FHADHM O=C(NCc1ncccc1[O-])N[C@@H](CCc1ccccc1)c1ccccc1 ZINC000471652591 932013273 /nfs/dbraw/zinc/01/32/73/932013273.db2.gz GBENICHOQZMNDZ-IBGZPJMESA-N -1 3 361.445 3.961 20 0 FHADHM O=C(NCc1ncccc1[O-])N[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000471660922 932108405 /nfs/dbraw/zinc/10/84/05/932108405.db2.gz YGUNZUPAOIKRRR-LJQANCHMSA-N -1 3 351.381 3.515 20 0 FHADHM CCCOc1ccc(CN[C@H](C(=O)[O-])c2ccc(OC)c(F)c2)c(C)c1 ZINC000656572407 932110110 /nfs/dbraw/zinc/11/01/10/932110110.db2.gz JDYRGPDQPODOSD-IBGZPJMESA-N -1 3 361.413 3.847 20 0 FHADHM CO[C@H](CS(=O)(=O)[N-]c1cccc(-c2nccs2)c1)C1CCCC1 ZINC000656617414 932189139 /nfs/dbraw/zinc/18/91/39/932189139.db2.gz KDQHOASDJHLBNE-MRXNPFEDSA-N -1 3 366.508 3.757 20 0 FHADHM O=C(Cn1ccnc1)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000129477856 932256066 /nfs/dbraw/zinc/25/60/66/932256066.db2.gz VOOCQKZJRZSITE-UHFFFAOYSA-N -1 3 350.403 3.504 20 0 FHADHM COc1ccc([C@@H](NCc2cc(=O)[n-]c(C3CC3)n2)c2ccccc2)cc1 ZINC000656658831 932277643 /nfs/dbraw/zinc/27/76/43/932277643.db2.gz GCXIROFBQLBPDE-NRFANRHFSA-N -1 3 361.445 3.947 20 0 FHADHM O=C([N-]c1n[nH]c(-c2ccccc2Cl)n1)c1ccoc1C(F)(F)F ZINC000581636975 932361294 /nfs/dbraw/zinc/36/12/94/932361294.db2.gz ZNYSFHDEPYIKLC-UHFFFAOYSA-N -1 3 356.691 3.989 20 0 FHADHM Cc1ccc(Br)c([N-]S(=O)(=O)c2ccc(C3CC3)cc2)n1 ZINC000656739522 932370607 /nfs/dbraw/zinc/37/06/07/932370607.db2.gz SHIQSLJGIJIECG-UHFFFAOYSA-N -1 3 367.268 3.831 20 0 FHADHM CCOc1ccc(C(C)=O)cc1CN1CC[C@H](C(=O)[O-])[C@H]2CCCC[C@H]21 ZINC000656762719 932396060 /nfs/dbraw/zinc/39/60/60/932396060.db2.gz CFXIBJBIMCSXRC-CEXWTWQISA-N -1 3 359.466 3.753 20 0 FHADHM CCOc1ccc(C(C)=O)cc1CN1CC[C@H](C(=O)[O-])[C@@H]2CCCC[C@@H]21 ZINC000656762720 932396496 /nfs/dbraw/zinc/39/64/96/932396496.db2.gz CFXIBJBIMCSXRC-FHWLQOOXSA-N -1 3 359.466 3.753 20 0 FHADHM Cc1cccc(-c2noc(CN3CC[C@H](C(=O)[O-])[C@H]4CCCC[C@H]43)n2)c1 ZINC000656764599 932397940 /nfs/dbraw/zinc/39/79/40/932397940.db2.gz KZUUSXUQJDCDBJ-IXDOHACOSA-N -1 3 355.438 3.510 20 0 FHADHM Cc1ccc(-c2noc(CN3CC[C@H](C(=O)[O-])[C@H]4CCCC[C@@H]43)n2)cc1 ZINC000656765216 932401982 /nfs/dbraw/zinc/40/19/82/932401982.db2.gz MMVAFKYJTVBDFY-IKGGRYGDSA-N -1 3 355.438 3.510 20 0 FHADHM O=C([O-])[C@@H]1CCN(Cc2ccc(-c3ccccn3)nc2)[C@H]2CCCC[C@@H]12 ZINC000656768727 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CC(C)c1ccc(C(=O)N2CCC(c3nnc4ccccn43)CC2)c([O-])c1 ZINC000613232594 940489520 /nfs/dbraw/zinc/48/95/20/940489520.db2.gz RLVRZJUIKPOWOW-UHFFFAOYSA-N -1 3 364.449 3.578 20 0 FHADHM O=c1[n-]c(CN2CCC[C@@H](c3ccccn3)C2)nc2c3ccccc3oc21 ZINC000660628321 945326413 /nfs/dbraw/zinc/32/64/13/945326413.db2.gz RVHZOJVJTLEBFH-CQSZACIVSA-N -1 3 360.417 3.856 20 0 FHADHM O=C(c1cc([O-])ccc1Cl)N1CCC[C@H]1c1cccc2c1OCCO2 ZINC000431790637 940505247 /nfs/dbraw/zinc/50/52/47/940505247.db2.gz IAVJWHBQGMAULO-INIZCTEOSA-N -1 3 359.809 3.794 20 0 FHADHM Cc1nc(C[N-]S(=O)(=O)c2cc(Cl)ccc2Cl)sc1C ZINC000173227023 940598062 /nfs/dbraw/zinc/59/80/62/940598062.db2.gz VIIKJEMOJKQLMG-UHFFFAOYSA-N -1 3 351.280 3.545 20 0 FHADHM Cc1c(C(=O)NCc2cc(=O)[n-]c(C3CCC3)n2)sc2nccc(C)c12 ZINC000636319851 940611156 /nfs/dbraw/zinc/61/11/56/940611156.db2.gz ZYTVZSIPBNDYRG-UHFFFAOYSA-N -1 3 368.462 3.606 20 0 FHADHM COC(=O)c1cc(C)ccc1S(=O)(=O)[N-]c1cc(C)c(F)cc1Cl ZINC000507580786 945339697 /nfs/dbraw/zinc/33/96/97/945339697.db2.gz 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CC[C@H](C(=O)Nc1nc(C(F)(F)F)n[n-]1)c1cccc(C(F)(F)F)c1 ZINC000175775939 940926318 /nfs/dbraw/zinc/92/63/18/940926318.db2.gz LZESDFCSWSPBSZ-VIFPVBQESA-N -1 3 366.265 3.975 20 0 FHADHM [O-]c1cc(F)cc(CN2C[C@H](O)C[C@H]2c2cccc(C(F)(F)F)c2)c1 ZINC000186271562 940970072 /nfs/dbraw/zinc/97/00/72/940970072.db2.gz ZGQFGYPWHKQVBB-SJORKVTESA-N -1 3 355.331 3.858 20 0 FHADHM O=C(CCOc1cccc(Cl)c1)OCc1noc(-c2ccccc2[O-])n1 ZINC000782797043 941031427 /nfs/dbraw/zinc/03/14/27/941031427.db2.gz GQIWGTSQQUBZLW-UHFFFAOYSA-N -1 3 374.780 3.608 20 0 FHADHM O=C(CCCc1ccc(Br)s1)[N-]OCCC(F)(F)F ZINC000162728677 941055474 /nfs/dbraw/zinc/05/54/74/941055474.db2.gz FDFCMFLAKWHXDF-UHFFFAOYSA-N -1 3 360.195 3.834 20 0 FHADHM CCOc1cc(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)cc(Cl)c1[O-] ZINC000186970750 941071216 /nfs/dbraw/zinc/07/12/16/941071216.db2.gz UCMMHHAIRPCEPF-SJLPKXTDSA-N -1 3 374.868 3.620 20 0 FHADHM CCN(CC)[C@H](CNC(=O)c1cc(F)c([O-])c(F)c1)c1ccsc1 ZINC000177059338 941096757 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O=C(N[C@@H](CC(F)(F)F)c1ccccc1)c1cc(F)cc2n[n-]nc21 ZINC000503152764 943008716 /nfs/dbraw/zinc/00/87/16/943008716.db2.gz PWVHPNNEULZGQW-ZDUSSCGKSA-N -1 3 352.291 3.521 20 0 FHADHM O=S(=O)([N-][C@@H]1C[C@H]1c1ccco1)c1ccc(Cl)cc1C(F)(F)F ZINC000416641068 943018551 /nfs/dbraw/zinc/01/85/51/943018551.db2.gz BQOIOVOXJFYIRT-MWLCHTKSSA-N -1 3 365.760 3.786 20 0 FHADHM CCc1cc(=O)[n-]c(CN[C@H](c2cccc(OC(F)(F)F)c2)C2CC2)n1 ZINC000511573735 943029204 /nfs/dbraw/zinc/02/92/04/943029204.db2.gz IWWIZZUIECSKFK-KRWDZBQOSA-N -1 3 367.371 3.884 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H](c3cnn(C)c3)C(C)(C)C)nc2)n1 ZINC000425243511 943054152 /nfs/dbraw/zinc/05/41/52/943054152.db2.gz TUQHNKKTZGKXDZ-SFHVURJKSA-N -1 3 366.469 3.739 20 0 FHADHM CC[C@H](NC(=O)c1cc(F)cc2n[n-]nc21)c1ccccc1OC(F)F ZINC000431898176 943058191 /nfs/dbraw/zinc/05/81/91/943058191.db2.gz KQKXHSBOKJYFGT-LBPRGKRZSA-N -1 3 364.327 3.580 20 0 FHADHM O=C([O-])[C@@H]1[C@H]2CCC[C@H]2CN1Cc1cc(Br)ccc1Cl ZINC000300514147 943063272 /nfs/dbraw/zinc/06/32/72/943063272.db2.gz FCLZUEGMRVAIQG-WFBYXXMGSA-N -1 3 358.663 3.788 20 0 FHADHM Cc1ccc(S(=O)(=O)[N-]C2(C(F)(F)F)CCC2)cc1Br ZINC000545466612 943076161 /nfs/dbraw/zinc/07/61/61/943076161.db2.gz ZEJQXTATGYOXJF-UHFFFAOYSA-N -1 3 372.206 3.521 20 0 FHADHM O=C([N-]C[C@@H]1CCCCN1Cc1cccc(Cl)c1)C(F)(F)C(F)F ZINC001125895413 943265712 /nfs/dbraw/zinc/26/57/12/943265712.db2.gz FBEZPSQEYANXRR-ZDUSSCGKSA-N -1 3 366.786 3.711 20 0 FHADHM Cc1c(NCc2cc(=O)[n-]c(C3CC3)n2)cccc1OCC(F)(F)F ZINC000417032030 943308345 /nfs/dbraw/zinc/30/83/45/943308345.db2.gz QSURLHUCSOSXCJ-UHFFFAOYSA-N -1 3 353.344 3.921 20 0 FHADHM COc1cc(C(=O)Nc2ccc(Br)cc2[O-])cc(OC)c1C ZINC000514820590 943311252 /nfs/dbraw/zinc/31/12/52/943311252.db2.gz QIDNEZANXANTFQ-UHFFFAOYSA-N -1 3 366.211 3.733 20 0 FHADHM CCCc1cc(=O)[n-]c(C(=Cc2csc(N(CC)C(C)=O)n2)CC)n1 ZINC000435337456 943339471 /nfs/dbraw/zinc/33/94/71/943339471.db2.gz WIMNFVJSYKYZDG-LCYFTJDESA-N -1 3 360.483 3.915 20 0 FHADHM Cc1ccsc1C[N-]S(=O)(=O)c1c(Cl)cc(F)cc1Cl ZINC000435437996 943416320 /nfs/dbraw/zinc/41/63/20/943416320.db2.gz MPSUHKMCEALGOB-UHFFFAOYSA-N -1 3 354.255 3.981 20 0 FHADHM CCOc1ccc([C@@H]2C[C@H]2[N-]S(=O)(=O)c2ccc(Cl)s2)cc1 ZINC000435441132 943418672 /nfs/dbraw/zinc/41/86/72/943418672.db2.gz ACPAMNAIJXFFDP-QWHCGFSZSA-N -1 3 357.884 3.635 20 0 FHADHM COCC1(NC(=O)Nc2ccc(-c3cc(=O)[n-]c(C)n3)cc2)CCCCC1 ZINC000664486725 943423493 /nfs/dbraw/zinc/42/34/93/943423493.db2.gz FZVLQNWZCPLBFH-UHFFFAOYSA-N -1 3 370.453 3.628 20 0 FHADHM Cc1ccc(S(=O)(=O)[N-][C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)o1 ZINC000435592993 943507957 /nfs/dbraw/zinc/50/79/57/943507957.db2.gz OAYLNWIXFMJKGF-MQMHXKEQSA-N -1 3 359.369 3.831 20 0 FHADHM Cc1cc(S(=O)(=O)[N-][C@@H](C)C[C@@H](O)c2cccs2)sc1Cl ZINC000188126442 943616294 /nfs/dbraw/zinc/61/62/94/943616294.db2.gz WAAROCLMNZRRAO-VHSXEESVSA-N -1 3 365.929 3.562 20 0 FHADHM Cc1cc(F)cc(-c2nc3cc(Br)c(F)cc3c(=O)[n-]2)c1 ZINC000504486443 943642983 /nfs/dbraw/zinc/64/29/83/943642983.db2.gz AFGVNTQADUBMMU-UHFFFAOYSA-N -1 3 351.150 3.939 20 0 FHADHM C[C@H](CCCCC(=O)[O-])NCc1csc(-c2ccc3c(c2)OCO3)n1 ZINC000417534688 943666927 /nfs/dbraw/zinc/66/69/27/943666927.db2.gz AVMMQCYQFBVEIW-GFCCVEGCSA-N -1 3 362.451 3.662 20 0 FHADHM O=C([O-])[C@@H](CNCc1csc(C2CC2)n1)Cc1ccccc1Cl ZINC000417546673 943686350 /nfs/dbraw/zinc/68/63/50/943686350.db2.gz MXLOVXUFVMXURE-CYBMUJFWSA-N -1 3 350.871 3.707 20 0 FHADHM CC(C)(C)OC(=O)c1cccc(CNCc2ccccc2CC(=O)[O-])c1 ZINC000417535073 943689936 /nfs/dbraw/zinc/68/99/36/943689936.db2.gz BEGKLBSJSMXUOZ-UHFFFAOYSA-N -1 3 355.434 3.559 20 0 FHADHM COc1ccc(CN[C@H](C(=O)[O-])c2ccc(Cl)c(F)c2)c(C)c1OC ZINC000417558273 943706518 /nfs/dbraw/zinc/70/65/18/943706518.db2.gz FCFJZQMUYMDTDZ-INIZCTEOSA-N -1 3 367.804 3.720 20 0 FHADHM O=C([O-])[C@H](Cc1ccc2c(c1)OCO2)NCc1cc(Cl)sc1Cl ZINC000417563551 943715646 /nfs/dbraw/zinc/71/56/46/943715646.db2.gz DLUYXHPHBZBSRL-JTQLQIEISA-N -1 3 374.245 3.569 20 0 FHADHM CC(C)c1ccc([C@H](CC(=O)[O-])NCc2cnn(CC(F)F)c2)cc1 ZINC000417578333 943722977 /nfs/dbraw/zinc/72/29/77/943722977.db2.gz YDWXJHTXLDFOHQ-INIZCTEOSA-N -1 3 351.397 3.577 20 0 FHADHM C[C@H](CC(=O)[O-])NCc1csc(-c2cccc(Br)c2)n1 ZINC000417597363 943743267 /nfs/dbraw/zinc/74/32/67/943743267.db2.gz SNDZSSUEBXUHFO-SECBINFHSA-N -1 3 355.257 3.525 20 0 FHADHM O=C([O-])[C@H]1C[C@@H](NCc2cc(Cl)c3c(c2)OCCO3)c2ccccc21 ZINC000417612108 943762357 /nfs/dbraw/zinc/76/23/57/943762357.db2.gz BIKWRUSPQHAREQ-GOEBONIOSA-N -1 3 359.809 3.514 20 0 FHADHM Cc1cc(CNC[C@@H](CC(=O)[O-])C(F)(F)F)c(OC(F)F)cc1C ZINC000417633473 943771558 /nfs/dbraw/zinc/77/15/58/943771558.db2.gz ULANFWXUELSFBB-LLVKDONJSA-N -1 3 355.303 3.648 20 0 FHADHM O=C([O-])[C@H]1C[C@H](NCc2ccccc2OC(F)(F)F)c2ccccc21 ZINC000417624891 943774889 /nfs/dbraw/zinc/77/48/89/943774889.db2.gz LJEDRFYHSDBDKU-GJZGRUSLSA-N -1 3 351.324 3.988 20 0 FHADHM O=C([O-])[C@@H](NCc1ncc(C(F)(F)F)s1)C(C1CCC1)C1CCC1 ZINC000417653803 943801011 /nfs/dbraw/zinc/80/10/11/943801011.db2.gz HRZLAFNRNVULQC-AWEZNQCLSA-N -1 3 362.417 3.921 20 0 FHADHM O=S(=O)(CCOCC1CC1)[N-]c1ccc(-c2ccc(Cl)s2)nc1 ZINC000424214333 943801929 /nfs/dbraw/zinc/80/19/29/943801929.db2.gz WTSPFBVJWUBISU-UHFFFAOYSA-N -1 3 372.899 3.632 20 0 FHADHM Cc1cc(CNCc2cccc(C(=O)OC(C)(C)C)c2)ccc1C(=O)[O-] ZINC000417671034 943813200 /nfs/dbraw/zinc/81/32/00/943813200.db2.gz PVKBCRWMFFKFSZ-UHFFFAOYSA-N -1 3 355.434 3.938 20 0 FHADHM O=C([O-])CC[C@H]1CCCCN1CC(=O)N[C@H](c1ccccc1)C1CCCC1 ZINC000424266577 943813614 /nfs/dbraw/zinc/81/36/14/943813614.db2.gz XCXHXGWSRQLGJB-DENIHFKCSA-N -1 3 372.509 3.753 20 0 FHADHM C[C@@H]1C[C@@H]1[C@H](NC(=O)c1cc(=O)[n-]c(C2CC2)n1)c1ccc(Cl)cc1 ZINC000516935852 943844066 /nfs/dbraw/zinc/84/40/66/943844066.db2.gz LKGGFPMHBZNNFF-OVWKYPIYSA-N -1 3 357.841 3.840 20 0 FHADHM Cc1nc(C)c(CCC(=O)N2c3ccccc3C(C)(C)C[C@H]2C)c(=O)[n-]1 ZINC000504857553 943848827 /nfs/dbraw/zinc/84/88/27/943848827.db2.gz KJYCDLYOZDWLKQ-CYBMUJFWSA-N -1 3 353.466 3.835 20 0 FHADHM CSC1(C[N-]S(=O)(=O)c2csc(-c3ccc(Cl)cc3)n2)CC1 ZINC000435930252 943865203 /nfs/dbraw/zinc/86/52/03/943865203.db2.gz WRZTXHBLWSNHMA-UHFFFAOYSA-N -1 3 374.940 3.637 20 0 FHADHM O=C(NC1CC(F)(c2cccc(Cl)c2)C1)c1cc(=O)c2ccccc2[n-]1 ZINC000435941711 943873353 /nfs/dbraw/zinc/87/33/53/943873353.db2.gz AJLNDMDEFXAWFF-UHFFFAOYSA-N -1 3 370.811 3.939 20 0 FHADHM Cc1ncc(S(=O)(=O)[N-][C@@H](C)c2ccc(F)c3ccccc32)s1 ZINC000516993454 943898372 /nfs/dbraw/zinc/89/83/72/943898372.db2.gz UQQXZYGWDMMLPN-JTQLQIEISA-N -1 3 350.440 3.783 20 0 FHADHM COc1ccc(-c2ocnc2C(=O)N=c2cc(-c3ccccc3)o[n-]2)cc1 ZINC000517057507 943941351 /nfs/dbraw/zinc/94/13/51/943941351.db2.gz PGVVCUFESLNJJP-UHFFFAOYSA-N -1 3 361.357 3.679 20 0 FHADHM NC(=O)[C@H]1CCC2(C1)CCN(Cc1cc(Cl)c([O-])c(Cl)c1)CC2 ZINC001280029920 943967501 /nfs/dbraw/zinc/96/75/01/943967501.db2.gz CYPHBAJMCMZWKS-LBPRGKRZSA-N -1 3 357.281 3.567 20 0 FHADHM CC[C@H](Cc1ccccc1C)C(=O)Nc1ccccc1[N-]S(C)(=O)=O ZINC000424553944 943969999 /nfs/dbraw/zinc/96/99/99/943969999.db2.gz AVKNTZYOANWPJX-OAHLLOKOSA-N -1 3 360.479 3.574 20 0 FHADHM O=C(CCSCc1cc(=O)[n-]c(C2CC2)n1)N1CCCc2ccccc21 ZINC000517101610 944009511 /nfs/dbraw/zinc/00/95/11/944009511.db2.gz BWAWTTXWVRMDHA-UHFFFAOYSA-N -1 3 369.490 3.662 20 0 FHADHM C[C@H]1Cc2cc(S(=O)(=O)[N-]c3cccc(C(C)(F)F)c3)ccc2O1 ZINC000436168962 944072804 /nfs/dbraw/zinc/07/28/04/944072804.db2.gz JVXXWPXCEOKEAO-NSHDSACASA-N -1 3 353.390 3.923 20 0 FHADHM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2ccc(OC3COC3)cc2)cc1 ZINC000436171849 944084993 /nfs/dbraw/zinc/08/49/93/944084993.db2.gz DSGHJMAKLHNEEU-CQSZACIVSA-N -1 3 361.463 3.779 20 0 FHADHM CCCc1nc(-c2noc(C(=O)[N-]c3ccc(Cl)c(F)c3)n2)co1 ZINC000517266584 944169792 /nfs/dbraw/zinc/16/97/92/944169792.db2.gz XYYBMLWQRDMMHM-UHFFFAOYSA-N -1 3 350.737 3.722 20 0 FHADHM Cc1cccc(C)c1OC1CCN(CCOc2ccccc2C(=O)[O-])CC1 ZINC000364257637 944171156 /nfs/dbraw/zinc/17/11/56/944171156.db2.gz SVQQPWXUJBIFNE-UHFFFAOYSA-N -1 3 369.461 3.924 20 0 FHADHM C[C@H]1Cc2cc(S(=O)(=O)[N-]c3ccc(Br)cc3)ccc2O1 ZINC000517298389 944192600 /nfs/dbraw/zinc/19/26/00/944192600.db2.gz JYOXOVHVSPMNHF-JTQLQIEISA-N -1 3 368.252 3.573 20 0 FHADHM O=C(Nc1ccc(Br)cc1[O-])C1=NO[C@H](c2ccccc2)C1 ZINC000053500720 944209054 /nfs/dbraw/zinc/20/90/54/944209054.db2.gz GUZHHNZWEKXGRP-HNNXBMFYSA-N -1 3 361.195 3.611 20 0 FHADHM CC(=O)c1ccc(C(=O)NCCc2cc(Cl)cc(Cl)c2)cc1[O-] ZINC000439050385 944296653 /nfs/dbraw/zinc/29/66/53/944296653.db2.gz AYLSKLFWLOAZLK-UHFFFAOYSA-N -1 3 352.217 3.874 20 0 FHADHM COc1ccc(C(=O)CC(C)(C)CC(=O)NCc2ccc([O-])c(F)c2)cc1 ZINC000546126571 944334020 /nfs/dbraw/zinc/33/40/20/944334020.db2.gz VNFVWYZGPKQTNY-UHFFFAOYSA-N -1 3 373.424 3.845 20 0 FHADHM CCOc1ccccc1[C@@H](CC)NC(=O)c1c[n-]c2ccccc2c1=O ZINC000101677519 944339818 /nfs/dbraw/zinc/33/98/18/944339818.db2.gz NFVUDYYHILGGOF-QGZVFWFLSA-N -1 3 350.418 3.808 20 0 FHADHM Cc1sc2[n-]c([C@@H](C)OC(=O)c3ccc(F)c(F)c3)nc(=O)c2c1C ZINC000007134349 944375405 /nfs/dbraw/zinc/37/54/05/944375405.db2.gz FWHPTMJRFOWOSI-MRVPVSSYSA-N -1 3 364.373 3.798 20 0 FHADHM Cc1ccc(C(=O)N2CCN(c3ccc(C(F)(F)F)cc3)CC2)c([O-])c1 ZINC000436507709 944377603 /nfs/dbraw/zinc/37/76/03/944377603.db2.gz BAOQEWUJUNOJJJ-UHFFFAOYSA-N -1 3 364.367 3.682 20 0 FHADHM CCCCOc1ccc([C@@H](C)NC(=O)c2ccc(O)cc2[O-])cc1OC ZINC000436511981 944383166 /nfs/dbraw/zinc/38/31/66/944383166.db2.gz IYYKEXOKBYWHFF-CYBMUJFWSA-N -1 3 359.422 3.776 20 0 FHADHM CCN(C(=O)C[C@H](NC(=O)c1ccc([O-])cc1)c1ccccc1)C1CCC1 ZINC000436529060 944396693 /nfs/dbraw/zinc/39/66/93/944396693.db2.gz ZGRWSANHAVZESP-FQEVSTJZSA-N -1 3 366.461 3.654 20 0 FHADHM COC(=O)CC1CCN(C(=O)c2cc(Oc3ccccc3)ccc2[O-])CC1 ZINC000436546300 944406737 /nfs/dbraw/zinc/40/67/37/944406737.db2.gz OBHFEAKCVOCGDA-UHFFFAOYSA-N -1 3 369.417 3.600 20 0 FHADHM COc1ccc([O-])c(C(=O)Nc2ccc(-n3nc(C)cc3C)c(F)c2)c1 ZINC000516009471 944413363 /nfs/dbraw/zinc/41/33/63/944413363.db2.gz JFAFSHSYLIJDMR-UHFFFAOYSA-N -1 3 355.369 3.595 20 0 FHADHM CCCN(C(=O)c1cc(CC)ccc1[O-])[C@H](C)C(=O)Nc1ccccc1 ZINC000436537437 944415571 /nfs/dbraw/zinc/41/55/71/944415571.db2.gz RIPYMRPDAFYSRA-OAHLLOKOSA-N -1 3 354.450 3.834 20 0 FHADHM Cc1cccc(C(=O)Nc2ccc(Sc3nncn3C)c(Cl)c2)c1[O-] ZINC000436543091 944421143 /nfs/dbraw/zinc/42/11/43/944421143.db2.gz JUWMALQRLIAKKV-UHFFFAOYSA-N -1 3 374.853 3.886 20 0 FHADHM CCOC(=O)[C@H](Cc1ccccc1)N(C)C(=O)c1ccc(C(C)C)cc1[O-] ZINC000436558880 944426409 /nfs/dbraw/zinc/42/64/09/944426409.db2.gz ZVBNGZNTLKAQMH-IBGZPJMESA-N -1 3 369.461 3.762 20 0 FHADHM CN1CCCN(C(=O)c2ccc3c(c2[O-])OC(C)(C)C3)c2cc(F)ccc21 ZINC000436562467 944428786 /nfs/dbraw/zinc/42/87/86/944428786.db2.gz JPEHLPBBLOJKKF-UHFFFAOYSA-N -1 3 370.424 3.732 20 0 FHADHM COc1cc(-c2nc(Cc3cc4ccccc4o3)no2)cc(OC)c1[O-] ZINC000436577299 944428881 /nfs/dbraw/zinc/42/88/81/944428881.db2.gz OCNVWEMJNCWRQZ-UHFFFAOYSA-N -1 3 352.346 3.796 20 0 FHADHM COC(=O)CCSCc1cccc(NC(=O)c2cccc(C)c2[O-])c1 ZINC000436564194 944430450 /nfs/dbraw/zinc/43/04/50/944430450.db2.gz PULOCIXELBXGHT-UHFFFAOYSA-N -1 3 359.447 3.749 20 0 FHADHM C[C@H](Oc1cc(C(F)(F)F)nc(=S)[n-]1)c1cc(Br)no1 ZINC001225849778 944443724 /nfs/dbraw/zinc/44/37/24/944443724.db2.gz AVGDUUNCZONXIZ-BYPYZUCNSA-N -1 3 370.150 3.675 20 0 FHADHM CC(C)CO[C@@H]1CCN(C(=O)c2cc(Cc3ccccc3)ccc2[O-])C1 ZINC000436582534 944446258 /nfs/dbraw/zinc/44/62/58/944446258.db2.gz IGQZBSAMNGDVDP-LJQANCHMSA-N -1 3 353.462 3.870 20 0 FHADHM Cn1ncc2c1CCC[C@@H]2NC(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436583072 944446875 /nfs/dbraw/zinc/44/68/75/944446875.db2.gz NBHLGYHSMDFPRB-IBGZPJMESA-N -1 3 361.445 3.524 20 0 FHADHM COc1cc(N(C)C(=O)c2cc3c(cc2[O-])CCCC3)cc(OC)c1OC ZINC000436589469 944450812 /nfs/dbraw/zinc/45/08/12/944450812.db2.gz KTLSDLBNNUEYPJ-UHFFFAOYSA-N -1 3 371.433 3.573 20 0 FHADHM Cc1csc(CNC(=O)c2cc(CCc3ccccc3)ccc2[O-])n1 ZINC000436602029 944453952 /nfs/dbraw/zinc/45/39/52/944453952.db2.gz JKAZJTQTLMBOGQ-UHFFFAOYSA-N -1 3 352.459 3.872 20 0 FHADHM C[C@H](NC(=O)c1cc(Cc2ccccc2)ccc1[O-])c1nnc2ccccn21 ZINC000436603016 944454073 /nfs/dbraw/zinc/45/40/73/944454073.db2.gz LCYOFNOYLWIZCK-HNNXBMFYSA-N -1 3 372.428 3.517 20 0 FHADHM C[C@@H](CNC(=O)c1ccc2ccccc2c1[O-])N1CCc2sccc2C1 ZINC000436604776 944455682 /nfs/dbraw/zinc/45/56/82/944455682.db2.gz ONSWTAXIJUEIHX-AWEZNQCLSA-N -1 3 366.486 3.784 20 0 FHADHM C[C@H](CNC(=O)c1ccc2ccccc2c1[O-])N1CCc2sccc2C1 ZINC000436604779 944455811 /nfs/dbraw/zinc/45/58/11/944455811.db2.gz ONSWTAXIJUEIHX-CQSZACIVSA-N -1 3 366.486 3.784 20 0 FHADHM CCc1nnc(CNC(=O)c2cc(Oc3ccccc3)ccc2[O-])s1 ZINC000436619824 944477535 /nfs/dbraw/zinc/47/75/35/944477535.db2.gz SRPFJXJGZKGGHW-UHFFFAOYSA-N -1 3 355.419 3.528 20 0 FHADHM CC(=O)c1ccc(C(=O)Nc2ccc(NC[C@H]3CCCO3)c(F)c2)cc1[O-] ZINC000436650518 944480864 /nfs/dbraw/zinc/48/08/64/944480864.db2.gz WMECHLLVAIQKKR-OAHLLOKOSA-N -1 3 372.396 3.577 20 0 FHADHM Cc1cc(F)cc2c(=O)c(C(=O)Nc3ccc(-c4cncnc4)cc3)c[n-]c12 ZINC000516102156 944485051 /nfs/dbraw/zinc/48/50/51/944485051.db2.gz ULSAWGGTGMCECJ-UHFFFAOYSA-N -1 3 374.375 3.685 20 0 FHADHM CCOc1ccc([C@H]2CCCN2C(=O)c2cc(OC)c([O-])c(OC)c2)cc1 ZINC000436642234 944490980 /nfs/dbraw/zinc/49/09/80/944490980.db2.gz ZZETYAYECVPXMR-QGZVFWFLSA-N -1 3 371.433 3.785 20 0 FHADHM O=C(NCC1(c2cccc(C(F)(F)F)c2)CC1)c1c([O-])cccc1O ZINC000436647833 944496324 /nfs/dbraw/zinc/49/63/24/944496324.db2.gz LUAVFHKFKZWQJN-UHFFFAOYSA-N -1 3 351.324 3.578 20 0 FHADHM O=C(Nc1c([O-])cccc1Cl)[C@@H]1COc2ccc(Br)cc21 ZINC000516119754 944503141 /nfs/dbraw/zinc/50/31/41/944503141.db2.gz SNUZWZKJYBIDOE-SNVBAGLBSA-N -1 3 368.614 3.923 20 0 FHADHM Cn1cc2c(n1)CCC[C@@H]2NC(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436674395 944508075 /nfs/dbraw/zinc/50/80/75/944508075.db2.gz HSTJRMFEXWNZML-IBGZPJMESA-N -1 3 361.445 3.524 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]C2(C(F)F)CCCCC2)c(Cl)c1 ZINC000516110901 944510572 /nfs/dbraw/zinc/51/05/72/944510572.db2.gz BADHODFTYWKTMJ-UHFFFAOYSA-N -1 3 353.818 3.595 20 0 FHADHM COC(=O)c1cccc2[n-]c(NC(=O)c3cc4ccc(Cl)cc4[nH]3)nc21 ZINC000438339374 944520653 /nfs/dbraw/zinc/52/06/53/944520653.db2.gz DKJDUINTIPTMGQ-UHFFFAOYSA-N -1 3 368.780 3.737 20 0 FHADHM O=S(=O)([N-]C[C@H](c1ccco1)N1CCCCC1)c1ccc(Cl)s1 ZINC000047031340 944522277 /nfs/dbraw/zinc/52/22/77/944522277.db2.gz SOFNCPMJIUOCDL-GFCCVEGCSA-N -1 3 374.915 3.500 20 0 FHADHM COC(=O)c1cccc2[n-]c(NC(=O)c3cccc4c(C)c(C)[nH]c43)nc21 ZINC000438343230 944523854 /nfs/dbraw/zinc/52/38/54/944523854.db2.gz RWJYJBFTGNMWOT-UHFFFAOYSA-N -1 3 362.389 3.700 20 0 FHADHM Cc1cc(NC(=O)c2cc(Cc3ccccc3)ccc2[O-])ccc1C(N)=O ZINC000436689465 944528578 /nfs/dbraw/zinc/52/85/78/944528578.db2.gz OCEVOBVFKPBYOI-UHFFFAOYSA-N -1 3 360.413 3.643 20 0 FHADHM COc1cc(-c2nc([C@@H]3CCCc4ccccc43)no2)cc(OC)c1[O-] ZINC000436691624 944530536 /nfs/dbraw/zinc/53/05/36/944530536.db2.gz UCJCRXRFPSHWNF-OAHLLOKOSA-N -1 3 352.390 3.928 20 0 FHADHM O=C(c1ccc([O-])cc1)N1CCN(Cc2c(Cl)cccc2Cl)CC1 ZINC000436693458 944532974 /nfs/dbraw/zinc/53/29/74/944532974.db2.gz APBGBSCPKDGCPJ-UHFFFAOYSA-N -1 3 365.260 3.657 20 0 FHADHM O=C(c1ccc([O-])cc1)N1CCN(Cc2c(Cl)oc3ccccc32)CC1 ZINC000436697540 944537371 /nfs/dbraw/zinc/53/73/71/944537371.db2.gz UVMCOSUSPMOXHU-UHFFFAOYSA-N -1 3 370.836 3.750 20 0 FHADHM Cc1ccc([C@H](NCc2ccc(OCC(F)(F)F)c(F)c2)C(=O)[O-])cc1 ZINC000426670350 944541102 /nfs/dbraw/zinc/54/11/02/944541102.db2.gz FBLUQGFWOWUUHK-INIZCTEOSA-N -1 3 371.330 3.991 20 0 FHADHM COc1cnc2ccccc2c1C(=O)Nc1cc(Br)ccc1[O-] ZINC000436705576 944545277 /nfs/dbraw/zinc/54/52/77/944545277.db2.gz RSQFVOWUMCBUAL-UHFFFAOYSA-N -1 3 373.206 3.964 20 0 FHADHM CCCCOc1ccc(C(=O)N2CCC=C(c3ccncc3)C2)c([O-])c1 ZINC000436707990 944546552 /nfs/dbraw/zinc/54/65/52/944546552.db2.gz TXRRPWQGSYYSNR-UHFFFAOYSA-N -1 3 352.434 3.896 20 0 FHADHM COc1ccc([C@H](NC(=O)c2ccc(O)cc2[O-])c2ccc(F)cc2)cc1 ZINC000436726927 944549092 /nfs/dbraw/zinc/54/90/92/944549092.db2.gz WVTPMHYOBHMGFN-HXUWFJFHSA-N -1 3 367.376 3.765 20 0 FHADHM O=C(NC[C@@H](OCC1CC1)c1ccc(Cl)cc1)c1c([O-])cccc1O ZINC000436710833 944550144 /nfs/dbraw/zinc/55/01/44/944550144.db2.gz ZSCPAUIGCATNQM-QGZVFWFLSA-N -1 3 361.825 3.649 20 0 FHADHM CCSc1cc(C(=O)Nc2ccc(Br)cc2[O-])ccn1 ZINC000516173258 944557617 /nfs/dbraw/zinc/55/76/17/944557617.db2.gz ZGWWTODUMZKAKH-UHFFFAOYSA-N -1 3 353.241 3.914 20 0 FHADHM CCOC(=O)c1cnc(C(=O)[N-]c2ccc(O)cc2SC)c(Cl)c1 ZINC000436735636 944565776 /nfs/dbraw/zinc/56/57/76/944565776.db2.gz HBLCRSZPGMLVPV-UHFFFAOYSA-N -1 3 366.826 3.592 20 0 FHADHM C[C@@H]1C[C@@H](C(C)(C)C)CCN1C(=O)[C@H]1CCCN1C(=O)c1ccccc1[O-] ZINC000436745868 944573620 /nfs/dbraw/zinc/57/36/20/944573620.db2.gz FCLXTZQBAOXIIO-SOLBZPMBSA-N -1 3 372.509 3.670 20 0 FHADHM COc1ccc(C(=O)N[C@H](CC(F)(F)F)c2ccc(F)cc2)c([O-])c1 ZINC000436728096 944574779 /nfs/dbraw/zinc/57/47/79/944574779.db2.gz HRPQBACQIFTHCJ-CQSZACIVSA-N -1 3 357.303 3.963 20 0 FHADHM C[C@@H]1c2cccc(Br)c2CCN1C(=O)c1ccc(O)cc1[O-] ZINC000436729525 944576406 /nfs/dbraw/zinc/57/64/06/944576406.db2.gz RTYKGWDMGDZRFQ-SNVBAGLBSA-N -1 3 362.223 3.620 20 0 FHADHM Cc1ccc(C(=O)NCc2ccnc(Oc3ccccc3F)c2)c([O-])c1 ZINC000436731857 944577299 /nfs/dbraw/zinc/57/72/99/944577299.db2.gz NQNVBYWJAPRLDK-UHFFFAOYSA-N -1 3 352.365 3.957 20 0 FHADHM CCC(CC)c1cc(C[N-]S(=O)(=O)c2cnc3ccccc3c2)on1 ZINC000518680607 944591235 /nfs/dbraw/zinc/59/12/35/944591235.db2.gz HDRRZFSIHHDFGO-UHFFFAOYSA-N -1 3 359.451 3.605 20 0 FHADHM CC(C)c1ccc(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)c([O-])c1 ZINC000436756717 944599088 /nfs/dbraw/zinc/59/90/88/944599088.db2.gz DHVRMCJXKOPIPA-UHFFFAOYSA-N -1 3 366.461 3.550 20 0 FHADHM CC(C)(C)c1ccc(C2(C(=O)Nc3cccc(-c4nnn[n-]4)c3)CC2)cc1 ZINC000073543247 944603554 /nfs/dbraw/zinc/60/35/54/944603554.db2.gz IUYXFKCQXDLOST-UHFFFAOYSA-N -1 3 361.449 3.835 20 0 FHADHM CC(C)(C)c1ccc(C2(C(=O)Nc3cccc(-c4nn[n-]n4)c3)CC2)cc1 ZINC000073543247 944603561 /nfs/dbraw/zinc/60/35/61/944603561.db2.gz IUYXFKCQXDLOST-UHFFFAOYSA-N -1 3 361.449 3.835 20 0 FHADHM CC(C)[C@H](CC1CCCC1)C(=O)N1CCN(C(=O)c2ccc([O-])cc2)CC1 ZINC000436800110 944623720 /nfs/dbraw/zinc/62/37/20/944623720.db2.gz SVHBFUJZQGHNBR-FQEVSTJZSA-N -1 3 372.509 3.529 20 0 FHADHM CC1(C)Cc2ccc(C(=O)Nc3ccc(Cn4cccn4)cc3)c([O-])c2O1 ZINC000436782304 944627140 /nfs/dbraw/zinc/62/71/40/944627140.db2.gz XASJAXDLHJQDJY-UHFFFAOYSA-N -1 3 363.417 3.603 20 0 FHADHM CCCN(C(=O)c1cc(NC(C)=O)ccc1[O-])[C@@H]1CCc2ccccc21 ZINC000436786655 944633670 /nfs/dbraw/zinc/63/36/70/944633670.db2.gz KDDYYZBTQGWLDV-LJQANCHMSA-N -1 3 352.434 3.890 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N(C)[C@H](Cc2ccc(F)cc2)C(C)C)c1 ZINC000436789704 944638779 /nfs/dbraw/zinc/63/87/79/944638779.db2.gz LXFFRRYVZHCQQS-LJQANCHMSA-N -1 3 372.440 3.829 20 0 FHADHM COc1ccc(C(=O)N[C@@H](c2ccco2)c2ccccc2OC)c([O-])c1 ZINC000436791804 944642311 /nfs/dbraw/zinc/64/23/11/944642311.db2.gz LDTKRXBTFWNMGJ-LJQANCHMSA-N -1 3 353.374 3.522 20 0 FHADHM CCOC(=O)CN(C(=O)c1cc(Cc2ccccc2)ccc1[O-])C1CCC1 ZINC000436817464 944653913 /nfs/dbraw/zinc/65/39/13/944653913.db2.gz HQOOSRXNQYCLGA-UHFFFAOYSA-N -1 3 367.445 3.541 20 0 FHADHM C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCN2C(=O)CCCc2ccc([O-])c(F)c2)C1 ZINC000500369605 944656734 /nfs/dbraw/zinc/65/67/34/944656734.db2.gz HFTKYIZLPJOBSI-JZGRTCEGSA-N -1 3 363.473 3.642 20 0 FHADHM CCc1ccc(C(=O)N2CCC[C@@H]2c2ccc(OC)cc2OC)c([O-])c1 ZINC000436802670 944658070 /nfs/dbraw/zinc/65/80/70/944658070.db2.gz JYHUNJLLVCSKEN-GOSISDBHSA-N -1 3 355.434 3.949 20 0 FHADHM Cc1ccc(C(=O)N[C@@H](C)c2noc(-c3ccc(Cl)cc3)n2)c([O-])c1 ZINC000436804872 944658844 /nfs/dbraw/zinc/65/88/44/944658844.db2.gz BNGFXLZFRZNNRQ-NSHDSACASA-N -1 3 357.797 3.895 20 0 FHADHM COc1ccc(C(=O)N(C)Cc2ccc(Br)c(F)c2)c([O-])c1 ZINC000436806641 944662516 /nfs/dbraw/zinc/66/25/16/944662516.db2.gz ILGJLGANTQIZIR-UHFFFAOYSA-N -1 3 368.202 3.575 20 0 FHADHM CC[C@H](C)Oc1cc(C)ccc1CNC(=O)c1cc(OC)c([O-])c(OC)c1 ZINC000436810153 944666051 /nfs/dbraw/zinc/66/60/51/944666051.db2.gz WVTCHIZAWAPQRB-AWEZNQCLSA-N -1 3 373.449 3.825 20 0 FHADHM Cc1oc(-c2ccccc2)c(C(=O)N=c2cc([C@H]3CCCO3)[n-][nH]2)c1C ZINC000473847198 944669093 /nfs/dbraw/zinc/66/90/93/944669093.db2.gz CGSRSVVSANKFSP-MRXNPFEDSA-N -1 3 351.406 3.812 20 0 FHADHM CCc1ccc(C(=O)Nc2ccc([C@@H](C)N3CCOCC3)cc2)c([O-])c1 ZINC000436827512 944673347 /nfs/dbraw/zinc/67/33/47/944673347.db2.gz SSIDLFJZUCIAPY-OAHLLOKOSA-N -1 3 354.450 3.600 20 0 FHADHM CCc1ccc(C(=O)N2CCC[C@@H]2CC(=O)c2ccc(F)cc2)c([O-])c1 ZINC000436831170 944677052 /nfs/dbraw/zinc/67/70/52/944677052.db2.gz DVKRWGCDHIDACM-QGZVFWFLSA-N -1 3 355.409 3.971 20 0 FHADHM CCOC(=O)C[C@@H](C)N(C)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436832088 944678422 /nfs/dbraw/zinc/67/84/22/944678422.db2.gz YOTUBTRIQSODPT-CQSZACIVSA-N -1 3 357.406 3.598 20 0 FHADHM CCc1ccc(C(=O)N[C@H](C)c2nc(-c3cccc(OC)c3)no2)c([O-])c1 ZINC000436835191 944682540 /nfs/dbraw/zinc/68/25/40/944682540.db2.gz UQFCDWZWYFMJNC-GFCCVEGCSA-N -1 3 367.405 3.504 20 0 FHADHM CCc1ccc(C(=O)Nc2cc(C(=O)NCC3CC3)ccc2C)c([O-])c1 ZINC000436838097 944686513 /nfs/dbraw/zinc/68/65/13/944686513.db2.gz JQYDSXHDTHQOSH-UHFFFAOYSA-N -1 3 352.434 3.655 20 0 FHADHM O=C(CCc1ccc(Cl)cc1Cl)N=c1cc([C@@H]2CCCO2)[n-][nH]1 ZINC000473847287 944691318 /nfs/dbraw/zinc/69/13/18/944691318.db2.gz DHBBCJWOGFHOEO-AWEZNQCLSA-N -1 3 354.237 3.561 20 0 FHADHM COc1cc(CN[C@@H](CC(=O)[O-])c2ccsc2)cc(Cl)c1OC ZINC000426697469 944697626 /nfs/dbraw/zinc/69/76/26/944697626.db2.gz XGLACCYHASGMRN-ZDUSSCGKSA-N -1 3 355.843 3.724 20 0 FHADHM O=C([O-])COc1ccc(CCNCc2csc(-c3ccccc3)n2)cc1 ZINC000426690846 944710203 /nfs/dbraw/zinc/71/02/03/944710203.db2.gz CWGOLTBGYQTXMK-UHFFFAOYSA-N -1 3 368.458 3.606 20 0 FHADHM COC(=O)c1ccc(-c2nc(-c3cccc(-c4cscn4)c3)no2)[n-]1 ZINC000426410137 944721285 /nfs/dbraw/zinc/72/12/85/944721285.db2.gz IFLKDRIRHLYQRE-UHFFFAOYSA-N -1 3 352.375 3.642 20 0 FHADHM COC(=O)c1ccc(-c2nc(Cc3ccc(Cl)c(Cl)c3)no2)[n-]1 ZINC000426415916 944730576 /nfs/dbraw/zinc/73/05/76/944730576.db2.gz FTZZBLQCVNRHPC-UHFFFAOYSA-N -1 3 352.177 3.749 20 0 FHADHM Cc1cc(CNCc2ccccc2CC(=O)[O-])sc1Br ZINC000426712996 944735713 /nfs/dbraw/zinc/73/57/13/944735713.db2.gz ABXLUTFMJYOGET-UHFFFAOYSA-N -1 3 354.269 3.736 20 0 FHADHM CC[C@@](C)(NC(=O)c1ccccc1)c1noc(-c2ccc(C)cc2[O-])n1 ZINC000436893724 944746555 /nfs/dbraw/zinc/74/65/55/944746555.db2.gz OHHHMGOVUVCNRA-HXUWFJFHSA-N -1 3 351.406 3.806 20 0 FHADHM O=C([O-])CC[C@@H](Cc1ccccc1)NCc1coc(-c2ccccc2)n1 ZINC000426738041 944748849 /nfs/dbraw/zinc/74/88/49/944748849.db2.gz SHLODQWSHOPRKG-SFHVURJKSA-N -1 3 350.418 3.907 20 0 FHADHM COc1ccc([O-])c(-c2nc([C@@H](NC(=O)c3ccccc3)C(C)C)no2)c1 ZINC000436878805 944750765 /nfs/dbraw/zinc/75/07/65/944750765.db2.gz DMNHLCDRBYDHHQ-KRWDZBQOSA-N -1 3 367.405 3.578 20 0 FHADHM C[C@@H](CC(=O)N=c1cc([C@@H]2CCCO2)[n-][nH]1)c1ccccc1C(F)(F)F ZINC000473849974 944750927 /nfs/dbraw/zinc/75/09/27/944750927.db2.gz MFHDXMUVTIMCSL-NHYWBVRUSA-N -1 3 367.371 3.834 20 0 FHADHM COc1ccc(C(=O)NCc2nc(-c3ccccc3F)cs2)c([O-])c1 ZINC000436879338 944750947 /nfs/dbraw/zinc/75/09/47/944750947.db2.gz MESNZRIFQCLRKF-UHFFFAOYSA-N -1 3 358.394 3.593 20 0 FHADHM COc1cc(CN[C@@H](C(=O)[O-])c2cccc(C)c2C)ccc1OC(F)F ZINC000426739334 944752691 /nfs/dbraw/zinc/75/26/91/944752691.db2.gz BMUWJMUJVDAQJI-QGZVFWFLSA-N -1 3 365.376 3.829 20 0 FHADHM COc1ccc(C(=O)N[C@H]2CCCc3cc(OC(F)F)ccc32)c([O-])c1 ZINC000436884170 944757739 /nfs/dbraw/zinc/75/77/39/944757739.db2.gz KIXLFGNONIJSCN-INIZCTEOSA-N -1 3 363.360 3.810 20 0 FHADHM Cc1ccc(OCc2nc(CN[C@H]3CCC[C@@]3(C)C(=O)[O-])cs2)cc1 ZINC000426744440 944758672 /nfs/dbraw/zinc/75/86/72/944758672.db2.gz QXMGGYHTCDUEQS-QFBILLFUSA-N -1 3 360.479 3.764 20 0 FHADHM CC(C)c1ccc(-c2nc(CS(=O)(=O)c3ccccc3)no2)c([O-])c1 ZINC000436886299 944760636 /nfs/dbraw/zinc/76/06/36/944760636.db2.gz MGXFNOKCVYZWJT-UHFFFAOYSA-N -1 3 358.419 3.540 20 0 FHADHM Cc1cc(C)cc([C@H](NCc2cnc3c(cnn3C(C)C)c2)C(=O)[O-])c1 ZINC000426749215 944767383 /nfs/dbraw/zinc/76/73/83/944767383.db2.gz DLGNSIHALDMCMJ-SFHVURJKSA-N -1 3 352.438 3.545 20 0 FHADHM C[C@H]1C[C@@H](CC(=O)N(C)c2ccc(-c3nnn[n-]3)cc2F)CC(C)(C)C1 ZINC000736231289 944770467 /nfs/dbraw/zinc/77/04/67/944770467.db2.gz WVCOMQOXCKYDFV-STQMWFEESA-N -1 3 359.449 3.821 20 0 FHADHM C[C@H]1C[C@@H](CC(=O)N(C)c2ccc(-c3nn[n-]n3)cc2F)CC(C)(C)C1 ZINC000736231289 944770475 /nfs/dbraw/zinc/77/04/75/944770475.db2.gz WVCOMQOXCKYDFV-STQMWFEESA-N -1 3 359.449 3.821 20 0 FHADHM CC1(C)[C@H](NC(=O)c2cc(Cc3ccccc3)ccc2[O-])[C@H]2CCO[C@H]21 ZINC000436903873 944771158 /nfs/dbraw/zinc/77/11/58/944771158.db2.gz XKQJMPURFPXLPK-NSISKUIASA-N -1 3 351.446 3.526 20 0 FHADHM CN(C[C@@H]1CCCC[C@H]1O)C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436904167 944771239 /nfs/dbraw/zinc/77/12/39/944771239.db2.gz KLJISEYRQWVFSA-PZJWPPBQSA-N -1 3 367.489 3.801 20 0 FHADHM COc1ccc(C(=O)NCCCO[C@@H]2CCCc3ccccc32)c([O-])c1 ZINC000436903951 944772572 /nfs/dbraw/zinc/77/25/72/944772572.db2.gz JTYWXAGHPNCDNA-HXUWFJFHSA-N -1 3 355.434 3.615 20 0 FHADHM CCc1cnc(CNC(=O)c2cc(CCc3ccccc3)ccc2[O-])o1 ZINC000436911320 944778977 /nfs/dbraw/zinc/77/89/77/944778977.db2.gz ACOONEWONSBMPF-UHFFFAOYSA-N -1 3 350.418 3.658 20 0 FHADHM COc1cc(CN[C@@H](C(=O)[O-])c2cc(C)cc(C)c2)ccc1OC(F)F ZINC000426758020 944779195 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FHADHM C[C@@H](C[N-]S(=O)(=O)c1ccc(Cl)cc1F)COCc1ccccc1 ZINC000520028872 946047164 /nfs/dbraw/zinc/04/71/64/946047164.db2.gz LGMMYWMAPWLQBL-ZDUSSCGKSA-N -1 3 371.861 3.610 20 0 FHADHM Cc1ccccc1-c1csc(NC(=O)c2cc(-c3nnn[n-]3)cs2)n1 ZINC000822345824 946059825 /nfs/dbraw/zinc/05/98/25/946059825.db2.gz STRCDKFGVGLXHX-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM Cc1ccccc1-c1csc(NC(=O)c2cc(-c3nn[n-]n3)cs2)n1 ZINC000822345824 946059839 /nfs/dbraw/zinc/05/98/39/946059839.db2.gz STRCDKFGVGLXHX-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM Cc1sc(NC(=O)C2(Cc3ccccc3)CCC2)c(-c2nnn[n-]2)c1C ZINC000822559178 946129626 /nfs/dbraw/zinc/12/96/26/946129626.db2.gz XHDVSPFPYCOWSN-UHFFFAOYSA-N -1 3 367.478 3.897 20 0 FHADHM Cc1sc(NC(=O)C2(Cc3ccccc3)CCC2)c(-c2nn[n-]n2)c1C ZINC000822559178 946129631 /nfs/dbraw/zinc/12/96/31/946129631.db2.gz XHDVSPFPYCOWSN-UHFFFAOYSA-N -1 3 367.478 3.897 20 0 FHADHM C[C@@H](N(C)C(=O)c1c[n-]c2c(OC(F)(F)F)cccc2c1=O)C1(C)CC1 ZINC000544377272 946186637 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Cc1nc(-c2ccccc2)ncc1C(=O)N=c1cc(-c2ccccc2)[n-][nH]1 ZINC000487488830 946530237 /nfs/dbraw/zinc/53/02/37/946530237.db2.gz JQYRRRSSDXQICE-UHFFFAOYSA-N -1 3 355.401 3.516 20 0 FHADHM COc1ccc(-c2ncc(C(=O)Nc3cc(F)ccc3[O-])s2)cc1OC ZINC000444324900 946531998 /nfs/dbraw/zinc/53/19/98/946531998.db2.gz FHTOMCULDAFGPH-UHFFFAOYSA-N -1 3 374.393 3.924 20 0 FHADHM CC(=O)Oc1ccc(CSc2cccc(Cl)c2-c2nnn[n-]2)cc1 ZINC000824009556 946540744 /nfs/dbraw/zinc/54/07/44/946540744.db2.gz AFKGKSWVMHCDBV-UHFFFAOYSA-N -1 3 360.826 3.738 20 0 FHADHM CC(=O)Oc1ccc(CSc2cccc(Cl)c2-c2nn[n-]n2)cc1 ZINC000824009556 946540754 /nfs/dbraw/zinc/54/07/54/946540754.db2.gz AFKGKSWVMHCDBV-UHFFFAOYSA-N -1 3 360.826 3.738 20 0 FHADHM CC(C)(C)Oc1c(F)cc(NCc2cc(-c3nnn[n-]3)cs2)cc1F ZINC000824119690 946596208 /nfs/dbraw/zinc/59/62/08/946596208.db2.gz OGLBUTPMMLZOGB-UHFFFAOYSA-N -1 3 365.409 3.996 20 0 FHADHM CC(C)(C)Oc1c(F)cc(NCc2cc(-c3nn[n-]n3)cs2)cc1F ZINC000824119690 946596220 /nfs/dbraw/zinc/59/62/20/946596220.db2.gz 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FHADHM Brc1cc(N2CC=CC23CCCCC3)ccc1-c1nnn[n-]1 ZINC001573280078 946655403 /nfs/dbraw/zinc/65/54/03/946655403.db2.gz ORBUUHULQZSQNL-UHFFFAOYSA-N -1 3 360.259 3.708 20 0 FHADHM Brc1cc(N2CC=CC23CCCCC3)ccc1-c1nn[n-]n1 ZINC001573280078 946655406 /nfs/dbraw/zinc/65/54/06/946655406.db2.gz ORBUUHULQZSQNL-UHFFFAOYSA-N -1 3 360.259 3.708 20 0 FHADHM Cc1cc(S(=O)(=O)[N-]Cc2cc(-c3ccccc3)on2)sc1Cl ZINC000473912569 946663229 /nfs/dbraw/zinc/66/32/29/946663229.db2.gz KSOJWSONTCINFM-UHFFFAOYSA-N -1 3 368.867 3.843 20 0 FHADHM Cc1ccc(S(=O)(=O)[N-]c2cccc(CN3CCCCC3=O)c2)cc1C ZINC000050534374 946678054 /nfs/dbraw/zinc/67/80/54/946678054.db2.gz RLPMYXLSSGJPKI-UHFFFAOYSA-N -1 3 372.490 3.617 20 0 FHADHM Cc1cc(Cl)ccc1S(=O)(=O)[N-]c1ccc(NC(=O)C2CC2)cc1 ZINC000614775857 946684911 /nfs/dbraw/zinc/68/49/11/946684911.db2.gz HJRPHWTUEVRSFZ-UHFFFAOYSA-N -1 3 364.854 3.798 20 0 FHADHM COc1cc(Cl)c(S(=O)(=O)[N-]c2ccsc2Cl)cc1OC ZINC000192802048 946696709 /nfs/dbraw/zinc/69/67/09/946696709.db2.gz RFFKWIBFQZINCR-UHFFFAOYSA-N -1 3 368.263 3.873 20 0 FHADHM C[C@H](NC(=O)CCC1CC1)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824478795 946728486 /nfs/dbraw/zinc/72/84/86/946728486.db2.gz IPKSWIVBLHFWRV-AWEZNQCLSA-N -1 3 361.449 3.901 20 0 FHADHM C[C@H](NC(=O)CCC1CC1)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824478795 946728496 /nfs/dbraw/zinc/72/84/96/946728496.db2.gz IPKSWIVBLHFWRV-AWEZNQCLSA-N -1 3 361.449 3.901 20 0 FHADHM COc1ccc(CN2CCCC[C@@H]2CCC(=O)[O-])c(Br)c1 ZINC000313952490 946729110 /nfs/dbraw/zinc/72/91/10/946729110.db2.gz ZZZSKQURSKIUAF-CYBMUJFWSA-N -1 3 356.260 3.677 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)CO[C@H]3CCCC[C@H]3C)c2)n1 ZINC000112793022 946787729 /nfs/dbraw/zinc/78/77/29/946787729.db2.gz OCTKERNCSVPCHY-KDOFPFPSSA-N -1 3 369.465 3.533 20 0 FHADHM COC(=O)c1cccc(C(=O)[N-]c2cc(F)ccc2SCC(F)F)n1 ZINC000609993298 946813385 /nfs/dbraw/zinc/81/33/85/946813385.db2.gz QGUAMHBQEGKMQP-UHFFFAOYSA-N -1 3 370.352 3.617 20 0 FHADHM C[C@H](Nc1ccc(N2CCCC2)cc1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824657964 946887078 /nfs/dbraw/zinc/88/70/78/946887078.db2.gz TVRXVDCFCRUTCH-ZDUSSCGKSA-N -1 3 352.417 3.779 20 0 FHADHM C[C@H](Nc1ccc(N2CCCC2)cc1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824657964 946887088 /nfs/dbraw/zinc/88/70/88/946887088.db2.gz TVRXVDCFCRUTCH-ZDUSSCGKSA-N -1 3 352.417 3.779 20 0 FHADHM CC(=O)c1cc(-c2nnn[n-]2)ccc1NC(=O)c1ccc(C2=CCCC2)cc1 ZINC001573554667 946902587 /nfs/dbraw/zinc/90/25/87/946902587.db2.gz ZLPAEKPUEJFXAK-UHFFFAOYSA-N -1 3 373.416 3.889 20 0 FHADHM CC(=O)c1cc(-c2nn[n-]n2)ccc1NC(=O)c1ccc(C2=CCCC2)cc1 ZINC001573554667 946902590 /nfs/dbraw/zinc/90/25/90/946902590.db2.gz ZLPAEKPUEJFXAK-UHFFFAOYSA-N -1 3 373.416 3.889 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)c1cccc(OC2CCCCC2)c1 ZINC000523134686 946903814 /nfs/dbraw/zinc/90/38/14/946903814.db2.gz WXLCPRKVSVRBSA-UHFFFAOYSA-N -1 3 363.421 3.831 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)c1cccc(OC2CCCCC2)c1 ZINC000523134686 946903806 /nfs/dbraw/zinc/90/38/06/946903806.db2.gz WXLCPRKVSVRBSA-UHFFFAOYSA-N -1 3 363.421 3.831 20 0 FHADHM C[C@@H](OC(=O)CCc1ccc2[nH]ccc2c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824713418 946907518 /nfs/dbraw/zinc/90/75/18/946907518.db2.gz IDXDHCPSUWKMJV-CYBMUJFWSA-N -1 3 361.405 3.585 20 0 FHADHM C[C@@H](OC(=O)CCc1ccc2[nH]ccc2c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824713418 946907527 /nfs/dbraw/zinc/90/75/27/946907527.db2.gz IDXDHCPSUWKMJV-CYBMUJFWSA-N -1 3 361.405 3.585 20 0 FHADHM C[C@H](Sc1cccc(Cl)c1-c1nnn[n-]1)C(=O)Nc1ccccc1 ZINC000824756833 946926654 /nfs/dbraw/zinc/92/66/54/946926654.db2.gz QBKODENOSJGSCJ-JTQLQIEISA-N -1 3 359.842 3.639 20 0 FHADHM C[C@H](Sc1cccc(Cl)c1-c1nn[n-]n1)C(=O)Nc1ccccc1 ZINC000824756833 946926665 /nfs/dbraw/zinc/92/66/65/946926665.db2.gz QBKODENOSJGSCJ-JTQLQIEISA-N -1 3 359.842 3.639 20 0 FHADHM C[C@H]1CC[C@@H](C(=O)NCc2cccc(-c3ccc(-c4nnn[n-]4)s3)c2)C1 ZINC000824898298 946978172 /nfs/dbraw/zinc/97/81/72/946978172.db2.gz DXIWIKJRUQPTFC-SWLSCSKDSA-N -1 3 367.478 3.648 20 0 FHADHM C[C@H]1CC[C@H](C(=O)N(Cc2ccccc2)c2ccccc2-c2nnn[n-]2)C1 ZINC000824899417 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CCc1cc(Oc2ccc([N-]S(=O)(=O)c3ccc(C)cc3)cc2)ncn1 ZINC000603370657 568092059 /nfs/dbraw/zinc/09/20/59/568092059.db2.gz WMNCIXRSDYBTJP-UHFFFAOYSA-N -1 3 369.446 3.941 20 0 FHADHM O=S(=O)([N-]C[C@H]1OCCc2ccccc21)c1c(Cl)cccc1Cl ZINC000603506951 568109862 /nfs/dbraw/zinc/10/98/62/568109862.db2.gz ZHFBWHRNBOMIDK-OAHLLOKOSA-N -1 3 372.273 3.586 20 0 FHADHM Cc1[n-][nH]c(=NC(=O)[C@H]2C[C@@H]2c2ccc(F)cc2F)c1-c1ccccc1 ZINC000603547284 568118012 /nfs/dbraw/zinc/11/80/12/568118012.db2.gz LFWHGTROCADZKU-CVEARBPZSA-N -1 3 353.372 3.827 20 0 FHADHM Cc1[n-][nH]c(=NC(=O)[C@@H]2C[C@@H]2c2ccc(F)cc2F)c1-c1ccccc1 ZINC000603547286 568118055 /nfs/dbraw/zinc/11/80/55/568118055.db2.gz LFWHGTROCADZKU-HZPDHXFCSA-N -1 3 353.372 3.827 20 0 FHADHM C[C@@H](CC1CCCCC1)C(=O)NC1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000603901360 568180126 /nfs/dbraw/zinc/18/01/26/568180126.db2.gz TVHLXGFSNMBXPD-INIZCTEOSA-N -1 3 372.509 3.720 20 0 FHADHM O=C(Nc1ccc(Nc2ccccc2)nc1)c1c[n-]nc1-c1ccncc1 ZINC000604082423 568209262 /nfs/dbraw/zinc/20/92/62/568209262.db2.gz FKBXKRCBBNBOPE-UHFFFAOYSA-N -1 3 356.389 3.863 20 0 FHADHM O=C(Nc1ccc(Nc2ccccc2)nc1)c1cn[n-]c1-c1ccncc1 ZINC000604082423 568209263 /nfs/dbraw/zinc/20/92/63/568209263.db2.gz FKBXKRCBBNBOPE-UHFFFAOYSA-N -1 3 356.389 3.863 20 0 FHADHM Cc1cccnc1[C@H]([N-]S(=O)(=O)c1ccc(Cl)cc1F)C(C)C ZINC000604407147 568268370 /nfs/dbraw/zinc/26/83/70/568268370.db2.gz YLPOVBTWLGNQTA-OAHLLOKOSA-N -1 3 356.850 3.858 20 0 FHADHM COc1ccc([O-])c(C(=O)Nc2nccn2Cc2ccccc2Cl)c1 ZINC000604604963 568323255 /nfs/dbraw/zinc/32/32/55/568323255.db2.gz JFHSRNXAHYOHAG-UHFFFAOYSA-N -1 3 357.797 3.551 20 0 FHADHM COc1ccc([N-]S(=O)(=O)c2cc(C)c(Br)cc2C)cc1 ZINC000604858343 568378839 /nfs/dbraw/zinc/37/88/39/568378839.db2.gz ASZWPPBTWDLBGF-UHFFFAOYSA-N -1 3 370.268 3.875 20 0 FHADHM CC(C)[C@H](Sc1n[n-]c(-c2ccccn2)n1)C(=O)N(C)C1CCCCC1 ZINC000604932697 568395178 /nfs/dbraw/zinc/39/51/78/568395178.db2.gz CBKSNNKUWNTMHB-INIZCTEOSA-N -1 3 373.526 3.775 20 0 FHADHM C[C@H](Sc1cc(F)ccc1F)C(=O)c1ccc([N-]S(C)(=O)=O)cc1 ZINC000007069101 568431766 /nfs/dbraw/zinc/43/17/66/568431766.db2.gz AAVZUDDZCLPWDJ-JTQLQIEISA-N -1 3 371.430 3.700 20 0 FHADHM Brc1cccc(-c2nnc(-c3noc([C@@H]4CC45CC5)n3)[n-]2)c1 ZINC000643279756 568485732 /nfs/dbraw/zinc/48/57/32/568485732.db2.gz XFNURMLGSLCMNY-JTQLQIEISA-N -1 3 358.199 3.552 20 0 FHADHM Brc1cccc(-c2n[n-]c(-c3noc([C@@H]4CC45CC5)n3)n2)c1 ZINC000643279756 568485733 /nfs/dbraw/zinc/48/57/33/568485733.db2.gz XFNURMLGSLCMNY-JTQLQIEISA-N -1 3 358.199 3.552 20 0 FHADHM Brc1cccc(-c2nc(-c3noc([C@@H]4CC45CC5)n3)n[n-]2)c1 ZINC000643279756 568485734 /nfs/dbraw/zinc/48/57/34/568485734.db2.gz XFNURMLGSLCMNY-JTQLQIEISA-N -1 3 358.199 3.552 20 0 FHADHM CS(=O)(=O)[N-]c1ccc(C(=O)Nc2cccc(NC3CCCC3)c2)cc1 ZINC000605180897 568605588 /nfs/dbraw/zinc/60/55/88/568605588.db2.gz DDBGFKKZLJXQMJ-UHFFFAOYSA-N -1 3 373.478 3.665 20 0 FHADHM O=C(Nc1cccc(C2CCC2)c1)[C@@H]1CCCN1C(=O)c1ccccc1[O-] ZINC000643293448 568628152 /nfs/dbraw/zinc/62/81/52/568628152.db2.gz YJMGDRQGWNHYBW-IBGZPJMESA-N -1 3 364.445 3.903 20 0 FHADHM Cc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@@H]3C[C@@H]3c3cccc(O)c3)c2)n1 ZINC000365422439 568650898 /nfs/dbraw/zinc/65/08/98/568650898.db2.gz SOSRKCOOEOWMHZ-QZTJIDSGSA-N -1 3 361.401 3.605 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)c1cccc(OC2CCCCC2)c1 ZINC000606187624 568709096 /nfs/dbraw/zinc/70/90/96/568709096.db2.gz ONLQVFPERFNCAK-UHFFFAOYSA-N -1 3 363.421 3.831 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)c1cccc(OC2CCCCC2)c1 ZINC000606187624 568709099 /nfs/dbraw/zinc/70/90/99/568709099.db2.gz ONLQVFPERFNCAK-UHFFFAOYSA-N -1 3 363.421 3.831 20 0 FHADHM O=C(N[C@H]1CCc2c1ccc(Cl)c2Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000738037533 598823960 /nfs/dbraw/zinc/82/39/60/598823960.db2.gz WUHMTEKFRVHPBZ-AWEZNQCLSA-N -1 3 374.231 3.591 20 0 FHADHM O=C(N[C@H]1CCc2c1ccc(Cl)c2Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000738037533 598823961 /nfs/dbraw/zinc/82/39/61/598823961.db2.gz WUHMTEKFRVHPBZ-AWEZNQCLSA-N -1 3 374.231 3.591 20 0 FHADHM CC(C)c1cnc(SCCOc2ccccc2-c2nnn[n-]2)n1C(C)C ZINC000735931964 598824042 /nfs/dbraw/zinc/82/40/42/598824042.db2.gz HMAMRUQVQBIOTN-UHFFFAOYSA-N -1 3 372.498 3.939 20 0 FHADHM CC(C)c1cnc(SCCOc2ccccc2-c2nn[n-]n2)n1C(C)C ZINC000735931964 598824043 /nfs/dbraw/zinc/82/40/43/598824043.db2.gz HMAMRUQVQBIOTN-UHFFFAOYSA-N -1 3 372.498 3.939 20 0 FHADHM C[C@H]1C[C@H](NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)C[C@@H](C)C1 ZINC000736223227 598827458 /nfs/dbraw/zinc/82/74/58/598827458.db2.gz ILXXTOYAYDFKGS-IAZYJMLFSA-N -1 3 364.906 3.631 20 0 FHADHM C[C@H]1C[C@H](NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)C[C@@H](C)C1 ZINC000736223227 598827460 /nfs/dbraw/zinc/82/74/60/598827460.db2.gz ILXXTOYAYDFKGS-IAZYJMLFSA-N -1 3 364.906 3.631 20 0 FHADHM CC(C)[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736103507 598829289 /nfs/dbraw/zinc/82/92/89/598829289.db2.gz YTUCMQBODNGGOA-DNVCBOLYSA-N -1 3 363.465 3.559 20 0 FHADHM CC(C)[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736103507 598829291 /nfs/dbraw/zinc/82/92/91/598829291.db2.gz YTUCMQBODNGGOA-DNVCBOLYSA-N -1 3 363.465 3.559 20 0 FHADHM CCN(C(=O)[C@H](C)c1cccc(C)c1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736502445 598830224 /nfs/dbraw/zinc/83/02/24/598830224.db2.gz MWRNASORVJTDMQ-HZPDHXFCSA-N -1 3 363.465 3.888 20 0 FHADHM CCN(C(=O)[C@H](C)c1cccc(C)c1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736502445 598830227 /nfs/dbraw/zinc/83/02/27/598830227.db2.gz MWRNASORVJTDMQ-HZPDHXFCSA-N -1 3 363.465 3.888 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H](SC)c2ccccc2)c1-c1nnn[n-]1 ZINC000736669748 598832371 /nfs/dbraw/zinc/83/23/71/598832371.db2.gz JGQIUBNTOSULDQ-AWEZNQCLSA-N -1 3 373.507 3.842 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H](SC)c2ccccc2)c1-c1nn[n-]n1 ZINC000736669748 598832373 /nfs/dbraw/zinc/83/23/73/598832373.db2.gz JGQIUBNTOSULDQ-AWEZNQCLSA-N -1 3 373.507 3.842 20 0 FHADHM C[C@@H](CC(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1)C1CC1 ZINC000735975674 598833366 /nfs/dbraw/zinc/83/33/66/598833366.db2.gz NSLGDYBCOAAOQQ-LBPRGKRZSA-N -1 3 367.478 3.648 20 0 FHADHM CCCCCCNC(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000821055740 599294885 /nfs/dbraw/zinc/29/48/85/599294885.db2.gz FNAXCTCCDCSTSH-UHFFFAOYSA-N -1 3 356.352 3.587 20 0 FHADHM CCCCCCNC(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000821055740 599294887 /nfs/dbraw/zinc/29/48/87/599294887.db2.gz FNAXCTCCDCSTSH-UHFFFAOYSA-N -1 3 356.352 3.587 20 0 FHADHM CC(C)[C@H](C)CNC(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735700206 598848000 /nfs/dbraw/zinc/84/80/00/598848000.db2.gz FVSNUZCVXOUDFD-CQSZACIVSA-N -1 3 364.453 3.632 20 0 FHADHM C[C@H](Oc1ccccc1-c1nnn[n-]1)c1nc(-c2ccccc2Cl)no1 ZINC000736188122 598859117 /nfs/dbraw/zinc/85/91/17/598859117.db2.gz LUXIYKGFBXWZKP-JTQLQIEISA-N -1 3 368.784 3.710 20 0 FHADHM C[C@H](Oc1ccccc1-c1nn[n-]n1)c1nc(-c2ccccc2Cl)no1 ZINC000736188122 598859118 /nfs/dbraw/zinc/85/91/18/598859118.db2.gz LUXIYKGFBXWZKP-JTQLQIEISA-N -1 3 368.784 3.710 20 0 FHADHM C[C@@H](Oc1ccccc1-c1nnn[n-]1)c1nc(-c2ccccc2Cl)no1 ZINC000736188123 598859314 /nfs/dbraw/zinc/85/93/14/598859314.db2.gz LUXIYKGFBXWZKP-SNVBAGLBSA-N -1 3 368.784 3.710 20 0 FHADHM C[C@@H](Oc1ccccc1-c1nn[n-]n1)c1nc(-c2ccccc2Cl)no1 ZINC000736188123 598859315 /nfs/dbraw/zinc/85/93/15/598859315.db2.gz LUXIYKGFBXWZKP-SNVBAGLBSA-N -1 3 368.784 3.710 20 0 FHADHM Clc1cc(N[C@@H](c2ccccc2)[C@H]2CCCO2)ccc1-c1nnn[n-]1 ZINC000737562911 598870572 /nfs/dbraw/zinc/87/05/72/598870572.db2.gz AFOAORFLGYPSHJ-SJORKVTESA-N -1 3 355.829 3.852 20 0 FHADHM Clc1cc(N[C@@H](c2ccccc2)[C@H]2CCCO2)ccc1-c1nn[n-]n1 ZINC000737562911 598870573 /nfs/dbraw/zinc/87/05/73/598870573.db2.gz AFOAORFLGYPSHJ-SJORKVTESA-N -1 3 355.829 3.852 20 0 FHADHM CC[C@H](CC1CCCCC1)C(=O)Oc1ccc(-c2nnn[n-]2)cc1OC ZINC000736350420 598903516 /nfs/dbraw/zinc/90/35/16/598903516.db2.gz NIASYTSEVGUBOR-CQSZACIVSA-N -1 3 358.442 3.777 20 0 FHADHM CC[C@H](CC1CCCCC1)C(=O)Oc1ccc(-c2nn[n-]n2)cc1OC ZINC000736350420 598903518 /nfs/dbraw/zinc/90/35/18/598903518.db2.gz NIASYTSEVGUBOR-CQSZACIVSA-N -1 3 358.442 3.777 20 0 FHADHM CC[C@H](c1ccncc1)N(CC)C(=O)Nc1cc(-c2nnn[n-]2)ccc1C ZINC000736394245 598904389 /nfs/dbraw/zinc/90/43/89/598904389.db2.gz BXXSUSCJNKTCEH-QGZVFWFLSA-N -1 3 365.441 3.575 20 0 FHADHM CC[C@H](c1ccncc1)N(CC)C(=O)Nc1cc(-c2nn[n-]n2)ccc1C ZINC000736394245 598904391 /nfs/dbraw/zinc/90/43/91/598904391.db2.gz BXXSUSCJNKTCEH-QGZVFWFLSA-N -1 3 365.441 3.575 20 0 FHADHM CCCN(CC)C(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000736469813 598906099 /nfs/dbraw/zinc/90/60/99/598906099.db2.gz MDNYBEUTSGTVNV-UHFFFAOYSA-N -1 3 370.482 3.537 20 0 FHADHM CCN(C(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1)C(C)C ZINC000736504637 598907958 /nfs/dbraw/zinc/90/79/58/598907958.db2.gz CESPAGVJTYZZMZ-UHFFFAOYSA-N -1 3 370.482 3.535 20 0 FHADHM CC1CCC(=CC(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(F)F)CC1 ZINC000736235466 598927814 /nfs/dbraw/zinc/92/78/14/598927814.db2.gz BYSOCXXOAOHYOH-UHFFFAOYSA-N -1 3 363.368 3.543 20 0 FHADHM CC1CCC(=CC(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(F)F)CC1 ZINC000736235466 598927815 /nfs/dbraw/zinc/92/78/15/598927815.db2.gz BYSOCXXOAOHYOH-UHFFFAOYSA-N -1 3 363.368 3.543 20 0 FHADHM C[C@@H]1CC(=O)c2c1c(F)ccc2Oc1ncc(-c2nnn[n-]2)cc1Cl ZINC000736226076 598935433 /nfs/dbraw/zinc/93/54/33/598935433.db2.gz VASYUKRDMQGQGK-SSDOTTSWSA-N -1 3 359.748 3.536 20 0 FHADHM C[C@@H]1CC(=O)c2c1c(F)ccc2Oc1ncc(-c2nn[n-]n2)cc1Cl ZINC000736226076 598935435 /nfs/dbraw/zinc/93/54/35/598935435.db2.gz VASYUKRDMQGQGK-SSDOTTSWSA-N -1 3 359.748 3.536 20 0 FHADHM CN(Cc1cccc(-c2nn[n-]n2)c1)c1ccnc2ccc(Cl)cc21 ZINC000736822782 598937357 /nfs/dbraw/zinc/93/73/57/598937357.db2.gz UERYLYYHKJHFQU-UHFFFAOYSA-N -1 3 350.813 3.705 20 0 FHADHM CCn1c(C)cc2c1CCC[C@@H]2Nc1ncc(-c2nnn[n-]2)cc1Cl ZINC000736720216 598940045 /nfs/dbraw/zinc/94/00/45/598940045.db2.gz MUKGYQLPAGCDGP-AWEZNQCLSA-N -1 3 357.849 3.534 20 0 FHADHM CCn1c(C)cc2c1CCC[C@@H]2Nc1ncc(-c2nn[n-]n2)cc1Cl ZINC000736720216 598940047 /nfs/dbraw/zinc/94/00/47/598940047.db2.gz MUKGYQLPAGCDGP-AWEZNQCLSA-N -1 3 357.849 3.534 20 0 FHADHM Cc1ccc(-c2nc(CCNc3ccc(-c4nn[n-]n4)cc3F)co2)cc1 ZINC000737289821 598940120 /nfs/dbraw/zinc/94/01/20/598940120.db2.gz XNIGBBBPWZZOME-UHFFFAOYSA-N -1 3 364.384 3.624 20 0 FHADHM Fc1ccc([C@@H]2CCCN2c2ncc(-c3nnn[n-]3)cc2Cl)cc1F ZINC000737652896 598942895 /nfs/dbraw/zinc/94/28/95/598942895.db2.gz XVLLQJJLYMVTBT-AWEZNQCLSA-N -1 3 362.771 3.535 20 0 FHADHM Fc1ccc([C@@H]2CCCN2c2ncc(-c3nn[n-]n3)cc2Cl)cc1F ZINC000737652896 598942897 /nfs/dbraw/zinc/94/28/97/598942897.db2.gz XVLLQJJLYMVTBT-AWEZNQCLSA-N -1 3 362.771 3.535 20 0 FHADHM CC(C)[C@H]1CCCN(C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)CC1 ZINC000735749047 598965378 /nfs/dbraw/zinc/96/53/78/598965378.db2.gz LJJCWYSENGKRJR-LBPRGKRZSA-N -1 3 362.865 3.810 20 0 FHADHM CC(C)[C@H]1CCCN(C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)CC1 ZINC000735749047 598965379 /nfs/dbraw/zinc/96/53/79/598965379.db2.gz LJJCWYSENGKRJR-LBPRGKRZSA-N -1 3 362.865 3.810 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)Nc1ccc(C)c(OC(F)F)c1 ZINC000737294028 598966912 /nfs/dbraw/zinc/96/69/12/598966912.db2.gz JSWDDOSZCYNWTO-UHFFFAOYSA-N -1 3 374.351 3.729 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)Nc1ccc(C)c(OC(F)F)c1 ZINC000737294028 598966913 /nfs/dbraw/zinc/96/69/13/598966913.db2.gz JSWDDOSZCYNWTO-UHFFFAOYSA-N -1 3 374.351 3.729 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(-c3nnn[n-]3)cc2)cc1Oc1ccncc1 ZINC000115053677 598978768 /nfs/dbraw/zinc/97/87/68/598978768.db2.gz XETHQPKXIUBXLD-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(-c3nn[n-]n3)cc2)cc1Oc1ccncc1 ZINC000115053677 598978770 /nfs/dbraw/zinc/97/87/70/598978770.db2.gz XETHQPKXIUBXLD-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM CC(C)[C@@H](CC1CCCCC1)C(=O)NCc1cccc(-c2nnn[n-]2)c1 ZINC000735711912 598987030 /nfs/dbraw/zinc/98/70/30/598987030.db2.gz ZEEIHVTWEAJASD-GOSISDBHSA-N -1 3 355.486 3.726 20 0 FHADHM CC(C)[C@@H](CC1CCCCC1)C(=O)NCc1cccc(-c2nn[n-]n2)c1 ZINC000735711912 598987032 /nfs/dbraw/zinc/98/70/32/598987032.db2.gz ZEEIHVTWEAJASD-GOSISDBHSA-N -1 3 355.486 3.726 20 0 FHADHM C[C@@H](C(=O)Nc1nc(-c2ccc(-c3nnn[n-]3)cc2)cs1)C(C)(C)C ZINC000735569068 599014897 /nfs/dbraw/zinc/01/48/97/599014897.db2.gz DFKCHEWQQYCXRS-JTQLQIEISA-N -1 3 356.455 3.611 20 0 FHADHM C[C@@H](C(=O)Nc1nc(-c2ccc(-c3nn[n-]n3)cc2)cs1)C(C)(C)C ZINC000735569068 599014899 /nfs/dbraw/zinc/01/48/99/599014899.db2.gz DFKCHEWQQYCXRS-JTQLQIEISA-N -1 3 356.455 3.611 20 0 FHADHM CC[C@H](NC(=S)Nc1cc(-c2nnn[n-]2)ccc1C)c1cccs1 ZINC000736370636 599013861 /nfs/dbraw/zinc/01/38/61/599013861.db2.gz NCPIOBVPAPZGHN-LBPRGKRZSA-N -1 3 358.496 3.674 20 0 FHADHM CC[C@H](NC(=S)Nc1cc(-c2nn[n-]n2)ccc1C)c1cccs1 ZINC000736370636 599013863 /nfs/dbraw/zinc/01/38/63/599013863.db2.gz NCPIOBVPAPZGHN-LBPRGKRZSA-N -1 3 358.496 3.674 20 0 FHADHM Cc1sc(NC(=O)C[C@@H]2CCc3ccccc32)c(-c2nnn[n-]2)c1C ZINC000737563662 599016355 /nfs/dbraw/zinc/01/63/55/599016355.db2.gz RGJINAVHWCMSCN-ZDUSSCGKSA-N -1 3 353.451 3.604 20 0 FHADHM Cc1sc(NC(=O)C[C@@H]2CCc3ccccc32)c(-c2nn[n-]n2)c1C ZINC000737563662 599016357 /nfs/dbraw/zinc/01/63/57/599016357.db2.gz RGJINAVHWCMSCN-ZDUSSCGKSA-N -1 3 353.451 3.604 20 0 FHADHM CC[C@H]1CCC[C@H](NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)C1 ZINC000736395040 599023703 /nfs/dbraw/zinc/02/37/03/599023703.db2.gz GKSXXSFGNKIRFL-YJBOKZPZSA-N -1 3 370.501 3.756 20 0 FHADHM CC[C@H]1CCC[C@H](NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)C1 ZINC000736395040 599023704 /nfs/dbraw/zinc/02/37/04/599023704.db2.gz GKSXXSFGNKIRFL-YJBOKZPZSA-N -1 3 370.501 3.756 20 0 FHADHM C[C@@H]1CN(c2ccc(-c3nnn[n-]3)c(Cl)c2)C[C@@H](c2ccc(F)cc2)O1 ZINC000820767343 599038857 /nfs/dbraw/zinc/03/88/57/599038857.db2.gz IGZRNFZCPIRMJZ-DIFFPNOSSA-N -1 3 373.819 3.626 20 0 FHADHM C[C@@H]1CN(c2ccc(-c3nn[n-]n3)c(Cl)c2)C[C@@H](c2ccc(F)cc2)O1 ZINC000820767343 599038860 /nfs/dbraw/zinc/03/88/60/599038860.db2.gz IGZRNFZCPIRMJZ-DIFFPNOSSA-N -1 3 373.819 3.626 20 0 FHADHM C[C@H]1CN(c2ccc(Cl)cc2-c2nnn[n-]2)C[C@H](c2ccc(F)cc2)O1 ZINC000820778452 599039369 /nfs/dbraw/zinc/03/93/69/599039369.db2.gz WYVOVYJEBQTLDO-APPDUMDISA-N -1 3 373.819 3.626 20 0 FHADHM C[C@H]1CN(c2ccc(Cl)cc2-c2nn[n-]n2)C[C@H](c2ccc(F)cc2)O1 ZINC000820778452 599039371 /nfs/dbraw/zinc/03/93/71/599039371.db2.gz WYVOVYJEBQTLDO-APPDUMDISA-N -1 3 373.819 3.626 20 0 FHADHM CCC[C@@H](Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1)c1ccccn1 ZINC000736435499 599054008 /nfs/dbraw/zinc/05/40/08/599054008.db2.gz JJBYGMDQELUKMS-GFCCVEGCSA-N -1 3 363.347 3.629 20 0 FHADHM CCC[C@@H](Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1)c1ccccn1 ZINC000736435499 599054010 /nfs/dbraw/zinc/05/40/10/599054010.db2.gz JJBYGMDQELUKMS-GFCCVEGCSA-N -1 3 363.347 3.629 20 0 FHADHM Clc1cc(N[C@@H]2CCCN(c3ccccc3)C2)ccc1-c1nnn[n-]1 ZINC000737566653 599059227 /nfs/dbraw/zinc/05/92/27/599059227.db2.gz WHJNISWIHCEVJR-CQSZACIVSA-N -1 3 354.845 3.601 20 0 FHADHM Clc1cc(N[C@@H]2CCCN(c3ccccc3)C2)ccc1-c1nn[n-]n1 ZINC000737566653 599059230 /nfs/dbraw/zinc/05/92/30/599059230.db2.gz WHJNISWIHCEVJR-CQSZACIVSA-N -1 3 354.845 3.601 20 0 FHADHM FC(F)(F)c1ccc(N2CC[C@H](Nc3ccc(-c4nn[n-]n4)cc3)C2)cc1 ZINC000737637126 599061462 /nfs/dbraw/zinc/06/14/62/599061462.db2.gz ZYSKHAVOJWELNK-HNNXBMFYSA-N -1 3 374.370 3.576 20 0 FHADHM COc1cc(CNc2ccc(-c3nnn[n-]3)c(Cl)c2)c2ccccc2n1 ZINC000821717656 599062434 /nfs/dbraw/zinc/06/24/34/599062434.db2.gz SEYAHJPYSMIJMQ-UHFFFAOYSA-N -1 3 366.812 3.689 20 0 FHADHM COc1cc(CNc2ccc(-c3nn[n-]n3)c(Cl)c2)c2ccccc2n1 ZINC000821717656 599062437 /nfs/dbraw/zinc/06/24/37/599062437.db2.gz SEYAHJPYSMIJMQ-UHFFFAOYSA-N -1 3 366.812 3.689 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H]2C[C@@H]2C2CCCCC2)c1-c1nnn[n-]1 ZINC000736672074 599072808 /nfs/dbraw/zinc/07/28/08/599072808.db2.gz XOWXQOSOBWJQOC-ZIAGYGMSSA-N -1 3 359.499 3.954 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H]2C[C@@H]2C2CCCCC2)c1-c1nn[n-]n1 ZINC000736672074 599072811 /nfs/dbraw/zinc/07/28/11/599072811.db2.gz XOWXQOSOBWJQOC-ZIAGYGMSSA-N -1 3 359.499 3.954 20 0 FHADHM Fc1cc(-c2nnn[n-]2)cc(F)c1N1CC[C@@H](CSc2ccccc2)C1 ZINC000822736192 599088973 /nfs/dbraw/zinc/08/89/73/599088973.db2.gz ADGIVUWJHGYHRF-GFCCVEGCSA-N -1 3 373.432 3.764 20 0 FHADHM Fc1cc(-c2nn[n-]n2)cc(F)c1N1CC[C@@H](CSc2ccccc2)C1 ZINC000822736192 599088976 /nfs/dbraw/zinc/08/89/76/599088976.db2.gz ADGIVUWJHGYHRF-GFCCVEGCSA-N -1 3 373.432 3.764 20 0 FHADHM CC[C@@]1(C)CCCN(c2c(-c3nnn[n-]3)cnc3c(F)ccc(F)c32)C1 ZINC000820950715 599089185 /nfs/dbraw/zinc/08/91/85/599089185.db2.gz RGJHRVTVZUZLMR-SFHVURJKSA-N -1 3 358.396 3.710 20 0 FHADHM CC[C@@]1(C)CCCN(c2c(-c3nn[n-]n3)cnc3c(F)ccc(F)c32)C1 ZINC000820950715 599089188 /nfs/dbraw/zinc/08/91/88/599089188.db2.gz RGJHRVTVZUZLMR-SFHVURJKSA-N -1 3 358.396 3.710 20 0 FHADHM CO[C@H](CNc1c(Cl)cccc1-c1nnn[n-]1)c1cccc(Cl)c1 ZINC000821677250 599090630 /nfs/dbraw/zinc/09/06/30/599090630.db2.gz SBBFSYATFJEVDS-CQSZACIVSA-N -1 3 364.236 3.973 20 0 FHADHM CO[C@H](CNc1c(Cl)cccc1-c1nn[n-]n1)c1cccc(Cl)c1 ZINC000821677250 599090633 /nfs/dbraw/zinc/09/06/33/599090633.db2.gz SBBFSYATFJEVDS-CQSZACIVSA-N -1 3 364.236 3.973 20 0 FHADHM CC(C)(C)OC(=O)Cc1cccc(Nc2cccc(F)c2-c2nnn[n-]2)c1 ZINC000819927914 599094263 /nfs/dbraw/zinc/09/42/63/599094263.db2.gz AVNGCLLWTPPUGX-UHFFFAOYSA-N -1 3 369.400 3.634 20 0 FHADHM CC(C)(C)OC(=O)Cc1cccc(Nc2cccc(F)c2-c2nn[n-]n2)c1 ZINC000819927914 599094266 /nfs/dbraw/zinc/09/42/66/599094266.db2.gz AVNGCLLWTPPUGX-UHFFFAOYSA-N -1 3 369.400 3.634 20 0 FHADHM C[C@H](Sc1ccccc1-c1nnn[n-]1)C(=O)Nc1ccccc1Cl ZINC000736191823 599108350 /nfs/dbraw/zinc/10/83/50/599108350.db2.gz IVLLPSPVTHLYBQ-JTQLQIEISA-N -1 3 359.842 3.639 20 0 FHADHM C[C@H](Sc1ccccc1-c1nn[n-]n1)C(=O)Nc1ccccc1Cl ZINC000736191823 599108354 /nfs/dbraw/zinc/10/83/54/599108354.db2.gz IVLLPSPVTHLYBQ-JTQLQIEISA-N -1 3 359.842 3.639 20 0 FHADHM COc1ccccc1[C@H](C)SCCOc1cccc(-c2nnn[n-]2)c1 ZINC000821883320 599128571 /nfs/dbraw/zinc/12/85/71/599128571.db2.gz SRQXLLNYOMJLDY-ZDUSSCGKSA-N -1 3 356.451 3.749 20 0 FHADHM COc1ccccc1[C@H](C)SCCOc1cccc(-c2nn[n-]n2)c1 ZINC000821883320 599128573 /nfs/dbraw/zinc/12/85/73/599128573.db2.gz SRQXLLNYOMJLDY-ZDUSSCGKSA-N -1 3 356.451 3.749 20 0 FHADHM C/C(=C\C(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)CC(C)C)C(C)(C)C ZINC000819765703 599146203 /nfs/dbraw/zinc/14/62/03/599146203.db2.gz QHYWXFOBVHAOAH-RVDMUPIBSA-N -1 3 355.486 3.844 20 0 FHADHM C/C(=C\C(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)CC(C)C)C(C)(C)C ZINC000819765703 599146206 /nfs/dbraw/zinc/14/62/06/599146206.db2.gz QHYWXFOBVHAOAH-RVDMUPIBSA-N -1 3 355.486 3.844 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@@H](C)CCc1ccccc1F ZINC000822215973 599148195 /nfs/dbraw/zinc/14/81/95/599148195.db2.gz ARGGRUUVPWMFSI-ZDUSSCGKSA-N -1 3 353.401 3.522 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@@H](C)CCc1ccccc1F ZINC000822215973 599148197 /nfs/dbraw/zinc/14/81/97/599148197.db2.gz ARGGRUUVPWMFSI-ZDUSSCGKSA-N -1 3 353.401 3.522 20 0 FHADHM CC[C@@H]1CCC[C@H](OC(=O)CSCc2ccc(-c3nnn[n-]3)cc2)C1 ZINC000736401905 599156213 /nfs/dbraw/zinc/15/62/13/599156213.db2.gz ZXJIUKTWMWETMJ-CJNGLKHVSA-N -1 3 360.483 3.612 20 0 FHADHM CC[C@@H]1CCC[C@H](OC(=O)CSCc2ccc(-c3nn[n-]n3)cc2)C1 ZINC000736401905 599156214 /nfs/dbraw/zinc/15/62/14/599156214.db2.gz ZXJIUKTWMWETMJ-CJNGLKHVSA-N -1 3 360.483 3.612 20 0 FHADHM Cc1sc(NC(=O)C[C@@H](C)c2ccccc2C)c(-c2nnn[n-]2)c1C ZINC000737419153 599158693 /nfs/dbraw/zinc/15/86/93/599158693.db2.gz CYDZBFVXYZEDRH-LLVKDONJSA-N -1 3 355.467 3.986 20 0 FHADHM Cc1sc(NC(=O)C[C@@H](C)c2ccccc2C)c(-c2nn[n-]n2)c1C ZINC000737419153 599158697 /nfs/dbraw/zinc/15/86/97/599158697.db2.gz CYDZBFVXYZEDRH-LLVKDONJSA-N -1 3 355.467 3.986 20 0 FHADHM Clc1ccc(SCc2nnc(-c3ccc(-c4nnn[n-]4)cc3)o2)cc1 ZINC000737574715 599160582 /nfs/dbraw/zinc/16/05/82/599160582.db2.gz RTMJCUWXNJOIRP-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1ccc(SCc2nnc(-c3ccc(-c4nn[n-]n4)cc3)o2)cc1 ZINC000737574715 599160584 /nfs/dbraw/zinc/16/05/84/599160584.db2.gz RTMJCUWXNJOIRP-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Cc1ccccc1[C@H](C)CC(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000737421336 599161528 /nfs/dbraw/zinc/16/15/28/599161528.db2.gz LOLSVTRYYSHAPA-GFCCVEGCSA-N -1 3 355.829 3.961 20 0 FHADHM Cc1ccccc1[C@H](C)CC(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000737421336 599161530 /nfs/dbraw/zinc/16/15/30/599161530.db2.gz LOLSVTRYYSHAPA-GFCCVEGCSA-N -1 3 355.829 3.961 20 0 FHADHM CCSc1ccccc1OC(=O)C=Cc1ccccc1-c1nnn[n-]1 ZINC000736665064 599164809 /nfs/dbraw/zinc/16/48/09/599164809.db2.gz FBOWPXSBUXTHGI-QXMHVHEDSA-N -1 3 352.419 3.598 20 0 FHADHM CCSc1ccccc1OC(=O)C=Cc1ccccc1-c1nn[n-]n1 ZINC000736665064 599164811 /nfs/dbraw/zinc/16/48/11/599164811.db2.gz FBOWPXSBUXTHGI-QXMHVHEDSA-N -1 3 352.419 3.598 20 0 FHADHM CCSc1ccccc1OC(=O)CCc1ccc(-c2nnn[n-]2)cc1 ZINC000736668063 599165011 /nfs/dbraw/zinc/16/50/11/599165011.db2.gz VAOAQTNADSVVIB-UHFFFAOYSA-N -1 3 354.435 3.517 20 0 FHADHM CCSc1ccccc1OC(=O)CCc1ccc(-c2nn[n-]n2)cc1 ZINC000736668063 599165013 /nfs/dbraw/zinc/16/50/13/599165013.db2.gz VAOAQTNADSVVIB-UHFFFAOYSA-N -1 3 354.435 3.517 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1 ZINC000525157455 599177111 /nfs/dbraw/zinc/17/71/11/599177111.db2.gz RXWZJCQJQHHPBV-GJZGRUSLSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1 ZINC000525157455 599177114 /nfs/dbraw/zinc/17/71/14/599177114.db2.gz RXWZJCQJQHHPBV-GJZGRUSLSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1 ZINC000525157456 599177125 /nfs/dbraw/zinc/17/71/25/599177125.db2.gz RXWZJCQJQHHPBV-HUUCEWRRSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1 ZINC000525157456 599177126 /nfs/dbraw/zinc/17/71/26/599177126.db2.gz RXWZJCQJQHHPBV-HUUCEWRRSA-N -1 3 374.231 3.916 20 0 FHADHM S=C(Nc1ccccc1-c1nnn[n-]1)N1CC[C@H]1c1ccc(Cl)cc1 ZINC000738408614 599177622 /nfs/dbraw/zinc/17/76/22/599177622.db2.gz NFGJSTOSYCQFRX-HNNXBMFYSA-N -1 3 370.869 3.664 20 0 FHADHM S=C(Nc1ccccc1-c1nn[n-]n1)N1CC[C@H]1c1ccc(Cl)cc1 ZINC000738408614 599177624 /nfs/dbraw/zinc/17/76/24/599177624.db2.gz NFGJSTOSYCQFRX-HNNXBMFYSA-N -1 3 370.869 3.664 20 0 FHADHM C[C@H](C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1)c1cccc(Cl)c1 ZINC000735561057 599179133 /nfs/dbraw/zinc/17/91/33/599179133.db2.gz UTSZMQSHMOIRFG-VIFPVBQESA-N -1 3 362.220 3.916 20 0 FHADHM C[C@H](C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1)c1cccc(Cl)c1 ZINC000735561057 599179135 /nfs/dbraw/zinc/17/91/35/599179135.db2.gz UTSZMQSHMOIRFG-VIFPVBQESA-N -1 3 362.220 3.916 20 0 FHADHM CC(C)(C)NC(=O)c1cccc(Oc2cccc(Cl)c2-c2nnn[n-]2)c1 ZINC000735622552 599191759 /nfs/dbraw/zinc/19/17/59/599191759.db2.gz BIPGGNIFPGYXIJ-UHFFFAOYSA-N -1 3 371.828 3.841 20 0 FHADHM COCCCCCSc1nc(-c2ccccc2)ccc1-c1nnn[n-]1 ZINC000736980291 599192699 /nfs/dbraw/zinc/19/26/99/599192699.db2.gz YXDJEAJPIWWZJQ-UHFFFAOYSA-N -1 3 355.467 3.838 20 0 FHADHM COCCCCCSc1nc(-c2ccccc2)ccc1-c1nn[n-]n1 ZINC000736980291 599192701 /nfs/dbraw/zinc/19/27/01/599192701.db2.gz YXDJEAJPIWWZJQ-UHFFFAOYSA-N -1 3 355.467 3.838 20 0 FHADHM C[C@@H](CC(=O)Oc1ccc(-c2ccc(-c3nnn[n-]3)cc2)cc1)n1cccc1 ZINC000735975477 599199090 /nfs/dbraw/zinc/19/90/90/599199090.db2.gz HFYXZKCRSSYWDY-HNNXBMFYSA-N -1 3 373.416 3.892 20 0 FHADHM C[C@@H](CC(=O)Oc1ccc(-c2ccc(-c3nn[n-]n3)cc2)cc1)n1cccc1 ZINC000735975477 599199092 /nfs/dbraw/zinc/19/90/92/599199092.db2.gz HFYXZKCRSSYWDY-HNNXBMFYSA-N -1 3 373.416 3.892 20 0 FHADHM Cc1cccc([C@@H]2CCCCN2C(=O)c2cccc(-c3nnn[n-]3)c2)c1C ZINC000822299472 599202813 /nfs/dbraw/zinc/20/28/13/599202813.db2.gz KBHKOMSOUMNAEY-IBGZPJMESA-N -1 3 361.449 3.851 20 0 FHADHM Cc1cccc([C@@H]2CCCCN2C(=O)c2cccc(-c3nn[n-]n3)c2)c1C ZINC000822299472 599202815 /nfs/dbraw/zinc/20/28/15/599202815.db2.gz KBHKOMSOUMNAEY-IBGZPJMESA-N -1 3 361.449 3.851 20 0 FHADHM C[C@@H]1C[C@H]1C(=O)N(Cc1ccc(Cl)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000736235296 599208943 /nfs/dbraw/zinc/20/89/43/599208943.db2.gz MYONNGJIGPHPLV-SJKOYZFVSA-N -1 3 367.840 3.709 20 0 FHADHM C[C@@H]1C[C@H]1C(=O)N(Cc1ccc(Cl)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000736235296 599208946 /nfs/dbraw/zinc/20/89/46/599208946.db2.gz MYONNGJIGPHPLV-SJKOYZFVSA-N -1 3 367.840 3.709 20 0 FHADHM CCCC(=O)N(Cc1ccc(Cl)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000736408652 599210070 /nfs/dbraw/zinc/21/00/70/599210070.db2.gz GCEVQJRTADXDHR-UHFFFAOYSA-N -1 3 355.829 3.853 20 0 FHADHM CCCC(=O)N(Cc1ccc(Cl)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000736408652 599210072 /nfs/dbraw/zinc/21/00/72/599210072.db2.gz GCEVQJRTADXDHR-UHFFFAOYSA-N -1 3 355.829 3.853 20 0 FHADHM COc1ccc([C@@H]2CCCN2c2cccc(Cl)c2-c2nnn[n-]2)cc1 ZINC000821787011 599215774 /nfs/dbraw/zinc/21/57/74/599215774.db2.gz NGQZWOHCCDUEMX-HNNXBMFYSA-N -1 3 355.829 3.870 20 0 FHADHM COc1ccc([C@@H]2CCCN2c2cccc(Cl)c2-c2nn[n-]n2)cc1 ZINC000821787011 599215776 /nfs/dbraw/zinc/21/57/76/599215776.db2.gz NGQZWOHCCDUEMX-HNNXBMFYSA-N -1 3 355.829 3.870 20 0 FHADHM Fc1cccc(CNc2ccc(F)c(-c3nnn[n-]3)c2)c1Br ZINC000822782794 607265142 /nfs/dbraw/zinc/26/51/42/607265142.db2.gz HCZNUDMOEIOQJT-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1cccc(CNc2ccc(F)c(-c3nn[n-]n3)c2)c1Br ZINC000822782794 607265143 /nfs/dbraw/zinc/26/51/43/607265143.db2.gz HCZNUDMOEIOQJT-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Cc1c(NC(=O)CCCCCc2cccs2)cccc1-c1nnn[n-]1 ZINC000822066000 607268701 /nfs/dbraw/zinc/26/87/01/607268701.db2.gz DMQXDNOOXWVOLZ-UHFFFAOYSA-N -1 3 355.467 3.978 20 0 FHADHM Cc1c(NC(=O)CCCCCc2cccs2)cccc1-c1nn[n-]n1 ZINC000822066000 607268702 /nfs/dbraw/zinc/26/87/02/607268702.db2.gz DMQXDNOOXWVOLZ-UHFFFAOYSA-N -1 3 355.467 3.978 20 0 FHADHM Cc1c(NC(=O)[C@@H](C)CCc2cccc(F)c2)cccc1-c1nnn[n-]1 ZINC000822060450 607266453 /nfs/dbraw/zinc/26/64/53/607266453.db2.gz HNPAXFYZWOZRHJ-LBPRGKRZSA-N -1 3 353.401 3.522 20 0 FHADHM Cc1c(NC(=O)[C@@H](C)CCc2cccc(F)c2)cccc1-c1nn[n-]n1 ZINC000822060450 607266454 /nfs/dbraw/zinc/26/64/54/607266454.db2.gz HNPAXFYZWOZRHJ-LBPRGKRZSA-N -1 3 353.401 3.522 20 0 FHADHM Cc1ccc(NC(=S)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1C ZINC000822254433 599239573 /nfs/dbraw/zinc/23/95/73/599239573.db2.gz JQNCTYXQFBZDTC-ZDUSSCGKSA-N -1 3 352.467 3.531 20 0 FHADHM CCCC[C@H](CC)CNC(=S)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821039472 599238332 /nfs/dbraw/zinc/23/83/32/599238332.db2.gz CFNXGIJGUBQTEK-KGLIPLIRSA-N -1 3 360.531 3.608 20 0 FHADHM CCCC[C@H](CC)CNC(=S)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821039472 599238334 /nfs/dbraw/zinc/23/83/34/599238334.db2.gz CFNXGIJGUBQTEK-KGLIPLIRSA-N -1 3 360.531 3.608 20 0 FHADHM Cc1ccc(NC(=S)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1C ZINC000822254433 599239575 /nfs/dbraw/zinc/23/95/75/599239575.db2.gz JQNCTYXQFBZDTC-ZDUSSCGKSA-N -1 3 352.467 3.531 20 0 FHADHM Cc1ccc([C@@H]2CCCCN2C(=O)Nc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000822233154 599241523 /nfs/dbraw/zinc/24/15/23/599241523.db2.gz ITTARPMJSRLDNX-SFHVURJKSA-N -1 3 362.437 3.934 20 0 FHADHM Cc1ccc([C@@H]2CCCCN2C(=O)Nc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000822233154 599241527 /nfs/dbraw/zinc/24/15/27/599241527.db2.gz ITTARPMJSRLDNX-SFHVURJKSA-N -1 3 362.437 3.934 20 0 FHADHM Cc1c(NC(=O)Cc2ccc(Cl)c(Cl)c2)cccc1-c1nnn[n-]1 ZINC000822076648 607270949 /nfs/dbraw/zinc/27/09/49/607270949.db2.gz PKGONGKVCFQIRJ-UHFFFAOYSA-N -1 3 362.220 3.663 20 0 FHADHM Cc1c(NC(=O)Cc2ccc(Cl)c(Cl)c2)cccc1-c1nn[n-]n1 ZINC000822076648 607270950 /nfs/dbraw/zinc/27/09/50/607270950.db2.gz PKGONGKVCFQIRJ-UHFFFAOYSA-N -1 3 362.220 3.663 20 0 FHADHM CCc1cccc(CC)c1NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821492344 599247097 /nfs/dbraw/zinc/24/70/97/599247097.db2.gz MITUQDWVOVIDSH-ZDUSSCGKSA-N -1 3 364.453 3.874 20 0 FHADHM CCc1cccc(CC)c1NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821492344 599247099 /nfs/dbraw/zinc/24/70/99/599247099.db2.gz MITUQDWVOVIDSH-ZDUSSCGKSA-N -1 3 364.453 3.874 20 0 FHADHM Cc1ccc([C@H](C)N(C)C(=O)Nc2cccc(-c3nnn[n-]3)c2C)cc1 ZINC000822228991 607281826 /nfs/dbraw/zinc/28/18/26/607281826.db2.gz KDFHQEFUNODSRJ-AWEZNQCLSA-N -1 3 350.426 3.708 20 0 FHADHM Cc1ccc([C@H](C)N(C)C(=O)Nc2cccc(-c3nn[n-]n3)c2C)cc1 ZINC000822228991 607281827 /nfs/dbraw/zinc/28/18/27/607281827.db2.gz KDFHQEFUNODSRJ-AWEZNQCLSA-N -1 3 350.426 3.708 20 0 FHADHM Cc1c(NC(=O)N2CC[C@H](c3ccccc3)[C@@H]2C)cccc1-c1nnn[n-]1 ZINC000822084908 607288200 /nfs/dbraw/zinc/28/82/00/607288200.db2.gz RVCUWGJOAMZYOA-YOEHRIQHSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1c(NC(=O)N2CC[C@H](c3ccccc3)[C@@H]2C)cccc1-c1nn[n-]n1 ZINC000822084908 607288201 /nfs/dbraw/zinc/28/82/01/607288201.db2.gz RVCUWGJOAMZYOA-YOEHRIQHSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1cc(C)c2ncc(-c3nnn[n-]3)c(N(C)Cc3cccs3)c2c1 ZINC000737249323 599255081 /nfs/dbraw/zinc/25/50/81/599255081.db2.gz WIFJRXFPYCLNBP-UHFFFAOYSA-N -1 3 350.451 3.730 20 0 FHADHM Cc1cc(C)c2ncc(-c3nn[n-]n3)c(N(C)Cc3cccs3)c2c1 ZINC000737249323 599255084 /nfs/dbraw/zinc/25/50/84/599255084.db2.gz WIFJRXFPYCLNBP-UHFFFAOYSA-N -1 3 350.451 3.730 20 0 FHADHM Cc1ccc(CN(C)c2c(-c3nnn[n-]3)cnc3c(F)ccc(F)c32)cc1 ZINC000737343274 599256457 /nfs/dbraw/zinc/25/64/57/599256457.db2.gz YJXPZAZODGORDI-UHFFFAOYSA-N -1 3 366.375 3.638 20 0 FHADHM Cc1ccc(CN(C)c2c(-c3nn[n-]n3)cnc3c(F)ccc(F)c32)cc1 ZINC000737343274 599256459 /nfs/dbraw/zinc/25/64/59/599256459.db2.gz YJXPZAZODGORDI-UHFFFAOYSA-N -1 3 366.375 3.638 20 0 FHADHM Cc1c(NC(=O)N[C@@H]2CCc3cc(Cl)ccc32)cccc1-c1nnn[n-]1 ZINC000822088864 607284754 /nfs/dbraw/zinc/28/47/54/607284754.db2.gz AKYDUAGFKFXIIA-MRXNPFEDSA-N -1 3 368.828 3.638 20 0 FHADHM Cc1c(NC(=O)N[C@@H]2CCc3cc(Cl)ccc32)cccc1-c1nn[n-]n1 ZINC000822088864 607284755 /nfs/dbraw/zinc/28/47/55/607284755.db2.gz AKYDUAGFKFXIIA-MRXNPFEDSA-N -1 3 368.828 3.638 20 0 FHADHM Cc1c(NC(=O)N[C@@H](C)c2cccc(Cl)c2)cccc1-c1nnn[n-]1 ZINC000822090735 607285774 /nfs/dbraw/zinc/28/57/74/607285774.db2.gz MPCVFIQIMJJMTK-NSHDSACASA-N -1 3 356.817 3.711 20 0 FHADHM Cc1c(NC(=O)N[C@@H](C)c2cccc(Cl)c2)cccc1-c1nn[n-]n1 ZINC000822090735 607285775 /nfs/dbraw/zinc/28/57/75/607285775.db2.gz MPCVFIQIMJJMTK-NSHDSACASA-N -1 3 356.817 3.711 20 0 FHADHM Cc1ccccc1[C@H](C)N(C)C(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000822345632 607291305 /nfs/dbraw/zinc/29/13/05/607291305.db2.gz NLECWPWBLDPXLS-AWEZNQCLSA-N -1 3 350.426 3.708 20 0 FHADHM Cc1ccccc1[C@H](C)N(C)C(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000822345632 607291306 /nfs/dbraw/zinc/29/13/06/607291306.db2.gz NLECWPWBLDPXLS-AWEZNQCLSA-N -1 3 350.426 3.708 20 0 FHADHM Cc1c(NC(=O)N[C@@H](c2ccccc2)C2CCC2)cccc1-c1nnn[n-]1 ZINC000822091948 607292525 /nfs/dbraw/zinc/29/25/25/607292525.db2.gz VDSXIWNARAHNKD-SFHVURJKSA-N -1 3 362.437 3.838 20 0 FHADHM Cc1c(NC(=O)N[C@@H](c2ccccc2)C2CCC2)cccc1-c1nn[n-]n1 ZINC000822091948 607292526 /nfs/dbraw/zinc/29/25/26/607292526.db2.gz VDSXIWNARAHNKD-SFHVURJKSA-N -1 3 362.437 3.838 20 0 FHADHM CC[C@H](Sc1ccccc1)C(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000820937691 607294007 /nfs/dbraw/zinc/29/40/07/607294007.db2.gz BZJOATBMJOOICC-INIZCTEOSA-N -1 3 353.451 3.685 20 0 FHADHM CC[C@H](Sc1ccccc1)C(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000820937691 607294008 /nfs/dbraw/zinc/29/40/08/607294008.db2.gz BZJOATBMJOOICC-INIZCTEOSA-N -1 3 353.451 3.685 20 0 FHADHM Cc1c(NC(=O)c2cc(Cl)sc2Cl)cccc1-c1nnn[n-]1 ZINC000822109015 607297413 /nfs/dbraw/zinc/29/74/13/607297413.db2.gz ONLXABRVUFVBFE-UHFFFAOYSA-N -1 3 354.222 3.796 20 0 FHADHM Cc1c(NC(=O)c2cc(Cl)sc2Cl)cccc1-c1nn[n-]n1 ZINC000822109015 607297414 /nfs/dbraw/zinc/29/74/14/607297414.db2.gz ONLXABRVUFVBFE-UHFFFAOYSA-N -1 3 354.222 3.796 20 0 FHADHM O[C@@H]1CCCC[C@H]1CCCNc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000823706936 607306477 /nfs/dbraw/zinc/30/64/77/607306477.db2.gz RVUDSWQYUJCNLA-XHDPSFHLSA-N -1 3 369.391 3.629 20 0 FHADHM O[C@@H]1CCCC[C@H]1CCCNc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000823706936 607306478 /nfs/dbraw/zinc/30/64/78/607306478.db2.gz RVUDSWQYUJCNLA-XHDPSFHLSA-N -1 3 369.391 3.629 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NC(=O)N1C[C@@H](C)CCC[C@@H]1C ZINC000820690216 599262766 /nfs/dbraw/zinc/26/27/66/599262766.db2.gz HSHSDUFBONGCDC-KBPBESRZSA-N -1 3 372.473 3.696 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NC(=O)N1C[C@@H](C)CCC[C@@H]1C ZINC000820690216 599262770 /nfs/dbraw/zinc/26/27/70/599262770.db2.gz HSHSDUFBONGCDC-KBPBESRZSA-N -1 3 372.473 3.696 20 0 FHADHM CCCOc1cccc(CC(=O)O[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000821134483 607317559 /nfs/dbraw/zinc/31/75/59/607317559.db2.gz XENZHVTXBNAGTL-AWEZNQCLSA-N -1 3 366.421 3.502 20 0 FHADHM CCCOc1cccc(CC(=O)O[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000821134483 607317560 /nfs/dbraw/zinc/31/75/60/607317560.db2.gz XENZHVTXBNAGTL-AWEZNQCLSA-N -1 3 366.421 3.502 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cccc(C)c1C ZINC000736488944 599275269 /nfs/dbraw/zinc/27/52/69/599275269.db2.gz VOKDHFBKMAAHNZ-UHFFFAOYSA-N -1 3 350.426 3.558 20 0 FHADHM COc1ccc(CNc2ccc(OC(C)C)c(C)c2)cc1-c1nnn[n-]1 ZINC000821821182 607318521 /nfs/dbraw/zinc/31/85/21/607318521.db2.gz BGVRETWCACDHRA-UHFFFAOYSA-N -1 3 353.426 3.583 20 0 FHADHM COc1ccc(CNc2ccc(OC(C)C)c(C)c2)cc1-c1nn[n-]n1 ZINC000821821182 607318522 /nfs/dbraw/zinc/31/85/22/607318522.db2.gz BGVRETWCACDHRA-UHFFFAOYSA-N -1 3 353.426 3.583 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cc(C)cc(C)c1 ZINC000736488951 599278133 /nfs/dbraw/zinc/27/81/33/599278133.db2.gz VROHSIZLNASYQN-UHFFFAOYSA-N -1 3 350.426 3.558 20 0 FHADHM Cc1c2c(sc1NC(=O)CCc1ccc(-c3nnn[n-]3)cc1)CCCC2 ZINC000737220584 599279450 /nfs/dbraw/zinc/27/94/50/599279450.db2.gz ZPCCFEHHLVCMRX-UHFFFAOYSA-N -1 3 367.478 3.687 20 0 FHADHM Cc1c2c(sc1NC(=O)CCc1ccc(-c3nn[n-]n3)cc1)CCCC2 ZINC000737220584 599279453 /nfs/dbraw/zinc/27/94/53/599279453.db2.gz ZPCCFEHHLVCMRX-UHFFFAOYSA-N -1 3 367.478 3.687 20 0 FHADHM Cc1ccc([C@H](C)OC(=O)CSc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000822271238 607320648 /nfs/dbraw/zinc/32/06/48/607320648.db2.gz SEADBGPVAJUOEL-ZDUSSCGKSA-N -1 3 354.435 3.572 20 0 FHADHM Cc1ccc([C@H](C)OC(=O)CSc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000822271238 607320649 /nfs/dbraw/zinc/32/06/49/607320649.db2.gz SEADBGPVAJUOEL-ZDUSSCGKSA-N -1 3 354.435 3.572 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)N[C@H](CC1CC1)c1ccccc1 ZINC000823333174 599280417 /nfs/dbraw/zinc/28/04/17/599280417.db2.gz ZJWWJRCQEYTOTJ-QGZVFWFLSA-N -1 3 366.400 3.669 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)N[C@H](CC1CC1)c1ccccc1 ZINC000823333174 599280419 /nfs/dbraw/zinc/28/04/19/599280419.db2.gz ZJWWJRCQEYTOTJ-QGZVFWFLSA-N -1 3 366.400 3.669 20 0 FHADHM C[C@H](Sc1nnc(C2CC2)n1C1CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736193871 599287376 /nfs/dbraw/zinc/28/73/76/599287376.db2.gz VESZJGOKTXEDIG-JTQLQIEISA-N -1 3 353.455 3.524 20 0 FHADHM C[C@H](Sc1nnc(C2CC2)n1C1CC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736193871 599287378 /nfs/dbraw/zinc/28/73/78/599287378.db2.gz VESZJGOKTXEDIG-JTQLQIEISA-N -1 3 353.455 3.524 20 0 FHADHM CCCCN(CC)C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000821060626 599289153 /nfs/dbraw/zinc/28/91/53/599289153.db2.gz FJEMZNQNGVOQLV-UHFFFAOYSA-N -1 3 356.352 3.539 20 0 FHADHM CCCCN(CC)C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000821060626 599289155 /nfs/dbraw/zinc/28/91/55/599289155.db2.gz FJEMZNQNGVOQLV-UHFFFAOYSA-N -1 3 356.352 3.539 20 0 FHADHM O=C(c1cccc(-c2nnn[n-]2)c1)N1CCCC[C@@H]1c1ccc(F)cc1F ZINC000823487542 607321563 /nfs/dbraw/zinc/32/15/63/607321563.db2.gz DXEMMAAMGYVIJB-QGZVFWFLSA-N -1 3 369.375 3.512 20 0 FHADHM O=C(c1cccc(-c2nn[n-]n2)c1)N1CCCC[C@@H]1c1ccc(F)cc1F ZINC000823487542 607321564 /nfs/dbraw/zinc/32/15/64/607321564.db2.gz DXEMMAAMGYVIJB-QGZVFWFLSA-N -1 3 369.375 3.512 20 0 FHADHM COC(=O)c1ccc(CS[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000736947902 599290161 /nfs/dbraw/zinc/29/01/61/599290161.db2.gz NSOIXIGGRVMGMO-GFCCVEGCSA-N -1 3 354.435 3.648 20 0 FHADHM COC(=O)c1ccc(CS[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000736947902 599290163 /nfs/dbraw/zinc/29/01/63/599290163.db2.gz NSOIXIGGRVMGMO-GFCCVEGCSA-N -1 3 354.435 3.648 20 0 FHADHM CC1(C)CCCN(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)C1 ZINC000820594881 599290781 /nfs/dbraw/zinc/29/07/81/599290781.db2.gz FALHORDWEMNJCO-UHFFFAOYSA-N -1 3 368.363 3.539 20 0 FHADHM CC1(C)CCCN(C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)C1 ZINC000820594881 599290783 /nfs/dbraw/zinc/29/07/83/599290783.db2.gz FALHORDWEMNJCO-UHFFFAOYSA-N -1 3 368.363 3.539 20 0 FHADHM C[C@@H](Cc1nc2ccccc2s1)Nc1ncc(-c2nnn[n-]2)cc1Cl ZINC000820306788 607329317 /nfs/dbraw/zinc/32/93/17/607329317.db2.gz FMXBIXCITXZVDH-VIFPVBQESA-N -1 3 371.857 3.568 20 0 FHADHM C[C@@H](Cc1nc2ccccc2s1)Nc1ncc(-c2nn[n-]n2)cc1Cl ZINC000820306788 607329318 /nfs/dbraw/zinc/32/93/18/607329318.db2.gz FMXBIXCITXZVDH-VIFPVBQESA-N -1 3 371.857 3.568 20 0 FHADHM O=C([O-])c1cccc(CNCc2ccc(NC(=O)c3ccco3)cc2)c1 ZINC000821553057 598202652 /nfs/dbraw/zinc/20/26/52/598202652.db2.gz WXLBMTNHEUHWJX-UHFFFAOYSA-N -1 3 350.374 3.520 20 0 FHADHM COc1cc(C)c([C@@H](C)Nc2ccc(-c3nn[n-]n3)cc2F)cc1OC ZINC000737041917 598238642 /nfs/dbraw/zinc/23/86/42/598238642.db2.gz XFCVVVNEDLKZMC-LLVKDONJSA-N -1 3 357.389 3.505 20 0 FHADHM CC[C@H](C)C(=O)Nc1cccc(CNc2ccc(-c3nn[n-]n3)cc2F)c1 ZINC000736320301 598239662 /nfs/dbraw/zinc/23/96/62/598239662.db2.gz SPKDYUOUGYMBCJ-LBPRGKRZSA-N -1 3 368.416 3.603 20 0 FHADHM CC[C@H](C)[C@@H](C)N(C(=O)CSCc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000736334576 598240573 /nfs/dbraw/zinc/24/05/73/598240573.db2.gz XFJRPHUCCVEPDU-UONOGXRCSA-N -1 3 373.526 3.526 20 0 FHADHM CC[C@H](C)[C@@H](C)N(C(=O)CSCc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000736334576 598240575 /nfs/dbraw/zinc/24/05/75/598240575.db2.gz XFJRPHUCCVEPDU-UONOGXRCSA-N -1 3 373.526 3.526 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1NCc1nc2cc(Cl)ccc2s1 ZINC000737645072 598242329 /nfs/dbraw/zinc/24/23/29/598242329.db2.gz PWQAIWMANAZIQA-UHFFFAOYSA-N -1 3 360.805 3.881 20 0 FHADHM Cc1nnc(N(C)Cc2ccccc2-c2ccccc2)c(-c2nnn[n-]2)c1C ZINC000737523554 598247034 /nfs/dbraw/zinc/24/70/34/598247034.db2.gz UOZFTENFBDEAQN-UHFFFAOYSA-N -1 3 371.448 3.577 20 0 FHADHM Cc1nnc(N(C)Cc2ccccc2-c2ccccc2)c(-c2nn[n-]n2)c1C ZINC000737523554 598247036 /nfs/dbraw/zinc/24/70/36/598247036.db2.gz UOZFTENFBDEAQN-UHFFFAOYSA-N -1 3 371.448 3.577 20 0 FHADHM Cc1cccc2c1CC[C@@H]2NC(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000737407594 598264235 /nfs/dbraw/zinc/26/42/35/598264235.db2.gz DARNGRJGDLFSBV-INIZCTEOSA-N -1 3 368.828 3.638 20 0 FHADHM Cc1cccc2c1CC[C@@H]2NC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000737407594 598264238 /nfs/dbraw/zinc/26/42/38/598264238.db2.gz DARNGRJGDLFSBV-INIZCTEOSA-N -1 3 368.828 3.638 20 0 FHADHM C[C@H](NC(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)C1CC1 ZINC000736119352 598266318 /nfs/dbraw/zinc/26/63/18/598266318.db2.gz XXHQHRCPEVPFJQ-LBPRGKRZSA-N -1 3 364.409 3.579 20 0 FHADHM C[C@H](NC(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)C1CC1 ZINC000736119352 598266320 /nfs/dbraw/zinc/26/63/20/598266320.db2.gz XXHQHRCPEVPFJQ-LBPRGKRZSA-N -1 3 364.409 3.579 20 0 FHADHM CCC[C@H](C)NC(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736423240 598267320 /nfs/dbraw/zinc/26/73/20/598267320.db2.gz MPOWSKVLTXNBQE-ZDUSSCGKSA-N -1 3 366.425 3.969 20 0 FHADHM CCC[C@H](C)NC(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736423240 598267325 /nfs/dbraw/zinc/26/73/25/598267325.db2.gz MPOWSKVLTXNBQE-ZDUSSCGKSA-N -1 3 366.425 3.969 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)N[C@H](c1ccccc1)C1CCC1 ZINC000738167710 598268368 /nfs/dbraw/zinc/26/83/68/598268368.db2.gz RNDLIEFDTQSXNL-QGZVFWFLSA-N -1 3 366.400 3.669 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)N[C@H](c1ccccc1)C1CCC1 ZINC000738167710 598268370 /nfs/dbraw/zinc/26/83/70/598268370.db2.gz RNDLIEFDTQSXNL-QGZVFWFLSA-N -1 3 366.400 3.669 20 0 FHADHM Cc1noc([C@@H](C)Nc2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)n1 ZINC000737540351 598285545 /nfs/dbraw/zinc/28/55/45/598285545.db2.gz UWRWDPZBUHKNEC-LLVKDONJSA-N -1 3 363.381 3.524 20 0 FHADHM Cc1ccccc1N(C(=S)Nc1ccccc1-c1nnn[n-]1)C(C)C ZINC000737428972 598296327 /nfs/dbraw/zinc/29/63/27/598296327.db2.gz ZSUFWTZLXBPMQI-UHFFFAOYSA-N -1 3 352.467 3.787 20 0 FHADHM Cc1ccccc1N(C(=S)Nc1ccccc1-c1nn[n-]n1)C(C)C ZINC000737428972 598296329 /nfs/dbraw/zinc/29/63/29/598296329.db2.gz ZSUFWTZLXBPMQI-UHFFFAOYSA-N -1 3 352.467 3.787 20 0 FHADHM O=C(Nc1nc(-c2ccc(-c3nnn[n-]3)cc2)cs1)C1CCCCCC1 ZINC000738211612 598296471 /nfs/dbraw/zinc/29/64/71/598296471.db2.gz OKZUXZPXUOGISN-UHFFFAOYSA-N -1 3 368.466 3.899 20 0 FHADHM O=C(Nc1nc(-c2ccc(-c3nn[n-]n3)cc2)cs1)C1CCCCCC1 ZINC000738211612 598296473 /nfs/dbraw/zinc/29/64/73/598296473.db2.gz OKZUXZPXUOGISN-UHFFFAOYSA-N -1 3 368.466 3.899 20 0 FHADHM CC[C@@H](C)Oc1ccccc1C=CC(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000729833922 598296888 /nfs/dbraw/zinc/29/68/88/598296888.db2.gz NZVIKAYDFKVYIH-XMXAVACDSA-N -1 3 363.421 3.696 20 0 FHADHM CC[C@@H](C)Oc1ccccc1C=CC(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000729833922 598296889 /nfs/dbraw/zinc/29/68/89/598296889.db2.gz NZVIKAYDFKVYIH-XMXAVACDSA-N -1 3 363.421 3.696 20 0 FHADHM Cc1ccc(C)c(NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c1 ZINC000737326912 598316091 /nfs/dbraw/zinc/31/60/91/598316091.db2.gz UOEAOKQGVBDXBX-UHFFFAOYSA-N -1 3 358.858 3.946 20 0 FHADHM Cc1ccc(C)c(NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c1 ZINC000737326912 598316093 /nfs/dbraw/zinc/31/60/93/598316093.db2.gz UOEAOKQGVBDXBX-UHFFFAOYSA-N -1 3 358.858 3.946 20 0 FHADHM Cc1ccc(F)cc1NC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000737345934 598317704 /nfs/dbraw/zinc/31/77/04/598317704.db2.gz ACFPGVUMSWHYBW-UHFFFAOYSA-N -1 3 362.821 3.777 20 0 FHADHM Cc1ccc(F)cc1NC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000737345934 598317705 /nfs/dbraw/zinc/31/77/05/598317705.db2.gz ACFPGVUMSWHYBW-UHFFFAOYSA-N -1 3 362.821 3.777 20 0 FHADHM CCC1CCC(NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)CC1 ZINC000736394263 598320036 /nfs/dbraw/zinc/32/00/36/598320036.db2.gz AVPKGIODSFOVCA-UHFFFAOYSA-N -1 3 364.906 3.775 20 0 FHADHM CCC1CCC(NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)CC1 ZINC000736394263 598320038 /nfs/dbraw/zinc/32/00/38/598320038.db2.gz AVPKGIODSFOVCA-UHFFFAOYSA-N -1 3 364.906 3.775 20 0 FHADHM CC(C)(C)c1ccccc1NC(=O)NCc1ccc(-c2nnn[n-]2)cc1F ZINC000735652101 598321615 /nfs/dbraw/zinc/32/16/15/598321615.db2.gz AIWSTHPQJAFLLM-UHFFFAOYSA-N -1 3 368.416 3.625 20 0 FHADHM CC(C)(C)c1ccccc1NC(=O)NCc1ccc(-c2nn[n-]n2)cc1F ZINC000735652101 598321617 /nfs/dbraw/zinc/32/16/17/598321617.db2.gz AIWSTHPQJAFLLM-UHFFFAOYSA-N -1 3 368.416 3.625 20 0 FHADHM C[C@@H]1CCC[C@H](CNC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)C1 ZINC000736248534 598321938 /nfs/dbraw/zinc/32/19/38/598321938.db2.gz JCFNOJBGZIZNPL-MNOVXSKESA-N -1 3 364.906 3.633 20 0 FHADHM C[C@@H]1CCC[C@H](CNC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)C1 ZINC000736248534 598321939 /nfs/dbraw/zinc/32/19/39/598321939.db2.gz JCFNOJBGZIZNPL-MNOVXSKESA-N -1 3 364.906 3.633 20 0 FHADHM C[C@H](NC(=O)Nc1cccc(-c2nnn[n-]2)c1)c1csc2ccccc21 ZINC000736119474 598369261 /nfs/dbraw/zinc/36/92/61/598369261.db2.gz YZZDIUUKOUBUAQ-NSHDSACASA-N -1 3 364.434 3.964 20 0 FHADHM C[C@H](NC(=O)Nc1cccc(-c2nn[n-]n2)c1)c1csc2ccccc21 ZINC000736119474 598369264 /nfs/dbraw/zinc/36/92/64/598369264.db2.gz YZZDIUUKOUBUAQ-NSHDSACASA-N -1 3 364.434 3.964 20 0 FHADHM CCN(C(=O)c1cccc2cccnc21)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736508446 598382784 /nfs/dbraw/zinc/38/27/84/598382784.db2.gz LRNGFDMXTKHKCP-CQSZACIVSA-N -1 3 372.432 3.638 20 0 FHADHM CCN(C(=O)c1cccc2cccnc21)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736508446 598382785 /nfs/dbraw/zinc/38/27/85/598382785.db2.gz LRNGFDMXTKHKCP-CQSZACIVSA-N -1 3 372.432 3.638 20 0 FHADHM CCN(C(=O)c1cccc2c1ccn2C)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736509367 598382793 /nfs/dbraw/zinc/38/27/93/598382793.db2.gz WAJILQRVHULZCI-CQSZACIVSA-N -1 3 374.448 3.582 20 0 FHADHM CCN(C(=O)c1cccc2c1ccn2C)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736509367 598382795 /nfs/dbraw/zinc/38/27/95/598382795.db2.gz WAJILQRVHULZCI-CQSZACIVSA-N -1 3 374.448 3.582 20 0 FHADHM Clc1ccc(NCc2ccc(Br)cc2)c(-c2nnn[n-]2)c1 ZINC000737572894 598388459 /nfs/dbraw/zinc/38/84/59/598388459.db2.gz BCBWHJHQBSAWHW-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM Clc1ccc(NCc2ccc(Br)cc2)c(-c2nn[n-]n2)c1 ZINC000737572894 598388461 /nfs/dbraw/zinc/38/84/61/598388461.db2.gz BCBWHJHQBSAWHW-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1N1CCC(CCc2ccccc2)CC1 ZINC000737561800 598388482 /nfs/dbraw/zinc/38/84/82/598388482.db2.gz IMUBSZUCDOPJLF-UHFFFAOYSA-N -1 3 368.872 3.764 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1N1CCC(CCc2ccccc2)CC1 ZINC000737561800 598388484 /nfs/dbraw/zinc/38/84/84/598388484.db2.gz IMUBSZUCDOPJLF-UHFFFAOYSA-N -1 3 368.872 3.764 20 0 FHADHM C[C@H](Nc1ncc(-c2nnn[n-]2)cc1Cl)c1ccc(F)c(Cl)c1 ZINC000736137445 598392248 /nfs/dbraw/zinc/39/22/48/598392248.db2.gz MGDUGDIVVHHRDT-ZETCQYMHSA-N -1 3 353.188 3.881 20 0 FHADHM C[C@H](Nc1ncc(-c2nn[n-]n2)cc1Cl)c1ccc(F)c(Cl)c1 ZINC000736137445 598392249 /nfs/dbraw/zinc/39/22/49/598392249.db2.gz MGDUGDIVVHHRDT-ZETCQYMHSA-N -1 3 353.188 3.881 20 0 FHADHM FC(F)CN(Cc1ccc(-c2ccccc2-c2nnn[n-]2)cc1)C1CC1 ZINC000737639636 598405779 /nfs/dbraw/zinc/40/57/79/598405779.db2.gz USTXNOFZYDQTOQ-UHFFFAOYSA-N -1 3 355.392 3.763 20 0 FHADHM FC(F)CN(Cc1ccc(-c2ccccc2-c2nn[n-]n2)cc1)C1CC1 ZINC000737639636 598405782 /nfs/dbraw/zinc/40/57/82/598405782.db2.gz USTXNOFZYDQTOQ-UHFFFAOYSA-N -1 3 355.392 3.763 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)N1CCCc2ccccc2C1 ZINC000738152460 598414346 /nfs/dbraw/zinc/41/43/46/598414346.db2.gz UNKBVJXAJHXVCW-UHFFFAOYSA-N -1 3 368.828 3.500 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)N1CCCc2ccccc2C1 ZINC000738152460 598414348 /nfs/dbraw/zinc/41/43/48/598414348.db2.gz UNKBVJXAJHXVCW-UHFFFAOYSA-N -1 3 368.828 3.500 20 0 FHADHM Cc1cc(C)cc(NC(=O)[C@@H](C)Sc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737250870 598414512 /nfs/dbraw/zinc/41/45/12/598414512.db2.gz PXWAUDJBDYGXFW-CYBMUJFWSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1cc(C)cc(NC(=O)[C@@H](C)Sc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737250870 598414514 /nfs/dbraw/zinc/41/45/14/598414514.db2.gz PXWAUDJBDYGXFW-CYBMUJFWSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1cc(Cl)ccc1NC(=O)[C@H](C)Sc1ccc(-c2nnn[n-]2)cc1 ZINC000737265760 598414697 /nfs/dbraw/zinc/41/46/97/598414697.db2.gz YLCQDZOWZDKKTO-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM Cc1cc(Cl)ccc1NC(=O)[C@H](C)Sc1ccc(-c2nn[n-]n2)cc1 ZINC000737265760 598414699 /nfs/dbraw/zinc/41/46/99/598414699.db2.gz YLCQDZOWZDKKTO-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl ZINC000500684804 598418935 /nfs/dbraw/zinc/41/89/35/598418935.db2.gz OUYSVDVPUUSTFN-KGLIPLIRSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl ZINC000500684804 598418937 /nfs/dbraw/zinc/41/89/37/598418937.db2.gz OUYSVDVPUUSTFN-KGLIPLIRSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl ZINC000499756027 598418987 /nfs/dbraw/zinc/41/89/87/598418987.db2.gz JZBVGEKJHYPFRW-ZIAGYGMSSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl ZINC000499756027 598418988 /nfs/dbraw/zinc/41/89/88/598418988.db2.gz JZBVGEKJHYPFRW-ZIAGYGMSSA-N -1 3 374.231 3.916 20 0 FHADHM C[C@@H](NC(=O)c1sccc1-c1nnn[n-]1)c1cc2ccccc2s1 ZINC000736127731 598422265 /nfs/dbraw/zinc/42/22/65/598422265.db2.gz UDBLEQLEJABCHJ-SECBINFHSA-N -1 3 355.448 3.634 20 0 FHADHM C[C@@H](NC(=O)c1sccc1-c1nn[n-]n1)c1cc2ccccc2s1 ZINC000736127731 598422267 /nfs/dbraw/zinc/42/22/67/598422267.db2.gz UDBLEQLEJABCHJ-SECBINFHSA-N -1 3 355.448 3.634 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@H]1CCC[C@@H](C)[C@H]1C ZINC000736263471 598428074 /nfs/dbraw/zinc/42/80/74/598428074.db2.gz ROPMWUHADPQECY-RKVPGOIHSA-N -1 3 370.501 3.611 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@H]1CCC[C@@H](C)[C@H]1C ZINC000736263471 598428077 /nfs/dbraw/zinc/42/80/77/598428077.db2.gz ROPMWUHADPQECY-RKVPGOIHSA-N -1 3 370.501 3.611 20 0 FHADHM O=C(OCc1cccc(-c2nnn[n-]2)c1)c1sccc1SC(F)F ZINC000738232209 598432246 /nfs/dbraw/zinc/43/22/46/598432246.db2.gz IMPZSCLDNZPXDU-UHFFFAOYSA-N -1 3 368.390 3.600 20 0 FHADHM O=C(OCc1cccc(-c2nn[n-]n2)c1)c1sccc1SC(F)F ZINC000738232209 598432248 /nfs/dbraw/zinc/43/22/48/598432248.db2.gz IMPZSCLDNZPXDU-UHFFFAOYSA-N -1 3 368.390 3.600 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)[C@H]1C[C@@H]1c1cccc2ccccc21 ZINC000107542730 598435479 /nfs/dbraw/zinc/43/54/79/598435479.db2.gz FKHVVGCUUVTSIL-MOPGFXCFSA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)[C@H]1C[C@@H]1c1cccc2ccccc21 ZINC000107542730 598435480 /nfs/dbraw/zinc/43/54/80/598435480.db2.gz FKHVVGCUUVTSIL-MOPGFXCFSA-N -1 3 355.401 3.762 20 0 FHADHM CC(C)CNC(=O)c1cccc(CSc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000735839402 598439449 /nfs/dbraw/zinc/43/94/49/598439449.db2.gz SUUNWTUJOORNGN-UHFFFAOYSA-N -1 3 367.478 3.545 20 0 FHADHM CC(C)CNC(=O)c1cccc(CSc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735839402 598439451 /nfs/dbraw/zinc/43/94/51/598439451.db2.gz SUUNWTUJOORNGN-UHFFFAOYSA-N -1 3 367.478 3.545 20 0 FHADHM Clc1cc2c(cc1SCc1ccc(-c3nnn[n-]3)cc1)OCCO2 ZINC000737565786 598440078 /nfs/dbraw/zinc/44/00/78/598440078.db2.gz QUJMOMKHPZRZOV-UHFFFAOYSA-N -1 3 360.826 3.584 20 0 FHADHM Clc1cc2c(cc1SCc1ccc(-c3nn[n-]n3)cc1)OCCO2 ZINC000737565786 598440080 /nfs/dbraw/zinc/44/00/80/598440080.db2.gz QUJMOMKHPZRZOV-UHFFFAOYSA-N -1 3 360.826 3.584 20 0 FHADHM Cc1ccc2cccc(NC(=S)Nc3ccccc3-c3nnn[n-]3)c2n1 ZINC000737375840 598441539 /nfs/dbraw/zinc/44/15/39/598441539.db2.gz XTUZELSXKXRTCP-UHFFFAOYSA-N -1 3 361.434 3.532 20 0 FHADHM Cc1ccc2cccc(NC(=S)Nc3ccccc3-c3nn[n-]n3)c2n1 ZINC000737375840 598441540 /nfs/dbraw/zinc/44/15/40/598441540.db2.gz XTUZELSXKXRTCP-UHFFFAOYSA-N -1 3 361.434 3.532 20 0 FHADHM CC[C@H](C)Sc1ccc(NC(=O)c2ccc(-c3nnn[n-]3)cn2)c(C)c1 ZINC000736327542 598449488 /nfs/dbraw/zinc/44/94/88/598449488.db2.gz MFVOCASILIVMRJ-LBPRGKRZSA-N -1 3 368.466 3.713 20 0 FHADHM CC[C@H](C)Sc1ccc(NC(=O)c2ccc(-c3nn[n-]n3)cn2)c(C)c1 ZINC000736327542 598449489 /nfs/dbraw/zinc/44/94/89/598449489.db2.gz MFVOCASILIVMRJ-LBPRGKRZSA-N -1 3 368.466 3.713 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1N1CCC[C@@H](c2ccccc2)CC1 ZINC000737565651 598458801 /nfs/dbraw/zinc/45/88/01/598458801.db2.gz VKKBQKRTQOGEQQ-CQSZACIVSA-N -1 3 354.845 3.689 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1N1CCC[C@@H](c2ccccc2)CC1 ZINC000737565651 598458803 /nfs/dbraw/zinc/45/88/03/598458803.db2.gz VKKBQKRTQOGEQQ-CQSZACIVSA-N -1 3 354.845 3.689 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)N1CCC[C@H](c2ccccc2)CC1 ZINC000738178282 598468640 /nfs/dbraw/zinc/46/86/40/598468640.db2.gz IWTUTMFPCSHGEO-INIZCTEOSA-N -1 3 362.437 3.668 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)N1CCC[C@H](c2ccccc2)CC1 ZINC000738178282 598468642 /nfs/dbraw/zinc/46/86/42/598468642.db2.gz IWTUTMFPCSHGEO-INIZCTEOSA-N -1 3 362.437 3.668 20 0 FHADHM Cc1ccc(NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)c(C)c1 ZINC000737356089 598475098 /nfs/dbraw/zinc/47/50/98/598475098.db2.gz DNWFRWKDXJGYAP-UHFFFAOYSA-N -1 3 362.437 3.680 20 0 FHADHM Cc1ccc(NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)c(C)c1 ZINC000737356089 598475100 /nfs/dbraw/zinc/47/51/00/598475100.db2.gz DNWFRWKDXJGYAP-UHFFFAOYSA-N -1 3 362.437 3.680 20 0 FHADHM CC(C)CCC[C@@H](C)NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000735796547 598475710 /nfs/dbraw/zinc/47/57/10/598475710.db2.gz DDGSENRMPQNRGX-OAHLLOKOSA-N -1 3 370.501 3.756 20 0 FHADHM CC(C)CCC[C@@H](C)NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000735796547 598475712 /nfs/dbraw/zinc/47/57/12/598475712.db2.gz DDGSENRMPQNRGX-OAHLLOKOSA-N -1 3 370.501 3.756 20 0 FHADHM O=C(Nc1ccc2c(c1)CCC2)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000738173891 598476073 /nfs/dbraw/zinc/47/60/73/598476073.db2.gz GWFXXOUEGUKMAY-UHFFFAOYSA-N -1 3 374.448 3.552 20 0 FHADHM O=C(Nc1ccc2c(c1)CCC2)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000738173891 598476074 /nfs/dbraw/zinc/47/60/74/598476074.db2.gz GWFXXOUEGUKMAY-UHFFFAOYSA-N -1 3 374.448 3.552 20 0 FHADHM C[C@H](CC(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(F)cc1 ZINC000735977451 598482216 /nfs/dbraw/zinc/48/22/16/598482216.db2.gz OPYBIAVHPMZQDV-OLZOCXBDSA-N -1 3 354.385 3.804 20 0 FHADHM C[C@H](CC(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(F)cc1 ZINC000735977451 598482217 /nfs/dbraw/zinc/48/22/17/598482217.db2.gz OPYBIAVHPMZQDV-OLZOCXBDSA-N -1 3 354.385 3.804 20 0 FHADHM Cc1ccc(C(=O)CCC(=O)O[C@@H](C)c2cccc(-c3nnn[n-]3)c2)s1 ZINC000737308353 598486816 /nfs/dbraw/zinc/48/68/16/598486816.db2.gz LFTRTZARHLSMMY-LBPRGKRZSA-N -1 3 370.434 3.504 20 0 FHADHM Cc1ccc(C(=O)CCC(=O)O[C@@H](C)c2cccc(-c3nn[n-]n3)c2)s1 ZINC000737308353 598486818 /nfs/dbraw/zinc/48/68/18/598486818.db2.gz LFTRTZARHLSMMY-LBPRGKRZSA-N -1 3 370.434 3.504 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccc(Cl)s1)c1cccc(-c2nnn[n-]2)c1 ZINC000736150080 598487085 /nfs/dbraw/zinc/48/70/85/598487085.db2.gz ILDPDEOJWJVMBK-ZEBCKKTISA-N -1 3 360.826 3.899 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccc(Cl)s1)c1cccc(-c2nn[n-]n2)c1 ZINC000736150080 598487087 /nfs/dbraw/zinc/48/70/87/598487087.db2.gz ILDPDEOJWJVMBK-ZEBCKKTISA-N -1 3 360.826 3.899 20 0 FHADHM C[C@H](CC(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C)c1ccc(F)cc1 ZINC000735973649 598488025 /nfs/dbraw/zinc/48/80/25/598488025.db2.gz CFWXCNFZSSTGPN-GFCCVEGCSA-N -1 3 370.432 3.695 20 0 FHADHM C[C@H](CC(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C)c1ccc(F)cc1 ZINC000735973649 598488026 /nfs/dbraw/zinc/48/80/26/598488026.db2.gz CFWXCNFZSSTGPN-GFCCVEGCSA-N -1 3 370.432 3.695 20 0 FHADHM CC(=CC(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C)c1ccc(F)cc1 ZINC000735446622 598490407 /nfs/dbraw/zinc/49/04/07/598490407.db2.gz CETZHXIVASGFLH-FMIVXFBMSA-N -1 3 368.416 3.604 20 0 FHADHM CC(=CC(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C)c1ccc(F)cc1 ZINC000735446622 598490408 /nfs/dbraw/zinc/49/04/08/598490408.db2.gz CETZHXIVASGFLH-FMIVXFBMSA-N -1 3 368.416 3.604 20 0 FHADHM CC(C)c1ccc(C(=O)Nc2cc(-c3nnn[n-]3)cn2C(C)(C)C)cc1 ZINC000735922968 598490967 /nfs/dbraw/zinc/49/09/67/598490967.db2.gz QAQIGZBRFKAEJT-UHFFFAOYSA-N -1 3 352.442 3.799 20 0 FHADHM CC(C)c1ccc(C(=O)Nc2cc(-c3nn[n-]n3)cn2C(C)(C)C)cc1 ZINC000735922968 598490968 /nfs/dbraw/zinc/49/09/68/598490968.db2.gz QAQIGZBRFKAEJT-UHFFFAOYSA-N -1 3 352.442 3.799 20 0 FHADHM c1ccc2cc(OCCCSc3ccc(-c4nnn[n-]4)cn3)ccc2c1 ZINC000738443613 598495259 /nfs/dbraw/zinc/49/52/59/598495259.db2.gz ZESWXYCVPHOIBN-UHFFFAOYSA-N -1 3 363.446 3.976 20 0 FHADHM c1ccc2cc(OCCCSc3ccc(-c4nn[n-]n4)cn3)ccc2c1 ZINC000738443613 598495260 /nfs/dbraw/zinc/49/52/60/598495260.db2.gz ZESWXYCVPHOIBN-UHFFFAOYSA-N -1 3 363.446 3.976 20 0 FHADHM O=C(NCC1CCC(c2ccccc2)CC1)c1sccc1-c1nnn[n-]1 ZINC000738044145 598495463 /nfs/dbraw/zinc/49/54/63/598495463.db2.gz HLUACHUMVGHFNP-UHFFFAOYSA-N -1 3 367.478 3.632 20 0 FHADHM O=C(NCC1CCC(c2ccccc2)CC1)c1sccc1-c1nn[n-]n1 ZINC000738044145 598495464 /nfs/dbraw/zinc/49/54/64/598495464.db2.gz HLUACHUMVGHFNP-UHFFFAOYSA-N -1 3 367.478 3.632 20 0 FHADHM Cc1ncccc1C(=O)OCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000737502327 598513136 /nfs/dbraw/zinc/51/31/36/598513136.db2.gz MGOYIBGLDAZGOD-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM Cc1ncccc1C(=O)OCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000737502327 598513138 /nfs/dbraw/zinc/51/31/38/598513138.db2.gz MGOYIBGLDAZGOD-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000521464921 598513316 /nfs/dbraw/zinc/51/33/16/598513316.db2.gz FSNVWUVHHIBMLG-QWHCGFSZSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000521464921 598513317 /nfs/dbraw/zinc/51/33/17/598513317.db2.gz FSNVWUVHHIBMLG-QWHCGFSZSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(C[C@H]1CCCc2ccccc21)OCc1ccc(F)cc1-c1nnn[n-]1 ZINC000737822680 598515233 /nfs/dbraw/zinc/51/52/33/598515233.db2.gz NJZFPFYFBSCVIX-CQSZACIVSA-N -1 3 366.396 3.559 20 0 FHADHM O=C(C[C@H]1CCCc2ccccc21)OCc1ccc(F)cc1-c1nn[n-]n1 ZINC000737822680 598515234 /nfs/dbraw/zinc/51/52/34/598515234.db2.gz NJZFPFYFBSCVIX-CQSZACIVSA-N -1 3 366.396 3.559 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H](C)Cc2ccc(F)cc2)c1-c1nnn[n-]1 ZINC000736670822 598515492 /nfs/dbraw/zinc/51/54/92/598515492.db2.gz SQAYZDWOLYNOQY-JTQLQIEISA-N -1 3 373.457 3.755 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H](C)Cc2ccc(F)cc2)c1-c1nn[n-]n1 ZINC000736670822 598515493 /nfs/dbraw/zinc/51/54/93/598515493.db2.gz SQAYZDWOLYNOQY-JTQLQIEISA-N -1 3 373.457 3.755 20 0 FHADHM CCc1c(C)sc(NC(=O)CCc2cccc(C)c2)c1-c1nnn[n-]1 ZINC000736670418 598516900 /nfs/dbraw/zinc/51/69/00/598516900.db2.gz PDNLGAAZYHVIPC-UHFFFAOYSA-N -1 3 355.467 3.679 20 0 FHADHM CCc1c(C)sc(NC(=O)CCc2cccc(C)c2)c1-c1nn[n-]n1 ZINC000736670418 598516902 /nfs/dbraw/zinc/51/69/02/598516902.db2.gz PDNLGAAZYHVIPC-UHFFFAOYSA-N -1 3 355.467 3.679 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cccc3cccnc32)c1-c1nnn[n-]1 ZINC000736677100 598518062 /nfs/dbraw/zinc/51/80/62/598518062.db2.gz ZIPCGQLQKBCKGZ-UHFFFAOYSA-N -1 3 364.434 3.600 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cccc3cccnc32)c1-c1nn[n-]n1 ZINC000736677100 598518064 /nfs/dbraw/zinc/51/80/64/598518064.db2.gz ZIPCGQLQKBCKGZ-UHFFFAOYSA-N -1 3 364.434 3.600 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H](C)Oc2cccc(C)c2)c1-c1nnn[n-]1 ZINC000736670365 598518682 /nfs/dbraw/zinc/51/86/82/598518682.db2.gz NUXKRSKJILRHCB-LLVKDONJSA-N -1 3 371.466 3.513 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H](C)Oc2cccc(C)c2)c1-c1nn[n-]n1 ZINC000736670365 598518684 /nfs/dbraw/zinc/51/86/84/598518684.db2.gz NUXKRSKJILRHCB-LLVKDONJSA-N -1 3 371.466 3.513 20 0 FHADHM CCc1c(C)sc(NC(=O)CCCOc2ccccc2)c1-c1nnn[n-]1 ZINC000736669450 598518709 /nfs/dbraw/zinc/51/87/09/598518709.db2.gz HYDDXKFFSNSTFR-UHFFFAOYSA-N -1 3 371.466 3.597 20 0 FHADHM CCc1c(C)sc(NC(=O)CCCOc2ccccc2)c1-c1nn[n-]n1 ZINC000736669450 598518710 /nfs/dbraw/zinc/51/87/10/598518710.db2.gz HYDDXKFFSNSTFR-UHFFFAOYSA-N -1 3 371.466 3.597 20 0 FHADHM CCc1c(C)sc(NC(=O)CCc2ccc(CC)cc2)c1-c1nnn[n-]1 ZINC000736683815 598518986 /nfs/dbraw/zinc/51/89/86/598518986.db2.gz RZDVMGMEWDCWEF-UHFFFAOYSA-N -1 3 369.494 3.933 20 0 FHADHM CCc1c(C)sc(NC(=O)CCc2ccc(CC)cc2)c1-c1nn[n-]n1 ZINC000736683815 598518987 /nfs/dbraw/zinc/51/89/87/598518987.db2.gz RZDVMGMEWDCWEF-UHFFFAOYSA-N -1 3 369.494 3.933 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@H]1NC(=O)CCc1ccc(-c2nnn[n-]2)cc1 ZINC000735796342 598519238 /nfs/dbraw/zinc/51/92/38/598519238.db2.gz AHCUOGJBEXKKFM-FUHWJXTLSA-N -1 3 355.486 3.520 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@H]1NC(=O)CCc1ccc(-c2nn[n-]n2)cc1 ZINC000735796342 598519239 /nfs/dbraw/zinc/51/92/39/598519239.db2.gz AHCUOGJBEXKKFM-FUHWJXTLSA-N -1 3 355.486 3.520 20 0 FHADHM O[C@H](CCc1cccc(Nc2ccc(-c3nnn[n-]3)cn2)c1)c1ccccc1 ZINC000738380086 598521277 /nfs/dbraw/zinc/52/12/77/598521277.db2.gz DLTQWTLZYFFTTA-LJQANCHMSA-N -1 3 372.432 3.672 20 0 FHADHM O[C@H](CCc1cccc(Nc2ccc(-c3nn[n-]n3)cn2)c1)c1ccccc1 ZINC000738380086 598521278 /nfs/dbraw/zinc/52/12/78/598521278.db2.gz DLTQWTLZYFFTTA-LJQANCHMSA-N -1 3 372.432 3.672 20 0 FHADHM O=C(Nc1sccc1-c1nnn[n-]1)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000738206764 598533883 /nfs/dbraw/zinc/53/38/83/598533883.db2.gz GWMDKVFJTKNRDB-HZPDHXFCSA-N -1 3 361.430 3.824 20 0 FHADHM O=C(Nc1sccc1-c1nn[n-]n1)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000738206764 598533886 /nfs/dbraw/zinc/53/38/86/598533886.db2.gz GWMDKVFJTKNRDB-HZPDHXFCSA-N -1 3 361.430 3.824 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)c1cccc(OC2CCCC2)c1 ZINC000737293985 598534070 /nfs/dbraw/zinc/53/40/70/598534070.db2.gz JAXCPFMDUHJRKL-UHFFFAOYSA-N -1 3 363.421 3.749 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cccc(OC2CCCC2)c1 ZINC000737293985 598534072 /nfs/dbraw/zinc/53/40/72/598534072.db2.gz JAXCPFMDUHJRKL-UHFFFAOYSA-N -1 3 363.421 3.749 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)O[C@@H]1CCc2ccc(Cl)cc21 ZINC000737799048 598537771 /nfs/dbraw/zinc/53/77/71/598537771.db2.gz ITKMTIMNVRRBRK-PYUISTEWSA-N -1 3 366.808 3.764 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)O[C@@H]1CCc2ccc(Cl)cc21 ZINC000737799048 598537772 /nfs/dbraw/zinc/53/77/72/598537772.db2.gz ITKMTIMNVRRBRK-PYUISTEWSA-N -1 3 366.808 3.764 20 0 FHADHM CC(C)(C)CC(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000735593570 598542957 /nfs/dbraw/zinc/54/29/57/598542957.db2.gz KILMWLUZYKSALU-UHFFFAOYSA-N -1 3 365.437 3.820 20 0 FHADHM CC(C)(C)CC(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000735593570 598542958 /nfs/dbraw/zinc/54/29/58/598542958.db2.gz KILMWLUZYKSALU-UHFFFAOYSA-N -1 3 365.437 3.820 20 0 FHADHM C[C@@H](CC(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(F)F)CC(C)(C)C ZINC000735975777 598544840 /nfs/dbraw/zinc/54/48/40/598544840.db2.gz OHQPCMBKBZIRRQ-JTQLQIEISA-N -1 3 367.400 3.869 20 0 FHADHM C[C@@H](CC(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(F)F)CC(C)(C)C ZINC000735975777 598544841 /nfs/dbraw/zinc/54/48/41/598544841.db2.gz OHQPCMBKBZIRRQ-JTQLQIEISA-N -1 3 367.400 3.869 20 0 FHADHM Fc1cc(OCc2cc(Cl)ccc2OC(F)F)ccc1-c1nnn[n-]1 ZINC000737651641 598548105 /nfs/dbraw/zinc/54/81/05/598548105.db2.gz LWMWTSIIIXHDOT-UHFFFAOYSA-N -1 3 370.718 3.840 20 0 FHADHM Fc1cc(OCc2cc(Cl)ccc2OC(F)F)ccc1-c1nn[n-]n1 ZINC000737651641 598548106 /nfs/dbraw/zinc/54/81/06/598548106.db2.gz LWMWTSIIIXHDOT-UHFFFAOYSA-N -1 3 370.718 3.840 20 0 FHADHM Fc1cc(OCCOc2c(Cl)cccc2Cl)ccc1-c1nnn[n-]1 ZINC000737649209 598552172 /nfs/dbraw/zinc/55/21/72/598552172.db2.gz DLDBDAINIWUDTM-UHFFFAOYSA-N -1 3 369.183 3.770 20 0 FHADHM Fc1cc(OCCOc2c(Cl)cccc2Cl)ccc1-c1nn[n-]n1 ZINC000737649209 598552173 /nfs/dbraw/zinc/55/21/73/598552173.db2.gz DLDBDAINIWUDTM-UHFFFAOYSA-N -1 3 369.183 3.770 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@H](C)c1ccccc1F ZINC000735904537 598552932 /nfs/dbraw/zinc/55/29/32/598552932.db2.gz PRZUEYNAXDADSZ-GFCCVEGCSA-N -1 3 369.400 3.535 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@H](C)c1ccccc1F ZINC000735904537 598552933 /nfs/dbraw/zinc/55/29/33/598552933.db2.gz PRZUEYNAXDADSZ-GFCCVEGCSA-N -1 3 369.400 3.535 20 0 FHADHM CSC[C@H](C)C(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737180119 598553368 /nfs/dbraw/zinc/55/33/68/598553368.db2.gz PELQMPWYDNSEJX-LBPRGKRZSA-N -1 3 369.450 3.597 20 0 FHADHM CSC[C@H](C)C(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737180119 598553371 /nfs/dbraw/zinc/55/33/71/598553371.db2.gz PELQMPWYDNSEJX-LBPRGKRZSA-N -1 3 369.450 3.597 20 0 FHADHM CCCSCC(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736498509 598554795 /nfs/dbraw/zinc/55/47/95/598554795.db2.gz UNJSJQKRWVMAAS-UHFFFAOYSA-N -1 3 369.450 3.741 20 0 FHADHM CCCSCC(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736498509 598554796 /nfs/dbraw/zinc/55/47/96/598554796.db2.gz UNJSJQKRWVMAAS-UHFFFAOYSA-N -1 3 369.450 3.741 20 0 FHADHM O=C(C[C@@H]1C=CCC1)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000737814365 598555593 /nfs/dbraw/zinc/55/55/93/598555593.db2.gz NICSFFVCTVRCHX-CQSZACIVSA-N -1 3 361.405 3.954 20 0 FHADHM O=C(C[C@@H]1C=CCC1)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000737814365 598555595 /nfs/dbraw/zinc/55/55/95/598555595.db2.gz NICSFFVCTVRCHX-CQSZACIVSA-N -1 3 361.405 3.954 20 0 FHADHM Cc1c[nH]cc1C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000737219555 598557298 /nfs/dbraw/zinc/55/72/98/598557298.db2.gz RWVJAZBRWITWLO-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM Cc1c[nH]cc1C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000737219555 598557299 /nfs/dbraw/zinc/55/72/99/598557299.db2.gz RWVJAZBRWITWLO-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM CC/C=C\CCOC(=O)c1ccc(COc2ccc(-c3nn[n-]n3)cc2)o1 ZINC000736407605 598565019 /nfs/dbraw/zinc/56/50/19/598565019.db2.gz AIMSFXYSEVDJGI-ARJAWSKDSA-N -1 3 368.393 3.552 20 0 FHADHM Cc1ccccc1-c1nc(C(=O)Nc2ccccc2-c2nnn[n-]2)cs1 ZINC000737419454 598571809 /nfs/dbraw/zinc/57/18/09/598571809.db2.gz WYOPOQQOGLZKDH-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1ccccc1-c1nc(C(=O)Nc2ccccc2-c2nn[n-]n2)cs1 ZINC000737419454 598571811 /nfs/dbraw/zinc/57/18/11/598571811.db2.gz WYOPOQQOGLZKDH-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM C[C@H](OC(=O)[C@@H]1C[C@@H]1c1ccc(F)c(F)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000736149478 598582721 /nfs/dbraw/zinc/58/27/21/598582721.db2.gz GNOLEDMSDQVLIZ-COLVAYQJSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@@H]1C[C@@H]1c1ccc(F)c(F)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000736149478 598582723 /nfs/dbraw/zinc/58/27/23/598582723.db2.gz GNOLEDMSDQVLIZ-COLVAYQJSA-N -1 3 370.359 3.553 20 0 FHADHM CC(C)Sc1ccc(C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)cc1 ZINC000735921367 598584210 /nfs/dbraw/zinc/58/42/10/598584210.db2.gz QKCAQKZOYLWKQU-UHFFFAOYSA-N -1 3 357.414 3.759 20 0 FHADHM CC(C)Sc1ccc(C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)cc1 ZINC000735921367 598584211 /nfs/dbraw/zinc/58/42/11/598584211.db2.gz QKCAQKZOYLWKQU-UHFFFAOYSA-N -1 3 357.414 3.759 20 0 FHADHM Cc1c(C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)oc2c1c(C)ccc2C ZINC000737326607 598584899 /nfs/dbraw/zinc/58/48/99/598584899.db2.gz QSKNAOOVBHNPKG-UHFFFAOYSA-N -1 3 365.368 3.930 20 0 FHADHM Cc1c(C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)oc2c1c(C)ccc2C ZINC000737326607 598584901 /nfs/dbraw/zinc/58/49/01/598584901.db2.gz QSKNAOOVBHNPKG-UHFFFAOYSA-N -1 3 365.368 3.930 20 0 FHADHM Cc1ccc(SCCC(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)cc1C ZINC000737367903 598589182 /nfs/dbraw/zinc/58/91/82/598589182.db2.gz CQHDVAQUJCBNNC-UHFFFAOYSA-N -1 3 371.441 3.744 20 0 FHADHM Cc1ccc(SCCC(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)cc1C ZINC000737367903 598589184 /nfs/dbraw/zinc/58/91/84/598589184.db2.gz CQHDVAQUJCBNNC-UHFFFAOYSA-N -1 3 371.441 3.744 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)c1cc2c(cccc2F)s1 ZINC000738165231 598589506 /nfs/dbraw/zinc/58/95/06/598589506.db2.gz ACCSMTPFXLXBQO-UHFFFAOYSA-N -1 3 357.345 3.612 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)c1cc2c(cccc2F)s1 ZINC000738165231 598589507 /nfs/dbraw/zinc/58/95/07/598589507.db2.gz ACCSMTPFXLXBQO-UHFFFAOYSA-N -1 3 357.345 3.612 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)c1cc2cc(Cl)ccc2o1 ZINC000738167783 598589578 /nfs/dbraw/zinc/58/95/78/598589578.db2.gz VFBXHNFWKVEPQJ-UHFFFAOYSA-N -1 3 357.732 3.658 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)c1cc2cc(Cl)ccc2o1 ZINC000738167783 598589580 /nfs/dbraw/zinc/58/95/80/598589580.db2.gz VFBXHNFWKVEPQJ-UHFFFAOYSA-N -1 3 357.732 3.658 20 0 FHADHM C[C@@H](Oc1ccccc1-c1nnn[n-]1)c1nc(-c2ccc(Cl)cc2)no1 ZINC000736190573 598608314 /nfs/dbraw/zinc/60/83/14/598608314.db2.gz WHZQFXWINBRJNH-SNVBAGLBSA-N -1 3 368.784 3.710 20 0 FHADHM C[C@@H](Oc1ccccc1-c1nn[n-]n1)c1nc(-c2ccc(Cl)cc2)no1 ZINC000736190573 598608315 /nfs/dbraw/zinc/60/83/15/598608315.db2.gz WHZQFXWINBRJNH-SNVBAGLBSA-N -1 3 368.784 3.710 20 0 FHADHM Clc1cccc(Cl)c1-c1noc(-c2ccc(-c3nnn[n-]3)cc2)n1 ZINC000737575318 598608958 /nfs/dbraw/zinc/60/89/58/598608958.db2.gz QVELOJQNIPQGMW-UHFFFAOYSA-N -1 3 359.176 3.891 20 0 FHADHM Clc1cccc(Cl)c1-c1noc(-c2ccc(-c3nn[n-]n3)cc2)n1 ZINC000737575318 598608959 /nfs/dbraw/zinc/60/89/59/598608959.db2.gz QVELOJQNIPQGMW-UHFFFAOYSA-N -1 3 359.176 3.891 20 0 FHADHM CCN(Cc1ccccc1Cl)C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000736555294 598624782 /nfs/dbraw/zinc/62/47/82/598624782.db2.gz DXJFQOFUEVALMC-UHFFFAOYSA-N -1 3 374.807 3.713 20 0 FHADHM CCN(Cc1ccccc1Cl)C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000736555294 598624785 /nfs/dbraw/zinc/62/47/85/598624785.db2.gz DXJFQOFUEVALMC-UHFFFAOYSA-N -1 3 374.807 3.713 20 0 FHADHM Cc1ccc([C@H](C)N(C)C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)c(C)c1 ZINC000737320533 598626360 /nfs/dbraw/zinc/62/63/60/598626360.db2.gz MPQQPMOGEQFUCG-ZDUSSCGKSA-N -1 3 368.416 3.848 20 0 FHADHM Cc1ccc([C@H](C)N(C)C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)c(C)c1 ZINC000737320533 598626362 /nfs/dbraw/zinc/62/63/62/598626362.db2.gz MPQQPMOGEQFUCG-ZDUSSCGKSA-N -1 3 368.416 3.848 20 0 FHADHM Cc1ccc([C@@H](C)NC(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)c(C)c1 ZINC000737322601 598629531 /nfs/dbraw/zinc/62/95/31/598629531.db2.gz ZQBUZEOYNNSDPS-GFCCVEGCSA-N -1 3 354.389 3.505 20 0 FHADHM Cc1ccc([C@@H](C)NC(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)c(C)c1 ZINC000737322601 598629532 /nfs/dbraw/zinc/62/95/32/598629532.db2.gz ZQBUZEOYNNSDPS-GFCCVEGCSA-N -1 3 354.389 3.505 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(N2CCc3[nH]c4ccccc4c3C2)c1 ZINC000737570980 598632610 /nfs/dbraw/zinc/63/26/10/598632610.db2.gz OOMAJFNORFGNJP-UHFFFAOYSA-N -1 3 350.813 3.564 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(N2CCc3[nH]c4ccccc4c3C2)c1 ZINC000737570980 598632612 /nfs/dbraw/zinc/63/26/12/598632612.db2.gz OOMAJFNORFGNJP-UHFFFAOYSA-N -1 3 350.813 3.564 20 0 FHADHM Cc1nc2ccccc2n1CCCNc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000737490849 598636390 /nfs/dbraw/zinc/63/63/90/598636390.db2.gz YAPYQHLMNPIFMG-UHFFFAOYSA-N -1 3 367.844 3.680 20 0 FHADHM Cc1nc2ccccc2n1CCCNc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000737490849 598636392 /nfs/dbraw/zinc/63/63/92/598636392.db2.gz YAPYQHLMNPIFMG-UHFFFAOYSA-N -1 3 367.844 3.680 20 0 FHADHM C[C@@H](SCCCc1ccccc1)C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000736187959 598643355 /nfs/dbraw/zinc/64/33/55/598643355.db2.gz FARMDPBZVIAPMU-CQSZACIVSA-N -1 3 367.478 3.560 20 0 FHADHM C[C@@H](SCCCc1ccccc1)C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000736187959 598643357 /nfs/dbraw/zinc/64/33/57/598643357.db2.gz FARMDPBZVIAPMU-CQSZACIVSA-N -1 3 367.478 3.560 20 0 FHADHM S=C(Nc1ccccc1-c1nnn[n-]1)N1CCCC2(CCCCC2)C1 ZINC000738409672 598644136 /nfs/dbraw/zinc/64/41/36/598644136.db2.gz VXWJFTXOAKWHKM-UHFFFAOYSA-N -1 3 356.499 3.610 20 0 FHADHM S=C(Nc1ccccc1-c1nn[n-]n1)N1CCCC2(CCCCC2)C1 ZINC000738409672 598644138 /nfs/dbraw/zinc/64/41/38/598644138.db2.gz VXWJFTXOAKWHKM-UHFFFAOYSA-N -1 3 356.499 3.610 20 0 FHADHM Cc1ccc(OC(=O)c2ccc(Oc3ccc(-c4nnn[n-]4)cn3)cc2)cc1 ZINC000737364124 598644743 /nfs/dbraw/zinc/64/47/43/598644743.db2.gz IDUGZDVRZLTOAL-UHFFFAOYSA-N -1 3 373.372 3.582 20 0 FHADHM Cc1ccc(OC(=O)c2ccc(Oc3ccc(-c4nn[n-]n4)cn3)cc2)cc1 ZINC000737364124 598644745 /nfs/dbraw/zinc/64/47/45/598644745.db2.gz IDUGZDVRZLTOAL-UHFFFAOYSA-N -1 3 373.372 3.582 20 0 FHADHM Fc1ccc(CSc2nccn2Cc2ccccc2)c(-c2nnn[n-]2)c1 ZINC000737648254 598645065 /nfs/dbraw/zinc/64/50/65/598645065.db2.gz HWKPYGIYVXFGRO-UHFFFAOYSA-N -1 3 366.425 3.543 20 0 FHADHM Fc1ccc(CSc2nccn2Cc2ccccc2)c(-c2nn[n-]n2)c1 ZINC000737648254 598645067 /nfs/dbraw/zinc/64/50/67/598645067.db2.gz HWKPYGIYVXFGRO-UHFFFAOYSA-N -1 3 366.425 3.543 20 0 FHADHM O=C(C[C@@H](c1ccccc1)C(F)(F)F)Oc1ccc(-c2nnn[n-]2)cc1 ZINC000737810627 598646264 /nfs/dbraw/zinc/64/62/64/598646264.db2.gz YSZKTOXOCJPMBW-AWEZNQCLSA-N -1 3 362.311 3.508 20 0 FHADHM O=C(C[C@@H](c1ccccc1)C(F)(F)F)Oc1ccc(-c2nn[n-]n2)cc1 ZINC000737810627 598646266 /nfs/dbraw/zinc/64/62/66/598646266.db2.gz YSZKTOXOCJPMBW-AWEZNQCLSA-N -1 3 362.311 3.508 20 0 FHADHM O=C(NC1CCCCC1)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000738026132 598646677 /nfs/dbraw/zinc/64/66/77/598646677.db2.gz PVDRAMLNIMWLAE-UHFFFAOYSA-N -1 3 363.421 3.722 20 0 FHADHM O=C(NC1CCCCC1)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000738026132 598646678 /nfs/dbraw/zinc/64/66/78/598646678.db2.gz PVDRAMLNIMWLAE-UHFFFAOYSA-N -1 3 363.421 3.722 20 0 FHADHM CC(C)(C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccc(F)cc1 ZINC000735581212 598648343 /nfs/dbraw/zinc/64/83/43/598648343.db2.gz QBTPADIYPIOPGJ-UHFFFAOYSA-N -1 3 359.792 3.576 20 0 FHADHM CC(C)(C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccc(F)cc1 ZINC000735581212 598648345 /nfs/dbraw/zinc/64/83/45/598648345.db2.gz QBTPADIYPIOPGJ-UHFFFAOYSA-N -1 3 359.792 3.576 20 0 FHADHM CCC[C@H](CC)NC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736422546 598656906 /nfs/dbraw/zinc/65/69/06/598656906.db2.gz IVIKLKGVBYESBG-INIZCTEOSA-N -1 3 365.437 3.968 20 0 FHADHM CCC[C@H](CC)NC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736422546 598656908 /nfs/dbraw/zinc/65/69/08/598656908.db2.gz IVIKLKGVBYESBG-INIZCTEOSA-N -1 3 365.437 3.968 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@H]1NC(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000735796956 598659651 /nfs/dbraw/zinc/65/96/51/598659651.db2.gz KSKFAIRFKQLAFE-WMLDXEAASA-N -1 3 373.526 3.680 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@H]1NC(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000735796956 598659653 /nfs/dbraw/zinc/65/96/53/598659653.db2.gz KSKFAIRFKQLAFE-WMLDXEAASA-N -1 3 373.526 3.680 20 0 FHADHM CC1(NC(=O)c2cccc(Oc3ccc(-c4nnn[n-]4)cc3)c2)CCCC1 ZINC000736224057 598667261 /nfs/dbraw/zinc/66/72/61/598667261.db2.gz PUEPDTAQKYHRRD-UHFFFAOYSA-N -1 3 363.421 3.722 20 0 FHADHM CC1(NC(=O)c2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)CCCC1 ZINC000736224057 598667264 /nfs/dbraw/zinc/66/72/64/598667264.db2.gz PUEPDTAQKYHRRD-UHFFFAOYSA-N -1 3 363.421 3.722 20 0 FHADHM Fc1cc(Br)ccc1CNc1ccc(-c2nn[n-]n2)cc1F ZINC000737645421 598680365 /nfs/dbraw/zinc/68/03/65/598680365.db2.gz XLELCAAFYWOFOU-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM CCOc1ccc(OCCSCc2ccc(F)cc2-c2nnn[n-]2)cc1 ZINC000736651606 598694288 /nfs/dbraw/zinc/69/42/88/598694288.db2.gz QAPFLBIFNSBYEF-UHFFFAOYSA-N -1 3 374.441 3.717 20 0 FHADHM CCOc1ccc(OCCSCc2ccc(F)cc2-c2nn[n-]n2)cc1 ZINC000736651606 598694290 /nfs/dbraw/zinc/69/42/90/598694290.db2.gz QAPFLBIFNSBYEF-UHFFFAOYSA-N -1 3 374.441 3.717 20 0 FHADHM Cc1cccc(NC(=O)[C@@H](C)SCc2ccc(F)cc2-c2nnn[n-]2)c1 ZINC000737397840 598696974 /nfs/dbraw/zinc/69/69/74/598696974.db2.gz AMKGUZMDWQVXOJ-GFCCVEGCSA-N -1 3 371.441 3.575 20 0 FHADHM Cc1cccc(NC(=O)[C@@H](C)SCc2ccc(F)cc2-c2nn[n-]n2)c1 ZINC000737397840 598696976 /nfs/dbraw/zinc/69/69/76/598696976.db2.gz AMKGUZMDWQVXOJ-GFCCVEGCSA-N -1 3 371.441 3.575 20 0 FHADHM Fc1ccc(CSCc2noc(-c3cccs3)n2)c(-c2nnn[n-]2)c1 ZINC000737648960 598697039 /nfs/dbraw/zinc/69/70/39/598697039.db2.gz KTEPBQWNZQPTOG-UHFFFAOYSA-N -1 3 374.426 3.551 20 0 FHADHM Fc1ccc(CSCc2noc(-c3cccs3)n2)c(-c2nn[n-]n2)c1 ZINC000737648960 598697040 /nfs/dbraw/zinc/69/70/40/598697040.db2.gz KTEPBQWNZQPTOG-UHFFFAOYSA-N -1 3 374.426 3.551 20 0 FHADHM Fc1ccc(CSCc2cccc3cccnc32)c(-c2nnn[n-]2)c1 ZINC000737650522 598697172 /nfs/dbraw/zinc/69/71/72/598697172.db2.gz SGWXJALMZMKBBF-UHFFFAOYSA-N -1 3 351.410 3.987 20 0 FHADHM Fc1ccc(CSCc2cccc3cccnc32)c(-c2nn[n-]n2)c1 ZINC000737650522 598697173 /nfs/dbraw/zinc/69/71/73/598697173.db2.gz SGWXJALMZMKBBF-UHFFFAOYSA-N -1 3 351.410 3.987 20 0 FHADHM CC(C)[C@H](CC(=O)OCc1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000735706513 598711972 /nfs/dbraw/zinc/71/19/72/598711972.db2.gz CJFKZDGRLFSCHO-SFHVURJKSA-N -1 3 350.422 3.740 20 0 FHADHM CC(C)[C@H](CC(=O)OCc1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000735706513 598711973 /nfs/dbraw/zinc/71/19/73/598711973.db2.gz CJFKZDGRLFSCHO-SFHVURJKSA-N -1 3 350.422 3.740 20 0 FHADHM CC(C)[C@@H](CC(=O)OCc1cc(-c2nnn[n-]2)ccc1F)c1ccccc1 ZINC000735709127 598711994 /nfs/dbraw/zinc/71/19/94/598711994.db2.gz PELGPQVWKCZJNB-QGZVFWFLSA-N -1 3 368.412 3.879 20 0 FHADHM CC(C)[C@@H](CC(=O)OCc1cc(-c2nn[n-]n2)ccc1F)c1ccccc1 ZINC000735709127 598711995 /nfs/dbraw/zinc/71/19/95/598711995.db2.gz PELGPQVWKCZJNB-QGZVFWFLSA-N -1 3 368.412 3.879 20 0 FHADHM C[C@@H]1Cc2ccccc2[C@H]1NC(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736298458 598727834 /nfs/dbraw/zinc/72/78/34/598727834.db2.gz QAQANYJRVJNDCP-HWPZZCPQSA-N -1 3 368.828 3.575 20 0 FHADHM C[C@@H]1Cc2ccccc2[C@H]1NC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736298458 598727835 /nfs/dbraw/zinc/72/78/35/598727835.db2.gz QAQANYJRVJNDCP-HWPZZCPQSA-N -1 3 368.828 3.575 20 0 FHADHM CC(C)N(C(=O)CSc1ccc(-c2nnn[n-]2)cc1)C1CCCCC1 ZINC000735850312 598736783 /nfs/dbraw/zinc/73/67/83/598736783.db2.gz BCGBMVRKMKIKPZ-UHFFFAOYSA-N -1 3 359.499 3.529 20 0 FHADHM CC(C)N(C(=O)CSc1ccc(-c2nn[n-]n2)cc1)C1CCCCC1 ZINC000735850312 598736784 /nfs/dbraw/zinc/73/67/84/598736784.db2.gz BCGBMVRKMKIKPZ-UHFFFAOYSA-N -1 3 359.499 3.529 20 0 FHADHM CC[C@@H](Cc1ccccc1)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736354588 598763088 /nfs/dbraw/zinc/76/30/88/598763088.db2.gz USLWQHWWPNQWIE-ZDUSSCGKSA-N -1 3 355.829 3.728 20 0 FHADHM CC[C@@H](Cc1ccccc1)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736354588 598763090 /nfs/dbraw/zinc/76/30/90/598763090.db2.gz USLWQHWWPNQWIE-ZDUSSCGKSA-N -1 3 355.829 3.728 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1N1CCC[C@@H]1CCc1ccccc1 ZINC000737560753 598772290 /nfs/dbraw/zinc/77/22/90/598772290.db2.gz BVKKLHBUTZJIGW-OAHLLOKOSA-N -1 3 354.845 3.517 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1N1CCC[C@@H]1CCc1ccccc1 ZINC000737560753 598772291 /nfs/dbraw/zinc/77/22/91/598772291.db2.gz BVKKLHBUTZJIGW-OAHLLOKOSA-N -1 3 354.845 3.517 20 0 FHADHM CC[C@@H](CC(=O)OCc1ccc(F)cc1-c1nnn[n-]1)c1ccccc1 ZINC000736336027 598780742 /nfs/dbraw/zinc/78/07/42/598780742.db2.gz YLTPFWJYNQEZCJ-ZDUSSCGKSA-N -1 3 354.385 3.633 20 0 FHADHM CC[C@@H](CC(=O)OCc1ccc(F)cc1-c1nn[n-]n1)c1ccccc1 ZINC000736336027 598780743 /nfs/dbraw/zinc/78/07/43/598780743.db2.gz YLTPFWJYNQEZCJ-ZDUSSCGKSA-N -1 3 354.385 3.633 20 0 FHADHM CC(C)N(Cc1ccccc1F)C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000735874893 598781414 /nfs/dbraw/zinc/78/14/14/598781414.db2.gz VVICRCIZFZCAMZ-UHFFFAOYSA-N -1 3 372.379 3.587 20 0 FHADHM CC(C)N(Cc1ccccc1F)C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000735874893 598781415 /nfs/dbraw/zinc/78/14/15/598781415.db2.gz VVICRCIZFZCAMZ-UHFFFAOYSA-N -1 3 372.379 3.587 20 0 FHADHM O=C(Nc1cccc2[nH]ccc21)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000738184267 598782291 /nfs/dbraw/zinc/78/22/91/598782291.db2.gz NNWRVJJZHLKHMT-UHFFFAOYSA-N -1 3 373.420 3.545 20 0 FHADHM O=C(Nc1cccc2[nH]ccc21)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000738184267 598782293 /nfs/dbraw/zinc/78/22/93/598782293.db2.gz NNWRVJJZHLKHMT-UHFFFAOYSA-N -1 3 373.420 3.545 20 0 FHADHM Cc1cccc2[nH]cc(CC(=O)O[C@H](C)c3cccc(-c4nnn[n-]4)c3)c21 ZINC000737409719 598786682 /nfs/dbraw/zinc/78/66/82/598786682.db2.gz ROOPDWISBYATIM-CYBMUJFWSA-N -1 3 361.405 3.503 20 0 FHADHM Cc1cccc2[nH]cc(CC(=O)O[C@H](C)c3cccc(-c4nn[n-]n4)c3)c21 ZINC000737409719 598786684 /nfs/dbraw/zinc/78/66/84/598786684.db2.gz ROOPDWISBYATIM-CYBMUJFWSA-N -1 3 361.405 3.503 20 0 FHADHM CCN(C(=O)[C@H]1CCc2ccccc21)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736503420 598789930 /nfs/dbraw/zinc/78/99/30/598789930.db2.gz WHZRGVMMKUCJQV-LIRRHRJNSA-N -1 3 361.449 3.506 20 0 FHADHM CCN(C(=O)[C@H]1CCc2ccccc21)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736503420 598789931 /nfs/dbraw/zinc/78/99/31/598789931.db2.gz WHZRGVMMKUCJQV-LIRRHRJNSA-N -1 3 361.449 3.506 20 0 FHADHM Fc1ccc2c(CCNc3ccc(Cl)cc3-c3nnn[n-]3)c[nH]c2c1 ZINC000737665673 598794723 /nfs/dbraw/zinc/79/47/23/598794723.db2.gz IHQHLPVYNXTALG-UHFFFAOYSA-N -1 3 356.792 3.795 20 0 FHADHM Fc1ccc2c(CCNc3ccc(Cl)cc3-c3nn[n-]n3)c[nH]c2c1 ZINC000737665673 598794724 /nfs/dbraw/zinc/79/47/24/598794724.db2.gz IHQHLPVYNXTALG-UHFFFAOYSA-N -1 3 356.792 3.795 20 0 FHADHM Clc1ccc(NCCCCOCc2ccccc2)c(-c2nnn[n-]2)c1 ZINC000737574018 598794748 /nfs/dbraw/zinc/79/47/48/598794748.db2.gz JIJQBHCQFVQKBQ-UHFFFAOYSA-N -1 3 357.845 3.929 20 0 FHADHM Clc1ccc(NCCCCOCc2ccccc2)c(-c2nn[n-]n2)c1 ZINC000737574018 598794749 /nfs/dbraw/zinc/79/47/49/598794749.db2.gz JIJQBHCQFVQKBQ-UHFFFAOYSA-N -1 3 357.845 3.929 20 0 FHADHM FC(F)COc1cccc(CNc2ccc(Cl)cc2-c2nnn[n-]2)c1 ZINC000737638065 598795888 /nfs/dbraw/zinc/79/58/88/598795888.db2.gz CFFPSKYGIGGHNL-UHFFFAOYSA-N -1 3 365.771 3.776 20 0 FHADHM FC(F)COc1cccc(CNc2ccc(Cl)cc2-c2nn[n-]n2)c1 ZINC000737638065 598795889 /nfs/dbraw/zinc/79/58/89/598795889.db2.gz CFFPSKYGIGGHNL-UHFFFAOYSA-N -1 3 365.771 3.776 20 0 FHADHM C[C@H]1C[C@H]1C(=O)N(Cc1ccccc1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000736235642 598807357 /nfs/dbraw/zinc/80/73/57/598807357.db2.gz PCFDATMAQYMXMB-BLLLJJGKSA-N -1 3 367.840 3.709 20 0 FHADHM C[C@H]1C[C@H]1C(=O)N(Cc1ccccc1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000736235642 598807359 /nfs/dbraw/zinc/80/73/59/598807359.db2.gz PCFDATMAQYMXMB-BLLLJJGKSA-N -1 3 367.840 3.709 20 0 FHADHM Cc1cccc(C(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(C)C)c1C ZINC000737384610 598810854 /nfs/dbraw/zinc/81/08/54/598810854.db2.gz LTBJPJNNMZJFLB-UHFFFAOYSA-N -1 3 351.410 3.523 20 0 FHADHM Cc1cccc(C(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(C)C)c1C ZINC000737384610 598810855 /nfs/dbraw/zinc/81/08/55/598810855.db2.gz LTBJPJNNMZJFLB-UHFFFAOYSA-N -1 3 351.410 3.523 20 0 FHADHM CC(C)[C@H](c1ccccc1Cl)N(C)C(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000735733501 598822976 /nfs/dbraw/zinc/82/29/76/598822976.db2.gz BAWAZFPGMYVKPD-QGZVFWFLSA-N -1 3 369.856 3.989 20 0 FHADHM CC(C)[C@H](c1ccccc1Cl)N(C)C(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC000735733501 598822977 /nfs/dbraw/zinc/82/29/77/598822977.db2.gz BAWAZFPGMYVKPD-QGZVFWFLSA-N -1 3 369.856 3.989 20 0 FHADHM C[C@@H](NC(=O)Nc1ncc(C(C)(C)C)s1)c1cccc(-c2nnn[n-]2)c1 ZINC000820380756 599296594 /nfs/dbraw/zinc/29/65/94/599296594.db2.gz ZMRMEFKKVPUTPI-SNVBAGLBSA-N -1 3 371.470 3.503 20 0 FHADHM C[C@@H](NC(=O)Nc1ncc(C(C)(C)C)s1)c1cccc(-c2nn[n-]n2)c1 ZINC000820380756 599296595 /nfs/dbraw/zinc/29/65/95/599296595.db2.gz ZMRMEFKKVPUTPI-SNVBAGLBSA-N -1 3 371.470 3.503 20 0 FHADHM Cc1ccccc1NC(=S)Nc1ccc(OC(C)C)c(-c2nnn[n-]2)c1 ZINC000822361517 607368142 /nfs/dbraw/zinc/36/81/42/607368142.db2.gz DDVFYCJXHZOUIV-UHFFFAOYSA-N -1 3 368.466 3.771 20 0 FHADHM Cc1ccccc1NC(=S)Nc1ccc(OC(C)C)c(-c2nn[n-]n2)c1 ZINC000822361517 607368143 /nfs/dbraw/zinc/36/81/43/607368143.db2.gz DDVFYCJXHZOUIV-UHFFFAOYSA-N -1 3 368.466 3.771 20 0 FHADHM Cc1sc2ncnc(Oc3ccc(-c4nnn[n-]4)cc3Cl)c2c1C ZINC000822562745 599316247 /nfs/dbraw/zinc/31/62/47/599316247.db2.gz DIQNIUYEUCTMKI-UHFFFAOYSA-N -1 3 358.814 3.934 20 0 FHADHM Cc1sc2ncnc(Oc3ccc(-c4nn[n-]n4)cc3Cl)c2c1C ZINC000822562745 599316250 /nfs/dbraw/zinc/31/62/50/599316250.db2.gz DIQNIUYEUCTMKI-UHFFFAOYSA-N -1 3 358.814 3.934 20 0 FHADHM C[C@H](SCCC(=O)Nc1ccc(F)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736187449 599327627 /nfs/dbraw/zinc/32/76/27/599327627.db2.gz AVDDFIWFYYUVAX-LBPRGKRZSA-N -1 3 371.441 3.829 20 0 FHADHM C[C@H](SCCC(=O)Nc1ccc(F)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736187449 599327630 /nfs/dbraw/zinc/32/76/30/599327630.db2.gz AVDDFIWFYYUVAX-LBPRGKRZSA-N -1 3 371.441 3.829 20 0 FHADHM C[C@@H](S[C@@H](C)C(=O)N[C@H]1CCCC[C@@H]1C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736189196 599327993 /nfs/dbraw/zinc/32/79/93/599327993.db2.gz OLMCSQQETPZMJG-LOUJCGABSA-N -1 3 373.526 3.744 20 0 FHADHM C[C@@H](S[C@@H](C)C(=O)N[C@H]1CCCC[C@@H]1C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736189196 599327995 /nfs/dbraw/zinc/32/79/95/599327995.db2.gz OLMCSQQETPZMJG-LOUJCGABSA-N -1 3 373.526 3.744 20 0 FHADHM Fc1ccc(NCc2ccc(OCC(F)(F)F)cc2)cc1-c1nnn[n-]1 ZINC000737656376 599331243 /nfs/dbraw/zinc/33/12/43/599331243.db2.gz LOVBAOWTLNJTAP-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM Fc1ccc(NCc2ccc(OCC(F)(F)F)cc2)cc1-c1nn[n-]n1 ZINC000737656376 599331246 /nfs/dbraw/zinc/33/12/46/599331246.db2.gz LOVBAOWTLNJTAP-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM C[C@H](S[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)C(=O)N(C)C1CCCCC1 ZINC000736188261 599332774 /nfs/dbraw/zinc/33/27/74/599332774.db2.gz JZQYDRSSVWUEJT-KBPBESRZSA-N -1 3 373.526 3.841 20 0 FHADHM C[C@H](S[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)C(=O)N(C)C1CCCCC1 ZINC000736188261 599332777 /nfs/dbraw/zinc/33/27/77/599332777.db2.gz JZQYDRSSVWUEJT-KBPBESRZSA-N -1 3 373.526 3.841 20 0 FHADHM C[C@@H](Sc1cc(-c2nnn[n-]2)ccn1)c1ncc(-c2ccccc2)o1 ZINC000736190060 599339656 /nfs/dbraw/zinc/33/96/56/599339656.db2.gz FNDISWZQXCKFQF-LLVKDONJSA-N -1 3 350.407 3.770 20 0 FHADHM C[C@@H](Sc1cc(-c2nn[n-]n2)ccn1)c1ncc(-c2ccccc2)o1 ZINC000736190060 599339662 /nfs/dbraw/zinc/33/96/62/599339662.db2.gz FNDISWZQXCKFQF-LLVKDONJSA-N -1 3 350.407 3.770 20 0 FHADHM Cc1ccc(NC(=O)[C@@H](C)Sc2ccccc2-c2nnn[n-]2)cc1C ZINC000822242619 599342683 /nfs/dbraw/zinc/34/26/83/599342683.db2.gz RMHBZYIAJWVUGM-CYBMUJFWSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1ccc(NC(=O)[C@@H](C)Sc2ccccc2-c2nn[n-]n2)cc1C ZINC000822242619 599342686 /nfs/dbraw/zinc/34/26/86/599342686.db2.gz RMHBZYIAJWVUGM-CYBMUJFWSA-N -1 3 353.451 3.603 20 0 FHADHM CC(C)CNC(=O)c1cccc(CSc2ccccc2-c2nnn[n-]2)c1 ZINC000820097073 599346324 /nfs/dbraw/zinc/34/63/24/599346324.db2.gz JZMMKCDXKBUAIH-UHFFFAOYSA-N -1 3 367.478 3.545 20 0 FHADHM CC(C)CNC(=O)c1cccc(CSc2ccccc2-c2nn[n-]n2)c1 ZINC000820097073 599346326 /nfs/dbraw/zinc/34/63/26/599346326.db2.gz JZMMKCDXKBUAIH-UHFFFAOYSA-N -1 3 367.478 3.545 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1CNc1ccccc1OCC(C)C ZINC000821736272 607371030 /nfs/dbraw/zinc/37/10/30/607371030.db2.gz IKGDXDLGFXKHPR-UHFFFAOYSA-N -1 3 353.426 3.522 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CNc1ccccc1OCC(C)C ZINC000821736272 607371032 /nfs/dbraw/zinc/37/10/32/607371032.db2.gz IKGDXDLGFXKHPR-UHFFFAOYSA-N -1 3 353.426 3.522 20 0 FHADHM C[C@H](Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccc(-n2cccn2)cc1 ZINC000820456154 599357163 /nfs/dbraw/zinc/35/71/63/599357163.db2.gz QQIWFWXLSAPVRQ-LBPRGKRZSA-N -1 3 365.828 3.879 20 0 FHADHM C[C@H](Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccc(-n2cccn2)cc1 ZINC000820456154 599357165 /nfs/dbraw/zinc/35/71/65/599357165.db2.gz QQIWFWXLSAPVRQ-LBPRGKRZSA-N -1 3 365.828 3.879 20 0 FHADHM Cc1cc2nc(N[C@@H](C)c3cccc(-c4nnn[n-]4)c3)c3ccccc3n2n1 ZINC000822213115 599357621 /nfs/dbraw/zinc/35/76/21/599357621.db2.gz VLGZZPLASBOLIZ-ZDUSSCGKSA-N -1 3 370.420 3.544 20 0 FHADHM Cc1cc2nc(N[C@@H](C)c3cccc(-c4nn[n-]n4)c3)c3ccccc3n2n1 ZINC000822213115 599357623 /nfs/dbraw/zinc/35/76/23/599357623.db2.gz VLGZZPLASBOLIZ-ZDUSSCGKSA-N -1 3 370.420 3.544 20 0 FHADHM CC(C)(C)OC(=O)Nc1ccc(OCc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000819946819 599385564 /nfs/dbraw/zinc/38/55/64/599385564.db2.gz SHLGNUNJASWRSJ-UHFFFAOYSA-N -1 3 367.409 3.793 20 0 FHADHM CC(C)(C)OC(=O)Nc1ccc(OCc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000819946819 599385566 /nfs/dbraw/zinc/38/55/66/599385566.db2.gz SHLGNUNJASWRSJ-UHFFFAOYSA-N -1 3 367.409 3.793 20 0 FHADHM Cc1cc(-c2nn[n-]n2)cc(C)c1OCC(=O)Nc1ccccc1C(C)C ZINC000822130823 599389394 /nfs/dbraw/zinc/38/93/94/599389394.db2.gz YURWJFKLPCFRLV-UHFFFAOYSA-N -1 3 365.437 3.624 20 0 FHADHM C[C@H](NCc1csc(-c2ccccc2)n1)c1cccc(-c2nn[n-]n2)c1 ZINC000820438739 599393715 /nfs/dbraw/zinc/39/37/15/599393715.db2.gz VZCCLDXQMUQYNT-ZDUSSCGKSA-N -1 3 362.462 3.841 20 0 FHADHM c1ccc2c(c1)nc(NCCc1cccc3cccnc31)cc2-c1nnn[n-]1 ZINC000738446288 599403838 /nfs/dbraw/zinc/40/38/38/599403838.db2.gz UFZGHIZZXVFJKF-UHFFFAOYSA-N -1 3 367.416 3.618 20 0 FHADHM c1ccc2c(c1)nc(NCCc1cccc3cccnc31)cc2-c1nn[n-]n1 ZINC000738446288 599403840 /nfs/dbraw/zinc/40/38/40/599403840.db2.gz UFZGHIZZXVFJKF-UHFFFAOYSA-N -1 3 367.416 3.618 20 0 FHADHM CCOc1cccc([C@H](C)Nc2cc(-c3nnn[n-]3)c3ccccc3n2)c1 ZINC000736654030 599420115 /nfs/dbraw/zinc/42/01/15/599420115.db2.gz HNRHWDJZXACNBN-ZDUSSCGKSA-N -1 3 360.421 3.987 20 0 FHADHM CCOc1cccc([C@H](C)Nc2cc(-c3nn[n-]n3)c3ccccc3n2)c1 ZINC000736654030 599420116 /nfs/dbraw/zinc/42/01/16/599420116.db2.gz HNRHWDJZXACNBN-ZDUSSCGKSA-N -1 3 360.421 3.987 20 0 FHADHM Cc1ccc([C@@H](C)NC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1C ZINC000822228902 599426463 /nfs/dbraw/zinc/42/64/63/599426463.db2.gz ILBSAERXMHVNGB-LSDHHAIUSA-N -1 3 364.453 3.605 20 0 FHADHM Cc1ccc([C@@H](C)NC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1C ZINC000822228902 599426467 /nfs/dbraw/zinc/42/64/67/599426467.db2.gz ILBSAERXMHVNGB-LSDHHAIUSA-N -1 3 364.453 3.605 20 0 FHADHM Fc1cccc([C@@H]2CCN(c3cc(-c4nnn[n-]4)c4ccccc4n3)C2)c1 ZINC000737666588 599430834 /nfs/dbraw/zinc/43/08/34/599430834.db2.gz MWQSOWXNWUUNLF-CQSZACIVSA-N -1 3 360.396 3.548 20 0 FHADHM Fc1cccc([C@@H]2CCN(c3cc(-c4nn[n-]n4)c4ccccc4n3)C2)c1 ZINC000737666588 599430836 /nfs/dbraw/zinc/43/08/36/599430836.db2.gz MWQSOWXNWUUNLF-CQSZACIVSA-N -1 3 360.396 3.548 20 0 FHADHM COc1cc(Cl)ccc1CNc1cc(Cl)ccc1-c1nnn[n-]1 ZINC000737047867 599433570 /nfs/dbraw/zinc/43/35/70/599433570.db2.gz SPSYHZKRADCOSF-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM COc1cc(Cl)ccc1CNc1cc(Cl)ccc1-c1nn[n-]n1 ZINC000737047867 599433572 /nfs/dbraw/zinc/43/35/72/599433572.db2.gz SPSYHZKRADCOSF-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM C[C@H](CCC1CCCCC1)NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820243014 599441526 /nfs/dbraw/zinc/44/15/26/599441526.db2.gz SXIMFZDKQAYCEF-HUUCEWRRSA-N -1 3 370.501 3.976 20 0 FHADHM C[C@H](CCC1CCCCC1)NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820243014 599441528 /nfs/dbraw/zinc/44/15/28/599441528.db2.gz SXIMFZDKQAYCEF-HUUCEWRRSA-N -1 3 370.501 3.976 20 0 FHADHM CSCC[C@H](C)Nc1cc(C)c(-c2nnn[n-]2)c2nc3ccccc3n21 ZINC000737184310 599445963 /nfs/dbraw/zinc/44/59/63/599445963.db2.gz XSJJFJYKCJLQMT-LBPRGKRZSA-N -1 3 367.482 3.530 20 0 FHADHM CSCC[C@H](C)Nc1cc(C)c(-c2nn[n-]n2)c2nc3ccccc3n21 ZINC000737184310 599445965 /nfs/dbraw/zinc/44/59/65/599445965.db2.gz XSJJFJYKCJLQMT-LBPRGKRZSA-N -1 3 367.482 3.530 20 0 FHADHM FC(F)C(F)(F)CSc1nc(-c2ccccc2)ccc1-c1nnn[n-]1 ZINC000737639096 599464313 /nfs/dbraw/zinc/46/43/13/599464313.db2.gz NOBDZFZIEOBGGQ-UHFFFAOYSA-N -1 3 369.347 3.921 20 0 FHADHM FC(F)C(F)(F)CSc1nc(-c2ccccc2)ccc1-c1nn[n-]n1 ZINC000737639096 599464315 /nfs/dbraw/zinc/46/43/15/599464315.db2.gz NOBDZFZIEOBGGQ-UHFFFAOYSA-N -1 3 369.347 3.921 20 0 FHADHM CN(Cc1nc2ccccc2s1)c1c(Cl)cccc1-c1nnn[n-]1 ZINC000821617943 599465744 /nfs/dbraw/zinc/46/57/44/599465744.db2.gz JDMKIKJTJDJZAL-UHFFFAOYSA-N -1 3 356.842 3.766 20 0 FHADHM CN(Cc1nc2ccccc2s1)c1c(Cl)cccc1-c1nn[n-]n1 ZINC000821617943 599465745 /nfs/dbraw/zinc/46/57/45/599465745.db2.gz JDMKIKJTJDJZAL-UHFFFAOYSA-N -1 3 356.842 3.766 20 0 FHADHM O=C(CCc1ccc(-c2nnn[n-]2)cc1)N1CCCCC[C@H]1c1ccco1 ZINC000737851814 599468717 /nfs/dbraw/zinc/46/87/17/599468717.db2.gz JVIVAVQFRWZZOK-KRWDZBQOSA-N -1 3 365.437 3.536 20 0 FHADHM O=C(CCc1ccc(-c2nn[n-]n2)cc1)N1CCCCC[C@H]1c1ccco1 ZINC000737851814 599468720 /nfs/dbraw/zinc/46/87/20/599468720.db2.gz JVIVAVQFRWZZOK-KRWDZBQOSA-N -1 3 365.437 3.536 20 0 FHADHM C[C@@H]1C[C@H](c2ccc(F)cc2)CN1c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000736234391 599472512 /nfs/dbraw/zinc/47/25/12/599472512.db2.gz IVEVVFSGAVOIEV-MFKMUULPSA-N -1 3 359.355 3.666 20 0 FHADHM C[C@@H]1C[C@H](c2ccc(F)cc2)CN1c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000736234391 599472515 /nfs/dbraw/zinc/47/25/15/599472515.db2.gz IVEVVFSGAVOIEV-MFKMUULPSA-N -1 3 359.355 3.666 20 0 FHADHM C[C@@H](NC(=O)N1CCC2(CCCCC2)CC1)c1cccc(-c2nnn[n-]2)c1 ZINC000820339497 599477557 /nfs/dbraw/zinc/47/75/57/599477557.db2.gz CZHKOGVRARAZPB-OAHLLOKOSA-N -1 3 368.485 3.684 20 0 FHADHM C[C@@H](NC(=O)N1CCC2(CCCCC2)CC1)c1cccc(-c2nn[n-]n2)c1 ZINC000820339497 599477560 /nfs/dbraw/zinc/47/75/60/599477560.db2.gz CZHKOGVRARAZPB-OAHLLOKOSA-N -1 3 368.485 3.684 20 0 FHADHM COc1ccc(Cl)cc1CNc1c(Cl)cccc1-c1nnn[n-]1 ZINC000821828390 599481112 /nfs/dbraw/zinc/48/11/12/599481112.db2.gz UULMUDQWCQLJSF-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM COc1ccc(Cl)cc1CNc1c(Cl)cccc1-c1nn[n-]n1 ZINC000821828390 599481113 /nfs/dbraw/zinc/48/11/13/599481113.db2.gz UULMUDQWCQLJSF-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM C[C@H](NC(=O)c1cc2c(cccc2F)s1)c1cccc(-c2nnn[n-]2)c1 ZINC000820390086 599501741 /nfs/dbraw/zinc/50/17/41/599501741.db2.gz DWYVAWQEIUDJEJ-JTQLQIEISA-N -1 3 367.409 3.712 20 0 FHADHM C[C@H](NC(=O)c1cc2c(cccc2F)s1)c1cccc(-c2nn[n-]n2)c1 ZINC000820390086 599501744 /nfs/dbraw/zinc/50/17/44/599501744.db2.gz DWYVAWQEIUDJEJ-JTQLQIEISA-N -1 3 367.409 3.712 20 0 FHADHM C[C@H](NC(=O)CCCc1c[nH]c2ccccc12)c1cccc(-c2nnn[n-]2)c1 ZINC000820321047 599503276 /nfs/dbraw/zinc/50/32/76/599503276.db2.gz BRSYXPLATKESJB-AWEZNQCLSA-N -1 3 374.448 3.548 20 0 FHADHM C[C@H](NC(=O)CCCc1c[nH]c2ccccc12)c1cccc(-c2nn[n-]n2)c1 ZINC000820321047 599503278 /nfs/dbraw/zinc/50/32/78/599503278.db2.gz BRSYXPLATKESJB-AWEZNQCLSA-N -1 3 374.448 3.548 20 0 FHADHM C[C@H](NC(=O)C[C@@H]1CCCc2ccccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000820321587 599515855 /nfs/dbraw/zinc/51/58/55/599515855.db2.gz IXFSRHVOWWJODC-YOEHRIQHSA-N -1 3 361.449 3.554 20 0 FHADHM C[C@H](NC(=O)C[C@@H]1CCCc2ccccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000820321587 599515856 /nfs/dbraw/zinc/51/58/56/599515856.db2.gz IXFSRHVOWWJODC-YOEHRIQHSA-N -1 3 361.449 3.554 20 0 FHADHM Cc1ccc(CNc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)cc1F ZINC000737342134 599518518 /nfs/dbraw/zinc/51/85/18/599518518.db2.gz LISSPMNUISHDQM-UHFFFAOYSA-N -1 3 351.307 3.945 20 0 FHADHM CC(C)COC1CCN(c2ccc(-c3nn[n-]n3)cc2C(F)(F)F)CC1 ZINC000735838095 599519278 /nfs/dbraw/zinc/51/92/78/599519278.db2.gz NVUMUHOLLWHRLK-UHFFFAOYSA-N -1 3 369.391 3.527 20 0 FHADHM CC[C@@H](Sc1nc(C)nc(C)c1-c1nnn[n-]1)c1ccc(F)cc1F ZINC000736390584 599520515 /nfs/dbraw/zinc/52/05/15/599520515.db2.gz IEPZXKHYQHSKHM-CYBMUJFWSA-N -1 3 362.409 3.795 20 0 FHADHM C[C@@H](S[C@H]1CCN(c2ccc(-c3nnn[n-]3)cc2)C1=O)c1cccs1 ZINC000736188864 599524212 /nfs/dbraw/zinc/52/42/12/599524212.db2.gz MATZTVWVLOQNQO-ABAIWWIYSA-N -1 3 371.491 3.528 20 0 FHADHM C[C@@H](S[C@H]1CCN(c2ccc(-c3nn[n-]n3)cc2)C1=O)c1cccs1 ZINC000736188864 599524215 /nfs/dbraw/zinc/52/42/15/599524215.db2.gz MATZTVWVLOQNQO-ABAIWWIYSA-N -1 3 371.491 3.528 20 0 FHADHM CS[C@H]1CCC[C@@H](Nc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)C1 ZINC000737180957 599526663 /nfs/dbraw/zinc/52/66/63/599526663.db2.gz URCPSSBPNUZVOO-MNOVXSKESA-N -1 3 357.405 3.972 20 0 FHADHM Fc1cccc([C@H]2CCN(c3c(-c4nnn[n-]4)cnc4ccccc43)C2)c1 ZINC000822786063 599529841 /nfs/dbraw/zinc/52/98/41/599529841.db2.gz BZIPQCYTHBQCPN-AWEZNQCLSA-N -1 3 360.396 3.548 20 0 FHADHM Fc1cccc([C@H]2CCN(c3c(-c4nn[n-]n4)cnc4ccccc43)C2)c1 ZINC000822786063 599529843 /nfs/dbraw/zinc/52/98/43/599529843.db2.gz BZIPQCYTHBQCPN-AWEZNQCLSA-N -1 3 360.396 3.548 20 0 FHADHM Cc1cc(C)c(C=CC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1C ZINC000822194159 599531995 /nfs/dbraw/zinc/53/19/95/599531995.db2.gz LFJKRXYMTLVCAK-FDMDGMSGSA-N -1 3 361.449 3.683 20 0 FHADHM Cc1cc(C)c(C=CC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1C ZINC000822194159 599531998 /nfs/dbraw/zinc/53/19/98/599531998.db2.gz LFJKRXYMTLVCAK-FDMDGMSGSA-N -1 3 361.449 3.683 20 0 FHADHM CC[C@H](C)[C@@H](C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000820860864 599532512 /nfs/dbraw/zinc/53/25/12/599532512.db2.gz KVQSAUYFIIDDMR-YZVOILCLSA-N -1 3 363.465 3.874 20 0 FHADHM CC[C@H](C)[C@@H](C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000820860864 599532514 /nfs/dbraw/zinc/53/25/14/599532514.db2.gz KVQSAUYFIIDDMR-YZVOILCLSA-N -1 3 363.465 3.874 20 0 FHADHM CC(C)c1ccc([C@@H](C)CC(=O)NCc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000523151836 599541432 /nfs/dbraw/zinc/54/14/32/599541432.db2.gz BSBIVYWAPPRWIH-HNNXBMFYSA-N -1 3 363.465 3.800 20 0 FHADHM CC(C)c1ccc([C@@H](C)CC(=O)NCc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000523151836 599541433 /nfs/dbraw/zinc/54/14/33/599541433.db2.gz BSBIVYWAPPRWIH-HNNXBMFYSA-N -1 3 363.465 3.800 20 0 FHADHM CC[C@@H](CC(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1)c1ccc(C)cc1 ZINC000736331419 599541917 /nfs/dbraw/zinc/54/19/17/599541917.db2.gz JSTZUNAHVUHPHM-KRWDZBQOSA-N -1 3 363.465 3.717 20 0 FHADHM CC[C@@H](CC(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1)c1ccc(C)cc1 ZINC000736331419 599541921 /nfs/dbraw/zinc/54/19/21/599541921.db2.gz JSTZUNAHVUHPHM-KRWDZBQOSA-N -1 3 363.465 3.717 20 0 FHADHM CC[C@@H](CC(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1)c1ccc(C)cc1 ZINC000736331781 599542478 /nfs/dbraw/zinc/54/24/78/599542478.db2.gz KQPIAJCWCFIAMH-KRWDZBQOSA-N -1 3 363.465 3.717 20 0 FHADHM CC[C@@H](CC(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1)c1ccc(C)cc1 ZINC000736331781 599542479 /nfs/dbraw/zinc/54/24/79/599542479.db2.gz KQPIAJCWCFIAMH-KRWDZBQOSA-N -1 3 363.465 3.717 20 0 FHADHM CC[C@H](CC(=O)NCc1ccc(-c2nnn[n-]2)cc1F)c1ccc(C)cc1 ZINC000736329891 599545690 /nfs/dbraw/zinc/54/56/90/599545690.db2.gz AAJNFFQSZSSADW-CQSZACIVSA-N -1 3 367.428 3.514 20 0 FHADHM CC[C@H](CC(=O)NCc1ccc(-c2nn[n-]n2)cc1F)c1ccc(C)cc1 ZINC000736329891 599545691 /nfs/dbraw/zinc/54/56/91/599545691.db2.gz AAJNFFQSZSSADW-CQSZACIVSA-N -1 3 367.428 3.514 20 0 FHADHM CC[C@@H](CC(=O)NCc1ccc(-c2nnn[n-]2)cc1F)c1ccc(C)cc1 ZINC000736329890 599545983 /nfs/dbraw/zinc/54/59/83/599545983.db2.gz AAJNFFQSZSSADW-AWEZNQCLSA-N -1 3 367.428 3.514 20 0 FHADHM CC[C@@H](CC(=O)NCc1ccc(-c2nn[n-]n2)cc1F)c1ccc(C)cc1 ZINC000736329890 599545985 /nfs/dbraw/zinc/54/59/85/599545985.db2.gz AAJNFFQSZSSADW-AWEZNQCLSA-N -1 3 367.428 3.514 20 0 FHADHM Cc1ccc(NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)CC(C)C)s1 ZINC000822249008 599551584 /nfs/dbraw/zinc/55/15/84/599551584.db2.gz YBRMNYMAFNWLQC-UHFFFAOYSA-N -1 3 370.482 3.927 20 0 FHADHM Cc1ccc(NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)CC(C)C)s1 ZINC000822249008 599551585 /nfs/dbraw/zinc/55/15/85/599551585.db2.gz YBRMNYMAFNWLQC-UHFFFAOYSA-N -1 3 370.482 3.927 20 0 FHADHM Cc1ccc([C@@H]2CCCCN2C(=O)Nc2cccc(-c3nnn[n-]3)c2)o1 ZINC000822233772 599551691 /nfs/dbraw/zinc/55/16/91/599551691.db2.gz UUJYVKCGBKYWBM-HNNXBMFYSA-N -1 3 352.398 3.527 20 0 FHADHM Cc1ccc([C@@H]2CCCCN2C(=O)Nc2cccc(-c3nn[n-]n3)c2)o1 ZINC000822233772 599551692 /nfs/dbraw/zinc/55/16/92/599551692.db2.gz UUJYVKCGBKYWBM-HNNXBMFYSA-N -1 3 352.398 3.527 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)N1CCC2(C1)CCCCC2 ZINC000819976040 599552546 /nfs/dbraw/zinc/55/25/46/599552546.db2.gz IRLDNIVWFQIPOC-UHFFFAOYSA-N -1 3 371.489 3.611 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)N1CCC2(C1)CCCCC2 ZINC000819976040 599552547 /nfs/dbraw/zinc/55/25/47/599552547.db2.gz IRLDNIVWFQIPOC-UHFFFAOYSA-N -1 3 371.489 3.611 20 0 FHADHM CCS[C@@H]1CCCCN(c2c(-c3nnn[n-]3)cnc3c(C)cccc32)C1 ZINC000821455025 599553350 /nfs/dbraw/zinc/55/33/50/599553350.db2.gz IKICOEATLFIKMP-CQSZACIVSA-N -1 3 368.510 3.835 20 0 FHADHM CCS[C@@H]1CCCCN(c2c(-c3nn[n-]n3)cnc3c(C)cccc32)C1 ZINC000821455025 599553352 /nfs/dbraw/zinc/55/33/52/599553352.db2.gz IKICOEATLFIKMP-CQSZACIVSA-N -1 3 368.510 3.835 20 0 FHADHM Fc1ccc(F)c2c1ncc(-c1nnn[n-]1)c2N1CCC[C@@H]1c1ccco1 ZINC000822773963 599560846 /nfs/dbraw/zinc/56/08/46/599560846.db2.gz CNYLTHRBMMHAIC-CYBMUJFWSA-N -1 3 368.347 3.628 20 0 FHADHM Fc1ccc(F)c2c1ncc(-c1nn[n-]n1)c2N1CCC[C@@H]1c1ccco1 ZINC000822773963 599560847 /nfs/dbraw/zinc/56/08/47/599560847.db2.gz CNYLTHRBMMHAIC-CYBMUJFWSA-N -1 3 368.347 3.628 20 0 FHADHM CCN(CC(C)C)C(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736514047 599564730 /nfs/dbraw/zinc/56/47/30/599564730.db2.gz UJJGTARFOFJMQQ-UHFFFAOYSA-N -1 3 364.453 3.728 20 0 FHADHM c1oc(-c2ccccc2)nc1CNc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000823766378 599586516 /nfs/dbraw/zinc/58/65/16/599586516.db2.gz BQNZNTJXKYYOBH-UHFFFAOYSA-N -1 3 369.388 3.682 20 0 FHADHM c1oc(-c2ccccc2)nc1CNc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000823766378 599586518 /nfs/dbraw/zinc/58/65/18/599586518.db2.gz BQNZNTJXKYYOBH-UHFFFAOYSA-N -1 3 369.388 3.682 20 0 FHADHM CS[C@H]1CCCCN(c2ccc(-c3nn[n-]n3)cc2C(F)(F)F)C1 ZINC000821956313 607385842 /nfs/dbraw/zinc/38/58/42/607385842.db2.gz LZFSQTLNNZZQCA-NSHDSACASA-N -1 3 357.405 3.607 20 0 FHADHM O=C(CC/C=C/c1ccccc1)OCc1cc(-c2nnn[n-]2)ccc1F ZINC000737824228 599606016 /nfs/dbraw/zinc/60/60/16/599606016.db2.gz GBSCALSKDWASCW-XBXARRHUSA-N -1 3 352.369 3.543 20 0 FHADHM O=C(CC/C=C/c1ccccc1)OCc1cc(-c2nn[n-]n2)ccc1F ZINC000737824228 599606017 /nfs/dbraw/zinc/60/60/17/599606017.db2.gz GBSCALSKDWASCW-XBXARRHUSA-N -1 3 352.369 3.543 20 0 FHADHM Cc1ccc([C@H](C)C(=O)Nc2sc3c(c2-c2nnn[n-]2)CC[C@@H](C)C3)o1 ZINC000822227636 599628694 /nfs/dbraw/zinc/62/86/94/599628694.db2.gz QDWHPRTVMDPHOJ-KOLCDFICSA-N -1 3 371.466 3.697 20 0 FHADHM Cc1ccc([C@H](C)C(=O)Nc2sc3c(c2-c2nn[n-]n2)CC[C@@H](C)C3)o1 ZINC000822227636 599628695 /nfs/dbraw/zinc/62/86/95/599628695.db2.gz QDWHPRTVMDPHOJ-KOLCDFICSA-N -1 3 371.466 3.697 20 0 FHADHM C[C@@H](CCc1ccccc1F)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820252420 599629404 /nfs/dbraw/zinc/62/94/04/599629404.db2.gz AIJKSSHSBCCUKK-NSHDSACASA-N -1 3 373.819 3.867 20 0 FHADHM C[C@@H](CCc1ccccc1F)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820252420 599629405 /nfs/dbraw/zinc/62/94/05/599629405.db2.gz AIJKSSHSBCCUKK-NSHDSACASA-N -1 3 373.819 3.867 20 0 FHADHM C[C@H]1CCC[C@H](C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)C1 ZINC000820691859 599632820 /nfs/dbraw/zinc/63/28/20/599632820.db2.gz ZVBIVUNECWCRQP-UWVGGRQHSA-N -1 3 353.348 3.650 20 0 FHADHM C[C@H]1CCC[C@H](C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)C1 ZINC000820691859 599632821 /nfs/dbraw/zinc/63/28/21/599632821.db2.gz ZVBIVUNECWCRQP-UWVGGRQHSA-N -1 3 353.348 3.650 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)s1 ZINC000822226514 599632871 /nfs/dbraw/zinc/63/28/71/599632871.db2.gz WALJSBCJJMOQBB-UHFFFAOYSA-N -1 3 353.329 3.508 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)s1 ZINC000822226514 599632872 /nfs/dbraw/zinc/63/28/72/599632872.db2.gz WALJSBCJJMOQBB-UHFFFAOYSA-N -1 3 353.329 3.508 20 0 FHADHM Cc1c2c(sc1NC(=O)C=Cc1ccccc1-c1nnn[n-]1)CCCC2 ZINC000822067254 599651379 /nfs/dbraw/zinc/65/13/79/599651379.db2.gz IWNKIHIVUDHFNI-KHPPLWFESA-N -1 3 365.462 3.767 20 0 FHADHM Cc1c2c(sc1NC(=O)C=Cc1ccccc1-c1nn[n-]n1)CCCC2 ZINC000822067254 599651380 /nfs/dbraw/zinc/65/13/80/599651380.db2.gz IWNKIHIVUDHFNI-KHPPLWFESA-N -1 3 365.462 3.767 20 0 FHADHM COc1ccc(C2CCN(c3ccc(-c4nnn[n-]4)c(Cl)c3)CC2)cc1 ZINC000821787115 599685879 /nfs/dbraw/zinc/68/58/79/599685879.db2.gz OJDZTWLRHNAUCW-UHFFFAOYSA-N -1 3 369.856 3.913 20 0 FHADHM COc1ccc(C2CCN(c3ccc(-c4nn[n-]n4)c(Cl)c3)CC2)cc1 ZINC000821787115 599685880 /nfs/dbraw/zinc/68/58/80/599685880.db2.gz OJDZTWLRHNAUCW-UHFFFAOYSA-N -1 3 369.856 3.913 20 0 FHADHM CCC1(CNc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)CCOCC1 ZINC000820962303 599689035 /nfs/dbraw/zinc/68/90/35/599689035.db2.gz NWCMBSBMECKPGP-UHFFFAOYSA-N -1 3 355.364 3.504 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@@H](C)CCOc2ccccc2)s1 ZINC000821465947 599689648 /nfs/dbraw/zinc/68/96/48/599689648.db2.gz RRMXKYHOJSMAFF-LBPRGKRZSA-N -1 3 371.466 3.534 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@@H](C)CCOc2ccccc2)s1 ZINC000821465947 599689649 /nfs/dbraw/zinc/68/96/49/599689649.db2.gz RRMXKYHOJSMAFF-LBPRGKRZSA-N -1 3 371.466 3.534 20 0 FHADHM CCC(C)(C)CC(=O)Nc1nc(-c2ccc(-c3nnn[n-]3)cc2)cs1 ZINC000820847521 599689766 /nfs/dbraw/zinc/68/97/66/599689766.db2.gz FJQSPHYNOOAZEK-UHFFFAOYSA-N -1 3 356.455 3.755 20 0 FHADHM CCC(C)(C)CC(=O)Nc1nc(-c2ccc(-c3nn[n-]n3)cc2)cs1 ZINC000820847521 599689767 /nfs/dbraw/zinc/68/97/67/599689767.db2.gz FJQSPHYNOOAZEK-UHFFFAOYSA-N -1 3 356.455 3.755 20 0 FHADHM CC[C@@H]1C[C@@H](C)CN1C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000820966923 599693341 /nfs/dbraw/zinc/69/33/41/599693341.db2.gz IUVPKFPXSHSEKL-MWLCHTKSSA-N -1 3 368.363 3.538 20 0 FHADHM CC[C@@H]1C[C@@H](C)CN1C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000820966923 599693342 /nfs/dbraw/zinc/69/33/42/599693342.db2.gz IUVPKFPXSHSEKL-MWLCHTKSSA-N -1 3 368.363 3.538 20 0 FHADHM Cc1c(F)cccc1NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000822034805 599693759 /nfs/dbraw/zinc/69/37/59/599693759.db2.gz LQZZHGHXZBFIFZ-UHFFFAOYSA-N -1 3 366.400 3.511 20 0 FHADHM Cc1c(F)cccc1NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000822034805 599693760 /nfs/dbraw/zinc/69/37/60/599693760.db2.gz LQZZHGHXZBFIFZ-UHFFFAOYSA-N -1 3 366.400 3.511 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)c1cc(-c2ccccc2)ns1 ZINC000822220167 599698549 /nfs/dbraw/zinc/69/85/49/599698549.db2.gz GNSVFCDIUOYGJZ-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cc(-c2ccccc2)ns1 ZINC000822220167 599698550 /nfs/dbraw/zinc/69/85/50/599698550.db2.gz GNSVFCDIUOYGJZ-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM COc1ccc(C(=O)C2CCN([C@@H](C(=O)[O-])c3ccc(F)cc3)CC2)cc1 ZINC000579603229 599709205 /nfs/dbraw/zinc/70/92/05/599709205.db2.gz MDJZUCBTHVRYGR-LJQANCHMSA-N -1 3 371.408 3.555 20 0 FHADHM CC(C)c1ccc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCC3)cn1 ZINC000820192215 607392167 /nfs/dbraw/zinc/39/21/67/607392167.db2.gz GNAYBMHKDDNICW-UHFFFAOYSA-N -1 3 368.466 3.578 20 0 FHADHM CC(C)c1ccc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCC3)cn1 ZINC000820192215 607392169 /nfs/dbraw/zinc/39/21/69/607392169.db2.gz GNAYBMHKDDNICW-UHFFFAOYSA-N -1 3 368.466 3.578 20 0 FHADHM O=C([O-])c1cccc(NC(=O)CN[C@@H](c2ccc(F)cc2)C2CCC2)c1 ZINC000739306645 599793318 /nfs/dbraw/zinc/79/33/18/599793318.db2.gz GVHSVMIREIJNOU-LJQANCHMSA-N -1 3 356.397 3.593 20 0 FHADHM CC(C)Oc1ccc(NC(=O)c2ccc(Cl)cc2)cc1-c1nnn[n-]1 ZINC000820168835 607399243 /nfs/dbraw/zinc/39/92/43/607399243.db2.gz BXJQXICUBNUKBW-UHFFFAOYSA-N -1 3 357.801 3.560 20 0 FHADHM CC(C)Oc1ccc(NC(=O)c2ccc(Cl)cc2)cc1-c1nn[n-]n1 ZINC000820168835 607399245 /nfs/dbraw/zinc/39/92/45/607399245.db2.gz BXJQXICUBNUKBW-UHFFFAOYSA-N -1 3 357.801 3.560 20 0 FHADHM CSc1ccc(C(=O)Nc2ccc(OC(C)C)c(-c3nnn[n-]3)c2)cc1 ZINC000821979779 607399376 /nfs/dbraw/zinc/39/93/76/607399376.db2.gz WSCZOAWHPZSPRI-UHFFFAOYSA-N -1 3 369.450 3.628 20 0 FHADHM CSc1ccc(C(=O)Nc2ccc(OC(C)C)c(-c3nn[n-]n3)c2)cc1 ZINC000821979779 607399378 /nfs/dbraw/zinc/39/93/78/607399378.db2.gz WSCZOAWHPZSPRI-UHFFFAOYSA-N -1 3 369.450 3.628 20 0 FHADHM COc1ccc([C@H](NCc2c(C)cc(C)c(C(C)=O)c2C)C(=O)[O-])cc1 ZINC000737971557 599862817 /nfs/dbraw/zinc/86/28/17/599862817.db2.gz LEERXZPMPMDQFR-FQEVSTJZSA-N -1 3 355.434 3.739 20 0 FHADHM O=C([O-])CN(Cc1ccc(Br)cc1)Cc1ccc(F)c(F)c1 ZINC000739793361 599866233 /nfs/dbraw/zinc/86/62/33/599866233.db2.gz GJADVCXOWSUHGY-UHFFFAOYSA-N -1 3 370.193 3.814 20 0 FHADHM Cc1ccc(CCCC(=O)OCc2ccc(-c3nnn[n-]3)cc2C)s1 ZINC000826287300 607410349 /nfs/dbraw/zinc/41/03/49/607410349.db2.gz JWCHXOJIVOIHDM-UHFFFAOYSA-N -1 3 356.451 3.611 20 0 FHADHM Cc1ccc(CCCC(=O)OCc2ccc(-c3nn[n-]n3)cc2C)s1 ZINC000826287300 607410350 /nfs/dbraw/zinc/41/03/50/607410350.db2.gz JWCHXOJIVOIHDM-UHFFFAOYSA-N -1 3 356.451 3.611 20 0 FHADHM COc1cc2c(cc1CN[C@H](CCC(=O)[O-])c1ccccc1)O[C@H](C)C2 ZINC000580292795 599992781 /nfs/dbraw/zinc/99/27/81/599992781.db2.gz MJSISJQIABVUAQ-RDTXWAMCSA-N -1 3 355.434 3.714 20 0 FHADHM C[C@@H](NCc1ccc(-c2ccc(C(=O)[O-])cc2)o1)[C@H](O)c1ccccc1 ZINC000020875544 600037937 /nfs/dbraw/zinc/03/79/37/600037937.db2.gz GTZDQPHUJRUZKY-VLIAUNLRSA-N -1 3 351.402 3.857 20 0 FHADHM O=C([O-])c1ccccc1NC(=O)CN[C@H](c1ccc(Cl)cc1)C1CC1 ZINC000739306621 600049080 /nfs/dbraw/zinc/04/90/80/600049080.db2.gz GOQXKSWUEDHEKI-SFHVURJKSA-N -1 3 358.825 3.718 20 0 FHADHM O=C([O-])c1cc(F)ccc1CN1CCC(OCCc2ccccc2)CC1 ZINC000572848435 600089880 /nfs/dbraw/zinc/08/98/80/600089880.db2.gz KRJPVIXYQPRHQL-UHFFFAOYSA-N -1 3 357.425 3.748 20 0 FHADHM CC[C@H](CC(=O)NC1(c2cccc(-c3nnn[n-]3)c2)CC1)c1ccccc1 ZINC000825082090 607419193 /nfs/dbraw/zinc/41/91/93/607419193.db2.gz QEAAESONJPKCRX-OAHLLOKOSA-N -1 3 361.449 3.556 20 0 FHADHM CC[C@H](CC(=O)NC1(c2cccc(-c3nn[n-]n3)c2)CC1)c1ccccc1 ZINC000825082090 607419195 /nfs/dbraw/zinc/41/91/95/607419195.db2.gz QEAAESONJPKCRX-OAHLLOKOSA-N -1 3 361.449 3.556 20 0 FHADHM O=C([O-])c1ccc(CN2CCC(c3nc(-c4ccccc4)no3)CC2)cc1 ZINC000653365579 600104556 /nfs/dbraw/zinc/10/45/56/600104556.db2.gz FFMFOXATKKIUTN-UHFFFAOYSA-N -1 3 363.417 3.814 20 0 FHADHM CN(Cc1nc2ccccc2c(-c2ccccc2)c1C(=O)[O-])[C@@H]1CCOC1 ZINC000579719686 600111285 /nfs/dbraw/zinc/11/12/85/600111285.db2.gz HEZNBESOKSAVKU-MRXNPFEDSA-N -1 3 362.429 3.821 20 0 FHADHM CC(C)C[C@H]1CCN(C(=O)Nc2ccc(OC(C)C)c(-c3nnn[n-]3)c2)C1 ZINC000820068149 607423781 /nfs/dbraw/zinc/42/37/81/607423781.db2.gz OIHUKDHDKPOJHG-CQSZACIVSA-N -1 3 372.473 3.554 20 0 FHADHM CC(C)C[C@H]1CCN(C(=O)Nc2ccc(OC(C)C)c(-c3nn[n-]n3)c2)C1 ZINC000820068149 607423783 /nfs/dbraw/zinc/42/37/83/607423783.db2.gz OIHUKDHDKPOJHG-CQSZACIVSA-N -1 3 372.473 3.554 20 0 FHADHM CCC1(C)CCN(C(=O)Nc2ccc(OC(C)C)c(-c3nnn[n-]3)c2)CC1 ZINC000820950545 607427850 /nfs/dbraw/zinc/42/78/50/607427850.db2.gz PAQMGBGTNIAAQV-UHFFFAOYSA-N -1 3 372.473 3.698 20 0 FHADHM CCC1(C)CCN(C(=O)Nc2ccc(OC(C)C)c(-c3nn[n-]n3)c2)CC1 ZINC000820950545 607427851 /nfs/dbraw/zinc/42/78/51/607427851.db2.gz PAQMGBGTNIAAQV-UHFFFAOYSA-N -1 3 372.473 3.698 20 0 FHADHM Cc1ccsc1CCCC(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2 ZINC000826315990 607428572 /nfs/dbraw/zinc/42/85/72/607428572.db2.gz ABPUFTWDGOPTKB-UHFFFAOYSA-N -1 3 373.507 3.748 20 0 FHADHM Cc1ccsc1CCCC(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2 ZINC000826315990 607428573 /nfs/dbraw/zinc/42/85/73/607428573.db2.gz ABPUFTWDGOPTKB-UHFFFAOYSA-N -1 3 373.507 3.748 20 0 FHADHM CC[C@]1(C)CCCN(C(=O)Nc2ccc(OC(C)C)c(-c3nnn[n-]3)c2)C1 ZINC000820950760 607433089 /nfs/dbraw/zinc/43/30/89/607433089.db2.gz SAPCHAFQAJXQNQ-LJQANCHMSA-N -1 3 372.473 3.698 20 0 FHADHM CC[C@]1(C)CCCN(C(=O)Nc2ccc(OC(C)C)c(-c3nn[n-]n3)c2)C1 ZINC000820950760 607433090 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O=C(Nc1ccccc1-c1nn[n-]n1)c1ccc(Cl)c(C(F)(F)F)c1 ZINC000826456934 607571886 /nfs/dbraw/zinc/57/18/86/607571886.db2.gz FKPHZOWYRLEYIL-UHFFFAOYSA-N -1 3 367.718 3.791 20 0 FHADHM Cc1ccc([C@H](CNC(=O)Nc2ccc(NC(=O)[O-])cc2)N(C)C)cc1 ZINC000740116189 602600890 /nfs/dbraw/zinc/60/08/90/602600890.db2.gz AOZBGEPSUIHKPO-KRWDZBQOSA-N -1 3 356.426 3.509 20 0 FHADHM Cc1ccc([C@@H](CNC(=O)Nc2ccc(NC(=O)[O-])cc2)N(C)C)cc1 ZINC000740116192 602601026 /nfs/dbraw/zinc/60/10/26/602601026.db2.gz AOZBGEPSUIHKPO-QGZVFWFLSA-N -1 3 356.426 3.509 20 0 FHADHM O=C([O-])N(CCCNCc1c(F)cccc1Cl)Cc1cccnc1 ZINC000740488417 602648869 /nfs/dbraw/zinc/64/88/69/602648869.db2.gz CLPPEADSQNNHMD-UHFFFAOYSA-N -1 3 351.809 3.534 20 0 FHADHM CC[C@@H](SC)C(=O)N(Cc1ccccc1)c1ccccc1-c1nnn[n-]1 ZINC000825159316 607578133 /nfs/dbraw/zinc/57/81/33/607578133.db2.gz NJFIMXXEPGETFL-QGZVFWFLSA-N -1 3 367.478 3.542 20 0 FHADHM CC[C@@H](SC)C(=O)N(Cc1ccccc1)c1ccccc1-c1nn[n-]n1 ZINC000825159316 607578136 /nfs/dbraw/zinc/57/81/36/607578136.db2.gz 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CC[C@@H](NC(=O)c1ccc(-c2nnn[n-]2)cc1C)c1cccc(Cl)c1 ZINC000825132643 607659862 /nfs/dbraw/zinc/65/98/62/607659862.db2.gz CCIDYKRUIZYDGY-MRXNPFEDSA-N -1 3 355.829 3.710 20 0 FHADHM CC[C@@H](NC(=O)c1ccc(-c2nn[n-]n2)cc1C)c1cccc(Cl)c1 ZINC000825132643 607659863 /nfs/dbraw/zinc/65/98/63/607659863.db2.gz CCIDYKRUIZYDGY-MRXNPFEDSA-N -1 3 355.829 3.710 20 0 FHADHM CN(C[C@@H]1CCCN1Cc1ccc(C(=O)Nc2ccccc2)cc1)C(=O)[O-] ZINC000828230134 604102752 /nfs/dbraw/zinc/10/27/52/604102752.db2.gz MSRVSVUGTWDOJK-IBGZPJMESA-N -1 3 367.449 3.513 20 0 FHADHM Cc1[nH]c2c(cc(C)cc2CNC(=O)c2ccc(-c3nnn[n-]3)cc2C)c1C ZINC000826266857 607672002 /nfs/dbraw/zinc/67/20/02/607672002.db2.gz FIVJQAVWNDFTSO-UHFFFAOYSA-N -1 3 374.448 3.512 20 0 FHADHM Cc1[nH]c2c(cc(C)cc2CNC(=O)c2ccc(-c3nn[n-]n3)cc2C)c1C ZINC000826266857 607672004 /nfs/dbraw/zinc/67/20/04/607672004.db2.gz FIVJQAVWNDFTSO-UHFFFAOYSA-N -1 3 374.448 3.512 20 0 FHADHM CCN(C(=O)c1ccc(-c2nnn[n-]2)cc1C)c1ccc2ccccc2c1 ZINC000825379917 607676571 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Cc1ccc([C@@H](CNC(=O)Nc2cc(C(=O)[O-])cs2)N2CCCC2)cc1 ZINC000832923184 604498130 /nfs/dbraw/zinc/49/81/30/604498130.db2.gz JZYSQBZJDPKJIZ-MRXNPFEDSA-N -1 3 373.478 3.713 20 0 FHADHM COc1ccc([C@H]2CCCN2Cc2ccc(O[C@H](C)C(=O)[O-])cc2)cc1 ZINC000833731678 604515801 /nfs/dbraw/zinc/51/58/01/604515801.db2.gz BVEDUSOZCKJNIZ-FOIQADDNSA-N -1 3 355.434 3.884 20 0 FHADHM O=C([O-])N1CCC[C@H](CN[C@H](c2cccc(Cl)c2)c2ccccn2)C1 ZINC000831980105 604527114 /nfs/dbraw/zinc/52/71/14/604527114.db2.gz CSVZCJQMELLLHC-RDTXWAMCSA-N -1 3 359.857 3.804 20 0 FHADHM C[C@@H](c1ccc2ccccc2c1)N(C(=O)c1ccc(-c2nnn[n-]2)[nH]1)C1CC1 ZINC000824762545 607704581 /nfs/dbraw/zinc/70/45/81/607704581.db2.gz HDIYGDXRCKFNNM-ZDUSSCGKSA-N -1 3 372.432 3.714 20 0 FHADHM C[C@@H](c1ccc2ccccc2c1)N(C(=O)c1ccc(-c2nn[n-]n2)[nH]1)C1CC1 ZINC000824762545 607704583 /nfs/dbraw/zinc/70/45/83/607704583.db2.gz HDIYGDXRCKFNNM-ZDUSSCGKSA-N -1 3 372.432 3.714 20 0 FHADHM CC[C@@H](Cc1ccccc1)N(CC)C(=O)c1ccc(-c2nnn[n-]2)cc1C ZINC000825127841 607705522 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CC(C)(C(=O)[O-])[C@@H]1CCCN(Cc2cc(F)cc(Br)c2)C1 ZINC000135024079 604941405 /nfs/dbraw/zinc/94/14/05/604941405.db2.gz IZXZBPBRSVUNOF-GFCCVEGCSA-N -1 3 358.251 3.911 20 0 FHADHM CC(C)(C(=O)[O-])[C@@H]1CCCN(Cc2coc(-c3ccc(F)c(F)c3)n2)C1 ZINC000833419598 604947617 /nfs/dbraw/zinc/94/76/17/604947617.db2.gz HENRSUQCKZOWQP-CYBMUJFWSA-N -1 3 364.392 3.943 20 0 FHADHM C[C@@H](C(=O)Nc1ccc2ccccc2c1)N1CCC[C@H](C(C)(C)C(=O)[O-])C1 ZINC000833409541 604949356 /nfs/dbraw/zinc/94/93/56/604949356.db2.gz OILOQLJEQLMOTP-YJBOKZPZSA-N -1 3 368.477 3.990 20 0 FHADHM CC(C)(C(=O)[O-])[C@H]1CCCN(CCOc2ccccc2Br)C1 ZINC000652498723 604952804 /nfs/dbraw/zinc/95/28/04/604952804.db2.gz QYKWVZFDAAUUTB-ZDUSSCGKSA-N -1 3 370.287 3.651 20 0 FHADHM C[C@H](N[C@@H](C(=O)[O-])c1cccnc1)c1ccc(OCc2cccnc2)cc1 ZINC000827716876 604990342 /nfs/dbraw/zinc/99/03/42/604990342.db2.gz BRVFMMABLFAICU-MGPUTAFESA-N -1 3 363.417 3.532 20 0 FHADHM C[C@H](Oc1ccc(CN[C@@H]2CCCc3c2cnn3C(C)(C)C)cc1)C(=O)[O-] ZINC000833540887 605091215 /nfs/dbraw/zinc/09/12/15/605091215.db2.gz NUKLZUPRBPJDLZ-KBXCAEBGSA-N -1 3 371.481 3.657 20 0 FHADHM Cc1cc(Oc2ccccc2)ccc1NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC000826271670 607734199 /nfs/dbraw/zinc/73/41/99/607734199.db2.gz BTJMSGXBMBTGDX-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM Cc1cc(Oc2ccccc2)ccc1NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC000826271670 607734200 /nfs/dbraw/zinc/73/42/00/607734200.db2.gz BTJMSGXBMBTGDX-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM CC(C)(C)OC(=O)c1cccc(CN[C@@H](C(=O)[O-])c2ccc(F)cc2)c1 ZINC000833444049 605102957 /nfs/dbraw/zinc/10/29/57/605102957.db2.gz KAUAQSXJNVXWQX-QGZVFWFLSA-N -1 3 359.397 3.697 20 0 FHADHM COc1ccc([C@H](C)NCc2ccc([C@@H](C)NC(=O)[O-])cc2)cc1OC ZINC000829301302 605119736 /nfs/dbraw/zinc/11/97/36/605119736.db2.gz BNEDLAQMJZSUOK-UONOGXRCSA-N -1 3 358.438 3.883 20 0 FHADHM CCc1ccc(C(C)(C)NCC(=O)Nc2cc(C(=O)[O-])ccc2C)cc1 ZINC000833670641 605145949 /nfs/dbraw/zinc/14/59/49/605145949.db2.gz OYKWRORSMJWQIX-UHFFFAOYSA-N -1 3 354.450 3.719 20 0 FHADHM CCc1ccc(C(C)(C)NCc2cc(C(=O)[O-])cc(C(=O)OC)c2)cc1 ZINC000833671055 605146066 /nfs/dbraw/zinc/14/60/66/605146066.db2.gz RPZXXKJMIHHQAC-UHFFFAOYSA-N -1 3 355.434 3.759 20 0 FHADHM C[C@@H](c1ccccc1)N(C)C(=O)CN[C@@H](c1ccccc1)C(C)(C)C(=O)[O-] ZINC000833548225 605183920 /nfs/dbraw/zinc/18/39/20/605183920.db2.gz JHILTYLHQOYDSZ-JXFKEZNVSA-N -1 3 368.477 3.648 20 0 FHADHM CC(C)(C)CCN1CCN(Cc2coc(-c3ccc(C(=O)[O-])cc3)n2)CC1 ZINC000833429433 605204591 /nfs/dbraw/zinc/20/45/91/605204591.db2.gz MHQNTSQOMVGQQG-UHFFFAOYSA-N -1 3 371.481 3.594 20 0 FHADHM C[C@H](CC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(F)cc1F ZINC000824384589 607745616 /nfs/dbraw/zinc/74/56/16/607745616.db2.gz FFUMOHUIHMINRR-VXGBXAGGSA-N -1 3 371.391 3.516 20 0 FHADHM C[C@H](CC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(F)cc1F ZINC000824384589 607745617 /nfs/dbraw/zinc/74/56/17/607745617.db2.gz FFUMOHUIHMINRR-VXGBXAGGSA-N -1 3 371.391 3.516 20 0 FHADHM CCOc1ccc([C@@H]2CCCN2Cc2ccc(OCC(=O)[O-])cc2)cc1 ZINC000833663470 605293669 /nfs/dbraw/zinc/29/36/69/605293669.db2.gz KZTZMVWTENCGOK-FQEVSTJZSA-N -1 3 355.434 3.886 20 0 FHADHM COc1ccc(C)cc1[C@@H](C)N[C@@H](C)CC(=O)Nc1cccc(C(=O)[O-])c1 ZINC000833731024 605299867 /nfs/dbraw/zinc/29/98/67/605299867.db2.gz SHBOPIAWHYTPDV-LSDHHAIUSA-N -1 3 370.449 3.770 20 0 FHADHM CC1([C@H]2CCCN([C@H](C(=O)[O-])c3ccc(Cl)cc3Cl)C2)OCCO1 ZINC000833563131 605443155 /nfs/dbraw/zinc/44/31/55/605443155.db2.gz DEPWFSWYPOWZOC-NHYWBVRUSA-N -1 3 374.264 3.594 20 0 FHADHM Cc1oc(-c2ccccc2)nc1CN1C[C@@H]2CCC[C@@H](NC(=O)[O-])[C@@H]2C1 ZINC000833937382 605450580 /nfs/dbraw/zinc/45/05/80/605450580.db2.gz WFROTDUTQWDZED-GVDBMIGSSA-N -1 3 355.438 3.518 20 0 FHADHM O=C([O-])N1CCC(N(Cc2ccc(CSC(F)F)o2)C2CC2)CC1 ZINC000834085299 605494991 /nfs/dbraw/zinc/49/49/91/605494991.db2.gz RDIBNVBADIVYPQ-UHFFFAOYSA-N -1 3 360.426 3.842 20 0 FHADHM O=C([O-])N1CCC[C@@H]1[C@H]1CCCCN1Cc1cnc(-c2ccncc2)s1 ZINC000834111126 605562078 /nfs/dbraw/zinc/56/20/78/605562078.db2.gz ZOSLJKJFNKIODC-IAGOWNOFSA-N -1 3 372.494 3.702 20 0 FHADHM C[C@H](NC(=O)[O-])[C@H]1CCCN(Cc2ccccc2OCc2ccncc2)C1 ZINC000833812309 605597312 /nfs/dbraw/zinc/59/73/12/605597312.db2.gz IRXBNMHEOFKHSN-WMZOPIPTSA-N -1 3 369.465 3.529 20 0 FHADHM CCC(=CC(=O)Nc1nc(-c2cccc(-c3nnn[n-]3)c2)cs1)CC ZINC000825028004 607768582 /nfs/dbraw/zinc/76/85/82/607768582.db2.gz BZHHBRJIDPDCAI-UHFFFAOYSA-N -1 3 354.439 3.675 20 0 FHADHM CCC(=CC(=O)Nc1nc(-c2cccc(-c3nn[n-]n3)c2)cs1)CC ZINC000825028004 607768583 /nfs/dbraw/zinc/76/85/83/607768583.db2.gz BZHHBRJIDPDCAI-UHFFFAOYSA-N -1 3 354.439 3.675 20 0 FHADHM C[C@@H]1CC[C@H](NC(=O)CCc2ccc(-c3nnn[n-]3)cc2)c2ccccc21 ZINC000824914924 607771964 /nfs/dbraw/zinc/77/19/64/607771964.db2.gz ADKRCWJFKFUNBM-KUHUBIRLSA-N -1 3 361.449 3.554 20 0 FHADHM C[C@@H]1CC[C@H](NC(=O)CCc2ccc(-c3nn[n-]n3)cc2)c2ccccc21 ZINC000824914924 607771965 /nfs/dbraw/zinc/77/19/65/607771965.db2.gz ADKRCWJFKFUNBM-KUHUBIRLSA-N -1 3 361.449 3.554 20 0 FHADHM O=C([O-])NC1C[C@H]2CCC[C@@H](C1)N2Cc1cc(-c2ccc(F)cc2)no1 ZINC000832239457 605942465 /nfs/dbraw/zinc/94/24/65/605942465.db2.gz IDTDXVBPQVKMLQ-MQVJKMGUSA-N -1 3 359.401 3.634 20 0 FHADHM O=C([O-])N1CCC[C@@H]1[C@H]1CCC[C@H]1NCc1csc(-c2ccco2)n1 ZINC000834111092 605990608 /nfs/dbraw/zinc/99/06/08/605990608.db2.gz ZINIHRFCGIJILB-RRFJBIMHSA-N -1 3 361.467 3.804 20 0 FHADHM CC[C@H]1CN(C(=O)c2cccc(-c3nnn[n-]3)c2)CC[C@H]1c1ccccc1 ZINC000820988642 606031043 /nfs/dbraw/zinc/03/10/43/606031043.db2.gz GWURUWFWOMXIEI-HNAYVOBHSA-N -1 3 361.449 3.523 20 0 FHADHM CC[C@H]1CN(C(=O)c2cccc(-c3nn[n-]n3)c2)CC[C@H]1c1ccccc1 ZINC000820988642 606031047 /nfs/dbraw/zinc/03/10/47/606031047.db2.gz GWURUWFWOMXIEI-HNAYVOBHSA-N -1 3 361.449 3.523 20 0 FHADHM CCC(CC)c1cc(CNc2nc3ccccc3cc2-c2nnn[n-]2)on1 ZINC000820898222 606090626 /nfs/dbraw/zinc/09/06/26/606090626.db2.gz WPFAYVNIQDSPQN-UHFFFAOYSA-N -1 3 363.425 3.919 20 0 FHADHM CCC(CC)c1cc(CNc2nc3ccccc3cc2-c2nn[n-]n2)on1 ZINC000820898222 606090629 /nfs/dbraw/zinc/09/06/29/606090629.db2.gz WPFAYVNIQDSPQN-UHFFFAOYSA-N -1 3 363.425 3.919 20 0 FHADHM CC(=CC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1cccc(Cl)c1 ZINC000819765319 606116461 /nfs/dbraw/zinc/11/64/61/606116461.db2.gz OHOHMPQGTZLGSA-KIWPFMIBSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=CC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1cccc(Cl)c1 ZINC000819765319 606116463 /nfs/dbraw/zinc/11/64/63/606116463.db2.gz OHOHMPQGTZLGSA-KIWPFMIBSA-N -1 3 367.840 3.801 20 0 FHADHM CC[C@@H](C)Oc1ccc(C(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000820876028 606117142 /nfs/dbraw/zinc/11/71/42/606117142.db2.gz KJMFYYRQMOOABQ-KGLIPLIRSA-N -1 3 365.437 3.535 20 0 FHADHM CC[C@@H](C)Oc1ccc(C(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000820876028 606117144 /nfs/dbraw/zinc/11/71/44/606117144.db2.gz KJMFYYRQMOOABQ-KGLIPLIRSA-N -1 3 365.437 3.535 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)[C@H](C)C1CCCC1 ZINC000821388923 606122993 /nfs/dbraw/zinc/12/29/93/606122993.db2.gz AVIXARHWWCTRPU-SNVBAGLBSA-N -1 3 364.833 3.651 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)[C@H](C)C1CCCC1 ZINC000821388923 606122995 /nfs/dbraw/zinc/12/29/95/606122995.db2.gz AVIXARHWWCTRPU-SNVBAGLBSA-N -1 3 364.833 3.651 20 0 FHADHM O=C(C/C=C\c1cccc(F)c1)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000822946170 606123412 /nfs/dbraw/zinc/12/34/12/606123412.db2.gz WLDSYTRHPHAOJY-RQOWECAXSA-N -1 3 357.776 3.701 20 0 FHADHM O=C(C/C=C\c1cccc(F)c1)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000822946170 606123413 /nfs/dbraw/zinc/12/34/13/606123413.db2.gz WLDSYTRHPHAOJY-RQOWECAXSA-N -1 3 357.776 3.701 20 0 FHADHM CC[C@H](Oc1ccccc1C)C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820938303 606127184 /nfs/dbraw/zinc/12/71/84/606127184.db2.gz IDIKATJQVOMDFY-YOEHRIQHSA-N -1 3 366.421 3.637 20 0 FHADHM CC[C@H](Oc1ccccc1C)C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820938303 606127185 /nfs/dbraw/zinc/12/71/85/606127185.db2.gz IDIKATJQVOMDFY-YOEHRIQHSA-N -1 3 366.421 3.637 20 0 FHADHM Cc1cccnc1C(=O)OCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000822369540 606148770 /nfs/dbraw/zinc/14/87/70/606148770.db2.gz JZEQJPGHEFNFFE-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM Cc1cccnc1C(=O)OCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000822369540 606148771 /nfs/dbraw/zinc/14/87/71/606148771.db2.gz JZEQJPGHEFNFFE-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM Fc1cccc(-c2cnc(CSc3ccccc3-c3nnn[n-]3)o2)c1 ZINC000822786446 606172206 /nfs/dbraw/zinc/17/22/06/606172206.db2.gz KLRUEKNMYVFHTN-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM Fc1cccc(-c2cnc(CSc3ccccc3-c3nn[n-]n3)o2)c1 ZINC000822786446 606172208 /nfs/dbraw/zinc/17/22/08/606172208.db2.gz KLRUEKNMYVFHTN-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000819773543 606177190 /nfs/dbraw/zinc/17/71/90/606177190.db2.gz TYPSIKVKZSNCGO-XSNHNAGMSA-N -1 3 352.369 3.714 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000819773543 606177192 /nfs/dbraw/zinc/17/71/92/606177192.db2.gz TYPSIKVKZSNCGO-XSNHNAGMSA-N -1 3 352.369 3.714 20 0 FHADHM CCOc1cccc([C@@H](CC)OC(=O)Cc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000821426688 606182174 /nfs/dbraw/zinc/18/21/74/606182174.db2.gz GDEHZRFPOXXTDW-GOSISDBHSA-N -1 3 366.421 3.502 20 0 FHADHM CCOc1cccc([C@@H](CC)OC(=O)Cc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000821426688 606182175 /nfs/dbraw/zinc/18/21/75/606182175.db2.gz GDEHZRFPOXXTDW-GOSISDBHSA-N -1 3 366.421 3.502 20 0 FHADHM Cc1ccc(CCCC(=O)Nc2sc3c(c2-c2nnn[n-]2)CCC3)s1 ZINC000822236172 606183362 /nfs/dbraw/zinc/18/33/62/606183362.db2.gz MSTJWTXFVOHMOG-UHFFFAOYSA-N -1 3 373.507 3.748 20 0 FHADHM Cc1ccc(CCCC(=O)Nc2sc3c(c2-c2nn[n-]n2)CCC3)s1 ZINC000822236172 606183363 /nfs/dbraw/zinc/18/33/63/606183363.db2.gz MSTJWTXFVOHMOG-UHFFFAOYSA-N -1 3 373.507 3.748 20 0 FHADHM CC(C)[C@@H](CNc1nc2ccccc2cc1-c1nnn[n-]1)c1cccnc1 ZINC000820021475 606229045 /nfs/dbraw/zinc/22/90/45/606229045.db2.gz USRMRHPILUBVKD-QGZVFWFLSA-N -1 3 359.437 3.662 20 0 FHADHM CC(C)[C@@H](CNc1nc2ccccc2cc1-c1nn[n-]n1)c1cccnc1 ZINC000820021475 606229048 /nfs/dbraw/zinc/22/90/48/606229048.db2.gz USRMRHPILUBVKD-QGZVFWFLSA-N -1 3 359.437 3.662 20 0 FHADHM C[C@@H]1[C@@H](c2ccccc2)CCN1c1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000820643655 606234006 /nfs/dbraw/zinc/23/40/06/606234006.db2.gz YCYPNXRITZIUKT-YPMHNXCESA-N -1 3 374.370 3.663 20 0 FHADHM C[C@@H]1[C@@H](c2ccccc2)CCN1c1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000820643655 606234008 /nfs/dbraw/zinc/23/40/08/606234008.db2.gz YCYPNXRITZIUKT-YPMHNXCESA-N -1 3 374.370 3.663 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)C=C(C)c2cccc(OC)c2)s1 ZINC000821465746 606234090 /nfs/dbraw/zinc/23/40/90/606234090.db2.gz NSBLRDHVKCGHSM-DHZHZOJOSA-N -1 3 369.450 3.541 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)C=C(C)c2cccc(OC)c2)s1 ZINC000821465746 606234092 /nfs/dbraw/zinc/23/40/92/606234092.db2.gz NSBLRDHVKCGHSM-DHZHZOJOSA-N -1 3 369.450 3.541 20 0 FHADHM O=C(NC1CCCC1)c1ccc(Sc2ccccc2-c2nnn[n-]2)cc1 ZINC000823151315 606247279 /nfs/dbraw/zinc/24/72/79/606247279.db2.gz ZPCONUSOODFPGG-UHFFFAOYSA-N -1 3 365.462 3.690 20 0 FHADHM O=C(NC1CCCC1)c1ccc(Sc2ccccc2-c2nn[n-]n2)cc1 ZINC000823151315 606247281 /nfs/dbraw/zinc/24/72/81/606247281.db2.gz ZPCONUSOODFPGG-UHFFFAOYSA-N -1 3 365.462 3.690 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)c1sccc1SC(F)F ZINC000823346894 606273626 /nfs/dbraw/zinc/27/36/26/606273626.db2.gz RZJFGXIWWPCWGI-UHFFFAOYSA-N -1 3 371.369 3.634 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)c1sccc1SC(F)F ZINC000823346894 606273627 /nfs/dbraw/zinc/27/36/27/606273627.db2.gz RZJFGXIWWPCWGI-UHFFFAOYSA-N -1 3 371.369 3.634 20 0 FHADHM O=C(c1cc(-c2nnn[n-]2)c[nH]1)N1CCCCC[C@H]1c1ccc(Cl)cc1 ZINC000823466775 606278009 /nfs/dbraw/zinc/27/80/09/606278009.db2.gz PIRAHXBOFFSPFE-INIZCTEOSA-N -1 3 370.844 3.606 20 0 FHADHM O=C(c1cc(-c2nn[n-]n2)c[nH]1)N1CCCCC[C@H]1c1ccc(Cl)cc1 ZINC000823466775 606278010 /nfs/dbraw/zinc/27/80/10/606278010.db2.gz PIRAHXBOFFSPFE-INIZCTEOSA-N -1 3 370.844 3.606 20 0 FHADHM C/C=C(\C)C(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)cc1C ZINC000820826131 606285794 /nfs/dbraw/zinc/28/57/94/606285794.db2.gz JQAUCICPXTXFQO-YIXHJXPBSA-N -1 3 363.421 3.659 20 0 FHADHM C/C=C(\C)C(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)cc1C ZINC000820826131 606285795 /nfs/dbraw/zinc/28/57/95/606285795.db2.gz JQAUCICPXTXFQO-YIXHJXPBSA-N -1 3 363.421 3.659 20 0 FHADHM CC(C)Sc1c(Cl)cccc1NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC000820184129 606322698 /nfs/dbraw/zinc/32/26/98/606322698.db2.gz SOMRKUJEPRDYQA-UHFFFAOYSA-N -1 3 362.846 3.601 20 0 FHADHM CC(C)Sc1c(Cl)cccc1NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC000820184129 606322700 /nfs/dbraw/zinc/32/27/00/606322700.db2.gz SOMRKUJEPRDYQA-UHFFFAOYSA-N -1 3 362.846 3.601 20 0 FHADHM Cc1cc2oc(=O)cc(CSc3cccc(-c4nnn[n-]4)c3)c2cc1C ZINC000822212939 606324675 /nfs/dbraw/zinc/32/46/75/606324675.db2.gz NMHULXBPQUBAMJ-UHFFFAOYSA-N -1 3 364.430 3.882 20 0 FHADHM Cc1cc2oc(=O)cc(CSc3cccc(-c4nn[n-]n4)c3)c2cc1C ZINC000822212939 606324676 /nfs/dbraw/zinc/32/46/76/606324676.db2.gz NMHULXBPQUBAMJ-UHFFFAOYSA-N -1 3 364.430 3.882 20 0 FHADHM CCC(CC)N(CC(C)C)C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820897696 606329307 /nfs/dbraw/zinc/32/93/07/606329307.db2.gz LZKPHEFQUWBSGZ-AWEZNQCLSA-N -1 3 358.490 3.784 20 0 FHADHM CCC(CC)N(CC(C)C)C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820897696 606329310 /nfs/dbraw/zinc/32/93/10/606329310.db2.gz LZKPHEFQUWBSGZ-AWEZNQCLSA-N -1 3 358.490 3.784 20 0 FHADHM CC(C)(C)OC(=O)Oc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000819947022 606331975 /nfs/dbraw/zinc/33/19/75/606331975.db2.gz ZYVKMWWSEPMGIL-UHFFFAOYSA-N -1 3 354.366 3.973 20 0 FHADHM CC(C)(C)OC(=O)Oc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000819947022 606331977 /nfs/dbraw/zinc/33/19/77/606331977.db2.gz ZYVKMWWSEPMGIL-UHFFFAOYSA-N -1 3 354.366 3.973 20 0 FHADHM C[C@@H](OC(=O)C1(c2cccc(F)c2)CCC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820489015 606342033 /nfs/dbraw/zinc/34/20/33/606342033.db2.gz XYWRVHCIGVTRTJ-CYBMUJFWSA-N -1 3 366.396 3.732 20 0 FHADHM C[C@@H](OC(=O)C1(c2cccc(F)c2)CCC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820489015 606342034 /nfs/dbraw/zinc/34/20/34/606342034.db2.gz XYWRVHCIGVTRTJ-CYBMUJFWSA-N -1 3 366.396 3.732 20 0 FHADHM C[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820678622 606342425 /nfs/dbraw/zinc/34/24/25/606342425.db2.gz WKOKPLBXFZHSDD-UEKVPHQBSA-N -1 3 360.849 3.705 20 0 FHADHM C[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820678622 606342427 /nfs/dbraw/zinc/34/24/27/606342427.db2.gz WKOKPLBXFZHSDD-UEKVPHQBSA-N -1 3 360.849 3.705 20 0 FHADHM C[C@H](OC(=O)CSCc1ccc(F)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820496705 606343967 /nfs/dbraw/zinc/34/39/67/606343967.db2.gz OMXWAXLVJHIYSC-LBPRGKRZSA-N -1 3 372.425 3.543 20 0 FHADHM C[C@H](OC(=O)CSCc1ccc(F)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820496705 606343969 /nfs/dbraw/zinc/34/39/69/606343969.db2.gz OMXWAXLVJHIYSC-LBPRGKRZSA-N -1 3 372.425 3.543 20 0 FHADHM C[C@H](OC(=O)[C@H]1C[C@@H]1c1cccc(F)c1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000820487236 606345616 /nfs/dbraw/zinc/34/56/16/606345616.db2.gz FUSVVPGVJIUERH-VQISRLSMSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@H]1C[C@@H]1c1cccc(F)c1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000820487236 606345619 /nfs/dbraw/zinc/34/56/19/606345619.db2.gz FUSVVPGVJIUERH-VQISRLSMSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@H]1C[C@H]1c1cccc(F)c1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000820487232 606345815 /nfs/dbraw/zinc/34/58/15/606345815.db2.gz FUSVVPGVJIUERH-LKTVYLICSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@H]1C[C@H]1c1cccc(F)c1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000820487232 606345818 /nfs/dbraw/zinc/34/58/18/606345818.db2.gz FUSVVPGVJIUERH-LKTVYLICSA-N -1 3 370.359 3.553 20 0 FHADHM CC(C)OCc1ccc(C(=O)O[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000820146995 606352400 /nfs/dbraw/zinc/35/24/00/606352400.db2.gz WTJWKLQICHVQCG-CQSZACIVSA-N -1 3 366.421 3.710 20 0 FHADHM CC(C)OCc1ccc(C(=O)O[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000820146995 606352402 /nfs/dbraw/zinc/35/24/02/606352402.db2.gz WTJWKLQICHVQCG-CQSZACIVSA-N -1 3 366.421 3.710 20 0 FHADHM C[C@H](OC(=O)[C@H]1CCC[C@H](C(F)(F)F)C1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488683 606357794 /nfs/dbraw/zinc/35/77/94/606357794.db2.gz RQGIHIUJJGQDGW-BPNCWPANSA-N -1 3 368.359 3.840 20 0 FHADHM C[C@H](OC(=O)[C@H]1CCC[C@H](C(F)(F)F)C1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488683 606357795 /nfs/dbraw/zinc/35/77/95/606357795.db2.gz RQGIHIUJJGQDGW-BPNCWPANSA-N -1 3 368.359 3.840 20 0 FHADHM O=C(CC(F)(F)F)Oc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000822935458 606361744 /nfs/dbraw/zinc/36/17/44/606361744.db2.gz LOKUALXHYMIXCD-UHFFFAOYSA-N -1 3 364.283 3.517 20 0 FHADHM O=C(CC(F)(F)F)Oc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000822935458 606361746 /nfs/dbraw/zinc/36/17/46/606361746.db2.gz LOKUALXHYMIXCD-UHFFFAOYSA-N -1 3 364.283 3.517 20 0 FHADHM CCc1ccc(CC)c(NC(=S)Nc2ccccc2-c2nnn[n-]2)c1 ZINC000821481045 606414224 /nfs/dbraw/zinc/41/42/24/606414224.db2.gz HPAFXTCCQVKVBR-UHFFFAOYSA-N -1 3 352.467 3.800 20 0 FHADHM CCc1ccc(CC)c(NC(=S)Nc2ccccc2-c2nn[n-]n2)c1 ZINC000821481045 606414226 /nfs/dbraw/zinc/41/42/26/606414226.db2.gz HPAFXTCCQVKVBR-UHFFFAOYSA-N -1 3 352.467 3.800 20 0 FHADHM FC(F)(F)[C@@H]1CCC[C@@H](Nc2cc(-c3nnn[n-]3)c3ccccc3n2)C1 ZINC000822714375 606447410 /nfs/dbraw/zinc/44/74/10/606447410.db2.gz MRNWOJVKTLDJMP-GHMZBOCLSA-N -1 3 362.359 3.948 20 0 FHADHM FC(F)(F)[C@@H]1CCC[C@@H](Nc2cc(-c3nn[n-]n3)c3ccccc3n2)C1 ZINC000822714375 606447412 /nfs/dbraw/zinc/44/74/12/606447412.db2.gz MRNWOJVKTLDJMP-GHMZBOCLSA-N -1 3 362.359 3.948 20 0 FHADHM Fc1ccc(NCc2cc(-c3ccc(Cl)cc3)no2)cc1-c1nnn[n-]1 ZINC000822782759 606457533 /nfs/dbraw/zinc/45/75/33/606457533.db2.gz FUSHFVCWLHCIKQ-UHFFFAOYSA-N -1 3 370.775 3.926 20 0 FHADHM Fc1ccc(NCc2cc(-c3ccc(Cl)cc3)no2)cc1-c1nn[n-]n1 ZINC000822782759 606457534 /nfs/dbraw/zinc/45/75/34/606457534.db2.gz FUSHFVCWLHCIKQ-UHFFFAOYSA-N -1 3 370.775 3.926 20 0 FHADHM FC(F)(F)c1cc(N2CCC[C@@H]2c2ccccn2)ccc1-c1nnn[n-]1 ZINC000822723450 606459697 /nfs/dbraw/zinc/45/96/97/606459697.db2.gz FLZNWQXNMLKMSJ-OAHLLOKOSA-N -1 3 360.343 3.622 20 0 FHADHM FC(F)(F)c1cc(N2CCC[C@@H]2c2ccccn2)ccc1-c1nn[n-]n1 ZINC000822723450 606459698 /nfs/dbraw/zinc/45/96/98/606459698.db2.gz FLZNWQXNMLKMSJ-OAHLLOKOSA-N -1 3 360.343 3.622 20 0 FHADHM Cc1cc(C)c(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CC[C@H](C)C3)o1 ZINC000822194403 606489482 /nfs/dbraw/zinc/48/94/82/606489482.db2.gz WFJHAITYBVJXRG-QMMMGPOBSA-N -1 3 357.439 3.515 20 0 FHADHM Cc1cc(C)c(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CC[C@H](C)C3)o1 ZINC000822194403 606489483 /nfs/dbraw/zinc/48/94/83/606489483.db2.gz WFJHAITYBVJXRG-QMMMGPOBSA-N -1 3 357.439 3.515 20 0 FHADHM O=C(Nc1ccc(OC2CCCC2)cc1)c1cc(-c2nnn[n-]2)cs1 ZINC000823350504 606489499 /nfs/dbraw/zinc/48/94/99/606489499.db2.gz PTWCNULUNIDNIE-UHFFFAOYSA-N -1 3 355.423 3.502 20 0 FHADHM O=C(Nc1ccc(OC2CCCC2)cc1)c1cc(-c2nn[n-]n2)cs1 ZINC000823350504 606489501 /nfs/dbraw/zinc/48/95/01/606489501.db2.gz PTWCNULUNIDNIE-UHFFFAOYSA-N -1 3 355.423 3.502 20 0 FHADHM CCSc1ccc(Cl)cc1C(=O)NCc1ccc(-c2nnn[n-]2)cc1 ZINC000175884489 606490353 /nfs/dbraw/zinc/49/03/53/606490353.db2.gz GSVVAKHMGSPRFZ-UHFFFAOYSA-N -1 3 373.869 3.562 20 0 FHADHM CCSc1ccc(Cl)cc1C(=O)NCc1ccc(-c2nn[n-]n2)cc1 ZINC000175884489 606490355 /nfs/dbraw/zinc/49/03/55/606490355.db2.gz GSVVAKHMGSPRFZ-UHFFFAOYSA-N -1 3 373.869 3.562 20 0 FHADHM O=C(Nc1ccccc1OC1CCCC1)c1cc(-c2nnn[n-]2)cs1 ZINC000823372581 606496833 /nfs/dbraw/zinc/49/68/33/606496833.db2.gz GGFLMBVBPSOMGA-UHFFFAOYSA-N -1 3 355.423 3.502 20 0 FHADHM O=C(Nc1ccccc1OC1CCCC1)c1cc(-c2nn[n-]n2)cs1 ZINC000823372581 606496834 /nfs/dbraw/zinc/49/68/34/606496834.db2.gz GGFLMBVBPSOMGA-UHFFFAOYSA-N -1 3 355.423 3.502 20 0 FHADHM CCN(C(=O)c1cc(-c2nnn[n-]2)cs1)[C@H](C)c1cc2ccccc2o1 ZINC000821154167 606497487 /nfs/dbraw/zinc/49/74/87/606497487.db2.gz KPARMBSJUNBZFE-LLVKDONJSA-N -1 3 367.434 3.898 20 0 FHADHM CCN(C(=O)c1cc(-c2nn[n-]n2)cs1)[C@H](C)c1cc2ccccc2o1 ZINC000821154167 606497488 /nfs/dbraw/zinc/49/74/88/606497488.db2.gz KPARMBSJUNBZFE-LLVKDONJSA-N -1 3 367.434 3.898 20 0 FHADHM O=C(Nc1cccc(-c2cccs2)c1)c1cc(-c2nnn[n-]2)cs1 ZINC000823359328 606503394 /nfs/dbraw/zinc/50/33/94/606503394.db2.gz LYZMUZAHYGTUBS-UHFFFAOYSA-N -1 3 353.432 3.909 20 0 FHADHM O=C(Nc1cccc(-c2cccs2)c1)c1cc(-c2nn[n-]n2)cs1 ZINC000823359328 606503396 /nfs/dbraw/zinc/50/33/96/606503396.db2.gz LYZMUZAHYGTUBS-UHFFFAOYSA-N -1 3 353.432 3.909 20 0 FHADHM CC(C)Sc1ccc([C@H](C)NC(=O)c2cc(-c3nnn[n-]3)cs2)cc1 ZINC000820183506 606507075 /nfs/dbraw/zinc/50/70/75/606507075.db2.gz GSFYKYBCKRSIOR-NSHDSACASA-N -1 3 373.507 3.920 20 0 FHADHM CC(C)Sc1ccc([C@H](C)NC(=O)c2cc(-c3nn[n-]n3)cs2)cc1 ZINC000820183506 606507077 /nfs/dbraw/zinc/50/70/77/606507077.db2.gz GSFYKYBCKRSIOR-NSHDSACASA-N -1 3 373.507 3.920 20 0 FHADHM C[C@H](NC(=O)c1cc(-c2nnn[n-]2)cs1)c1cccc(Cl)c1Cl ZINC000820392674 606513738 /nfs/dbraw/zinc/51/37/38/606513738.db2.gz YLBBPMRLAJLXES-ZETCQYMHSA-N -1 3 368.249 3.726 20 0 FHADHM C[C@H](NC(=O)c1cc(-c2nn[n-]n2)cs1)c1cccc(Cl)c1Cl ZINC000820392674 606513739 /nfs/dbraw/zinc/51/37/39/606513739.db2.gz YLBBPMRLAJLXES-ZETCQYMHSA-N -1 3 368.249 3.726 20 0 FHADHM CCc1ccc(CC)c(NC(=O)N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000821482823 606577468 /nfs/dbraw/zinc/57/74/68/606577468.db2.gz VKHSHFIAZTYECY-ZDUSSCGKSA-N -1 3 364.453 3.874 20 0 FHADHM CCc1ccc(CC)c(NC(=O)N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000821482823 606577469 /nfs/dbraw/zinc/57/74/69/606577469.db2.gz VKHSHFIAZTYECY-ZDUSSCGKSA-N -1 3 364.453 3.874 20 0 FHADHM Cc1cccc([C@@H](NC(=O)Cc2cccc(-c3nnn[n-]3)c2)C(C)(C)C)c1 ZINC000822288936 606590438 /nfs/dbraw/zinc/59/04/38/606590438.db2.gz NQBVEESDSVSJQQ-LJQANCHMSA-N -1 3 363.465 3.621 20 0 FHADHM Cc1cccc([C@@H](NC(=O)Cc2cccc(-c3nn[n-]n3)c2)C(C)(C)C)c1 ZINC000822288936 606590440 /nfs/dbraw/zinc/59/04/40/606590440.db2.gz NQBVEESDSVSJQQ-LJQANCHMSA-N -1 3 363.465 3.621 20 0 FHADHM CC(C)(C)OCc1ccc(NCc2ccc(-c3nnn[n-]3)cc2F)cc1 ZINC000819951830 606595785 /nfs/dbraw/zinc/59/57/85/606595785.db2.gz XMWYYXLOSUCKKZ-UHFFFAOYSA-N -1 3 355.417 3.933 20 0 FHADHM CC(C)(C)OCc1ccc(NCc2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000819951830 606595786 /nfs/dbraw/zinc/59/57/86/606595786.db2.gz XMWYYXLOSUCKKZ-UHFFFAOYSA-N -1 3 355.417 3.933 20 0 FHADHM Fc1c(Cl)cccc1NCc1ccc(-c2nnn[n-]2)cc1OC(F)F ZINC000822737515 606597168 /nfs/dbraw/zinc/59/71/68/606597168.db2.gz YHXQQQGSZWQZSV-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM Fc1c(Cl)cccc1NCc1ccc(-c2nn[n-]n2)cc1OC(F)F ZINC000822737515 606597170 /nfs/dbraw/zinc/59/71/70/606597170.db2.gz YHXQQQGSZWQZSV-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM Fc1ccc(Cl)c(NCc2ccc(-c3nnn[n-]3)cc2OC(F)F)c1 ZINC000822775266 606597631 /nfs/dbraw/zinc/59/76/31/606597631.db2.gz TYLRHDHJHIUDDZ-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM Fc1ccc(Cl)c(NCc2ccc(-c3nn[n-]n3)cc2OC(F)F)c1 ZINC000822775266 606597632 /nfs/dbraw/zinc/59/76/32/606597632.db2.gz TYLRHDHJHIUDDZ-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM Cc1cccn2cc(CS[C@@H](C)c3ccc(-c4nnn[n-]4)cc3)nc12 ZINC000822366146 606598920 /nfs/dbraw/zinc/59/89/20/606598920.db2.gz DIZLDRZHZOVZAP-ZDUSSCGKSA-N -1 3 350.451 3.817 20 0 FHADHM Cc1cccn2cc(CS[C@@H](C)c3ccc(-c4nn[n-]n4)cc3)nc12 ZINC000822366146 606598922 /nfs/dbraw/zinc/59/89/22/606598922.db2.gz DIZLDRZHZOVZAP-ZDUSSCGKSA-N -1 3 350.451 3.817 20 0 FHADHM Cc1cc(CCCC(=O)N(C)c2cccc(-c3nnn[n-]3)c2)c(C)s1 ZINC000822200148 606602913 /nfs/dbraw/zinc/60/29/13/606602913.db2.gz WQYUOEJGJGXPCI-UHFFFAOYSA-N -1 3 355.467 3.531 20 0 FHADHM Cc1cc(CCCC(=O)N(C)c2cccc(-c3nn[n-]n3)c2)c(C)s1 ZINC000822200148 606602914 /nfs/dbraw/zinc/60/29/14/606602914.db2.gz WQYUOEJGJGXPCI-UHFFFAOYSA-N -1 3 355.467 3.531 20 0 FHADHM C[C@H](NC(=O)c1cc2cccc(Cl)c2o1)c1cccc(-c2nnn[n-]2)c1 ZINC000820390074 606603945 /nfs/dbraw/zinc/60/39/45/606603945.db2.gz DWJREBFCURMORA-JTQLQIEISA-N -1 3 367.796 3.757 20 0 FHADHM C[C@H](NC(=O)c1cc2cccc(Cl)c2o1)c1cccc(-c2nn[n-]n2)c1 ZINC000820390074 606603947 /nfs/dbraw/zinc/60/39/47/606603947.db2.gz DWJREBFCURMORA-JTQLQIEISA-N -1 3 367.796 3.757 20 0 FHADHM O=C(Nc1ccc(CCC(F)(F)F)cc1)c1cc(-c2nnn[n-]2)cs1 ZINC000823323415 606605616 /nfs/dbraw/zinc/60/56/16/606605616.db2.gz NIJCPBAOCATUIU-UHFFFAOYSA-N -1 3 367.356 3.675 20 0 FHADHM O=C(Nc1ccc(CCC(F)(F)F)cc1)c1cc(-c2nn[n-]n2)cs1 ZINC000823323415 606605618 /nfs/dbraw/zinc/60/56/18/606605618.db2.gz NIJCPBAOCATUIU-UHFFFAOYSA-N -1 3 367.356 3.675 20 0 FHADHM COc1ccc([C@H](C)CC(=O)Nc2ccc(Cl)c(-c3nnn[n-]3)c2)cc1 ZINC000821777978 606624813 /nfs/dbraw/zinc/62/48/13/606624813.db2.gz QSKLYTBMNSXIQE-LLVKDONJSA-N -1 3 371.828 3.661 20 0 FHADHM COc1ccc([C@H](C)CC(=O)Nc2ccc(Cl)c(-c3nn[n-]n3)c2)cc1 ZINC000821777978 606624815 /nfs/dbraw/zinc/62/48/15/606624815.db2.gz QSKLYTBMNSXIQE-LLVKDONJSA-N -1 3 371.828 3.661 20 0 FHADHM Cc1cc(Cl)cc(C)c1OC(=O)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000822201891 606664549 /nfs/dbraw/zinc/66/45/49/606664549.db2.gz AJONJOSASPWQGG-UHFFFAOYSA-N -1 3 364.739 3.634 20 0 FHADHM Cc1cc(Cl)cc(C)c1OC(=O)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000822201891 606664550 /nfs/dbraw/zinc/66/45/50/606664550.db2.gz AJONJOSASPWQGG-UHFFFAOYSA-N -1 3 364.739 3.634 20 0 FHADHM CCN(C(=O)CCO[C@@H](C)CC(C)C)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821153861 606670270 /nfs/dbraw/zinc/67/02/70/606670270.db2.gz FTEZEZBHNDNINK-JKSUJKDBSA-N -1 3 373.501 3.618 20 0 FHADHM CCN(C(=O)CCO[C@@H](C)CC(C)C)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821153861 606670271 /nfs/dbraw/zinc/67/02/71/606670271.db2.gz FTEZEZBHNDNINK-JKSUJKDBSA-N -1 3 373.501 3.618 20 0 FHADHM CCc1c(C)sc(NC(=O)CCO[C@H](C)CC(C)C)c1-c1nnn[n-]1 ZINC000821465778 606677012 /nfs/dbraw/zinc/67/70/12/606677012.db2.gz OXRWUFAHUJDOPX-LLVKDONJSA-N -1 3 365.503 3.579 20 0 FHADHM CCc1c(C)sc(NC(=O)CCO[C@H](C)CC(C)C)c1-c1nn[n-]n1 ZINC000821465778 606677013 /nfs/dbraw/zinc/67/70/13/606677013.db2.gz OXRWUFAHUJDOPX-LLVKDONJSA-N -1 3 365.503 3.579 20 0 FHADHM O=C(c1c(F)cc(-c2nnn[n-]2)cc1F)N(CC1CCC1)c1ccccc1 ZINC000823453804 606687023 /nfs/dbraw/zinc/68/70/23/606687023.db2.gz ADFHDHRBUZITOW-UHFFFAOYSA-N -1 3 369.375 3.592 20 0 FHADHM O=C(c1c(F)cc(-c2nn[n-]n2)cc1F)N(CC1CCC1)c1ccccc1 ZINC000823453804 606687024 /nfs/dbraw/zinc/68/70/24/606687024.db2.gz ADFHDHRBUZITOW-UHFFFAOYSA-N -1 3 369.375 3.592 20 0 FHADHM O=C(N[C@H](c1ccccc1)c1cccc(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000823139488 606694481 /nfs/dbraw/zinc/69/44/81/606694481.db2.gz GCDXREADEDKMPP-LJQANCHMSA-N -1 3 373.391 3.525 20 0 FHADHM O=C(N[C@H](c1ccccc1)c1cccc(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000823139488 606694482 /nfs/dbraw/zinc/69/44/82/606694482.db2.gz GCDXREADEDKMPP-LJQANCHMSA-N -1 3 373.391 3.525 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NCc1nc(C(C)(C)C)cs1 ZINC000821412708 606707146 /nfs/dbraw/zinc/70/71/46/606707146.db2.gz RLOYXQLLBZRJSF-UHFFFAOYSA-N -1 3 358.471 3.632 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NCc1nc(C(C)(C)C)cs1 ZINC000821412708 606707147 /nfs/dbraw/zinc/70/71/47/606707147.db2.gz RLOYXQLLBZRJSF-UHFFFAOYSA-N -1 3 358.471 3.632 20 0 FHADHM Clc1ccc(NCc2ccc(-c3nnn[n-]3)cc2)cc1Br ZINC000822578890 606707776 /nfs/dbraw/zinc/70/77/76/606707776.db2.gz SQNSBIHDKSQIPY-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM Clc1ccc(NCc2ccc(-c3nn[n-]n3)cc2)cc1Br ZINC000822578890 606707779 /nfs/dbraw/zinc/70/77/79/606707779.db2.gz SQNSBIHDKSQIPY-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)c1cc(C(F)(F)F)ccc1F ZINC000822220490 606717322 /nfs/dbraw/zinc/71/73/22/606717322.db2.gz TUDMQCAIUBKYJJ-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cc(C(F)(F)F)ccc1F ZINC000822220490 606717323 /nfs/dbraw/zinc/71/73/23/606717323.db2.gz TUDMQCAIUBKYJJ-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM CCC(=O)c1ccc(C(=O)Nc2sc(C)c(CC)c2-c2nnn[n-]2)cc1 ZINC000820842847 606725486 /nfs/dbraw/zinc/72/54/86/606725486.db2.gz QISUZJAUZIXGHO-UHFFFAOYSA-N -1 3 369.450 3.644 20 0 FHADHM CCC(=O)c1ccc(C(=O)Nc2sc(C)c(CC)c2-c2nn[n-]n2)cc1 ZINC000820842847 606725487 /nfs/dbraw/zinc/72/54/87/606725487.db2.gz QISUZJAUZIXGHO-UHFFFAOYSA-N -1 3 369.450 3.644 20 0 FHADHM CCC1(CNC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)CCCC1 ZINC000820962305 606743575 /nfs/dbraw/zinc/74/35/75/606743575.db2.gz NXKJELVOBHUFAY-UHFFFAOYSA-N -1 3 371.485 3.502 20 0 FHADHM CCC1(CNC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)CCCC1 ZINC000820962305 606743577 /nfs/dbraw/zinc/74/35/77/606743577.db2.gz NXKJELVOBHUFAY-UHFFFAOYSA-N -1 3 371.485 3.502 20 0 FHADHM COc1cc(COc2cc(Cl)ccc2-c2nnn[n-]2)ccc1SC ZINC000821717507 606781033 /nfs/dbraw/zinc/78/10/33/606781033.db2.gz PRISKYPTWMJZSR-UHFFFAOYSA-N -1 3 362.842 3.830 20 0 FHADHM COc1cc(COc2cc(Cl)ccc2-c2nn[n-]n2)ccc1SC ZINC000821717507 606781034 /nfs/dbraw/zinc/78/10/34/606781034.db2.gz PRISKYPTWMJZSR-UHFFFAOYSA-N -1 3 362.842 3.830 20 0 FHADHM CC[C@H](C)N(C)C(=O)c1ccc(Oc2ccc(-c3nnn[n-]3)cc2C)cc1 ZINC000820875705 606789014 /nfs/dbraw/zinc/78/90/14/606789014.db2.gz CUSSQOWSDBYXTF-AWEZNQCLSA-N -1 3 365.437 3.838 20 0 FHADHM CC[C@H](C)N(C)C(=O)c1ccc(Oc2ccc(-c3nn[n-]n3)cc2C)cc1 ZINC000820875705 606789016 /nfs/dbraw/zinc/78/90/16/606789016.db2.gz CUSSQOWSDBYXTF-AWEZNQCLSA-N -1 3 365.437 3.838 20 0 FHADHM CCN(C(=O)c1cccc(C(C)C)n1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821160446 606799863 /nfs/dbraw/zinc/79/98/63/606799863.db2.gz KWEBSAKCNPGTJT-AWEZNQCLSA-N -1 3 364.453 3.608 20 0 FHADHM CCN(C(=O)c1cccc(C(C)C)n1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821160446 606799865 /nfs/dbraw/zinc/79/98/65/606799865.db2.gz KWEBSAKCNPGTJT-AWEZNQCLSA-N -1 3 364.453 3.608 20 0 FHADHM O=C(Nc1ccccc1-c1nnn[n-]1)c1cc(C2CC2)nc2ccccc21 ZINC000823367323 606804871 /nfs/dbraw/zinc/80/48/71/606804871.db2.gz JENJGZZQQJQDBN-UHFFFAOYSA-N -1 3 356.389 3.545 20 0 FHADHM O=C(Nc1ccccc1-c1nn[n-]n1)c1cc(C2CC2)nc2ccccc21 ZINC000823367323 606804872 /nfs/dbraw/zinc/80/48/72/606804872.db2.gz JENJGZZQQJQDBN-UHFFFAOYSA-N -1 3 356.389 3.545 20 0 FHADHM Cc1ccc(C)c([C@@H]2CCCN2C(=O)C=Cc2ccccc2-c2nnn[n-]2)c1 ZINC000822230775 606807491 /nfs/dbraw/zinc/80/74/91/606807491.db2.gz QEMWRZVPSMPGGW-SGWGQVFISA-N -1 3 373.460 3.860 20 0 FHADHM Cc1ccc(C)c([C@@H]2CCCN2C(=O)C=Cc2ccccc2-c2nn[n-]n2)c1 ZINC000822230775 606807493 /nfs/dbraw/zinc/80/74/93/606807493.db2.gz QEMWRZVPSMPGGW-SGWGQVFISA-N -1 3 373.460 3.860 20 0 FHADHM CC(C)CN(CC(C)(C)C)C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820081514 606811028 /nfs/dbraw/zinc/81/10/28/606811028.db2.gz JTODKYITMIMPTH-CQSZACIVSA-N -1 3 358.490 3.641 20 0 FHADHM CC(C)CN(CC(C)(C)C)C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820081514 606811030 /nfs/dbraw/zinc/81/10/30/606811030.db2.gz JTODKYITMIMPTH-CQSZACIVSA-N -1 3 358.490 3.641 20 0 FHADHM CC(C)CCc1noc(CSc2ccc(-c3nnn[n-]3)cc2Cl)n1 ZINC000820081729 606852935 /nfs/dbraw/zinc/85/29/35/606852935.db2.gz SLOXCMYXHSBAQB-UHFFFAOYSA-N -1 3 364.862 3.784 20 0 FHADHM CC(C)CCc1noc(CSc2ccc(-c3nn[n-]n3)cc2Cl)n1 ZINC000820081729 606852937 /nfs/dbraw/zinc/85/29/37/606852937.db2.gz SLOXCMYXHSBAQB-UHFFFAOYSA-N -1 3 364.862 3.784 20 0 FHADHM Cc1ccc(NCc2cccc(OCc3ccccc3-c3nn[n-]n3)c2)nc1 ZINC000822258812 606858654 /nfs/dbraw/zinc/85/86/54/606858654.db2.gz DJGLYRAOIPNCOE-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM CCN(C(=O)c1cc(F)c(C)cc1F)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821161517 606861511 /nfs/dbraw/zinc/86/15/11/606861511.db2.gz ZBLURPZQKLXQOX-LBPRGKRZSA-N -1 3 371.391 3.677 20 0 FHADHM CCN(C(=O)c1cc(F)c(C)cc1F)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821161517 606861512 /nfs/dbraw/zinc/86/15/12/606861512.db2.gz ZBLURPZQKLXQOX-LBPRGKRZSA-N -1 3 371.391 3.677 20 0 FHADHM CCc1noc(C)c1COc1ccc(-c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000821554554 606861516 /nfs/dbraw/zinc/86/15/16/606861516.db2.gz OHUXFDGCXWLZEX-UHFFFAOYSA-N -1 3 361.405 3.972 20 0 FHADHM CCc1noc(C)c1COc1ccc(-c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000821554554 606861518 /nfs/dbraw/zinc/86/15/18/606861518.db2.gz OHUXFDGCXWLZEX-UHFFFAOYSA-N -1 3 361.405 3.972 20 0 FHADHM CC[C@H](Sc1cc(-c2nnn[n-]2)ccn1)C(=O)c1ccc(Cl)cc1 ZINC000820937700 606866804 /nfs/dbraw/zinc/86/68/04/606866804.db2.gz CBJYOUVQHLEJJP-ZDUSSCGKSA-N -1 3 359.842 3.669 20 0 FHADHM CC[C@H](Sc1cc(-c2nn[n-]n2)ccn1)C(=O)c1ccc(Cl)cc1 ZINC000820937700 606866805 /nfs/dbraw/zinc/86/68/05/606866805.db2.gz CBJYOUVQHLEJJP-ZDUSSCGKSA-N -1 3 359.842 3.669 20 0 FHADHM CC(C)[C@@H]1c2ccccc2CCN1C(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000820051588 606869926 /nfs/dbraw/zinc/86/99/26/606869926.db2.gz RCFJMJZDPAYQOU-GOSISDBHSA-N -1 3 362.437 3.654 20 0 FHADHM CC(C)[C@@H]1c2ccccc2CCN1C(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000820051588 606869928 /nfs/dbraw/zinc/86/99/28/606869928.db2.gz RCFJMJZDPAYQOU-GOSISDBHSA-N -1 3 362.437 3.654 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)c1ccc(C(C)(C)C)s1 ZINC000821412964 606872191 /nfs/dbraw/zinc/87/21/91/606872191.db2.gz VDIGMTLMMJDUBW-UHFFFAOYSA-N -1 3 371.466 3.877 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)c1ccc(C(C)(C)C)s1 ZINC000821412964 606872189 /nfs/dbraw/zinc/87/21/89/606872189.db2.gz VDIGMTLMMJDUBW-UHFFFAOYSA-N -1 3 371.466 3.877 20 0 FHADHM Fc1cccc(N[C@H]2CC3(CCC3)Oc3ccccc32)c1-c1nnn[n-]1 ZINC000822791556 606879770 /nfs/dbraw/zinc/87/97/70/606879770.db2.gz JHPWGDKBHAXONY-HNNXBMFYSA-N -1 3 351.385 3.864 20 0 FHADHM Fc1cccc(N[C@H]2CC3(CCC3)Oc3ccccc32)c1-c1nn[n-]n1 ZINC000822791556 606879772 /nfs/dbraw/zinc/87/97/72/606879772.db2.gz JHPWGDKBHAXONY-HNNXBMFYSA-N -1 3 351.385 3.864 20 0 FHADHM CCc1nnc(S[C@H](C)c2ccc(F)cc2)c(-c2nnn[n-]2)c1CC ZINC000821547714 606925486 /nfs/dbraw/zinc/92/54/86/606925486.db2.gz ANPMNYIJGLAMIW-SNVBAGLBSA-N -1 3 358.446 3.774 20 0 FHADHM CCc1nnc(S[C@H](C)c2ccc(F)cc2)c(-c2nn[n-]n2)c1CC ZINC000821547714 606925487 /nfs/dbraw/zinc/92/54/87/606925487.db2.gz ANPMNYIJGLAMIW-SNVBAGLBSA-N -1 3 358.446 3.774 20 0 FHADHM Fc1ccc(CNc2ccccc2OC(F)(F)F)cc1-c1nnn[n-]1 ZINC000822771337 606926548 /nfs/dbraw/zinc/92/65/48/606926548.db2.gz GCOQZRRUZBTAOY-UHFFFAOYSA-N -1 3 353.279 3.517 20 0 FHADHM Fc1ccc(CNc2ccccc2OC(F)(F)F)cc1-c1nn[n-]n1 ZINC000822771337 606926550 /nfs/dbraw/zinc/92/65/50/606926550.db2.gz GCOQZRRUZBTAOY-UHFFFAOYSA-N -1 3 353.279 3.517 20 0 FHADHM Fc1ccc(CSC[C@@H]2OCCc3ccccc32)cc1-c1nnn[n-]1 ZINC000822774163 606927964 /nfs/dbraw/zinc/92/79/64/606927964.db2.gz GAZIYOBUFVHXJM-KRWDZBQOSA-N -1 3 356.426 3.553 20 0 FHADHM Fc1ccc(CSC[C@@H]2OCCc3ccccc32)cc1-c1nn[n-]n1 ZINC000822774163 606927966 /nfs/dbraw/zinc/92/79/66/606927966.db2.gz GAZIYOBUFVHXJM-KRWDZBQOSA-N -1 3 356.426 3.553 20 0 FHADHM Cc1ccc(NC(=O)C(C)C)cc1NCc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000822242510 606928062 /nfs/dbraw/zinc/92/80/62/606928062.db2.gz NIGMDFFITULQDH-UHFFFAOYSA-N -1 3 368.416 3.521 20 0 FHADHM Cc1ccc(NC(=O)C(C)C)cc1NCc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000822242510 606928063 /nfs/dbraw/zinc/92/80/63/606928063.db2.gz NIGMDFFITULQDH-UHFFFAOYSA-N -1 3 368.416 3.521 20 0 FHADHM Fc1ccc(NCc2ccc(F)c(-c3nnn[n-]3)c2)c(OCC2CC2)c1 ZINC000822782899 606929940 /nfs/dbraw/zinc/92/99/40/606929940.db2.gz LIRHNNBFHXMLRU-UHFFFAOYSA-N -1 3 357.364 3.546 20 0 FHADHM Fc1ccc(NCc2ccc(F)c(-c3nn[n-]n3)c2)c(OCC2CC2)c1 ZINC000822782899 606929941 /nfs/dbraw/zinc/92/99/41/606929941.db2.gz LIRHNNBFHXMLRU-UHFFFAOYSA-N -1 3 357.364 3.546 20 0 FHADHM CN(C(=O)CC(C)(C)c1ccccc1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821569428 606959322 /nfs/dbraw/zinc/95/93/22/606959322.db2.gz JYGHFUOTTKJILA-UHFFFAOYSA-N -1 3 369.856 3.851 20 0 FHADHM CN(C(=O)CC(C)(C)c1ccccc1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821569428 606959323 /nfs/dbraw/zinc/95/93/23/606959323.db2.gz JYGHFUOTTKJILA-UHFFFAOYSA-N -1 3 369.856 3.851 20 0 FHADHM CN(C(=O)c1cc2c(s1)CCCC2)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821573287 606962758 /nfs/dbraw/zinc/96/27/58/606962758.db2.gz JLKLOZPXKGQYLC-UHFFFAOYSA-N -1 3 373.869 3.737 20 0 FHADHM CN(C(=O)c1cc2c(s1)CCCC2)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821573287 606962760 /nfs/dbraw/zinc/96/27/60/606962760.db2.gz JLKLOZPXKGQYLC-UHFFFAOYSA-N -1 3 373.869 3.737 20 0 FHADHM CC(C)c1cccc(NC(=O)C(C)(C)Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000820198424 606981601 /nfs/dbraw/zinc/98/16/01/606981601.db2.gz VKRZDXNATZXQEG-UHFFFAOYSA-N -1 3 365.437 3.786 20 0 FHADHM CC(C)c1cccc(NC(=O)C(C)(C)Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000820198424 606981602 /nfs/dbraw/zinc/98/16/02/606981602.db2.gz VKRZDXNATZXQEG-UHFFFAOYSA-N -1 3 365.437 3.786 20 0 FHADHM Cc1ccccc1[C@@H](C)SCC(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000822345452 606989421 /nfs/dbraw/zinc/98/94/21/606989421.db2.gz JOHKCKIRUHGSTC-CYBMUJFWSA-N -1 3 353.451 3.608 20 0 FHADHM Cc1ccccc1[C@@H](C)SCC(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000822345452 606989423 /nfs/dbraw/zinc/98/94/23/606989423.db2.gz JOHKCKIRUHGSTC-CYBMUJFWSA-N -1 3 353.451 3.608 20 0 FHADHM Fc1ccc(CSc2nccn2Cc2ccccc2)cc1-c1nnn[n-]1 ZINC000822773986 607007317 /nfs/dbraw/zinc/00/73/17/607007317.db2.gz DHNWZBJXEHIFKO-UHFFFAOYSA-N -1 3 366.425 3.543 20 0 FHADHM Fc1ccc(CSc2nccn2Cc2ccccc2)cc1-c1nn[n-]n1 ZINC000822773986 607007319 /nfs/dbraw/zinc/00/73/19/607007319.db2.gz DHNWZBJXEHIFKO-UHFFFAOYSA-N -1 3 366.425 3.543 20 0 FHADHM CC=C(C=CC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)CC(C)C)CC ZINC000820827694 607015235 /nfs/dbraw/zinc/01/52/35/607015235.db2.gz WAQOOKPKEHGXFV-ASOSFMCKSA-N -1 3 353.470 3.764 20 0 FHADHM CC=C(C=CC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)CC(C)C)CC ZINC000820827694 607015236 /nfs/dbraw/zinc/01/52/36/607015236.db2.gz WAQOOKPKEHGXFV-ASOSFMCKSA-N -1 3 353.470 3.764 20 0 FHADHM CSc1ccc(NC(=O)[C@H](C)Sc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000821984324 607017206 /nfs/dbraw/zinc/01/72/06/607017206.db2.gz MNMIQRNMCWATGH-NSHDSACASA-N -1 3 371.491 3.708 20 0 FHADHM CSc1ccc(NC(=O)[C@H](C)Sc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000821984324 607017208 /nfs/dbraw/zinc/01/72/08/607017208.db2.gz MNMIQRNMCWATGH-NSHDSACASA-N -1 3 371.491 3.708 20 0 FHADHM Cc1ccc(NC(=O)[C@@H](C)Sc2cccc(-c3nnn[n-]3)c2)c(Cl)c1 ZINC000822242368 607017811 /nfs/dbraw/zinc/01/78/11/607017811.db2.gz JMHMCIBITFAMIY-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM Cc1ccc(NC(=O)[C@@H](C)Sc2cccc(-c3nn[n-]n3)c2)c(Cl)c1 ZINC000822242368 607017813 /nfs/dbraw/zinc/01/78/13/607017813.db2.gz JMHMCIBITFAMIY-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)C1(c2c(Cl)cccc2Cl)CC1 ZINC000468957181 607023212 /nfs/dbraw/zinc/02/32/12/607023212.db2.gz LMLFYAFZSGYHRF-UHFFFAOYSA-N -1 3 374.231 3.844 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)C1(c2c(Cl)cccc2Cl)CC1 ZINC000468957181 607023214 /nfs/dbraw/zinc/02/32/14/607023214.db2.gz LMLFYAFZSGYHRF-UHFFFAOYSA-N -1 3 374.231 3.844 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1CSCc1cnn(-c2ccccc2)c1 ZINC000822744132 607032969 /nfs/dbraw/zinc/03/29/69/607032969.db2.gz MXPADAGMNTUDGX-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CSCc1cnn(-c2ccccc2)c1 ZINC000822744132 607032971 /nfs/dbraw/zinc/03/29/71/607032971.db2.gz MXPADAGMNTUDGX-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)c(CSCc2cnn(-c3ccccc3)c2)c1 ZINC000822758553 607033936 /nfs/dbraw/zinc/03/39/36/607033936.db2.gz RICNSSIOJDCXJC-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)c(CSCc2cnn(-c3ccccc3)c2)c1 ZINC000822758553 607033938 /nfs/dbraw/zinc/03/39/38/607033938.db2.gz RICNSSIOJDCXJC-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM CC1(C)C[C@H](Nc2ncc(-c3nnn[n-]3)cc2Cl)c2ccc(F)cc2O1 ZINC000820590780 607041858 /nfs/dbraw/zinc/04/18/58/607041858.db2.gz ZQNQHAVHRIFPFI-ZDUSSCGKSA-N -1 3 374.807 3.769 20 0 FHADHM CC1(C)C[C@H](Nc2ncc(-c3nn[n-]n3)cc2Cl)c2ccc(F)cc2O1 ZINC000820590780 607041859 /nfs/dbraw/zinc/04/18/59/607041859.db2.gz ZQNQHAVHRIFPFI-ZDUSSCGKSA-N -1 3 374.807 3.769 20 0 FHADHM CCOc1cc(Cl)ccc1NC(=O)C=Cc1ccccc1-c1nnn[n-]1 ZINC000821395233 607054320 /nfs/dbraw/zinc/05/43/20/607054320.db2.gz TXIFXEWKQHJSAO-YFHOEESVSA-N -1 3 369.812 3.571 20 0 FHADHM CCOc1cc(Cl)ccc1NC(=O)C=Cc1ccccc1-c1nn[n-]n1 ZINC000821395233 607054322 /nfs/dbraw/zinc/05/43/22/607054322.db2.gz TXIFXEWKQHJSAO-YFHOEESVSA-N -1 3 369.812 3.571 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CN[C@H]1CCCOc2ccc(Cl)cc21 ZINC000822741514 607056871 /nfs/dbraw/zinc/05/68/71/607056871.db2.gz YCOKVRQJKSZUJF-INIZCTEOSA-N -1 3 373.819 3.663 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)c(CN(Cc2ccco2)Cc2cccs2)c1 ZINC000822757828 607057390 /nfs/dbraw/zinc/05/73/90/607057390.db2.gz FYLCIZVMHGLGBE-UHFFFAOYSA-N -1 3 369.425 3.863 20 0 FHADHM O=C(Cc1csc2ccccc12)OCc1cc(F)ccc1-c1nnn[n-]1 ZINC000823118795 607079803 /nfs/dbraw/zinc/07/98/03/607079803.db2.gz RAIUFRHEZSBLFN-UHFFFAOYSA-N -1 3 368.393 3.506 20 0 FHADHM O=C(Cc1csc2ccccc12)OCc1cc(F)ccc1-c1nn[n-]n1 ZINC000823118795 607079806 /nfs/dbraw/zinc/07/98/06/607079806.db2.gz RAIUFRHEZSBLFN-UHFFFAOYSA-N -1 3 368.393 3.506 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)O[C@@H]1CCc2sc(Cl)cc21 ZINC000822935218 607094058 /nfs/dbraw/zinc/09/40/58/607094058.db2.gz HFZQDNYUCMCTSZ-OQHXTRMZSA-N -1 3 372.837 3.826 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)O[C@@H]1CCc2sc(Cl)cc21 ZINC000822935218 607094060 /nfs/dbraw/zinc/09/40/60/607094060.db2.gz HFZQDNYUCMCTSZ-OQHXTRMZSA-N -1 3 372.837 3.826 20 0 FHADHM C[C@@H](Nc1ccn([C@H](C)c2ccccc2)n1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820461796 607112653 /nfs/dbraw/zinc/11/26/53/607112653.db2.gz QXWVRPIRYVVTPF-HUUCEWRRSA-N -1 3 359.437 3.846 20 0 FHADHM C[C@@H](Nc1ccn([C@H](C)c2ccccc2)n1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820461796 607112654 /nfs/dbraw/zinc/11/26/54/607112654.db2.gz QXWVRPIRYVVTPF-HUUCEWRRSA-N -1 3 359.437 3.846 20 0 FHADHM C[C@@H]1CN(c2cc(Cl)ccc2-c2nnn[n-]2)C[C@@H](c2ccsc2)O1 ZINC000820768318 607115744 /nfs/dbraw/zinc/11/57/44/607115744.db2.gz MNNVRRSDJJKCGM-BMIGLBTASA-N -1 3 361.858 3.548 20 0 FHADHM C[C@@H]1CN(c2cc(Cl)ccc2-c2nn[n-]n2)C[C@@H](c2ccsc2)O1 ZINC000820768318 607115745 /nfs/dbraw/zinc/11/57/45/607115745.db2.gz MNNVRRSDJJKCGM-BMIGLBTASA-N -1 3 361.858 3.548 20 0 FHADHM C[C@@H]1CN(c2ccc(-c3nnn[n-]3)c(Cl)c2)C[C@H](c2ccsc2)O1 ZINC000820768572 607116156 /nfs/dbraw/zinc/11/61/56/607116156.db2.gz ODCKUKXRWIDTNS-MEBBXXQBSA-N -1 3 361.858 3.548 20 0 FHADHM C[C@@H]1CN(c2ccc(-c3nn[n-]n3)c(Cl)c2)C[C@H](c2ccsc2)O1 ZINC000820768572 607116157 /nfs/dbraw/zinc/11/61/57/607116157.db2.gz ODCKUKXRWIDTNS-MEBBXXQBSA-N -1 3 361.858 3.548 20 0 FHADHM Clc1ccc(N2CCC3(CC2)OCc2ccccc23)c(-c2nnn[n-]2)c1 ZINC000822574085 607119479 /nfs/dbraw/zinc/11/94/79/607119479.db2.gz NZCCBEJLKIADFN-UHFFFAOYSA-N -1 3 367.840 3.546 20 0 FHADHM Clc1ccc(N2CCC3(CC2)OCc2ccccc23)c(-c2nn[n-]n2)c1 ZINC000822574085 607119481 /nfs/dbraw/zinc/11/94/81/607119481.db2.gz NZCCBEJLKIADFN-UHFFFAOYSA-N -1 3 367.840 3.546 20 0 FHADHM C[C@H](OC1CCCCCC1)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820518559 607149455 /nfs/dbraw/zinc/14/94/55/607149455.db2.gz GQENIBPSSPVCFE-NSHDSACASA-N -1 3 363.849 3.587 20 0 FHADHM C[C@H](OC1CCCCCC1)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820518559 607149457 /nfs/dbraw/zinc/14/94/57/607149457.db2.gz GQENIBPSSPVCFE-NSHDSACASA-N -1 3 363.849 3.587 20 0 FHADHM Cc1sc(NC(=O)[C@@H](C)OC2CCCCCC2)c(-c2nnn[n-]2)c1C ZINC000822556937 607151475 /nfs/dbraw/zinc/15/14/75/607151475.db2.gz DJYNBVCSESDPGG-LLVKDONJSA-N -1 3 363.487 3.611 20 0 FHADHM Cc1sc(NC(=O)[C@@H](C)OC2CCCCCC2)c(-c2nn[n-]n2)c1C ZINC000822556937 607151476 /nfs/dbraw/zinc/15/14/76/607151476.db2.gz DJYNBVCSESDPGG-LLVKDONJSA-N -1 3 363.487 3.611 20 0 FHADHM CCCCC[C@H]1CCCN1C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821050911 607153259 /nfs/dbraw/zinc/15/32/59/607153259.db2.gz VNJYKXMJHNGGGT-PBHICJAKSA-N -1 3 356.474 3.682 20 0 FHADHM CCCCC[C@H]1CCCN1C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821050911 607153261 /nfs/dbraw/zinc/15/32/61/607153261.db2.gz VNJYKXMJHNGGGT-PBHICJAKSA-N -1 3 356.474 3.682 20 0 FHADHM CCCCC[C@@H]1CCCN1C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821048603 607153544 /nfs/dbraw/zinc/15/35/44/607153544.db2.gz CZTIIMKYLBVAFL-WMLDXEAASA-N -1 3 356.474 3.682 20 0 FHADHM CCCCC[C@@H]1CCCN1C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821048603 607153545 /nfs/dbraw/zinc/15/35/45/607153545.db2.gz CZTIIMKYLBVAFL-WMLDXEAASA-N -1 3 356.474 3.682 20 0 FHADHM CCc1oc(C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)CC(C)C)cc1C ZINC000821559250 607153975 /nfs/dbraw/zinc/15/39/75/607153975.db2.gz YOKRHRMYNZSUHC-UHFFFAOYSA-N -1 3 367.453 3.629 20 0 FHADHM CCc1oc(C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)CC(C)C)cc1C ZINC000821559250 607153977 /nfs/dbraw/zinc/15/39/77/607153977.db2.gz YOKRHRMYNZSUHC-UHFFFAOYSA-N -1 3 367.453 3.629 20 0 FHADHM CCN(C(=O)c1ccc(F)c(Cl)c1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821160755 607156400 /nfs/dbraw/zinc/15/64/00/607156400.db2.gz PNIBTMRJDZZRPE-LLVKDONJSA-N -1 3 373.819 3.883 20 0 FHADHM CCN(C(=O)c1ccc(F)c(Cl)c1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821160755 607156401 /nfs/dbraw/zinc/15/64/01/607156401.db2.gz PNIBTMRJDZZRPE-LLVKDONJSA-N -1 3 373.819 3.883 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)c2ccc3sccc3c2)s1 ZINC000821465367 607157428 /nfs/dbraw/zinc/15/74/28/607157428.db2.gz FXGZXKOZDXDZNJ-UHFFFAOYSA-N -1 3 355.448 3.958 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)c2ccc3sccc3c2)s1 ZINC000821465367 607157429 /nfs/dbraw/zinc/15/74/29/607157429.db2.gz FXGZXKOZDXDZNJ-UHFFFAOYSA-N -1 3 355.448 3.958 20 0 FHADHM Cc1ccccc1-c1nc(CSc2ccc(-c3nnn[n-]3)cc2F)no1 ZINC000822345843 607157881 /nfs/dbraw/zinc/15/78/81/607157881.db2.gz UFHRHKIYDRVMEC-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM Cc1ccccc1-c1nc(CSc2ccc(-c3nn[n-]n3)cc2F)no1 ZINC000822345843 607157883 /nfs/dbraw/zinc/15/78/83/607157883.db2.gz UFHRHKIYDRVMEC-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1OCc1csc(Nc2ccccc2)n1 ZINC000822748242 607170866 /nfs/dbraw/zinc/17/08/66/607170866.db2.gz OUAZSALFODWZFO-UHFFFAOYSA-N -1 3 368.397 3.785 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1OCc1csc(Nc2ccccc2)n1 ZINC000822748242 607170867 /nfs/dbraw/zinc/17/08/67/607170867.db2.gz OUAZSALFODWZFO-UHFFFAOYSA-N -1 3 368.397 3.785 20 0 FHADHM Cc1noc(C)c1[C@H](C)Nc1ccc(C(F)(F)F)cc1-c1nnn[n-]1 ZINC000822519400 607174133 /nfs/dbraw/zinc/17/41/33/607174133.db2.gz FRBDXVFZVUTUKU-ZETCQYMHSA-N -1 3 352.320 3.663 20 0 FHADHM Cc1noc(C)c1[C@H](C)Nc1ccc(C(F)(F)F)cc1-c1nn[n-]n1 ZINC000822519400 607174134 /nfs/dbraw/zinc/17/41/34/607174134.db2.gz FRBDXVFZVUTUKU-ZETCQYMHSA-N -1 3 352.320 3.663 20 0 FHADHM COc1ccccc1C(C)=CC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000821882947 607189084 /nfs/dbraw/zinc/18/90/84/607189084.db2.gz OEBMFXCPXCBRAC-LUAWRHEFSA-N -1 3 369.812 3.571 20 0 FHADHM COc1ccccc1C(C)=CC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000821882947 607189085 /nfs/dbraw/zinc/18/90/85/607189085.db2.gz OEBMFXCPXCBRAC-LUAWRHEFSA-N -1 3 369.812 3.571 20 0 FHADHM Cc1ccc(C)c(OCCC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)c1 ZINC000822231893 607189114 /nfs/dbraw/zinc/18/91/14/607189114.db2.gz LGWRKYVAXLLFAO-UHFFFAOYSA-N -1 3 371.828 3.545 20 0 FHADHM Cc1ccc(C)c(OCCC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)c1 ZINC000822231893 607189115 /nfs/dbraw/zinc/18/91/15/607189115.db2.gz LGWRKYVAXLLFAO-UHFFFAOYSA-N -1 3 371.828 3.545 20 0 FHADHM O=C(Cc1ccc2c(c1)CCCC2)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000823082841 607192013 /nfs/dbraw/zinc/19/20/13/607192013.db2.gz SQGWAUUBEJHJLV-UHFFFAOYSA-N -1 3 367.840 3.580 20 0 FHADHM O=C(Cc1ccc2c(c1)CCCC2)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000823082841 607192014 /nfs/dbraw/zinc/19/20/14/607192014.db2.gz SQGWAUUBEJHJLV-UHFFFAOYSA-N -1 3 367.840 3.580 20 0 FHADHM Cc1ccc(NC(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)c(O)c1 ZINC000822254788 607192647 /nfs/dbraw/zinc/19/26/47/607192647.db2.gz RHAMRNHMAFXEKI-UHFFFAOYSA-N -1 3 371.400 3.800 20 0 FHADHM Cc1ccc(NC(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)c(O)c1 ZINC000822254788 607192648 /nfs/dbraw/zinc/19/26/48/607192648.db2.gz RHAMRNHMAFXEKI-UHFFFAOYSA-N -1 3 371.400 3.800 20 0 FHADHM C[C@@H]1Cc2ccccc2[C@H]1NC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820813639 607195652 /nfs/dbraw/zinc/19/56/52/607195652.db2.gz LIGRLLDLZOLYMV-HWPZZCPQSA-N -1 3 368.828 3.575 20 0 FHADHM C[C@@H]1Cc2ccccc2[C@H]1NC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820813639 607195653 /nfs/dbraw/zinc/19/56/53/607195653.db2.gz LIGRLLDLZOLYMV-HWPZZCPQSA-N -1 3 368.828 3.575 20 0 FHADHM CC(C)(NC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1cccs1 ZINC000819987692 607197006 /nfs/dbraw/zinc/19/70/06/607197006.db2.gz GTUHJRYJIRFSJN-UHFFFAOYSA-N -1 3 362.846 3.638 20 0 FHADHM CC(C)(NC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1cccs1 ZINC000819987692 607197007 /nfs/dbraw/zinc/19/70/07/607197007.db2.gz GTUHJRYJIRFSJN-UHFFFAOYSA-N -1 3 362.846 3.638 20 0 FHADHM CC(C)(NC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccc(F)cc1 ZINC000819987780 607197943 /nfs/dbraw/zinc/19/79/43/607197943.db2.gz LOWNSXAJCCLZBL-UHFFFAOYSA-N -1 3 374.807 3.716 20 0 FHADHM CC(C)(NC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccc(F)cc1 ZINC000819987780 607197944 /nfs/dbraw/zinc/19/79/44/607197944.db2.gz LOWNSXAJCCLZBL-UHFFFAOYSA-N -1 3 374.807 3.716 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N1CCC[C@@]2(CC=CCC2)C1 ZINC000823315349 607202045 /nfs/dbraw/zinc/20/20/45/607202045.db2.gz XKDFYBWIHZOHDW-SFHVURJKSA-N -1 3 372.860 3.874 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N1CCC[C@@]2(CC=CCC2)C1 ZINC000823315349 607202046 /nfs/dbraw/zinc/20/20/46/607202046.db2.gz XKDFYBWIHZOHDW-SFHVURJKSA-N -1 3 372.860 3.874 20 0 FHADHM C[C@H](CN(C)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccccc1 ZINC000820252474 607202406 /nfs/dbraw/zinc/20/24/06/607202406.db2.gz ATWHLNMPZDFZHY-GFCCVEGCSA-N -1 3 370.844 3.788 20 0 FHADHM C[C@H](CN(C)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccccc1 ZINC000820252474 607202407 /nfs/dbraw/zinc/20/24/07/607202407.db2.gz ATWHLNMPZDFZHY-GFCCVEGCSA-N -1 3 370.844 3.788 20 0 FHADHM Cc1ccc(CN(C)C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)s1 ZINC000822236307 607202700 /nfs/dbraw/zinc/20/27/00/607202700.db2.gz TTWHZZZXHGYLIZ-UHFFFAOYSA-N -1 3 362.846 3.554 20 0 FHADHM Cc1ccc(CN(C)C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)s1 ZINC000822236307 607202701 /nfs/dbraw/zinc/20/27/01/607202701.db2.gz TTWHZZZXHGYLIZ-UHFFFAOYSA-N -1 3 362.846 3.554 20 0 FHADHM C[C@H](c1ccco1)N(C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)C1CC1 ZINC000820570836 607203363 /nfs/dbraw/zinc/20/33/63/607203363.db2.gz RIGURSCQEITTFU-SNVBAGLBSA-N -1 3 372.816 3.871 20 0 FHADHM C[C@H](c1ccco1)N(C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)C1CC1 ZINC000820570836 607203364 /nfs/dbraw/zinc/20/33/64/607203364.db2.gz RIGURSCQEITTFU-SNVBAGLBSA-N -1 3 372.816 3.871 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N(C1CC1)C1CCCCC1 ZINC000823313631 607204103 /nfs/dbraw/zinc/20/41/03/607204103.db2.gz GOHZUPVQMABHIJ-UHFFFAOYSA-N -1 3 360.849 3.849 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N(C1CC1)C1CCCCC1 ZINC000823313631 607204104 /nfs/dbraw/zinc/20/41/04/607204104.db2.gz GOHZUPVQMABHIJ-UHFFFAOYSA-N -1 3 360.849 3.849 20 0 FHADHM O=C(C=Cc1ccccc1Cl)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822934721 607240775 /nfs/dbraw/zinc/24/07/75/607240775.db2.gz CZFCXBFUVCQSPD-SOFGYWHQSA-N -1 3 360.204 3.825 20 0 FHADHM O=C(C=Cc1ccccc1Cl)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822934721 607240776 /nfs/dbraw/zinc/24/07/76/607240776.db2.gz CZFCXBFUVCQSPD-SOFGYWHQSA-N -1 3 360.204 3.825 20 0 FHADHM CC[C@H](C)Oc1ccc(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000820876556 607241266 /nfs/dbraw/zinc/24/12/66/607241266.db2.gz REDUAVWPKSNVDM-NSHDSACASA-N -1 3 371.828 3.950 20 0 FHADHM CC[C@H](C)Oc1ccc(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000820876556 607241267 /nfs/dbraw/zinc/24/12/67/607241267.db2.gz REDUAVWPKSNVDM-NSHDSACASA-N -1 3 371.828 3.950 20 0 FHADHM Cc1c2ccccc2oc1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822020851 607241587 /nfs/dbraw/zinc/24/15/87/607241587.db2.gz LFEMKZSOVUJCMO-UHFFFAOYSA-N -1 3 353.769 3.827 20 0 FHADHM Cc1c2ccccc2oc1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822020851 607241588 /nfs/dbraw/zinc/24/15/88/607241588.db2.gz LFEMKZSOVUJCMO-UHFFFAOYSA-N -1 3 353.769 3.827 20 0 FHADHM O=C(Cc1coc2cc(F)ccc12)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000823118953 607242733 /nfs/dbraw/zinc/24/27/33/607242733.db2.gz WZZXRIFNUFZKJK-UHFFFAOYSA-N -1 3 371.759 3.587 20 0 FHADHM O=C(Cc1coc2cc(F)ccc12)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000823118953 607242734 /nfs/dbraw/zinc/24/27/34/607242734.db2.gz WZZXRIFNUFZKJK-UHFFFAOYSA-N -1 3 371.759 3.587 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)C1(c2ccc(Cl)cc2)CC1 ZINC000823313491 607243205 /nfs/dbraw/zinc/24/32/05/607243205.db2.gz CIIXPBDZIHNWGS-UHFFFAOYSA-N -1 3 374.231 3.844 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)C1(c2ccc(Cl)cc2)CC1 ZINC000823313491 607243206 /nfs/dbraw/zinc/24/32/06/607243206.db2.gz CIIXPBDZIHNWGS-UHFFFAOYSA-N -1 3 374.231 3.844 20 0 FHADHM CCC1(CC)CN(C(=O)c2cc(-c3nnn[n-]3)cs2)c2ccccc21 ZINC000825170598 607773678 /nfs/dbraw/zinc/77/36/78/607773678.db2.gz DEDUCTJWIMFWKL-UHFFFAOYSA-N -1 3 353.451 3.646 20 0 FHADHM O=C(Nc1ccccc1-c1nnn[n-]1)c1ccc(CCC(F)(F)F)cc1 ZINC000826456852 607782959 /nfs/dbraw/zinc/78/29/59/607782959.db2.gz AVXVDSJHPGFVEP-UHFFFAOYSA-N -1 3 361.327 3.614 20 0 FHADHM O=C(Nc1ccccc1-c1nn[n-]n1)c1ccc(CCC(F)(F)F)cc1 ZINC000826456852 607782960 /nfs/dbraw/zinc/78/29/60/607782960.db2.gz AVXVDSJHPGFVEP-UHFFFAOYSA-N -1 3 361.327 3.614 20 0 FHADHM C[C@@H]1CC[C@@H](NC(=S)Nc2ccccc2-c2nnn[n-]2)c2ccccc21 ZINC000824917796 607783756 /nfs/dbraw/zinc/78/37/56/607783756.db2.gz NQYCKVVNEWICRG-SJKOYZFVSA-N -1 3 364.478 3.792 20 0 FHADHM C[C@@H]1CC[C@@H](NC(=S)Nc2ccccc2-c2nn[n-]n2)c2ccccc21 ZINC000824917796 607783757 /nfs/dbraw/zinc/78/37/57/607783757.db2.gz NQYCKVVNEWICRG-SJKOYZFVSA-N -1 3 364.478 3.792 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@@H](C)c2ccccc2F)cc1-c1nnn[n-]1 ZINC000825553019 607784040 /nfs/dbraw/zinc/78/40/40/607784040.db2.gz IALOTWNPJBCURP-NSHDSACASA-N -1 3 370.388 3.747 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@@H](C)c2ccccc2F)cc1-c1nn[n-]n1 ZINC000825553019 607784041 /nfs/dbraw/zinc/78/40/41/607784041.db2.gz IALOTWNPJBCURP-NSHDSACASA-N -1 3 370.388 3.747 20 0 FHADHM Cc1c(C(=O)N(C)c2ccccc2-c2nnn[n-]2)sc2cccc(F)c12 ZINC000826234433 607786587 /nfs/dbraw/zinc/78/65/87/607786587.db2.gz WEINQGSJYAENPG-UHFFFAOYSA-N -1 3 367.409 3.806 20 0 FHADHM Cc1c(C(=O)N(C)c2ccccc2-c2nn[n-]n2)sc2cccc(F)c12 ZINC000826234433 607786588 /nfs/dbraw/zinc/78/65/88/607786588.db2.gz WEINQGSJYAENPG-UHFFFAOYSA-N -1 3 367.409 3.806 20 0 FHADHM CCN(C(=O)c1oc2ccc(F)cc2c1C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825390480 607795826 /nfs/dbraw/zinc/79/58/26/607795826.db2.gz GSLYTTIKPORCDJ-UHFFFAOYSA-N -1 3 365.368 3.727 20 0 FHADHM CCN(C(=O)c1oc2ccc(F)cc2c1C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825390480 607795827 /nfs/dbraw/zinc/79/58/27/607795827.db2.gz GSLYTTIKPORCDJ-UHFFFAOYSA-N -1 3 365.368 3.727 20 0 FHADHM CCN(C(=O)CCCc1ccc(C)s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825372485 607796604 /nfs/dbraw/zinc/79/66/04/607796604.db2.gz ZVJLGONXFARTQP-UHFFFAOYSA-N -1 3 355.467 3.612 20 0 FHADHM CCN(C(=O)CCCc1ccc(C)s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825372485 607796605 /nfs/dbraw/zinc/79/66/05/607796605.db2.gz ZVJLGONXFARTQP-UHFFFAOYSA-N -1 3 355.467 3.612 20 0 FHADHM CCN(C(=O)[C@@H](C)CCc1cccc(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825362585 607797911 /nfs/dbraw/zinc/79/79/11/607797911.db2.gz POAIDVJWVLQCQW-AWEZNQCLSA-N -1 3 367.428 3.628 20 0 FHADHM CCN(C(=O)[C@@H](C)CCc1cccc(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825362585 607797912 /nfs/dbraw/zinc/79/79/12/607797912.db2.gz POAIDVJWVLQCQW-AWEZNQCLSA-N -1 3 367.428 3.628 20 0 FHADHM CCCCOc1ccc(C(=O)N(CC)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000825291568 607799560 /nfs/dbraw/zinc/79/95/60/607799560.db2.gz TWMWBLGJGRHSFK-UHFFFAOYSA-N -1 3 365.437 3.712 20 0 FHADHM CCCCOc1ccc(C(=O)N(CC)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000825291568 607799561 /nfs/dbraw/zinc/79/95/61/607799561.db2.gz TWMWBLGJGRHSFK-UHFFFAOYSA-N -1 3 365.437 3.712 20 0 FHADHM CCN(C(=O)c1csc2c1CC[C@H](C)C2)c1ccc(-c2nnn[n-]2)cc1 ZINC000825391093 607799622 /nfs/dbraw/zinc/79/96/22/607799622.db2.gz UVTJGUYOWJIXDS-LBPRGKRZSA-N -1 3 367.478 3.720 20 0 FHADHM CCN(C(=O)c1csc2c1CC[C@H](C)C2)c1ccc(-c2nn[n-]n2)cc1 ZINC000825391093 607799623 /nfs/dbraw/zinc/79/96/23/607799623.db2.gz UVTJGUYOWJIXDS-LBPRGKRZSA-N -1 3 367.478 3.720 20 0 FHADHM O=C(CSc1ccc(-c2nnn[n-]2)cc1Cl)c1ccc(F)c(F)c1 ZINC000826420881 607844952 /nfs/dbraw/zinc/84/49/52/607844952.db2.gz HJSAAYNQJFZXJK-UHFFFAOYSA-N -1 3 366.780 3.773 20 0 FHADHM O=C(CSc1ccc(-c2nn[n-]n2)cc1Cl)c1ccc(F)c(F)c1 ZINC000826420881 607844953 /nfs/dbraw/zinc/84/49/53/607844953.db2.gz HJSAAYNQJFZXJK-UHFFFAOYSA-N -1 3 366.780 3.773 20 0 FHADHM C[C@H]1OCC[C@@H]1SCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000825019254 607845890 /nfs/dbraw/zinc/84/58/90/607845890.db2.gz CPSWSMNORIVUIS-ACJLOTCBSA-N -1 3 352.463 3.944 20 0 FHADHM C[C@H]1OCC[C@@H]1SCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000825019254 607845891 /nfs/dbraw/zinc/84/58/91/607845891.db2.gz CPSWSMNORIVUIS-ACJLOTCBSA-N -1 3 352.463 3.944 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000823943922 607881177 /nfs/dbraw/zinc/88/11/77/607881177.db2.gz VFAOMYIMLWIBSF-YLGBQOPLSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000823943922 607881178 /nfs/dbraw/zinc/88/11/78/607881178.db2.gz VFAOMYIMLWIBSF-YLGBQOPLSA-N -1 3 367.840 3.801 20 0 FHADHM CCC(C)(C)c1ccc(C(=O)N2CCc3ccc(-c4nnn[n-]4)cc32)cc1 ZINC000825044086 607952175 /nfs/dbraw/zinc/95/21/75/607952175.db2.gz NUIBZFSJLKKPNW-UHFFFAOYSA-N -1 3 361.449 3.757 20 0 FHADHM CCC(C)(C)c1ccc(C(=O)N2CCc3ccc(-c4nn[n-]n4)cc32)cc1 ZINC000825044086 607952176 /nfs/dbraw/zinc/95/21/76/607952176.db2.gz NUIBZFSJLKKPNW-UHFFFAOYSA-N -1 3 361.449 3.757 20 0 FHADHM Cc1nnc(SCc2ccc(-c3nnn[n-]3)cc2)n1[C@@H]1CCC[C@@H](C)C1 ZINC000826337428 607965953 /nfs/dbraw/zinc/96/59/53/607965953.db2.gz NVUWJHGTSNKFTI-MLGOLLRUSA-N -1 3 369.498 3.810 20 0 FHADHM Cc1nnc(SCc2ccc(-c3nn[n-]n3)cc2)n1[C@@H]1CCC[C@@H](C)C1 ZINC000826337428 607965954 /nfs/dbraw/zinc/96/59/54/607965954.db2.gz NVUWJHGTSNKFTI-MLGOLLRUSA-N -1 3 369.498 3.810 20 0 FHADHM CCc1onc(C)c1NC(=O)c1ccccc1-c1ccccc1-c1nnn[n-]1 ZINC000825782601 608009035 /nfs/dbraw/zinc/00/90/35/608009035.db2.gz IQPODVJCLHZLDJ-UHFFFAOYSA-N -1 3 374.404 3.645 20 0 FHADHM CCc1onc(C)c1NC(=O)c1ccccc1-c1ccccc1-c1nn[n-]n1 ZINC000825782601 608009036 /nfs/dbraw/zinc/00/90/36/608009036.db2.gz IQPODVJCLHZLDJ-UHFFFAOYSA-N -1 3 374.404 3.645 20 0 FHADHM CCc1noc(-c2ccc(Oc3ccccc3-c3nnn[n-]3)c(Cl)c2)n1 ZINC000825771893 608050257 /nfs/dbraw/zinc/05/02/57/608050257.db2.gz UWCXEWFYOGSSDM-UHFFFAOYSA-N -1 3 368.784 3.925 20 0 FHADHM CCc1noc(-c2ccc(Oc3ccccc3-c3nn[n-]n3)c(Cl)c2)n1 ZINC000825771893 608050258 /nfs/dbraw/zinc/05/02/58/608050258.db2.gz UWCXEWFYOGSSDM-UHFFFAOYSA-N -1 3 368.784 3.925 20 0 FHADHM CCCN(C)C(=O)c1ccc(Oc2ccccc2-c2nnn[n-]2)c(Cl)c1 ZINC000825301013 608060163 /nfs/dbraw/zinc/06/01/63/608060163.db2.gz HDPDWIYYASFYNB-UHFFFAOYSA-N -1 3 371.828 3.794 20 0 FHADHM CCCN(C)C(=O)c1ccc(Oc2ccccc2-c2nn[n-]n2)c(Cl)c1 ZINC000825301013 608060164 /nfs/dbraw/zinc/06/01/64/608060164.db2.gz HDPDWIYYASFYNB-UHFFFAOYSA-N -1 3 371.828 3.794 20 0 FHADHM C[C@H](c1cccc(Cl)c1)N1CCO[C@H](c2cccc(-c3nnn[n-]3)c2)C1 ZINC000824770481 608066236 /nfs/dbraw/zinc/06/62/36/608066236.db2.gz KZGIFQWYUYDXRE-ACJLOTCBSA-N -1 3 369.856 3.655 20 0 FHADHM C[C@H](c1cccc(Cl)c1)N1CCO[C@H](c2cccc(-c3nn[n-]n3)c2)C1 ZINC000824770481 608066237 /nfs/dbraw/zinc/06/62/37/608066237.db2.gz KZGIFQWYUYDXRE-ACJLOTCBSA-N -1 3 369.856 3.655 20 0 FHADHM CC(C)Oc1c(F)cc(NCc2ccc(-c3nnn[n-]3)s2)cc1F ZINC000824315091 608134327 /nfs/dbraw/zinc/13/43/27/608134327.db2.gz KDIQPRDKHMIOAF-UHFFFAOYSA-N -1 3 351.382 3.606 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)CCCC(F)(F)F ZINC000824255434 608149840 /nfs/dbraw/zinc/14/98/40/608149840.db2.gz JPSOMGLQHLHCJE-UHFFFAOYSA-N -1 3 369.391 3.584 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)CCCC(F)(F)F ZINC000824255434 608149841 /nfs/dbraw/zinc/14/98/41/608149841.db2.gz JPSOMGLQHLHCJE-UHFFFAOYSA-N -1 3 369.391 3.584 20 0 FHADHM CCN(C(=O)c1cc(C)c(F)c(C)c1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825379667 608151312 /nfs/dbraw/zinc/15/13/12/608151312.db2.gz JROLLTQWRXBDOU-AWEZNQCLSA-N -1 3 367.428 3.846 20 0 FHADHM CCN(C(=O)c1cc(C)c(F)c(C)c1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825379667 608151313 /nfs/dbraw/zinc/15/13/13/608151313.db2.gz JROLLTQWRXBDOU-AWEZNQCLSA-N -1 3 367.428 3.846 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@H](C)c2c(F)cccc2F)s1 ZINC000825694137 608155285 /nfs/dbraw/zinc/15/52/85/608155285.db2.gz LJEUJLBSAFLKFA-MRVPVSSYSA-N -1 3 363.393 3.511 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@H](C)c2c(F)cccc2F)s1 ZINC000825694137 608155286 /nfs/dbraw/zinc/15/52/86/608155286.db2.gz LJEUJLBSAFLKFA-MRVPVSSYSA-N -1 3 363.393 3.511 20 0 FHADHM C[C@H](NCc1ncc(-c2ccccc2)s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824633078 608157680 /nfs/dbraw/zinc/15/76/80/608157680.db2.gz HETPYTWPSRMVLE-ZDUSSCGKSA-N -1 3 362.462 3.841 20 0 FHADHM CC[C@@H](Oc1cccc(C)c1)C(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000825159156 608182365 /nfs/dbraw/zinc/18/23/65/608182365.db2.gz KDWKXEFCXLHLMV-RDTXWAMCSA-N -1 3 366.421 3.637 20 0 FHADHM CC[C@@H](Oc1cccc(C)c1)C(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000825159156 608182367 /nfs/dbraw/zinc/18/23/67/608182367.db2.gz KDWKXEFCXLHLMV-RDTXWAMCSA-N -1 3 366.421 3.637 20 0 FHADHM C[C@H](OC(=O)c1cc(F)c(F)cc1Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000824722462 608185347 /nfs/dbraw/zinc/18/53/47/608185347.db2.gz IXTIDBNKTLPJKL-QMMMGPOBSA-N -1 3 364.739 3.716 20 0 FHADHM C[C@H](OC(=O)c1cc(F)c(F)cc1Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000824722462 608185350 /nfs/dbraw/zinc/18/53/50/608185350.db2.gz IXTIDBNKTLPJKL-QMMMGPOBSA-N -1 3 364.739 3.716 20 0 FHADHM Cc1cccc(C2=CCN(C(=O)Nc3cc(-c4nnn[n-]4)ccc3C)CC2)c1 ZINC000826297911 608206440 /nfs/dbraw/zinc/20/64/40/608206440.db2.gz WNTACNCWMJNVFA-UHFFFAOYSA-N -1 3 374.448 3.805 20 0 FHADHM Cc1cccc(C2=CCN(C(=O)Nc3cc(-c4nn[n-]n4)ccc3C)CC2)c1 ZINC000826297911 608206441 /nfs/dbraw/zinc/20/64/41/608206441.db2.gz WNTACNCWMJNVFA-UHFFFAOYSA-N -1 3 374.448 3.805 20 0 FHADHM Cc1ccc(C)c(NC(=O)CSc2cccc(Cl)c2-c2nnn[n-]2)c1 ZINC000826284972 608206518 /nfs/dbraw/zinc/20/65/18/608206518.db2.gz MJSIWZQNAYLIGM-UHFFFAOYSA-N -1 3 373.869 3.868 20 0 FHADHM Cc1ccc(C)c(NC(=O)CSc2cccc(Cl)c2-c2nn[n-]n2)c1 ZINC000826284972 608206519 /nfs/dbraw/zinc/20/65/19/608206519.db2.gz MJSIWZQNAYLIGM-UHFFFAOYSA-N -1 3 373.869 3.868 20 0 FHADHM CC(C)N(C(=O)[C@@H](C)Sc1cccc(Cl)c1-c1nnn[n-]1)C(C)C ZINC000824756571 608206866 /nfs/dbraw/zinc/20/68/66/608206866.db2.gz PADHLKWOIWDHDA-LLVKDONJSA-N -1 3 367.906 3.646 20 0 FHADHM CC(C)N(C(=O)[C@@H](C)Sc1cccc(Cl)c1-c1nn[n-]n1)C(C)C ZINC000824756571 608206869 /nfs/dbraw/zinc/20/68/69/608206869.db2.gz PADHLKWOIWDHDA-LLVKDONJSA-N -1 3 367.906 3.646 20 0 FHADHM Cc1cnn(CCCCCSc2cccc(Cl)c2-c2nnn[n-]2)c1 ZINC000826320214 608207888 /nfs/dbraw/zinc/20/78/88/608207888.db2.gz JQHARIIUXISTHK-UHFFFAOYSA-N -1 3 362.890 3.988 20 0 FHADHM Cc1cnn(CCCCCSc2cccc(Cl)c2-c2nn[n-]n2)c1 ZINC000826320214 608207889 /nfs/dbraw/zinc/20/78/89/608207889.db2.gz JQHARIIUXISTHK-UHFFFAOYSA-N -1 3 362.890 3.988 20 0 FHADHM COc1ccc(F)cc1[C@H](C)Nc1ccc2cc(-c3nnn[n-]3)ccc2n1 ZINC000826209399 608223355 /nfs/dbraw/zinc/22/33/55/608223355.db2.gz ZZZUKZROLCTJIZ-NSHDSACASA-N -1 3 364.384 3.736 20 0 FHADHM COc1ccc(F)cc1[C@H](C)Nc1ccc2cc(-c3nn[n-]n3)ccc2n1 ZINC000826209399 608223357 /nfs/dbraw/zinc/22/33/57/608223357.db2.gz ZZZUKZROLCTJIZ-NSHDSACASA-N -1 3 364.384 3.736 20 0 FHADHM COc1ccccc1[C@H]1CCCN1c1ccc2cc(-c3nnn[n-]3)ccc2n1 ZINC000826218685 608226778 /nfs/dbraw/zinc/22/67/78/608226778.db2.gz IUYWZUQHELRTJA-GOSISDBHSA-N -1 3 372.432 3.765 20 0 FHADHM COc1ccccc1[C@H]1CCCN1c1ccc2cc(-c3nn[n-]n3)ccc2n1 ZINC000826218685 608226779 /nfs/dbraw/zinc/22/67/79/608226779.db2.gz IUYWZUQHELRTJA-GOSISDBHSA-N -1 3 372.432 3.765 20 0 FHADHM CCc1ccc([C@@H]2CCCN2c2ccc3cc(-c4nnn[n-]4)ccc3n2)o1 ZINC000825704953 608228426 /nfs/dbraw/zinc/22/84/26/608228426.db2.gz RLRPKABYZXFMNZ-KRWDZBQOSA-N -1 3 360.421 3.912 20 0 FHADHM CCc1ccc([C@@H]2CCCN2c2ccc3cc(-c4nn[n-]n4)ccc3n2)o1 ZINC000825704953 608228428 /nfs/dbraw/zinc/22/84/28/608228428.db2.gz RLRPKABYZXFMNZ-KRWDZBQOSA-N -1 3 360.421 3.912 20 0 FHADHM Cc1cnc([C@@H](Nc2ccc3cc(-c4nnn[n-]4)ccc3n2)C2CC2)s1 ZINC000826317439 608230759 /nfs/dbraw/zinc/23/07/59/608230759.db2.gz CURONSWFYFQPEG-INIZCTEOSA-N -1 3 363.450 3.743 20 0 FHADHM Cc1cnc([C@@H](Nc2ccc3cc(-c4nn[n-]n4)ccc3n2)C2CC2)s1 ZINC000826317439 608230761 /nfs/dbraw/zinc/23/07/61/608230761.db2.gz CURONSWFYFQPEG-INIZCTEOSA-N -1 3 363.450 3.743 20 0 FHADHM Cc1cccc([C@@H](Nc2ccc(F)cc2-c2nnn[n-]2)c2ccccn2)c1 ZINC000826297013 608231009 /nfs/dbraw/zinc/23/10/09/608231009.db2.gz RPEVSTXGYRQCFE-LJQANCHMSA-N -1 3 360.396 3.911 20 0 FHADHM Cc1cccc([C@@H](Nc2ccc(F)cc2-c2nn[n-]n2)c2ccccn2)c1 ZINC000826297013 608231011 /nfs/dbraw/zinc/23/10/11/608231011.db2.gz RPEVSTXGYRQCFE-LJQANCHMSA-N -1 3 360.396 3.911 20 0 FHADHM COc1ccc([C@H](OC)[C@H](C)Nc2cc(Cl)ccc2-c2nnn[n-]2)cc1 ZINC000826190163 608239616 /nfs/dbraw/zinc/23/96/16/608239616.db2.gz RRCQHELBMUDSBF-APPDUMDISA-N -1 3 373.844 3.717 20 0 FHADHM COc1ccc([C@H](OC)[C@H](C)Nc2cc(Cl)ccc2-c2nn[n-]n2)cc1 ZINC000826190163 608239617 /nfs/dbraw/zinc/23/96/17/608239617.db2.gz RRCQHELBMUDSBF-APPDUMDISA-N -1 3 373.844 3.717 20 0 FHADHM CC(C)[C@H]1C[C@@H](Nc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)CCO1 ZINC000824213327 608242049 /nfs/dbraw/zinc/24/20/49/608242049.db2.gz ABGRSIJQFRGLOL-SMDDNHRTSA-N -1 3 355.364 3.501 20 0 FHADHM C[C@H](CC(=O)Nc1ccc(F)cc1-c1nnn[n-]1)Cc1ccc(Cl)cc1 ZINC000824385313 608261618 /nfs/dbraw/zinc/26/16/18/608261618.db2.gz QBQXRSWSFRPDHH-NSHDSACASA-N -1 3 373.819 3.867 20 0 FHADHM C[C@H](CC(=O)Nc1ccc(F)cc1-c1nn[n-]n1)Cc1ccc(Cl)cc1 ZINC000824385313 608261619 /nfs/dbraw/zinc/26/16/19/608261619.db2.gz QBQXRSWSFRPDHH-NSHDSACASA-N -1 3 373.819 3.867 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CSc1nc(-c2ccccc2)c[nH]1 ZINC000826173478 608264217 /nfs/dbraw/zinc/26/42/17/608264217.db2.gz GEWOMOIEGGXMSK-UHFFFAOYSA-N -1 3 364.434 3.558 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CSc1nc(-c2ccccc2)c[nH]1 ZINC000826173478 608264219 /nfs/dbraw/zinc/26/42/19/608264219.db2.gz GEWOMOIEGGXMSK-UHFFFAOYSA-N -1 3 364.434 3.558 20 0 FHADHM CN(C(=O)c1cc(-c2nnn[n-]2)cs1)c1c(Cl)cccc1Cl ZINC000825825421 608264960 /nfs/dbraw/zinc/26/49/60/608264960.db2.gz AUTUFWBBJDBOFP-UHFFFAOYSA-N -1 3 354.222 3.512 20 0 FHADHM CN(C(=O)c1cc(-c2nn[n-]n2)cs1)c1c(Cl)cccc1Cl ZINC000825825421 608264961 /nfs/dbraw/zinc/26/49/61/608264961.db2.gz AUTUFWBBJDBOFP-UHFFFAOYSA-N -1 3 354.222 3.512 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)c(NCc2ccc(COc3ccccc3)cc2)n1 ZINC000826276592 608274788 /nfs/dbraw/zinc/27/47/88/608274788.db2.gz NACCIAUNIYLBGM-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)c(NCc2ccc(COc3ccccc3)cc2)n1 ZINC000826276592 608274790 /nfs/dbraw/zinc/27/47/90/608274790.db2.gz NACCIAUNIYLBGM-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)c(N2Cc3ccccc3-c3ccccc3C2)n1 ZINC000826275393 608281992 /nfs/dbraw/zinc/28/19/92/608281992.db2.gz YFYISAWEZNOKIC-UHFFFAOYSA-N -1 3 354.417 3.757 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)c(N2Cc3ccccc3-c3ccccc3C2)n1 ZINC000826275393 608281993 /nfs/dbraw/zinc/28/19/93/608281993.db2.gz YFYISAWEZNOKIC-UHFFFAOYSA-N -1 3 354.417 3.757 20 0 FHADHM CCN(C(=O)c1csc(C)c1C)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825391245 608299234 /nfs/dbraw/zinc/29/92/34/608299234.db2.gz XDHPUCKOPFTMSO-LBPRGKRZSA-N -1 3 355.467 3.768 20 0 FHADHM CCN(C(=O)c1csc(C)c1C)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825391245 608299235 /nfs/dbraw/zinc/29/92/35/608299235.db2.gz XDHPUCKOPFTMSO-LBPRGKRZSA-N -1 3 355.467 3.768 20 0 FHADHM CCC(=CC(=O)NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1)CC ZINC000825028143 608303696 /nfs/dbraw/zinc/30/36/96/608303696.db2.gz FGRSYEVDBWZJOK-UHFFFAOYSA-N -1 3 361.449 3.896 20 0 FHADHM CCC(=CC(=O)NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1)CC ZINC000825028143 608303697 /nfs/dbraw/zinc/30/36/97/608303697.db2.gz FGRSYEVDBWZJOK-UHFFFAOYSA-N -1 3 361.449 3.896 20 0 FHADHM O=C(NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1)c1ccc(F)cc1 ZINC000826440808 608304078 /nfs/dbraw/zinc/30/40/78/608304078.db2.gz BDSNQBNAWGKXMP-UHFFFAOYSA-N -1 3 373.391 3.603 20 0 FHADHM O=C(NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1)c1ccc(F)cc1 ZINC000826440808 608304080 /nfs/dbraw/zinc/30/40/80/608304080.db2.gz BDSNQBNAWGKXMP-UHFFFAOYSA-N -1 3 373.391 3.603 20 0 FHADHM CS[C@@H](C)CCC(=O)N(Cc1ccco1)c1ccccc1-c1nnn[n-]1 ZINC000826226100 608340621 /nfs/dbraw/zinc/34/06/21/608340621.db2.gz RYVHIVSOFHKDFP-ZDUSSCGKSA-N -1 3 371.466 3.525 20 0 FHADHM CS[C@@H](C)CCC(=O)N(Cc1ccco1)c1ccccc1-c1nn[n-]n1 ZINC000826226100 608340623 /nfs/dbraw/zinc/34/06/23/608340623.db2.gz RYVHIVSOFHKDFP-ZDUSSCGKSA-N -1 3 371.466 3.525 20 0 FHADHM CCN(C(=O)C=Cc1ccsc1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825367587 608343869 /nfs/dbraw/zinc/34/38/69/608343869.db2.gz SVYADBPWSBVLGE-ZZXKWVIFSA-N -1 3 359.842 3.648 20 0 FHADHM CCN(C(=O)C=Cc1ccsc1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825367587 608343870 /nfs/dbraw/zinc/34/38/70/608343870.db2.gz SVYADBPWSBVLGE-ZZXKWVIFSA-N -1 3 359.842 3.648 20 0 FHADHM CCN(C(=O)CCc1ccccc1C)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825371772 608345062 /nfs/dbraw/zinc/34/50/62/608345062.db2.gz LCOYOTUNSQSUFV-UHFFFAOYSA-N -1 3 369.856 3.814 20 0 FHADHM CCN(C(=O)CCc1ccccc1C)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825371772 608345064 /nfs/dbraw/zinc/34/50/64/608345064.db2.gz LCOYOTUNSQSUFV-UHFFFAOYSA-N -1 3 369.856 3.814 20 0 FHADHM CCN(C(=O)c1ccc(Cl)s1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825385298 608345636 /nfs/dbraw/zinc/34/56/36/608345636.db2.gz BSIPPQIYWPMYSM-UHFFFAOYSA-N -1 3 368.249 3.902 20 0 FHADHM CCN(C(=O)c1ccc(Cl)s1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825385298 608345638 /nfs/dbraw/zinc/34/56/38/608345638.db2.gz BSIPPQIYWPMYSM-UHFFFAOYSA-N -1 3 368.249 3.902 20 0 FHADHM CCc1cccc(CC(=O)N(CC)c2ccc(-c3nnn[n-]3)c(Cl)c2)c1 ZINC000825723275 608346264 /nfs/dbraw/zinc/34/62/64/608346264.db2.gz WHSJBCWUCFKAPJ-UHFFFAOYSA-N -1 3 369.856 3.678 20 0 FHADHM CCc1cccc(CC(=O)N(CC)c2ccc(-c3nn[n-]n3)c(Cl)c2)c1 ZINC000825723275 608346266 /nfs/dbraw/zinc/34/62/66/608346266.db2.gz WHSJBCWUCFKAPJ-UHFFFAOYSA-N -1 3 369.856 3.678 20 0 FHADHM CCN(C(=O)c1csc(C)c1C)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825390482 608347511 /nfs/dbraw/zinc/34/75/11/608347511.db2.gz GVFHEDORJWMPDB-UHFFFAOYSA-N -1 3 361.858 3.865 20 0 FHADHM CCN(C(=O)c1csc(C)c1C)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825390482 608347513 /nfs/dbraw/zinc/34/75/13/608347513.db2.gz GVFHEDORJWMPDB-UHFFFAOYSA-N -1 3 361.858 3.865 20 0 FHADHM Fc1cccc([C@@H]2CCCN2c2cc(-c3nnn[n-]3)c3ccccc3n2)c1 ZINC000826376587 608372068 /nfs/dbraw/zinc/37/20/68/608372068.db2.gz KAJWMBGMSBIBLL-SFHVURJKSA-N -1 3 360.396 3.896 20 0 FHADHM Fc1cccc([C@@H]2CCCN2c2cc(-c3nn[n-]n3)c3ccccc3n2)c1 ZINC000826376587 608372070 /nfs/dbraw/zinc/37/20/70/608372070.db2.gz KAJWMBGMSBIBLL-SFHVURJKSA-N -1 3 360.396 3.896 20 0 FHADHM Cc1ccc(SCCC(=O)OCc2cccc(-c3nnn[n-]3)c2F)cc1 ZINC000826292708 608434909 /nfs/dbraw/zinc/43/49/09/608434909.db2.gz IPDHVIHCYSSHGS-UHFFFAOYSA-N -1 3 372.425 3.540 20 0 FHADHM Cc1ccc(SCCC(=O)OCc2cccc(-c3nn[n-]n3)c2F)cc1 ZINC000826292708 608434911 /nfs/dbraw/zinc/43/49/11/608434911.db2.gz IPDHVIHCYSSHGS-UHFFFAOYSA-N -1 3 372.425 3.540 20 0 FHADHM C[C@H](NCc1ccnc(-c2nnn[n-]2)c1)c1c(Cl)ccc(F)c1Cl ZINC000824626622 608439548 /nfs/dbraw/zinc/43/95/48/608439548.db2.gz PPCZIFFOJRUEOU-QMMMGPOBSA-N -1 3 367.215 3.558 20 0 FHADHM C[C@H](NCc1ccnc(-c2nn[n-]n2)c1)c1c(Cl)ccc(F)c1Cl ZINC000824626622 608439551 /nfs/dbraw/zinc/43/95/51/608439551.db2.gz PPCZIFFOJRUEOU-QMMMGPOBSA-N -1 3 367.215 3.558 20 0 FHADHM Cc1ccc(-c2cnc(CN[C@H](C)c3ccc(-c4nnn[n-]4)cc3)o2)cc1 ZINC000826273612 608467171 /nfs/dbraw/zinc/46/71/71/608467171.db2.gz MQCSFUWCTIFRHZ-CQSZACIVSA-N -1 3 360.421 3.681 20 0 FHADHM Cc1ccc(-c2cnc(CN[C@H](C)c3ccc(-c4nn[n-]n4)cc3)o2)cc1 ZINC000826273612 608467172 /nfs/dbraw/zinc/46/71/72/608467172.db2.gz MQCSFUWCTIFRHZ-CQSZACIVSA-N -1 3 360.421 3.681 20 0 FHADHM CC(C)(C)CN(CC(C)(C)C)C(=O)CCc1ccc(-c2nnn[n-]2)cc1 ZINC000824087594 608470235 /nfs/dbraw/zinc/47/02/35/608470235.db2.gz YLYJUGIQADKNKY-UHFFFAOYSA-N -1 3 357.502 3.720 20 0 FHADHM CC(C)(C)CN(CC(C)(C)C)C(=O)CCc1ccc(-c2nn[n-]n2)cc1 ZINC000824087594 608470236 /nfs/dbraw/zinc/47/02/36/608470236.db2.gz YLYJUGIQADKNKY-UHFFFAOYSA-N -1 3 357.502 3.720 20 0 FHADHM CSc1cccc(NC(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)c1C ZINC000826230630 608479103 /nfs/dbraw/zinc/47/91/03/608479103.db2.gz BYEAABOSUWWVAE-UHFFFAOYSA-N -1 3 358.402 3.680 20 0 FHADHM CSc1cccc(NC(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)c1C ZINC000826230630 608479105 /nfs/dbraw/zinc/47/91/05/608479105.db2.gz BYEAABOSUWWVAE-UHFFFAOYSA-N -1 3 358.402 3.680 20 0 FHADHM CCC(CC)[C@H](C)C(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000825097426 608479789 /nfs/dbraw/zinc/47/97/89/608479789.db2.gz WNQAXZUCRNPNJE-AWEZNQCLSA-N -1 3 353.470 3.555 20 0 FHADHM CCC(CC)[C@H](C)C(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000825097426 608479792 /nfs/dbraw/zinc/47/97/92/608479792.db2.gz WNQAXZUCRNPNJE-AWEZNQCLSA-N -1 3 353.470 3.555 20 0 FHADHM C[C@@H]1CCCC[C@@H]1CC(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000824936157 608487818 /nfs/dbraw/zinc/48/78/18/608487818.db2.gz FEHLRSGBEIOSQK-DNVCBOLYSA-N -1 3 365.481 3.699 20 0 FHADHM C[C@@H]1CCCC[C@@H]1CC(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000824936157 608487820 /nfs/dbraw/zinc/48/78/20/608487820.db2.gz FEHLRSGBEIOSQK-DNVCBOLYSA-N -1 3 365.481 3.699 20 0 FHADHM CC(C)CC1(C(=O)N2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)CCC1 ZINC000824235491 608487830 /nfs/dbraw/zinc/48/78/30/608487830.db2.gz HWGUXRRBPSQMSP-UHFFFAOYSA-N -1 3 365.481 3.699 20 0 FHADHM CC(C)CC1(C(=O)N2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)CCC1 ZINC000824235491 608487831 /nfs/dbraw/zinc/48/78/31/608487831.db2.gz HWGUXRRBPSQMSP-UHFFFAOYSA-N -1 3 365.481 3.699 20 0 FHADHM CC[C@@H](OC(=O)c1c(F)cc(-c2nnn[n-]2)cc1F)c1ccc(C)cc1 ZINC000825153575 608498142 /nfs/dbraw/zinc/49/81/42/608498142.db2.gz ILRKWNFSDMXOSB-OAHLLOKOSA-N -1 3 358.348 3.761 20 0 FHADHM CC[C@@H](OC(=O)c1c(F)cc(-c2nn[n-]n2)cc1F)c1ccc(C)cc1 ZINC000825153575 608498143 /nfs/dbraw/zinc/49/81/43/608498143.db2.gz ILRKWNFSDMXOSB-OAHLLOKOSA-N -1 3 358.348 3.761 20 0 FHADHM CC[C@@H](OC(=O)c1c(F)cc(-c2nnn[n-]2)cc1F)c1ccc(F)cc1 ZINC000825154186 608498343 /nfs/dbraw/zinc/49/83/43/608498343.db2.gz MLIUFNHHYGUUDW-CQSZACIVSA-N -1 3 362.311 3.592 20 0 FHADHM CC[C@@H](OC(=O)c1c(F)cc(-c2nn[n-]n2)cc1F)c1ccc(F)cc1 ZINC000825154186 608498345 /nfs/dbraw/zinc/49/83/45/608498345.db2.gz MLIUFNHHYGUUDW-CQSZACIVSA-N -1 3 362.311 3.592 20 0 FHADHM c1csc([C@H]2c3ccsc3CCN2Cc2ccc(-c3nnn[n-]3)o2)c1 ZINC000826525827 608506242 /nfs/dbraw/zinc/50/62/42/608506242.db2.gz APGQOLRTLDWXEW-MRXNPFEDSA-N -1 3 369.475 3.730 20 0 FHADHM c1csc([C@H]2c3ccsc3CCN2Cc2ccc(-c3nn[n-]n3)o2)c1 ZINC000826525827 608506243 /nfs/dbraw/zinc/50/62/43/608506243.db2.gz APGQOLRTLDWXEW-MRXNPFEDSA-N -1 3 369.475 3.730 20 0 FHADHM CCc1nc([C@@H](C)N[C@@H]2CCCc3cc(-c4nn[n-]n4)ccc32)cs1 ZINC000825746164 608510658 /nfs/dbraw/zinc/51/06/58/608510658.db2.gz SJPHVJKLPSXUQC-IAQYHMDHSA-N -1 3 354.483 3.614 20 0 FHADHM FC(F)(F)c1ccccc1CN(Cc1ccc(-c2nnn[n-]2)o1)C1CC1 ZINC000826369130 608522567 /nfs/dbraw/zinc/52/25/67/608522567.db2.gz OISINCNQOBLCSR-UHFFFAOYSA-N -1 3 363.343 3.643 20 0 FHADHM CC(C)CCc1nc(CNC2(c3cccc(-c4nnn[n-]4)c3)CC2)cs1 ZINC000824248795 608532148 /nfs/dbraw/zinc/53/21/48/608532148.db2.gz CBHZQPJOALUTBS-UHFFFAOYSA-N -1 3 368.510 3.691 20 0 FHADHM CC(C)CCc1nc(CNC2(c3cccc(-c4nn[n-]n4)c3)CC2)cs1 ZINC000824248795 608532151 /nfs/dbraw/zinc/53/21/51/608532151.db2.gz CBHZQPJOALUTBS-UHFFFAOYSA-N -1 3 368.510 3.691 20 0 FHADHM O=C(c1ccc(Cl)c(-c2nnn[n-]2)c1)N1CCCCC[C@@H]1c1ccco1 ZINC000826473382 608577543 /nfs/dbraw/zinc/57/75/43/608577543.db2.gz WEDSFVITTXEPQM-OAHLLOKOSA-N -1 3 371.828 3.871 20 0 FHADHM O=C(c1ccc(Cl)c(-c2nn[n-]n2)c1)N1CCCCC[C@@H]1c1ccco1 ZINC000826473382 608577544 /nfs/dbraw/zinc/57/75/44/608577544.db2.gz WEDSFVITTXEPQM-OAHLLOKOSA-N -1 3 371.828 3.871 20 0 FHADHM C[C@H]1CCCN(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)[C@H]1C ZINC000824937800 608604743 /nfs/dbraw/zinc/60/47/43/608604743.db2.gz RJTSHONGOCBHAQ-UWVGGRQHSA-N -1 3 368.363 3.538 20 0 FHADHM C[C@H]1CCCN(C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)[C@H]1C ZINC000824937800 608604744 /nfs/dbraw/zinc/60/47/44/608604744.db2.gz RJTSHONGOCBHAQ-UWVGGRQHSA-N -1 3 368.363 3.538 20 0 FHADHM c1c(CC2CC2)nn(-c2ccccc2)c1NCc1cccc(-c2nnn[n-]2)c1 ZINC000826519630 608668780 /nfs/dbraw/zinc/66/87/80/608668780.db2.gz HEIAIJMHNLLSKX-UHFFFAOYSA-N -1 3 371.448 3.617 20 0 FHADHM c1c(CC2CC2)nn(-c2ccccc2)c1NCc1cccc(-c2nn[n-]n2)c1 ZINC000826519630 608668782 /nfs/dbraw/zinc/66/87/82/608668782.db2.gz HEIAIJMHNLLSKX-UHFFFAOYSA-N -1 3 371.448 3.617 20 0 FHADHM c1sc(CN2CCCC[C@@H]2c2nc3ccccc3o2)cc1-c1nnn[n-]1 ZINC000826524129 608741925 /nfs/dbraw/zinc/74/19/25/608741925.db2.gz KMKBEDOICKJSIB-OAHLLOKOSA-N -1 3 366.450 3.797 20 0 FHADHM c1sc(CN2CCCC[C@@H]2c2nc3ccccc3o2)cc1-c1nn[n-]n1 ZINC000826524129 608741929 /nfs/dbraw/zinc/74/19/29/608741929.db2.gz KMKBEDOICKJSIB-OAHLLOKOSA-N -1 3 366.450 3.797 20 0 FHADHM c1cc(-c2nnn[n-]2)sc1CN1CCCC[C@@H]1c1nc2ccccc2o1 ZINC000826524002 608742079 /nfs/dbraw/zinc/74/20/79/608742079.db2.gz FJCPKYSCWOZHKT-CQSZACIVSA-N -1 3 366.450 3.797 20 0 FHADHM c1cc(-c2nn[n-]n2)sc1CN1CCCC[C@@H]1c1nc2ccccc2o1 ZINC000826524002 608742081 /nfs/dbraw/zinc/74/20/81/608742081.db2.gz FJCPKYSCWOZHKT-CQSZACIVSA-N -1 3 366.450 3.797 20 0 FHADHM FC(F)(F)CSCCNc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000826367725 608798992 /nfs/dbraw/zinc/79/89/92/608798992.db2.gz LNQIQWVBYBQAEF-UHFFFAOYSA-N -1 3 371.310 3.593 20 0 FHADHM FC(F)(F)CSCCNc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000826367725 608798993 /nfs/dbraw/zinc/79/89/93/608798993.db2.gz LNQIQWVBYBQAEF-UHFFFAOYSA-N -1 3 371.310 3.593 20 0 FHADHM FC(F)(F)CSCCNc1ccc(C(F)(F)F)cc1-c1nnn[n-]1 ZINC000826367793 608799227 /nfs/dbraw/zinc/79/92/27/608799227.db2.gz OIODXULWEXHXQH-UHFFFAOYSA-N -1 3 371.310 3.593 20 0 FHADHM FC(F)(F)CSCCNc1ccc(C(F)(F)F)cc1-c1nn[n-]n1 ZINC000826367793 608799231 /nfs/dbraw/zinc/79/92/31/608799231.db2.gz OIODXULWEXHXQH-UHFFFAOYSA-N -1 3 371.310 3.593 20 0 FHADHM CC[C@H](C)Oc1cc(CNc2cccc(-c3nnn[n-]3)c2)ccc1OC ZINC000825076862 608870923 /nfs/dbraw/zinc/87/09/23/608870923.db2.gz YFQLJPFTBOEHKW-ZDUSSCGKSA-N -1 3 353.426 3.665 20 0 FHADHM CC[C@H](C)Oc1cc(CNc2cccc(-c3nn[n-]n3)c2)ccc1OC ZINC000825076862 608870925 /nfs/dbraw/zinc/87/09/25/608870925.db2.gz YFQLJPFTBOEHKW-ZDUSSCGKSA-N -1 3 353.426 3.665 20 0 FHADHM Cc1cc(C)cc(CCC(=O)Nc2sc3c(c2-c2nnn[n-]2)CCC3)c1 ZINC000826264636 609143416 /nfs/dbraw/zinc/14/34/16/609143416.db2.gz UZGPTTMEPPEDNT-UHFFFAOYSA-N -1 3 367.478 3.605 20 0 FHADHM Cc1cc(C)cc(CCC(=O)Nc2sc3c(c2-c2nn[n-]n2)CCC3)c1 ZINC000826264636 609143418 /nfs/dbraw/zinc/14/34/18/609143418.db2.gz UZGPTTMEPPEDNT-UHFFFAOYSA-N -1 3 367.478 3.605 20 0 FHADHM Fc1cccc(F)c1[C@@H](NCc1ccc(-c2nnn[n-]2)cc1)C(F)(F)F ZINC000826377137 609152432 /nfs/dbraw/zinc/15/24/32/609152432.db2.gz GNCGSPXLRUUJIA-CQSZACIVSA-N -1 3 369.297 3.538 20 0 FHADHM Fc1cccc(F)c1[C@@H](NCc1ccc(-c2nn[n-]n2)cc1)C(F)(F)F ZINC000826377137 609152435 /nfs/dbraw/zinc/15/24/35/609152435.db2.gz GNCGSPXLRUUJIA-CQSZACIVSA-N -1 3 369.297 3.538 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CCC[C@@H]1/C=C/c1ccccc1 ZINC000826278381 609157565 /nfs/dbraw/zinc/15/75/65/609157565.db2.gz ZHJZVQUJLXNHRT-NCUBBLFSSA-N -1 3 374.448 3.885 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CCC[C@@H]1/C=C/c1ccccc1 ZINC000826278381 609157566 /nfs/dbraw/zinc/15/75/66/609157566.db2.gz ZHJZVQUJLXNHRT-NCUBBLFSSA-N -1 3 374.448 3.885 20 0 FHADHM C[C@H]1CCN(c2cc(-c3nnn[n-]3)c3ccccc3n2)[C@H](c2ccco2)C1 ZINC000824961893 609164342 /nfs/dbraw/zinc/16/43/42/609164342.db2.gz KPFOABVCODHSGT-GUYCJALGSA-N -1 3 360.421 3.986 20 0 FHADHM C[C@H]1CCN(c2cc(-c3nn[n-]n3)c3ccccc3n2)[C@H](c2ccco2)C1 ZINC000824961893 609164344 /nfs/dbraw/zinc/16/43/44/609164344.db2.gz KPFOABVCODHSGT-GUYCJALGSA-N -1 3 360.421 3.986 20 0 FHADHM CCc1nc2cc(N[C@@H](C)c3ccc(-c4nnn[n-]4)c(F)c3)ccc2o1 ZINC000825750028 609175902 /nfs/dbraw/zinc/17/59/02/609175902.db2.gz IOOLRWHXNXPNNA-JTQLQIEISA-N -1 3 352.373 3.883 20 0 FHADHM CCc1nc2cc(N[C@@H](C)c3ccc(-c4nn[n-]n4)c(F)c3)ccc2o1 ZINC000825750028 609175903 /nfs/dbraw/zinc/17/59/03/609175903.db2.gz IOOLRWHXNXPNNA-JTQLQIEISA-N -1 3 352.373 3.883 20 0 FHADHM CC(=O)Nc1c(C)ccc(N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1C ZINC000823993977 609179923 /nfs/dbraw/zinc/17/99/23/609179923.db2.gz CIEITMJSBCSDLO-ZDUSSCGKSA-N -1 3 350.426 3.615 20 0 FHADHM CC(=O)Nc1c(C)ccc(N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1C ZINC000823993977 609179924 /nfs/dbraw/zinc/17/99/24/609179924.db2.gz CIEITMJSBCSDLO-ZDUSSCGKSA-N -1 3 350.426 3.615 20 0 FHADHM CC(=O)Nc1c(C)ccc(N[C@@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)c1C ZINC000823994663 609180132 /nfs/dbraw/zinc/18/01/32/609180132.db2.gz MCOYUHPBONCPGE-LBPRGKRZSA-N -1 3 368.416 3.754 20 0 FHADHM CC(=O)Nc1c(C)ccc(N[C@@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)c1C ZINC000823994663 609180134 /nfs/dbraw/zinc/18/01/34/609180134.db2.gz MCOYUHPBONCPGE-LBPRGKRZSA-N -1 3 368.416 3.754 20 0 FHADHM Cc1ccc(CSCc2ccc(-c3nnn[n-]3)cc2OC(F)F)nc1 ZINC000826288822 609184183 /nfs/dbraw/zinc/18/41/83/609184183.db2.gz YBYWITCNNPKLPZ-UHFFFAOYSA-N -1 3 363.393 3.605 20 0 FHADHM Cc1ccc(CSCc2ccc(-c3nn[n-]n3)cc2OC(F)F)nc1 ZINC000826288822 609184185 /nfs/dbraw/zinc/18/41/85/609184185.db2.gz YBYWITCNNPKLPZ-UHFFFAOYSA-N -1 3 363.393 3.605 20 0 FHADHM COCCCOc1cccc(CNc2ccc(Cl)c(-c3nnn[n-]3)c2)c1 ZINC000826157228 609199345 /nfs/dbraw/zinc/19/93/45/609199345.db2.gz MEPXXEPLBPQFHF-UHFFFAOYSA-N -1 3 373.844 3.548 20 0 FHADHM COCCCOc1cccc(CNc2ccc(Cl)c(-c3nn[n-]n3)c2)c1 ZINC000826157228 609199346 /nfs/dbraw/zinc/19/93/46/609199346.db2.gz MEPXXEPLBPQFHF-UHFFFAOYSA-N -1 3 373.844 3.548 20 0 FHADHM Cc1ncc(CNc2ccc(Cl)c(-c3nnn[n-]3)c2)n1-c1ccccc1 ZINC000826330336 609199852 /nfs/dbraw/zinc/19/98/52/609199852.db2.gz PNBOZJHBDZWSQG-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM Cc1ncc(CNc2ccc(Cl)c(-c3nn[n-]n3)c2)n1-c1ccccc1 ZINC000826330336 609199853 /nfs/dbraw/zinc/19/98/53/609199853.db2.gz PNBOZJHBDZWSQG-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM O=C(c1c[nH]c(-c2nnn[n-]2)c1)N1CCCCC[C@@H]1c1ccc(Cl)cc1 ZINC000826469689 609215084 /nfs/dbraw/zinc/21/50/84/609215084.db2.gz OMXUBLYZHLPBKZ-MRXNPFEDSA-N -1 3 370.844 3.606 20 0 FHADHM 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CCc1nnc(COc2ccc(-c3ccc(-c4nn[n-]n4)cc3)cc2)s1 ZINC000825766673 609481001 /nfs/dbraw/zinc/48/10/01/609481001.db2.gz BXRAJNUPNDGGPM-UHFFFAOYSA-N -1 3 364.434 3.527 20 0 FHADHM Cc1coc(-c2ccc(C)c(NCc3cccc(-c4nnn[n-]4)c3F)c2)n1 ZINC000826320442 609481557 /nfs/dbraw/zinc/48/15/57/609481557.db2.gz QYKNMQMSFFFAPB-UHFFFAOYSA-N -1 3 364.384 3.890 20 0 FHADHM Cc1coc(-c2ccc(C)c(NCc3cccc(-c4nn[n-]n4)c3F)c2)n1 ZINC000826320442 609481558 /nfs/dbraw/zinc/48/15/58/609481558.db2.gz QYKNMQMSFFFAPB-UHFFFAOYSA-N -1 3 364.384 3.890 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NCc1cc(C(F)(F)F)ccc1F ZINC000826186045 609483101 /nfs/dbraw/zinc/48/31/01/609483101.db2.gz BOGGECVXCLBHLB-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NCc1cc(C(F)(F)F)ccc1F ZINC000826186045 609483102 /nfs/dbraw/zinc/48/31/02/609483102.db2.gz BOGGECVXCLBHLB-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM c1cc(COc2ccc(NC3CCSCC3)cc2)cc(-c2nnn[n-]2)c1 ZINC000826516250 609485508 /nfs/dbraw/zinc/48/55/08/609485508.db2.gz CWEPPRAFQVAQFC-UHFFFAOYSA-N -1 3 367.478 3.753 20 0 FHADHM c1cc(COc2ccc(NC3CCSCC3)cc2)cc(-c2nn[n-]n2)c1 ZINC000826516250 609485510 /nfs/dbraw/zinc/48/55/10/609485510.db2.gz CWEPPRAFQVAQFC-UHFFFAOYSA-N -1 3 367.478 3.753 20 0 FHADHM Cc1c(CNc2cccc(-c3nnn[n-]3)c2C)sc2nc(C)nc(C)c12 ZINC000826324479 609486568 /nfs/dbraw/zinc/48/65/68/609486568.db2.gz STNWXUIPKQNAQY-UHFFFAOYSA-N -1 3 365.466 3.717 20 0 FHADHM Cc1c(CNc2cccc(-c3nn[n-]n3)c2C)sc2nc(C)nc(C)c12 ZINC000826324479 609486571 /nfs/dbraw/zinc/48/65/71/609486571.db2.gz STNWXUIPKQNAQY-UHFFFAOYSA-N -1 3 365.466 3.717 20 0 FHADHM O=C(c1cc(-c2nnn[n-]2)cs1)N1CC=C(c2cccc3ccccc32)C1 ZINC000826470683 609503829 /nfs/dbraw/zinc/50/38/29/609503829.db2.gz YONVLSXYKYCQSH-UHFFFAOYSA-N -1 3 373.441 3.621 20 0 FHADHM O=C(c1cc(-c2nn[n-]n2)cs1)N1CC=C(c2cccc3ccccc32)C1 ZINC000826470683 609503830 /nfs/dbraw/zinc/50/38/30/609503830.db2.gz YONVLSXYKYCQSH-UHFFFAOYSA-N -1 3 373.441 3.621 20 0 FHADHM CC[C@H](C)[C@H](C)C(=O)Nc1nc(-c2ccc(-c3nnn[n-]3)cc2)cs1 ZINC000825049364 609506074 /nfs/dbraw/zinc/50/60/74/609506074.db2.gz BFVQXNCXFFVZJG-QWRGUYRKSA-N -1 3 356.455 3.611 20 0 FHADHM CC[C@H](C)[C@H](C)C(=O)Nc1nc(-c2ccc(-c3nn[n-]n3)cc2)cs1 ZINC000825049364 609506077 /nfs/dbraw/zinc/50/60/77/609506077.db2.gz BFVQXNCXFFVZJG-QWRGUYRKSA-N -1 3 356.455 3.611 20 0 FHADHM Cc1cc(NCc2ccc(-c3nnn[n-]3)s2)cnc1N1CCCC[C@H]1C ZINC000826271192 609512534 /nfs/dbraw/zinc/51/25/34/609512534.db2.gz HHYYKHUNKPXMNF-CYBMUJFWSA-N -1 3 369.498 3.623 20 0 FHADHM Cc1cc(NCc2ccc(-c3nn[n-]n3)s2)cnc1N1CCCC[C@H]1C ZINC000826271192 609512536 /nfs/dbraw/zinc/51/25/36/609512536.db2.gz HHYYKHUNKPXMNF-CYBMUJFWSA-N -1 3 369.498 3.623 20 0 FHADHM CC/C(C)=C(/C)C(=O)Nc1ncc(Cc2ccc(-c3nnn[n-]3)cc2)s1 ZINC000825050672 609516912 /nfs/dbraw/zinc/51/69/12/609516912.db2.gz KVKURANGENUXIE-QXMHVHEDSA-N -1 3 368.466 3.599 20 0 FHADHM CC/C(C)=C(/C)C(=O)Nc1ncc(Cc2ccc(-c3nn[n-]n3)cc2)s1 ZINC000825050672 609516913 /nfs/dbraw/zinc/51/69/13/609516913.db2.gz KVKURANGENUXIE-QXMHVHEDSA-N -1 3 368.466 3.599 20 0 FHADHM Cc1nc(-c2ccc(CNc3nccc(C)c3-c3nnn[n-]3)s2)cs1 ZINC000826322188 609525556 /nfs/dbraw/zinc/52/55/56/609525556.db2.gz BRVVLYLRKXSDHG-UHFFFAOYSA-N -1 3 369.479 3.676 20 0 FHADHM Cc1nc(-c2ccc(CNc3nccc(C)c3-c3nn[n-]n3)s2)cs1 ZINC000826322188 609525559 /nfs/dbraw/zinc/52/55/59/609525559.db2.gz BRVVLYLRKXSDHG-UHFFFAOYSA-N -1 3 369.479 3.676 20 0 FHADHM COc1cccc([C@H]2CCCN2c2ncc(Cl)c(C)c2-c2nnn[n-]2)c1 ZINC000826215453 609526485 /nfs/dbraw/zinc/52/64/85/609526485.db2.gz PFMMHBRTCLHXKM-OAHLLOKOSA-N -1 3 370.844 3.574 20 0 FHADHM COc1cccc([C@H]2CCCN2c2ncc(Cl)c(C)c2-c2nn[n-]n2)c1 ZINC000826215453 609526487 /nfs/dbraw/zinc/52/64/87/609526487.db2.gz PFMMHBRTCLHXKM-OAHLLOKOSA-N -1 3 370.844 3.574 20 0 FHADHM CCOc1ccc([C@H](C)Nc2ncc(Cl)c(C)c2-c2nnn[n-]2)cc1 ZINC000825639553 609526632 /nfs/dbraw/zinc/52/66/32/609526632.db2.gz ZLTSXNOSPBSICQ-NSHDSACASA-N -1 3 358.833 3.795 20 0 FHADHM CCOc1ccc([C@H](C)Nc2ncc(Cl)c(C)c2-c2nn[n-]n2)cc1 ZINC000825639553 609526634 /nfs/dbraw/zinc/52/66/34/609526634.db2.gz ZLTSXNOSPBSICQ-NSHDSACASA-N -1 3 358.833 3.795 20 0 FHADHM CC[C@@H](C)[C@H](C)C(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)nc1 ZINC000825049393 609529450 /nfs/dbraw/zinc/52/94/50/609529450.db2.gz BRGPCIGRYDIWAJ-OLZOCXBDSA-N -1 3 366.425 3.675 20 0 FHADHM Cc1ccccc1[C@@H]1CCCN1c1ncc(Cl)c(C)c1-c1nnn[n-]1 ZINC000826306495 609537683 /nfs/dbraw/zinc/53/76/83/609537683.db2.gz BELMTZYEJNMJMK-HNNXBMFYSA-N -1 3 354.845 3.873 20 0 FHADHM Cc1ccccc1[C@@H]1CCCN1c1ncc(Cl)c(C)c1-c1nn[n-]n1 ZINC000826306495 609537684 /nfs/dbraw/zinc/53/76/84/609537684.db2.gz BELMTZYEJNMJMK-HNNXBMFYSA-N -1 3 354.845 3.873 20 0 FHADHM Cc1c(Cl)cnc(N[C@@H](c2ccccc2)[C@H]2CCCO2)c1-c1nnn[n-]1 ZINC000826239154 609545624 /nfs/dbraw/zinc/54/56/24/609545624.db2.gz YWXSARRLTSGHJM-ZBFHGGJFSA-N -1 3 370.844 3.556 20 0 FHADHM Cc1c(Cl)cnc(N[C@@H](c2ccccc2)[C@H]2CCCO2)c1-c1nn[n-]n1 ZINC000826239154 609545626 /nfs/dbraw/zinc/54/56/26/609545626.db2.gz YWXSARRLTSGHJM-ZBFHGGJFSA-N -1 3 370.844 3.556 20 0 FHADHM CC[C@H](Nc1ncc(Cl)c(C)c1-c1nnn[n-]1)c1nc2ccccc2[nH]1 ZINC000825148586 609546227 /nfs/dbraw/zinc/54/62/27/609546227.db2.gz REKRSUXPLJUJOP-NSHDSACASA-N -1 3 368.832 3.663 20 0 FHADHM CC[C@H](Nc1ncc(Cl)c(C)c1-c1nn[n-]n1)c1nc2ccccc2[nH]1 ZINC000825148586 609546228 /nfs/dbraw/zinc/54/62/28/609546228.db2.gz REKRSUXPLJUJOP-NSHDSACASA-N -1 3 368.832 3.663 20 0 FHADHM Cc1c(Cl)cnc(N2CC[C@@H](C)C[C@H]2c2ccco2)c1-c1nnn[n-]1 ZINC000826237297 609565975 /nfs/dbraw/zinc/56/59/75/609565975.db2.gz VCFLUNXFYSZURL-MFKMUULPSA-N -1 3 358.833 3.794 20 0 FHADHM Cc1c(Cl)cnc(N2CC[C@@H](C)C[C@H]2c2ccco2)c1-c1nn[n-]n1 ZINC000826237297 609565977 /nfs/dbraw/zinc/56/59/77/609565977.db2.gz VCFLUNXFYSZURL-MFKMUULPSA-N -1 3 358.833 3.794 20 0 FHADHM C[C@@H]1CC[C@H](C(F)(F)F)CN1c1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000824907237 609576421 /nfs/dbraw/zinc/57/64/21/609576421.db2.gz HEDVZPQFINGLQW-MNOVXSKESA-N -1 3 362.359 3.582 20 0 FHADHM C[C@@H]1CC[C@H](C(F)(F)F)CN1c1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000824907237 609576424 /nfs/dbraw/zinc/57/64/24/609576424.db2.gz HEDVZPQFINGLQW-MNOVXSKESA-N -1 3 362.359 3.582 20 0 FHADHM COc1cccc([C@H]2C[C@@H](C)CN2c2cccc(F)c2-c2nnn[n-]2)c1 ZINC000826215189 609593102 /nfs/dbraw/zinc/59/31/02/609593102.db2.gz ITHPBXHFDUTPPJ-SJKOYZFVSA-N -1 3 353.401 3.602 20 0 FHADHM COc1cccc([C@H]2C[C@@H](C)CN2c2cccc(F)c2-c2nn[n-]n2)c1 ZINC000826215189 609593103 /nfs/dbraw/zinc/59/31/03/609593103.db2.gz ITHPBXHFDUTPPJ-SJKOYZFVSA-N -1 3 353.401 3.602 20 0 FHADHM Cc1cc(C)cc([C@@H]2CCN(c3ncc(-c4nnn[n-]4)cc3Cl)C2)c1 ZINC000826264239 609602519 /nfs/dbraw/zinc/60/25/19/609602519.db2.gz GVTXMPZINJGBKL-CYBMUJFWSA-N -1 3 354.845 3.526 20 0 FHADHM Cc1cc(C)cc([C@@H]2CCN(c3ncc(-c4nn[n-]n4)cc3Cl)C2)c1 ZINC000826264239 609602521 /nfs/dbraw/zinc/60/25/21/609602521.db2.gz GVTXMPZINJGBKL-CYBMUJFWSA-N -1 3 354.845 3.526 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NCc3ccc(OC)c(Cl)c3)nc2)n1 ZINC000153619728 936327765 /nfs/dbraw/zinc/32/77/65/936327765.db2.gz HAHLAZLJXAJGQM-UHFFFAOYSA-N -1 3 370.840 3.668 20 0 FHADHM COc1cc(-c2nc3cc(F)c(F)cc3[nH]2)cc(Br)c1[O-] ZINC000048878119 936333351 /nfs/dbraw/zinc/33/33/51/936333351.db2.gz HLWQOHYQUIRRMZ-UHFFFAOYSA-N -1 3 355.138 3.985 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N2CCCCC[C@H]2c2ccncc2)c1 ZINC000121851390 936355876 /nfs/dbraw/zinc/35/58/76/936355876.db2.gz RRMATQGZCRUXCV-SFHVURJKSA-N -1 3 353.422 3.503 20 0 FHADHM C[C@H]1CCN(C(=O)NCc2ccc([O-])c(Br)c2)C[C@@H](C)C1 ZINC000506374588 945065510 /nfs/dbraw/zinc/06/55/10/945065510.db2.gz DRGXMUADBUFJAG-RYUDHWBXSA-N -1 3 355.276 3.732 20 0 FHADHM Cc1sc(NC(=O)c2cc(F)cc3n[n-]nc32)nc1-c1ccc(F)cc1 ZINC000431521058 937097986 /nfs/dbraw/zinc/09/79/86/937097986.db2.gz DKAJPQNZHKGVMA-UHFFFAOYSA-N -1 3 371.372 3.920 20 0 FHADHM O=C([O-])c1cccc(CCNCc2ccc(F)cc2Br)c1 ZINC000426688259 937117339 /nfs/dbraw/zinc/11/73/39/937117339.db2.gz OTFTVXBGVSXNNB-UHFFFAOYSA-N -1 3 352.203 3.619 20 0 FHADHM Cc1sc2[n-]c([C@@H](C)OC(=O)c3ccc(C)nc3C)nc(=O)c2c1C ZINC000052107924 937132550 /nfs/dbraw/zinc/13/25/50/937132550.db2.gz KXCDPLKTWQTVJT-LLVKDONJSA-N -1 3 357.435 3.531 20 0 FHADHM O=C(Nc1ccc(COC2CCCC2)cc1)c1cc(=O)[n-]c(C2CC2)n1 ZINC000654823855 927378274 /nfs/dbraw/zinc/37/82/74/927378274.db2.gz DCQFSPRWKZPLEW-UHFFFAOYSA-N -1 3 353.422 3.771 20 0 FHADHM COc1ccc(-c2ncc(C(=O)[N-]c3nnc(C4CC4)s3)s2)cc1 ZINC000079632655 937159555 /nfs/dbraw/zinc/15/95/55/937159555.db2.gz GNVQXQSNFZAHCG-UHFFFAOYSA-N -1 3 358.448 3.800 20 0 FHADHM CC[C@H]1CN(C(=O)c2cc(=O)[n-]c(C3CC3)n2)CC[C@@H]1c1ccccc1 ZINC000654850895 927422174 /nfs/dbraw/zinc/42/21/74/927422174.db2.gz WYAJJNJAUXMRLT-YOEHRIQHSA-N -1 3 351.450 3.716 20 0 FHADHM CCCC(=O)Nc1cccc([N-]S(=O)(=O)c2ccc(OC)cc2)c1C ZINC000063181283 927427421 /nfs/dbraw/zinc/42/74/21/927427421.db2.gz ATHWYROKTCHHCI-UHFFFAOYSA-N -1 3 362.451 3.543 20 0 FHADHM CCOc1cc(C(=O)N2CCN(C3CCCCC3)CC2)cc(Cl)c1[O-] ZINC000186875203 927567007 /nfs/dbraw/zinc/56/70/07/927567007.db2.gz GBSOFYNTDVATPS-UHFFFAOYSA-N -1 3 366.889 3.535 20 0 FHADHM Cc1c(NC([O-])=NO[C@@H]2CCCCO2)cccc1C(=O)Nc1ccccc1 ZINC000274745691 927814724 /nfs/dbraw/zinc/81/47/24/927814724.db2.gz GLEIQWFPFYVAGG-GOSISDBHSA-N -1 3 369.421 3.827 20 0 FHADHM Cc1c(NC(=O)[N-]O[C@@H]2CCCCO2)cccc1C(=O)Nc1ccccc1 ZINC000274745691 927814733 /nfs/dbraw/zinc/81/47/33/927814733.db2.gz GLEIQWFPFYVAGG-GOSISDBHSA-N -1 3 369.421 3.827 20 0 FHADHM Cc1cc(NC(=O)c2cc(=O)[n-]c(C3CC3)n2)cc(C)c1Br ZINC000655027287 927883304 /nfs/dbraw/zinc/88/33/04/927883304.db2.gz MUKUQAGZTXFIRZ-UHFFFAOYSA-N -1 3 362.227 3.691 20 0 FHADHM CC(C)(C)OC(=O)Nc1ccc(NC([O-])=NO[C@@H]2CCCCO2)cc1 ZINC000274753728 927902237 /nfs/dbraw/zinc/90/22/37/927902237.db2.gz BKSXFOVQVUNVFU-CQSZACIVSA-N -1 3 351.403 3.613 20 0 FHADHM CC(C)(C)OC(=O)Nc1ccc(NC(=O)[N-]O[C@@H]2CCCCO2)cc1 ZINC000274753728 927902248 /nfs/dbraw/zinc/90/22/48/927902248.db2.gz BKSXFOVQVUNVFU-CQSZACIVSA-N -1 3 351.403 3.613 20 0 FHADHM CCCCc1nc(NC(=O)c2ccc3oc(C)nc3c2)c(C(=O)OCC)[n-]1 ZINC000471148660 927994369 /nfs/dbraw/zinc/99/43/69/927994369.db2.gz UWOJEQMGRMIZTH-UHFFFAOYSA-N -1 3 370.409 3.631 20 0 FHADHM O=C(NCc1ccc([O-])c(F)c1)N1CCC[C@@H]1c1ccc(F)cc1F ZINC000458426932 937230890 /nfs/dbraw/zinc/23/08/90/937230890.db2.gz UIAHVKQXTKPCCW-MRXNPFEDSA-N -1 3 350.340 3.856 20 0 FHADHM Cc1cc(=O)[n-]c(-c2cccc(NC(=O)c3cc4ccccc4cc3N)c2)n1 ZINC000154567218 937237758 /nfs/dbraw/zinc/23/77/58/937237758.db2.gz BZWBJCLGRUQZLN-UHFFFAOYSA-N -1 3 370.412 3.733 20 0 FHADHM Cc1ccc([N-]S(=O)(=O)c2cccc3c2OCCCO3)c(Cl)c1 ZINC000650148705 928357956 /nfs/dbraw/zinc/35/79/56/928357956.db2.gz SDNBZTSLTPEMDR-UHFFFAOYSA-N -1 3 353.827 3.611 20 0 FHADHM COCCOc1ccc(NC(=O)c2cc3c(cc2[O-])CCCC3)cc1F ZINC000109189568 928573169 /nfs/dbraw/zinc/57/31/69/928573169.db2.gz QFXXFYJKFUVYMR-UHFFFAOYSA-N -1 3 359.397 3.688 20 0 FHADHM [O-]c1cc2ccccc2cc1-c1nc([C@H]2CN3CCCC[C@@H]3CO2)no1 ZINC000278154661 937272174 /nfs/dbraw/zinc/27/21/74/937272174.db2.gz SZFOJRUCHIBRRY-CRAIPNDOSA-N -1 3 351.406 3.521 20 0 FHADHM Cc1ccc(Cl)c(S(=O)(=O)[N-]c2cc3c(cc2Cl)OCO3)c1 ZINC000179591702 928842764 /nfs/dbraw/zinc/84/27/64/928842764.db2.gz FETUPPZHQYQQEL-UHFFFAOYSA-N -1 3 360.218 3.831 20 0 FHADHM CS(=O)(=O)[N-]c1ccc(C(F)(F)F)cc1NC(=O)C1=CCCCC1 ZINC000187792262 928868244 /nfs/dbraw/zinc/86/82/44/928868244.db2.gz PPGJALVYGDBRNJ-UHFFFAOYSA-N -1 3 362.373 3.516 20 0 FHADHM CCCCCc1nnc([N-]C(=O)c2nnn(-c3ccc(C)cc3)c2C)s1 ZINC000059740175 928970052 /nfs/dbraw/zinc/97/00/52/928970052.db2.gz HPQAKYXCDGQYLN-UHFFFAOYSA-N -1 3 370.482 3.721 20 0 FHADHM CCc1cc(NC(=O)c2c[n-]c3ccc(Oc4ccccc4)cc3c2=O)n[nH]1 ZINC000683262265 929000511 /nfs/dbraw/zinc/00/05/11/929000511.db2.gz QAKZQMMVOCPILT-UHFFFAOYSA-N -1 3 374.400 3.858 20 0 FHADHM Cc1ccc(S(=O)(=O)[N-][C@@H](c2cccc(Cl)c2)c2ccccn2)o1 ZINC000538013051 929061040 /nfs/dbraw/zinc/06/10/40/929061040.db2.gz LNCBCWHFGXMPMD-KRWDZBQOSA-N -1 3 362.838 3.704 20 0 FHADHM CCCc1ccc([C@H](NC(=O)NN=c2cccn[n-]2)c2cccs2)cc1 ZINC000077547026 929426911 /nfs/dbraw/zinc/42/69/11/929426911.db2.gz AVJLJWLXGZQZSS-SFHVURJKSA-N -1 3 367.478 3.906 20 0 FHADHM CC(C)Cn1ncc(C(=O)NCc2ccc([O-])c(F)c2)c1-c1ccccc1 ZINC000430298499 929446752 /nfs/dbraw/zinc/44/67/52/929446752.db2.gz MGFSIJAXAYNUQG-UHFFFAOYSA-N -1 3 367.424 3.981 20 0 FHADHM CC(C)c1ccc(-c2noc(CCC(=O)Nc3ccncc3[O-])n2)cc1 ZINC000109889519 929680807 /nfs/dbraw/zinc/68/08/07/929680807.db2.gz AXHQKHOBEZMINI-UHFFFAOYSA-N -1 3 352.394 3.532 20 0 FHADHM O=S(=O)([N-]CCc1ccc(F)cc1F)c1cccc(Cl)c1Cl ZINC000561493183 937361525 /nfs/dbraw/zinc/36/15/25/937361525.db2.gz UHHFPFAJKHTKGI-UHFFFAOYSA-N -1 3 366.216 3.793 20 0 FHADHM O=C(NCCCC1CCC1)c1cc(=O)c2cc(Br)ccc2[n-]1 ZINC000618617382 929838291 /nfs/dbraw/zinc/83/82/91/929838291.db2.gz XZIIGRFULXAUSJ-UHFFFAOYSA-N -1 3 363.255 3.601 20 0 FHADHM CCCCCNC(=O)N1CCC(C(=O)Nc2cc(Cl)ccc2[O-])CC1 ZINC000042844935 930055849 /nfs/dbraw/zinc/05/58/49/930055849.db2.gz ZNSKKTRFWOIIAS-UHFFFAOYSA-N -1 3 367.877 3.596 20 0 FHADHM O=C(CCn1ccc2cc(Cl)ccc21)Nc1n[n-]c(-c2ccco2)n1 ZINC000536308574 930110286 /nfs/dbraw/zinc/11/02/86/930110286.db2.gz 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COc1ccc(Cl)cc1-c1cc(=NC(=O)c2cccc3cc[nH]c32)[nH][n-]1 ZINC000439160606 944382957 /nfs/dbraw/zinc/38/29/57/944382957.db2.gz LWAASJVPYIUABZ-UHFFFAOYSA-N -1 3 366.808 3.894 20 0 FHADHM Cn1ccnc1[C@@H](NC(=O)c1cc(Cc2ccccc2)ccc1[O-])C1CC1 ZINC000436534555 944401452 /nfs/dbraw/zinc/40/14/52/944401452.db2.gz KMUSGQLORIHEKA-FQEVSTJZSA-N -1 3 361.445 3.598 20 0 FHADHM O=C(c1ccccc1[O-])N1CCN(c2ccnc3c(Cl)cccc23)CC1 ZINC000436536429 944403295 /nfs/dbraw/zinc/40/32/95/944403295.db2.gz QESMJMGHXZOMME-UHFFFAOYSA-N -1 3 367.836 3.556 20 0 FHADHM CC(=O)Nc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(C)cc1[O-] ZINC000436551689 944410379 /nfs/dbraw/zinc/41/03/79/944410379.db2.gz RAUUYWAKFLAHNV-UHFFFAOYSA-N -1 3 352.312 3.930 20 0 FHADHM COC(=O)CCN(C(=O)c1cc(Oc2ccccc2)ccc1[O-])C(C)C ZINC000436551577 944411235 /nfs/dbraw/zinc/41/12/35/944411235.db2.gz OZEBHWACTYGPBB-UHFFFAOYSA-N -1 3 357.406 3.598 20 0 FHADHM Cc1ccc(C(=O)N2CCC(CN3CCc4ccccc43)CC2)c([O-])c1 ZINC000436552559 944411851 /nfs/dbraw/zinc/41/18/51/944411851.db2.gz DRJIXFLHMKZLGB-UHFFFAOYSA-N -1 3 350.462 3.616 20 0 FHADHM CC(C)c1ccc(C(=O)N[C@@H](c2nnc3ccccn32)C(C)C)c([O-])c1 ZINC000436543998 944421112 /nfs/dbraw/zinc/42/11/12/944421112.db2.gz NUXWGFKXCVRPCT-GOSISDBHSA-N -1 3 352.438 3.685 20 0 FHADHM CCOC(=O)[C@@H](Cc1ccccc1)N(C)C(=O)c1ccc(C(C)C)cc1[O-] ZINC000436558882 944426221 /nfs/dbraw/zinc/42/62/21/944426221.db2.gz ZVBNGZNTLKAQMH-LJQANCHMSA-N -1 3 369.461 3.762 20 0 FHADHM Cc1ccc(NC(=O)c2cc(Oc3ccccc3)ccc2[O-])cc1C(N)=O ZINC000436562422 944428763 /nfs/dbraw/zinc/42/87/63/944428763.db2.gz AKSVHIPEMPLYAD-UHFFFAOYSA-N -1 3 362.385 3.844 20 0 FHADHM COc1ccc(CCNC(=O)c2ccc(C(C)C)cc2[O-])c(OC)c1OC ZINC000436566458 944431043 /nfs/dbraw/zinc/43/10/43/944431043.db2.gz PSBDOAIAZPOENQ-UHFFFAOYSA-N -1 3 373.449 3.514 20 0 FHADHM Cc1cc(NC(=O)c2cc(Oc3ccccc3)ccc2[O-])ccc1C(N)=O ZINC000436568885 944432898 /nfs/dbraw/zinc/43/28/98/944432898.db2.gz XBGYUWRZZIYHTJ-UHFFFAOYSA-N -1 3 362.385 3.844 20 0 FHADHM NC(=O)Nc1ccc(NC(=O)c2cc(Cc3ccccc3)ccc2[O-])cc1 ZINC000436571654 944435648 /nfs/dbraw/zinc/43/56/48/944435648.db2.gz BPWVOYOEZWHWNT-UHFFFAOYSA-N -1 3 361.401 3.726 20 0 FHADHM COc1ccc(C(=O)N[C@@H](C)c2ccc(-n3nc(C)cc3C)cc2)c([O-])c1 ZINC000436591945 944437674 /nfs/dbraw/zinc/43/76/74/944437674.db2.gz RYCCXOFLTJWPBX-HNNXBMFYSA-N -1 3 365.433 3.694 20 0 FHADHM CC(C)c1ccc(C(=O)N[C@@H](C)c2nc(Cc3ccccc3)no2)c([O-])c1 ZINC000436591237 944438222 /nfs/dbraw/zinc/43/82/22/944438222.db2.gz WAZNCRPKIJONNO-AWEZNQCLSA-N -1 3 365.433 3.980 20 0 FHADHM COCc1nc(CNC(=O)c2cc(Cc3ccccc3)ccc2[O-])cs1 ZINC000436596126 944441008 /nfs/dbraw/zinc/44/10/08/944441008.db2.gz LDCXYVHRLSBOHV-UHFFFAOYSA-N -1 3 368.458 3.516 20 0 FHADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CCOC2(CCCC2)C1 ZINC000436596899 944441320 /nfs/dbraw/zinc/44/13/20/944441320.db2.gz OFSPKGZOOKANBC-UHFFFAOYSA-N -1 3 351.446 3.768 20 0 FHADHM CC(C)CO[C@H]1CCN(C(=O)c2cc(Cc3ccccc3)ccc2[O-])C1 ZINC000436582532 944446059 /nfs/dbraw/zinc/44/60/59/944446059.db2.gz IGQZBSAMNGDVDP-IBGZPJMESA-N -1 3 353.462 3.870 20 0 FHADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CCC[C@@H]2COCC[C@@H]21 ZINC000436587670 944449563 /nfs/dbraw/zinc/44/95/63/944449563.db2.gz QACPWNCKCUZAME-CTNGQTDRSA-N -1 3 365.473 3.819 20 0 FHADHM COc1ccc(C(=O)N2CCCCC[C@H]2CC(=O)c2ccco2)c([O-])c1 ZINC000436589957 944450749 /nfs/dbraw/zinc/45/07/49/944450749.db2.gz XBQHWGNFXHOWGP-AWEZNQCLSA-N -1 3 357.406 3.652 20 0 FHADHM COc1ccc(C(=O)N[C@@H](C)c2ccc(OCC(C)C)c(OC)c2)c([O-])c1 ZINC000436600822 944452762 /nfs/dbraw/zinc/45/27/62/944452762.db2.gz IRBMVWRTJOQHQS-AWEZNQCLSA-N -1 3 373.449 3.935 20 0 FHADHM CC[C@@H](Oc1ccccc1C(C)C)C(=O)N=c1cc(-c2ccncc2)[n-][nH]1 ZINC000518508779 944453751 /nfs/dbraw/zinc/45/37/51/944453751.db2.gz BQZXHAOAUDHYMI-GOSISDBHSA-N -1 3 364.449 3.813 20 0 FHADHM Cc1nc(C)c(CC(=O)N[C@H](CC2CCCCC2)c2ccccc2)c(=O)[n-]1 ZINC000101877293 944456044 /nfs/dbraw/zinc/45/60/44/944456044.db2.gz AFGGWRNYAVSNJC-HXUWFJFHSA-N -1 3 367.493 3.757 20 0 FHADHM Cc1nccn1C[C@@H](C)CNC(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436617491 944465083 /nfs/dbraw/zinc/46/50/83/944465083.db2.gz NMOIWRNBKXEHEB-INIZCTEOSA-N -1 3 363.461 3.554 20 0 FHADHM O=S(=O)([N-][C@@H]1CCSc2ccccc21)c1cccc(Cl)c1F ZINC000032444910 944465363 /nfs/dbraw/zinc/46/53/63/944465363.db2.gz VMHVCPCVMGKSGA-GFCCVEGCSA-N -1 3 357.859 3.995 20 0 FHADHM CC(C)c1ccc(C(=O)N2CCN(C(=O)CC3CCCCC3)CC2)c([O-])c1 ZINC000436624545 944465835 /nfs/dbraw/zinc/46/58/35/944465835.db2.gz JUZKZSAISNXDMX-UHFFFAOYSA-N -1 3 372.509 3.770 20 0 FHADHM COc1ccc([O-])c(C(=O)Nc2cc(NC(=O)C(C)(C)C)ccc2C)c1 ZINC000112020906 944469060 /nfs/dbraw/zinc/46/90/60/944469060.db2.gz WWRKYSOZPPRLBX-UHFFFAOYSA-N -1 3 356.422 3.946 20 0 FHADHM C[C@@](O)(C(=O)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1)C1CC1 ZINC000436631532 944472024 /nfs/dbraw/zinc/47/20/24/944472024.db2.gz SQANBHULQQZTCL-IBGZPJMESA-N -1 3 354.431 3.768 20 0 FHADHM COc1ccc([C@H](NC(=O)c2cc(OC)c([O-])c(OC)c2)C(C)C)cc1 ZINC000436638489 944477310 /nfs/dbraw/zinc/47/73/10/944477310.db2.gz FFWWADCMDFMKQV-GOSISDBHSA-N -1 3 359.422 3.545 20 0 FHADHM CCOc1ccc(Br)cc1NC(=O)c1cc(OC)ccc1[O-] ZINC000436655166 944486700 /nfs/dbraw/zinc/48/67/00/944486700.db2.gz ZDDGZZVLJVHJKA-UHFFFAOYSA-N -1 3 366.211 3.814 20 0 FHADHM Cc1ccc(C(=O)Nc2nc(CN3CCC[C@@H](C)C3)cs2)c([O-])c1C ZINC000436657115 944487485 /nfs/dbraw/zinc/48/74/85/944487485.db2.gz PSXHYSHYRIBCSE-GFCCVEGCSA-N -1 3 359.495 3.950 20 0 FHADHM O=C(c1c([O-])cccc1O)N1CC[C@@H](Oc2ccc(Cl)c(Cl)c2)C1 ZINC000436646003 944493986 /nfs/dbraw/zinc/49/39/86/944493986.db2.gz FSZAXPYZPVORAZ-LLVKDONJSA-N -1 3 368.216 3.698 20 0 FHADHM O=C(Nc1cnn(-c2ccc(C(F)(F)F)cc2)c1)c1c([O-])cccc1O ZINC000436645853 944494437 /nfs/dbraw/zinc/49/44/37/944494437.db2.gz DZWGVTFYXHXLIC-UHFFFAOYSA-N -1 3 363.295 3.555 20 0 FHADHM CCc1nocc1CN(C)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436673443 944507604 /nfs/dbraw/zinc/50/76/04/944507604.db2.gz OMVNQZUUIZECTA-UHFFFAOYSA-N -1 3 350.418 3.806 20 0 FHADHM Cc1cccc(C(=O)Nc2ccc(C(=O)NCCc3ccccc3)cc2)c1[O-] ZINC000436674308 944508271 /nfs/dbraw/zinc/50/82/71/944508271.db2.gz RJVAQLVHDPYWQZ-UHFFFAOYSA-N -1 3 374.440 3.925 20 0 FHADHM CCC[C@H](CC1CCCCC1)C(=O)NCCNC(=O)c1ccc([O-])cc1 ZINC000436678628 944516498 /nfs/dbraw/zinc/51/64/98/944516498.db2.gz HNQZQEYHEXEUMB-GOSISDBHSA-N -1 3 360.498 3.625 20 0 FHADHM O=C(NCCCc1nccs1)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436680827 944519300 /nfs/dbraw/zinc/51/93/00/944519300.db2.gz LCESDICOBIMYHJ-UHFFFAOYSA-N -1 3 366.486 3.997 20 0 FHADHM COc1cc(-c2nc(Cc3c[nH]c4cccc(C)c34)no2)cc(OC)c1[O-] ZINC000436686445 944525839 /nfs/dbraw/zinc/52/58/39/944525839.db2.gz DOMMUYDVLGKWOV-UHFFFAOYSA-N -1 3 365.389 3.840 20 0 FHADHM Cc1ccc([C@@H](C)c2noc(CCNC(=O)c3ccc(C)cc3[O-])n2)cc1 ZINC000436690168 944530189 /nfs/dbraw/zinc/53/01/89/944530189.db2.gz OTEHTJWJGRDHDK-OAHLLOKOSA-N -1 3 365.433 3.516 20 0 FHADHM CCc1ccc([O-])c(C(=O)Nc2ccc(CS(=O)(=O)C(C)C)cc2)c1 ZINC000517720485 944534581 /nfs/dbraw/zinc/53/45/81/944534581.db2.gz KGOKBXOOHUAQRF-UHFFFAOYSA-N -1 3 361.463 3.530 20 0 FHADHM Cc1ccc(C(=O)Nc2cc(CN3CCSCC3)ccc2C)c([O-])c1 ZINC000436710252 944550831 /nfs/dbraw/zinc/55/08/31/944550831.db2.gz RKSNNSQOOWUCHQ-UHFFFAOYSA-N -1 3 356.491 3.810 20 0 FHADHM CCc1ccc(C(=O)Nc2ccc(N(C(C)=O)[C@H]3C[C@H]3C)cc2)c([O-])c1 ZINC000436735838 944565547 /nfs/dbraw/zinc/56/55/47/944565547.db2.gz DOIWKUOKNXLDCZ-YJYMSZOUSA-N -1 3 352.434 3.968 20 0 FHADHM O=C(c1ccccc1[O-])N1CCN(c2c(Cl)cccc2Cl)CC1 ZINC000436739654 944569138 /nfs/dbraw/zinc/56/91/38/944569138.db2.gz OXXJPIOSYZNUCU-UHFFFAOYSA-N -1 3 351.233 3.661 20 0 FHADHM C/C=C\c1ccc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2[O-])cc1 ZINC000436741528 944571297 /nfs/dbraw/zinc/57/12/97/944571297.db2.gz CJWMVHDOCIWWPQ-VGLFAYCPSA-N -1 3 350.418 3.669 20 0 FHADHM CCc1ccc(C(=O)N2CCc3c(ncn3-c3ccc(C)cc3)C2)c([O-])c1 ZINC000436729049 944575454 /nfs/dbraw/zinc/57/54/54/944575454.db2.gz PNYOHVCTPRPHDO-UHFFFAOYSA-N -1 3 361.445 3.647 20 0 FHADHM Cc1nc(CCNC(=O)c2cc(Cc3ccccc3)ccc2[O-])cs1 ZINC000436730998 944576053 /nfs/dbraw/zinc/57/60/53/944576053.db2.gz JLURWDNWPCPMPM-UHFFFAOYSA-N -1 3 352.459 3.720 20 0 FHADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1CC[C@@]2(C1)CCCOC2 ZINC000436731062 944576167 /nfs/dbraw/zinc/57/61/67/944576167.db2.gz ZQTDQPXGMIPHSK-OAQYLSRUSA-N -1 3 353.418 3.827 20 0 FHADHM Cc1ccc(C(=O)Nc2ccccc2C(=O)N2CCCCC2)c([O-])c1C ZINC000436757242 944580947 /nfs/dbraw/zinc/58/09/47/944580947.db2.gz RQXYNDOBMBVRIH-UHFFFAOYSA-N -1 3 352.434 3.887 20 0 FHADHM CNC(=O)c1ccc(NC(=O)c2cc(Oc3ccccc3)ccc2[O-])cc1 ZINC000436758707 944581437 /nfs/dbraw/zinc/58/14/37/944581437.db2.gz NQBCUOBVBNALAL-UHFFFAOYSA-N -1 3 362.385 3.796 20 0 FHADHM C[C@@H](NC(=O)c1cc(Oc2ccccc2)ccc1[O-])c1nnc2ccccn21 ZINC000436753138 944593194 /nfs/dbraw/zinc/59/31/94/944593194.db2.gz CLVMXCKLKUVPIV-CQSZACIVSA-N -1 3 374.400 3.718 20 0 FHADHM COc1ccc(Cl)c([N-]S(=O)(=O)c2cc(OC)ccc2Cl)c1 ZINC000112266485 944617695 /nfs/dbraw/zinc/61/76/95/944617695.db2.gz CSVDGYYDPRPYJB-UHFFFAOYSA-N -1 3 362.234 3.811 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N[C@H](c2ccc(F)cc2F)C(C)C)c1 ZINC000436787246 944632447 /nfs/dbraw/zinc/63/24/47/944632447.db2.gz NOLVRXOMLYXPBX-SFHVURJKSA-N -1 3 362.376 3.756 20 0 FHADHM CCOc1cc(C=Cc2nc(C)cc(=O)[n-]2)cc(Br)c1O ZINC000436785518 944632536 /nfs/dbraw/zinc/63/25/36/944632536.db2.gz UTYJDXCXIRZSTG-PLNGDYQASA-N -1 3 351.200 3.528 20 0 FHADHM CCc1nn(C)cc1-c1noc(-c2cc(Cc3ccccc3)ccc2[O-])n1 ZINC000436787844 944636655 /nfs/dbraw/zinc/63/66/55/944636655.db2.gz ZBXSSFVGDVWZKL-UHFFFAOYSA-N -1 3 360.417 3.996 20 0 FHADHM CCc1ccc(C(=O)N(CC(=O)Nc2ccc(F)cc2)C(C)C)c([O-])c1 ZINC000436796335 944649846 /nfs/dbraw/zinc/64/98/46/944649846.db2.gz JFFQVDDHNASRKD-UHFFFAOYSA-N -1 3 358.413 3.583 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(C(=O)N3CCCC[C@@H]3C)cc2)c([O-])c1 ZINC000436805821 944660293 /nfs/dbraw/zinc/66/02/93/944660293.db2.gz FTBFOCIVRQKADZ-HNNXBMFYSA-N -1 3 352.434 3.968 20 0 FHADHM O=C(CCCc1csc2ccccc12)N=c1cc([C@H]2CCCO2)[n-][nH]1 ZINC000473846079 944667212 /nfs/dbraw/zinc/66/72/12/944667212.db2.gz ICTJTNDTVYLKAS-MRXNPFEDSA-N -1 3 355.463 3.859 20 0 FHADHM CCc1ccc(C(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)c([O-])c1 ZINC000436811848 944667691 /nfs/dbraw/zinc/66/76/91/944667691.db2.gz KWXTTWXLPKBGNL-QGZVFWFLSA-N -1 3 353.418 3.703 20 0 FHADHM COc1ccc(Cl)cc1-c1cc(=NC(=O)c2cccc(C(C)=O)c2)[nH][n-]1 ZINC000487338396 944672873 /nfs/dbraw/zinc/67/28/73/944672873.db2.gz SGCZESZYNHRKFW-UHFFFAOYSA-N -1 3 369.808 3.616 20 0 FHADHM CCc1ccc(C(=O)N2CCC[C@H]2CC(=O)c2ccc(F)cc2)c([O-])c1 ZINC000436831168 944677381 /nfs/dbraw/zinc/67/73/81/944677381.db2.gz DVKRWGCDHIDACM-KRWDZBQOSA-N -1 3 355.409 3.971 20 0 FHADHM CCc1ccc(C(=O)N[C@H](C)c2nc(-c3ccccc3OC)no2)c([O-])c1 ZINC000436831531 944678656 /nfs/dbraw/zinc/67/86/56/944678656.db2.gz GWKHFPKOQNQIGL-GFCCVEGCSA-N -1 3 367.405 3.504 20 0 FHADHM CCOC(=O)C[C@H](C)N(C)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436832087 944679035 /nfs/dbraw/zinc/67/90/35/944679035.db2.gz YOTUBTRIQSODPT-AWEZNQCLSA-N -1 3 357.406 3.598 20 0 FHADHM COc1ccc(CN[C@@H](C(=O)[O-])c2ccc(C)cc2)cc1OCC(C)C ZINC000426686860 944687458 /nfs/dbraw/zinc/68/74/58/944687458.db2.gz OOPSKKYPQWSCEZ-HXUWFJFHSA-N -1 3 357.450 3.954 20 0 FHADHM COCCC[C@H](CNC(=O)c1ccc(O)cc1[O-])c1ccc(Cl)cc1 ZINC000436821141 944688167 /nfs/dbraw/zinc/68/81/67/944688167.db2.gz VAAAZAWNOMJQJK-CQSZACIVSA-N -1 3 363.841 3.691 20 0 FHADHM CCc1ccc(C(=O)N[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)c([O-])c1 ZINC000436821165 944689675 /nfs/dbraw/zinc/68/96/75/944689675.db2.gz VMTDYOAHZGNQFY-CYBMUJFWSA-N -1 3 367.449 3.730 20 0 FHADHM CCc1ccc(C(=O)N(C)[C@@H](c2cnn(C)c2)c2cccc(F)c2)c([O-])c1 ZINC000436821658 944690965 /nfs/dbraw/zinc/69/09/65/944690965.db2.gz QAJKSNFBYUXLMA-HXUWFJFHSA-N -1 3 367.424 3.689 20 0 FHADHM CCc1ccc(C(=O)N(Cc2cccc(OC)c2)C[C@@H]2CCCO2)c([O-])c1 ZINC000436828121 944699157 /nfs/dbraw/zinc/69/91/57/944699157.db2.gz PPBSSOSZYZIEEY-IBGZPJMESA-N -1 3 369.461 3.785 20 0 FHADHM CN(CC[C@H]1CCCO1)C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436838983 944704314 /nfs/dbraw/zinc/70/43/14/944704314.db2.gz KQBPBVNAKJKNRN-LJQANCHMSA-N -1 3 353.462 3.819 20 0 FHADHM O=C([O-])[C@H](CNCc1ccn(-c2ccccc2)n1)Cc1ccccc1Cl ZINC000426703431 944705655 /nfs/dbraw/zinc/70/56/55/944705655.db2.gz LSWDBWGTVZIZCD-INIZCTEOSA-N -1 3 369.852 3.559 20 0 FHADHM COc1ccc(NC(=O)c2ccc(C)cc2[O-])cc1Oc1ccc(C)nn1 ZINC000436839456 944706378 /nfs/dbraw/zinc/70/63/78/944706378.db2.gz PFYQYYYXNYUGMK-UHFFFAOYSA-N -1 3 365.389 3.852 20 0 FHADHM CC(C)c1ccc(C(=O)NCCCc2nc3ccccc3n2C)c([O-])c1 ZINC000436841513 944707253 /nfs/dbraw/zinc/70/72/53/944707253.db2.gz AXVYYAJGCNEWLI-UHFFFAOYSA-N -1 3 351.450 3.765 20 0 FHADHM C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)N=c1cc([C@H]2CCCO2)[n-][nH]1 ZINC000473849384 944709649 /nfs/dbraw/zinc/70/96/49/944709649.db2.gz VZQQIAKZTMRSTN-MEBBXXQBSA-N -1 3 368.264 3.807 20 0 FHADHM CO[C@H]1CN(C(=O)c2cc(CCc3ccccc3)ccc2[O-])CC[C@H]1C ZINC000436842467 944709757 /nfs/dbraw/zinc/70/97/57/944709757.db2.gz WPKOMOGRJBYNCM-IERDGZPVSA-N -1 3 353.462 3.674 20 0 FHADHM C[C@@H](NC(=O)c1ccc(O)cc1[O-])c1ccc(Oc2cccnc2)cc1 ZINC000436847606 944714555 /nfs/dbraw/zinc/71/45/55/944714555.db2.gz RHNSRODULMFWAD-CYBMUJFWSA-N -1 3 350.374 3.776 20 0 FHADHM C[C@H](NC(=O)c1ccc(O)cc1[O-])c1ccc(Oc2cccnc2)cc1 ZINC000436847607 944715003 /nfs/dbraw/zinc/71/50/03/944715003.db2.gz RHNSRODULMFWAD-ZDUSSCGKSA-N -1 3 350.374 3.776 20 0 FHADHM CC(=O)c1ccc(C(=O)Nc2ncc(Cc3ccccc3)s2)cc1[O-] ZINC000436859792 944724398 /nfs/dbraw/zinc/72/43/98/944724398.db2.gz LTVWEIJINCLLID-UHFFFAOYSA-N -1 3 352.415 3.894 20 0 FHADHM Cc1cccc([C@H](NCc2ccc(OC(F)F)c(F)c2)C(=O)[O-])c1C ZINC000426724894 944726171 /nfs/dbraw/zinc/72/61/71/944726171.db2.gz WSIMLHSNEWWMJT-INIZCTEOSA-N -1 3 353.340 3.959 20 0 FHADHM CCc1ccc(-c2nc(-c3ccc(OCCOC)c(F)c3)no2)c([O-])c1 ZINC000436862451 944729199 /nfs/dbraw/zinc/72/91/99/944729199.db2.gz HGTQECYJUAKVRE-UHFFFAOYSA-N -1 3 358.369 3.836 20 0 FHADHM COc1ccc([C@H]2CCCN2C(=O)c2ccc(C(C)=O)c([O-])c2)c(OC)c1 ZINC000436867879 944733792 /nfs/dbraw/zinc/73/37/92/944733792.db2.gz FKDKCMRRKYSCBN-GOSISDBHSA-N -1 3 369.417 3.589 20 0 FHADHM CCc1nc(C)c(CNC(=O)c2cc(Oc3ccccc3)ccc2[O-])o1 ZINC000436869831 944735436 /nfs/dbraw/zinc/73/54/36/944735436.db2.gz BYNCLKQMEVYVLM-UHFFFAOYSA-N -1 3 352.390 3.973 20 0 FHADHM CC(C)n1ncc2cc(CN[C@H](C(=O)[O-])c3cccc(Cl)c3)cnc21 ZINC000426730484 944740058 /nfs/dbraw/zinc/74/00/58/944740058.db2.gz ABEGAUYQABDSAA-INIZCTEOSA-N -1 3 358.829 3.581 20 0 FHADHM COc1cccc(C2(c3noc(-c4cc(OC)c([O-])c(OC)c4)n3)CC2)c1 ZINC000436883737 944757859 /nfs/dbraw/zinc/75/78/59/944757859.db2.gz BWPRBOSUWARFQR-UHFFFAOYSA-N -1 3 368.389 3.548 20 0 FHADHM C[C@@H](C(=O)[O-])[C@@H](NCc1ccc(OC(F)F)c(F)c1)c1ccccc1 ZINC000426749933 944768980 /nfs/dbraw/zinc/76/89/80/944768980.db2.gz JNUCUBAUAQKARP-BDJLRTHQSA-N -1 3 353.340 3.979 20 0 FHADHM CN(C[C@@H]1CCCC[C@H]1O)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436904140 944771799 /nfs/dbraw/zinc/77/17/99/944771799.db2.gz KIMKSCKHSXYACG-HNAYVOBHSA-N -1 3 355.434 3.808 20 0 FHADHM Cc1nc(C)c(CCC(=O)Nc2cc(Cl)ccc2OC(F)F)c(=O)[n-]1 ZINC000425647646 944774964 /nfs/dbraw/zinc/77/49/64/944774964.db2.gz PHIDRKFPYBRQCP-UHFFFAOYSA-N -1 3 371.771 3.625 20 0 FHADHM COc1cc(C)c(CN[C@H](C(=O)[O-])c2ccc(Cl)c(F)c2)cc1OC ZINC000426755471 944776559 /nfs/dbraw/zinc/77/65/59/944776559.db2.gz ZQHKMGDFOWRMLW-KRWDZBQOSA-N -1 3 367.804 3.720 20 0 FHADHM O=C([O-])[C@@H](NCc1ccc(OC(F)F)cc1)c1ccc(Cl)c(F)c1 ZINC000426755331 944776893 /nfs/dbraw/zinc/77/68/93/944776893.db2.gz YKRRKIRAABRIOL-AWEZNQCLSA-N -1 3 359.731 3.996 20 0 FHADHM CC1CCC(N2CCN(C(=O)c3cc(F)c([O-])c(Cl)c3)CC2)CC1 ZINC000436897925 944786968 /nfs/dbraw/zinc/78/69/68/944786968.db2.gz VKVHCXXIMVTDFY-UHFFFAOYSA-N -1 3 354.853 3.521 20 0 FHADHM CCC(=CC(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1)c1ccc(C)cc1 ZINC000736302443 944792448 /nfs/dbraw/zinc/79/24/48/944792448.db2.gz FTESMJFJWPYYLK-LGMDPLHJSA-N -1 3 361.449 3.627 20 0 FHADHM CCC(=CC(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1)c1ccc(C)cc1 ZINC000736302443 944792456 /nfs/dbraw/zinc/79/24/56/944792456.db2.gz FTESMJFJWPYYLK-LGMDPLHJSA-N -1 3 361.449 3.627 20 0 FHADHM CCOc1cc(CN[C@H](C(=O)[O-])c2cccc(F)c2)ccc1OC(F)F ZINC000426767449 944805092 /nfs/dbraw/zinc/80/50/92/944805092.db2.gz NBOJWFMROQWJEM-INIZCTEOSA-N -1 3 369.339 3.741 20 0 FHADHM CCC[C@@H](CC)S(=O)(=O)[N-]c1ccc(NC(C)=O)cc1C(F)(F)F ZINC000517912804 944812925 /nfs/dbraw/zinc/81/29/25/944812925.db2.gz RRRYMWXOBDEVRM-GFCCVEGCSA-N -1 3 366.405 3.984 20 0 FHADHM CC(C)c1ccc(C(=O)N2CC[C@](CO)(Cc3ccc(F)cc3)C2)c([O-])c1 ZINC000436928072 944813873 /nfs/dbraw/zinc/81/38/73/944813873.db2.gz RJZMLEWYHPYTCJ-QFIPXVFZSA-N -1 3 371.452 3.722 20 0 FHADHM CCC[C@]1(CO)CCN(C(=O)c2cc(CCc3ccccc3)ccc2[O-])C1 ZINC000436927892 944815014 /nfs/dbraw/zinc/81/50/14/944815014.db2.gz UHEWHAZNQXLDGV-QHCPKHFHSA-N -1 3 367.489 3.802 20 0 FHADHM COCCC1(C)CN(C(=O)c2cc(CCc3ccccc3)ccc2[O-])C1 ZINC000436930173 944816141 /nfs/dbraw/zinc/81/61/41/944816141.db2.gz XBDPWFYFNYQCKE-UHFFFAOYSA-N -1 3 353.462 3.676 20 0 FHADHM O=C([O-])[C@H](NCc1ccc(Cl)c(C(F)(F)F)c1)c1ccc(O)cc1 ZINC000426807388 944821237 /nfs/dbraw/zinc/82/12/37/944821237.db2.gz HJJZFAPTTMLTGL-CQSZACIVSA-N -1 3 359.731 3.980 20 0 FHADHM CC(C)c1ccc(C(=O)N2CCCN3c4ccccc4C[C@@H]3C2)c([O-])c1 ZINC000436933806 944821320 /nfs/dbraw/zinc/82/13/20/944821320.db2.gz DPRCDMOAIYFFAJ-GOSISDBHSA-N -1 3 350.462 3.793 20 0 FHADHM O=C([O-])[C@@H](NCc1ccc(OCc2ccncc2)cc1)c1cccc(F)c1 ZINC000426800956 944822387 /nfs/dbraw/zinc/82/23/87/944822387.db2.gz PLQLHYAOCYIZJX-FQEVSTJZSA-N -1 3 366.392 3.715 20 0 FHADHM Cc1cc(CNC(=O)c2cc3ccccc3cc2[O-])cc(N2CCCC2)n1 ZINC000436934616 944822665 /nfs/dbraw/zinc/82/26/65/944822665.db2.gz XJOYSMLRLGJLKM-UHFFFAOYSA-N -1 3 361.445 3.779 20 0 FHADHM Cc1ccc(C(=O)Nc2cccc(CN3C[C@@H](C)O[C@H](C)C3)c2)c([O-])c1 ZINC000436940441 944827770 /nfs/dbraw/zinc/82/77/70/944827770.db2.gz ADTOUMRDGJQDAW-HZPDHXFCSA-N -1 3 354.450 3.562 20 0 FHADHM O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc2c(c1[O-])CCCC2 ZINC000436950832 944832963 /nfs/dbraw/zinc/83/29/63/944832963.db2.gz WFGYYBUHMDCMTP-UHFFFAOYSA-N -1 3 364.445 3.759 20 0 FHADHM CCOc1cc(CN[C@@H](C(=O)[O-])c2cccs2)cc(Cl)c1OC ZINC000426812587 944834354 /nfs/dbraw/zinc/83/43/54/944834354.db2.gz RBBFDQHARBZNDN-CQSZACIVSA-N -1 3 355.843 3.724 20 0 FHADHM CN(C)c1ncccc1CNC(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436953966 944849258 /nfs/dbraw/zinc/84/92/58/944849258.db2.gz SZSASYJEDAIEBW-UHFFFAOYSA-N -1 3 363.417 3.576 20 0 FHADHM COc1ccc([C@@H](NCc2cccc(-c3ccncc3)c2)C(=O)[O-])cc1F ZINC000426827027 944851698 /nfs/dbraw/zinc/85/16/98/944851698.db2.gz VKRDWBPBILYFNB-HXUWFJFHSA-N -1 3 366.392 3.812 20 0 FHADHM CCCCOCC[N-]S(=O)(=O)c1csc(-c2ccc(Cl)cc2)n1 ZINC000500421940 944852098 /nfs/dbraw/zinc/85/20/98/944852098.db2.gz IMEYVAYZNXHOOY-UHFFFAOYSA-N -1 3 374.915 3.559 20 0 FHADHM CC(=O)Nc1cccc2c1CCCN2C(=O)c1ccc2c(c1[O-])CCCC2 ZINC000436958721 944855712 /nfs/dbraw/zinc/85/57/12/944855712.db2.gz JNAXNQIXAFYGJF-UHFFFAOYSA-N -1 3 364.445 3.822 20 0 FHADHM Cc1oncc1C(=O)Nc1ccc([O-])c(C(=O)NCC(C)(C)CC(C)C)c1 ZINC000436974998 944864166 /nfs/dbraw/zinc/86/41/66/944864166.db2.gz FLAKYYUCZMMGNY-UHFFFAOYSA-N -1 3 373.453 3.743 20 0 FHADHM CCc1cc(=O)c2cc(NC(=O)c3ccc4c(c3[O-])CCCC4)ccc2[nH]1 ZINC000436978744 944869186 /nfs/dbraw/zinc/86/91/86/944869186.db2.gz JCINHLHCJBRGJS-UHFFFAOYSA-N -1 3 362.429 3.927 20 0 FHADHM CCCCOc1ccc(C(=O)N(C)Cc2cccc(N(C)C)c2)c([O-])c1 ZINC000436981923 944872725 /nfs/dbraw/zinc/87/27/25/944872725.db2.gz RTOAXSFDZHPFRS-UHFFFAOYSA-N -1 3 356.466 3.909 20 0 FHADHM C[C@@H]1CN(C(=O)c2cc(Oc3ccccc3)ccc2[O-])C[C@H](C2CC2)O1 ZINC000436987238 944878420 /nfs/dbraw/zinc/87/84/20/944878420.db2.gz ULIKCKBBNGMLRG-JLTOFOAXSA-N -1 3 353.418 3.824 20 0 FHADHM Cc1ccc(CNCc2c(F)ccc([O-])c2F)c(OC[C@@H]2CCOC2)c1 ZINC000511664064 944892161 /nfs/dbraw/zinc/89/21/61/944892161.db2.gz FWEFLDAWPJMBLL-CQSZACIVSA-N -1 3 363.404 3.684 20 0 FHADHM COc1ccc(C(=O)N(C)Cc2ccc(Br)cc2C)c([O-])c1 ZINC000436998374 944893455 /nfs/dbraw/zinc/89/34/55/944893455.db2.gz BPHQNAAHHNZHRN-UHFFFAOYSA-N -1 3 364.239 3.744 20 0 FHADHM O=C(CC1(CSc2ccccc2)CC1)N=c1cc([C@H]2CCCO2)[n-][nH]1 ZINC000473852072 944922237 /nfs/dbraw/zinc/92/22/37/944922237.db2.gz UAKPEUNUHLSACC-MRXNPFEDSA-N -1 3 357.479 3.584 20 0 FHADHM CC(C)Cc1cccc([C@@H](C)C(=O)Nc2ccccc2[N-]S(C)(=O)=O)c1 ZINC000505933580 944937017 /nfs/dbraw/zinc/93/70/17/944937017.db2.gz KDOXGFXLMVYXJR-OAHLLOKOSA-N -1 3 374.506 3.999 20 0 FHADHM CC(C)Nc1ccc(C(=O)Nc2cc(Br)ccc2[O-])cn1 ZINC000426953759 944948688 /nfs/dbraw/zinc/94/86/88/944948688.db2.gz KYKGTXZQKRIHAJ-UHFFFAOYSA-N -1 3 350.216 3.622 20 0 FHADHM O=C(c1cc([O-])ccc1Cl)N(CCCO)Cc1cccc(Cl)c1 ZINC000516518406 944966345 /nfs/dbraw/zinc/96/63/45/944966345.db2.gz IXTYAJXFKKFCDH-UHFFFAOYSA-N -1 3 354.233 3.724 20 0 FHADHM COc1cc(C(=O)N2[C@H](C)C[C@@H](c3ccccc3)[C@H]2C)cc(OC)c1[O-] ZINC000426974580 944975211 /nfs/dbraw/zinc/97/52/11/944975211.db2.gz XKSWODKJBJCLFO-CKEIUWERSA-N -1 3 355.434 3.816 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)N[C@H]3CCc4ccccc43)cc2)cc(=O)[n-]1 ZINC000505955828 944979480 /nfs/dbraw/zinc/97/94/80/944979480.db2.gz BIFBTUGFJRMBIF-SFHVURJKSA-N -1 3 360.417 3.967 20 0 FHADHM O=C(N=c1cc([C@H]2CCCO2)[n-][nH]1)c1csc(-c2ccccc2Cl)n1 ZINC000473853000 944990782 /nfs/dbraw/zinc/99/07/82/944990782.db2.gz CKPAFWDVKNNAKW-CQSZACIVSA-N -1 3 374.853 3.712 20 0 FHADHM COC(=O)c1cc(S(=O)(=O)[N-]c2cc(Cl)ccc2Cl)cs1 ZINC000438774015 945012452 /nfs/dbraw/zinc/01/24/52/945012452.db2.gz NVACTTFOPCQCIB-UHFFFAOYSA-N -1 3 366.247 3.642 20 0 FHADHM CC(C)(NC(=O)c1cc(F)cc2n[n-]nc21)c1cccc(Cl)c1F ZINC000505967542 945017395 /nfs/dbraw/zinc/01/73/95/945017395.db2.gz GWJMMCBNGCPNLB-UHFFFAOYSA-N -1 3 350.756 3.555 20 0 FHADHM CCOc1ccc([N-]S(=O)(=O)c2ccc(F)c(Br)c2)cc1 ZINC000438784857 945027160 /nfs/dbraw/zinc/02/71/60/945027160.db2.gz LFLPCUCDIRSVEL-UHFFFAOYSA-N -1 3 374.231 3.788 20 0 FHADHM Cc1nc(-c2ccc(N3C(=O)NC4(CCCCCC4)C3=O)cc2)cc(=O)[n-]1 ZINC000330247172 945422831 /nfs/dbraw/zinc/42/28/31/945422831.db2.gz FLKRVPKLERHBFV-UHFFFAOYSA-N -1 3 366.421 3.511 20 0 FHADHM Cc1ccc(C[C@@H](CNCc2coc(-c3ccccc3)n2)C(=O)[O-])cc1 ZINC000426636431 945429528 /nfs/dbraw/zinc/42/95/28/945429528.db2.gz FZVKOGLCSAGGNK-SFHVURJKSA-N -1 3 350.418 3.683 20 0 FHADHM Cc1cc(=O)[n-]c(C(C)(C)NCc2csc(-c3ccccc3F)n2)n1 ZINC000660746058 945451588 /nfs/dbraw/zinc/45/15/88/945451588.db2.gz IVRQVIVYIUHYGK-UHFFFAOYSA-N -1 3 358.442 3.778 20 0 FHADHM O=C([O-])[C@@H](CNCc1cccc(Cl)c1Cl)Oc1ccc(F)cc1 ZINC000426642030 945452662 /nfs/dbraw/zinc/45/26/62/945452662.db2.gz DNTJIUZEOXJPHX-CQSZACIVSA-N -1 3 358.196 3.754 20 0 FHADHM Cc1ccccc1C[C@@H](CNCc1nc2c(s1)C[C@@H](C)CC2)C(=O)[O-] ZINC000426643733 945455921 /nfs/dbraw/zinc/45/59/21/945455921.db2.gz RVABZCLMEFUWLP-BBRMVZONSA-N -1 3 358.507 3.609 20 0 FHADHM Cc1ccccc1C[C@@H](CNCc1nc2c(s1)C[C@H](C)CC2)C(=O)[O-] ZINC000426643734 945456068 /nfs/dbraw/zinc/45/60/68/945456068.db2.gz RVABZCLMEFUWLP-CJNGLKHVSA-N -1 3 358.507 3.609 20 0 FHADHM Cc1ccccc1C[C@H](CNCc1nc2c(s1)C[C@@H](C)CC2)C(=O)[O-] ZINC000426643736 945456288 /nfs/dbraw/zinc/45/62/88/945456288.db2.gz RVABZCLMEFUWLP-XJKSGUPXSA-N -1 3 358.507 3.609 20 0 FHADHM O=C([O-])[C@H](CNCc1ccc(-c2ccccc2F)o1)Oc1ccc(F)cc1 ZINC000426648047 945460801 /nfs/dbraw/zinc/46/08/01/945460801.db2.gz QZRNUAYZKIDVMY-IBGZPJMESA-N -1 3 373.355 3.847 20 0 FHADHM CC[C@H](C)[C@@H]1CCCCN1C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820859569 945572991 /nfs/dbraw/zinc/57/29/91/945572991.db2.gz FSXXTFGMSGOFQY-VBQJREDUSA-N -1 3 356.474 3.538 20 0 FHADHM CC[C@H](C)[C@@H]1CCCCN1C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820859569 945572997 /nfs/dbraw/zinc/57/29/97/945572997.db2.gz FSXXTFGMSGOFQY-VBQJREDUSA-N -1 3 356.474 3.538 20 0 FHADHM CC(C)(Cc1cccc(Cl)c1)C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000440524297 945602177 /nfs/dbraw/zinc/60/21/77/945602177.db2.gz JSQOYMUDSSPFPL-UHFFFAOYSA-N -1 3 355.829 3.728 20 0 FHADHM CC(C)(Cc1cccc(Cl)c1)C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000440524297 945602186 /nfs/dbraw/zinc/60/21/86/945602186.db2.gz JSQOYMUDSSPFPL-UHFFFAOYSA-N -1 3 355.829 3.728 20 0 FHADHM O=C(NCc1ncccc1[O-])[C@H](Sc1ccccc1)c1ccccc1 ZINC000473633890 945634530 /nfs/dbraw/zinc/63/45/30/945634530.db2.gz MHGHQIDVNQCUDA-LJQANCHMSA-N -1 3 350.443 3.937 20 0 FHADHM O=C(NCc1ncccc1[O-])c1cccnc1SCc1ccc(F)cc1 ZINC000473635036 945635573 /nfs/dbraw/zinc/63/55/73/945635573.db2.gz DCBSKAFVQDXMBT-UHFFFAOYSA-N -1 3 369.421 3.544 20 0 FHADHM O=C(NCc1ncccc1[O-])[C@@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1 ZINC000473629730 945638909 /nfs/dbraw/zinc/63/89/09/945638909.db2.gz KFNXKVGBAILXFS-WOJBJXKFSA-N -1 3 374.440 3.786 20 0 FHADHM O=C(NCc1ncccc1[O-])c1cccc(-n2nccc2-c2ccccc2)c1 ZINC000473637453 945660009 /nfs/dbraw/zinc/66/00/09/945660009.db2.gz KNVSAJZTBDQEQM-UHFFFAOYSA-N -1 3 370.412 3.570 20 0 FHADHM O=C(CCC(=O)c1ccc(-c2ccccc2)cc1)NCc1ncccc1[O-] ZINC000473643243 945688826 /nfs/dbraw/zinc/68/88/26/945688826.db2.gz RIKIMPBMJCEZPL-UHFFFAOYSA-N -1 3 360.413 3.734 20 0 FHADHM O=C(CCCOc1cccc(Cl)c1Cl)NCc1ncccc1[O-] ZINC000473647060 945712396 /nfs/dbraw/zinc/71/23/96/945712396.db2.gz YWJMFKFJYOROJT-UHFFFAOYSA-N -1 3 355.221 3.569 20 0 FHADHM Cc1ccc(NC(=O)[C@H](C)SCc2cc(=O)[n-]c(C3CC3)n2)cc1C ZINC000519755344 945737544 /nfs/dbraw/zinc/73/75/44/945737544.db2.gz RKCIKNHGQRNWKM-ZDUSSCGKSA-N -1 3 357.479 3.937 20 0 FHADHM CCOc1cc(C)ccc1C[N-]S(=O)(=O)c1ccccc1SC ZINC000444070889 945787289 /nfs/dbraw/zinc/78/72/89/945787289.db2.gz LPWQMZYEYYVXJH-UHFFFAOYSA-N -1 3 351.493 3.594 20 0 FHADHM CCc1oc(C(=O)Nc2cccc(-c3nc(CC)cc(=O)[n-]3)c2)cc1C ZINC000123554900 945799794 /nfs/dbraw/zinc/79/97/94/945799794.db2.gz ZWRYJUHVCLVKGV-UHFFFAOYSA-N -1 3 351.406 3.715 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@@H](C)Oc3ccc(F)cc3)nc2)n1 ZINC000301483155 945809136 /nfs/dbraw/zinc/80/91/36/945809136.db2.gz XPPUBUMYPYFPPW-CYBMUJFWSA-N -1 3 368.412 3.825 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)c3ccc(F)c(F)c3)c2)n1 ZINC000049302214 945831130 /nfs/dbraw/zinc/83/11/30/945831130.db2.gz VNUAULOABJEKKI-UHFFFAOYSA-N -1 3 355.344 3.530 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H](CCO)C3CCCCC3)nc2)n1 ZINC000301529490 945832985 /nfs/dbraw/zinc/83/29/85/945832985.db2.gz JFUXHMFUOIVSAH-KRWDZBQOSA-N -1 3 356.470 3.550 20 0 FHADHM COc1ccc(-c2ccc(CNc3ccc(-c4nnn[n-]4)cn3)s2)cc1 ZINC000821727330 945848302 /nfs/dbraw/zinc/84/83/02/945848302.db2.gz HTTVVKVOEWZCIT-UHFFFAOYSA-N -1 3 364.434 3.611 20 0 FHADHM COc1ccc(-c2ccc(CNc3ccc(-c4nn[n-]n4)cn3)s2)cc1 ZINC000821727330 945848317 /nfs/dbraw/zinc/84/83/17/945848317.db2.gz HTTVVKVOEWZCIT-UHFFFAOYSA-N -1 3 364.434 3.611 20 0 FHADHM CCCCc1ccc([C@H](NC(=O)Cc2c(C)nc(C)[n-]c2=O)C(C)C)cc1 ZINC000045058323 945919299 /nfs/dbraw/zinc/91/92/99/945919299.db2.gz DUYLDUUYKZGYGQ-OAQYLSRUSA-N -1 3 369.509 3.785 20 0 FHADHM CN(C(=O)c1c[n-]c2c(OC(F)(F)F)cccc2c1=O)C1CCCCC1 ZINC000522870917 946027245 /nfs/dbraw/zinc/02/72/45/946027245.db2.gz PCJONECUUAKKJW-UHFFFAOYSA-N -1 3 368.355 3.831 20 0 FHADHM O=S(=O)([N-]C1CCC(F)(F)CC1)c1ccc(C(F)(F)F)cc1F ZINC000444199022 946062568 /nfs/dbraw/zinc/06/25/68/946062568.db2.gz AOIGBCRXWPJXGZ-UHFFFAOYSA-N -1 3 361.307 3.701 20 0 FHADHM COc1cc(CCC(=O)Nc2ccc([O-])c(C(F)(F)F)c2)cc(OC)c1 ZINC000440985756 946081568 /nfs/dbraw/zinc/08/15/68/946081568.db2.gz JRQSEJKFWIHDBY-UHFFFAOYSA-N -1 3 369.339 4.000 20 0 FHADHM C[C@H](C(=O)Nc1ccc([O-])c(C(F)(F)F)c1)N1CCc2ccccc2C1 ZINC000440974410 946085908 /nfs/dbraw/zinc/08/59/08/946085908.db2.gz BMXGYWASCFQYPA-GFCCVEGCSA-N -1 3 364.367 3.796 20 0 FHADHM CC[C@H]1C[C@@H](C)CN1C(=O)c1c[n-]c2ccc(Br)cc2c1=O ZINC000444289066 946167165 /nfs/dbraw/zinc/16/71/65/946167165.db2.gz HAGMADGOVBURRG-PWSUYJOCSA-N -1 3 363.255 3.551 20 0 FHADHM O=S(=O)([N-]Cc1ccco1)c1csc(-c2ccc(Cl)cc2)n1 ZINC000500436115 946212644 /nfs/dbraw/zinc/21/26/44/946212644.db2.gz ZZDQFZGDHMJTLV-UHFFFAOYSA-N -1 3 354.840 3.535 20 0 FHADHM O=C(C/C=C\c1ccc(F)cc1)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000822945495 946227283 /nfs/dbraw/zinc/22/72/83/946227283.db2.gz HNVCTGHSLAWSJT-UPHRSURJSA-N -1 3 357.776 3.701 20 0 FHADHM O=C(C/C=C\c1ccc(F)cc1)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000822945495 946227292 /nfs/dbraw/zinc/22/72/92/946227292.db2.gz HNVCTGHSLAWSJT-UPHRSURJSA-N -1 3 357.776 3.701 20 0 FHADHM CC[C@@H](C)N(C)C(=O)C[C@@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000184145481 946231660 /nfs/dbraw/zinc/23/16/60/946231660.db2.gz RLZLLKFRLDTQLE-DNVCBOLYSA-N -1 3 354.450 3.510 20 0 FHADHM CCCc1nnc([N-]C(=O)c2ccc(COc3ccccc3OC)o2)s1 ZINC000042386878 946262558 /nfs/dbraw/zinc/26/25/58/946262558.db2.gz SOFFYNHJYACGLC-UHFFFAOYSA-N -1 3 373.434 3.924 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NCc3ccccc3-n3ccnc3)nc2)n1 ZINC000302689221 946280846 /nfs/dbraw/zinc/28/08/46/946280846.db2.gz USHITADAFIJSPO-UHFFFAOYSA-N -1 3 372.432 3.604 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@@](C)(O)C3CCCCC3)nc2)n1 ZINC000302696916 946283688 /nfs/dbraw/zinc/28/36/88/946283688.db2.gz GTFHEODXWKSJGX-HXUWFJFHSA-N -1 3 356.470 3.550 20 0 FHADHM C[C@H](Cc1ccsc1)[N-]S(=O)(=O)c1csc(-c2ccccc2)n1 ZINC000520223371 946303073 /nfs/dbraw/zinc/30/30/73/946303073.db2.gz FUMCBWYJUMSBJP-GFCCVEGCSA-N -1 3 364.517 3.781 20 0 FHADHM CCSc1ccc([C@H](C)NC(=O)c2cc(NC(C)=O)ccc2[O-])cc1 ZINC000103526104 946314887 /nfs/dbraw/zinc/31/48/87/946314887.db2.gz CGFVTWJUOLDUEZ-LBPRGKRZSA-N -1 3 358.463 3.954 20 0 FHADHM Cc1cnc(N2CCC(C(=O)Nc3cc(Cl)ccc3[O-])CC2)s1 ZINC000302843838 946348912 /nfs/dbraw/zinc/34/89/12/946348912.db2.gz NCECMXDLYBPNDE-UHFFFAOYSA-N -1 3 351.859 3.666 20 0 FHADHM O=C(Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1)[C@H]1[C@@H]2CCCC[C@@H]21 ZINC000823383487 946421732 /nfs/dbraw/zinc/42/17/32/946421732.db2.gz SIVRIDHPNVPOAA-VIKVFOODSA-N -1 3 365.462 3.970 20 0 FHADHM O=C(Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1)[C@H]1[C@@H]2CCCC[C@@H]21 ZINC000823383487 946421739 /nfs/dbraw/zinc/42/17/39/946421739.db2.gz SIVRIDHPNVPOAA-VIKVFOODSA-N -1 3 365.462 3.970 20 0 FHADHM C[C@@H]1CN(CC(F)(F)F)CCN(C(=O)c2cc([O-])c3ccccc3c2)C1 ZINC000456627798 946471515 /nfs/dbraw/zinc/47/15/15/946471515.db2.gz AMSFMJYEAHUQDJ-CYBMUJFWSA-N -1 3 366.383 3.502 20 0 FHADHM c1cc(OC2CCCCC2)ccc1CNc1ccc(-c2nnn[n-]2)nc1 ZINC000823756760 946476876 /nfs/dbraw/zinc/47/68/76/946476876.db2.gz HBXKWRDLQMVADL-UHFFFAOYSA-N -1 3 350.426 3.585 20 0 FHADHM c1cc(OC2CCCCC2)ccc1CNc1ccc(-c2nn[n-]n2)nc1 ZINC000823756760 946476879 /nfs/dbraw/zinc/47/68/79/946476879.db2.gz HBXKWRDLQMVADL-UHFFFAOYSA-N -1 3 350.426 3.585 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N3CC[C@@H]4CC[C@@]43c3cccnc3)nc2)n1 ZINC000897070704 946565651 /nfs/dbraw/zinc/56/56/51/946565651.db2.gz MCFHYLCNPXRIAM-AOMKIAJQSA-N -1 3 373.460 3.717 20 0 FHADHM Cc1cc(S(=O)(=O)[N-]CCCCOCc2ccccc2)sc1Cl ZINC000473901270 946580272 /nfs/dbraw/zinc/58/02/72/946580272.db2.gz HIUUAUOQQDLDRV-UHFFFAOYSA-N -1 3 373.927 3.985 20 0 FHADHM CC(C)(C)Oc1c(F)cc(NC(=O)c2ccc(-c3nnn[n-]3)cc2)cc1F ZINC000824119977 946596714 /nfs/dbraw/zinc/59/67/14/946596714.db2.gz WDVCCUJFKCJKAT-UHFFFAOYSA-N -1 3 373.363 3.575 20 0 FHADHM CC(C)(C)Oc1c(F)cc(NC(=O)c2ccc(-c3nn[n-]n3)cc2)cc1F ZINC000824119977 946596719 /nfs/dbraw/zinc/59/67/19/946596719.db2.gz WDVCCUJFKCJKAT-UHFFFAOYSA-N -1 3 373.363 3.575 20 0 FHADHM O=C(NCCCOc1ccc2ccccc2c1)c1cc(=O)c2ccccc2[n-]1 ZINC000475540879 946626472 /nfs/dbraw/zinc/62/64/72/946626472.db2.gz BDKUABASDRKGAW-UHFFFAOYSA-N -1 3 372.424 3.880 20 0 FHADHM Brc1cc(Nc2ccc3ncsc3c2)ccc1-c1nnn[n-]1 ZINC001573280003 946653317 /nfs/dbraw/zinc/65/33/17/946653317.db2.gz ODLIFYPNRPLANE-UHFFFAOYSA-N -1 3 373.239 3.983 20 0 FHADHM Brc1cc(Nc2ccc3ncsc3c2)ccc1-c1nn[n-]n1 ZINC001573280003 946653324 /nfs/dbraw/zinc/65/33/24/946653324.db2.gz ODLIFYPNRPLANE-UHFFFAOYSA-N -1 3 373.239 3.983 20 0 FHADHM Brc1cc(N2CCC[C@@H]2C2CCCC2)ccc1-c1nnn[n-]1 ZINC001573280494 946663104 /nfs/dbraw/zinc/66/31/04/946663104.db2.gz SZEHDQWIOQACPN-OAHLLOKOSA-N -1 3 362.275 3.788 20 0 FHADHM Brc1cc(N2CCC[C@@H]2C2CCCC2)ccc1-c1nn[n-]n1 ZINC001573280494 946663108 /nfs/dbraw/zinc/66/31/08/946663108.db2.gz SZEHDQWIOQACPN-OAHLLOKOSA-N -1 3 362.275 3.788 20 0 FHADHM CC(C)c1ccc([C@@H]2CCCCN2C(=O)c2cc(-c3nnn[n-]3)c[nH]2)cc1 ZINC000824347985 946665365 /nfs/dbraw/zinc/66/53/65/946665365.db2.gz VPDCHNNHLWUTCW-SFHVURJKSA-N -1 3 364.453 3.686 20 0 FHADHM CC(C)c1ccc([C@@H]2CCCCN2C(=O)c2cc(-c3nn[n-]n3)c[nH]2)cc1 ZINC000824347985 946665367 /nfs/dbraw/zinc/66/53/67/946665367.db2.gz VPDCHNNHLWUTCW-SFHVURJKSA-N -1 3 364.453 3.686 20 0 FHADHM CCOc1ccc([C@@H](C)NC(=O)c2ccc(OC)cc2[O-])cc1OCC ZINC000104655391 946676314 /nfs/dbraw/zinc/67/63/14/946676314.db2.gz IUUNNWODBCDIOR-CYBMUJFWSA-N -1 3 359.422 3.689 20 0 FHADHM C[C@@H](NC(=O)[C@H](C)C1CC1)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824470438 946723360 /nfs/dbraw/zinc/72/33/60/946723360.db2.gz IDNFZGNKEUAQIB-ZIAGYGMSSA-N -1 3 361.449 3.757 20 0 FHADHM C[C@@H](NC(=O)[C@H](C)C1CC1)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824470438 946723370 /nfs/dbraw/zinc/72/33/70/946723370.db2.gz IDNFZGNKEUAQIB-ZIAGYGMSSA-N -1 3 361.449 3.757 20 0 FHADHM C[C@H](NC(=O)NC1CC=CC1)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824498206 946743186 /nfs/dbraw/zinc/74/31/86/946743186.db2.gz DOLBYGRRLRFCQI-AWEZNQCLSA-N -1 3 374.448 3.613 20 0 FHADHM C[C@H](NC(=O)NC1CC=CC1)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824498206 946743194 /nfs/dbraw/zinc/74/31/94/946743194.db2.gz DOLBYGRRLRFCQI-AWEZNQCLSA-N -1 3 374.448 3.613 20 0 FHADHM O=C(NCCc1ccc(C(F)(F)F)cc1)NCc1ccc([O-])c(F)c1 ZINC000121442459 946744207 /nfs/dbraw/zinc/74/42/07/946744207.db2.gz DYOARNYDFDZAHG-UHFFFAOYSA-N -1 3 356.319 3.592 20 0 FHADHM C[C@@H](N[C@H](c1nccs1)c1ccccc1)c1cccc(-c2nnn[n-]2)c1 ZINC000824537630 946775946 /nfs/dbraw/zinc/77/59/46/946775946.db2.gz FGRQKKHVVRAHKQ-DYVFJYSZSA-N -1 3 362.462 3.763 20 0 FHADHM C[C@@H](N[C@H](c1nccs1)c1ccccc1)c1cccc(-c2nn[n-]n2)c1 ZINC000824537630 946775959 /nfs/dbraw/zinc/77/59/59/946775959.db2.gz FGRQKKHVVRAHKQ-DYVFJYSZSA-N -1 3 362.462 3.763 20 0 FHADHM COCC[C@H]([N-]S(=O)(=O)c1cc(C)c(Cl)s1)c1ccc(C)o1 ZINC000473939168 946799973 /nfs/dbraw/zinc/79/99/73/946799973.db2.gz VBXWBEZRRCPFKT-NSHDSACASA-N -1 3 363.888 3.667 20 0 FHADHM CC(C)=CCC[C@@H](C)CC(=O)Nc1ccc(-c2nnn[n-]2)cc1C(C)=O ZINC001573551301 946871152 /nfs/dbraw/zinc/87/11/52/946871152.db2.gz IZVQQICWUJABAL-CYBMUJFWSA-N -1 3 355.442 3.780 20 0 FHADHM CC(C)=CCC[C@@H](C)CC(=O)Nc1ccc(-c2nn[n-]n2)cc1C(C)=O ZINC001573551301 946871162 /nfs/dbraw/zinc/87/11/62/946871162.db2.gz IZVQQICWUJABAL-CYBMUJFWSA-N -1 3 355.442 3.780 20 0 FHADHM Cc1cc(S(=O)(=O)[N-][C@H]2CCO[C@@H](CC(C)C)C2)sc1Cl ZINC000473948832 946871764 /nfs/dbraw/zinc/87/17/64/946871764.db2.gz IFPOZTILLCALKG-RYUDHWBXSA-N -1 3 351.921 3.582 20 0 FHADHM Cc1cc(S(=O)(=O)[N-][C@@H]2CCO[C@@H](CC(C)C)C2)sc1Cl ZINC000473948828 946872009 /nfs/dbraw/zinc/87/20/09/946872009.db2.gz IFPOZTILLCALKG-NEPJUHHUSA-N -1 3 351.921 3.582 20 0 FHADHM O=C(c1cc(F)cc2n[n-]nc21)N1CC2(CCCC2)c2cccc(F)c21 ZINC000328657586 946968181 /nfs/dbraw/zinc/96/81/81/946968181.db2.gz PIKICGRXEPYRBB-UHFFFAOYSA-N -1 3 354.360 3.708 20 0 FHADHM C[C@@H]1CC[C@@H](C(=O)NCc2cccc(-c3ccc(-c4nnn[n-]4)s3)c2)C1 ZINC000824898296 946977227 /nfs/dbraw/zinc/97/72/27/946977227.db2.gz DXIWIKJRUQPTFC-IUODEOHRSA-N -1 3 367.478 3.648 20 0 FHADHM O=C([O-])c1cccc(OCCN(Cc2cccc(F)c2)C[C@@H]2CCCO2)c1 ZINC000652404568 947036237 /nfs/dbraw/zinc/03/62/37/947036237.db2.gz DHEZJVSPYBMKKB-FQEVSTJZSA-N -1 3 373.424 3.584 20 0 FHADHM CC[C@@H](C)NC(=O)[C@@H](Sc1cccc(Cl)c1-c1nnn[n-]1)C(C)C ZINC000825069266 947069178 /nfs/dbraw/zinc/06/91/78/947069178.db2.gz ZJQCLHKKPVPBEM-YGRLFVJLSA-N -1 3 367.906 3.552 20 0 FHADHM CC[C@@H](C)NC(=O)[C@@H](Sc1cccc(Cl)c1-c1nn[n-]n1)C(C)C ZINC000825069266 947069189 /nfs/dbraw/zinc/06/91/89/947069189.db2.gz ZJQCLHKKPVPBEM-YGRLFVJLSA-N -1 3 367.906 3.552 20 0 FHADHM O=C(CCc1nc2cc(Cl)ccc2s1)Nc1n[n-]c(-c2ccco2)n1 ZINC000523303315 947091520 /nfs/dbraw/zinc/09/15/20/947091520.db2.gz BUQGPFOSCMKBKO-UHFFFAOYSA-N -1 3 373.825 3.899 20 0 FHADHM CCCN(CC(F)F)C(=O)Nc1ccc(-c2cc(=O)[n-]c(C)n2)cc1 ZINC000523310534 947098900 /nfs/dbraw/zinc/09/89/00/947098900.db2.gz MYLUILCXPXERQJ-UHFFFAOYSA-N -1 3 350.369 3.667 20 0 FHADHM Cc1noc(C)c1[N-]C(=O)c1n[nH]c(-c2ccccc2)c1Br ZINC000523323942 947118681 /nfs/dbraw/zinc/11/86/81/947118681.db2.gz PWMQSIYJORQYFO-UHFFFAOYSA-N -1 3 361.199 3.696 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NCc3ccc(F)c(COC)c3)nc2)n1 ZINC000301167497 947212164 /nfs/dbraw/zinc/21/21/64/947212164.db2.gz FBXQTFQKIZFCIS-UHFFFAOYSA-N -1 3 368.412 3.704 20 0 FHADHM CCSc1ccc([C@H](C)N/C=C2/C(=O)[N-]C(=O)c3ccccc32)cc1 ZINC000728853997 947245297 /nfs/dbraw/zinc/24/52/97/947245297.db2.gz FFJZQGIBWOKDBD-HTMJNSLASA-N -1 3 352.459 3.760 20 0 FHADHM CC(C)[C@H]1C[C@@H](CC(=O)Nc2cc(Br)ccc2[O-])CCO1 ZINC000330805729 947278168 /nfs/dbraw/zinc/27/81/68/947278168.db2.gz JRMKRNOZMKPNDD-XHDPSFHLSA-N -1 3 356.260 3.935 20 0 FHADHM Cc1cc(Cl)ccc1OCCCNC(=O)NCc1ccc([O-])c(F)c1 ZINC000523467679 947288234 /nfs/dbraw/zinc/28/82/34/947288234.db2.gz HEKQSYBNKNZNIK-UHFFFAOYSA-N -1 3 366.820 3.761 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NCCc3ccc(C)c(OC)c3)nc2)n1 ZINC000301332422 947289467 /nfs/dbraw/zinc/28/94/67/947289467.db2.gz FCYMPYGMSUGCOP-UHFFFAOYSA-N -1 3 364.449 3.778 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@H]2CCc3c2cccc3Cl)s1 ZINC000825694144 947292717 /nfs/dbraw/zinc/29/27/17/947292717.db2.gz LMQWEEQCQYWKLU-LBPRGKRZSA-N -1 3 373.869 3.813 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@H]2CCc3c2cccc3Cl)s1 ZINC000825694144 947292732 /nfs/dbraw/zinc/29/27/32/947292732.db2.gz LMQWEEQCQYWKLU-LBPRGKRZSA-N -1 3 373.869 3.813 20 0 FHADHM CCO[C@@H]1C[C@@H](Nc2ccc(-c3nc(CC)cc(=O)[n-]3)cn2)C12CCC2 ZINC000301346402 947298957 /nfs/dbraw/zinc/29/89/57/947298957.db2.gz KMOHYDFGLQKGAF-HZPDHXFCSA-N -1 3 354.454 3.566 20 0 FHADHM CN(C(=O)CC1CCC(C(F)(F)F)CC1)c1cccc(-c2nnn[n-]2)c1 ZINC000825812632 947338427 /nfs/dbraw/zinc/33/84/27/947338427.db2.gz PGGJBQHRNAEATE-UHFFFAOYSA-N -1 3 367.375 3.588 20 0 FHADHM CN(C(=O)CC1CCC(C(F)(F)F)CC1)c1cccc(-c2nn[n-]n2)c1 ZINC000825812632 947338440 /nfs/dbraw/zinc/33/84/40/947338440.db2.gz PGGJBQHRNAEATE-UHFFFAOYSA-N -1 3 367.375 3.588 20 0 FHADHM COCC[C@H](Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)c1ccco1 ZINC000826155351 947487834 /nfs/dbraw/zinc/48/78/34/947487834.db2.gz MZZBBUNWJFEICI-ZDUSSCGKSA-N -1 3 367.331 3.668 20 0 FHADHM COCC[C@H](Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)c1ccco1 ZINC000826155351 947487843 /nfs/dbraw/zinc/48/78/43/947487843.db2.gz MZZBBUNWJFEICI-ZDUSSCGKSA-N -1 3 367.331 3.668 20 0 FHADHM C[C@@H](C(=O)N(c1cccc(-c2nnn[n-]2)c1)C1CCC1)c1cccc(F)c1 ZINC001573607849 947553787 /nfs/dbraw/zinc/55/37/87/947553787.db2.gz SRLQFWPAGHNSKO-CYBMUJFWSA-N -1 3 365.412 3.695 20 0 FHADHM C[C@@H](C(=O)N(c1cccc(-c2nn[n-]n2)c1)C1CCC1)c1cccc(F)c1 ZINC001573607849 947553790 /nfs/dbraw/zinc/55/37/90/947553790.db2.gz SRLQFWPAGHNSKO-CYBMUJFWSA-N -1 3 365.412 3.695 20 0 FHADHM O=C(Nc1cc(Br)ccc1[O-])c1cccnc1C(F)(F)F ZINC000188403380 947580264 /nfs/dbraw/zinc/58/02/64/947580264.db2.gz ZXXDTVFRWGDHTH-UHFFFAOYSA-N -1 3 361.117 3.821 20 0 FHADHM O=C([O-])CC[C@@H](CNCc1cc(Br)ccc1F)C(F)(F)F ZINC000663262151 947583579 /nfs/dbraw/zinc/58/35/79/947583579.db2.gz PZODTFFNUNKQCH-VIFPVBQESA-N -1 3 372.156 3.721 20 0 FHADHM O=C([O-])CC[C@@H](CNCc1cc(F)cc(Br)c1)C(F)(F)F ZINC000663261879 947584246 /nfs/dbraw/zinc/58/42/46/947584246.db2.gz NUGRZWREMHZRES-VIFPVBQESA-N -1 3 372.156 3.721 20 0 FHADHM O=C([O-])CC[C@@H](CNCc1ccccc1OC(F)(F)F)C(F)(F)F ZINC000663262577 947594196 /nfs/dbraw/zinc/59/41/96/947594196.db2.gz ULINRVASTMQBFZ-JTQLQIEISA-N -1 3 359.266 3.718 20 0 FHADHM Cc1cc(C)cc(-c2cc(=NC(=O)c3cnc(-c4ccccc4)nc3)[nH][n-]2)c1 ZINC000523776363 947599156 /nfs/dbraw/zinc/59/91/56/947599156.db2.gz DMOYGSXWXMUMLO-UHFFFAOYSA-N -1 3 369.428 3.825 20 0 FHADHM C[C@H]([N-]S(=O)(=O)c1ccc(F)c(F)c1F)c1cc2ccccc2o1 ZINC000008058383 947628772 /nfs/dbraw/zinc/62/87/72/947628772.db2.gz QFLHCWQNMVGNOS-VIFPVBQESA-N -1 3 355.337 3.890 20 0 FHADHM COC(=O)CCSc1cc(Cl)ccc1[N-]C(=O)c1conc1C ZINC000601698908 947651984 /nfs/dbraw/zinc/65/19/84/947651984.db2.gz LEHPKJPPSRDEBR-UHFFFAOYSA-N -1 3 354.815 3.544 20 0 FHADHM CC(=CC(=O)N(C)c1ccccc1-c1nnn[n-]1)c1ccccc1Cl ZINC001573359154 947679355 /nfs/dbraw/zinc/67/93/55/947679355.db2.gz WEAFZPXUDQXGHP-VAWYXSNFSA-N -1 3 353.813 3.586 20 0 FHADHM CC(=CC(=O)N(C)c1ccccc1-c1nn[n-]n1)c1ccccc1Cl ZINC001573359154 947679361 /nfs/dbraw/zinc/67/93/61/947679361.db2.gz WEAFZPXUDQXGHP-VAWYXSNFSA-N -1 3 353.813 3.586 20 0 FHADHM Cc1c(N[C@@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)cnn1-c1ccccc1 ZINC000826242510 947719495 /nfs/dbraw/zinc/71/94/95/947719495.db2.gz SAEJQCMYIYWQPK-LBPRGKRZSA-N -1 3 363.400 3.673 20 0 FHADHM Cc1c(N[C@@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)cnn1-c1ccccc1 ZINC000826242510 947719507 /nfs/dbraw/zinc/71/95/07/947719507.db2.gz SAEJQCMYIYWQPK-LBPRGKRZSA-N -1 3 363.400 3.673 20 0 FHADHM C[C@H](C(=O)N1CCC(c2ccc(-c3nnn[n-]3)cc2)CC1)[C@H](C)C(C)(C)C ZINC001573627171 947719717 /nfs/dbraw/zinc/71/97/17/947719717.db2.gz ZVVQRHISXIRBNN-GJZGRUSLSA-N -1 3 369.513 3.891 20 0 FHADHM C[C@H](C(=O)N1CCC(c2ccc(-c3nn[n-]n3)cc2)CC1)[C@H](C)C(C)(C)C ZINC001573627171 947719727 /nfs/dbraw/zinc/71/97/27/947719727.db2.gz ZVVQRHISXIRBNN-GJZGRUSLSA-N -1 3 369.513 3.891 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)Nc1cc(C)cc(-c2nnn[n-]2)c1 ZINC001573364635 947722157 /nfs/dbraw/zinc/72/21/57/947722157.db2.gz ICXXDKQHVMSAFN-FMIVXFBMSA-N -1 3 353.813 3.871 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)Nc1cc(C)cc(-c2nn[n-]n2)c1 ZINC001573364635 947722163 /nfs/dbraw/zinc/72/21/63/947722163.db2.gz ICXXDKQHVMSAFN-FMIVXFBMSA-N -1 3 353.813 3.871 20 0 FHADHM Cc1cc(C(=O)NCc2ccc(-c3ccccc3-c3nnn[n-]3)cc2)oc1C ZINC000826260016 947750093 /nfs/dbraw/zinc/75/00/93/947750093.db2.gz RGLBDPUJCHLYDE-UHFFFAOYSA-N -1 3 373.416 3.674 20 0 FHADHM Cc1cc(C(=O)NCc2ccc(-c3ccccc3-c3nn[n-]n3)cc2)oc1C ZINC000826260016 947750101 /nfs/dbraw/zinc/75/01/01/947750101.db2.gz RGLBDPUJCHLYDE-UHFFFAOYSA-N -1 3 373.416 3.674 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)N1CCc2c1cccc2-c1nnn[n-]1 ZINC001573367108 947751601 /nfs/dbraw/zinc/75/16/01/947751601.db2.gz XKBDCEQKPOJQGE-VAWYXSNFSA-N -1 3 365.824 3.513 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)N1CCc2c1cccc2-c1nn[n-]n1 ZINC001573367108 947751612 /nfs/dbraw/zinc/75/16/12/947751612.db2.gz XKBDCEQKPOJQGE-VAWYXSNFSA-N -1 3 365.824 3.513 20 0 FHADHM Cc1ccc(C(=O)N[C@H](C)c2ccc(-c3cccc(-c4nnn[n-]4)c3)cc2)o1 ZINC000826281700 947809889 /nfs/dbraw/zinc/80/98/89/947809889.db2.gz GJKNJWMSPZQEFT-CQSZACIVSA-N -1 3 373.416 3.926 20 0 FHADHM Cc1ccc(C(=O)N[C@H](C)c2ccc(-c3cccc(-c4nn[n-]n4)c3)cc2)o1 ZINC000826281700 947809895 /nfs/dbraw/zinc/80/98/95/947809895.db2.gz GJKNJWMSPZQEFT-CQSZACIVSA-N -1 3 373.416 3.926 20 0 FHADHM Cc1ccc([C@H]2CCN(c3nc(C(F)(F)F)ccc3-c3nnn[n-]3)C2)cc1 ZINC000826285661 947822259 /nfs/dbraw/zinc/82/22/59/947822259.db2.gz GGRUHALOVRANSP-ZDUSSCGKSA-N -1 3 374.370 3.583 20 0 FHADHM Cc1ccc([C@H]2CCN(c3nc(C(F)(F)F)ccc3-c3nn[n-]n3)C2)cc1 ZINC000826285661 947822263 /nfs/dbraw/zinc/82/22/63/947822263.db2.gz GGRUHALOVRANSP-ZDUSSCGKSA-N -1 3 374.370 3.583 20 0 FHADHM Cc1ccc([C@@H]2CCN(c3nc(C(F)(F)F)ccc3-c3nnn[n-]3)C2)cc1 ZINC000826285660 947823600 /nfs/dbraw/zinc/82/36/00/947823600.db2.gz GGRUHALOVRANSP-CYBMUJFWSA-N -1 3 374.370 3.583 20 0 FHADHM Cc1ccc([C@@H]2CCN(c3nc(C(F)(F)F)ccc3-c3nn[n-]n3)C2)cc1 ZINC000826285660 947823608 /nfs/dbraw/zinc/82/36/08/947823608.db2.gz GGRUHALOVRANSP-CYBMUJFWSA-N -1 3 374.370 3.583 20 0 FHADHM CC(C)(N)c1cc(C(=O)[N-]c2ccccc2SCC(F)(F)F)on1 ZINC000662462332 947831508 /nfs/dbraw/zinc/83/15/08/947831508.db2.gz TZKUTRNPWMSZCR-UHFFFAOYSA-N -1 3 359.373 3.775 20 0 FHADHM Cc1cccc(NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)c1F ZINC000826299539 947867114 /nfs/dbraw/zinc/86/71/14/947867114.db2.gz JZYYTEOZKQAJGT-UHFFFAOYSA-N -1 3 368.416 3.757 20 0 FHADHM Cc1cccc(NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)c1F ZINC000826299539 947867125 /nfs/dbraw/zinc/86/71/25/947867125.db2.gz JZYYTEOZKQAJGT-UHFFFAOYSA-N -1 3 368.416 3.757 20 0 FHADHM Cc1ccnc(N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)c1-c1nnn[n-]1 ZINC000826310368 947895276 /nfs/dbraw/zinc/89/52/76/947895276.db2.gz TYAYAMSGOZXUAV-CYBMUJFWSA-N -1 3 374.370 3.583 20 0 FHADHM Cc1ccnc(N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)c1-c1nn[n-]n1 ZINC000826310368 947895281 /nfs/dbraw/zinc/89/52/81/947895281.db2.gz TYAYAMSGOZXUAV-CYBMUJFWSA-N -1 3 374.370 3.583 20 0 FHADHM Cc1ccnc(N[C@H](C)c2nc(-c3ccccc3)cs2)c1-c1nnn[n-]1 ZINC000826311558 947901939 /nfs/dbraw/zinc/90/19/39/947901939.db2.gz HWLRTUFRSUKJDY-GFCCVEGCSA-N -1 3 363.450 3.867 20 0 FHADHM Cc1ccnc(N[C@H](C)c2nc(-c3ccccc3)cs2)c1-c1nn[n-]n1 ZINC000826311558 947901948 /nfs/dbraw/zinc/90/19/48/947901948.db2.gz HWLRTUFRSUKJDY-GFCCVEGCSA-N -1 3 363.450 3.867 20 0 FHADHM C[C@@H](C(=O)N1Cc2ccc(-c3nnn[n-]3)cc2C1)c1ccc2ccccc2c1 ZINC001573652443 947937339 /nfs/dbraw/zinc/93/73/39/947937339.db2.gz ZZSNTNCRLOCPAK-CQSZACIVSA-N -1 3 369.428 3.666 20 0 FHADHM C[C@@H](C(=O)N1Cc2ccc(-c3nn[n-]n3)cc2C1)c1ccc2ccccc2c1 ZINC001573652443 947937347 /nfs/dbraw/zinc/93/73/47/947937347.db2.gz ZZSNTNCRLOCPAK-CQSZACIVSA-N -1 3 369.428 3.666 20 0 FHADHM Cc1nscc1C(=O)Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1 ZINC000826340382 947977937 /nfs/dbraw/zinc/97/79/37/947977937.db2.gz VXJNZCMWSPNAIB-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM Cc1nscc1C(=O)Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1 ZINC000826340382 947977945 /nfs/dbraw/zinc/97/79/45/947977945.db2.gz VXJNZCMWSPNAIB-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM Clc1cc(-c2nnn[n-]2)ccc1SCc1nnc(C2CC2)n1C1CC1 ZINC000826351058 948097962 /nfs/dbraw/zinc/09/79/62/948097962.db2.gz VYYRIFQVDXKELE-UHFFFAOYSA-N -1 3 373.873 3.616 20 0 FHADHM Clc1cc(-c2nn[n-]n2)ccc1SCc1nnc(C2CC2)n1C1CC1 ZINC000826351058 948097973 /nfs/dbraw/zinc/09/79/73/948097973.db2.gz VYYRIFQVDXKELE-UHFFFAOYSA-N -1 3 373.873 3.616 20 0 FHADHM Fc1ccc(F)c(CN[C@@H](c2cccc(-c3nnn[n-]3)c2)C(F)(F)F)c1 ZINC000826374926 948163507 /nfs/dbraw/zinc/16/35/07/948163507.db2.gz RWNWRPOKZJINHH-AWEZNQCLSA-N -1 3 369.297 3.538 20 0 FHADHM Fc1ccc(F)c(CN[C@@H](c2cccc(-c3nn[n-]n3)c2)C(F)(F)F)c1 ZINC000826374926 948163514 /nfs/dbraw/zinc/16/35/14/948163514.db2.gz RWNWRPOKZJINHH-AWEZNQCLSA-N -1 3 369.297 3.538 20 0 FHADHM O=C([O-])[C@H](CCCNCc1nccn1-c1ccccc1)Cc1ccccc1 ZINC000417556442 948215356 /nfs/dbraw/zinc/21/53/56/948215356.db2.gz OOYYLWMUBCPBFP-LJQANCHMSA-N -1 3 363.461 3.686 20 0 FHADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)c3cccc(C)c3Cl)cc2)n1 ZINC000165680139 948237797 /nfs/dbraw/zinc/23/77/97/948237797.db2.gz MDPJWXZBDDWSFH-UHFFFAOYSA-N -1 3 353.809 3.959 20 0 FHADHM O=C(Nc1ncc(C2CCCCC2)s1)c1cc(-c2nnn[n-]2)cs1 ZINC000826459910 948345161 /nfs/dbraw/zinc/34/51/61/948345161.db2.gz FCKOPRGEKZFGKW-UHFFFAOYSA-N -1 3 360.468 3.685 20 0 FHADHM O=C(Nc1ncc(C2CCCCC2)s1)c1cc(-c2nn[n-]n2)cs1 ZINC000826459910 948345164 /nfs/dbraw/zinc/34/51/64/948345164.db2.gz FCKOPRGEKZFGKW-UHFFFAOYSA-N -1 3 360.468 3.685 20 0 FHADHM O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1cc([O-])ccc1Cl ZINC000278975446 948353108 /nfs/dbraw/zinc/35/31/08/948353108.db2.gz XZPDDPYLCYXYMD-UHFFFAOYSA-N -1 3 358.825 3.924 20 0 FHADHM O=C([O-])[C@H](CNCc1c(Cl)cccc1N1CCCC1)Oc1ccccc1 ZINC000417642608 948391772 /nfs/dbraw/zinc/39/17/72/948391772.db2.gz WDTKBBXNIZAFMI-IBGZPJMESA-N -1 3 374.868 3.562 20 0 FHADHM C[C@H](CC(=O)Nc1cc(-c2nnn[n-]2)ccc1F)c1c[nH]c2ccccc12 ZINC001535492129 948546791 /nfs/dbraw/zinc/54/67/91/948546791.db2.gz LEDVCLGZCGQEMW-LLVKDONJSA-N -1 3 364.384 3.619 20 0 FHADHM C[C@H](CC(=O)Nc1cc(-c2nn[n-]n2)ccc1F)c1c[nH]c2ccccc12 ZINC001535492129 948546797 /nfs/dbraw/zinc/54/67/97/948546797.db2.gz LEDVCLGZCGQEMW-LLVKDONJSA-N -1 3 364.384 3.619 20 0 FHADHM CCOC(=O)c1nc([C@@H](CC(C)C)NCc2cc3ccccc3o2)n[n-]1 ZINC000895104802 948589803 /nfs/dbraw/zinc/58/98/03/948589803.db2.gz MXACULOLUYIHFY-OAHLLOKOSA-N -1 3 356.426 3.605 20 0 FHADHM CCOC(=O)c1nnc([C@@H](CC(C)C)NCc2cc3ccccc3o2)[n-]1 ZINC000895104802 948589808 /nfs/dbraw/zinc/58/98/08/948589808.db2.gz MXACULOLUYIHFY-OAHLLOKOSA-N -1 3 356.426 3.605 20 0 FHADHM CCOC(=O)c1n[n-]c([C@@H](CC(C)C)NCc2cc3ccccc3o2)n1 ZINC000895104802 948589816 /nfs/dbraw/zinc/58/98/16/948589816.db2.gz MXACULOLUYIHFY-OAHLLOKOSA-N -1 3 356.426 3.605 20 0 FHADHM COc1cc2nc(-c3ccc(C(C)=O)c(Cl)c3)[n-]c(=O)c2cc1OC ZINC000432505611 948636353 /nfs/dbraw/zinc/63/63/53/948636353.db2.gz ZSAFLRWSSVPYGH-UHFFFAOYSA-N -1 3 358.781 3.876 20 0 FHADHM Cc1cc(S(=O)(=O)[N-]c2ccc(Cc3ccncc3)cc2)ccc1F ZINC000536458707 948657703 /nfs/dbraw/zinc/65/77/03/948657703.db2.gz GPVVKIIIVBHRPB-UHFFFAOYSA-N -1 3 356.422 3.921 20 0 FHADHM C[C@H]([N-]S(=O)(=O)c1cc(F)ccc1F)c1nc(C(C)(C)C)cs1 ZINC000106893073 948710600 /nfs/dbraw/zinc/71/06/00/948710600.db2.gz ZUIMLZJOVFQTIQ-VIFPVBQESA-N -1 3 360.451 3.758 20 0 FHADHM COc1cccc(CN(Cc2c(F)ccc([O-])c2F)C[C@@H]2CCCO2)c1 ZINC000507808402 948720934 /nfs/dbraw/zinc/72/09/34/948720934.db2.gz RJNHROSIMZAUNH-INIZCTEOSA-N -1 3 363.404 3.860 20 0 FHADHM CC(C)NC(=O)Nc1ccc([N-]S(=O)(=O)c2ccc(C3CC3)cc2)cc1 ZINC000520728433 948738891 /nfs/dbraw/zinc/73/88/91/948738891.db2.gz RDSPWESIXRHIFR-UHFFFAOYSA-N -1 3 373.478 3.895 20 0 FHADHM C[C@@H](C[N-]S(=O)(=O)c1ccccc1C(F)(F)F)N(C)c1ccccc1 ZINC000071905785 221387070 /nfs/dbraw/zinc/38/70/70/221387070.db2.gz BBGLMKVSFBLQHB-ZDUSSCGKSA-N -1 3 372.412 3.509 20 0 FHADHM O=S(=O)([N-]Cc1ccsc1)c1cc(C(F)(F)F)ccc1Cl ZINC000106308445 222386769 /nfs/dbraw/zinc/38/67/69/222386769.db2.gz FKEXTOWDFUSDQT-UHFFFAOYSA-N -1 3 355.790 3.899 20 0 FHADHM CCCCCc1n[n-]c(=NC(=O)NC[C@H](C)N2CCC[C@H](C)C2)s1 ZINC000503142133 514932318 /nfs/dbraw/zinc/93/23/18/514932318.db2.gz AUHUDNRIQHYNGB-KBPBESRZSA-N -1 3 353.536 3.513 20 0 FHADHM CC(C)Cc1n[n-]c(=NC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)s1 ZINC000508899324 514945285 /nfs/dbraw/zinc/94/52/85/514945285.db2.gz OIXDRNRZQWXGQU-CJNGLKHVSA-N -1 3 361.515 3.550 20 0 FHADHM Cc1onc(-c2ccccc2C)c1C(=O)N=c1cc(OC(F)F)n(C)[n-]1 ZINC000476868592 515228353 /nfs/dbraw/zinc/22/83/53/515228353.db2.gz JHSHRNJKNLTUQB-UHFFFAOYSA-N -1 3 362.336 3.546 20 0 FHADHM Cn1[n-]c(=NC(=O)Cc2ccc(Cl)c(Cl)c2)cc1OC(F)F ZINC000490957190 515341477 /nfs/dbraw/zinc/34/14/77/515341477.db2.gz VFWOWABZDSTEAJ-UHFFFAOYSA-N -1 3 350.152 3.510 20 0 FHADHM C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)N=c1[n-]nc(-c2ccsc2)s1 ZINC000510669789 515630840 /nfs/dbraw/zinc/63/08/40/515630840.db2.gz VOSTYWFJTQBGSA-NEPJUHHUSA-N -1 3 365.528 3.509 20 0 FHADHM C[C@@H](CN1CCC[C@H](C)C1)NC(=O)N=c1[n-]nc(-c2ccsc2)s1 ZINC000510669815 515630922 /nfs/dbraw/zinc/63/09/22/515630922.db2.gz VOSTYWFJTQBGSA-RYUDHWBXSA-N -1 3 365.528 3.509 20 0 FHADHM O=C(N=c1cc2ccc(Br)cn2[n-]1)[C@@H]1CCCc2cccnc21 ZINC000511318873 515862245 /nfs/dbraw/zinc/86/22/45/515862245.db2.gz HFUKKJZJBGDIRX-CQSZACIVSA-N -1 3 371.238 3.550 20 0 FHADHM O=C(N=c1cc([C@H]2CCCO2)[n-][nH]1)[C@H]1CCCN1Cc1ccc(Cl)cc1 ZINC000529522804 517195761 /nfs/dbraw/zinc/19/57/61/517195761.db2.gz VZGRYPYJNCFIBR-IAGOWNOFSA-N -1 3 374.872 3.518 20 0 FHADHM CCN(CC)CCN(CC(C)C)C(=O)N=c1[n-]nc(CC(C)C)s1 ZINC000515222369 517260346 /nfs/dbraw/zinc/26/03/46/517260346.db2.gz LXHNNQMEOMGQCL-UHFFFAOYSA-N -1 3 355.552 3.568 20 0 FHADHM CCc1c(C(=O)N=c2cc([C@H]3CCCO3)[n-][nH]2)cnn1-c1ccccc1C ZINC000527208327 517562299 /nfs/dbraw/zinc/56/22/99/517562299.db2.gz ATBVTDUPTUVOMV-GOSISDBHSA-N -1 3 365.437 3.570 20 0 FHADHM Cc1[n-][nH]c(=NC(=O)c2c[nH]c(=O)c(Br)c2)c1-c1ccccc1 ZINC000608359279 519948249 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O=S(=O)([N-]c1cccc(F)c1F)c1cccc(OC(F)(F)F)c1 ZINC000521414545 567953193 /nfs/dbraw/zinc/95/31/93/567953193.db2.gz SBBWTKHGQIBJRI-UHFFFAOYSA-N -1 3 353.268 3.664 20 0 FHADHM COc1ccc(Cl)c(S(=O)(=O)[N-][C@H]2CCc3ccc(C)cc32)c1 ZINC000602255432 567960287 /nfs/dbraw/zinc/96/02/87/567960287.db2.gz FJBXRISBINHBBT-INIZCTEOSA-N -1 3 351.855 3.623 20 0 FHADHM COc1ccc(Cl)c(S(=O)(=O)[N-]Cc2cc3c(s2)CCCC3)c1 ZINC000602257675 567960508 /nfs/dbraw/zinc/96/05/08/567960508.db2.gz GOEQXSTZAHEJEB-UHFFFAOYSA-N -1 3 371.911 3.767 20 0 FHADHM CCOc1ncc(C(=O)N=c2cc(-c3ccccc3C)[n-][nH]2)cc1Cl ZINC000602324267 567967537 /nfs/dbraw/zinc/96/75/37/567967537.db2.gz FKTUVQHVWSSFMS-UHFFFAOYSA-N -1 3 356.813 3.506 20 0 FHADHM C[C@H](Cc1ccc(O)cc1)NC(=O)c1c[n-]nc1-c1ccc(Cl)s1 ZINC000186841889 567991152 /nfs/dbraw/zinc/99/11/52/567991152.db2.gz DURIDMIYTPBEEM-SNVBAGLBSA-N -1 3 361.854 3.858 20 0 FHADHM Cc1cc([N-]C(=O)[C@H](C)Nc2cc(C)n(-c3cc(C)cc(C)c3)n2)on1 ZINC000188624899 568012071 /nfs/dbraw/zinc/01/20/71/568012071.db2.gz WMPCCBZNRZDAER-HNNXBMFYSA-N -1 3 353.426 3.533 20 0 FHADHM Cc1cc([N-]C(=O)[C@@H](C)Nc2cc(C)n(-c3cc(C)cc(C)c3)n2)on1 ZINC000188624924 568012302 /nfs/dbraw/zinc/01/23/02/568012302.db2.gz WMPCCBZNRZDAER-OAHLLOKOSA-N -1 3 353.426 3.533 20 0 FHADHM C[C@H]1CCC[C@H](NC(=O)c2cc(=O)c3cc(Br)ccc3[n-]2)C1 ZINC000602740836 568020898 /nfs/dbraw/zinc/02/08/98/568020898.db2.gz WEJVQHIZUQZBDU-JQWIXIFHSA-N -1 3 363.255 3.599 20 0 FHADHM C[C@H]1CCC[C@@H](NC(=O)c2cc(=O)c3cc(Br)ccc3[n-]2)C1 ZINC000602740833 568020979 /nfs/dbraw/zinc/02/09/79/568020979.db2.gz WEJVQHIZUQZBDU-CMPLNLGQSA-N -1 3 363.255 3.599 20 0 FHADHM O=C(NC[C@@H](c1ccccc1)C(F)(F)F)c1c[n-]c2ccccc2c1=O ZINC000188641095 568032406 /nfs/dbraw/zinc/03/24/06/568032406.db2.gz VAOAIRRPBSVKRX-HNNXBMFYSA-N -1 3 360.335 3.604 20 0 FHADHM CCCOCc1ccccc1C[N-]S(=O)(=O)c1ccccc1SC ZINC000186991689 568039834 /nfs/dbraw/zinc/03/98/34/568039834.db2.gz XNAOIPWDICPVEY-UHFFFAOYSA-N -1 3 365.520 3.814 20 0 FHADHM COC(=O)c1sc(NC(=O)c2cc(C(F)F)[n-]n2)nc1C1CCCC1 ZINC000603007241 568051083 /nfs/dbraw/zinc/05/10/83/568051083.db2.gz CMTJPJOKGBVZAC-UHFFFAOYSA-N -1 3 370.381 3.500 20 0 FHADHM CC(C)n1cc(NC(=O)c2n[n-]c(-c3ccccc3)c2Br)cn1 ZINC000066673026 568069585 /nfs/dbraw/zinc/06/95/85/568069585.db2.gz WMUIHBFGRISAQZ-UHFFFAOYSA-N -1 3 374.242 3.869 20 0 FHADHM CC(C)n1cc(NC(=O)c2[n-]nc(-c3ccccc3)c2Br)cn1 ZINC000066673026 568069586 /nfs/dbraw/zinc/06/95/86/568069586.db2.gz WMUIHBFGRISAQZ-UHFFFAOYSA-N -1 3 374.242 3.869 20 0 FHADHM Cc1cccc([O-])c1C(=O)N1C[C@H](O)C[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000626261592 568141183 /nfs/dbraw/zinc/14/11/83/568141183.db2.gz BPXRQMXGTWUQQC-HUUCEWRRSA-N -1 3 365.351 3.668 20 0 FHADHM CC[C@H](CC1CCCC1)C(=O)NC1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000603901356 568180007 /nfs/dbraw/zinc/18/00/07/568180007.db2.gz RUOUQNDWVBXGEO-QGZVFWFLSA-N -1 3 372.509 3.720 20 0 FHADHM CCn1c(=O)[n-]nc1SCC/C=C\c1ccc(Br)cc1 ZINC000604930899 568398432 /nfs/dbraw/zinc/39/84/32/568398432.db2.gz SBWMOLLOBRJNFT-HYXAFXHYSA-N -1 3 354.273 3.962 20 0 FHADHM C[C@H]1CCN(C(=O)c2cc(=O)c3ccccc3[n-]2)[C@@H]1c1cccc(F)c1 ZINC000365370412 568574875 /nfs/dbraw/zinc/57/48/75/568574875.db2.gz VIRZSSNCDNJWLE-RBZFPXEDSA-N -1 3 350.393 3.891 20 0 FHADHM CC(C)(C)CCCNC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000735601777 598827580 /nfs/dbraw/zinc/82/75/80/598827580.db2.gz CTOXBYJUXADWCI-UHFFFAOYSA-N -1 3 352.895 3.633 20 0 FHADHM CC(C)(C)CCCNC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000735601777 598827582 /nfs/dbraw/zinc/82/75/82/598827582.db2.gz CTOXBYJUXADWCI-UHFFFAOYSA-N -1 3 352.895 3.633 20 0 FHADHM Cc1ccc(-c2nc(CNCc3ccc(-c4nn[n-]n4)cc3)cs2)cc1 ZINC000737288485 598837196 /nfs/dbraw/zinc/83/71/96/598837196.db2.gz NNYLRGWETPLNOC-UHFFFAOYSA-N -1 3 362.462 3.588 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)Nc1cccc(SC)c1 ZINC000736634085 598850281 /nfs/dbraw/zinc/85/02/81/598850281.db2.gz GKKIQWQTQOCXOY-UHFFFAOYSA-N -1 3 370.438 3.631 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)Nc1cccc(SC)c1 ZINC000736634085 598850282 /nfs/dbraw/zinc/85/02/82/598850282.db2.gz GKKIQWQTQOCXOY-UHFFFAOYSA-N -1 3 370.438 3.631 20 0 FHADHM C[C@@H](CNc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)Oc1ccccc1 ZINC000736027097 598869312 /nfs/dbraw/zinc/86/93/12/598869312.db2.gz XGBVOVBJWBWLLU-NSHDSACASA-N -1 3 363.343 3.765 20 0 FHADHM C[C@@H](CNc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)Oc1ccccc1 ZINC000736027097 598869314 /nfs/dbraw/zinc/86/93/14/598869314.db2.gz XGBVOVBJWBWLLU-NSHDSACASA-N -1 3 363.343 3.765 20 0 FHADHM CCSc1cccc(NC(=O)Nc2cc(-c3nnn[n-]3)ccc2C)c1 ZINC000736665021 598879698 /nfs/dbraw/zinc/87/96/98/598879698.db2.gz CZPKMGBILIUITO-UHFFFAOYSA-N -1 3 354.439 3.931 20 0 FHADHM CCSc1cccc(NC(=O)Nc2cc(-c3nn[n-]n3)ccc2C)c1 ZINC000736665021 598879699 /nfs/dbraw/zinc/87/96/99/598879699.db2.gz CZPKMGBILIUITO-UHFFFAOYSA-N -1 3 354.439 3.931 20 0 FHADHM Clc1cc(Nc2ccc(N3CCCCC3)nc2)ccc1-c1nnn[n-]1 ZINC000737566593 598891241 /nfs/dbraw/zinc/89/12/41/598891241.db2.gz VOINBNGSIRXIFP-UHFFFAOYSA-N -1 3 355.833 3.649 20 0 FHADHM Clc1cc(Nc2ccc(N3CCCCC3)nc2)ccc1-c1nn[n-]n1 ZINC000737566593 598891242 /nfs/dbraw/zinc/89/12/42/598891242.db2.gz VOINBNGSIRXIFP-UHFFFAOYSA-N -1 3 355.833 3.649 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@@H](C)CC1CCCC1 ZINC000735986023 598902717 /nfs/dbraw/zinc/90/27/17/598902717.db2.gz PJXKJTHHBFIKJU-HNNXBMFYSA-N -1 3 355.486 3.820 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@@H](C)CC1CCCC1 ZINC000735986023 598902719 /nfs/dbraw/zinc/90/27/19/598902719.db2.gz PJXKJTHHBFIKJU-HNNXBMFYSA-N -1 3 355.486 3.820 20 0 FHADHM CCN(C(=O)[C@H](C)CC1CCCC1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736502894 598903555 /nfs/dbraw/zinc/90/35/55/598903555.db2.gz QLKGLUZKXYOZAY-HUUCEWRRSA-N -1 3 355.486 3.993 20 0 FHADHM CCN(C(=O)[C@H](C)CC1CCCC1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736502894 598903557 /nfs/dbraw/zinc/90/35/57/598903557.db2.gz QLKGLUZKXYOZAY-HUUCEWRRSA-N -1 3 355.486 3.993 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1OCCSc1ccc(C)cc1C ZINC000737033134 598938972 /nfs/dbraw/zinc/93/89/72/598938972.db2.gz SRDPJFMMEDKRQL-UHFFFAOYSA-N -1 3 356.451 3.663 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1OCCSc1ccc(C)cc1C ZINC000737033134 598938973 /nfs/dbraw/zinc/93/89/73/598938973.db2.gz SRDPJFMMEDKRQL-UHFFFAOYSA-N -1 3 356.451 3.663 20 0 FHADHM CC[C@@H]1CCC[C@@H](NC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)C1 ZINC000736395066 598942328 /nfs/dbraw/zinc/94/23/28/598942328.db2.gz GTXKJYHEJYYADE-NVXWUHKLSA-N -1 3 371.485 3.501 20 0 FHADHM CC[C@@H]1CCC[C@@H](NC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)C1 ZINC000736395066 598942330 /nfs/dbraw/zinc/94/23/30/598942330.db2.gz GTXKJYHEJYYADE-NVXWUHKLSA-N -1 3 371.485 3.501 20 0 FHADHM O=C(Nc1nc2ccccc2n1C1CCCC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000738209853 598946720 /nfs/dbraw/zinc/94/67/20/598946720.db2.gz IXCJOPCDPGBIAQ-UHFFFAOYSA-N -1 3 373.420 3.584 20 0 FHADHM O=C(Nc1nc2ccccc2n1C1CCCC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000738209853 598946721 /nfs/dbraw/zinc/94/67/21/598946721.db2.gz IXCJOPCDPGBIAQ-UHFFFAOYSA-N -1 3 373.420 3.584 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CCC[C@H](C(C)C)CC1 ZINC000736633725 598966047 /nfs/dbraw/zinc/96/60/47/598966047.db2.gz DSBIWRLJRNSEIE-AWEZNQCLSA-N -1 3 372.473 3.555 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CCC[C@H](C(C)C)CC1 ZINC000736633725 598966048 /nfs/dbraw/zinc/96/60/48/598966048.db2.gz DSBIWRLJRNSEIE-AWEZNQCLSA-N -1 3 372.473 3.555 20 0 FHADHM Fc1ccccc1[C@@H](Cc1ccccc1)Nc1ccc(-c2nnn[n-]2)cn1 ZINC000737665614 598975772 /nfs/dbraw/zinc/97/57/72/598975772.db2.gz SSURQFLPPLNPGX-GOSISDBHSA-N -1 3 360.396 3.797 20 0 FHADHM Fc1ccccc1[C@@H](Cc1ccccc1)Nc1ccc(-c2nn[n-]n2)cn1 ZINC000737665614 598975774 /nfs/dbraw/zinc/97/57/74/598975774.db2.gz SSURQFLPPLNPGX-GOSISDBHSA-N -1 3 360.396 3.797 20 0 FHADHM Cc1cc(C)c(-c2nnn[n-]2)c(N[C@H]2C[C@H]2c2c(F)cccc2Cl)n1 ZINC000737243787 598972510 /nfs/dbraw/zinc/97/25/10/598972510.db2.gz BGZQNZVIVGKUGH-MFKMUULPSA-N -1 3 358.808 3.639 20 0 FHADHM Cc1cc(C)c(-c2nn[n-]n2)c(N[C@H]2C[C@H]2c2c(F)cccc2Cl)n1 ZINC000737243787 598972511 /nfs/dbraw/zinc/97/25/11/598972511.db2.gz BGZQNZVIVGKUGH-MFKMUULPSA-N -1 3 358.808 3.639 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@H]1CCC[C@H](CC)C1 ZINC000736482149 599013616 /nfs/dbraw/zinc/01/36/16/599013616.db2.gz VHXVEKHCNLTTGS-YJBOKZPZSA-N -1 3 370.501 3.757 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@H]1CCC[C@H](CC)C1 ZINC000736482149 599013618 /nfs/dbraw/zinc/01/36/18/599013618.db2.gz VHXVEKHCNLTTGS-YJBOKZPZSA-N -1 3 370.501 3.757 20 0 FHADHM C[C@@H]1CN(c2ccc(-c3nnn[n-]3)c(Cl)c2)C[C@H](c2ccc(F)cc2)O1 ZINC000820767346 599038693 /nfs/dbraw/zinc/03/86/93/599038693.db2.gz IGZRNFZCPIRMJZ-PIGZYNQJSA-N -1 3 373.819 3.626 20 0 FHADHM C[C@@H]1CN(c2ccc(-c3nn[n-]n3)c(Cl)c2)C[C@H](c2ccc(F)cc2)O1 ZINC000820767346 599038696 /nfs/dbraw/zinc/03/86/96/599038696.db2.gz IGZRNFZCPIRMJZ-PIGZYNQJSA-N -1 3 373.819 3.626 20 0 FHADHM CC(C)c1csc([C@H]2CCCN(c3ccc(-c4nn[n-]n4)cc3F)C2)n1 ZINC000820197449 599042874 /nfs/dbraw/zinc/04/28/74/599042874.db2.gz IZMMPVVKILYPEN-ZDUSSCGKSA-N -1 3 372.473 3.970 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(NC[C@H]2CCCc3ccccc32)n1 ZINC000737637095 599043123 /nfs/dbraw/zinc/04/31/23/599043123.db2.gz ZGJACNJGNSMHKB-GFCCVEGCSA-N -1 3 374.370 3.813 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(NC[C@H]2CCCc3ccccc32)n1 ZINC000737637095 599043126 /nfs/dbraw/zinc/04/31/26/599043126.db2.gz ZGJACNJGNSMHKB-GFCCVEGCSA-N -1 3 374.370 3.813 20 0 FHADHM C[C@@H](c1cccs1)N(C)c1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000736204368 599046283 /nfs/dbraw/zinc/04/62/83/599046283.db2.gz QTVQVRMVHABAQN-QMMMGPOBSA-N -1 3 354.361 3.539 20 0 FHADHM C[C@@H](c1cccs1)N(C)c1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000736204368 599046285 /nfs/dbraw/zinc/04/62/85/599046285.db2.gz QTVQVRMVHABAQN-QMMMGPOBSA-N -1 3 354.361 3.539 20 0 FHADHM C[C@H]1CN(c2ncc(-c3nnn[n-]3)cc2Cl)CC[C@@H]1c1ccccc1 ZINC000820774324 599050635 /nfs/dbraw/zinc/05/06/35/599050635.db2.gz ANWQOIZOAUOMRG-WFASDCNBSA-N -1 3 354.845 3.545 20 0 FHADHM C[C@H]1CN(c2ncc(-c3nn[n-]n3)cc2Cl)CC[C@@H]1c1ccccc1 ZINC000820774324 599050638 /nfs/dbraw/zinc/05/06/38/599050638.db2.gz ANWQOIZOAUOMRG-WFASDCNBSA-N -1 3 354.845 3.545 20 0 FHADHM Cc1cccc2c(CC(=O)O[C@@H](C)c3cccc(-c4nnn[n-]4)c3)c[nH]c21 ZINC000737407173 599061237 /nfs/dbraw/zinc/06/12/37/599061237.db2.gz AGCVHFDQZLEAQZ-ZDUSSCGKSA-N -1 3 361.405 3.503 20 0 FHADHM Cc1cccc2c(CC(=O)O[C@@H](C)c3cccc(-c4nn[n-]n4)c3)c[nH]c21 ZINC000737407173 599061243 /nfs/dbraw/zinc/06/12/43/599061243.db2.gz AGCVHFDQZLEAQZ-ZDUSSCGKSA-N -1 3 361.405 3.503 20 0 FHADHM CCn1c(CSc2ccc(-c3nnn[n-]3)cc2F)nc2cc(F)ccc21 ZINC000736714983 599063177 /nfs/dbraw/zinc/06/31/77/599063177.db2.gz YTPUBGODQJSFKT-UHFFFAOYSA-N -1 3 372.404 3.807 20 0 FHADHM CCn1c(CSc2ccc(-c3nn[n-]n3)cc2F)nc2cc(F)ccc21 ZINC000736714983 599063180 /nfs/dbraw/zinc/06/31/80/599063180.db2.gz YTPUBGODQJSFKT-UHFFFAOYSA-N -1 3 372.404 3.807 20 0 FHADHM C[C@@H](CNc1c(F)cc(-c2nnn[n-]2)cc1F)Oc1ccccc1Cl ZINC000820275398 599064342 /nfs/dbraw/zinc/06/43/42/599064342.db2.gz PQXPRCGJZOQRMK-VIFPVBQESA-N -1 3 365.771 3.678 20 0 FHADHM C[C@@H](CNc1c(F)cc(-c2nn[n-]n2)cc1F)Oc1ccccc1Cl ZINC000820275398 599064344 /nfs/dbraw/zinc/06/43/44/599064344.db2.gz PQXPRCGJZOQRMK-VIFPVBQESA-N -1 3 365.771 3.678 20 0 FHADHM C[C@H](Sc1ccc(-c2nnn[n-]2)cc1F)c1nnc(-c2ccccc2)o1 ZINC000736194207 599065177 /nfs/dbraw/zinc/06/51/77/599065177.db2.gz XTKOSFYTUTWLQR-JTQLQIEISA-N -1 3 368.397 3.909 20 0 FHADHM C[C@H](Sc1ccc(-c2nn[n-]n2)cc1F)c1nnc(-c2ccccc2)o1 ZINC000736194207 599065181 /nfs/dbraw/zinc/06/51/81/599065181.db2.gz XTKOSFYTUTWLQR-JTQLQIEISA-N -1 3 368.397 3.909 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)[C@H]1C[C@H]1C1CCCCC1 ZINC000735654817 599069721 /nfs/dbraw/zinc/06/97/21/599069721.db2.gz JCBKDMBVLDNCEZ-GJZGRUSLSA-N -1 3 356.474 3.578 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)[C@H]1C[C@H]1C1CCCCC1 ZINC000735654817 599069724 /nfs/dbraw/zinc/06/97/24/599069724.db2.gz JCBKDMBVLDNCEZ-GJZGRUSLSA-N -1 3 356.474 3.578 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1N1CC[C@H](CSc2ccccc2)C1 ZINC000822563456 599087478 /nfs/dbraw/zinc/08/74/78/599087478.db2.gz JVPFZTRTTWMOAV-LBPRGKRZSA-N -1 3 372.885 3.534 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1N1CC[C@H](CSc2ccccc2)C1 ZINC000822563456 599087481 /nfs/dbraw/zinc/08/74/81/599087481.db2.gz JVPFZTRTTWMOAV-LBPRGKRZSA-N -1 3 372.885 3.534 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)NC[C@H](C)C(C)(C)C ZINC000735831041 599103234 /nfs/dbraw/zinc/10/32/34/599103234.db2.gz MLCWJPTUABFBJL-HNNXBMFYSA-N -1 3 372.517 3.717 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)NC[C@H](C)C(C)(C)C ZINC000735831041 599103235 /nfs/dbraw/zinc/10/32/35/599103235.db2.gz MLCWJPTUABFBJL-HNNXBMFYSA-N -1 3 372.517 3.717 20 0 FHADHM C[C@H](CCC1CCCCC1)NC(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000735984319 599105995 /nfs/dbraw/zinc/10/59/95/599105995.db2.gz CHODZOCGGYOXEY-OAHLLOKOSA-N -1 3 370.501 3.757 20 0 FHADHM C[C@H](CCC1CCCCC1)NC(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000735984319 599105997 /nfs/dbraw/zinc/10/59/97/599105997.db2.gz CHODZOCGGYOXEY-OAHLLOKOSA-N -1 3 370.501 3.757 20 0 FHADHM Cc1ccc([C@@H]2OCCC[C@H]2CNc2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000822233377 599108641 /nfs/dbraw/zinc/10/86/41/599108641.db2.gz NRKUJBKVUCUQSX-LPHOPBHVSA-N -1 3 367.428 3.894 20 0 FHADHM C[C@H](Sc1ccccc1-c1nnn[n-]1)C(=O)Nc1cccc(Cl)c1 ZINC000736193336 599109193 /nfs/dbraw/zinc/10/91/93/599109193.db2.gz PBWWECYISPYKJI-JTQLQIEISA-N -1 3 359.842 3.639 20 0 FHADHM C[C@H](Sc1ccccc1-c1nn[n-]n1)C(=O)Nc1cccc(Cl)c1 ZINC000736193336 599109196 /nfs/dbraw/zinc/10/91/96/599109196.db2.gz PBWWECYISPYKJI-JTQLQIEISA-N -1 3 359.842 3.639 20 0 FHADHM CCCn1c(C)cc(C(=O)CSc2ccccc2-c2nnn[n-]2)c1C ZINC000736499023 599109790 /nfs/dbraw/zinc/10/97/90/599109790.db2.gz AMAMBQKHNHBRMJ-UHFFFAOYSA-N -1 3 355.467 3.670 20 0 FHADHM CCCn1c(C)cc(C(=O)CSc2ccccc2-c2nn[n-]n2)c1C ZINC000736499023 599109793 /nfs/dbraw/zinc/10/97/93/599109793.db2.gz AMAMBQKHNHBRMJ-UHFFFAOYSA-N -1 3 355.467 3.670 20 0 FHADHM Fc1ccc(-c2nc(CSc3ccccc3-c3nnn[n-]3)co2)cc1 ZINC000737654321 599111174 /nfs/dbraw/zinc/11/11/74/599111174.db2.gz ZNAUCCHXFBHJRY-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM Fc1ccc(-c2nc(CSc3ccccc3-c3nn[n-]n3)co2)cc1 ZINC000737654321 599111176 /nfs/dbraw/zinc/11/11/76/599111176.db2.gz ZNAUCCHXFBHJRY-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM CCO[C@H]1C[C@H](Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)C12CCC2 ZINC000736611638 599119824 /nfs/dbraw/zinc/11/98/24/599119824.db2.gz JYIDDQCTGFPLHD-KBPBESRZSA-N -1 3 367.375 3.645 20 0 FHADHM CCO[C@H]1C[C@H](Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)C12CCC2 ZINC000736611638 599119826 /nfs/dbraw/zinc/11/98/26/599119826.db2.gz JYIDDQCTGFPLHD-KBPBESRZSA-N -1 3 367.375 3.645 20 0 FHADHM CCO[C@H]1C[C@@H](Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)C12CCC2 ZINC000736611640 599120105 /nfs/dbraw/zinc/12/01/05/599120105.db2.gz JYIDDQCTGFPLHD-KGLIPLIRSA-N -1 3 367.375 3.645 20 0 FHADHM CCO[C@H]1C[C@@H](Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)C12CCC2 ZINC000736611640 599120107 /nfs/dbraw/zinc/12/01/07/599120107.db2.gz JYIDDQCTGFPLHD-KGLIPLIRSA-N -1 3 367.375 3.645 20 0 FHADHM C[C@H](Sc1ccc(-c2nnn[n-]2)cc1F)c1nnc(-c2cccs2)o1 ZINC000820548488 599127642 /nfs/dbraw/zinc/12/76/42/599127642.db2.gz ASOSSPMUPGSSHV-QMMMGPOBSA-N -1 3 374.426 3.971 20 0 FHADHM C[C@H](Sc1ccc(-c2nn[n-]n2)cc1F)c1nnc(-c2cccs2)o1 ZINC000820548488 599127644 /nfs/dbraw/zinc/12/76/44/599127644.db2.gz ASOSSPMUPGSSHV-QMMMGPOBSA-N -1 3 374.426 3.971 20 0 FHADHM CCc1ccc(-c2ccc(C(=O)NCc3cccc(-c4nnn[n-]4)c3)o2)cc1 ZINC000821476551 599137706 /nfs/dbraw/zinc/13/77/06/599137706.db2.gz PKBCCFALCBUSIB-UHFFFAOYSA-N -1 3 373.416 3.619 20 0 FHADHM CCc1ccc(-c2ccc(C(=O)NCc3cccc(-c4nn[n-]n4)c3)o2)cc1 ZINC000821476551 599137707 /nfs/dbraw/zinc/13/77/07/599137707.db2.gz PKBCCFALCBUSIB-UHFFFAOYSA-N -1 3 373.416 3.619 20 0 FHADHM C/C(=C/C(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)CC(C)C)C(C)(C)C ZINC000819765702 599145876 /nfs/dbraw/zinc/14/58/76/599145876.db2.gz QHYWXFOBVHAOAH-PTNGSMBKSA-N -1 3 355.486 3.844 20 0 FHADHM C/C(=C/C(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)CC(C)C)C(C)(C)C ZINC000819765702 599145878 /nfs/dbraw/zinc/14/58/78/599145878.db2.gz QHYWXFOBVHAOAH-PTNGSMBKSA-N -1 3 355.486 3.844 20 0 FHADHM CC(C)(C)[C@H]1CCCN(C(=S)Nc2ccccc2-c2nnn[n-]2)CC1 ZINC000735594788 599157780 /nfs/dbraw/zinc/15/77/80/599157780.db2.gz CFFSXDUBANLHOO-ZDUSSCGKSA-N -1 3 358.515 3.712 20 0 FHADHM CC(C)(C)[C@H]1CCCN(C(=S)Nc2ccccc2-c2nn[n-]n2)CC1 ZINC000735594788 599157783 /nfs/dbraw/zinc/15/77/83/599157783.db2.gz CFFSXDUBANLHOO-ZDUSSCGKSA-N -1 3 358.515 3.712 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)C[C@H](C)c2ccccc2C)s1 ZINC000736679436 599160577 /nfs/dbraw/zinc/16/05/77/599160577.db2.gz UAFMJUQPNAPTFP-LBPRGKRZSA-N -1 3 355.467 3.931 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)C[C@H](C)c2ccccc2C)s1 ZINC000736679436 599160579 /nfs/dbraw/zinc/16/05/79/599160579.db2.gz UAFMJUQPNAPTFP-LBPRGKRZSA-N -1 3 355.467 3.931 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1SCc1cc(-c2ccccc2)on1 ZINC000737645209 599167835 /nfs/dbraw/zinc/16/78/35/599167835.db2.gz RTFZUUXFMZBKDI-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1SCc1cc(-c2ccccc2)on1 ZINC000737645209 599167836 /nfs/dbraw/zinc/16/78/36/599167836.db2.gz RTFZUUXFMZBKDI-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1SCCCOCCc1ccccc1 ZINC000737645448 599171903 /nfs/dbraw/zinc/17/19/03/599171903.db2.gz YTLANRWCAFIYRJ-UHFFFAOYSA-N -1 3 358.442 3.747 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1SCCCOCCc1ccccc1 ZINC000737645448 599171905 /nfs/dbraw/zinc/17/19/05/599171905.db2.gz YTLANRWCAFIYRJ-UHFFFAOYSA-N -1 3 358.442 3.747 20 0 FHADHM Cc1cccc(NC(=O)[C@@H](C)Sc2ccc(-c3nnn[n-]3)cc2F)c1C ZINC000737400551 599172179 /nfs/dbraw/zinc/17/21/79/599172179.db2.gz TUVIQJIGGIQZNE-GFCCVEGCSA-N -1 3 371.441 3.742 20 0 FHADHM Cc1cccc(NC(=O)[C@@H](C)Sc2ccc(-c3nn[n-]n3)cc2F)c1C ZINC000737400551 599172181 /nfs/dbraw/zinc/17/21/81/599172181.db2.gz TUVIQJIGGIQZNE-GFCCVEGCSA-N -1 3 371.441 3.742 20 0 FHADHM Cc1ccc([C@H]2CCCN2c2nc(C(F)(F)F)ccc2-c2nnn[n-]2)o1 ZINC000737331496 599172335 /nfs/dbraw/zinc/17/23/35/599172335.db2.gz NAOCLNZSAJKRSY-LLVKDONJSA-N -1 3 364.331 3.523 20 0 FHADHM Cc1ccc([C@H]2CCCN2c2nc(C(F)(F)F)ccc2-c2nn[n-]n2)o1 ZINC000737331496 599172336 /nfs/dbraw/zinc/17/23/36/599172336.db2.gz NAOCLNZSAJKRSY-LLVKDONJSA-N -1 3 364.331 3.523 20 0 FHADHM CC(C)(C(=O)Oc1ccc(-c2nnn[n-]2)cc1)c1ccc2ccccc2c1 ZINC000735581765 599174762 /nfs/dbraw/zinc/17/47/62/599174762.db2.gz CORAYJJPGCRNSY-UHFFFAOYSA-N -1 3 358.401 3.903 20 0 FHADHM CC(C)(C(=O)Oc1ccc(-c2nn[n-]n2)cc1)c1ccc2ccccc2c1 ZINC000735581765 599174765 /nfs/dbraw/zinc/17/47/65/599174765.db2.gz CORAYJJPGCRNSY-UHFFFAOYSA-N -1 3 358.401 3.903 20 0 FHADHM Clc1ccc([C@H]2CSCCN2Cc2ccccc2-c2nn[n-]n2)cc1 ZINC000737571075 599177612 /nfs/dbraw/zinc/17/76/12/599177612.db2.gz QMXWEBKIMCLNKA-QGZVFWFLSA-N -1 3 371.897 3.810 20 0 FHADHM CC(C)(C(=O)NCc1cccc(-c2nnn[n-]2)c1)c1ccc2ccccc2c1 ZINC000735581206 599179432 /nfs/dbraw/zinc/17/94/32/599179432.db2.gz PXMNJRDUNCLPCY-UHFFFAOYSA-N -1 3 371.444 3.614 20 0 FHADHM CC(C)(C(=O)NCc1cccc(-c2nn[n-]n2)c1)c1ccc2ccccc2c1 ZINC000735581206 599179434 /nfs/dbraw/zinc/17/94/34/599179434.db2.gz PXMNJRDUNCLPCY-UHFFFAOYSA-N -1 3 371.444 3.614 20 0 FHADHM CCCc1ncc(C(=O)N(CC(C)C)c2ccc(-c3nnn[n-]3)cc2)s1 ZINC000736494751 599184426 /nfs/dbraw/zinc/18/44/26/599184426.db2.gz FTIKIXQBWJZEIY-UHFFFAOYSA-N -1 3 370.482 3.579 20 0 FHADHM CCCc1ncc(C(=O)N(CC(C)C)c2ccc(-c3nn[n-]n3)cc2)s1 ZINC000736494751 599184429 /nfs/dbraw/zinc/18/44/29/599184429.db2.gz FTIKIXQBWJZEIY-UHFFFAOYSA-N -1 3 370.482 3.579 20 0 FHADHM C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)C)CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736113518 599187470 /nfs/dbraw/zinc/18/74/70/599187470.db2.gz OWUIMUIOJYQZQM-PBHICJAKSA-N -1 3 370.501 3.786 20 0 FHADHM C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)C)CC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736113518 599187473 /nfs/dbraw/zinc/18/74/73/599187473.db2.gz OWUIMUIOJYQZQM-PBHICJAKSA-N -1 3 370.501 3.786 20 0 FHADHM CCC[C@@H]1[C@@H](C)CCCN1C(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000821034311 599192501 /nfs/dbraw/zinc/19/25/01/599192501.db2.gz KKVYNOGGCCDBBL-WMLDXEAASA-N -1 3 373.526 3.527 20 0 FHADHM CCC[C@@H]1[C@@H](C)CCCN1C(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000821034311 599192505 /nfs/dbraw/zinc/19/25/05/599192505.db2.gz KKVYNOGGCCDBBL-WMLDXEAASA-N -1 3 373.526 3.527 20 0 FHADHM O=C(NC1CCC1)c1cccc(Oc2cccc(Cl)c2-c2nnn[n-]2)c1 ZINC000738026703 599203336 /nfs/dbraw/zinc/20/33/36/599203336.db2.gz UXMVQQPOBKMRIY-UHFFFAOYSA-N -1 3 369.812 3.595 20 0 FHADHM O=C(/C=C/C1CC1)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1 ZINC000822924225 599219291 /nfs/dbraw/zinc/21/92/91/599219291.db2.gz ZFUWJEUBBMWAGU-JXMROGBWSA-N -1 3 365.368 3.703 20 0 FHADHM O=C(/C=C/C1CC1)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1 ZINC000822924225 599219293 /nfs/dbraw/zinc/21/92/93/599219293.db2.gz ZFUWJEUBBMWAGU-JXMROGBWSA-N -1 3 365.368 3.703 20 0 FHADHM O=C(Nc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1)C1CCC1 ZINC000823356831 599220364 /nfs/dbraw/zinc/22/03/64/599220364.db2.gz OUISEQFHWJKGKU-UHFFFAOYSA-N -1 3 353.357 3.537 20 0 FHADHM O=C(Nc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1)C1CCC1 ZINC000823356831 599220366 /nfs/dbraw/zinc/22/03/66/599220366.db2.gz OUISEQFHWJKGKU-UHFFFAOYSA-N -1 3 353.357 3.537 20 0 FHADHM CCc1ccc([C@H]2C[C@H](C)CCN2C(=O)c2ccc(-c3nnn[n-]3)cc2)o1 ZINC000821481994 599220837 /nfs/dbraw/zinc/22/08/37/599220837.db2.gz PDINWDCGTPJKHA-CXAGYDPISA-N -1 3 365.437 3.636 20 0 FHADHM CCc1ccc([C@H]2C[C@H](C)CCN2C(=O)c2ccc(-c3nn[n-]n3)cc2)o1 ZINC000821481994 599220839 /nfs/dbraw/zinc/22/08/39/599220839.db2.gz PDINWDCGTPJKHA-CXAGYDPISA-N -1 3 365.437 3.636 20 0 FHADHM Cc1ccccc1NC(=O)CCSCc1ccc(F)cc1-c1nnn[n-]1 ZINC000822361895 599224199 /nfs/dbraw/zinc/22/41/99/599224199.db2.gz KHBGJDFPGHXUTA-UHFFFAOYSA-N -1 3 371.441 3.576 20 0 FHADHM Cc1ccccc1NC(=O)CCSCc1ccc(F)cc1-c1nn[n-]n1 ZINC000822361895 599224202 /nfs/dbraw/zinc/22/42/02/599224202.db2.gz KHBGJDFPGHXUTA-UHFFFAOYSA-N -1 3 371.441 3.576 20 0 FHADHM O=C(c1ccccc1-c1ccccc1-c1nnn[n-]1)N1CCC[C@@H]2CCC[C@@H]21 ZINC000738277899 599225530 /nfs/dbraw/zinc/22/55/30/599225530.db2.gz HAUOPFHGVMWRST-YWZLYKJASA-N -1 3 373.460 3.938 20 0 FHADHM O=C(c1ccccc1-c1ccccc1-c1nn[n-]n1)N1CCC[C@@H]2CCC[C@@H]21 ZINC000738277899 599225533 /nfs/dbraw/zinc/22/55/33/599225533.db2.gz HAUOPFHGVMWRST-YWZLYKJASA-N -1 3 373.460 3.938 20 0 FHADHM CC[C@H](C)C[C@H](C)NC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820870538 599227338 /nfs/dbraw/zinc/22/73/38/599227338.db2.gz URDNYLQVDCJOLL-UWVGGRQHSA-N -1 3 352.895 3.631 20 0 FHADHM CC[C@H](C)C[C@H](C)NC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820870538 599227341 /nfs/dbraw/zinc/22/73/41/599227341.db2.gz URDNYLQVDCJOLL-UWVGGRQHSA-N -1 3 352.895 3.631 20 0 FHADHM Cc1ccc(NC(=O)c2cccc(Oc3ccc(-c4nnn[n-]4)cc3)c2)cn1 ZINC000822254724 607265564 /nfs/dbraw/zinc/26/55/64/607265564.db2.gz POHQZKJXSNRXPW-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccc(NC(=O)c2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)cn1 ZINC000822254724 607265565 /nfs/dbraw/zinc/26/55/65/607265565.db2.gz POHQZKJXSNRXPW-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM CCSCc1ccc(C(=O)Nc2cccc(-c3nnn[n-]3)c2C)cc1 ZINC000821461154 607267598 /nfs/dbraw/zinc/26/75/98/607267598.db2.gz KUNTWIFTCVIUIK-UHFFFAOYSA-N -1 3 353.451 3.681 20 0 FHADHM CCSCc1ccc(C(=O)Nc2cccc(-c3nn[n-]n3)c2C)cc1 ZINC000821461154 607267599 /nfs/dbraw/zinc/26/75/99/607267599.db2.gz KUNTWIFTCVIUIK-UHFFFAOYSA-N -1 3 353.451 3.681 20 0 FHADHM Cc1c(NC(=O)CCSc2ccc(Cl)cc2)cccc1-c1nnn[n-]1 ZINC000822067029 607267895 /nfs/dbraw/zinc/26/78/95/607267895.db2.gz HUFQINGQEISJPV-UHFFFAOYSA-N -1 3 373.869 3.949 20 0 FHADHM Cc1c(NC(=O)CCSc2ccc(Cl)cc2)cccc1-c1nn[n-]n1 ZINC000822067029 607267896 /nfs/dbraw/zinc/26/78/96/607267896.db2.gz HUFQINGQEISJPV-UHFFFAOYSA-N -1 3 373.869 3.949 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)Nc1cccc(CC(F)(F)F)c1 ZINC000823309077 599242403 /nfs/dbraw/zinc/24/24/03/599242403.db2.gz RKWSMVDJCRHLQG-UHFFFAOYSA-N -1 3 362.315 3.616 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)Nc1cccc(CC(F)(F)F)c1 ZINC000823309077 599242406 /nfs/dbraw/zinc/24/24/06/599242406.db2.gz RKWSMVDJCRHLQG-UHFFFAOYSA-N -1 3 362.315 3.616 20 0 FHADHM Cc1c(NC(=O)CCCc2ccc(Cl)cc2)cccc1-c1nnn[n-]1 ZINC000822068920 607271636 /nfs/dbraw/zinc/27/16/36/607271636.db2.gz WHNCEZREUDJCMM-UHFFFAOYSA-N -1 3 355.829 3.790 20 0 FHADHM Cc1c(NC(=O)CCCc2ccc(Cl)cc2)cccc1-c1nn[n-]n1 ZINC000822068920 607271637 /nfs/dbraw/zinc/27/16/37/607271637.db2.gz WHNCEZREUDJCMM-UHFFFAOYSA-N -1 3 355.829 3.790 20 0 FHADHM C[C@H]1CN(C(=O)Nc2cccc(-c3nnn[n-]3)c2)CC[C@@H]1c1ccccc1 ZINC000820743483 599243240 /nfs/dbraw/zinc/24/32/40/599243240.db2.gz UQZOGIWXBMUXDJ-KSSFIOAISA-N -1 3 362.437 3.524 20 0 FHADHM C[C@H]1CN(C(=O)Nc2cccc(-c3nn[n-]n3)c2)CC[C@@H]1c1ccccc1 ZINC000820743483 599243243 /nfs/dbraw/zinc/24/32/43/599243243.db2.gz UQZOGIWXBMUXDJ-KSSFIOAISA-N -1 3 362.437 3.524 20 0 FHADHM CC[C@@H](Cc1ccc(C)cc1)N(C)C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000820916144 599245197 /nfs/dbraw/zinc/24/51/97/599245197.db2.gz ZLBLYCUYBFQUKO-SFHVURJKSA-N -1 3 364.453 3.660 20 0 FHADHM CC[C@@H](Cc1ccc(C)cc1)N(C)C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000820916144 599245199 /nfs/dbraw/zinc/24/51/99/599245199.db2.gz ZLBLYCUYBFQUKO-SFHVURJKSA-N -1 3 364.453 3.660 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@@H](C(C)(C)C)CC2)cccc1-c1nnn[n-]1 ZINC000822084553 607282062 /nfs/dbraw/zinc/28/20/62/607282062.db2.gz MSBTTWFUUFOLLZ-CQSZACIVSA-N -1 3 356.474 3.855 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@@H](C(C)(C)C)CC2)cccc1-c1nn[n-]n1 ZINC000822084553 607282063 /nfs/dbraw/zinc/28/20/63/607282063.db2.gz MSBTTWFUUFOLLZ-CQSZACIVSA-N -1 3 356.474 3.855 20 0 FHADHM Cc1c(NC(=O)N2C[C@H](c3ccccc3)C[C@@H]2C)cccc1-c1nnn[n-]1 ZINC000822085173 607286337 /nfs/dbraw/zinc/28/63/37/607286337.db2.gz WPTICRQEOLBCJA-XJKSGUPXSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1c(NC(=O)N2C[C@H](c3ccccc3)C[C@@H]2C)cccc1-c1nn[n-]n1 ZINC000822085173 607286338 /nfs/dbraw/zinc/28/63/38/607286338.db2.gz WPTICRQEOLBCJA-XJKSGUPXSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1c(NC(=O)C(C)(C)Oc2ccc(Cl)cc2)cccc1-c1nnn[n-]1 ZINC000822061478 607295648 /nfs/dbraw/zinc/29/56/48/607295648.db2.gz NSCCFZGODRNZST-UHFFFAOYSA-N -1 3 371.828 3.625 20 0 FHADHM Cc1c(NC(=O)C(C)(C)Oc2ccc(Cl)cc2)cccc1-c1nn[n-]n1 ZINC000822061478 607295649 /nfs/dbraw/zinc/29/56/49/607295649.db2.gz NSCCFZGODRNZST-UHFFFAOYSA-N -1 3 371.828 3.625 20 0 FHADHM CSc1ccc(Cl)c(C(=O)Nc2cccc(-c3nnn[n-]3)c2C)c1 ZINC000821983082 607295840 /nfs/dbraw/zinc/29/58/40/607295840.db2.gz DFXXTDYLIZKESR-UHFFFAOYSA-N -1 3 359.842 3.803 20 0 FHADHM CSc1ccc(Cl)c(C(=O)Nc2cccc(-c3nn[n-]n3)c2C)c1 ZINC000821983082 607295841 /nfs/dbraw/zinc/29/58/41/607295841.db2.gz DFXXTDYLIZKESR-UHFFFAOYSA-N -1 3 359.842 3.803 20 0 FHADHM Cc1cc(F)cc(NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c1 ZINC000822203561 607307381 /nfs/dbraw/zinc/30/73/81/607307381.db2.gz ZVEUDSXTARQHGT-UHFFFAOYSA-N -1 3 362.821 3.777 20 0 FHADHM Cc1cc(F)cc(NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c1 ZINC000822203561 607307382 /nfs/dbraw/zinc/30/73/82/607307382.db2.gz ZVEUDSXTARQHGT-UHFFFAOYSA-N -1 3 362.821 3.777 20 0 FHADHM c1sc(CNc2ccc(-c3cn4ccccc4n3)cc2)cc1-c1nnn[n-]1 ZINC000823802185 607309592 /nfs/dbraw/zinc/30/95/92/607309592.db2.gz ITOMYIJQEDYGSW-UHFFFAOYSA-N -1 3 373.445 3.855 20 0 FHADHM c1sc(CNc2ccc(-c3cn4ccccc4n3)cc2)cc1-c1nn[n-]n1 ZINC000823802185 607309593 /nfs/dbraw/zinc/30/95/93/607309593.db2.gz ITOMYIJQEDYGSW-UHFFFAOYSA-N -1 3 373.445 3.855 20 0 FHADHM c1cc(-c2nnn[n-]2)sc1CNc1cccc(OCc2cccnc2)c1 ZINC000823816655 607309645 /nfs/dbraw/zinc/30/96/45/607309645.db2.gz VRLWPDMNFTWBCR-UHFFFAOYSA-N -1 3 364.434 3.514 20 0 FHADHM COc1ccc(CNc2ccc(C)c(Br)c2)cc1-c1nnn[n-]1 ZINC000821821691 607311428 /nfs/dbraw/zinc/31/14/28/607311428.db2.gz REKUTHDQNPYDPT-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM COc1ccc(CNc2ccc(C)c(Br)c2)cc1-c1nn[n-]n1 ZINC000821821691 607311429 /nfs/dbraw/zinc/31/14/29/607311429.db2.gz REKUTHDQNPYDPT-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM Cc1c(Br)cccc1NCc1cc(-c2nnn[n-]2)cs1 ZINC000822015120 607311642 /nfs/dbraw/zinc/31/16/42/607311642.db2.gz CVOULZBGUCUAAL-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM Cc1c(Br)cccc1NCc1cc(-c2nn[n-]n2)cs1 ZINC000822015120 607311643 /nfs/dbraw/zinc/31/16/43/607311643.db2.gz CVOULZBGUCUAAL-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM c1csc(-c2cccc(NCc3cnc4ccc(-c5nnn[n-]5)cn34)c2)c1 ZINC000823756533 607312072 /nfs/dbraw/zinc/31/20/72/607312072.db2.gz AZXNPDVVBXOXRG-UHFFFAOYSA-N -1 3 373.445 3.855 20 0 FHADHM c1csc(-c2cccc(NCc3cnc4ccc(-c5nn[n-]n5)cn34)c2)c1 ZINC000823756533 607312073 /nfs/dbraw/zinc/31/20/73/607312073.db2.gz AZXNPDVVBXOXRG-UHFFFAOYSA-N -1 3 373.445 3.855 20 0 FHADHM c1nc(-c2ccc(NCc3ccc(-c4nn[n-]n4)cc3)cc2)n2c1CCCC2 ZINC000823742211 607313583 /nfs/dbraw/zinc/31/35/83/607313583.db2.gz AUJPXIBSGDSDOE-UHFFFAOYSA-N -1 3 371.448 3.679 20 0 FHADHM c1nc(-c2ccc(NCc3cccc(-c4nn[n-]n4)c3)cc2)n2c1CCCC2 ZINC000823751702 607313783 /nfs/dbraw/zinc/31/37/83/607313783.db2.gz QIXOIEBRPNLENH-UHFFFAOYSA-N -1 3 371.448 3.679 20 0 FHADHM CCc1ccccc1C(=O)Nc1sc2c(c1-c1nnn[n-]1)CC[C@H](C)C2 ZINC000821492766 607303864 /nfs/dbraw/zinc/30/38/64/607303864.db2.gz WQHQPCQMGKYXKB-NSHDSACASA-N -1 3 367.478 3.868 20 0 FHADHM CCc1ccccc1C(=O)Nc1sc2c(c1-c1nn[n-]n1)CC[C@H](C)C2 ZINC000821492766 607303865 /nfs/dbraw/zinc/30/38/65/607303865.db2.gz WQHQPCQMGKYXKB-NSHDSACASA-N -1 3 367.478 3.868 20 0 FHADHM FC(F)(F)c1ccc(NCc2ccc3c(c2)COC3)c(-c2nnn[n-]2)c1 ZINC000822728691 607305619 /nfs/dbraw/zinc/30/56/19/607305619.db2.gz JJMBDJNTFZASQJ-UHFFFAOYSA-N -1 3 361.327 3.528 20 0 FHADHM FC(F)(F)c1ccc(NCc2ccc3c(c2)COC3)c(-c2nn[n-]n2)c1 ZINC000822728691 607305620 /nfs/dbraw/zinc/30/56/20/607305620.db2.gz JJMBDJNTFZASQJ-UHFFFAOYSA-N -1 3 361.327 3.528 20 0 FHADHM CC(C)(C)[S@](=O)Cc1cccc(NCc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000819951321 607316836 /nfs/dbraw/zinc/31/68/36/607316836.db2.gz SECWQLLBEBIKOR-AREMUKBSSA-N -1 3 369.494 3.526 20 0 FHADHM CC(C)(C)[S@](=O)Cc1cccc(NCc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000819951321 607316837 /nfs/dbraw/zinc/31/68/37/607316837.db2.gz SECWQLLBEBIKOR-AREMUKBSSA-N -1 3 369.494 3.526 20 0 FHADHM Cc1ccc(NC(=O)C(C)(C)C)cc1NCc1cc(-c2nnn[n-]2)cs1 ZINC000822242785 607317071 /nfs/dbraw/zinc/31/70/71/607317071.db2.gz XVICVZYDPYQBRH-UHFFFAOYSA-N -1 3 370.482 3.833 20 0 FHADHM Cc1ccc(NC(=O)C(C)(C)C)cc1NCc1cc(-c2nn[n-]n2)cs1 ZINC000822242785 607317072 /nfs/dbraw/zinc/31/70/72/607317072.db2.gz XVICVZYDPYQBRH-UHFFFAOYSA-N -1 3 370.482 3.833 20 0 FHADHM CCCOc1cccc(CC(=O)O[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000821134484 607317464 /nfs/dbraw/zinc/31/74/64/607317464.db2.gz XENZHVTXBNAGTL-CQSZACIVSA-N -1 3 366.421 3.502 20 0 FHADHM CCCOc1cccc(CC(=O)O[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000821134484 607317465 /nfs/dbraw/zinc/31/74/65/607317465.db2.gz XENZHVTXBNAGTL-CQSZACIVSA-N -1 3 366.421 3.502 20 0 FHADHM CCCCS[C@H](C)C(=O)Nc1cc(-c2nn[n-]n2)ccc1NCCC ZINC000736463966 599275792 /nfs/dbraw/zinc/27/57/92/599275792.db2.gz TYFDNFJDVSNFQB-GFCCVEGCSA-N -1 3 362.503 3.549 20 0 FHADHM CCC(CC)(CC)NC(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(F)F ZINC000820887972 599277200 /nfs/dbraw/zinc/27/72/00/599277200.db2.gz ZUPIAGWMXJIVHD-UHFFFAOYSA-N -1 3 368.388 3.558 20 0 FHADHM CCC(CC)(CC)NC(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(F)F ZINC000820887972 599277202 /nfs/dbraw/zinc/27/72/02/599277202.db2.gz ZUPIAGWMXJIVHD-UHFFFAOYSA-N -1 3 368.388 3.558 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cc(C)c(CC)s1 ZINC000736487968 599277506 /nfs/dbraw/zinc/27/75/06/599277506.db2.gz LWSMTYXQHUMXEG-UHFFFAOYSA-N -1 3 370.482 3.873 20 0 FHADHM CN(C(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)C1CCC1 ZINC000821571732 599281421 /nfs/dbraw/zinc/28/14/21/599281421.db2.gz CHIRJQWMLBHLFQ-UHFFFAOYSA-N -1 3 364.409 3.675 20 0 FHADHM CN(C(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)C1CCC1 ZINC000821571732 599281422 /nfs/dbraw/zinc/28/14/22/599281422.db2.gz CHIRJQWMLBHLFQ-UHFFFAOYSA-N -1 3 364.409 3.675 20 0 FHADHM CCSc1nnc(S[C@H](C)c2ccc(-c3nnn[n-]3)cc2)s1 ZINC000736667350 599285549 /nfs/dbraw/zinc/28/55/49/599285549.db2.gz OEEOLMOSPFLYPC-MRVPVSSYSA-N -1 3 350.498 3.684 20 0 FHADHM CCSc1nnc(S[C@H](C)c2ccc(-c3nn[n-]n3)cc2)s1 ZINC000736667350 599285550 /nfs/dbraw/zinc/28/55/50/599285550.db2.gz OEEOLMOSPFLYPC-MRVPVSSYSA-N -1 3 350.498 3.684 20 0 FHADHM C[C@@H](Sc1ccc(Br)cn1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736191337 599289542 /nfs/dbraw/zinc/28/95/42/599289542.db2.gz ICIHLYCXHXMBSI-SECBINFHSA-N -1 3 362.256 3.878 20 0 FHADHM C[C@@H](Sc1ccc(Br)cn1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736191337 599289545 /nfs/dbraw/zinc/28/95/45/599289545.db2.gz ICIHLYCXHXMBSI-SECBINFHSA-N -1 3 362.256 3.878 20 0 FHADHM Cc1ccc(NC(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)cc1 ZINC000822248934 599290210 /nfs/dbraw/zinc/29/02/10/599290210.db2.gz UYHJTGAYUGKORO-UHFFFAOYSA-N -1 3 362.315 3.838 20 0 FHADHM Cc1ccc(NC(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)cc1 ZINC000822248934 599290212 /nfs/dbraw/zinc/29/02/12/599290212.db2.gz UYHJTGAYUGKORO-UHFFFAOYSA-N -1 3 362.315 3.838 20 0 FHADHM CC(C)N(C(=O)c1sccc1-c1nnn[n-]1)c1ccc(F)cc1Cl ZINC000735856930 599291498 /nfs/dbraw/zinc/29/14/98/599291498.db2.gz LZNWVYXUWSPIGW-UHFFFAOYSA-N -1 3 365.821 3.776 20 0 FHADHM CC(C)N(C(=O)c1sccc1-c1nn[n-]n1)c1ccc(F)cc1Cl ZINC000735856930 599291500 /nfs/dbraw/zinc/29/15/00/599291500.db2.gz LZNWVYXUWSPIGW-UHFFFAOYSA-N -1 3 365.821 3.776 20 0 FHADHM CC[C@@H]1CCCCN1C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000820981590 599291959 /nfs/dbraw/zinc/29/19/59/599291959.db2.gz USFUCLJBXRLVRB-LLVKDONJSA-N -1 3 368.363 3.682 20 0 FHADHM CC[C@@H]1CCCCN1C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000820981590 599291961 /nfs/dbraw/zinc/29/19/61/599291961.db2.gz USFUCLJBXRLVRB-LLVKDONJSA-N -1 3 368.363 3.682 20 0 FHADHM O=C([O-])c1cccc(CNCc2cccc(NC(=O)c3ccccc3)c2)c1 ZINC000821552352 598203003 /nfs/dbraw/zinc/20/30/03/598203003.db2.gz JPKYTZOBOHFZHD-UHFFFAOYSA-N -1 3 360.413 3.927 20 0 FHADHM CCSc1ccc(Cl)cc1NC(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000736665808 598234550 /nfs/dbraw/zinc/23/45/50/598234550.db2.gz IWPFKSSBCYHGHE-UHFFFAOYSA-N -1 3 359.842 3.884 20 0 FHADHM CCSc1ccc(Cl)cc1NC(=O)c1cccc(-c2nn[n-]n2)c1 ZINC000736665808 598234551 /nfs/dbraw/zinc/23/45/51/598234551.db2.gz IWPFKSSBCYHGHE-UHFFFAOYSA-N -1 3 359.842 3.884 20 0 FHADHM C[C@H](Nc1ccc(-c2nn[n-]n2)cc1F)c1cccc(Br)c1 ZINC000736140335 598236916 /nfs/dbraw/zinc/23/69/16/598236916.db2.gz UFUPKJKAQDBSKZ-VIFPVBQESA-N -1 3 362.206 3.941 20 0 FHADHM CN(C[C@@H]1CCCO[C@@H]1c1ccccc1)c1ccc(-c2nn[n-]n2)cc1F ZINC000736793389 598243206 /nfs/dbraw/zinc/24/32/06/598243206.db2.gz WSMNNXGJQYYJFY-QFBILLFUSA-N -1 3 367.428 3.610 20 0 FHADHM C[C@@H](NC(=O)NCc1ccc2ccccc2c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736119622 598263032 /nfs/dbraw/zinc/26/30/32/598263032.db2.gz SVEZSLFRCZKXRB-CQSZACIVSA-N -1 3 372.432 3.580 20 0 FHADHM C[C@@H](NC(=O)NCc1ccc2ccccc2c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736119622 598263034 /nfs/dbraw/zinc/26/30/34/598263034.db2.gz SVEZSLFRCZKXRB-CQSZACIVSA-N -1 3 372.432 3.580 20 0 FHADHM CC(C)CN(C)C(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000735827327 598266250 /nfs/dbraw/zinc/26/62/50/598266250.db2.gz KDFBCYNDLRTXBU-UHFFFAOYSA-N -1 3 366.425 3.779 20 0 FHADHM CC(C)CN(C)C(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735827327 598266252 /nfs/dbraw/zinc/26/62/52/598266252.db2.gz KDFBCYNDLRTXBU-UHFFFAOYSA-N -1 3 366.425 3.779 20 0 FHADHM C[C@@H](NC(=O)Nc1cccc(C(F)F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736115346 598292107 /nfs/dbraw/zinc/29/21/07/598292107.db2.gz HHQDAXVHZGRYJC-SNVBAGLBSA-N -1 3 358.352 3.687 20 0 FHADHM C[C@@H](NC(=O)Nc1cccc(C(F)F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736115346 598292108 /nfs/dbraw/zinc/29/21/08/598292108.db2.gz HHQDAXVHZGRYJC-SNVBAGLBSA-N -1 3 358.352 3.687 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N(Cc1ccccc1)C(C)C ZINC000737291435 598293237 /nfs/dbraw/zinc/29/32/37/598293237.db2.gz LFVLIQAFUJFNQN-UHFFFAOYSA-N -1 3 350.426 3.618 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N(Cc1ccccc1)C(C)C ZINC000737291435 598293238 /nfs/dbraw/zinc/29/32/38/598293238.db2.gz LFVLIQAFUJFNQN-UHFFFAOYSA-N -1 3 350.426 3.618 20 0 FHADHM CC[C@H](C)Oc1ccccc1C=CC(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000729846030 598296907 /nfs/dbraw/zinc/29/69/07/598296907.db2.gz ZIRPCACWCVCRCD-ZVHGMHCTSA-N -1 3 363.421 3.696 20 0 FHADHM CC[C@H](C)Oc1ccccc1C=CC(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000729846030 598296909 /nfs/dbraw/zinc/29/69/09/598296909.db2.gz ZIRPCACWCVCRCD-ZVHGMHCTSA-N -1 3 363.421 3.696 20 0 FHADHM CC[C@@H](C)Oc1ccccc1C=CC(=O)Nc1ccccc1-c1nnn[n-]1 ZINC000736323551 598297470 /nfs/dbraw/zinc/29/74/70/598297470.db2.gz BCKTZVFIRWUOHO-WUFNSSIPSA-N -1 3 363.421 3.696 20 0 FHADHM CC[C@@H](C)Oc1ccccc1C=CC(=O)Nc1ccccc1-c1nn[n-]n1 ZINC000736323551 598297471 /nfs/dbraw/zinc/29/74/71/598297471.db2.gz BCKTZVFIRWUOHO-WUFNSSIPSA-N -1 3 363.421 3.696 20 0 FHADHM CC[C@@H](C)Oc1ccccc1C=CC(=O)Nc1ccccc1-c1nnn[n-]1 ZINC000736323553 598297536 /nfs/dbraw/zinc/29/75/36/598297536.db2.gz BCKTZVFIRWUOHO-XTZCOPOCSA-N -1 3 363.421 3.696 20 0 FHADHM CC[C@@H](C)Oc1ccccc1C=CC(=O)Nc1ccccc1-c1nn[n-]n1 ZINC000736323553 598297537 /nfs/dbraw/zinc/29/75/37/598297537.db2.gz BCKTZVFIRWUOHO-XTZCOPOCSA-N -1 3 363.421 3.696 20 0 FHADHM CC(C)N(Cc1cccs1)C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736112090 598303357 /nfs/dbraw/zinc/30/33/57/598303357.db2.gz PMHKXXPTGMMNMO-ZDUSSCGKSA-N -1 3 370.482 3.609 20 0 FHADHM CC(C)N(Cc1cccs1)C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736112090 598303359 /nfs/dbraw/zinc/30/33/59/598303359.db2.gz PMHKXXPTGMMNMO-ZDUSSCGKSA-N -1 3 370.482 3.609 20 0 FHADHM Cc1ccc(-c2ccc(CNCc3ccc(-c4nnn[n-]4)cc3F)o2)cc1 ZINC000737288410 598314956 /nfs/dbraw/zinc/31/49/56/598314956.db2.gz OEZCZUVEXLWIQH-UHFFFAOYSA-N -1 3 363.396 3.864 20 0 FHADHM Cc1ccc(-c2ccc(CNCc3ccc(-c4nn[n-]n4)cc3F)o2)cc1 ZINC000737288410 598314958 /nfs/dbraw/zinc/31/49/58/598314958.db2.gz OEZCZUVEXLWIQH-UHFFFAOYSA-N -1 3 363.396 3.864 20 0 FHADHM O=C(CS[C@H]1CCCc2ccccc21)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000737932133 598316205 /nfs/dbraw/zinc/31/62/05/598316205.db2.gz JWAUCIWZVGODJJ-KRWDZBQOSA-N -1 3 365.462 3.616 20 0 FHADHM O=C(CS[C@H]1CCCc2ccccc21)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000737932133 598316207 /nfs/dbraw/zinc/31/62/07/598316207.db2.gz JWAUCIWZVGODJJ-KRWDZBQOSA-N -1 3 365.462 3.616 20 0 FHADHM S=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)N1CCCc2ccccc21 ZINC000738401304 598316375 /nfs/dbraw/zinc/31/63/75/598316375.db2.gz NZOJCIPHAXZUQA-UHFFFAOYSA-N -1 3 370.869 3.670 20 0 FHADHM S=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)N1CCCc2ccccc21 ZINC000738401304 598316378 /nfs/dbraw/zinc/31/63/78/598316378.db2.gz NZOJCIPHAXZUQA-UHFFFAOYSA-N -1 3 370.869 3.670 20 0 FHADHM CCc1ccccc1NC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736701849 598316856 /nfs/dbraw/zinc/31/68/56/598316856.db2.gz IZQLRCGCHHTXCS-UHFFFAOYSA-N -1 3 358.858 3.891 20 0 FHADHM CCc1ccccc1NC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736701849 598316857 /nfs/dbraw/zinc/31/68/57/598316857.db2.gz IZQLRCGCHHTXCS-UHFFFAOYSA-N -1 3 358.858 3.891 20 0 FHADHM Cc1ccc([C@H](C)NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1 ZINC000737318521 598320942 /nfs/dbraw/zinc/32/09/42/598320942.db2.gz AZGZLRYKIATZKZ-NSHDSACASA-N -1 3 372.885 3.876 20 0 FHADHM Cc1ccc([C@H](C)NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1 ZINC000737318521 598320944 /nfs/dbraw/zinc/32/09/44/598320944.db2.gz AZGZLRYKIATZKZ-NSHDSACASA-N -1 3 372.885 3.876 20 0 FHADHM S=C(Nc1ccccc1-c1nnn[n-]1)N1CCC2(CCCCC2)CC1 ZINC000738407988 598325163 /nfs/dbraw/zinc/32/51/63/598325163.db2.gz ISACLTMXSDKAQD-UHFFFAOYSA-N -1 3 356.499 3.610 20 0 FHADHM S=C(Nc1ccccc1-c1nn[n-]n1)N1CCC2(CCCCC2)CC1 ZINC000738407988 598325166 /nfs/dbraw/zinc/32/51/66/598325166.db2.gz ISACLTMXSDKAQD-UHFFFAOYSA-N -1 3 356.499 3.610 20 0 FHADHM O=C(OC1CCCCC1)c1occc1COc1cccc(-c2nnn[n-]2)c1 ZINC000738215886 598326472 /nfs/dbraw/zinc/32/64/72/598326472.db2.gz SMHAMDQYKDAOPL-UHFFFAOYSA-N -1 3 368.393 3.528 20 0 FHADHM O=C(OC1CCCCC1)c1occc1COc1cccc(-c2nn[n-]n2)c1 ZINC000738215886 598326475 /nfs/dbraw/zinc/32/64/75/598326475.db2.gz SMHAMDQYKDAOPL-UHFFFAOYSA-N -1 3 368.393 3.528 20 0 FHADHM C[C@H](OC(=O)[C@@H]1CCCc2sccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488830 607351664 /nfs/dbraw/zinc/35/16/64/607351664.db2.gz VAEARSSHZFZQEI-XHDPSFHLSA-N -1 3 354.435 3.653 20 0 FHADHM C[C@H](OC(=O)[C@@H]1CCCc2sccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488830 607351666 /nfs/dbraw/zinc/35/16/66/607351666.db2.gz VAEARSSHZFZQEI-XHDPSFHLSA-N -1 3 354.435 3.653 20 0 FHADHM Cc1ccc(Cl)cc1N1CC[C@H](CNc2ccc(-c3nn[n-]n3)cc2)C1 ZINC000737343939 598353400 /nfs/dbraw/zinc/35/34/00/598353400.db2.gz YYVXQGBFYZPRTA-CQSZACIVSA-N -1 3 368.872 3.767 20 0 FHADHM Cc1cccc(-c2cccc(CNc3nnc(C)c(C)c3-c3nnn[n-]3)c2)c1 ZINC000737381204 598368627 /nfs/dbraw/zinc/36/86/27/598368627.db2.gz WVUZQQQWAZZANH-UHFFFAOYSA-N -1 3 371.448 3.861 20 0 FHADHM Cc1cccc(-c2cccc(CNc3nnc(C)c(C)c3-c3nn[n-]n3)c2)c1 ZINC000737381204 598368628 /nfs/dbraw/zinc/36/86/28/598368628.db2.gz WVUZQQQWAZZANH-UHFFFAOYSA-N -1 3 371.448 3.861 20 0 FHADHM COc1ccc(NC(=S)Nc2cc(-c3nnn[n-]3)ccc2C)cc1Cl ZINC000737102800 598378744 /nfs/dbraw/zinc/37/87/44/598378744.db2.gz CWVBRCJNVIKQPF-UHFFFAOYSA-N -1 3 374.857 3.646 20 0 FHADHM COc1ccc(NC(=S)Nc2cc(-c3nn[n-]n3)ccc2C)cc1Cl ZINC000737102800 598378745 /nfs/dbraw/zinc/37/87/45/598378745.db2.gz CWVBRCJNVIKQPF-UHFFFAOYSA-N -1 3 374.857 3.646 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)[C@H](OC1CCCC1)c1ccccc1 ZINC000104367842 598379268 /nfs/dbraw/zinc/37/92/68/598379268.db2.gz RKTWTKPGDAQEKF-GOSISDBHSA-N -1 3 363.421 3.506 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)[C@H](OC1CCCC1)c1ccccc1 ZINC000104367842 598379271 /nfs/dbraw/zinc/37/92/71/598379271.db2.gz RKTWTKPGDAQEKF-GOSISDBHSA-N -1 3 363.421 3.506 20 0 FHADHM CC(C)CN(C(=O)c1cccc2cccnc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000735819587 598383855 /nfs/dbraw/zinc/38/38/55/598383855.db2.gz YMDCIBMNVKRNHJ-UHFFFAOYSA-N -1 3 372.432 3.718 20 0 FHADHM CC(C)CN(C(=O)c1cccc2cccnc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000735819587 598383856 /nfs/dbraw/zinc/38/38/56/598383856.db2.gz YMDCIBMNVKRNHJ-UHFFFAOYSA-N -1 3 372.432 3.718 20 0 FHADHM FC(F)(F)c1ccc(CCNc2ncc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000737635055 598386676 /nfs/dbraw/zinc/38/66/76/598386676.db2.gz DWVAPAGTSMPIKU-UHFFFAOYSA-N -1 3 368.750 3.589 20 0 FHADHM FC(F)(F)c1ccc(CCNc2ncc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000737635055 598386678 /nfs/dbraw/zinc/38/66/78/598386678.db2.gz DWVAPAGTSMPIKU-UHFFFAOYSA-N -1 3 368.750 3.589 20 0 FHADHM Cc1ccc(C2=CCN(c3ncc(-c4nnn[n-]4)cc3Cl)CC2)cc1 ZINC000737327755 598388057 /nfs/dbraw/zinc/38/80/57/598388057.db2.gz AFXWXRCUSOBKGZ-UHFFFAOYSA-N -1 3 352.829 3.517 20 0 FHADHM Cc1ccc(C2=CCN(c3ncc(-c4nn[n-]n4)cc3Cl)CC2)cc1 ZINC000737327755 598388058 /nfs/dbraw/zinc/38/80/58/598388058.db2.gz AFXWXRCUSOBKGZ-UHFFFAOYSA-N -1 3 352.829 3.517 20 0 FHADHM CC(C)Oc1ccccc1[C@@H](C)Nc1ncc(-c2nnn[n-]2)cc1Cl ZINC000735914434 598390149 /nfs/dbraw/zinc/39/01/49/598390149.db2.gz SRENRXGKCUQMDR-LLVKDONJSA-N -1 3 358.833 3.875 20 0 FHADHM CC(C)Oc1ccccc1[C@@H](C)Nc1ncc(-c2nn[n-]n2)cc1Cl ZINC000735914434 598390151 /nfs/dbraw/zinc/39/01/51/598390151.db2.gz SRENRXGKCUQMDR-LLVKDONJSA-N -1 3 358.833 3.875 20 0 FHADHM CC(C)Oc1ccc([C@@H](C)Nc2ncc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000735915546 598390363 /nfs/dbraw/zinc/39/03/63/598390363.db2.gz PCCPKVHMBJFRTR-LLVKDONJSA-N -1 3 358.833 3.875 20 0 FHADHM CC(C)Oc1ccc([C@@H](C)Nc2ncc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000735915546 598390364 /nfs/dbraw/zinc/39/03/64/598390364.db2.gz PCCPKVHMBJFRTR-LLVKDONJSA-N -1 3 358.833 3.875 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1NCCOc1cccc2ccccc21 ZINC000737559480 598391255 /nfs/dbraw/zinc/39/12/55/598391255.db2.gz YYBOKCGYPGRTTA-UHFFFAOYSA-N -1 3 366.812 3.559 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1NCCOc1cccc2ccccc21 ZINC000737559480 598391258 /nfs/dbraw/zinc/39/12/58/598391258.db2.gz YYBOKCGYPGRTTA-UHFFFAOYSA-N -1 3 366.812 3.559 20 0 FHADHM CC(C)(C)Oc1ccc(CNc2ncc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000735640020 598392067 /nfs/dbraw/zinc/39/20/67/598392067.db2.gz UXLVBCYHALKBPN-UHFFFAOYSA-N -1 3 358.833 3.705 20 0 FHADHM CC(C)(C)Oc1ccc(CNc2ncc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000735640020 598392069 /nfs/dbraw/zinc/39/20/69/598392069.db2.gz UXLVBCYHALKBPN-UHFFFAOYSA-N -1 3 358.833 3.705 20 0 FHADHM CCN(C(=O)[C@@H](C)Sc1ccc(-c2nnn[n-]2)cc1)C1CCCCC1 ZINC000736501236 598416656 /nfs/dbraw/zinc/41/66/56/598416656.db2.gz BHFSLHGFEYYNFS-CYBMUJFWSA-N -1 3 359.499 3.529 20 0 FHADHM CCN(C(=O)[C@@H](C)Sc1ccc(-c2nn[n-]n2)cc1)C1CCCCC1 ZINC000736501236 598416657 /nfs/dbraw/zinc/41/66/57/598416657.db2.gz BHFSLHGFEYYNFS-CYBMUJFWSA-N -1 3 359.499 3.529 20 0 FHADHM CSc1ccsc1C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000737189705 598419400 /nfs/dbraw/zinc/41/94/00/598419400.db2.gz AQNSMIOTJXOCJJ-UHFFFAOYSA-N -1 3 351.844 3.556 20 0 FHADHM CSc1ccsc1C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000737189705 598419402 /nfs/dbraw/zinc/41/94/02/598419402.db2.gz AQNSMIOTJXOCJJ-UHFFFAOYSA-N -1 3 351.844 3.556 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H]1CCC[C@@H](C)[C@H]1C ZINC000736263470 598427938 /nfs/dbraw/zinc/42/79/38/598427938.db2.gz ROPMWUHADPQECY-IIDMSEBBSA-N -1 3 370.501 3.611 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H]1CCC[C@@H](C)[C@H]1C ZINC000736263470 598427939 /nfs/dbraw/zinc/42/79/39/598427939.db2.gz ROPMWUHADPQECY-IIDMSEBBSA-N -1 3 370.501 3.611 20 0 FHADHM C[C@H](NC(=O)Nc1cccc(-c2nnn[n-]2)c1)c1cc2ccccc2s1 ZINC000736117476 598428808 /nfs/dbraw/zinc/42/88/08/598428808.db2.gz PMWFHFZPOFNESC-NSHDSACASA-N -1 3 364.434 3.964 20 0 FHADHM C[C@H](NC(=O)Nc1cccc(-c2nn[n-]n2)c1)c1cc2ccccc2s1 ZINC000736117476 598428810 /nfs/dbraw/zinc/42/88/10/598428810.db2.gz PMWFHFZPOFNESC-NSHDSACASA-N -1 3 364.434 3.964 20 0 FHADHM CC(C)[C@@H](CCc1ccccc1)OC(=O)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000735711258 598431160 /nfs/dbraw/zinc/43/11/60/598431160.db2.gz XKIGIYMMZZPYRK-LJQANCHMSA-N -1 3 364.449 3.610 20 0 FHADHM CC(C)[C@@H](CCc1ccccc1)OC(=O)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000735711258 598431162 /nfs/dbraw/zinc/43/11/62/598431162.db2.gz XKIGIYMMZZPYRK-LJQANCHMSA-N -1 3 364.449 3.610 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H](C)c1ccccc1 ZINC000735874653 598432977 /nfs/dbraw/zinc/43/29/77/598432977.db2.gz TYUYUUKWSHKEMJ-HNNXBMFYSA-N -1 3 364.453 3.548 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H](C)c1ccccc1 ZINC000735874653 598432979 /nfs/dbraw/zinc/43/29/79/598432979.db2.gz TYUYUUKWSHKEMJ-HNNXBMFYSA-N -1 3 364.453 3.548 20 0 FHADHM O=C(Nc1ccccc1-c1nnn[n-]1)[C@H]1C[C@@H]1c1cccc2ccccc21 ZINC000738190191 598436068 /nfs/dbraw/zinc/43/60/68/598436068.db2.gz AZXJMYCHUKPJFQ-MSOLQXFVSA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1ccccc1-c1nn[n-]n1)[C@H]1C[C@@H]1c1cccc2ccccc21 ZINC000738190191 598436069 /nfs/dbraw/zinc/43/60/69/598436069.db2.gz AZXJMYCHUKPJFQ-MSOLQXFVSA-N -1 3 355.401 3.762 20 0 FHADHM Cc1ccccc1-c1nc(C(=O)Nc2ccc(-c3nnn[n-]3)cc2)cs1 ZINC000104367922 598440717 /nfs/dbraw/zinc/44/07/17/598440717.db2.gz TYCGQEZDAUQDPX-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1ccccc1-c1nc(C(=O)Nc2ccc(-c3nn[n-]n3)cc2)cs1 ZINC000104367922 598440719 /nfs/dbraw/zinc/44/07/19/598440719.db2.gz TYCGQEZDAUQDPX-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM CC(=CC(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1)c1ccccc1Cl ZINC000735450082 598442363 /nfs/dbraw/zinc/44/23/63/598442363.db2.gz VEQYIIHVYLUJDT-JLHYYAGUSA-N -1 3 367.840 3.582 20 0 FHADHM CC(=CC(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1)c1ccccc1Cl ZINC000735450082 598442364 /nfs/dbraw/zinc/44/23/64/598442364.db2.gz VEQYIIHVYLUJDT-JLHYYAGUSA-N -1 3 367.840 3.582 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)N1CCC[C@H](c2ccccc2)CC1 ZINC000737801738 598456591 /nfs/dbraw/zinc/45/65/91/598456591.db2.gz TXWZXARNRMKWPQ-HHNLSAEISA-N -1 3 373.460 3.676 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)N1CCC[C@H](c2ccccc2)CC1 ZINC000737801738 598456592 /nfs/dbraw/zinc/45/65/92/598456592.db2.gz TXWZXARNRMKWPQ-HHNLSAEISA-N -1 3 373.460 3.676 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)N1CCC[C@H](c2ccccc2)CC1 ZINC000738151978 598468840 /nfs/dbraw/zinc/46/88/40/598468840.db2.gz MPUMGAZTMVSUBU-INIZCTEOSA-N -1 3 362.437 3.668 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)N1CCC[C@H](c2ccccc2)CC1 ZINC000738151978 598468841 /nfs/dbraw/zinc/46/88/41/598468841.db2.gz MPUMGAZTMVSUBU-INIZCTEOSA-N -1 3 362.437 3.668 20 0 FHADHM O=C(OCc1ccc(-c2nnn[n-]2)cc1)[C@H]1C[C@H]1c1cccc2ccccc21 ZINC000738236216 598475967 /nfs/dbraw/zinc/47/59/67/598475967.db2.gz FIRVEZKPXVUDHQ-PMACEKPBSA-N -1 3 370.412 3.867 20 0 FHADHM O=C(OCc1ccc(-c2nn[n-]n2)cc1)[C@H]1C[C@H]1c1cccc2ccccc21 ZINC000738236216 598475969 /nfs/dbraw/zinc/47/59/69/598475969.db2.gz FIRVEZKPXVUDHQ-PMACEKPBSA-N -1 3 370.412 3.867 20 0 FHADHM C[C@@H](OC(=O)c1cnc(C(C)(C)C)s1)c1cccc(-c2nnn[n-]2)c1 ZINC000736163586 598481000 /nfs/dbraw/zinc/48/10/00/598481000.db2.gz PMOCJAJPXBAWBS-SNVBAGLBSA-N -1 3 357.439 3.539 20 0 FHADHM C[C@@H](OC(=O)c1cnc(C(C)(C)C)s1)c1cccc(-c2nn[n-]n2)c1 ZINC000736163586 598481001 /nfs/dbraw/zinc/48/10/01/598481001.db2.gz PMOCJAJPXBAWBS-SNVBAGLBSA-N -1 3 357.439 3.539 20 0 FHADHM C[C@H](CC(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1F ZINC000735975447 598482536 /nfs/dbraw/zinc/48/25/36/598482536.db2.gz GUBXPDAFBTUVJC-CHWSQXEVSA-N -1 3 354.385 3.804 20 0 FHADHM C[C@H](CC(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1F ZINC000735975447 598482538 /nfs/dbraw/zinc/48/25/38/598482538.db2.gz GUBXPDAFBTUVJC-CHWSQXEVSA-N -1 3 354.385 3.804 20 0 FHADHM Cc1nc(C(C)C)sc1C(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000737468337 598485396 /nfs/dbraw/zinc/48/53/96/598485396.db2.gz WNDJVNOQYZRURO-LLVKDONJSA-N -1 3 357.439 3.673 20 0 FHADHM Cc1nc(C(C)C)sc1C(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000737468337 598485398 /nfs/dbraw/zinc/48/53/98/598485398.db2.gz WNDJVNOQYZRURO-LLVKDONJSA-N -1 3 357.439 3.673 20 0 FHADHM Cc1ccc(OCCC(=O)O[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1C ZINC000737366978 598486268 /nfs/dbraw/zinc/48/62/68/598486268.db2.gz YIGNBAVEGNAZDI-HNNXBMFYSA-N -1 3 366.421 3.557 20 0 FHADHM Cc1ccc(OCCC(=O)O[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1C ZINC000737366978 598486269 /nfs/dbraw/zinc/48/62/69/598486269.db2.gz YIGNBAVEGNAZDI-HNNXBMFYSA-N -1 3 366.421 3.557 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)C=Cc1ccc(Cl)cc1 ZINC000735656148 598487714 /nfs/dbraw/zinc/48/77/14/598487714.db2.gz VSYFKZKSWYILFX-RMKNXTFCSA-N -1 3 370.844 3.729 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)C=Cc1ccc(Cl)cc1 ZINC000735656148 598487716 /nfs/dbraw/zinc/48/77/16/598487716.db2.gz VSYFKZKSWYILFX-RMKNXTFCSA-N -1 3 370.844 3.729 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)C12CC3CC(CC(C3)C1)C2 ZINC000735654849 598487813 /nfs/dbraw/zinc/48/78/13/598487813.db2.gz JUVZEUIKPCPPQY-UHFFFAOYSA-N -1 3 368.485 3.578 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)C12CC3CC(CC(C3)C1)C2 ZINC000735654849 598487815 /nfs/dbraw/zinc/48/78/15/598487815.db2.gz JUVZEUIKPCPPQY-UHFFFAOYSA-N -1 3 368.485 3.578 20 0 FHADHM Cc1ccc2c(CC(=O)O[C@@H](C)c3cccc(-c4nnn[n-]4)c3)coc2c1 ZINC000737372450 598488073 /nfs/dbraw/zinc/48/80/73/598488073.db2.gz YBSRQSUWRIARDV-ZDUSSCGKSA-N -1 3 362.389 3.768 20 0 FHADHM Cc1ccc2c(CC(=O)O[C@@H](C)c3cccc(-c4nn[n-]n4)c3)coc2c1 ZINC000737372450 598488075 /nfs/dbraw/zinc/48/80/75/598488075.db2.gz YBSRQSUWRIARDV-ZDUSSCGKSA-N -1 3 362.389 3.768 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)C[C@H](C)CC(C)C ZINC000736629072 598494642 /nfs/dbraw/zinc/49/46/42/598494642.db2.gz TUIHBWBYPPNEEA-LLVKDONJSA-N -1 3 366.849 3.897 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)C[C@H](C)CC(C)C ZINC000736629072 598494643 /nfs/dbraw/zinc/49/46/43/598494643.db2.gz TUIHBWBYPPNEEA-LLVKDONJSA-N -1 3 366.849 3.897 20 0 FHADHM CCc1ccc([C@H](C)C(=O)Nc2sc(C)c(C)c2-c2nnn[n-]2)cc1 ZINC000736686219 598496817 /nfs/dbraw/zinc/49/68/17/598496817.db2.gz KCPUMNJLSJCSDQ-NSHDSACASA-N -1 3 355.467 3.850 20 0 FHADHM CCc1ccc([C@H](C)C(=O)Nc2sc(C)c(C)c2-c2nn[n-]n2)cc1 ZINC000736686219 598496819 /nfs/dbraw/zinc/49/68/19/598496819.db2.gz KCPUMNJLSJCSDQ-NSHDSACASA-N -1 3 355.467 3.850 20 0 FHADHM CC(C)(C)[C@@H](Cc1ccccc1)OC(=O)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000735590382 598510474 /nfs/dbraw/zinc/51/04/74/598510474.db2.gz YBMCSTTXAYCKHD-GOSISDBHSA-N -1 3 364.449 3.610 20 0 FHADHM CC(C)(C)[C@@H](Cc1ccccc1)OC(=O)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000735590382 598510475 /nfs/dbraw/zinc/51/04/75/598510475.db2.gz YBMCSTTXAYCKHD-GOSISDBHSA-N -1 3 364.449 3.610 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H](C)c2cccc(OC)c2)c1-c1nnn[n-]1 ZINC000736669345 598513767 /nfs/dbraw/zinc/51/37/67/598513767.db2.gz FLUCSFRUZQSWFW-SNVBAGLBSA-N -1 3 371.466 3.550 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H](C)c2cccc(OC)c2)c1-c1nn[n-]n1 ZINC000736669345 598513768 /nfs/dbraw/zinc/51/37/68/598513768.db2.gz FLUCSFRUZQSWFW-SNVBAGLBSA-N -1 3 371.466 3.550 20 0 FHADHM CCCOc1cccc(C(=O)Nc2sc(C)c(CC)c2-c2nnn[n-]2)c1 ZINC000736493121 598515248 /nfs/dbraw/zinc/51/52/48/598515248.db2.gz RYMSLDCYKLVGSF-UHFFFAOYSA-N -1 3 371.466 3.840 20 0 FHADHM CCCOc1cccc(C(=O)Nc2sc(C)c(CC)c2-c2nn[n-]n2)c1 ZINC000736493121 598515249 /nfs/dbraw/zinc/51/52/49/598515249.db2.gz RYMSLDCYKLVGSF-UHFFFAOYSA-N -1 3 371.466 3.840 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H](C)Oc2cccc(C)c2)c1-c1nnn[n-]1 ZINC000736670366 598518627 /nfs/dbraw/zinc/51/86/27/598518627.db2.gz NUXKRSKJILRHCB-NSHDSACASA-N -1 3 371.466 3.513 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H](C)Oc2cccc(C)c2)c1-c1nn[n-]n1 ZINC000736670366 598518628 /nfs/dbraw/zinc/51/86/28/598518628.db2.gz NUXKRSKJILRHCB-NSHDSACASA-N -1 3 371.466 3.513 20 0 FHADHM O=C(CCc1ccc(-c2nnn[n-]2)cc1)O[C@@H]1CCc2ccc(Cl)cc21 ZINC000737854695 598538131 /nfs/dbraw/zinc/53/81/31/598538131.db2.gz UIPCSMPDXKQFKK-QGZVFWFLSA-N -1 3 368.824 3.683 20 0 FHADHM O=C(CCc1ccc(-c2nn[n-]n2)cc1)O[C@@H]1CCc2ccc(Cl)cc21 ZINC000737854695 598538133 /nfs/dbraw/zinc/53/81/33/598538133.db2.gz UIPCSMPDXKQFKK-QGZVFWFLSA-N -1 3 368.824 3.683 20 0 FHADHM CC(C)C(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)c(Cl)c1 ZINC000735693132 598541583 /nfs/dbraw/zinc/54/15/83/598541583.db2.gz WWMBNJABUQVXOA-UHFFFAOYSA-N -1 3 371.828 3.694 20 0 FHADHM CC(C)C(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)c(Cl)c1 ZINC000735693132 598541586 /nfs/dbraw/zinc/54/15/86/598541586.db2.gz WWMBNJABUQVXOA-UHFFFAOYSA-N -1 3 371.828 3.694 20 0 FHADHM C[C@@H](CC(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(F)F)c1ccccc1 ZINC000735974016 598546336 /nfs/dbraw/zinc/54/63/36/598546336.db2.gz DRBNTLXEAJYOQK-NSHDSACASA-N -1 3 373.363 3.600 20 0 FHADHM C[C@@H](CC(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(F)F)c1ccccc1 ZINC000735974016 598546337 /nfs/dbraw/zinc/54/63/37/598546337.db2.gz DRBNTLXEAJYOQK-NSHDSACASA-N -1 3 373.363 3.600 20 0 FHADHM Fc1ccc(-c2nc(COc3ccc(-c4nnn[n-]4)c(F)c3)co2)cc1F ZINC000737649155 598550430 /nfs/dbraw/zinc/55/04/30/598550430.db2.gz DGIMBWGBKWLDTH-UHFFFAOYSA-N -1 3 373.294 3.518 20 0 FHADHM Fc1ccc(-c2nc(COc3ccc(-c4nn[n-]n4)c(F)c3)co2)cc1F ZINC000737649155 598550431 /nfs/dbraw/zinc/55/04/31/598550431.db2.gz DGIMBWGBKWLDTH-UHFFFAOYSA-N -1 3 373.294 3.518 20 0 FHADHM CCOc1ccc(Br)cc1NCc1ccc(-c2nnn[n-]2)cc1 ZINC000736638182 598552375 /nfs/dbraw/zinc/55/23/75/598552375.db2.gz WCRORNBXZDUMNG-UHFFFAOYSA-N -1 3 374.242 3.640 20 0 FHADHM CCOc1ccc(Br)cc1NCc1ccc(-c2nn[n-]n2)cc1 ZINC000736638182 598552377 /nfs/dbraw/zinc/55/23/77/598552377.db2.gz WCRORNBXZDUMNG-UHFFFAOYSA-N -1 3 374.242 3.640 20 0 FHADHM CSC[C@@H](C)C(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)cc1 ZINC000737179122 598553659 /nfs/dbraw/zinc/55/36/59/598553659.db2.gz HSNCNTLNNUQWBX-GFCCVEGCSA-N -1 3 369.450 3.597 20 0 FHADHM CSC[C@@H](C)C(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)cc1 ZINC000737179122 598553660 /nfs/dbraw/zinc/55/36/60/598553660.db2.gz HSNCNTLNNUQWBX-GFCCVEGCSA-N -1 3 369.450 3.597 20 0 FHADHM CCC(CC)NC(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736346238 598565328 /nfs/dbraw/zinc/56/53/28/598565328.db2.gz VVKNBSZZEXIXND-UHFFFAOYSA-N -1 3 366.425 3.969 20 0 FHADHM CCC(CC)NC(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736346238 598565329 /nfs/dbraw/zinc/56/53/29/598565329.db2.gz VVKNBSZZEXIXND-UHFFFAOYSA-N -1 3 366.425 3.969 20 0 FHADHM O=C(Nc1ccccc1-c1nnn[n-]1)[C@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000738192830 598572669 /nfs/dbraw/zinc/57/26/69/598572669.db2.gz XIIBVXKUVUMIHP-RYUDHWBXSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1ccccc1-c1nn[n-]n1)[C@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000738192830 598572670 /nfs/dbraw/zinc/57/26/70/598572670.db2.gz XIIBVXKUVUMIHP-RYUDHWBXSA-N -1 3 374.231 3.916 20 0 FHADHM FC(F)(F)c1cc(NCCCOC2CCCC2)ccc1-c1nnn[n-]1 ZINC000737631030 598579082 /nfs/dbraw/zinc/57/90/82/598579082.db2.gz BQZXHOFWXQSZNV-UHFFFAOYSA-N -1 3 355.364 3.647 20 0 FHADHM FC(F)(F)c1cc(NCCCOC2CCCC2)ccc1-c1nn[n-]n1 ZINC000737631030 598579084 /nfs/dbraw/zinc/57/90/84/598579084.db2.gz BQZXHOFWXQSZNV-UHFFFAOYSA-N -1 3 355.364 3.647 20 0 FHADHM CCc1cccc(CC)c1NC(=S)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000736698597 598580584 /nfs/dbraw/zinc/58/05/84/598580584.db2.gz KAQMZQAHKCBETH-UHFFFAOYSA-N -1 3 370.457 3.940 20 0 FHADHM CCc1cccc(CC)c1NC(=S)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000736698597 598580585 /nfs/dbraw/zinc/58/05/85/598580585.db2.gz KAQMZQAHKCBETH-UHFFFAOYSA-N -1 3 370.457 3.940 20 0 FHADHM CC(C)[C@H](Sc1ccccc1)C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000735736370 598583076 /nfs/dbraw/zinc/58/30/76/598583076.db2.gz SVYPLZRKTVWNJW-INIZCTEOSA-N -1 3 371.441 3.761 20 0 FHADHM CC(C)[C@H](Sc1ccccc1)C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000735736370 598583077 /nfs/dbraw/zinc/58/30/77/598583077.db2.gz SVYPLZRKTVWNJW-INIZCTEOSA-N -1 3 371.441 3.761 20 0 FHADHM CC(C)c1ccc(SCC(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)cc1 ZINC000735928426 598585497 /nfs/dbraw/zinc/58/54/97/598585497.db2.gz MJDFZLHPGFUJIJ-UHFFFAOYSA-N -1 3 371.441 3.860 20 0 FHADHM CC(C)c1ccc(SCC(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)cc1 ZINC000735928426 598585499 /nfs/dbraw/zinc/58/54/99/598585499.db2.gz MJDFZLHPGFUJIJ-UHFFFAOYSA-N -1 3 371.441 3.860 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1N1CCC[C@H]1c1nc2ccccc2s1 ZINC000737641750 598591303 /nfs/dbraw/zinc/59/13/03/598591303.db2.gz XVSPSTUBAWRBJR-HNNXBMFYSA-N -1 3 366.425 3.957 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1N1CCC[C@@H]1c1nc2ccccc2s1 ZINC000737641753 598591733 /nfs/dbraw/zinc/59/17/33/598591733.db2.gz XVSPSTUBAWRBJR-OAHLLOKOSA-N -1 3 366.425 3.957 20 0 FHADHM CC(C)(C)C(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)c(F)c1 ZINC000735588507 598593350 /nfs/dbraw/zinc/59/33/50/598593350.db2.gz DEDGOUOEHYPULU-UHFFFAOYSA-N -1 3 369.400 3.569 20 0 FHADHM CC(C)(C)C(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)c(F)c1 ZINC000735588507 598593352 /nfs/dbraw/zinc/59/33/52/598593352.db2.gz DEDGOUOEHYPULU-UHFFFAOYSA-N -1 3 369.400 3.569 20 0 FHADHM CCOCCOc1ccc(Cl)cc1NCc1ccc(-c2nnn[n-]2)cc1 ZINC000736625026 598603271 /nfs/dbraw/zinc/60/32/71/598603271.db2.gz HSAAKDALSXTIFU-UHFFFAOYSA-N -1 3 373.844 3.548 20 0 FHADHM CCOCCOc1ccc(Cl)cc1NCc1ccc(-c2nn[n-]n2)cc1 ZINC000736625026 598603273 /nfs/dbraw/zinc/60/32/73/598603273.db2.gz HSAAKDALSXTIFU-UHFFFAOYSA-N -1 3 373.844 3.548 20 0 FHADHM Cc1ccc(-c2noc([C@@H](C)Oc3ccc(-c4nn[n-]n4)cc3)n2)cc1F ZINC000737303500 598608317 /nfs/dbraw/zinc/60/83/17/598608317.db2.gz MLRJHZCPXZRGKQ-LLVKDONJSA-N -1 3 366.356 3.504 20 0 FHADHM Clc1ccc(-c2noc(C=Cc3ccccc3-c3nnn[n-]3)n2)cc1 ZINC000737571132 598609074 /nfs/dbraw/zinc/60/90/74/598609074.db2.gz SUIZUZMXIXEPRA-JXMROGBWSA-N -1 3 350.769 3.741 20 0 FHADHM Clc1ccc(-c2noc(C=Cc3ccccc3-c3nn[n-]n3)n2)cc1 ZINC000737571132 598609076 /nfs/dbraw/zinc/60/90/76/598609076.db2.gz SUIZUZMXIXEPRA-JXMROGBWSA-N -1 3 350.769 3.741 20 0 FHADHM Clc1ccccc1Cc1noc(C=Cc2ccccc2-c2nnn[n-]2)n1 ZINC000737585076 598610221 /nfs/dbraw/zinc/61/02/21/598610221.db2.gz YGTLIWBMYFNVHP-KTKRTIGZSA-N -1 3 364.796 3.664 20 0 FHADHM Clc1ccccc1Cc1noc(C=Cc2ccccc2-c2nn[n-]n2)n1 ZINC000737585076 598610222 /nfs/dbraw/zinc/61/02/22/598610222.db2.gz YGTLIWBMYFNVHP-KTKRTIGZSA-N -1 3 364.796 3.664 20 0 FHADHM Cc1ccccc1[C@@H]1CCCN1C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000737424760 598629349 /nfs/dbraw/zinc/62/93/49/598629349.db2.gz WUDCYZGEVVDCQJ-KRWDZBQOSA-N -1 3 366.400 3.683 20 0 FHADHM Cc1ccccc1[C@@H]1CCCN1C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000737424760 598629351 /nfs/dbraw/zinc/62/93/51/598629351.db2.gz WUDCYZGEVVDCQJ-KRWDZBQOSA-N -1 3 366.400 3.683 20 0 FHADHM Cc1ccccc1[C@H]1CCCN1C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000737424761 598629607 /nfs/dbraw/zinc/62/96/07/598629607.db2.gz WUDCYZGEVVDCQJ-QGZVFWFLSA-N -1 3 366.400 3.683 20 0 FHADHM Cc1ccccc1[C@H]1CCCN1C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000737424761 598629609 /nfs/dbraw/zinc/62/96/09/598629609.db2.gz WUDCYZGEVVDCQJ-QGZVFWFLSA-N -1 3 366.400 3.683 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)N1CCC[C@H]1c1ccc(F)cc1 ZINC000738160780 598631440 /nfs/dbraw/zinc/63/14/40/598631440.db2.gz BABPHXSMEULXEO-INIZCTEOSA-N -1 3 370.363 3.514 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)N1CCC[C@H]1c1ccc(F)cc1 ZINC000738160780 598631441 /nfs/dbraw/zinc/63/14/41/598631441.db2.gz BABPHXSMEULXEO-INIZCTEOSA-N -1 3 370.363 3.514 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(N2CCC(COc3ccccc3)CC2)c1 ZINC000737570919 598634601 /nfs/dbraw/zinc/63/46/01/598634601.db2.gz LUBRKWDFSSGDHE-UHFFFAOYSA-N -1 3 369.856 3.816 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(N2CCC(COc3ccccc3)CC2)c1 ZINC000737570919 598634602 /nfs/dbraw/zinc/63/46/02/598634602.db2.gz LUBRKWDFSSGDHE-UHFFFAOYSA-N -1 3 369.856 3.816 20 0 FHADHM CCn1c(COc2ccc(-c3nnn[n-]3)cc2Cl)nc2c1cccc2F ZINC000736713176 598644525 /nfs/dbraw/zinc/64/45/25/598644525.db2.gz GZKBRDNYIGCGBV-UHFFFAOYSA-N -1 3 372.791 3.608 20 0 FHADHM CCn1c(COc2ccc(-c3nn[n-]n3)cc2Cl)nc2c1cccc2F ZINC000736713176 598644527 /nfs/dbraw/zinc/64/45/27/598644527.db2.gz GZKBRDNYIGCGBV-UHFFFAOYSA-N -1 3 372.791 3.608 20 0 FHADHM Fc1ccc(CSc2ccc(C(F)(F)F)cn2)c(-c2nnn[n-]2)c1 ZINC000737651942 598645071 /nfs/dbraw/zinc/64/50/71/598645071.db2.gz ZNKWVIMEVVXVHW-UHFFFAOYSA-N -1 3 355.320 3.712 20 0 FHADHM Fc1ccc(CSc2ccc(C(F)(F)F)cn2)c(-c2nn[n-]n2)c1 ZINC000737651942 598645072 /nfs/dbraw/zinc/64/50/72/598645072.db2.gz ZNKWVIMEVVXVHW-UHFFFAOYSA-N -1 3 355.320 3.712 20 0 FHADHM O=C(Oc1ccc(-c2nnn[n-]2)cc1)C1(Sc2ccccc2)CCCC1 ZINC000738251903 598645833 /nfs/dbraw/zinc/64/58/33/598645833.db2.gz TYLDBGRUWFSBOU-UHFFFAOYSA-N -1 3 366.446 3.877 20 0 FHADHM O=C(Oc1ccc(-c2nn[n-]n2)cc1)C1(Sc2ccccc2)CCCC1 ZINC000738251903 598645834 /nfs/dbraw/zinc/64/58/34/598645834.db2.gz TYLDBGRUWFSBOU-UHFFFAOYSA-N -1 3 366.446 3.877 20 0 FHADHM C[C@@H]1CCC[C@@H](OC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)C1 ZINC000736253327 598645956 /nfs/dbraw/zinc/64/59/56/598645956.db2.gz MXSOKXZLUDUGMI-RHSMWYFYSA-N -1 3 358.442 3.538 20 0 FHADHM C[C@@H]1CCC[C@@H](OC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)C1 ZINC000736253327 598645957 /nfs/dbraw/zinc/64/59/57/598645957.db2.gz MXSOKXZLUDUGMI-RHSMWYFYSA-N -1 3 358.442 3.538 20 0 FHADHM O=C(CSc1ccc(-c2nnn[n-]2)cc1)Oc1cccc2ccccc21 ZINC000737949210 598646881 /nfs/dbraw/zinc/64/68/81/598646881.db2.gz XWLPXKDSFBRZIT-UHFFFAOYSA-N -1 3 362.414 3.718 20 0 FHADHM O=C(CSc1ccc(-c2nn[n-]n2)cc1)Oc1cccc2ccccc21 ZINC000737949210 598646882 /nfs/dbraw/zinc/64/68/82/598646882.db2.gz XWLPXKDSFBRZIT-UHFFFAOYSA-N -1 3 362.414 3.718 20 0 FHADHM CN(C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)c1ccccc1 ZINC000736740575 598648308 /nfs/dbraw/zinc/64/83/08/598648308.db2.gz BPXPMJHVOHNIAV-UHFFFAOYSA-N -1 3 371.400 3.936 20 0 FHADHM CN(C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)c1ccccc1 ZINC000736740575 598648309 /nfs/dbraw/zinc/64/83/09/598648309.db2.gz BPXPMJHVOHNIAV-UHFFFAOYSA-N -1 3 371.400 3.936 20 0 FHADHM CC(C)[C@H](CC(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000736103689 598651968 /nfs/dbraw/zinc/65/19/68/598651968.db2.gz XSQNTEGMOAKYJR-BEFAXECRSA-N -1 3 363.465 3.874 20 0 FHADHM CC(C)[C@H](CC(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000736103689 598651970 /nfs/dbraw/zinc/65/19/70/598651970.db2.gz XSQNTEGMOAKYJR-BEFAXECRSA-N -1 3 363.465 3.874 20 0 FHADHM Cc1cccc(N(C(=O)CSc2ccc(-c3nnn[n-]3)cc2)C(C)C)c1 ZINC000737397578 598658525 /nfs/dbraw/zinc/65/85/25/598658525.db2.gz YHWIZSFYIZUEGG-UHFFFAOYSA-N -1 3 367.478 3.709 20 0 FHADHM Cc1cccc(N(C(=O)CSc2ccc(-c3nn[n-]n3)cc2)C(C)C)c1 ZINC000737397578 598658527 /nfs/dbraw/zinc/65/85/27/598658527.db2.gz YHWIZSFYIZUEGG-UHFFFAOYSA-N -1 3 367.478 3.709 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@@H]1NC(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000735796958 598659600 /nfs/dbraw/zinc/65/96/00/598659600.db2.gz KSKFAIRFKQLAFE-YOEHRIQHSA-N -1 3 373.526 3.680 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@@H]1NC(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000735796958 598659602 /nfs/dbraw/zinc/65/96/02/598659602.db2.gz KSKFAIRFKQLAFE-YOEHRIQHSA-N -1 3 373.526 3.680 20 0 FHADHM CCC[C@H](NC(=O)CSc1ccc(-c2nnn[n-]2)cc1)C1CCCCC1 ZINC000736430489 598660051 /nfs/dbraw/zinc/66/00/51/598660051.db2.gz NVLARHXVCYIIFG-KRWDZBQOSA-N -1 3 373.526 3.824 20 0 FHADHM CCC[C@H](NC(=O)CSc1ccc(-c2nn[n-]n2)cc1)C1CCCCC1 ZINC000736430489 598660052 /nfs/dbraw/zinc/66/00/52/598660052.db2.gz NVLARHXVCYIIFG-KRWDZBQOSA-N -1 3 373.526 3.824 20 0 FHADHM Cc1cccc2sc(C(=O)Nc3ccc(-c4nnn[n-]4)cn3)c(Cl)c21 ZINC000737419371 598660559 /nfs/dbraw/zinc/66/05/59/598660559.db2.gz VUILCLAJLGJVMF-UHFFFAOYSA-N -1 3 370.825 3.691 20 0 FHADHM Cc1cccc2sc(C(=O)Nc3ccc(-c4nn[n-]n4)cn3)c(Cl)c21 ZINC000737419371 598660561 /nfs/dbraw/zinc/66/05/61/598660561.db2.gz VUILCLAJLGJVMF-UHFFFAOYSA-N -1 3 370.825 3.691 20 0 FHADHM Clc1cc(NCCc2ccc3ccccc3n2)ccc1-c1nnn[n-]1 ZINC000737567280 598666792 /nfs/dbraw/zinc/66/67/92/598666792.db2.gz ZHCCKOIRLMDULJ-UHFFFAOYSA-N -1 3 350.813 3.723 20 0 FHADHM Clc1cc(NCCc2ccc3ccccc3n2)ccc1-c1nn[n-]n1 ZINC000737567280 598666794 /nfs/dbraw/zinc/66/67/94/598666794.db2.gz ZHCCKOIRLMDULJ-UHFFFAOYSA-N -1 3 350.813 3.723 20 0 FHADHM Fc1cc(-c2nnn[n-]2)cc(F)c1N1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000737639809 598680420 /nfs/dbraw/zinc/68/04/20/598680420.db2.gz SWJVAXBEZNWTQY-NSHDSACASA-N -1 3 361.783 3.792 20 0 FHADHM Fc1cc(-c2nn[n-]n2)cc(F)c1N1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000737639809 598680422 /nfs/dbraw/zinc/68/04/22/598680422.db2.gz SWJVAXBEZNWTQY-NSHDSACASA-N -1 3 361.783 3.792 20 0 FHADHM CC(=O)c1ccccc1OCCSCc1ccc(F)cc1-c1nnn[n-]1 ZINC000735502708 598694079 /nfs/dbraw/zinc/69/40/79/598694079.db2.gz DGICTQUTJMSPKR-UHFFFAOYSA-N -1 3 372.425 3.521 20 0 FHADHM CC(=O)c1ccccc1OCCSCc1ccc(F)cc1-c1nn[n-]n1 ZINC000735502708 598694081 /nfs/dbraw/zinc/69/40/81/598694081.db2.gz DGICTQUTJMSPKR-UHFFFAOYSA-N -1 3 372.425 3.521 20 0 FHADHM Cc1cc(NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)ccc1F ZINC000737273774 598718295 /nfs/dbraw/zinc/71/82/95/598718295.db2.gz GUKCQPMEVVJNEB-UHFFFAOYSA-N -1 3 368.416 3.757 20 0 FHADHM Cc1cc(NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)ccc1F ZINC000737273774 598718297 /nfs/dbraw/zinc/71/82/97/598718297.db2.gz GUKCQPMEVVJNEB-UHFFFAOYSA-N -1 3 368.416 3.757 20 0 FHADHM CC(C)Oc1cccc(Cn2ccc(-c3ccc(-c4nnn[n-]4)cc3)n2)c1 ZINC000735912617 598722667 /nfs/dbraw/zinc/72/26/67/598722667.db2.gz GORLRYCTKNMVJW-UHFFFAOYSA-N -1 3 360.421 3.566 20 0 FHADHM CC(C)Oc1cccc(Cn2ccc(-c3ccc(-c4nn[n-]n4)cc3)n2)c1 ZINC000735912617 598722669 /nfs/dbraw/zinc/72/26/69/598722669.db2.gz GORLRYCTKNMVJW-UHFFFAOYSA-N -1 3 360.421 3.566 20 0 FHADHM FC(F)(F)c1ccc(Cn2ccc(-c3ccc(-c4nnn[n-]4)cc3)n2)cc1 ZINC000737634917 598723039 /nfs/dbraw/zinc/72/30/39/598723039.db2.gz BIHXDSYQYYIRJF-UHFFFAOYSA-N -1 3 370.338 3.797 20 0 FHADHM FC(F)(F)c1ccc(Cn2ccc(-c3ccc(-c4nn[n-]n4)cc3)n2)cc1 ZINC000737634917 598723041 /nfs/dbraw/zinc/72/30/41/598723041.db2.gz BIHXDSYQYYIRJF-UHFFFAOYSA-N -1 3 370.338 3.797 20 0 FHADHM COc1ccccc1[C@H](C)CC(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000737143742 598727232 /nfs/dbraw/zinc/72/72/32/598727232.db2.gz YZSIJHCKWUBSOI-KGLIPLIRSA-N -1 3 366.421 3.673 20 0 FHADHM COc1ccccc1[C@H](C)CC(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000737143742 598727233 /nfs/dbraw/zinc/72/72/33/598727233.db2.gz YZSIJHCKWUBSOI-KGLIPLIRSA-N -1 3 366.421 3.673 20 0 FHADHM Cc1ccc(C)n1C1CCN(c2ccc(-c3nnn[n-]3)c(Cl)c2)CC1 ZINC000737330816 598747120 /nfs/dbraw/zinc/74/71/20/598747120.db2.gz OASMCRVRGLXLNQ-UHFFFAOYSA-N -1 3 356.861 3.780 20 0 FHADHM Cc1ccc(C)n1C1CCN(c2ccc(-c3nn[n-]n3)c(Cl)c2)CC1 ZINC000737330816 598747122 /nfs/dbraw/zinc/74/71/22/598747122.db2.gz OASMCRVRGLXLNQ-UHFFFAOYSA-N -1 3 356.861 3.780 20 0 FHADHM C[C@@H](Sc1cc(-c2nnn[n-]2)ccn1)c1ccc(Br)cc1 ZINC000736191434 598761935 /nfs/dbraw/zinc/76/19/35/598761935.db2.gz IQUFTNHJNAQQCT-SECBINFHSA-N -1 3 362.256 3.878 20 0 FHADHM C[C@@H](Sc1cc(-c2nn[n-]n2)ccn1)c1ccc(Br)cc1 ZINC000736191434 598761936 /nfs/dbraw/zinc/76/19/36/598761936.db2.gz IQUFTNHJNAQQCT-SECBINFHSA-N -1 3 362.256 3.878 20 0 FHADHM CC(C)(CCCc1ccccc1)C(=O)NCc1ccc(-c2nnn[n-]2)cc1 ZINC000496467093 598789206 /nfs/dbraw/zinc/78/92/06/598789206.db2.gz IDTGRKAQMJRJCT-UHFFFAOYSA-N -1 3 363.465 3.532 20 0 FHADHM CC(C)(CCCc1ccccc1)C(=O)NCc1ccc(-c2nn[n-]n2)cc1 ZINC000496467093 598789207 /nfs/dbraw/zinc/78/92/07/598789207.db2.gz IDTGRKAQMJRJCT-UHFFFAOYSA-N -1 3 363.465 3.532 20 0 FHADHM COc1ccc([C@@H]2CCN(c3ccc(Cl)cc3-c3nnn[n-]3)C2)cc1 ZINC000737077453 598796008 /nfs/dbraw/zinc/79/60/08/598796008.db2.gz UIZJRFACZTVVSK-CYBMUJFWSA-N -1 3 355.829 3.523 20 0 FHADHM COc1ccc([C@@H]2CCN(c3ccc(Cl)cc3-c3nn[n-]n3)C2)cc1 ZINC000737077453 598796009 /nfs/dbraw/zinc/79/60/09/598796009.db2.gz UIZJRFACZTVVSK-CYBMUJFWSA-N -1 3 355.829 3.523 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1coc2ccccc12 ZINC000736480059 598821509 /nfs/dbraw/zinc/82/15/09/598821509.db2.gz JEDVRSRXSQWGSP-UHFFFAOYSA-N -1 3 361.405 3.665 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1coc2ccccc12 ZINC000736480059 598821510 /nfs/dbraw/zinc/82/15/10/598821510.db2.gz JEDVRSRXSQWGSP-UHFFFAOYSA-N -1 3 361.405 3.665 20 0 FHADHM CCC[C@@H](CC1CCCCC1)C(=O)NCc1ccc(-c2nnn[n-]2)cc1 ZINC000499835343 598821639 /nfs/dbraw/zinc/82/16/39/598821639.db2.gz CWETZLFBWMKOCR-SFHVURJKSA-N -1 3 355.486 3.870 20 0 FHADHM CCC[C@@H](CC1CCCCC1)C(=O)NCc1ccc(-c2nn[n-]n2)cc1 ZINC000499835343 598821640 /nfs/dbraw/zinc/82/16/40/598821640.db2.gz CWETZLFBWMKOCR-SFHVURJKSA-N -1 3 355.486 3.870 20 0 FHADHM CC[C@@H](C)NC(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1 ZINC000820875787 599296419 /nfs/dbraw/zinc/29/64/19/599296419.db2.gz FVJNPUNSSJXWMN-LLVKDONJSA-N -1 3 370.388 3.718 20 0 FHADHM CC[C@@H](C)NC(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1 ZINC000820875787 599296421 /nfs/dbraw/zinc/29/64/21/599296421.db2.gz FVJNPUNSSJXWMN-LLVKDONJSA-N -1 3 370.388 3.718 20 0 FHADHM CCCCc1noc([C@H](C)SCc2cc(-c3nnn[n-]3)ccc2OC)n1 ZINC000821082770 607367645 /nfs/dbraw/zinc/36/76/45/607367645.db2.gz NRRNSJMGNYAYOP-NSHDSACASA-N -1 3 374.470 3.595 20 0 FHADHM CCCCc1noc([C@H](C)SCc2cc(-c3nn[n-]n3)ccc2OC)n1 ZINC000821082770 607367647 /nfs/dbraw/zinc/36/76/47/607367647.db2.gz NRRNSJMGNYAYOP-NSHDSACASA-N -1 3 374.470 3.595 20 0 FHADHM CCCCCOc1ccc(C(=O)N(C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000736451641 599304341 /nfs/dbraw/zinc/30/43/41/599304341.db2.gz PNBQJBTZWZXUEK-UHFFFAOYSA-N -1 3 365.437 3.712 20 0 FHADHM CCCCCOc1ccc(C(=O)N(C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000736451641 599304343 /nfs/dbraw/zinc/30/43/43/599304343.db2.gz PNBQJBTZWZXUEK-UHFFFAOYSA-N -1 3 365.437 3.712 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1CNc1ccc2c3c(cccc31)CC2 ZINC000821737270 607369211 /nfs/dbraw/zinc/36/92/11/607369211.db2.gz SSHYZFZXGVRRSJ-UHFFFAOYSA-N -1 3 357.417 3.739 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CNc1ccc2c3c(cccc31)CC2 ZINC000821737270 607369212 /nfs/dbraw/zinc/36/92/12/607369212.db2.gz SSHYZFZXGVRRSJ-UHFFFAOYSA-N -1 3 357.417 3.739 20 0 FHADHM CN(C(=O)c1ccc(-c2ccccc2F)o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736750231 599307961 /nfs/dbraw/zinc/30/79/61/599307961.db2.gz XKMNVUILDXVKGP-UHFFFAOYSA-N -1 3 363.352 3.542 20 0 FHADHM CN(C(=O)c1ccc(-c2ccccc2F)o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736750231 599307964 /nfs/dbraw/zinc/30/79/64/599307964.db2.gz XKMNVUILDXVKGP-UHFFFAOYSA-N -1 3 363.352 3.542 20 0 FHADHM Cc1ccc(SCCC(=O)N(C)c2ccc(-c3nnn[n-]3)cc2)cc1C ZINC000737369392 599308253 /nfs/dbraw/zinc/30/82/53/599308253.db2.gz SNOXBHLPEPVZOE-UHFFFAOYSA-N -1 3 367.478 3.629 20 0 FHADHM Cc1ccc(SCCC(=O)N(C)c2ccc(-c3nn[n-]n3)cc2)cc1C ZINC000737369392 599308256 /nfs/dbraw/zinc/30/82/56/599308256.db2.gz SNOXBHLPEPVZOE-UHFFFAOYSA-N -1 3 367.478 3.629 20 0 FHADHM CCN(C(=O)CSc1ccccc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000736504236 599308884 /nfs/dbraw/zinc/30/88/84/599308884.db2.gz BYYXJSYEAWMNPC-UHFFFAOYSA-N -1 3 373.869 3.665 20 0 FHADHM CCN(C(=O)CSc1ccccc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000736504236 599308888 /nfs/dbraw/zinc/30/88/88/599308888.db2.gz BYYXJSYEAWMNPC-UHFFFAOYSA-N -1 3 373.869 3.665 20 0 FHADHM Clc1cccc(NCCc2nc3ccccc3s2)c1-c1nnn[n-]1 ZINC000822585737 599316354 /nfs/dbraw/zinc/31/63/54/599316354.db2.gz MFJOIDHXSJZBQC-UHFFFAOYSA-N -1 3 356.842 3.784 20 0 FHADHM Clc1cccc(NCCc2nc3ccccc3s2)c1-c1nn[n-]n1 ZINC000822585737 599316357 /nfs/dbraw/zinc/31/63/57/599316357.db2.gz MFJOIDHXSJZBQC-UHFFFAOYSA-N -1 3 356.842 3.784 20 0 FHADHM CCOc1ccc(OCC)c(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736650691 599324024 /nfs/dbraw/zinc/32/40/24/599324024.db2.gz HPKNPTBSNLQWFZ-CYBMUJFWSA-N -1 3 353.426 3.837 20 0 FHADHM CCOc1ccc(OCC)c(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736650691 599324027 /nfs/dbraw/zinc/32/40/27/599324027.db2.gz HPKNPTBSNLQWFZ-CYBMUJFWSA-N -1 3 353.426 3.837 20 0 FHADHM COc1ccccc1OCCS[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000737155061 599326673 /nfs/dbraw/zinc/32/66/73/599326673.db2.gz CQYNXBRTOGGDSI-ZDUSSCGKSA-N -1 3 356.451 3.749 20 0 FHADHM COc1ccccc1OCCS[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000737155061 599326675 /nfs/dbraw/zinc/32/66/75/599326675.db2.gz CQYNXBRTOGGDSI-ZDUSSCGKSA-N -1 3 356.451 3.749 20 0 FHADHM COc1ccc(COCCS[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000737097023 599326705 /nfs/dbraw/zinc/32/67/05/599326705.db2.gz HCHRYKXUQXDHQW-CQSZACIVSA-N -1 3 370.478 3.886 20 0 FHADHM COc1ccc(COCCS[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000737097023 599326707 /nfs/dbraw/zinc/32/67/07/599326707.db2.gz HCHRYKXUQXDHQW-CQSZACIVSA-N -1 3 370.478 3.886 20 0 FHADHM COC(=O)c1cc(CS[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)oc1C ZINC000736950779 599327164 /nfs/dbraw/zinc/32/71/64/599327164.db2.gz NRKQJTGGJOKMDK-NSHDSACASA-N -1 3 358.423 3.549 20 0 FHADHM COC(=O)c1cc(CS[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)oc1C ZINC000736950779 599327166 /nfs/dbraw/zinc/32/71/66/599327166.db2.gz NRKQJTGGJOKMDK-NSHDSACASA-N -1 3 358.423 3.549 20 0 FHADHM Cc1cccc(NC(=O)[C@H](C)S[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737398642 599329378 /nfs/dbraw/zinc/32/93/78/599329378.db2.gz JANGOWSKAHZASS-KGLIPLIRSA-N -1 3 367.478 3.997 20 0 FHADHM Cc1cccc(NC(=O)[C@H](C)S[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737398642 599329381 /nfs/dbraw/zinc/32/93/81/599329381.db2.gz JANGOWSKAHZASS-KGLIPLIRSA-N -1 3 367.478 3.997 20 0 FHADHM Cc1cccc(NC(=O)[C@H](C)Sc2ccccc2-c2nnn[n-]2)c1C ZINC000822324255 599342620 /nfs/dbraw/zinc/34/26/20/599342620.db2.gz YHPLXKIMPPAMQA-ZDUSSCGKSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1cccc(NC(=O)[C@H](C)Sc2ccccc2-c2nn[n-]n2)c1C ZINC000822324255 599342621 /nfs/dbraw/zinc/34/26/21/599342621.db2.gz YHPLXKIMPPAMQA-ZDUSSCGKSA-N -1 3 353.451 3.603 20 0 FHADHM C[C@H](Sc1ccccc1-c1nnn[n-]1)c1nc(Cc2ccccc2)no1 ZINC000820555758 599344529 /nfs/dbraw/zinc/34/45/29/599344529.db2.gz PHLFMRQHYWACQE-LBPRGKRZSA-N -1 3 364.434 3.694 20 0 FHADHM C[C@H](Sc1ccccc1-c1nn[n-]n1)c1nc(Cc2ccccc2)no1 ZINC000820555758 599344531 /nfs/dbraw/zinc/34/45/31/599344531.db2.gz PHLFMRQHYWACQE-LBPRGKRZSA-N -1 3 364.434 3.694 20 0 FHADHM Cc1cc(Cl)ccc1NC(=O)[C@H](C)Sc1ccccc1-c1nnn[n-]1 ZINC000822201974 599348401 /nfs/dbraw/zinc/34/84/01/599348401.db2.gz DXAARMWHLAXRST-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM Cc1cc(Cl)ccc1NC(=O)[C@H](C)Sc1ccccc1-c1nn[n-]n1 ZINC000822201974 599348404 /nfs/dbraw/zinc/34/84/04/599348404.db2.gz DXAARMWHLAXRST-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM CCC[C@@H](NC(=O)CSc1ccccc1-c1nnn[n-]1)c1ccccc1 ZINC000821020621 599349600 /nfs/dbraw/zinc/34/96/00/599349600.db2.gz FYINDPUEIJQYKJ-MRXNPFEDSA-N -1 3 367.478 3.616 20 0 FHADHM CCC[C@@H](NC(=O)CSc1ccccc1-c1nn[n-]n1)c1ccccc1 ZINC000821020621 599349602 /nfs/dbraw/zinc/34/96/02/599349602.db2.gz FYINDPUEIJQYKJ-MRXNPFEDSA-N -1 3 367.478 3.616 20 0 FHADHM CC1CCC(N(C(=O)CSc2ccccc2-c2nnn[n-]2)C2CC2)CC1 ZINC000820689848 599350038 /nfs/dbraw/zinc/35/00/38/599350038.db2.gz CWOWNTNUGIJKDI-UHFFFAOYSA-N -1 3 371.510 3.529 20 0 FHADHM CC1CCC(N(C(=O)CSc2ccccc2-c2nn[n-]n2)C2CC2)CC1 ZINC000820689848 599350041 /nfs/dbraw/zinc/35/00/41/599350041.db2.gz CWOWNTNUGIJKDI-UHFFFAOYSA-N -1 3 371.510 3.529 20 0 FHADHM Cc1ccccc1-c1noc(CSc2ccccc2-c2nnn[n-]2)n1 ZINC000822345945 599350771 /nfs/dbraw/zinc/35/07/71/599350771.db2.gz XDAIVRMDMBJGIN-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM Cc1ccccc1-c1noc(CSc2ccccc2-c2nn[n-]n2)n1 ZINC000822345945 599350774 /nfs/dbraw/zinc/35/07/74/599350774.db2.gz XDAIVRMDMBJGIN-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM CCN(C(=O)Nc1ccccc1C)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736504603 599352200 /nfs/dbraw/zinc/35/22/00/599352200.db2.gz BWZIPCHVFWMPHW-CQSZACIVSA-N -1 3 350.426 3.790 20 0 FHADHM CCN(C(=O)Nc1ccccc1C)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736504603 599352203 /nfs/dbraw/zinc/35/22/03/599352203.db2.gz BWZIPCHVFWMPHW-CQSZACIVSA-N -1 3 350.426 3.790 20 0 FHADHM CCOc1ccc(NCc2cc(-c3nnn[n-]3)ccc2OC)cc1Cl ZINC000821421647 607370790 /nfs/dbraw/zinc/37/07/90/607370790.db2.gz BKWDGVOENSMBRR-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM CCOc1ccc(NCc2cc(-c3nn[n-]n3)ccc2OC)cc1Cl ZINC000821421647 607370791 /nfs/dbraw/zinc/37/07/91/607370791.db2.gz BKWDGVOENSMBRR-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM Clc1ccc(CNc2ccc(Br)cc2-c2nnn[n-]2)cc1 ZINC000737576344 599362230 /nfs/dbraw/zinc/36/22/30/599362230.db2.gz PUMQNDSUOYOJSN-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM Clc1ccc(CNc2ccc(Br)cc2-c2nn[n-]n2)cc1 ZINC000737576344 599362233 /nfs/dbraw/zinc/36/22/33/599362233.db2.gz PUMQNDSUOYOJSN-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM CCOc1ccc(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1OCC ZINC000821422138 599363237 /nfs/dbraw/zinc/36/32/37/599363237.db2.gz PCLZUJMBNPNCRG-CYBMUJFWSA-N -1 3 353.426 3.837 20 0 FHADHM CCOc1ccc(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1OCC ZINC000821422138 599363240 /nfs/dbraw/zinc/36/32/40/599363240.db2.gz PCLZUJMBNPNCRG-CYBMUJFWSA-N -1 3 353.426 3.837 20 0 FHADHM CCOC(=O)N(C)c1ccc(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000821334086 599371526 /nfs/dbraw/zinc/37/15/26/599371526.db2.gz HWWVYXNRIVQMSB-CYBMUJFWSA-N -1 3 366.425 3.633 20 0 FHADHM CCOC(=O)N(C)c1ccc(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000821334086 599371529 /nfs/dbraw/zinc/37/15/29/599371529.db2.gz HWWVYXNRIVQMSB-CYBMUJFWSA-N -1 3 366.425 3.633 20 0 FHADHM CSCCCC(=O)Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000737180737 599372184 /nfs/dbraw/zinc/37/21/84/599372184.db2.gz IEMILYAPTGTSHQ-UHFFFAOYSA-N -1 3 369.450 3.741 20 0 FHADHM CSCCCC(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000737180737 599372187 /nfs/dbraw/zinc/37/21/87/599372187.db2.gz IEMILYAPTGTSHQ-UHFFFAOYSA-N -1 3 369.450 3.741 20 0 FHADHM C[C@H](Nc1cc(-c2nnn[n-]2)c2ccccc2n1)c1ccc(F)c(F)c1 ZINC000736139968 599394453 /nfs/dbraw/zinc/39/44/53/599394453.db2.gz SIKJOLCQMVFSBC-JTQLQIEISA-N -1 3 352.348 3.866 20 0 FHADHM C[C@H](Nc1cc(-c2nn[n-]n2)c2ccccc2n1)c1ccc(F)c(F)c1 ZINC000736139968 599394454 /nfs/dbraw/zinc/39/44/54/599394454.db2.gz SIKJOLCQMVFSBC-JTQLQIEISA-N -1 3 352.348 3.866 20 0 FHADHM CN(Cc1cccc(Cl)c1)c1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000736828121 599395053 /nfs/dbraw/zinc/39/50/53/599395053.db2.gz LBWLQVXCEMQCHB-UHFFFAOYSA-N -1 3 350.813 3.705 20 0 FHADHM CN(Cc1cccc(Cl)c1)c1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000736828121 599395054 /nfs/dbraw/zinc/39/50/54/599395054.db2.gz LBWLQVXCEMQCHB-UHFFFAOYSA-N -1 3 350.813 3.705 20 0 FHADHM CC(C)[C@@H](NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000820356944 599400781 /nfs/dbraw/zinc/40/07/81/599400781.db2.gz CYCTVFUJMRPXDZ-RDTXWAMCSA-N -1 3 364.453 3.624 20 0 FHADHM CC(C)[C@@H](NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000820356944 599400786 /nfs/dbraw/zinc/40/07/86/599400786.db2.gz CYCTVFUJMRPXDZ-RDTXWAMCSA-N -1 3 364.453 3.624 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1CNc1ccccc1SC(C)C ZINC000821736169 607373647 /nfs/dbraw/zinc/37/36/47/607373647.db2.gz DRYMHCMWCFRPHI-UHFFFAOYSA-N -1 3 355.467 3.988 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CNc1ccccc1SC(C)C ZINC000821736169 607373649 /nfs/dbraw/zinc/37/36/49/607373649.db2.gz DRYMHCMWCFRPHI-UHFFFAOYSA-N -1 3 355.467 3.988 20 0 FHADHM CC(C)OCc1ccccc1CNc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000735904435 599404228 /nfs/dbraw/zinc/40/42/28/599404228.db2.gz PPYISQMEJZEAOA-UHFFFAOYSA-N -1 3 374.448 3.952 20 0 FHADHM CC(C)OCc1ccccc1CNc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000735904435 599404229 /nfs/dbraw/zinc/40/42/29/599404229.db2.gz PPYISQMEJZEAOA-UHFFFAOYSA-N -1 3 374.448 3.952 20 0 FHADHM COc1cc(CNc2cc(Cl)ccc2-c2nnn[n-]2)ccc1OC(C)C ZINC000737047690 599406936 /nfs/dbraw/zinc/40/69/36/599406936.db2.gz QCOIBLDYIHEACN-UHFFFAOYSA-N -1 3 373.844 3.928 20 0 FHADHM COc1cc(CNc2cc(Cl)ccc2-c2nn[n-]n2)ccc1OC(C)C ZINC000737047690 599406938 /nfs/dbraw/zinc/40/69/38/599406938.db2.gz QCOIBLDYIHEACN-UHFFFAOYSA-N -1 3 373.844 3.928 20 0 FHADHM CC(C)(NCc1ccc(-c2nnn[n-]2)o1)c1ccc(Cl)c(Cl)c1 ZINC000819988020 599418510 /nfs/dbraw/zinc/41/85/10/599418510.db2.gz QIUFMSHNMOAAAI-UHFFFAOYSA-N -1 3 352.225 3.791 20 0 FHADHM CC(C)CCOc1ccc([C@@H](C)NCc2ccc(-c3nnn[n-]3)o2)cc1 ZINC000820076700 599421452 /nfs/dbraw/zinc/42/14/52/599421452.db2.gz RMDSPOXJVNRHED-CQSZACIVSA-N -1 3 355.442 3.735 20 0 FHADHM Cc1cccc2[nH]cc(CCNc3cc(-c4nnn[n-]4)c4ccccc4n3)c21 ZINC000737408411 599427549 /nfs/dbraw/zinc/42/75/49/599427549.db2.gz LVEVDHUFRBESPL-UHFFFAOYSA-N -1 3 369.432 3.859 20 0 FHADHM Cc1cccc2[nH]cc(CCNc3cc(-c4nn[n-]n4)c4ccccc4n3)c21 ZINC000737408411 599427551 /nfs/dbraw/zinc/42/75/51/599427551.db2.gz LVEVDHUFRBESPL-UHFFFAOYSA-N -1 3 369.432 3.859 20 0 FHADHM CC(C)CC(CC(C)C)NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820055971 599435553 /nfs/dbraw/zinc/43/55/53/599435553.db2.gz MCWIGVWMMKWVFY-CQSZACIVSA-N -1 3 358.490 3.688 20 0 FHADHM CC(C)CC(CC(C)C)NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820055971 599435557 /nfs/dbraw/zinc/43/55/57/599435557.db2.gz MCWIGVWMMKWVFY-CQSZACIVSA-N -1 3 358.490 3.688 20 0 FHADHM CCc1nc([C@@H](C)Nc2cc(-c3nnn[n-]3)c3ccccc3n2)cs1 ZINC000736698067 599436994 /nfs/dbraw/zinc/43/69/94/599436994.db2.gz HWKXZLMFYXJHRB-SNVBAGLBSA-N -1 3 351.439 3.607 20 0 FHADHM CCc1nc([C@@H](C)Nc2cc(-c3nn[n-]n3)c3ccccc3n2)cs1 ZINC000736698067 599436996 /nfs/dbraw/zinc/43/69/96/599436996.db2.gz HWKXZLMFYXJHRB-SNVBAGLBSA-N -1 3 351.439 3.607 20 0 FHADHM S=C(Nc1ccccc1-c1nnn[n-]1)N1CCCCC[C@H]1c1ccco1 ZINC000738407109 599465212 /nfs/dbraw/zinc/46/52/12/599465212.db2.gz FXKGBUVXXSJWRN-HNNXBMFYSA-N -1 3 368.466 3.774 20 0 FHADHM S=C(Nc1ccccc1-c1nn[n-]n1)N1CCCCC[C@H]1c1ccco1 ZINC000738407109 599465213 /nfs/dbraw/zinc/46/52/13/599465213.db2.gz FXKGBUVXXSJWRN-HNNXBMFYSA-N -1 3 368.466 3.774 20 0 FHADHM CO[C@@H](CNc1ccc(-c2nn[n-]n2)cc1C(F)(F)F)c1ccccc1 ZINC000821677125 599469214 /nfs/dbraw/zinc/46/92/14/599469214.db2.gz PEBNOLSWCZXMQI-HNNXBMFYSA-N -1 3 363.343 3.685 20 0 FHADHM Fc1ccc(C[C@H]2CCN(c3cc(-c4nnn[n-]4)c4ccccc4n3)C2)cc1 ZINC000737650606 599473021 /nfs/dbraw/zinc/47/30/21/599473021.db2.gz QBEOMTIQKLBPND-OAHLLOKOSA-N -1 3 374.423 3.623 20 0 FHADHM Fc1ccc(C[C@H]2CCN(c3cc(-c4nn[n-]n4)c4ccccc4n3)C2)cc1 ZINC000737650606 599473023 /nfs/dbraw/zinc/47/30/23/599473023.db2.gz QBEOMTIQKLBPND-OAHLLOKOSA-N -1 3 374.423 3.623 20 0 FHADHM Fc1ccc(C[C@@H]2CCN(c3cc(-c4nnn[n-]4)c4ccccc4n3)C2)cc1 ZINC000737650605 599473156 /nfs/dbraw/zinc/47/31/56/599473156.db2.gz QBEOMTIQKLBPND-HNNXBMFYSA-N -1 3 374.423 3.623 20 0 FHADHM Fc1ccc(C[C@@H]2CCN(c3cc(-c4nn[n-]n4)c4ccccc4n3)C2)cc1 ZINC000737650605 599473158 /nfs/dbraw/zinc/47/31/58/599473158.db2.gz QBEOMTIQKLBPND-HNNXBMFYSA-N -1 3 374.423 3.623 20 0 FHADHM Fc1ccc(NC[C@@H]2CCCO[C@@H]2c2ccccc2)c(-c2nnn[n-]2)c1 ZINC000822778952 599496944 /nfs/dbraw/zinc/49/69/44/599496944.db2.gz PKFHNKLLPGQLGQ-KBXCAEBGSA-N -1 3 353.401 3.586 20 0 FHADHM Fc1ccc(NC[C@@H]2CCCO[C@@H]2c2ccccc2)c(-c2nn[n-]n2)c1 ZINC000822778952 599496946 /nfs/dbraw/zinc/49/69/46/599496946.db2.gz PKFHNKLLPGQLGQ-KBXCAEBGSA-N -1 3 353.401 3.586 20 0 FHADHM CC(C)Sc1ccccc1C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820183797 599498147 /nfs/dbraw/zinc/49/81/47/599498147.db2.gz LQQGHLGTKCEEFZ-CYBMUJFWSA-N -1 3 367.478 3.858 20 0 FHADHM CC(C)Sc1ccccc1C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820183797 599498149 /nfs/dbraw/zinc/49/81/49/599498149.db2.gz LQQGHLGTKCEEFZ-CYBMUJFWSA-N -1 3 367.478 3.858 20 0 FHADHM C[C@H](NC(=O)C(C)(C)c1cccc(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820316035 599498744 /nfs/dbraw/zinc/49/87/44/599498744.db2.gz RJVOIKLXTRAPCC-LBPRGKRZSA-N -1 3 369.856 3.675 20 0 FHADHM C[C@H](NC(=O)C(C)(C)c1cccc(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820316035 599498747 /nfs/dbraw/zinc/49/87/47/599498747.db2.gz RJVOIKLXTRAPCC-LBPRGKRZSA-N -1 3 369.856 3.675 20 0 FHADHM CCCc1sc(C(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1CC ZINC000821143885 599502851 /nfs/dbraw/zinc/50/28/51/599502851.db2.gz ZNIMBOWTZTVYKO-LBPRGKRZSA-N -1 3 369.494 3.934 20 0 FHADHM CCCc1sc(C(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1CC ZINC000821143885 599502855 /nfs/dbraw/zinc/50/28/55/599502855.db2.gz ZNIMBOWTZTVYKO-LBPRGKRZSA-N -1 3 369.494 3.934 20 0 FHADHM Fc1ccc(NCc2ccc(Br)c(F)c2)c(-c2nnn[n-]2)c1 ZINC000822782793 599504093 /nfs/dbraw/zinc/50/40/93/599504093.db2.gz HCGBNXLCZZMTRW-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1ccc(NCc2ccc(Br)c(F)c2)c(-c2nn[n-]n2)c1 ZINC000822782793 599504095 /nfs/dbraw/zinc/50/40/95/599504095.db2.gz HCGBNXLCZZMTRW-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM CCC(CC)(C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000820882405 599509966 /nfs/dbraw/zinc/50/99/66/599509966.db2.gz QXEAOVYDUJWPRO-HNNXBMFYSA-N -1 3 363.465 3.802 20 0 FHADHM CCC(CC)(C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000820882405 599509969 /nfs/dbraw/zinc/50/99/69/599509969.db2.gz QXEAOVYDUJWPRO-HNNXBMFYSA-N -1 3 363.465 3.802 20 0 FHADHM Fc1ccc(NCc2ccc(OC3CCCCC3)nc2)c(-c2nnn[n-]2)c1 ZINC000822782884 599513106 /nfs/dbraw/zinc/51/31/06/599513106.db2.gz KPDJQHNFMFOKCI-UHFFFAOYSA-N -1 3 368.416 3.724 20 0 FHADHM Fc1ccc(NCc2ccc(OC3CCCCC3)nc2)c(-c2nn[n-]n2)c1 ZINC000822782884 599513109 /nfs/dbraw/zinc/51/31/09/599513109.db2.gz KPDJQHNFMFOKCI-UHFFFAOYSA-N -1 3 368.416 3.724 20 0 FHADHM COCc1cccc(CNc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)c1 ZINC000737016399 599521305 /nfs/dbraw/zinc/52/13/05/599521305.db2.gz CWUBTWOJRMERBI-UHFFFAOYSA-N -1 3 363.343 3.644 20 0 FHADHM C[C@@H](SCCC(=O)Nc1ccccc1-c1nnn[n-]1)c1cccs1 ZINC000736188022 599524543 /nfs/dbraw/zinc/52/45/43/599524543.db2.gz GVKPHRONPSMLJF-LLVKDONJSA-N -1 3 359.480 3.751 20 0 FHADHM C[C@@H](SCCC(=O)Nc1ccccc1-c1nn[n-]n1)c1cccs1 ZINC000736188022 599524546 /nfs/dbraw/zinc/52/45/46/599524546.db2.gz GVKPHRONPSMLJF-LLVKDONJSA-N -1 3 359.480 3.751 20 0 FHADHM C[C@H](NC(=O)c1cccc(Cl)c1Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000820397127 599525997 /nfs/dbraw/zinc/52/59/97/599525997.db2.gz MCNIIZCZVJRIEY-VIFPVBQESA-N -1 3 362.220 3.665 20 0 FHADHM C[C@H](NC(=O)c1cccc(Cl)c1Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000820397127 599526000 /nfs/dbraw/zinc/52/60/00/599526000.db2.gz MCNIIZCZVJRIEY-VIFPVBQESA-N -1 3 362.220 3.665 20 0 FHADHM C[C@H](NC(=O)c1cc2cc(Cl)ccc2o1)c1cccc(-c2nnn[n-]2)c1 ZINC000820391095 599526183 /nfs/dbraw/zinc/52/61/83/599526183.db2.gz MZXIJXFOEFVTPN-JTQLQIEISA-N -1 3 367.796 3.757 20 0 FHADHM C[C@H](NC(=O)c1cc2cc(Cl)ccc2o1)c1cccc(-c2nn[n-]n2)c1 ZINC000820391095 599526184 /nfs/dbraw/zinc/52/61/84/599526184.db2.gz MZXIJXFOEFVTPN-JTQLQIEISA-N -1 3 367.796 3.757 20 0 FHADHM Cc1ccccc1[C@@H]1C[C@H](C)N(c2ncc(-c3nnn[n-]3)cc2Cl)C1 ZINC000737420225 599529349 /nfs/dbraw/zinc/52/93/49/599529349.db2.gz DLGCFQUUPFKDEC-GXTWGEPZSA-N -1 3 354.845 3.606 20 0 FHADHM Cc1ccccc1[C@@H]1C[C@H](C)N(c2ncc(-c3nn[n-]n3)cc2Cl)C1 ZINC000737420225 599529350 /nfs/dbraw/zinc/52/93/50/599529350.db2.gz DLGCFQUUPFKDEC-GXTWGEPZSA-N -1 3 354.845 3.606 20 0 FHADHM Cc1noc(C)c1C[C@@H](C)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000737538810 599531417 /nfs/dbraw/zinc/53/14/17/599531417.db2.gz PQDMQQWTQIIFJN-MRVPVSSYSA-N -1 3 366.347 3.533 20 0 FHADHM Cc1noc(C)c1C[C@@H](C)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000737538810 599531419 /nfs/dbraw/zinc/53/14/19/599531419.db2.gz PQDMQQWTQIIFJN-MRVPVSSYSA-N -1 3 366.347 3.533 20 0 FHADHM COc1ccc(C(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c2ccccc12 ZINC000821770030 599534890 /nfs/dbraw/zinc/53/48/90/599534890.db2.gz NQIPYXPMGLXSIV-CYBMUJFWSA-N -1 3 373.416 3.520 20 0 FHADHM COc1ccc(C(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c2ccccc12 ZINC000821770030 599534893 /nfs/dbraw/zinc/53/48/93/599534893.db2.gz NQIPYXPMGLXSIV-CYBMUJFWSA-N -1 3 373.416 3.520 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)CC/C=C/c1ccccc1 ZINC000736638266 599544084 /nfs/dbraw/zinc/54/40/84/599544084.db2.gz ZHEDYFXDRPIHGM-UXBLZVDNSA-N -1 3 363.421 3.698 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)CC/C=C/c1ccccc1 ZINC000736638266 599544086 /nfs/dbraw/zinc/54/40/86/599544086.db2.gz ZHEDYFXDRPIHGM-UXBLZVDNSA-N -1 3 363.421 3.698 20 0 FHADHM Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)C=Cc2ccccc2-c2nnn[n-]2)C1 ZINC000737424413 599548691 /nfs/dbraw/zinc/54/86/91/599548691.db2.gz YDNKULVHMMUJDN-JZDUJLCSSA-N -1 3 373.460 3.593 20 0 FHADHM Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)C=Cc2ccccc2-c2nn[n-]n2)C1 ZINC000737424413 599548693 /nfs/dbraw/zinc/54/86/93/599548693.db2.gz YDNKULVHMMUJDN-JZDUJLCSSA-N -1 3 373.460 3.593 20 0 FHADHM Clc1ccc2ncc(-c3nnn[n-]3)c(N3CC[C@H](c4ccco4)C3)c2c1 ZINC000822581574 599551378 /nfs/dbraw/zinc/55/13/78/599551378.db2.gz KFPKSANTRHYSTA-NSHDSACASA-N -1 3 366.812 3.655 20 0 FHADHM Clc1ccc2ncc(-c3nn[n-]n3)c(N3CC[C@H](c4ccco4)C3)c2c1 ZINC000822581574 599551381 /nfs/dbraw/zinc/55/13/81/599551381.db2.gz KFPKSANTRHYSTA-NSHDSACASA-N -1 3 366.812 3.655 20 0 FHADHM Cc1ccc([C@H]2[C@H](C)CCCN2C(=O)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000737330366 599558727 /nfs/dbraw/zinc/55/87/27/599558727.db2.gz NJJASKYQYZEOOL-DNVCBOLYSA-N -1 3 361.449 3.789 20 0 FHADHM Cc1ccc([C@H]2[C@H](C)CCCN2C(=O)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000737330366 599558730 /nfs/dbraw/zinc/55/87/30/599558730.db2.gz NJJASKYQYZEOOL-DNVCBOLYSA-N -1 3 361.449 3.789 20 0 FHADHM CCC(C)(C)NC(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736312419 599561866 /nfs/dbraw/zinc/56/18/66/599561866.db2.gz CUMGVRLFEKJXAI-UHFFFAOYSA-N -1 3 350.426 3.529 20 0 FHADHM CC[C@H]1CCCN1C(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736403121 599567070 /nfs/dbraw/zinc/56/70/70/599567070.db2.gz SINKQOPAFDZWIQ-SFHVURJKSA-N -1 3 362.437 3.625 20 0 FHADHM c1ccc2c(c1)cccc2-c1nnc(Sc2ccc(-c3nnn[n-]3)cn2)o1 ZINC000823791995 599577570 /nfs/dbraw/zinc/57/75/70/599577570.db2.gz MBNHZBLZLKBZMO-UHFFFAOYSA-N -1 3 373.401 3.616 20 0 FHADHM c1ccc2c(c1)cccc2-c1nnc(Sc2ccc(-c3nn[n-]n3)cn2)o1 ZINC000823791995 599577572 /nfs/dbraw/zinc/57/75/72/599577572.db2.gz MBNHZBLZLKBZMO-UHFFFAOYSA-N -1 3 373.401 3.616 20 0 FHADHM Cc1cccc2c(CCNc3c(F)cc(-c4nnn[n-]4)cc3F)c[nH]c21 ZINC000822331473 599579597 /nfs/dbraw/zinc/57/95/97/599579597.db2.gz GKBUFKAXRFVUPG-UHFFFAOYSA-N -1 3 354.364 3.589 20 0 FHADHM Cc1cccc2c(CCNc3c(F)cc(-c4nn[n-]n4)cc3F)c[nH]c21 ZINC000822331473 599579599 /nfs/dbraw/zinc/57/95/99/599579599.db2.gz GKBUFKAXRFVUPG-UHFFFAOYSA-N -1 3 354.364 3.589 20 0 FHADHM C[C@@]1(C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)CCc2ccccc2C1 ZINC000820578088 599629344 /nfs/dbraw/zinc/62/93/44/599629344.db2.gz XAHARXSFKCAAAP-LJQANCHMSA-N -1 3 367.840 3.654 20 0 FHADHM C[C@@]1(C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)CCc2ccccc2C1 ZINC000820578088 599629345 /nfs/dbraw/zinc/62/93/45/599629345.db2.gz XAHARXSFKCAAAP-LJQANCHMSA-N -1 3 367.840 3.654 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@H](C)CCc2cccc(F)c2)s1 ZINC000821465807 599630622 /nfs/dbraw/zinc/63/06/22/599630622.db2.gz QCJRAKFXENFRFT-LLVKDONJSA-N -1 3 373.457 3.837 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@H](C)CCc2cccc(F)c2)s1 ZINC000821465807 599630623 /nfs/dbraw/zinc/63/06/23/599630623.db2.gz QCJRAKFXENFRFT-LLVKDONJSA-N -1 3 373.457 3.837 20 0 FHADHM O=C(CCC(F)(F)F)Nc1sc2c(c1-c1nnn[n-]1)CCCCCC2 ZINC000822950365 599630860 /nfs/dbraw/zinc/63/08/60/599630860.db2.gz LFXAQRWPHCUXIE-UHFFFAOYSA-N -1 3 373.404 3.868 20 0 FHADHM O=C(CCC(F)(F)F)Nc1sc2c(c1-c1nn[n-]n1)CCCCCC2 ZINC000822950365 599630861 /nfs/dbraw/zinc/63/08/61/599630861.db2.gz LFXAQRWPHCUXIE-UHFFFAOYSA-N -1 3 373.404 3.868 20 0 FHADHM Cc1cccc(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)c1C ZINC000822284589 599632985 /nfs/dbraw/zinc/63/29/85/599632985.db2.gz WBQCJIHRXWFLSS-UHFFFAOYSA-N -1 3 361.327 3.755 20 0 FHADHM Cc1cccc(C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)c1C ZINC000822284589 599632986 /nfs/dbraw/zinc/63/29/86/599632986.db2.gz WBQCJIHRXWFLSS-UHFFFAOYSA-N -1 3 361.327 3.755 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)c1cccc2c1CCC2 ZINC000823303892 599633385 /nfs/dbraw/zinc/63/33/85/599633385.db2.gz XVEBLMVUBDAGOD-UHFFFAOYSA-N -1 3 373.338 3.627 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)c1cccc2c1CCC2 ZINC000823303892 599633386 /nfs/dbraw/zinc/63/33/86/599633386.db2.gz XVEBLMVUBDAGOD-UHFFFAOYSA-N -1 3 373.338 3.627 20 0 FHADHM O=C(CCc1cccs1)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000822983750 599633871 /nfs/dbraw/zinc/63/38/71/599633871.db2.gz TXZISIFAQROKDH-UHFFFAOYSA-N -1 3 367.356 3.518 20 0 FHADHM O=C(CCc1cccs1)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000822983750 599633872 /nfs/dbraw/zinc/63/38/72/599633872.db2.gz TXZISIFAQROKDH-UHFFFAOYSA-N -1 3 367.356 3.518 20 0 FHADHM Cc1cccc(NC(=O)CSCc2ccc(-c3nnn[n-]3)cc2)c1Cl ZINC000822324024 599656217 /nfs/dbraw/zinc/65/62/17/599656217.db2.gz SGDPTCBMVSJCGQ-UHFFFAOYSA-N -1 3 373.869 3.700 20 0 FHADHM Cc1cccc(NC(=O)CSCc2ccc(-c3nn[n-]n3)cc2)c1Cl ZINC000822324024 599656218 /nfs/dbraw/zinc/65/62/18/599656218.db2.gz SGDPTCBMVSJCGQ-UHFFFAOYSA-N -1 3 373.869 3.700 20 0 FHADHM Cc1ncccc1NC(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000822476956 599657330 /nfs/dbraw/zinc/65/73/30/599657330.db2.gz BGQMKLHWJZXWME-UHFFFAOYSA-N -1 3 371.404 3.566 20 0 FHADHM CSc1ccc(F)cc1CNc1c(F)cc(-c2nnn[n-]2)cc1F ZINC000821984337 599686883 /nfs/dbraw/zinc/68/68/83/599686883.db2.gz NEQRMJDHKOBQLV-UHFFFAOYSA-N -1 3 351.357 3.618 20 0 FHADHM CSc1ccc(F)cc1CNc1c(F)cc(-c2nn[n-]n2)cc1F ZINC000821984337 599686884 /nfs/dbraw/zinc/68/68/84/599686884.db2.gz NEQRMJDHKOBQLV-UHFFFAOYSA-N -1 3 351.357 3.618 20 0 FHADHM C[C@@H](Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1cccc(-n2cccn2)c1 ZINC000820457202 599687269 /nfs/dbraw/zinc/68/72/69/599687269.db2.gz YXALAKZYBCQZRH-GFCCVEGCSA-N -1 3 365.828 3.879 20 0 FHADHM C[C@@H](Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1cccc(-n2cccn2)c1 ZINC000820457202 599687270 /nfs/dbraw/zinc/68/72/70/599687270.db2.gz YXALAKZYBCQZRH-GFCCVEGCSA-N -1 3 365.828 3.879 20 0 FHADHM S=C(Nc1cccc(-c2nnn[n-]2)c1)Nc1cc(Cl)cc(Cl)c1 ZINC000823732409 599692008 /nfs/dbraw/zinc/69/20/08/599692008.db2.gz MEAJPWHMCMXAAU-UHFFFAOYSA-N -1 3 365.249 3.982 20 0 FHADHM S=C(Nc1cccc(-c2nn[n-]n2)c1)Nc1cc(Cl)cc(Cl)c1 ZINC000823732409 599692009 /nfs/dbraw/zinc/69/20/09/599692009.db2.gz MEAJPWHMCMXAAU-UHFFFAOYSA-N -1 3 365.249 3.982 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)Nc1cccc(F)c1C ZINC000821105161 599693290 /nfs/dbraw/zinc/69/32/90/599693290.db2.gz WTMIXRMVYPILRC-UHFFFAOYSA-N -1 3 368.416 3.758 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)Nc1cccc(F)c1C ZINC000821105161 599693291 /nfs/dbraw/zinc/69/32/91/599693291.db2.gz WTMIXRMVYPILRC-UHFFFAOYSA-N -1 3 368.416 3.758 20 0 FHADHM COc1ccc(CN(C)[C@H](C(=O)[O-])c2ccc(F)cc2)cc1OC(F)F ZINC000579132406 599710347 /nfs/dbraw/zinc/71/03/47/599710347.db2.gz CTJCBAYWICKNKU-INIZCTEOSA-N -1 3 369.339 3.693 20 0 FHADHM Cc1[nH]c(C(=O)[C@H](C)N2CC[C@H](c3ccccc3C)C2)c(C)c1C(=O)[O-] ZINC000738768676 599717989 /nfs/dbraw/zinc/71/79/89/599717989.db2.gz MSTHZEQGOZJWOK-HOTGVXAUSA-N -1 3 354.450 3.699 20 0 FHADHM COc1ccc(CN[C@@H](C(=O)[O-])c2ccc(Br)cc2)cc1F ZINC000426799684 599790135 /nfs/dbraw/zinc/79/01/35/599790135.db2.gz JFISCSFFTAKSAM-OAHLLOKOSA-N -1 3 368.202 3.512 20 0 FHADHM COc1ccc(CN[C@@H](C(=O)[O-])c2ccccc2C(F)(F)F)cc1F ZINC000738008123 599791598 /nfs/dbraw/zinc/79/15/98/599791598.db2.gz DXSSWEDGLDGWCW-OAHLLOKOSA-N -1 3 357.303 3.769 20 0 FHADHM Cc1ccc(C(=O)[O-])cc1NC(=O)CN[C@H](c1ccc(F)cc1)C1CCC1 ZINC000738532984 599793248 /nfs/dbraw/zinc/79/32/48/599793248.db2.gz QLZSAVYJXALCHU-FQEVSTJZSA-N -1 3 370.424 3.902 20 0 FHADHM CC(C)Cc1ccc(CCC(=O)Nc2sccc2-c2nnn[n-]2)cc1 ZINC000824280278 607782941 /nfs/dbraw/zinc/78/29/41/607782941.db2.gz IGPDFMFKUQBQMN-UHFFFAOYSA-N -1 3 355.467 3.698 20 0 FHADHM CC(C)Cc1ccc(CCC(=O)Nc2sccc2-c2nn[n-]n2)cc1 ZINC000824280278 607782942 /nfs/dbraw/zinc/78/29/42/607782942.db2.gz IGPDFMFKUQBQMN-UHFFFAOYSA-N -1 3 355.467 3.698 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Oc1cccc(Oc2ccccn2)c1 ZINC000826252643 607397557 /nfs/dbraw/zinc/39/75/57/607397557.db2.gz MELKKPAGWFDDPC-UHFFFAOYSA-N -1 3 373.372 3.582 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Oc1cccc(Oc2ccccn2)c1 ZINC000826252643 607397558 /nfs/dbraw/zinc/39/75/58/607397558.db2.gz 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ZINC000826234462 607420467 /nfs/dbraw/zinc/42/04/67/607420467.db2.gz XRIXZVMWYOKABZ-UHFFFAOYSA-N -1 3 373.416 3.649 20 0 FHADHM Cc1c2cccc(C)c2oc1C(=O)NC1(c2cccc(-c3nn[n-]n3)c2)CC1 ZINC000826234462 607420469 /nfs/dbraw/zinc/42/04/69/607420469.db2.gz XRIXZVMWYOKABZ-UHFFFAOYSA-N -1 3 373.416 3.649 20 0 FHADHM CC[C@](NCc1cccc(C(=O)NCC(C)C)c1)(C(=O)[O-])c1ccccc1 ZINC000736920336 600129520 /nfs/dbraw/zinc/12/95/20/600129520.db2.gz LCDNPYXOLKYCSN-JOCHJYFZSA-N -1 3 368.477 3.552 20 0 FHADHM O=C([O-])C1(NCc2csc(COc3ccc(F)cc3)n2)CCCCC1 ZINC000739519119 600150842 /nfs/dbraw/zinc/15/08/42/600150842.db2.gz DRFRFQRZAUJBDH-UHFFFAOYSA-N -1 3 364.442 3.738 20 0 FHADHM CN(Cc1cccc(C(=O)N2CCCCC2)c1)[C@@H](C(=O)[O-])c1ccccc1 ZINC000737487946 600214075 /nfs/dbraw/zinc/21/40/75/600214075.db2.gz UKRIXULGIJYHIZ-HXUWFJFHSA-N -1 3 366.461 3.570 20 0 FHADHM CC(C)(C)[C@H]1CCCN(CC(=O)NCc2ccc(NC(=O)[O-])cc2)CC1 ZINC000736252424 600216649 /nfs/dbraw/zinc/21/66/49/600216649.db2.gz PNPIVPHSZKPKJM-INIZCTEOSA-N -1 3 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C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cccc(NC(=O)[O-])c1 ZINC000736813629 603259387 /nfs/dbraw/zinc/25/93/87/603259387.db2.gz FOSHXZQRBSAJLI-MRXNPFEDSA-N -1 3 367.449 3.513 20 0 FHADHM Fc1cccc(CN(Cc2ccncc2)Cc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000826376419 607643941 /nfs/dbraw/zinc/64/39/41/607643941.db2.gz DBUNJYGSVWRYNM-UHFFFAOYSA-N -1 3 374.423 3.603 20 0 FHADHM COc1ccc(OCc2nc(-c3cccc(-c4nnn[n-]4)c3)cs2)cc1 ZINC000826211718 607644374 /nfs/dbraw/zinc/64/43/74/607644374.db2.gz QZRNIZWBBMAJMO-UHFFFAOYSA-N -1 3 365.418 3.578 20 0 FHADHM COc1ccc(OCc2nc(-c3cccc(-c4nn[n-]n4)c3)cs2)cc1 ZINC000826211718 607644377 /nfs/dbraw/zinc/64/43/77/607644377.db2.gz QZRNIZWBBMAJMO-UHFFFAOYSA-N -1 3 365.418 3.578 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N[C@@H](C)c1ccc2ccccc2c1 ZINC000826246769 607649612 /nfs/dbraw/zinc/64/96/12/607649612.db2.gz KVRBZLRLJSRISJ-AWEZNQCLSA-N -1 3 357.417 3.819 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N[C@@H](C)c1ccc2ccccc2c1 ZINC000826246769 607649614 /nfs/dbraw/zinc/64/96/14/607649614.db2.gz KVRBZLRLJSRISJ-AWEZNQCLSA-N -1 3 357.417 3.819 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N(C)[C@@H](C)c1cccc(Cl)c1 ZINC000826243697 607660205 /nfs/dbraw/zinc/66/02/05/607660205.db2.gz RTXKFLULAHJQCS-LBPRGKRZSA-N -1 3 355.829 3.662 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N(C)[C@@H](C)c1cccc(Cl)c1 ZINC000826243697 607660207 /nfs/dbraw/zinc/66/02/07/607660207.db2.gz RTXKFLULAHJQCS-LBPRGKRZSA-N -1 3 355.829 3.662 20 0 FHADHM CCCOc1ccc(NC(=O)c2ccc(-c3nnn[n-]3)cc2C)c(C)c1 ZINC000825339153 607668114 /nfs/dbraw/zinc/66/81/14/607668114.db2.gz PAAGWJAZHQVROB-UHFFFAOYSA-N -1 3 351.410 3.525 20 0 FHADHM CCCOc1ccc(NC(=O)c2ccc(-c3nn[n-]n3)cc2C)c(C)c1 ZINC000825339153 607668116 /nfs/dbraw/zinc/66/81/16/607668116.db2.gz PAAGWJAZHQVROB-UHFFFAOYSA-N -1 3 351.410 3.525 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N[C@H](CC(C)C)c1cccs1 ZINC000826247289 607668934 /nfs/dbraw/zinc/66/89/34/607668934.db2.gz YOXMLMMOAVGDOD-OAHLLOKOSA-N -1 3 355.467 3.754 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N[C@H](CC(C)C)c1cccs1 ZINC000826247289 607668936 /nfs/dbraw/zinc/66/89/36/607668936.db2.gz YOXMLMMOAVGDOD-OAHLLOKOSA-N -1 3 355.467 3.754 20 0 FHADHM C[C@H](NC(=O)[O-])[C@@H]1CCCN(Cc2ccccc2Oc2cccnc2)C1 ZINC000825272462 604257795 /nfs/dbraw/zinc/25/77/95/604257795.db2.gz LDPKCKGCPBTHCW-JKSUJKDBSA-N -1 3 355.438 3.742 20 0 FHADHM Cc1cc([C@@H](C)N2CCCN(Cc3ccc(F)cc3)CC2)oc1C(=O)[O-] ZINC000832870335 604382670 /nfs/dbraw/zinc/38/26/70/604382670.db2.gz HAZJQANVCZFLNH-OAHLLOKOSA-N -1 3 360.429 3.694 20 0 FHADHM COc1ccc([C@@H]2CCCN2Cc2ccc(O[C@@H](C)C(=O)[O-])cc2)cc1 ZINC000833731681 604515724 /nfs/dbraw/zinc/51/57/24/604515724.db2.gz BVEDUSOZCKJNIZ-YWZLYKJASA-N -1 3 355.434 3.884 20 0 FHADHM C[C@H](Oc1ccc(CN2CC=C(c3ccc(F)cc3)CC2)cc1)C(=O)[O-] ZINC000833542411 604523447 /nfs/dbraw/zinc/52/34/47/604523447.db2.gz RDNXNGLCWYXVPK-HNNXBMFYSA-N -1 3 355.409 3.967 20 0 FHADHM CN(C(=O)Nc1cc(C(=O)[O-])cs1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000830499706 604526417 /nfs/dbraw/zinc/52/64/17/604526417.db2.gz AYQLTZFPLVRKII-MRXNPFEDSA-N -1 3 373.478 3.575 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1cc(Cl)ccc1NC1CC1 ZINC000826250386 607698645 /nfs/dbraw/zinc/69/86/45/607698645.db2.gz YLCHJBMDGYXZKS-UHFFFAOYSA-N -1 3 368.828 3.655 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1cc(Cl)ccc1NC1CC1 ZINC000826250386 607698647 /nfs/dbraw/zinc/69/86/47/607698647.db2.gz YLCHJBMDGYXZKS-UHFFFAOYSA-N -1 3 368.828 3.655 20 0 FHADHM CCc1oc(C(=O)[O-])cc1CN1CCC(OCc2ccccc2F)CC1 ZINC000833679185 604576766 /nfs/dbraw/zinc/57/67/66/604576766.db2.gz VSDJBYSTAKLWGO-UHFFFAOYSA-N -1 3 361.413 3.861 20 0 FHADHM C[C@H](Oc1ccc(CN2CCC[C@H](Oc3ccccc3)C2)cc1)C(=O)[O-] ZINC000833537967 604586928 /nfs/dbraw/zinc/58/69/28/604586928.db2.gz AHKQNHFMZNSZMV-JXFKEZNVSA-N -1 3 355.434 3.582 20 0 FHADHM C[C@H](Oc1ccc(CN(Cc2ccccc2)C[C@H]2CCCO2)cc1)C(=O)[O-] ZINC000833538203 604607799 /nfs/dbraw/zinc/60/77/99/604607799.db2.gz RRJJRXCSOVFHII-LAUBAEHRSA-N -1 3 369.461 3.720 20 0 FHADHM C[C@@H](c1ccccc1)N(Cc1ccccc1)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC000824773070 607709983 /nfs/dbraw/zinc/70/99/83/607709983.db2.gz YBXIUBNQCKOOQA-HNNXBMFYSA-N -1 3 372.432 3.598 20 0 FHADHM C[C@@H](c1ccccc1)N(Cc1ccccc1)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC000824773070 607709984 /nfs/dbraw/zinc/70/99/84/607709984.db2.gz YBXIUBNQCKOOQA-HNNXBMFYSA-N -1 3 372.432 3.598 20 0 FHADHM CC(C)(C(=O)[O-])[C@@H]1CCCN(CCOc2ccccc2Br)C1 ZINC000652498722 604952729 /nfs/dbraw/zinc/95/27/29/604952729.db2.gz QYKWVZFDAAUUTB-CYBMUJFWSA-N -1 3 370.287 3.651 20 0 FHADHM CC(C)C[C@H](NC(=O)CN1CCC[C@H](C(C)(C)C(=O)[O-])C1)c1ccccc1 ZINC000833478870 604953530 /nfs/dbraw/zinc/95/35/30/604953530.db2.gz VUUISUDNWPNZNU-OALUTQOASA-N -1 3 374.525 3.713 20 0 FHADHM Cc1nc(-c2ccc([C@H](C)N[C@@H](C(=O)[O-])c3cccnc3)cc2)cs1 ZINC000832990625 604973863 /nfs/dbraw/zinc/97/38/63/604973863.db2.gz HICWMDOMNAKJBU-KPZWWZAWSA-N -1 3 353.447 3.990 20 0 FHADHM Clc1cc(N2CCS[C@@H](c3ccccc3)C2)ccc1-c1nnn[n-]1 ZINC000826350540 607728232 /nfs/dbraw/zinc/72/82/32/607728232.db2.gz AODWDTZNCZOJCL-MRXNPFEDSA-N -1 3 357.870 3.815 20 0 FHADHM Clc1cc(N2CCS[C@@H](c3ccccc3)C2)ccc1-c1nn[n-]n1 ZINC000826350540 607728234 /nfs/dbraw/zinc/72/82/34/607728234.db2.gz AODWDTZNCZOJCL-MRXNPFEDSA-N -1 3 357.870 3.815 20 0 FHADHM C[C@]1(NCc2nc3cc(C(F)(F)F)ccc3o2)CCCC[C@@H]1C(=O)[O-] ZINC000833569855 605059931 /nfs/dbraw/zinc/05/99/31/605059931.db2.gz PQLTYSVJFZKZGO-BZNIZROVSA-N -1 3 356.344 3.970 20 0 FHADHM C[C@@H](NC(=O)[O-])c1ccc(CN[C@@H](C)c2ccc3c(c2)CCC(=O)N3)cc1 ZINC000825503882 605118888 /nfs/dbraw/zinc/11/88/88/605118888.db2.gz YZOADYTUJNMOMP-UONOGXRCSA-N -1 3 367.449 3.751 20 0 FHADHM COc1ccc([C@@H](C)NCc2ccc([C@@H](C)NC(=O)[O-])cc2)cc1OC ZINC000829301306 605120023 /nfs/dbraw/zinc/12/00/23/605120023.db2.gz BNEDLAQMJZSUOK-ZIAGYGMSSA-N -1 3 358.438 3.883 20 0 FHADHM CC(C)COC1CCN([C@@H](C(=O)[O-])c2cccc(Br)c2)CC1 ZINC000579133089 605202050 /nfs/dbraw/zinc/20/20/50/605202050.db2.gz VFSCTGJSHMANPD-MRXNPFEDSA-N -1 3 370.287 3.712 20 0 FHADHM C[C@@H]1CC(C)(C)C[C@](CO)(NCc2coc(-c3ccc(C(=O)[O-])cc3)n2)C1 ZINC000833588674 605214670 /nfs/dbraw/zinc/21/46/70/605214670.db2.gz ITTHVPHXURKRNB-SPLOXXLWSA-N -1 3 372.465 3.707 20 0 FHADHM COc1ccc2c(c1)CCC[C@H]2N[C@@H](C)c1ccc(CNC(=O)[O-])nc1C ZINC000833890367 605596894 /nfs/dbraw/zinc/59/68/94/605596894.db2.gz LBCKCICGJVBCPW-VBKZILBWSA-N -1 3 369.465 3.894 20 0 FHADHM C[C@@H](NC(=O)[O-])[C@@H]1CCCN(Cc2ccccc2OCc2ccccn2)C1 ZINC000833812045 605600262 /nfs/dbraw/zinc/60/02/62/605600262.db2.gz GRTQWKIDVZLETO-IAGOWNOFSA-N -1 3 369.465 3.529 20 0 FHADHM C[C@@H](NC(=O)[O-])[C@H]1CCCN(Cc2ccccc2OCc2ccccn2)C1 ZINC000833812049 605600497 /nfs/dbraw/zinc/60/04/97/605600497.db2.gz GRTQWKIDVZLETO-SJORKVTESA-N -1 3 369.465 3.529 20 0 FHADHM Cc1cc(C(=O)N(c2ccccc2)C2CCN(C)CC2)ccc1NC(=O)[O-] ZINC000829920312 605625935 /nfs/dbraw/zinc/62/59/35/605625935.db2.gz YHEMXHVTRYGWEB-UHFFFAOYSA-N -1 3 367.449 3.826 20 0 FHADHM Cc1cc(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)ccc1NC(=O)[O-] ZINC000829940014 605637615 /nfs/dbraw/zinc/63/76/15/605637615.db2.gz JESGIQOTXDUQGR-CRAIPNDOSA-N -1 3 367.449 3.650 20 0 FHADHM C[C@@H](NC(=O)Nc1cccc2ccsc21)c1cccc(-c2nnn[n-]2)c1 ZINC000824507048 607767730 /nfs/dbraw/zinc/76/77/30/607767730.db2.gz SLBFGGFZASIZMV-LLVKDONJSA-N -1 3 364.434 3.964 20 0 FHADHM C[C@@H](NC(=O)Nc1cccc2ccsc21)c1cccc(-c2nn[n-]n2)c1 ZINC000824507048 607767731 /nfs/dbraw/zinc/76/77/31/607767731.db2.gz SLBFGGFZASIZMV-LLVKDONJSA-N -1 3 364.434 3.964 20 0 FHADHM O=C(Nc1nc(-c2cccc(-c3nnn[n-]3)c2)cs1)C1CCCCC1 ZINC000826459452 607769979 /nfs/dbraw/zinc/76/99/79/607769979.db2.gz KJTJIVXPYHJSST-UHFFFAOYSA-N -1 3 354.439 3.509 20 0 FHADHM O=C(Nc1nc(-c2cccc(-c3nn[n-]n3)c2)cs1)C1CCCCC1 ZINC000826459452 607769980 /nfs/dbraw/zinc/76/99/80/607769980.db2.gz KJTJIVXPYHJSST-UHFFFAOYSA-N -1 3 354.439 3.509 20 0 FHADHM O=C([O-])N[C@@H]1C[C@@H](NCc2ccnc(N3CCCCC3)c2)c2ccccc21 ZINC000834156481 605791729 /nfs/dbraw/zinc/79/17/29/605791729.db2.gz APWGTYWWDSOXSP-RTBURBONSA-N -1 3 366.465 3.615 20 0 FHADHM c1ccc(C2CCN(c3nc4ccccc4cc3-c3nnn[n-]3)CC2)cc1 ZINC000823779881 606037346 /nfs/dbraw/zinc/03/73/46/606037346.db2.gz KFDZNBIUKUVHLW-UHFFFAOYSA-N -1 3 356.433 3.799 20 0 FHADHM c1ccc(C2CCN(c3nc4ccccc4cc3-c3nn[n-]n3)CC2)cc1 ZINC000823779881 606037352 /nfs/dbraw/zinc/03/73/52/606037352.db2.gz KFDZNBIUKUVHLW-UHFFFAOYSA-N -1 3 356.433 3.799 20 0 FHADHM Cc1nc(-c2ccccc2)sc1[C@@H](C)Nc1ccc(-c2nnn[n-]2)nc1 ZINC000822424136 606054625 /nfs/dbraw/zinc/05/46/25/606054625.db2.gz RZGOBWQIEVAZFQ-LLVKDONJSA-N -1 3 363.450 3.867 20 0 FHADHM Cc1nc(-c2ccccc2)sc1[C@@H](C)Nc1ccc(-c2nn[n-]n2)nc1 ZINC000822424136 606054631 /nfs/dbraw/zinc/05/46/31/606054631.db2.gz RZGOBWQIEVAZFQ-LLVKDONJSA-N -1 3 363.450 3.867 20 0 FHADHM Cc1noc(C)c1N(C)Cc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000822523017 606098049 /nfs/dbraw/zinc/09/80/49/606098049.db2.gz NYGAHLKVWAMAIQ-UHFFFAOYSA-N -1 3 360.421 3.775 20 0 FHADHM Cc1noc(C)c1N(C)Cc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000822523017 606098052 /nfs/dbraw/zinc/09/80/52/606098052.db2.gz NYGAHLKVWAMAIQ-UHFFFAOYSA-N -1 3 360.421 3.775 20 0 FHADHM C[C@H](NC(=O)[C@H](C)c1ccc(Cl)s1)c1cccc(-c2nnn[n-]2)c1 ZINC000820314450 606116937 /nfs/dbraw/zinc/11/69/37/606116937.db2.gz IZYFNWSMWCFLEU-ZJUUUORDSA-N -1 3 361.858 3.563 20 0 FHADHM C[C@H](NC(=O)[C@H](C)c1ccc(Cl)s1)c1cccc(-c2nn[n-]n2)c1 ZINC000820314450 606116938 /nfs/dbraw/zinc/11/69/38/606116938.db2.gz IZYFNWSMWCFLEU-ZJUUUORDSA-N -1 3 361.858 3.563 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)Nc1sc(C)c(C)c1-c1nnn[n-]1 ZINC000819773889 606121749 /nfs/dbraw/zinc/12/17/49/606121749.db2.gz WUAQBNPIMIMTDU-HJWRWDBZSA-N -1 3 357.414 3.726 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)Nc1sc(C)c(C)c1-c1nn[n-]n1 ZINC000819773889 606121750 /nfs/dbraw/zinc/12/17/50/606121750.db2.gz WUAQBNPIMIMTDU-HJWRWDBZSA-N -1 3 357.414 3.726 20 0 FHADHM C[C@@H](C(=O)Nc1nc(-c2ccc(-c3nnn[n-]3)cc2)cs1)C1CCCC1 ZINC000819877062 606121862 /nfs/dbraw/zinc/12/18/62/606121862.db2.gz NWRCZSWYJSSZRI-LLVKDONJSA-N -1 3 368.466 3.755 20 0 FHADHM C[C@@H](C(=O)Nc1nc(-c2ccc(-c3nn[n-]n3)cc2)cs1)C1CCCC1 ZINC000819877062 606121864 /nfs/dbraw/zinc/12/18/64/606121864.db2.gz NWRCZSWYJSSZRI-LLVKDONJSA-N -1 3 368.466 3.755 20 0 FHADHM C[C@H](OC(=O)C/C=C/c1cccc(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488795 606127473 /nfs/dbraw/zinc/12/74/73/606127473.db2.gz UJLOWUGEEFCKGP-LQPUYASZSA-N -1 3 352.369 3.714 20 0 FHADHM C[C@H](OC(=O)C/C=C/c1cccc(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488795 606127475 /nfs/dbraw/zinc/12/74/75/606127475.db2.gz UJLOWUGEEFCKGP-LQPUYASZSA-N -1 3 352.369 3.714 20 0 FHADHM O=C(Nc1sc2c(c1-c1nnn[n-]1)CCCCC2)[C@H]1CC12CCCC2 ZINC000823387705 606147283 /nfs/dbraw/zinc/14/72/83/606147283.db2.gz VFSBJXUOSPIHHS-GFCCVEGCSA-N -1 3 357.483 3.716 20 0 FHADHM O=C(Nc1sc2c(c1-c1nn[n-]n1)CCCCC2)[C@H]1CC12CCCC2 ZINC000823387705 606147285 /nfs/dbraw/zinc/14/72/85/606147285.db2.gz VFSBJXUOSPIHHS-GFCCVEGCSA-N -1 3 357.483 3.716 20 0 FHADHM C[C@H](C(=O)OCc1ccc(F)cc1-c1nnn[n-]1)c1ccc(Cl)s1 ZINC000819884640 606149808 /nfs/dbraw/zinc/14/98/08/606149808.db2.gz YEBRPIMDSHEFIU-QMMMGPOBSA-N -1 3 366.805 3.568 20 0 FHADHM C[C@H](C(=O)OCc1ccc(F)cc1-c1nn[n-]n1)c1ccc(Cl)s1 ZINC000819884640 606149810 /nfs/dbraw/zinc/14/98/10/606149810.db2.gz YEBRPIMDSHEFIU-QMMMGPOBSA-N -1 3 366.805 3.568 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000819773540 606176922 /nfs/dbraw/zinc/17/69/22/606176922.db2.gz TYPSIKVKZSNCGO-KXXVWKPMSA-N -1 3 352.369 3.714 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000819773540 606176923 /nfs/dbraw/zinc/17/69/23/606176923.db2.gz TYPSIKVKZSNCGO-KXXVWKPMSA-N -1 3 352.369 3.714 20 0 FHADHM CC[C@@H](Oc1cccc(C)c1)C(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820939467 606179969 /nfs/dbraw/zinc/17/99/69/606179969.db2.gz VCHNBEPVFHLQDD-RDTXWAMCSA-N -1 3 366.421 3.637 20 0 FHADHM CC[C@@H](Oc1cccc(C)c1)C(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820939467 606179970 /nfs/dbraw/zinc/17/99/70/606179970.db2.gz VCHNBEPVFHLQDD-RDTXWAMCSA-N -1 3 366.421 3.637 20 0 FHADHM CC(C)(C)n1ncc2c1CCC[C@@H]2Nc1c(F)cc(-c2nnn[n-]2)cc1F ZINC000819975803 606223736 /nfs/dbraw/zinc/22/37/36/606223736.db2.gz DFPGPYAKSXVIBH-AWEZNQCLSA-N -1 3 373.411 3.586 20 0 FHADHM CC(C)(C)n1ncc2c1CCC[C@@H]2Nc1c(F)cc(-c2nn[n-]n2)cc1F ZINC000819975803 606223737 /nfs/dbraw/zinc/22/37/37/606223737.db2.gz DFPGPYAKSXVIBH-AWEZNQCLSA-N -1 3 373.411 3.586 20 0 FHADHM C[C@H](NC(=O)c1ccc(Sc2ccccc2-c2nnn[n-]2)cc1)C1CC1 ZINC000820396850 606247691 /nfs/dbraw/zinc/24/76/91/606247691.db2.gz IRBAWYCREKPKFM-LBPRGKRZSA-N -1 3 365.462 3.546 20 0 FHADHM C[C@H](NC(=O)c1ccc(Sc2ccccc2-c2nn[n-]n2)cc1)C1CC1 ZINC000820396850 606247694 /nfs/dbraw/zinc/24/76/94/606247694.db2.gz IRBAWYCREKPKFM-LBPRGKRZSA-N -1 3 365.462 3.546 20 0 FHADHM COc1cccc(C(C)=CC(=O)O[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000821859994 606260242 /nfs/dbraw/zinc/26/02/42/606260242.db2.gz VOWUCKNRJJZFEY-YBEMTRGBSA-N -1 3 364.405 3.583 20 0 FHADHM COc1cccc(C(C)=CC(=O)O[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000821859994 606260243 /nfs/dbraw/zinc/26/02/43/606260243.db2.gz VOWUCKNRJJZFEY-YBEMTRGBSA-N -1 3 364.405 3.583 20 0 FHADHM CCCCc1ccc(CC(=O)Nc2ccc(F)cc2-c2nnn[n-]2)cc1 ZINC000821077367 606264286 /nfs/dbraw/zinc/26/42/86/606264286.db2.gz CJUODNDXBQJSAG-UHFFFAOYSA-N -1 3 353.401 3.530 20 0 FHADHM CCCCc1ccc(CC(=O)Nc2ccc(F)cc2-c2nn[n-]n2)cc1 ZINC000821077367 606264288 /nfs/dbraw/zinc/26/42/88/606264288.db2.gz CJUODNDXBQJSAG-UHFFFAOYSA-N -1 3 353.401 3.530 20 0 FHADHM CC(C)c1ccc(SCC(=O)Nc2ccc(F)cc2-c2nnn[n-]2)cc1 ZINC000820192428 606271874 /nfs/dbraw/zinc/27/18/74/606271874.db2.gz NPCIZLNMNCDUDL-UHFFFAOYSA-N -1 3 371.441 3.860 20 0 FHADHM CC(C)c1ccc(SCC(=O)Nc2ccc(F)cc2-c2nn[n-]n2)cc1 ZINC000820192428 606271876 /nfs/dbraw/zinc/27/18/76/606271876.db2.gz NPCIZLNMNCDUDL-UHFFFAOYSA-N -1 3 371.441 3.860 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)[C@@H]1C[C@@H]1c1cccc2ccccc21 ZINC000823343719 606272367 /nfs/dbraw/zinc/27/23/67/606272367.db2.gz FHLWDRFBQUGKMU-IAGOWNOFSA-N -1 3 373.391 3.901 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)[C@@H]1C[C@@H]1c1cccc2ccccc21 ZINC000823343719 606272369 /nfs/dbraw/zinc/27/23/69/606272369.db2.gz FHLWDRFBQUGKMU-IAGOWNOFSA-N -1 3 373.391 3.901 20 0 FHADHM CC[C@@H](CC(=O)Nc1ccc(F)cc1-c1nnn[n-]1)c1ccc(C)cc1 ZINC000820882646 606273982 /nfs/dbraw/zinc/27/39/82/606273982.db2.gz WPSUANXUZUQEHV-ZDUSSCGKSA-N -1 3 353.401 3.837 20 0 FHADHM CC[C@@H](CC(=O)Nc1ccc(F)cc1-c1nn[n-]n1)c1ccc(C)cc1 ZINC000820882646 606273983 /nfs/dbraw/zinc/27/39/83/606273983.db2.gz WPSUANXUZUQEHV-ZDUSSCGKSA-N -1 3 353.401 3.837 20 0 FHADHM O=C(Nc1cccc(CSC2CCCC2)c1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC000823363820 606279764 /nfs/dbraw/zinc/27/97/64/606279764.db2.gz OTDVMKLUTMDRTF-UHFFFAOYSA-N -1 3 368.466 3.623 20 0 FHADHM O=C(Nc1cccc(CSC2CCCC2)c1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC000823363820 606279765 /nfs/dbraw/zinc/27/97/65/606279765.db2.gz OTDVMKLUTMDRTF-UHFFFAOYSA-N -1 3 368.466 3.623 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@H](C)c1cccc(F)c1 ZINC000821119376 606281541 /nfs/dbraw/zinc/28/15/41/606281541.db2.gz YFXSNLACXLLTCS-GFCCVEGCSA-N -1 3 368.416 3.570 20 0 FHADHM Cc1cccc(Oc2ccccc2NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)c1 ZINC000822333114 606312845 /nfs/dbraw/zinc/31/28/45/606312845.db2.gz WZHHSBKGZNYQCU-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM Cc1cccc(Oc2ccccc2NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)c1 ZINC000822333114 606312846 /nfs/dbraw/zinc/31/28/46/606312846.db2.gz WZHHSBKGZNYQCU-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM C[C@H](OC(=O)[C@@H]1C[C@H]1c1c(F)cccc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000820487737 606342245 /nfs/dbraw/zinc/34/22/45/606342245.db2.gz IHCCIPJRVYCWNL-ZLKJLUDKSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@@H]1C[C@H]1c1c(F)cccc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000820487737 606342247 /nfs/dbraw/zinc/34/22/47/606342247.db2.gz IHCCIPJRVYCWNL-ZLKJLUDKSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@H]1C[C@H]1c1c(F)cccc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000820487735 606342409 /nfs/dbraw/zinc/34/24/09/606342409.db2.gz IHCCIPJRVYCWNL-GDLCADMTSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@H]1C[C@H]1c1c(F)cccc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000820487735 606342411 /nfs/dbraw/zinc/34/24/11/606342411.db2.gz IHCCIPJRVYCWNL-GDLCADMTSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)C12CC3CC(CC(C3)C1)C2)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488113 606345834 /nfs/dbraw/zinc/34/58/34/606345834.db2.gz LFNLJPLAFOFWFV-PGBBXINNSA-N -1 3 352.438 3.687 20 0 FHADHM C[C@H](OC(=O)C12CC3CC(CC(C3)C1)C2)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488113 606345836 /nfs/dbraw/zinc/34/58/36/606345836.db2.gz LFNLJPLAFOFWFV-PGBBXINNSA-N -1 3 352.438 3.687 20 0 FHADHM C[C@H](OC(=O)[C@@H](C)c1cccc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820481730 606346972 /nfs/dbraw/zinc/34/69/72/606346972.db2.gz ZGGDHHWVKXFKQF-RYUDHWBXSA-N -1 3 356.813 3.928 20 0 FHADHM C[C@H](OC(=O)[C@@H](C)c1cccc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820481730 606346974 /nfs/dbraw/zinc/34/69/74/606346974.db2.gz ZGGDHHWVKXFKQF-RYUDHWBXSA-N -1 3 356.813 3.928 20 0 FHADHM CC(C)[C@@H](c1ccccc1)N(C)C(=O)Nc1ccc(F)cc1-c1nnn[n-]1 ZINC000820033925 606354067 /nfs/dbraw/zinc/35/40/67/606354067.db2.gz ZRAAAJAAKBNZGL-KRWDZBQOSA-N -1 3 368.416 3.867 20 0 FHADHM CC(C)[C@@H](c1ccccc1)N(C)C(=O)Nc1ccc(F)cc1-c1nn[n-]n1 ZINC000820033925 606354068 /nfs/dbraw/zinc/35/40/68/606354068.db2.gz ZRAAAJAAKBNZGL-KRWDZBQOSA-N -1 3 368.416 3.867 20 0 FHADHM CCOc1ccccc1CCC(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821430992 606355002 /nfs/dbraw/zinc/35/50/02/606355002.db2.gz JONRXWSJKCRFAN-CQSZACIVSA-N -1 3 366.421 3.502 20 0 FHADHM CCOc1ccccc1CCC(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821430992 606355003 /nfs/dbraw/zinc/35/50/03/606355003.db2.gz JONRXWSJKCRFAN-CQSZACIVSA-N -1 3 366.421 3.502 20 0 FHADHM C[C@@H](OC(=O)CCOc1ccc(Cl)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820497449 606355679 /nfs/dbraw/zinc/35/56/79/606355679.db2.gz RSTFKGIHOLZVPQ-GFCCVEGCSA-N -1 3 372.812 3.593 20 0 FHADHM C[C@@H](OC(=O)CCOc1ccc(Cl)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820497449 606355681 /nfs/dbraw/zinc/35/56/81/606355681.db2.gz RSTFKGIHOLZVPQ-GFCCVEGCSA-N -1 3 372.812 3.593 20 0 FHADHM C[C@@H](OC(=O)Cc1ccc(-n2cccc2)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820495956 606357753 /nfs/dbraw/zinc/35/77/53/606357753.db2.gz KPMDYGVXJQLKHQ-OAHLLOKOSA-N -1 3 373.416 3.504 20 0 FHADHM C[C@@H](OC(=O)Cc1ccc(-n2cccc2)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820495956 606357755 /nfs/dbraw/zinc/35/77/55/606357755.db2.gz KPMDYGVXJQLKHQ-OAHLLOKOSA-N -1 3 373.416 3.504 20 0 FHADHM O=C(Oc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1)C1CCCC1 ZINC000823454722 606360582 /nfs/dbraw/zinc/36/05/82/606360582.db2.gz RZJVQNOYNMLASX-UHFFFAOYSA-N -1 3 350.378 3.755 20 0 FHADHM O=C(Oc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1)C1CCCC1 ZINC000823454722 606360583 /nfs/dbraw/zinc/36/05/83/606360583.db2.gz RZJVQNOYNMLASX-UHFFFAOYSA-N -1 3 350.378 3.755 20 0 FHADHM Cc1ccc(C(=O)Oc2ccc(Oc3ccc(-c4nnn[n-]4)cc3)cc2)cn1 ZINC000822227707 606361067 /nfs/dbraw/zinc/36/10/67/606361067.db2.gz SNFGLGUWRQEZDC-UHFFFAOYSA-N -1 3 373.372 3.582 20 0 FHADHM Cc1ccc(C(=O)Oc2ccc(Oc3ccc(-c4nn[n-]n4)cc3)cc2)cn1 ZINC000822227707 606361069 /nfs/dbraw/zinc/36/10/69/606361069.db2.gz SNFGLGUWRQEZDC-UHFFFAOYSA-N -1 3 373.372 3.582 20 0 FHADHM C[C@H](OC(=O)CCn1ccc2ccccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000820496107 606397469 /nfs/dbraw/zinc/39/74/69/606397469.db2.gz LPFINBYHJOUWRE-AWEZNQCLSA-N -1 3 361.405 3.516 20 0 FHADHM C[C@H](OC(=O)CCn1ccc2ccccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000820496107 606397471 /nfs/dbraw/zinc/39/74/71/606397471.db2.gz LPFINBYHJOUWRE-AWEZNQCLSA-N -1 3 361.405 3.516 20 0 FHADHM Fc1ccc(NCc2ccc(Br)c(F)c2)cc1-c1nnn[n-]1 ZINC000822748010 606405079 /nfs/dbraw/zinc/40/50/79/606405079.db2.gz CKBHDJONQZCREN-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1ccc(NCc2ccc(Br)c(F)c2)cc1-c1nn[n-]n1 ZINC000822748010 606405080 /nfs/dbraw/zinc/40/50/80/606405080.db2.gz CKBHDJONQZCREN-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1ccc(N2CCC[C@H](c3nc4ccccc4o3)C2)c(-c2nnn[n-]2)c1 ZINC000822779717 606452634 /nfs/dbraw/zinc/45/26/34/606452634.db2.gz ZVIOAYHXCOPNIR-LBPRGKRZSA-N -1 3 364.384 3.531 20 0 FHADHM Fc1ccc(N2CCC[C@H](c3nc4ccccc4o3)C2)c(-c2nn[n-]n2)c1 ZINC000822779717 606452635 /nfs/dbraw/zinc/45/26/35/606452635.db2.gz ZVIOAYHXCOPNIR-LBPRGKRZSA-N -1 3 364.384 3.531 20 0 FHADHM COc1c(Cl)cc(NCc2cccc(-c3nnn[n-]3)c2)cc1Cl ZINC000821698784 606455307 /nfs/dbraw/zinc/45/53/07/606455307.db2.gz YSALUKSFKWDVLP-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM COc1c(Cl)cc(NCc2cccc(-c3nn[n-]n3)c2)cc1Cl ZINC000821698784 606455309 /nfs/dbraw/zinc/45/53/09/606455309.db2.gz YSALUKSFKWDVLP-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM FC(F)(F)c1cc(N2CCC[C@H]2c2ccccn2)ccc1-c1nnn[n-]1 ZINC000822723449 606459685 /nfs/dbraw/zinc/45/96/85/606459685.db2.gz FLZNWQXNMLKMSJ-HNNXBMFYSA-N -1 3 360.343 3.622 20 0 FHADHM FC(F)(F)c1cc(N2CCC[C@H]2c2ccccn2)ccc1-c1nn[n-]n1 ZINC000822723449 606459686 /nfs/dbraw/zinc/45/96/86/606459686.db2.gz FLZNWQXNMLKMSJ-HNNXBMFYSA-N -1 3 360.343 3.622 20 0 FHADHM O=C(OCc1ccc(Cl)c(Cl)c1)c1cc(-c2nnn[n-]2)cs1 ZINC000823421546 606463906 /nfs/dbraw/zinc/46/39/06/606463906.db2.gz BYHXAIQEMHSXTQ-UHFFFAOYSA-N -1 3 355.206 3.592 20 0 FHADHM O=C(OCc1ccc(Cl)c(Cl)c1)c1cc(-c2nn[n-]n2)cs1 ZINC000823421546 606463908 /nfs/dbraw/zinc/46/39/08/606463908.db2.gz BYHXAIQEMHSXTQ-UHFFFAOYSA-N -1 3 355.206 3.592 20 0 FHADHM Cc1cnc([C@@H](Nc2cc(-c3nnn[n-]3)c3ccccc3n2)C2CC2)s1 ZINC000822389279 606469104 /nfs/dbraw/zinc/46/91/04/606469104.db2.gz QTUPUVOIVBCRHN-INIZCTEOSA-N -1 3 363.450 3.743 20 0 FHADHM Cc1cnc([C@@H](Nc2cc(-c3nn[n-]n3)c3ccccc3n2)C2CC2)s1 ZINC000822389279 606469107 /nfs/dbraw/zinc/46/91/07/606469107.db2.gz QTUPUVOIVBCRHN-INIZCTEOSA-N -1 3 363.450 3.743 20 0 FHADHM S=C(Nc1ccccc1-c1nnn[n-]1)N(CC1CCC1)c1ccccc1 ZINC000823733542 606473107 /nfs/dbraw/zinc/47/31/07/606473107.db2.gz YHXAQEGTUBTUPP-UHFFFAOYSA-N -1 3 364.478 3.870 20 0 FHADHM S=C(Nc1ccccc1-c1nn[n-]n1)N(CC1CCC1)c1ccccc1 ZINC000823733542 606473109 /nfs/dbraw/zinc/47/31/09/606473109.db2.gz YHXAQEGTUBTUPP-UHFFFAOYSA-N -1 3 364.478 3.870 20 0 FHADHM Cc1ccc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCCC3)c(F)c1 ZINC000822227225 606489224 /nfs/dbraw/zinc/48/92/24/606489224.db2.gz ABVUVIQDEXKZJT-UHFFFAOYSA-N -1 3 371.441 3.897 20 0 FHADHM Cc1ccc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCCC3)c(F)c1 ZINC000822227225 606489226 /nfs/dbraw/zinc/48/92/26/606489226.db2.gz ABVUVIQDEXKZJT-UHFFFAOYSA-N -1 3 371.441 3.897 20 0 FHADHM O=C(c1cc(-c2nnn[n-]2)cs1)N(Cc1ccccc1)C1CCCCC1 ZINC000823465823 606496418 /nfs/dbraw/zinc/49/64/18/606496418.db2.gz ASCOOAUKBVGAJG-UHFFFAOYSA-N -1 3 367.478 3.903 20 0 FHADHM O=C(c1cc(-c2nn[n-]n2)cs1)N(Cc1ccccc1)C1CCCCC1 ZINC000823465823 606496420 /nfs/dbraw/zinc/49/64/20/606496420.db2.gz ASCOOAUKBVGAJG-UHFFFAOYSA-N -1 3 367.478 3.903 20 0 FHADHM CCC[C@H]1CCc2nc(NC(=O)c3cc(-c4nnn[n-]4)cs3)sc2C1 ZINC000821039565 606499981 /nfs/dbraw/zinc/49/99/81/606499981.db2.gz DPTYJQJLBASGTF-VIFPVBQESA-N -1 3 374.495 3.542 20 0 FHADHM CCC[C@H]1CCc2nc(NC(=O)c3cc(-c4nn[n-]n4)cs3)sc2C1 ZINC000821039565 606499983 /nfs/dbraw/zinc/49/99/83/606499983.db2.gz DPTYJQJLBASGTF-VIFPVBQESA-N -1 3 374.495 3.542 20 0 FHADHM CCC[C@@H]1CCc2nc(NC(=O)c3cc(-c4nnn[n-]4)cs3)sc2C1 ZINC000821039564 606500609 /nfs/dbraw/zinc/50/06/09/606500609.db2.gz DPTYJQJLBASGTF-SECBINFHSA-N -1 3 374.495 3.542 20 0 FHADHM CCC[C@@H]1CCc2nc(NC(=O)c3cc(-c4nn[n-]n4)cs3)sc2C1 ZINC000821039564 606500610 /nfs/dbraw/zinc/50/06/10/606500610.db2.gz DPTYJQJLBASGTF-SECBINFHSA-N -1 3 374.495 3.542 20 0 FHADHM CC(C)[C@H](C(=O)NCc1ccc(-c2nnn[n-]2)cc1)c1cccc(Cl)c1 ZINC000487234506 606502927 /nfs/dbraw/zinc/50/29/27/606502927.db2.gz IPXLMWJECQIJOF-KRWDZBQOSA-N -1 3 369.856 3.576 20 0 FHADHM CC(C)[C@H](C(=O)NCc1ccc(-c2nn[n-]n2)cc1)c1cccc(Cl)c1 ZINC000487234506 606502928 /nfs/dbraw/zinc/50/29/28/606502928.db2.gz IPXLMWJECQIJOF-KRWDZBQOSA-N -1 3 369.856 3.576 20 0 FHADHM CC(C)Oc1c(Cl)cccc1NC(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000820147091 606513804 /nfs/dbraw/zinc/51/38/04/606513804.db2.gz ZNZOBWABCONORG-UHFFFAOYSA-N -1 3 363.830 3.621 20 0 FHADHM CC(C)Oc1c(Cl)cccc1NC(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000820147091 606513806 /nfs/dbraw/zinc/51/38/06/606513806.db2.gz ZNZOBWABCONORG-UHFFFAOYSA-N -1 3 363.830 3.621 20 0 FHADHM O=C(c1cc(-c2nnn[n-]2)cs1)N1CC=C(c2ccc(Cl)cc2)CC1 ZINC000823466195 606548243 /nfs/dbraw/zinc/54/82/43/606548243.db2.gz GEIFXBNCBGZJAU-UHFFFAOYSA-N -1 3 371.853 3.511 20 0 FHADHM O=C(c1cc(-c2nn[n-]n2)cs1)N1CC=C(c2ccc(Cl)cc2)CC1 ZINC000823466195 606548245 /nfs/dbraw/zinc/54/82/45/606548245.db2.gz GEIFXBNCBGZJAU-UHFFFAOYSA-N -1 3 371.853 3.511 20 0 FHADHM C[C@@H](NC(=O)Cc1cccc(-c2nnn[n-]2)c1)c1csc2ccccc21 ZINC000820335587 606553055 /nfs/dbraw/zinc/55/30/55/606553055.db2.gz ZZLRKZRVAHBACM-GFCCVEGCSA-N -1 3 363.446 3.501 20 0 FHADHM C[C@@H](NC(=O)Cc1cccc(-c2nn[n-]n2)c1)c1csc2ccccc21 ZINC000820335587 606553057 /nfs/dbraw/zinc/55/30/57/606553057.db2.gz ZZLRKZRVAHBACM-GFCCVEGCSA-N -1 3 363.446 3.501 20 0 FHADHM CC1(CNC(=O)Nc2ccc(Oc3ccccc3-c3nnn[n-]3)cc2)CC1 ZINC000820618350 606574266 /nfs/dbraw/zinc/57/42/66/606574266.db2.gz ADGFUWUACXBMCQ-UHFFFAOYSA-N -1 3 364.409 3.581 20 0 FHADHM CC1(CNC(=O)Nc2ccc(Oc3ccccc3-c3nn[n-]n3)cc2)CC1 ZINC000820618350 606574268 /nfs/dbraw/zinc/57/42/68/606574268.db2.gz ADGFUWUACXBMCQ-UHFFFAOYSA-N -1 3 364.409 3.581 20 0 FHADHM CCc1ccc(CC)c(NC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000821482920 606577441 /nfs/dbraw/zinc/57/74/41/606577441.db2.gz WLXYURSECRBYQL-CYBMUJFWSA-N -1 3 364.453 3.874 20 0 FHADHM CCc1ccc(CC)c(NC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000821482920 606577442 /nfs/dbraw/zinc/57/74/42/606577442.db2.gz WLXYURSECRBYQL-CYBMUJFWSA-N -1 3 364.453 3.874 20 0 FHADHM CC1CC(NC(=O)c2ccc(Sc3ccccc3-c3nnn[n-]3)cc2)C1 ZINC000820656552 606577522 /nfs/dbraw/zinc/57/75/22/606577522.db2.gz GDEHGWSMNJAIRX-UHFFFAOYSA-N -1 3 365.462 3.546 20 0 FHADHM CC1CC(NC(=O)c2ccc(Sc3ccccc3-c3nn[n-]n3)cc2)C1 ZINC000820656552 606577524 /nfs/dbraw/zinc/57/75/24/606577524.db2.gz GDEHGWSMNJAIRX-UHFFFAOYSA-N -1 3 365.462 3.546 20 0 FHADHM FC(F)Oc1cc(-c2nnn[n-]2)ccc1CSC1=Nc2ccccc2C1 ZINC000822731980 606591553 /nfs/dbraw/zinc/59/15/53/606591553.db2.gz HCCZCFARULSTHH-UHFFFAOYSA-N -1 3 373.388 3.988 20 0 FHADHM FC(F)Oc1cc(-c2nn[n-]n2)ccc1CSC1=Nc2ccccc2C1 ZINC000822731980 606591554 /nfs/dbraw/zinc/59/15/54/606591554.db2.gz HCCZCFARULSTHH-UHFFFAOYSA-N -1 3 373.388 3.988 20 0 FHADHM COc1cccc([C@@H](C)CC(=O)O[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000821860029 606604640 /nfs/dbraw/zinc/60/46/40/606604640.db2.gz WLAHILMVHOEPAD-KBPBESRZSA-N -1 3 366.421 3.673 20 0 FHADHM COc1cccc([C@@H](C)CC(=O)O[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000821860029 606604641 /nfs/dbraw/zinc/60/46/41/606604641.db2.gz WLAHILMVHOEPAD-KBPBESRZSA-N -1 3 366.421 3.673 20 0 FHADHM O=C(Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)C1CC(F)(F)C1 ZINC000823368388 606621185 /nfs/dbraw/zinc/62/11/85/606621185.db2.gz VWAVYLZQZQOEMJ-UHFFFAOYSA-N -1 3 371.347 3.643 20 0 FHADHM O=C(Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)C1CC(F)(F)C1 ZINC000823368388 606621186 /nfs/dbraw/zinc/62/11/86/606621186.db2.gz VWAVYLZQZQOEMJ-UHFFFAOYSA-N -1 3 371.347 3.643 20 0 FHADHM Cc1ccc(/C=C/CC(=O)Nc2sc3c(c2-c2nnn[n-]2)CCC3)cc1 ZINC000822233948 606621267 /nfs/dbraw/zinc/62/12/67/606621267.db2.gz YMGGRYBTCANQSB-DUXPYHPUSA-N -1 3 365.462 3.767 20 0 FHADHM Cc1ccc(/C=C/CC(=O)Nc2sc3c(c2-c2nn[n-]n2)CCC3)cc1 ZINC000822233948 606621268 /nfs/dbraw/zinc/62/12/68/606621268.db2.gz YMGGRYBTCANQSB-DUXPYHPUSA-N -1 3 365.462 3.767 20 0 FHADHM C[C@@H](NC(=O)[C@H](C)c1ccc(Cl)s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820315575 606625709 /nfs/dbraw/zinc/62/57/09/606625709.db2.gz OMKCREZDWKVRDM-NXEZZACHSA-N -1 3 361.858 3.563 20 0 FHADHM C[C@@H](NC(=O)[C@H](C)c1ccc(Cl)s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820315575 606625710 /nfs/dbraw/zinc/62/57/10/606625710.db2.gz OMKCREZDWKVRDM-NXEZZACHSA-N -1 3 361.858 3.563 20 0 FHADHM CC[C@H](C)Oc1ccc(C(=O)N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000820875749 606626549 /nfs/dbraw/zinc/62/65/49/606626549.db2.gz DVZXBJXHFCFLPG-KBPBESRZSA-N -1 3 365.437 3.535 20 0 FHADHM CC[C@H](C)Oc1ccc(C(=O)N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000820875749 606626551 /nfs/dbraw/zinc/62/65/51/606626551.db2.gz DVZXBJXHFCFLPG-KBPBESRZSA-N -1 3 365.437 3.535 20 0 FHADHM CC[C@H](C)N(Cc1ccccc1)C(=O)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000820876242 606666020 /nfs/dbraw/zinc/66/60/20/606666020.db2.gz ONYFHTJINKIXBM-LBPRGKRZSA-N -1 3 371.391 3.586 20 0 FHADHM CC[C@H](C)N(Cc1ccccc1)C(=O)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000820876242 606666021 /nfs/dbraw/zinc/66/60/21/606666021.db2.gz ONYFHTJINKIXBM-LBPRGKRZSA-N -1 3 371.391 3.586 20 0 FHADHM Cc1ccccc1[C@H](NC(=O)c1c(F)cc(-c2nnn[n-]2)cc1F)C(C)C ZINC000822350169 606679396 /nfs/dbraw/zinc/67/93/96/606679396.db2.gz AWEPVCAFADGNSY-QGZVFWFLSA-N -1 3 371.391 3.580 20 0 FHADHM Cc1ccccc1[C@H](NC(=O)c1c(F)cc(-c2nn[n-]n2)cc1F)C(C)C ZINC000822350169 606679397 /nfs/dbraw/zinc/67/93/97/606679397.db2.gz AWEPVCAFADGNSY-QGZVFWFLSA-N -1 3 371.391 3.580 20 0 FHADHM CC[C@H]1CCc2ccccc2N1C(=O)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000820989151 606685729 /nfs/dbraw/zinc/68/57/29/606685729.db2.gz MTILAFWZHMNFSO-ZDUSSCGKSA-N -1 3 369.375 3.517 20 0 FHADHM CC[C@H]1CCc2ccccc2N1C(=O)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000820989151 606685730 /nfs/dbraw/zinc/68/57/30/606685730.db2.gz MTILAFWZHMNFSO-ZDUSSCGKSA-N -1 3 369.375 3.517 20 0 FHADHM C[C@@H](Nc1ccc(F)cc1-c1nnn[n-]1)c1cccc(N2CCCC2)c1 ZINC000820455643 606732771 /nfs/dbraw/zinc/73/27/71/606732771.db2.gz KCQWIVVEJDDXQZ-CYBMUJFWSA-N -1 3 352.417 3.779 20 0 FHADHM C[C@@H](Nc1ccc(F)cc1-c1nn[n-]n1)c1cccc(N2CCCC2)c1 ZINC000820455643 606732773 /nfs/dbraw/zinc/73/27/73/606732773.db2.gz KCQWIVVEJDDXQZ-CYBMUJFWSA-N -1 3 352.417 3.779 20 0 FHADHM CC[C@@H](OC1CCCCC1)C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820937918 606735976 /nfs/dbraw/zinc/73/59/76/606735976.db2.gz FHCVMPPQIDYVEA-SUMWQHHRSA-N -1 3 358.442 3.599 20 0 FHADHM CC[C@@H](OC1CCCCC1)C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820937918 606735979 /nfs/dbraw/zinc/73/59/79/606735979.db2.gz FHCVMPPQIDYVEA-SUMWQHHRSA-N -1 3 358.442 3.599 20 0 FHADHM Cc1c(NC(=O)C=Cc2ccccc2-c2nnn[n-]2)cccc1C(F)(F)F ZINC000822068050 606739339 /nfs/dbraw/zinc/73/93/39/606739339.db2.gz PHAXMZXPSIOXPT-KTKRTIGZSA-N -1 3 373.338 3.846 20 0 FHADHM Cc1c(NC(=O)C=Cc2ccccc2-c2nn[n-]n2)cccc1C(F)(F)F ZINC000822068050 606739340 /nfs/dbraw/zinc/73/93/40/606739340.db2.gz PHAXMZXPSIOXPT-KTKRTIGZSA-N -1 3 373.338 3.846 20 0 FHADHM Cc1cc(C)c([C@H](C)OC(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)c(C)c1 ZINC000822194176 606757553 /nfs/dbraw/zinc/75/75/53/606757553.db2.gz LRYRFLZEQWHRAR-LBPRGKRZSA-N -1 3 372.375 3.988 20 0 FHADHM Cc1cc(C)c([C@H](C)OC(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)c(C)c1 ZINC000822194176 606757554 /nfs/dbraw/zinc/75/75/54/606757554.db2.gz LRYRFLZEQWHRAR-LBPRGKRZSA-N -1 3 372.375 3.988 20 0 FHADHM CN(c1ccccc1NC(=O)c1sccc1-c1nnn[n-]1)C1CCCC1 ZINC000821619006 606814534 /nfs/dbraw/zinc/81/45/34/606814534.db2.gz FHTCEIBDOAQTPA-UHFFFAOYSA-N -1 3 368.466 3.559 20 0 FHADHM CN(c1ccccc1NC(=O)c1sccc1-c1nn[n-]n1)C1CCCC1 ZINC000821619006 606814535 /nfs/dbraw/zinc/81/45/35/606814535.db2.gz FHTCEIBDOAQTPA-UHFFFAOYSA-N -1 3 368.466 3.559 20 0 FHADHM C[C@@H](SCC(=O)NCCC1CCCCC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820550169 606827871 /nfs/dbraw/zinc/82/78/71/606827871.db2.gz VHCIYFSXGQAHJC-CQSZACIVSA-N -1 3 373.526 3.748 20 0 FHADHM C[C@@H](SCC(=O)NCCC1CCCCC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820550169 606827873 /nfs/dbraw/zinc/82/78/73/606827873.db2.gz VHCIYFSXGQAHJC-CQSZACIVSA-N -1 3 373.526 3.748 20 0 FHADHM CC(C)N(C(=O)[C@@H](C)Sc1ccc(-c2nnn[n-]2)cc1Cl)C(C)C ZINC000820549523 606852669 /nfs/dbraw/zinc/85/26/69/606852669.db2.gz OMHIAATWFHVTGQ-LLVKDONJSA-N -1 3 367.906 3.646 20 0 FHADHM CC(C)N(C(=O)[C@@H](C)Sc1ccc(-c2nn[n-]n2)cc1Cl)C(C)C ZINC000820549523 606852671 /nfs/dbraw/zinc/85/26/71/606852671.db2.gz OMHIAATWFHVTGQ-LLVKDONJSA-N -1 3 367.906 3.646 20 0 FHADHM C[C@H]1c2cc(Cl)cc(Cl)c2CCN1c1ncccc1-c1nnn[n-]1 ZINC000820819741 606858319 /nfs/dbraw/zinc/85/83/19/606858319.db2.gz KGYVLFYIXSJDFX-VIFPVBQESA-N -1 3 361.236 3.692 20 0 FHADHM C[C@H]1c2cc(Cl)cc(Cl)c2CCN1c1ncccc1-c1nn[n-]n1 ZINC000820819741 606858320 /nfs/dbraw/zinc/85/83/20/606858320.db2.gz KGYVLFYIXSJDFX-VIFPVBQESA-N -1 3 361.236 3.692 20 0 FHADHM Cc1cc(Oc2ccc(-c3nnn[n-]3)cc2)ccc1NC(=O)NC(C)(C)C ZINC000822211940 606906314 /nfs/dbraw/zinc/90/63/14/606906314.db2.gz UTWMFPJXKSYCFD-UHFFFAOYSA-N -1 3 366.425 3.887 20 0 FHADHM Cc1cc(Oc2ccc(-c3nn[n-]n3)cc2)ccc1NC(=O)NC(C)(C)C ZINC000822211940 606906316 /nfs/dbraw/zinc/90/63/16/606906316.db2.gz UTWMFPJXKSYCFD-UHFFFAOYSA-N -1 3 366.425 3.887 20 0 FHADHM CC(C)(C)NC(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000819923297 606907138 /nfs/dbraw/zinc/90/71/38/606907138.db2.gz YTVITDRSQWGAEB-UHFFFAOYSA-N -1 3 352.398 3.579 20 0 FHADHM CC(C)(C)NC(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000819923297 606907140 /nfs/dbraw/zinc/90/71/40/606907140.db2.gz YTVITDRSQWGAEB-UHFFFAOYSA-N -1 3 352.398 3.579 20 0 FHADHM C[C@@H](NC(=O)c1ccc(C(C)(C)C)s1)c1cccc(-c2nnn[n-]2)c1 ZINC000820396961 606914895 /nfs/dbraw/zinc/91/48/95/606914895.db2.gz KCTNXPWUXKWAPL-LLVKDONJSA-N -1 3 355.467 3.717 20 0 FHADHM C[C@@H](NC(=O)c1ccc(C(C)(C)C)s1)c1cccc(-c2nn[n-]n2)c1 ZINC000820396961 606914896 /nfs/dbraw/zinc/91/48/96/606914896.db2.gz KCTNXPWUXKWAPL-LLVKDONJSA-N -1 3 355.467 3.717 20 0 FHADHM CN(C[C@@H](O)c1ccc(-c2nnn[n-]2)cc1)c1ccccc1-c1ccccc1 ZINC000821596366 606921148 /nfs/dbraw/zinc/92/11/48/606921148.db2.gz IEWBUKBFEDYQJX-OAQYLSRUSA-N -1 3 371.444 3.704 20 0 FHADHM CN(C[C@@H](O)c1ccc(-c2nn[n-]n2)cc1)c1ccccc1-c1ccccc1 ZINC000821596366 606921149 /nfs/dbraw/zinc/92/11/49/606921149.db2.gz IEWBUKBFEDYQJX-OAQYLSRUSA-N -1 3 371.444 3.704 20 0 FHADHM O[C@H](CN1Cc2ccccc2-c2ccccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000823682759 606921675 /nfs/dbraw/zinc/92/16/75/606921675.db2.gz UKMUOQZBGQATEE-OAQYLSRUSA-N -1 3 369.428 3.587 20 0 FHADHM O[C@H](CN1Cc2ccccc2-c2ccccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000823682759 606921676 /nfs/dbraw/zinc/92/16/76/606921676.db2.gz UKMUOQZBGQATEE-OAQYLSRUSA-N -1 3 369.428 3.587 20 0 FHADHM CN(C(=O)c1ccc(C(F)F)cc1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821573193 606960896 /nfs/dbraw/zinc/96/08/96/606960896.db2.gz FFQXMFZVYAXFRP-UHFFFAOYSA-N -1 3 363.755 3.734 20 0 FHADHM CN(C(=O)c1ccc(C(F)F)cc1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821573193 606960898 /nfs/dbraw/zinc/96/08/98/606960898.db2.gz FFQXMFZVYAXFRP-UHFFFAOYSA-N -1 3 363.755 3.734 20 0 FHADHM C[C@@H](Cc1ccccc1F)C(=O)N(C)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000820300321 606963998 /nfs/dbraw/zinc/96/39/98/606963998.db2.gz PIZLRZXOUIEVLC-NSHDSACASA-N -1 3 373.819 3.501 20 0 FHADHM C[C@@H](Cc1ccccc1F)C(=O)N(C)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000820300321 606963999 /nfs/dbraw/zinc/96/39/99/606963999.db2.gz PIZLRZXOUIEVLC-NSHDSACASA-N -1 3 373.819 3.501 20 0 FHADHM Cc1ccc(SCCC(=O)N(C)c2ccccc2-c2nnn[n-]2)cc1C ZINC000822267533 606972453 /nfs/dbraw/zinc/97/24/53/606972453.db2.gz ZLRLWUFLYHYPKX-UHFFFAOYSA-N -1 3 367.478 3.629 20 0 FHADHM Cc1ccc(SCCC(=O)N(C)c2ccccc2-c2nn[n-]n2)cc1C ZINC000822267533 606972456 /nfs/dbraw/zinc/97/24/56/606972456.db2.gz ZLRLWUFLYHYPKX-UHFFFAOYSA-N -1 3 367.478 3.629 20 0 FHADHM Cc1ccc2ccccc2c1C[S@@](=O)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000822279584 606979221 /nfs/dbraw/zinc/97/92/21/606979221.db2.gz BNJPRVXIDXDRTM-SANMLTNESA-N -1 3 362.458 3.777 20 0 FHADHM Cc1ccc2ccccc2c1C[S@@](=O)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000822279584 606979223 /nfs/dbraw/zinc/97/92/23/606979223.db2.gz BNJPRVXIDXDRTM-SANMLTNESA-N -1 3 362.458 3.777 20 0 FHADHM O=C(OCc1ccc(F)c(-c2nnn[n-]2)c1)[C@H]1C[C@@H]1c1cccc(Cl)c1 ZINC000823422398 606998030 /nfs/dbraw/zinc/99/80/30/606998030.db2.gz UAIFBXCJZCSOGR-KGLIPLIRSA-N -1 3 372.787 3.506 20 0 FHADHM O=C(OCc1ccc(F)c(-c2nn[n-]n2)c1)[C@H]1C[C@@H]1c1cccc(Cl)c1 ZINC000823422398 606998031 /nfs/dbraw/zinc/99/80/31/606998031.db2.gz UAIFBXCJZCSOGR-KGLIPLIRSA-N -1 3 372.787 3.506 20 0 FHADHM Cc1ccccc1-c1nnc(SCc2ccc(F)c(-c3nnn[n-]3)c2)o1 ZINC000822344905 607005776 /nfs/dbraw/zinc/00/57/76/607005776.db2.gz CSEDOFUWGNSOJM-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM Cc1ccccc1-c1nnc(SCc2ccc(F)c(-c3nn[n-]n3)c2)o1 ZINC000822344905 607005778 /nfs/dbraw/zinc/00/57/78/607005778.db2.gz CSEDOFUWGNSOJM-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM Fc1ccc(CSc2ccc(C(F)(F)F)cn2)cc1-c1nnn[n-]1 ZINC000822773931 607007645 /nfs/dbraw/zinc/00/76/45/607007645.db2.gz AYJVZJJPHZOCHD-UHFFFAOYSA-N -1 3 355.320 3.712 20 0 FHADHM Fc1ccc(CSc2ccc(C(F)(F)F)cn2)cc1-c1nn[n-]n1 ZINC000822773931 607007646 /nfs/dbraw/zinc/00/76/46/607007646.db2.gz AYJVZJJPHZOCHD-UHFFFAOYSA-N -1 3 355.320 3.712 20 0 FHADHM Fc1ccc(-c2cc(CSc3cccc(-c4nnn[n-]4)c3)on2)cc1 ZINC000822753671 607015821 /nfs/dbraw/zinc/01/58/21/607015821.db2.gz RHTDSCDHJMJCMA-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM Fc1ccc(-c2cc(CSc3cccc(-c4nn[n-]n4)c3)on2)cc1 ZINC000822753671 607015823 /nfs/dbraw/zinc/01/58/23/607015823.db2.gz RHTDSCDHJMJCMA-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM Cc1ccccc1-c1noc(CSc2cccc(-c3nnn[n-]3)c2)n1 ZINC000822346004 607015908 /nfs/dbraw/zinc/01/59/08/607015908.db2.gz ZHNRRTZNLHWCSY-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM Cc1ccccc1-c1noc(CSc2cccc(-c3nn[n-]n3)c2)n1 ZINC000822346004 607015911 /nfs/dbraw/zinc/01/59/11/607015911.db2.gz ZHNRRTZNLHWCSY-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM Cc1cccc([C@H]2CCCN2c2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)n1 ZINC000822299581 607032892 /nfs/dbraw/zinc/03/28/92/607032892.db2.gz NPJQUZZWZDQAOC-MRXNPFEDSA-N -1 3 374.370 3.930 20 0 FHADHM Cc1cccc([C@H]2CCCN2c2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)n1 ZINC000822299581 607032895 /nfs/dbraw/zinc/03/28/95/607032895.db2.gz NPJQUZZWZDQAOC-MRXNPFEDSA-N -1 3 374.370 3.930 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)C[C@H]1CC[C@H](C)C1 ZINC000820087757 607033731 /nfs/dbraw/zinc/03/37/31/607033731.db2.gz ZEPJXLBIXGRJQR-RDJZCZTQSA-N -1 3 355.486 3.678 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)C[C@H]1CC[C@H](C)C1 ZINC000820087757 607033733 /nfs/dbraw/zinc/03/37/33/607033733.db2.gz ZEPJXLBIXGRJQR-RDJZCZTQSA-N -1 3 355.486 3.678 20 0 FHADHM CO[C@H](C)c1nc(CSCc2cc(F)ccc2-c2nnn[n-]2)cs1 ZINC000821675805 607035356 /nfs/dbraw/zinc/03/53/56/607035356.db2.gz UGDWDZSUJPZBFJ-SECBINFHSA-N -1 3 365.459 3.603 20 0 FHADHM CO[C@H](C)c1nc(CSCc2cc(F)ccc2-c2nn[n-]n2)cs1 ZINC000821675805 607035358 /nfs/dbraw/zinc/03/53/58/607035358.db2.gz UGDWDZSUJPZBFJ-SECBINFHSA-N -1 3 365.459 3.603 20 0 FHADHM Cc1cc(C)c2ncc(-c3nnn[n-]3)c(N3CCC(C(F)F)CC3)c2c1 ZINC000822195287 607040135 /nfs/dbraw/zinc/04/01/35/607040135.db2.gz NKYNDPQMSXXGGQ-UHFFFAOYSA-N -1 3 358.396 3.513 20 0 FHADHM Cc1cc(C)c2ncc(-c3nn[n-]n3)c(N3CCC(C(F)F)CC3)c2c1 ZINC000822195287 607040136 /nfs/dbraw/zinc/04/01/36/607040136.db2.gz NKYNDPQMSXXGGQ-UHFFFAOYSA-N -1 3 358.396 3.513 20 0 FHADHM O=C(OCc1cc(F)ccc1-c1nnn[n-]1)c1cc(Cl)sc1Cl ZINC000823414397 607076441 /nfs/dbraw/zinc/07/64/41/607076441.db2.gz XTHLHRBEPWDLRE-UHFFFAOYSA-N -1 3 373.196 3.731 20 0 FHADHM O=C(OCc1cc(F)ccc1-c1nn[n-]n1)c1cc(Cl)sc1Cl ZINC000823414397 607076442 /nfs/dbraw/zinc/07/64/42/607076442.db2.gz XTHLHRBEPWDLRE-UHFFFAOYSA-N -1 3 373.196 3.731 20 0 FHADHM CCC1CCC(N(C(=O)NCc2ccc(-c3nnn[n-]3)cc2)C2CC2)CC1 ZINC000820973642 607101250 /nfs/dbraw/zinc/10/12/50/607101250.db2.gz YTTBEVCASUYBOI-UHFFFAOYSA-N -1 3 368.485 3.510 20 0 FHADHM CCC1CCC(N(C(=O)NCc2ccc(-c3nn[n-]n3)cc2)C2CC2)CC1 ZINC000820973642 607101251 /nfs/dbraw/zinc/10/12/51/607101251.db2.gz YTTBEVCASUYBOI-UHFFFAOYSA-N -1 3 368.485 3.510 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NC(=O)C=Cc1ccc(Cl)s1 ZINC000821294879 607101646 /nfs/dbraw/zinc/10/16/46/607101646.db2.gz ZGLMAURMWAQUSY-VMPITWQZSA-N -1 3 374.857 3.665 20 0 FHADHM COc1cccc2c1CC[C@H]2Nc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000821877734 607119422 /nfs/dbraw/zinc/11/94/22/607119422.db2.gz SCFNEBFRVHQPQP-QGZVFWFLSA-N -1 3 358.405 3.523 20 0 FHADHM COc1cccc2c1CC[C@H]2Nc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000821877734 607119424 /nfs/dbraw/zinc/11/94/24/607119424.db2.gz SCFNEBFRVHQPQP-QGZVFWFLSA-N -1 3 358.405 3.523 20 0 FHADHM C[C@H](OC(=O)/C=C/SCc1ccco1)c1cccc(-c2nnn[n-]2)c1 ZINC000820489091 607130087 /nfs/dbraw/zinc/13/00/87/607130087.db2.gz ZELIJTBEJHMNKG-CRALRDPISA-N -1 3 356.407 3.511 20 0 FHADHM C[C@H](OC(=O)/C=C/SCc1ccco1)c1cccc(-c2nn[n-]n2)c1 ZINC000820489091 607130089 /nfs/dbraw/zinc/13/00/89/607130089.db2.gz ZELIJTBEJHMNKG-CRALRDPISA-N -1 3 356.407 3.511 20 0 FHADHM O=C(Nc1sc2c(c1-c1nnn[n-]1)CCCCCC2)[C@@H]1CC12CCC2 ZINC000823387072 607144904 /nfs/dbraw/zinc/14/49/04/607144904.db2.gz BZQOKWGZWIJRKN-LBPRGKRZSA-N -1 3 357.483 3.716 20 0 FHADHM O=C(Nc1sc2c(c1-c1nn[n-]n1)CCCCCC2)[C@@H]1CC12CCC2 ZINC000823387072 607144905 /nfs/dbraw/zinc/14/49/05/607144905.db2.gz BZQOKWGZWIJRKN-LBPRGKRZSA-N -1 3 357.483 3.716 20 0 FHADHM CCC[C@H](C)[C@@H]1CCCN1C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821015451 607153420 /nfs/dbraw/zinc/15/34/20/607153420.db2.gz QEQVDOJRPPORJR-VBQJREDUSA-N -1 3 356.474 3.538 20 0 FHADHM CCC[C@H](C)[C@@H]1CCCN1C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821015451 607153422 /nfs/dbraw/zinc/15/34/22/607153422.db2.gz QEQVDOJRPPORJR-VBQJREDUSA-N -1 3 356.474 3.538 20 0 FHADHM CCN(C(=O)c1cccc(C)c1F)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821160242 607153665 /nfs/dbraw/zinc/15/36/65/607153665.db2.gz HYCJWAJREQKFTD-CYBMUJFWSA-N -1 3 353.401 3.538 20 0 FHADHM CCN(C(=O)c1cccc(C)c1F)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821160242 607153666 /nfs/dbraw/zinc/15/36/66/607153666.db2.gz HYCJWAJREQKFTD-CYBMUJFWSA-N -1 3 353.401 3.538 20 0 FHADHM Cc1ccc2oc(C(=O)Nc3ccc(-c4nnn[n-]4)cc3Cl)cc2c1 ZINC000822284384 607191042 /nfs/dbraw/zinc/19/10/42/607191042.db2.gz QPYZCDNPCKGKIT-UHFFFAOYSA-N -1 3 353.769 3.827 20 0 FHADHM Cc1ccc2oc(C(=O)Nc3ccc(-c4nn[n-]n4)cc3Cl)cc2c1 ZINC000822284384 607191043 /nfs/dbraw/zinc/19/10/43/607191043.db2.gz QPYZCDNPCKGKIT-UHFFFAOYSA-N -1 3 353.769 3.827 20 0 FHADHM C[C@H]1CCc2c(C(=O)Nc3ccc(-c4nnn[n-]4)cc3Cl)csc2C1 ZINC000820727803 607191465 /nfs/dbraw/zinc/19/14/65/607191465.db2.gz PICJAXYELMOWGB-VIFPVBQESA-N -1 3 373.869 3.959 20 0 FHADHM C[C@H]1CCc2c(C(=O)Nc3ccc(-c4nn[n-]n4)cc3Cl)csc2C1 ZINC000820727803 607191466 /nfs/dbraw/zinc/19/14/66/607191466.db2.gz PICJAXYELMOWGB-VIFPVBQESA-N -1 3 373.869 3.959 20 0 FHADHM CC[C@](C)(NC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccccc1 ZINC000820852372 607194545 /nfs/dbraw/zinc/19/45/45/607194545.db2.gz ACFBNHOLKJWCHH-SFHVURJKSA-N -1 3 370.844 3.967 20 0 FHADHM CC[C@](C)(NC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccccc1 ZINC000820852372 607194546 /nfs/dbraw/zinc/19/45/46/607194546.db2.gz ACFBNHOLKJWCHH-SFHVURJKSA-N -1 3 370.844 3.967 20 0 FHADHM C[C@H](CCc1ccccc1)NC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820252558 607195446 /nfs/dbraw/zinc/19/54/46/607195446.db2.gz BSUATXGFVYYSOB-GFCCVEGCSA-N -1 3 370.844 3.663 20 0 FHADHM C[C@H](CCc1ccccc1)NC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820252558 607195447 /nfs/dbraw/zinc/19/54/47/607195447.db2.gz BSUATXGFVYYSOB-GFCCVEGCSA-N -1 3 370.844 3.663 20 0 FHADHM CC(C)Oc1ccccc1NC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820178588 607197833 /nfs/dbraw/zinc/19/78/33/607197833.db2.gz VEORJXSSEFYGFY-UHFFFAOYSA-N -1 3 372.816 3.951 20 0 FHADHM CC(C)Oc1ccccc1NC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820178588 607197834 /nfs/dbraw/zinc/19/78/34/607197834.db2.gz VEORJXSSEFYGFY-UHFFFAOYSA-N -1 3 372.816 3.951 20 0 FHADHM Cc1ccc2c(c1)[C@@H](NC(=O)Nc1ccc(-c3nnn[n-]3)cc1Cl)CC2 ZINC000822274596 607198368 /nfs/dbraw/zinc/19/83/68/607198368.db2.gz CBJRGYJIHXVKCO-HNNXBMFYSA-N -1 3 368.828 3.638 20 0 FHADHM Cc1ccc2c(c1)[C@@H](NC(=O)Nc1ccc(-c3nn[n-]n3)cc1Cl)CC2 ZINC000822274596 607198369 /nfs/dbraw/zinc/19/83/69/607198369.db2.gz CBJRGYJIHXVKCO-HNNXBMFYSA-N -1 3 368.828 3.638 20 0 FHADHM CC[C@H](C)[C@@H]1CCCCN1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820864168 607201571 /nfs/dbraw/zinc/20/15/71/607201571.db2.gz XBLQPLJHHWVPLR-NHYWBVRUSA-N -1 3 362.865 3.953 20 0 FHADHM CC[C@H](C)[C@@H]1CCCCN1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820864168 607201572 /nfs/dbraw/zinc/20/15/72/607201572.db2.gz XBLQPLJHHWVPLR-NHYWBVRUSA-N -1 3 362.865 3.953 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N1CCC[C@H]1C1CCCC1 ZINC000823314187 607203113 /nfs/dbraw/zinc/20/31/13/607203113.db2.gz ODHTWVGSXKKEMZ-HNNXBMFYSA-N -1 3 360.849 3.707 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N1CCC[C@H]1C1CCCC1 ZINC000823314187 607203114 /nfs/dbraw/zinc/20/31/14/607203114.db2.gz ODHTWVGSXKKEMZ-HNNXBMFYSA-N -1 3 360.849 3.707 20 0 FHADHM c1csc(-c2noc(CCCSc3ccc(-c4nnn[n-]4)cc3)n2)c1 ZINC000823816018 607237824 /nfs/dbraw/zinc/23/78/24/607237824.db2.gz NUSAYTGGCAOFTD-UHFFFAOYSA-N -1 3 370.463 3.703 20 0 FHADHM c1csc(-c2noc(CCCSc3ccc(-c4nn[n-]n4)cc3)n2)c1 ZINC000823816018 607237825 /nfs/dbraw/zinc/23/78/25/607237825.db2.gz NUSAYTGGCAOFTD-UHFFFAOYSA-N -1 3 370.463 3.703 20 0 FHADHM O=C(Nc1cccc2ccsc21)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000826456991 607777031 /nfs/dbraw/zinc/77/70/31/607777031.db2.gz HPCJKKRLSRVDKW-UHFFFAOYSA-N -1 3 357.345 3.612 20 0 FHADHM O=C(Nc1cccc2ccsc21)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000826456991 607777032 /nfs/dbraw/zinc/77/70/32/607777032.db2.gz HPCJKKRLSRVDKW-UHFFFAOYSA-N -1 3 357.345 3.612 20 0 FHADHM COc1cc(-c2nnn[n-]2)cc(Cl)c1OCCCCC(F)(F)F ZINC000826167514 607783192 /nfs/dbraw/zinc/78/31/92/607783192.db2.gz HICKOYSLXHCJRZ-UHFFFAOYSA-N -1 3 350.728 3.640 20 0 FHADHM COc1cc(-c2nn[n-]n2)cc(Cl)c1OCCCCC(F)(F)F ZINC000826167514 607783193 /nfs/dbraw/zinc/78/31/93/607783193.db2.gz HICKOYSLXHCJRZ-UHFFFAOYSA-N -1 3 350.728 3.640 20 0 FHADHM Cc1ccc(-c2cncc(C(=O)N(C)c3ccccc3-c3nnn[n-]3)c2)cc1 ZINC000826273896 607788340 /nfs/dbraw/zinc/78/83/40/607788340.db2.gz YYMPLWSSKLPZIR-UHFFFAOYSA-N -1 3 370.416 3.514 20 0 FHADHM Cc1ccc(-c2cncc(C(=O)N(C)c3ccccc3-c3nn[n-]n3)c2)cc1 ZINC000826273896 607788341 /nfs/dbraw/zinc/78/83/41/607788341.db2.gz YYMPLWSSKLPZIR-UHFFFAOYSA-N -1 3 370.416 3.514 20 0 FHADHM CN(C(=O)[C@@H]1C[C@@H]1c1cccc2ccccc21)c1ccccc1-c1nnn[n-]1 ZINC000825811736 607789672 /nfs/dbraw/zinc/78/96/72/607789672.db2.gz AHEGTEFFBAFXJM-RTBURBONSA-N -1 3 369.428 3.786 20 0 FHADHM CN(C(=O)[C@@H]1C[C@@H]1c1cccc2ccccc21)c1ccccc1-c1nn[n-]n1 ZINC000825811736 607789673 /nfs/dbraw/zinc/78/96/73/607789673.db2.gz AHEGTEFFBAFXJM-RTBURBONSA-N -1 3 369.428 3.786 20 0 FHADHM CN(C(=O)CCCc1ccc(Cl)cc1)c1ccccc1-c1nnn[n-]1 ZINC000825817318 607789985 /nfs/dbraw/zinc/78/99/85/607789985.db2.gz HCYYTKOZJLOMBL-UHFFFAOYSA-N -1 3 355.829 3.506 20 0 FHADHM CN(C(=O)CCCc1ccc(Cl)cc1)c1ccccc1-c1nn[n-]n1 ZINC000825817318 607789986 /nfs/dbraw/zinc/78/99/86/607789986.db2.gz HCYYTKOZJLOMBL-UHFFFAOYSA-N -1 3 355.829 3.506 20 0 FHADHM Cc1cc(Cl)c(NC(=O)Cc2cccc(-c3nnn[n-]3)c2)cc1Cl ZINC000826267357 607791590 /nfs/dbraw/zinc/79/15/90/607791590.db2.gz BOXGINOXNUOXNN-UHFFFAOYSA-N -1 3 362.220 3.663 20 0 FHADHM Cc1cc(Cl)c(NC(=O)Cc2cccc(-c3nn[n-]n3)c2)cc1Cl ZINC000826267357 607791591 /nfs/dbraw/zinc/79/15/91/607791591.db2.gz BOXGINOXNUOXNN-UHFFFAOYSA-N -1 3 362.220 3.663 20 0 FHADHM O=C(Cc1cc2c(ccc3ccccc23)o1)Nc1ccccc1-c1nnn[n-]1 ZINC000826421463 607793587 /nfs/dbraw/zinc/79/35/87/607793587.db2.gz JCHBHBZGPKOPRG-UHFFFAOYSA-N -1 3 369.384 3.947 20 0 FHADHM O=C(Cc1cc2c(ccc3ccccc23)o1)Nc1ccccc1-c1nn[n-]n1 ZINC000826421463 607793588 /nfs/dbraw/zinc/79/35/88/607793588.db2.gz JCHBHBZGPKOPRG-UHFFFAOYSA-N -1 3 369.384 3.947 20 0 FHADHM CCN(C(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825367323 607798869 /nfs/dbraw/zinc/79/88/69/607798869.db2.gz NGWHJFCKQTVDEB-SJORKVTESA-N -1 3 367.840 3.677 20 0 FHADHM CCN(C(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825367323 607798870 /nfs/dbraw/zinc/79/88/70/607798870.db2.gz NGWHJFCKQTVDEB-SJORKVTESA-N -1 3 367.840 3.677 20 0 FHADHM CCN(C(=O)Cc1coc2cc(C)ccc12)c1ccc(-c2nnn[n-]2)cc1 ZINC000825376993 607799107 /nfs/dbraw/zinc/79/91/07/607799107.db2.gz QMTVRRUHKILFOS-UHFFFAOYSA-N -1 3 361.405 3.517 20 0 FHADHM CCN(C(=O)Cc1coc2cc(C)ccc12)c1ccc(-c2nn[n-]n2)cc1 ZINC000825376993 607799108 /nfs/dbraw/zinc/79/91/08/607799108.db2.gz QMTVRRUHKILFOS-UHFFFAOYSA-N -1 3 361.405 3.517 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@H](OC(C)(C)C)c1ccccc1 ZINC000826277138 607817899 /nfs/dbraw/zinc/81/78/99/607817899.db2.gz KQUQNNOVXDSAMK-QGZVFWFLSA-N -1 3 365.437 3.670 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@H](OC(C)(C)C)c1ccccc1 ZINC000826277138 607817900 /nfs/dbraw/zinc/81/79/00/607817900.db2.gz KQUQNNOVXDSAMK-QGZVFWFLSA-N -1 3 365.437 3.670 20 0 FHADHM Cc1c(NC(=O)[C@@H](OC(C)(C)C)c2ccccc2)cccc1-c1nnn[n-]1 ZINC000826241103 607822997 /nfs/dbraw/zinc/82/29/97/607822997.db2.gz RDRVLONREOZTRQ-KRWDZBQOSA-N -1 3 365.437 3.670 20 0 FHADHM Cc1c(NC(=O)[C@@H](OC(C)(C)C)c2ccccc2)cccc1-c1nn[n-]n1 ZINC000826241103 607822998 /nfs/dbraw/zinc/82/29/98/607822998.db2.gz RDRVLONREOZTRQ-KRWDZBQOSA-N -1 3 365.437 3.670 20 0 FHADHM CCC(CC)c1cc(CNc2ccc3cc(-c4nnn[n-]4)ccc3n2)on1 ZINC000825113734 607841717 /nfs/dbraw/zinc/84/17/17/607841717.db2.gz DXNUNTQHRJFUFO-UHFFFAOYSA-N -1 3 363.425 3.919 20 0 FHADHM CCC(CC)c1cc(CNc2ccc3cc(-c4nn[n-]n4)ccc3n2)on1 ZINC000825113734 607841718 /nfs/dbraw/zinc/84/17/18/607841718.db2.gz DXNUNTQHRJFUFO-UHFFFAOYSA-N -1 3 363.425 3.919 20 0 FHADHM CCc1ccccc1NC(=O)CSc1ccc(-c2nnn[n-]2)cc1Cl ZINC000825723031 607845636 /nfs/dbraw/zinc/84/56/36/607845636.db2.gz RCSWJFPJUPBYTP-UHFFFAOYSA-N -1 3 373.869 3.813 20 0 FHADHM CCc1ccccc1NC(=O)CSc1ccc(-c2nn[n-]n2)cc1Cl ZINC000825723031 607845637 /nfs/dbraw/zinc/84/56/37/607845637.db2.gz RCSWJFPJUPBYTP-UHFFFAOYSA-N -1 3 373.869 3.813 20 0 FHADHM Cc1cccc(C(=O)N(C)c2cc(Cl)ccc2-c2nnn[n-]2)c1Cl ZINC000826295279 607861548 /nfs/dbraw/zinc/86/15/48/607861548.db2.gz ADFVKNDSYMUZBP-UHFFFAOYSA-N -1 3 362.220 3.759 20 0 FHADHM Cc1cccc(C(=O)N(C)c2cc(Cl)ccc2-c2nn[n-]n2)c1Cl ZINC000826295279 607861549 /nfs/dbraw/zinc/86/15/49/607861549.db2.gz ADFVKNDSYMUZBP-UHFFFAOYSA-N -1 3 362.220 3.759 20 0 FHADHM Cc1cccc(C(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(C)C)c1Cl ZINC000826295957 607861639 /nfs/dbraw/zinc/86/16/39/607861639.db2.gz FBDNHUBQERPVCI-UHFFFAOYSA-N -1 3 371.828 3.868 20 0 FHADHM Cc1cccc(C(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(C)C)c1Cl ZINC000826295957 607861640 /nfs/dbraw/zinc/86/16/40/607861640.db2.gz FBDNHUBQERPVCI-UHFFFAOYSA-N -1 3 371.828 3.868 20 0 FHADHM O[C@@H](COc1ccc(Cl)c2ccccc12)c1ccc(-c2nnn[n-]2)cc1 ZINC000826504844 607869734 /nfs/dbraw/zinc/86/97/34/607869734.db2.gz GGNNKIIFEAUKDP-KRWDZBQOSA-N -1 3 366.808 3.786 20 0 FHADHM O[C@@H](COc1ccc(Cl)c2ccccc12)c1ccc(-c2nn[n-]n2)cc1 ZINC000826504844 607869735 /nfs/dbraw/zinc/86/97/35/607869735.db2.gz GGNNKIIFEAUKDP-KRWDZBQOSA-N -1 3 366.808 3.786 20 0 FHADHM O[C@@H](COc1ccc(Nc2ccccc2)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000826505396 607869872 /nfs/dbraw/zinc/86/98/72/607869872.db2.gz UTHCTKPZEJSMIF-FQEVSTJZSA-N -1 3 373.416 3.723 20 0 FHADHM O[C@@H](COc1ccc(Nc2ccccc2)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000826505396 607869873 /nfs/dbraw/zinc/86/98/73/607869873.db2.gz UTHCTKPZEJSMIF-FQEVSTJZSA-N -1 3 373.416 3.723 20 0 FHADHM O[C@H](COc1ccc(Cc2ccccc2)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000826505235 607873743 /nfs/dbraw/zinc/87/37/43/607873743.db2.gz QCAHZECWBBZVBO-OAQYLSRUSA-N -1 3 372.428 3.570 20 0 FHADHM O[C@H](COc1ccc(Cc2ccccc2)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000826505235 607873744 /nfs/dbraw/zinc/87/37/44/607873744.db2.gz QCAHZECWBBZVBO-OAQYLSRUSA-N -1 3 372.428 3.570 20 0 FHADHM CCc1ccc(C(=O)N(CC)c2ccc(-c3nnn[n-]3)c(Cl)c2)cc1 ZINC000825704462 607879313 /nfs/dbraw/zinc/87/93/13/607879313.db2.gz JDTQUWQWSMCPQM-UHFFFAOYSA-N -1 3 355.829 3.749 20 0 FHADHM CCc1ccc(C(=O)N(CC)c2ccc(-c3nn[n-]n3)c(Cl)c2)cc1 ZINC000825704462 607879314 /nfs/dbraw/zinc/87/93/14/607879314.db2.gz JDTQUWQWSMCPQM-UHFFFAOYSA-N -1 3 355.829 3.749 20 0 FHADHM Cc1noc(C)c1CCOc1ccc(-c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000826339071 607892526 /nfs/dbraw/zinc/89/25/26/607892526.db2.gz QGWPAHRJAVRQCT-UHFFFAOYSA-N -1 3 361.405 3.760 20 0 FHADHM Cc1noc(C)c1CCOc1ccc(-c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000826339071 607892527 /nfs/dbraw/zinc/89/25/27/607892527.db2.gz QGWPAHRJAVRQCT-UHFFFAOYSA-N -1 3 361.405 3.760 20 0 FHADHM CC1(C)CCC[C@@H](C(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(F)F)C1 ZINC000824801445 607893917 /nfs/dbraw/zinc/89/39/17/607893917.db2.gz FRTJWPSBQCDZSN-LLVKDONJSA-N -1 3 365.384 3.623 20 0 FHADHM CC1(C)CCC[C@@H](C(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(F)F)C1 ZINC000824801445 607893918 /nfs/dbraw/zinc/89/39/18/607893918.db2.gz FRTJWPSBQCDZSN-LLVKDONJSA-N -1 3 365.384 3.623 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000823942322 607905819 /nfs/dbraw/zinc/90/58/19/607905819.db2.gz BCGKUKJAXDOICD-UKVQZPPCSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000823942322 607905820 /nfs/dbraw/zinc/90/58/20/607905820.db2.gz BCGKUKJAXDOICD-UKVQZPPCSA-N -1 3 367.840 3.801 20 0 FHADHM CCc1ccc([C@H](C)CC(=O)N2CCc3ccc(-c4nnn[n-]4)cc32)cc1 ZINC000825704597 607946517 /nfs/dbraw/zinc/94/65/17/607946517.db2.gz KCSCFMUATGNHFP-CQSZACIVSA-N -1 3 361.449 3.512 20 0 FHADHM CCc1ccc([C@H](C)CC(=O)N2CCc3ccc(-c4nn[n-]n4)cc32)cc1 ZINC000825704597 607946518 /nfs/dbraw/zinc/94/65/18/607946518.db2.gz KCSCFMUATGNHFP-CQSZACIVSA-N -1 3 361.449 3.512 20 0 FHADHM CC(C)c1ccc(CCC(=O)N2CCc3ccc(-c4nnn[n-]4)cc32)cc1 ZINC000824347952 607953116 /nfs/dbraw/zinc/95/31/16/607953116.db2.gz USAPQLXUCMXJGI-UHFFFAOYSA-N -1 3 361.449 3.512 20 0 FHADHM CC(C)c1ccc(CCC(=O)N2CCc3ccc(-c4nn[n-]n4)cc32)cc1 ZINC000824347952 607953117 /nfs/dbraw/zinc/95/31/17/607953117.db2.gz USAPQLXUCMXJGI-UHFFFAOYSA-N -1 3 361.449 3.512 20 0 FHADHM O=C(c1sccc1-c1ccccc1)N1CCc2ccc(-c3nnn[n-]3)cc21 ZINC000826476011 607954791 /nfs/dbraw/zinc/95/47/91/607954791.db2.gz YRXCIYJSRYKHLM-UHFFFAOYSA-N -1 3 373.441 3.798 20 0 FHADHM O=C(c1sccc1-c1ccccc1)N1CCc2ccc(-c3nn[n-]n3)cc21 ZINC000826476011 607954792 /nfs/dbraw/zinc/95/47/92/607954792.db2.gz YRXCIYJSRYKHLM-UHFFFAOYSA-N -1 3 373.441 3.798 20 0 FHADHM Cc1nnc(SCc2ccccc2-c2nnn[n-]2)n1[C@@H]1CCC[C@H](C)C1 ZINC000826337322 607965917 /nfs/dbraw/zinc/96/59/17/607965917.db2.gz KJODEMHKRMVHMC-SWLSCSKDSA-N -1 3 369.498 3.810 20 0 FHADHM Cc1nnc(SCc2ccccc2-c2nn[n-]n2)n1[C@@H]1CCC[C@H](C)C1 ZINC000826337322 607965918 /nfs/dbraw/zinc/96/59/18/607965918.db2.gz KJODEMHKRMVHMC-SWLSCSKDSA-N -1 3 369.498 3.810 20 0 FHADHM CCCn1c2ccc(-c3nnn[n-]3)cc2nc1-c1cnc(Cl)c(C)c1 ZINC000825351650 607974664 /nfs/dbraw/zinc/97/46/64/607974664.db2.gz FYLHNUGVGTXCQI-UHFFFAOYSA-N -1 3 353.817 3.650 20 0 FHADHM CCCn1c2ccc(-c3nn[n-]n3)cc2nc1-c1cnc(Cl)c(C)c1 ZINC000825351650 607974665 /nfs/dbraw/zinc/97/46/65/607974665.db2.gz FYLHNUGVGTXCQI-UHFFFAOYSA-N -1 3 353.817 3.650 20 0 FHADHM CC1(C)CCCN(C(=O)c2cc(-c3nnn[n-]3)cs2)c2ccccc21 ZINC000824802301 608030420 /nfs/dbraw/zinc/03/04/20/608030420.db2.gz LRZNDUWIDCJUMB-UHFFFAOYSA-N -1 3 353.451 3.646 20 0 FHADHM CC1(C)CCCN(C(=O)c2cc(-c3nn[n-]n3)cs2)c2ccccc21 ZINC000824802301 608030421 /nfs/dbraw/zinc/03/04/21/608030421.db2.gz LRZNDUWIDCJUMB-UHFFFAOYSA-N -1 3 353.451 3.646 20 0 FHADHM Cc1ncc(-c2ccccc2)cc1NC(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000826329794 608032293 /nfs/dbraw/zinc/03/22/93/608032293.db2.gz RUMRIRBNOHALTD-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1ncc(-c2ccccc2)cc1NC(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000826329794 608032294 /nfs/dbraw/zinc/03/22/94/608032294.db2.gz RUMRIRBNOHALTD-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM COc1ccc(CNc2cc(C)ccc2Br)cc1-c1nnn[n-]1 ZINC000826203175 608048705 /nfs/dbraw/zinc/04/87/05/608048705.db2.gz BPNAWVCMEJXAAH-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM COc1ccc(CNc2cc(C)ccc2Br)cc1-c1nn[n-]n1 ZINC000826203175 608048706 /nfs/dbraw/zinc/04/87/06/608048706.db2.gz BPNAWVCMEJXAAH-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM COc1ccc(CNc2cc(C(C)C)nc(C(C)C)n2)cc1-c1nnn[n-]1 ZINC000826203211 608051508 /nfs/dbraw/zinc/05/15/08/608051508.db2.gz DOWANOMUHFZTAG-UHFFFAOYSA-N -1 3 367.457 3.524 20 0 FHADHM COc1ccc(CNc2cc(C(C)C)nc(C(C)C)n2)cc1-c1nn[n-]n1 ZINC000826203211 608051509 /nfs/dbraw/zinc/05/15/09/608051509.db2.gz DOWANOMUHFZTAG-UHFFFAOYSA-N -1 3 367.457 3.524 20 0 FHADHM Cc1cc2c(ncnc2SCc2cc(-c3nnn[n-]3)ccc2F)s1 ZINC000826273350 608056654 /nfs/dbraw/zinc/05/66/54/608056654.db2.gz ZUPZBYFBIKCFGW-UHFFFAOYSA-N -1 3 358.427 3.611 20 0 FHADHM Cc1cc2c(ncnc2SCc2cc(-c3nn[n-]n3)ccc2F)s1 ZINC000826273350 608056655 /nfs/dbraw/zinc/05/66/55/608056655.db2.gz ZUPZBYFBIKCFGW-UHFFFAOYSA-N -1 3 358.427 3.611 20 0 FHADHM c1sc(CNc2ccccc2N2CCCCCC2)cc1-c1nnn[n-]1 ZINC000826521837 608112561 /nfs/dbraw/zinc/11/25/61/608112561.db2.gz AHGKOBNCGFYFNT-UHFFFAOYSA-N -1 3 354.483 3.921 20 0 FHADHM c1sc(CNc2ccccc2N2CCCCCC2)cc1-c1nn[n-]n1 ZINC000826521837 608112562 /nfs/dbraw/zinc/11/25/62/608112562.db2.gz AHGKOBNCGFYFNT-UHFFFAOYSA-N -1 3 354.483 3.921 20 0 FHADHM CC(C)(C)[C@H]1C[C@H](Nc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)CCO1 ZINC000824078597 608149194 /nfs/dbraw/zinc/14/91/94/608149194.db2.gz JIJJKERAWCPQDY-BXUZGUMPSA-N -1 3 369.391 3.891 20 0 FHADHM O=C(Nc1sccc1-c1nnn[n-]1)C1(Cc2ccc(Cl)cc2)CC1 ZINC000826460699 608149832 /nfs/dbraw/zinc/14/98/32/608149832.db2.gz NPBUZDFHJGOHKS-UHFFFAOYSA-N -1 3 359.842 3.543 20 0 FHADHM O=C(Nc1sccc1-c1nn[n-]n1)C1(Cc2ccc(Cl)cc2)CC1 ZINC000826460699 608149833 /nfs/dbraw/zinc/14/98/33/608149833.db2.gz NPBUZDFHJGOHKS-UHFFFAOYSA-N -1 3 359.842 3.543 20 0 FHADHM C[C@H](OC(=O)C12CC3CC(CC(C3)C1)C2)c1cccc(-c2nnn[n-]2)c1 ZINC000824713615 608181865 /nfs/dbraw/zinc/18/18/65/608181865.db2.gz JETWDIRTTZCEOX-PGBBXINNSA-N -1 3 352.438 3.687 20 0 FHADHM C[C@H](OC(=O)C12CC3CC(CC(C3)C1)C2)c1cccc(-c2nn[n-]n2)c1 ZINC000824713615 608181866 /nfs/dbraw/zinc/18/18/66/608181866.db2.gz JETWDIRTTZCEOX-PGBBXINNSA-N -1 3 352.438 3.687 20 0 FHADHM C[C@@H](Oc1ccccc1Cl)C(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000824756118 608183373 /nfs/dbraw/zinc/18/33/73/608183373.db2.gz NTKKAWFCPZUEMB-VXGBXAGGSA-N -1 3 372.812 3.592 20 0 FHADHM C[C@@H](Oc1ccccc1Cl)C(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000824756118 608183374 /nfs/dbraw/zinc/18/33/74/608183374.db2.gz NTKKAWFCPZUEMB-VXGBXAGGSA-N -1 3 372.812 3.592 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nnn[n-]2)c1)c1ccc(Cl)c(F)c1 ZINC000826453296 608229528 /nfs/dbraw/zinc/22/95/28/608229528.db2.gz FWHMNXHXEWLBTQ-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nn[n-]n2)c1)c1ccc(Cl)c(F)c1 ZINC000826453296 608229530 /nfs/dbraw/zinc/22/95/30/608229530.db2.gz FWHMNXHXEWLBTQ-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM CSc1cc(CNc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)ccn1 ZINC000826230486 608241469 /nfs/dbraw/zinc/24/14/69/608241469.db2.gz WHMUUUKRTWIKMY-UHFFFAOYSA-N -1 3 366.372 3.615 20 0 FHADHM CSc1cc(CNc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)ccn1 ZINC000826230486 608241471 /nfs/dbraw/zinc/24/14/71/608241471.db2.gz WHMUUUKRTWIKMY-UHFFFAOYSA-N -1 3 366.372 3.615 20 0 FHADHM C[C@H](CC(=O)N(C)c1ccc(-c2nnn[n-]2)cc1)Cc1ccc(Cl)cc1 ZINC000824385609 608259827 /nfs/dbraw/zinc/25/98/27/608259827.db2.gz XPCDZQKVHLEPSO-ZDUSSCGKSA-N -1 3 369.856 3.752 20 0 FHADHM C[C@H](CC(=O)N(C)c1ccc(-c2nn[n-]n2)cc1)Cc1ccc(Cl)cc1 ZINC000824385609 608259829 /nfs/dbraw/zinc/25/98/29/608259829.db2.gz XPCDZQKVHLEPSO-ZDUSSCGKSA-N -1 3 369.856 3.752 20 0 FHADHM CCc1cccnc1C(=O)Oc1ccc(-c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000825728663 608260428 /nfs/dbraw/zinc/26/04/28/608260428.db2.gz VEGMNMVEXMQLRP-UHFFFAOYSA-N -1 3 371.400 3.710 20 0 FHADHM CCc1cccnc1C(=O)Oc1ccc(-c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000825728663 608260429 /nfs/dbraw/zinc/26/04/29/608260429.db2.gz VEGMNMVEXMQLRP-UHFFFAOYSA-N -1 3 371.400 3.710 20 0 FHADHM c1cc([C@@H]2CCCN2c2nc3c(cc2-c2nnn[n-]2)CCCC3)cs1 ZINC000826514791 608275216 /nfs/dbraw/zinc/27/52/16/608275216.db2.gz CYJUPDSFAMTTKF-INIZCTEOSA-N -1 3 352.467 3.544 20 0 FHADHM c1cc([C@@H]2CCCN2c2nc3c(cc2-c2nn[n-]n2)CCCC3)cs1 ZINC000826514791 608275218 /nfs/dbraw/zinc/27/52/18/608275218.db2.gz CYJUPDSFAMTTKF-INIZCTEOSA-N -1 3 352.467 3.544 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)c(N[C@@H]2CCCc3cc(OC(F)F)ccc32)n1 ZINC000826275555 608280078 /nfs/dbraw/zinc/28/00/78/608280078.db2.gz CVXCKYAYONRGDK-OAHLLOKOSA-N -1 3 372.379 3.661 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)c(N[C@@H]2CCCc3cc(OC(F)F)ccc32)n1 ZINC000826275555 608280080 /nfs/dbraw/zinc/28/00/80/608280080.db2.gz CVXCKYAYONRGDK-OAHLLOKOSA-N -1 3 372.379 3.661 20 0 FHADHM C[C@@H](Nc1ccc(F)cc1OCC(F)F)c1ccc(-c2nnn[n-]2)cc1 ZINC000824655819 608287307 /nfs/dbraw/zinc/28/73/07/608287307.db2.gz FYFOWFMCNZXCJE-SNVBAGLBSA-N -1 3 363.343 3.823 20 0 FHADHM C[C@@H](Nc1ccc(F)cc1OCC(F)F)c1ccc(-c2nn[n-]n2)cc1 ZINC000824655819 608287309 /nfs/dbraw/zinc/28/73/09/608287309.db2.gz FYFOWFMCNZXCJE-SNVBAGLBSA-N -1 3 363.343 3.823 20 0 FHADHM CCc1c(C)sc(NC(=O)c2c(F)ccc(C)c2F)c1-c1nnn[n-]1 ZINC000825686925 608304923 /nfs/dbraw/zinc/30/49/23/608304923.db2.gz BSCQVMKQRNAMJE-UHFFFAOYSA-N -1 3 363.393 3.638 20 0 FHADHM CCc1c(C)sc(NC(=O)c2c(F)ccc(C)c2F)c1-c1nn[n-]n1 ZINC000825686925 608304925 /nfs/dbraw/zinc/30/49/25/608304925.db2.gz BSCQVMKQRNAMJE-UHFFFAOYSA-N -1 3 363.393 3.638 20 0 FHADHM O=C(NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1)c1ccsc1 ZINC000826441100 608306078 /nfs/dbraw/zinc/30/60/78/608306078.db2.gz OATXAVQYNNEHCD-UHFFFAOYSA-N -1 3 361.430 3.525 20 0 FHADHM O=C(NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1)c1ccsc1 ZINC000826441100 608306079 /nfs/dbraw/zinc/30/60/79/608306079.db2.gz OATXAVQYNNEHCD-UHFFFAOYSA-N -1 3 361.430 3.525 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CNc1ccc(F)cc1OC(C)(C)C ZINC000826170523 608320512 /nfs/dbraw/zinc/32/05/12/608320512.db2.gz CYPFXFNMKMWEAH-UHFFFAOYSA-N -1 3 371.416 3.804 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CNc1ccc(F)cc1OC(C)(C)C ZINC000826170523 608320514 /nfs/dbraw/zinc/32/05/14/608320514.db2.gz CYPFXFNMKMWEAH-UHFFFAOYSA-N -1 3 371.416 3.804 20 0 FHADHM CCCCS[C@@H](C)C(=O)N(CC)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825296457 608342258 /nfs/dbraw/zinc/34/22/58/608342258.db2.gz JTZNVRAINVFOPK-NSHDSACASA-N -1 3 367.906 3.795 20 0 FHADHM CCCCS[C@@H](C)C(=O)N(CC)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825296457 608342259 /nfs/dbraw/zinc/34/22/59/608342259.db2.gz JTZNVRAINVFOPK-NSHDSACASA-N -1 3 367.906 3.795 20 0 FHADHM CCN(C(=O)C=Cc1cccs1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825366563 608343200 /nfs/dbraw/zinc/34/32/00/608343200.db2.gz BZYUINITBYSICD-SOFGYWHQSA-N -1 3 359.842 3.648 20 0 FHADHM CCN(C(=O)C=Cc1cccs1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825366563 608343202 /nfs/dbraw/zinc/34/32/02/608343202.db2.gz BZYUINITBYSICD-SOFGYWHQSA-N -1 3 359.842 3.648 20 0 FHADHM O=C(OCc1cccc(-c2nnn[n-]2)c1F)c1cccc(Cl)c1Cl ZINC000826466458 608437428 /nfs/dbraw/zinc/43/74/28/608437428.db2.gz DNJJQVXMIGJRLA-UHFFFAOYSA-N -1 3 367.167 3.670 20 0 FHADHM O=C(OCc1cccc(-c2nn[n-]n2)c1F)c1cccc(Cl)c1Cl ZINC000826466458 608437429 /nfs/dbraw/zinc/43/74/29/608437429.db2.gz DNJJQVXMIGJRLA-UHFFFAOYSA-N -1 3 367.167 3.670 20 0 FHADHM FC(F)(F)c1cccc(N2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)n1 ZINC000826369158 608442286 /nfs/dbraw/zinc/44/22/86/608442286.db2.gz POPTYFKIGNQUMJ-UHFFFAOYSA-N -1 3 372.354 3.574 20 0 FHADHM FC(F)(F)c1cccc(N2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)n1 ZINC000826369158 608442288 /nfs/dbraw/zinc/44/22/88/608442288.db2.gz POPTYFKIGNQUMJ-UHFFFAOYSA-N -1 3 372.354 3.574 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)Nc1cccc(SC)c1C ZINC000826186514 608479075 /nfs/dbraw/zinc/47/90/75/608479075.db2.gz WNXRTXWLBJVURO-UHFFFAOYSA-N -1 3 370.438 3.550 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)Nc1cccc(SC)c1C ZINC000826186514 608479076 /nfs/dbraw/zinc/47/90/76/608479076.db2.gz WNXRTXWLBJVURO-UHFFFAOYSA-N -1 3 370.438 3.550 20 0 FHADHM Fc1c(CNc2cccc(OC(F)(F)F)c2)cccc1-c1nnn[n-]1 ZINC000826371150 608480002 /nfs/dbraw/zinc/48/00/02/608480002.db2.gz VHORQOKUQPTFDN-UHFFFAOYSA-N -1 3 353.279 3.517 20 0 FHADHM Fc1c(CNc2cccc(OC(F)(F)F)c2)cccc1-c1nn[n-]n1 ZINC000826371150 608480004 /nfs/dbraw/zinc/48/00/04/608480004.db2.gz VHORQOKUQPTFDN-UHFFFAOYSA-N -1 3 353.279 3.517 20 0 FHADHM Fc1c(CNc2cccc(CC(F)(F)F)c2)cccc1-c1nnn[n-]1 ZINC000826371269 608481319 /nfs/dbraw/zinc/48/13/19/608481319.db2.gz ZIPXPOMXXICLPA-UHFFFAOYSA-N -1 3 351.307 3.723 20 0 FHADHM Fc1c(CNc2cccc(CC(F)(F)F)c2)cccc1-c1nn[n-]n1 ZINC000826371269 608481321 /nfs/dbraw/zinc/48/13/21/608481321.db2.gz ZIPXPOMXXICLPA-UHFFFAOYSA-N -1 3 351.307 3.723 20 0 FHADHM C[C@H](NCc1ncc(-c2cccc(F)c2)o1)c1cccc(-c2nn[n-]n2)c1 ZINC000824634670 608482395 /nfs/dbraw/zinc/48/23/95/608482395.db2.gz WNBFRVDLJJWTQX-LBPRGKRZSA-N -1 3 364.384 3.512 20 0 FHADHM CC(=CC(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1)c1ccccc1 ZINC000823943751 608484215 /nfs/dbraw/zinc/48/42/15/608484215.db2.gz SHZJFUUMWFYNRQ-FOCLMDBBSA-N -1 3 371.444 3.586 20 0 FHADHM CC(=CC(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1)c1ccccc1 ZINC000823943751 608484217 /nfs/dbraw/zinc/48/42/17/608484217.db2.gz SHZJFUUMWFYNRQ-FOCLMDBBSA-N -1 3 371.444 3.586 20 0 FHADHM CSc1cccc(NC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1C ZINC000826231166 608518167 /nfs/dbraw/zinc/51/81/67/608518167.db2.gz ZXIBJAVVUDWIKP-LBPRGKRZSA-N -1 3 368.466 3.780 20 0 FHADHM CSc1cccc(NC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1C ZINC000826231166 608518169 /nfs/dbraw/zinc/51/81/69/608518169.db2.gz ZXIBJAVVUDWIKP-LBPRGKRZSA-N -1 3 368.466 3.780 20 0 FHADHM O=C(Nc1cccc(Cl)c1F)c1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000826456582 608574008 /nfs/dbraw/zinc/57/40/08/608574008.db2.gz MUZKYDKWGVDJDX-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1cccc(Cl)c1F)c1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000826456582 608574009 /nfs/dbraw/zinc/57/40/09/608574009.db2.gz MUZKYDKWGVDJDX-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(c1ccc(Cl)c(-c2nnn[n-]2)c1)N1CCCCC[C@H]1c1ccco1 ZINC000826473381 608577078 /nfs/dbraw/zinc/57/70/78/608577078.db2.gz WEDSFVITTXEPQM-HNNXBMFYSA-N -1 3 371.828 3.871 20 0 FHADHM O=C(c1ccc(Cl)c(-c2nn[n-]n2)c1)N1CCCCC[C@H]1c1ccco1 ZINC000826473381 608577080 /nfs/dbraw/zinc/57/70/80/608577080.db2.gz WEDSFVITTXEPQM-HNNXBMFYSA-N -1 3 371.828 3.871 20 0 FHADHM CSc1ccc(C)c(NC(=O)CSc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000826230155 608591707 /nfs/dbraw/zinc/59/17/07/608591707.db2.gz HEASZQOHJOLQBJ-UHFFFAOYSA-N -1 3 371.491 3.628 20 0 FHADHM CSc1ccc(C)c(NC(=O)CSc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000826230155 608591708 /nfs/dbraw/zinc/59/17/08/608591708.db2.gz HEASZQOHJOLQBJ-UHFFFAOYSA-N -1 3 371.491 3.628 20 0 FHADHM Cc1ccc([C@H]2CSCCN2Cc2cccc(-c3nnn[n-]3)c2F)cc1 ZINC000826285619 608651634 /nfs/dbraw/zinc/65/16/34/608651634.db2.gz FBZFOGCWFLTLIZ-QGZVFWFLSA-N -1 3 369.469 3.604 20 0 FHADHM Cc1ccc([C@H]2CSCCN2Cc2cccc(-c3nn[n-]n3)c2F)cc1 ZINC000826285619 608651636 /nfs/dbraw/zinc/65/16/36/608651636.db2.gz FBZFOGCWFLTLIZ-QGZVFWFLSA-N -1 3 369.469 3.604 20 0 FHADHM Cc1ccc(C)c([C@@H]2CN(Cc3cc(-c4nnn[n-]4)cs3)[C@H](C)CO2)c1 ZINC000826284976 608729246 /nfs/dbraw/zinc/72/92/46/608729246.db2.gz MKTCKUXHVAYNKS-KDOFPFPSSA-N -1 3 369.494 3.507 20 0 FHADHM Cc1ccc(C)c([C@@H]2CN(Cc3cc(-c4nn[n-]n4)cs3)[C@H](C)CO2)c1 ZINC000826284976 608729249 /nfs/dbraw/zinc/72/92/49/608729249.db2.gz MKTCKUXHVAYNKS-KDOFPFPSSA-N -1 3 369.494 3.507 20 0 FHADHM Cc1cc(C)cc(C2=CCN(C(=O)Nc3cccc(-c4nnn[n-]4)c3)CC2)c1 ZINC000826264106 608757557 /nfs/dbraw/zinc/75/75/57/608757557.db2.gz CCANLZFGMZWNKV-UHFFFAOYSA-N -1 3 374.448 3.805 20 0 FHADHM Cc1cc(C)cc(C2=CCN(C(=O)Nc3cccc(-c4nn[n-]n4)c3)CC2)c1 ZINC000826264106 608757559 /nfs/dbraw/zinc/75/75/59/608757559.db2.gz CCANLZFGMZWNKV-UHFFFAOYSA-N -1 3 374.448 3.805 20 0 FHADHM FC(F)(F)c1ccccc1C1=CCN(c2cnccc2-c2nnn[n-]2)CC1 ZINC000826369302 608791734 /nfs/dbraw/zinc/79/17/34/608791734.db2.gz WVXROCKFSYLFEO-UHFFFAOYSA-N -1 3 372.354 3.574 20 0 FHADHM FC(F)(F)c1ccccc1C1=CCN(c2cnccc2-c2nn[n-]n2)CC1 ZINC000826369302 608791735 /nfs/dbraw/zinc/79/17/35/608791735.db2.gz WVXROCKFSYLFEO-UHFFFAOYSA-N -1 3 372.354 3.574 20 0 FHADHM Fc1ccc([C@H]2CCCCN2Cc2ccc(-c3nnn[n-]3)s2)c(F)c1 ZINC000826374218 608847722 /nfs/dbraw/zinc/84/77/22/608847722.db2.gz QLKJKFPDNOEPMM-OAHLLOKOSA-N -1 3 361.421 3.934 20 0 FHADHM Fc1ccc([C@H]2CCCCN2Cc2ccc(-c3nn[n-]n3)s2)c(F)c1 ZINC000826374218 608847724 /nfs/dbraw/zinc/84/77/24/608847724.db2.gz QLKJKFPDNOEPMM-OAHLLOKOSA-N -1 3 361.421 3.934 20 0 FHADHM S=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)N[C@H]1CC12CCCCC2 ZINC000826512238 608884549 /nfs/dbraw/zinc/88/45/49/608884549.db2.gz UGCYHSFINZRQJZ-ZDUSSCGKSA-N -1 3 362.890 3.529 20 0 FHADHM S=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)N[C@H]1CC12CCCCC2 ZINC000826512238 608884551 /nfs/dbraw/zinc/88/45/51/608884551.db2.gz UGCYHSFINZRQJZ-ZDUSSCGKSA-N -1 3 362.890 3.529 20 0 FHADHM Cc1cnc([C@@H](C)Sc2nc(C)cc(C(F)(F)F)c2-c2nnn[n-]2)o1 ZINC000826262248 608885662 /nfs/dbraw/zinc/88/56/62/608885662.db2.gz JHHFKXPKWMMSSB-MRVPVSSYSA-N -1 3 370.360 3.739 20 0 FHADHM C[C@H](N[C@@H]1CCOc2c(Cl)cccc21)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824553538 609137996 /nfs/dbraw/zinc/13/79/96/609137996.db2.gz CKNPJNHICLAOPS-MGPLVRAMSA-N -1 3 373.819 3.834 20 0 FHADHM C[C@@H](NCc1nc(C(C)(C)C)cs1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824625788 609141294 /nfs/dbraw/zinc/14/12/94/609141294.db2.gz KAIZGKPVOSZISZ-SNVBAGLBSA-N -1 3 360.462 3.611 20 0 FHADHM C[C@@H](NCc1nc(C(C)(C)C)cs1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824625788 609141295 /nfs/dbraw/zinc/14/12/95/609141295.db2.gz KAIZGKPVOSZISZ-SNVBAGLBSA-N -1 3 360.462 3.611 20 0 FHADHM C[C@@H](Nc1cccc(Br)c1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824663172 609160912 /nfs/dbraw/zinc/16/09/12/609160912.db2.gz WFFWCISPYSKYNP-SECBINFHSA-N -1 3 362.206 3.941 20 0 FHADHM C[C@@H](Nc1cccc(Br)c1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824663172 609160914 /nfs/dbraw/zinc/16/09/14/609160914.db2.gz WFFWCISPYSKYNP-SECBINFHSA-N -1 3 362.206 3.941 20 0 FHADHM CC(C)C(=O)Nc1ccc(N[C@@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)cc1 ZINC000824185326 609161742 /nfs/dbraw/zinc/16/17/42/609161742.db2.gz VZZJHPMSKCDCFU-LBPRGKRZSA-N -1 3 368.416 3.773 20 0 FHADHM CC(C)C(=O)Nc1ccc(N[C@@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)cc1 ZINC000824185326 609161744 /nfs/dbraw/zinc/16/17/44/609161744.db2.gz VZZJHPMSKCDCFU-LBPRGKRZSA-N -1 3 368.416 3.773 20 0 FHADHM c1cc(N2CCCC2)ccc1N[C@@H]1CCCc2cc(-c3nn[n-]n3)ccc21 ZINC000826517147 609163987 /nfs/dbraw/zinc/16/39/87/609163987.db2.gz SPLXDOAESIUHBD-HXUWFJFHSA-N -1 3 360.465 3.956 20 0 FHADHM Fc1ccc2c(c1)OCCC[C@H]2Nc1c(F)cc(-c2nnn[n-]2)cc1F ZINC000826376343 609170063 /nfs/dbraw/zinc/17/00/63/609170063.db2.gz ZEMKTASNKWHPBQ-CQSZACIVSA-N -1 3 361.327 3.610 20 0 FHADHM Fc1ccc2c(c1)OCCC[C@H]2Nc1c(F)cc(-c2nn[n-]n2)cc1F ZINC000826376343 609170064 /nfs/dbraw/zinc/17/00/64/609170064.db2.gz ZEMKTASNKWHPBQ-CQSZACIVSA-N -1 3 361.327 3.610 20 0 FHADHM Cc1cc(NCc2cccc(-c3nnn[n-]3)c2)nn1-c1cc(C)cc(C)c1 ZINC000826264452 609180665 /nfs/dbraw/zinc/18/06/65/609180665.db2.gz OXEOBKVXGIQLAO-UHFFFAOYSA-N -1 3 359.437 3.590 20 0 FHADHM Cc1cc(NCc2cccc(-c3nn[n-]n3)c2)nn1-c1cc(C)cc(C)c1 ZINC000826264452 609180667 /nfs/dbraw/zinc/18/06/67/609180667.db2.gz OXEOBKVXGIQLAO-UHFFFAOYSA-N -1 3 359.437 3.590 20 0 FHADHM C[C@H](Nc1ccc(OC[C@H]2CCCO2)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000824655556 609236352 /nfs/dbraw/zinc/23/63/52/609236352.db2.gz DQKQDPWKSSCGIR-IFXJQAMLSA-N -1 3 365.437 3.598 20 0 FHADHM C[C@H](Nc1ccc(OC[C@H]2CCCO2)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000824655556 609236353 /nfs/dbraw/zinc/23/63/53/609236353.db2.gz DQKQDPWKSSCGIR-IFXJQAMLSA-N -1 3 365.437 3.598 20 0 FHADHM C[C@@H](Nc1cccc(OC[C@@H]2CCCO2)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824662833 609237014 /nfs/dbraw/zinc/23/70/14/609237014.db2.gz SBBMLQVGZZTTCM-KUHUBIRLSA-N -1 3 365.437 3.598 20 0 FHADHM C[C@@H](Nc1cccc(OC[C@@H]2CCCO2)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824662833 609237016 /nfs/dbraw/zinc/23/70/16/609237016.db2.gz SBBMLQVGZZTTCM-KUHUBIRLSA-N -1 3 365.437 3.598 20 0 FHADHM C[C@H](Nc1ccccc1OCC(F)F)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824662370 609243456 /nfs/dbraw/zinc/24/34/56/609243456.db2.gz IWOHGGFKWCLLDU-JTQLQIEISA-N -1 3 363.343 3.823 20 0 FHADHM C[C@H](Nc1ccccc1OCC(F)F)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824662370 609243459 /nfs/dbraw/zinc/24/34/59/609243459.db2.gz IWOHGGFKWCLLDU-JTQLQIEISA-N -1 3 363.343 3.823 20 0 FHADHM C[C@@H](Nc1ccn([C@H](C)c2ccccc2)n1)c1cccc(-c2nnn[n-]2)c1 ZINC000824663490 609245460 /nfs/dbraw/zinc/24/54/60/609245460.db2.gz ZVVIKWXEOYQCHV-HUUCEWRRSA-N -1 3 359.437 3.846 20 0 FHADHM C[C@@H](Nc1ccn([C@H](C)c2ccccc2)n1)c1cccc(-c2nn[n-]n2)c1 ZINC000824663490 609245461 /nfs/dbraw/zinc/24/54/61/609245461.db2.gz ZVVIKWXEOYQCHV-HUUCEWRRSA-N -1 3 359.437 3.846 20 0 FHADHM c1sc(CNc2ccc(OCc3ccccc3)nc2)cc1-c1nnn[n-]1 ZINC000826522331 609266557 /nfs/dbraw/zinc/26/65/57/609266557.db2.gz WHHFWHVULNJGRL-UHFFFAOYSA-N -1 3 364.434 3.514 20 0 FHADHM c1sc(CNc2ccc(OCc3ccccc3)nc2)cc1-c1nn[n-]n1 ZINC000826522331 609266558 /nfs/dbraw/zinc/26/65/58/609266558.db2.gz WHHFWHVULNJGRL-UHFFFAOYSA-N -1 3 364.434 3.514 20 0 FHADHM FCc1ccc(CNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)cc1 ZINC000826370201 609267896 /nfs/dbraw/zinc/26/78/96/609267896.db2.gz IBLCCTNTWYWEDK-UHFFFAOYSA-N -1 3 351.307 3.967 20 0 FHADHM FCc1ccc(CNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)cc1 ZINC000826370201 609267898 /nfs/dbraw/zinc/26/78/98/609267898.db2.gz IBLCCTNTWYWEDK-UHFFFAOYSA-N -1 3 351.307 3.967 20 0 FHADHM C[C@@H](Nc1ccc(-c2csnn2)cc1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824649513 609274361 /nfs/dbraw/zinc/27/43/61/609274361.db2.gz NCLYIGHPWYGNGF-SNVBAGLBSA-N -1 3 367.413 3.697 20 0 FHADHM C[C@@H](Nc1ccc(-c2csnn2)cc1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824649513 609274363 /nfs/dbraw/zinc/27/43/63/609274363.db2.gz NCLYIGHPWYGNGF-SNVBAGLBSA-N -1 3 367.413 3.697 20 0 FHADHM CCn1ncc2ccc(N[C@@H]3CCCc4cc(-c5nnn[n-]5)ccc43)cc21 ZINC000825806909 609276811 /nfs/dbraw/zinc/27/68/11/609276811.db2.gz JPCYZXCTMJACOJ-GOSISDBHSA-N -1 3 359.437 3.726 20 0 FHADHM CCn1ncc2ccc(N[C@@H]3CCCc4cc(-c5nn[n-]n5)ccc43)cc21 ZINC000825806909 609276812 /nfs/dbraw/zinc/27/68/12/609276812.db2.gz JPCYZXCTMJACOJ-GOSISDBHSA-N -1 3 359.437 3.726 20 0 FHADHM COc1cc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c(OC)cc1Cl ZINC000826180509 609279732 /nfs/dbraw/zinc/27/97/32/609279732.db2.gz KVHFAMSHZDOSRN-JTQLQIEISA-N -1 3 359.817 3.710 20 0 FHADHM COc1cc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c(OC)cc1Cl ZINC000826180509 609279733 /nfs/dbraw/zinc/27/97/33/609279733.db2.gz KVHFAMSHZDOSRN-JTQLQIEISA-N -1 3 359.817 3.710 20 0 FHADHM COc1cc(Br)cc(N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000826177087 609279757 /nfs/dbraw/zinc/27/97/57/609279757.db2.gz QUISDQQDGFXTPG-JTQLQIEISA-N -1 3 374.242 3.811 20 0 FHADHM COc1cc(Br)cc(N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000826177087 609279759 /nfs/dbraw/zinc/27/97/59/609279759.db2.gz QUISDQQDGFXTPG-JTQLQIEISA-N -1 3 374.242 3.811 20 0 FHADHM Cc1cnn(-c2ccc(N[C@@H](C)c3cccc(-c4nnn[n-]4)c3)cc2F)c1 ZINC000826319658 609280312 /nfs/dbraw/zinc/28/03/12/609280312.db2.gz MGEPTFJJLIQXBC-ZDUSSCGKSA-N -1 3 363.400 3.673 20 0 FHADHM Cc1cnn(-c2ccc(N[C@@H](C)c3cccc(-c4nn[n-]n4)c3)cc2F)c1 ZINC000826319658 609280313 /nfs/dbraw/zinc/28/03/13/609280313.db2.gz MGEPTFJJLIQXBC-ZDUSSCGKSA-N -1 3 363.400 3.673 20 0 FHADHM Cc1cccc([C@@H]2CCCN2C(=O)c2ccc(Cl)c(-c3nnn[n-]3)c2)c1 ZINC000826297958 609298764 /nfs/dbraw/zinc/29/87/64/609298764.db2.gz XWGNIRNYNOTJSS-KRWDZBQOSA-N -1 3 367.840 3.806 20 0 FHADHM Cc1cccc([C@@H]2CCCN2C(=O)c2ccc(Cl)c(-c3nn[n-]n3)c2)c1 ZINC000826297958 609298765 /nfs/dbraw/zinc/29/87/65/609298765.db2.gz XWGNIRNYNOTJSS-KRWDZBQOSA-N -1 3 367.840 3.806 20 0 FHADHM O=C(NC1(c2ccc(Cl)cc2)CC1)c1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000826427066 609300719 /nfs/dbraw/zinc/30/07/19/609300719.db2.gz FLATVFLJZXIRKZ-UHFFFAOYSA-N -1 3 374.231 3.593 20 0 FHADHM O=C(NC1(c2ccc(Cl)cc2)CC1)c1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000826427066 609300721 /nfs/dbraw/zinc/30/07/21/609300721.db2.gz FLATVFLJZXIRKZ-UHFFFAOYSA-N -1 3 374.231 3.593 20 0 FHADHM COCCC[C@@H](C)C(=O)Oc1ccc(-c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000826156357 609302483 /nfs/dbraw/zinc/30/24/83/609302483.db2.gz ZPQDMGKWCSTFLT-CQSZACIVSA-N -1 3 366.421 3.502 20 0 FHADHM COCCC[C@@H](C)C(=O)Oc1ccc(-c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000826156357 609302485 /nfs/dbraw/zinc/30/24/85/609302485.db2.gz ZPQDMGKWCSTFLT-CQSZACIVSA-N -1 3 366.421 3.502 20 0 FHADHM CCC[C@@H](C)N(C)C(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000825231818 609314274 /nfs/dbraw/zinc/31/42/74/609314274.db2.gz ALGDRTMQUIJMKV-CQSZACIVSA-N -1 3 365.437 3.920 20 0 FHADHM CCC[C@@H](C)N(C)C(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000825231818 609314276 /nfs/dbraw/zinc/31/42/76/609314276.db2.gz ALGDRTMQUIJMKV-CQSZACIVSA-N -1 3 365.437 3.920 20 0 FHADHM CC[C@@H](C)CN(C)C(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000825059421 609317760 /nfs/dbraw/zinc/31/77/60/609317760.db2.gz FIOPLEQHLVHEBN-CQSZACIVSA-N -1 3 365.437 3.777 20 0 FHADHM CC[C@@H](C)CN(C)C(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000825059421 609317762 /nfs/dbraw/zinc/31/77/62/609317762.db2.gz FIOPLEQHLVHEBN-CQSZACIVSA-N -1 3 365.437 3.777 20 0 FHADHM COc1ccc(C)cc1[C@H](C)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000826189752 609324171 /nfs/dbraw/zinc/32/41/71/609324171.db2.gz DHUNMAXXAJMKIC-STQMWFEESA-N -1 3 355.417 3.735 20 0 FHADHM Fc1cccc2c1OCCC[C@@H]2Nc1c(F)cc(-c2nnn[n-]2)cc1F ZINC000826371623 609324593 /nfs/dbraw/zinc/32/45/93/609324593.db2.gz MZDBQADKFFXWIV-AWEZNQCLSA-N -1 3 361.327 3.610 20 0 FHADHM Fc1cccc2c1OCCC[C@@H]2Nc1c(F)cc(-c2nn[n-]n2)cc1F ZINC000826371623 609324595 /nfs/dbraw/zinc/32/45/95/609324595.db2.gz MZDBQADKFFXWIV-AWEZNQCLSA-N -1 3 361.327 3.610 20 0 FHADHM C[C@@H]1CCN(C(=O)c2ccccc2Oc2ccccc2-c2nnn[n-]2)[C@@H]1C ZINC000824956462 609327160 /nfs/dbraw/zinc/32/71/60/609327160.db2.gz RKIYUYMANZQZPU-ZIAGYGMSSA-N -1 3 363.421 3.530 20 0 FHADHM C[C@@H]1CCN(C(=O)c2ccccc2Oc2ccccc2-c2nn[n-]n2)[C@@H]1C ZINC000824956462 609327162 /nfs/dbraw/zinc/32/71/62/609327162.db2.gz RKIYUYMANZQZPU-ZIAGYGMSSA-N -1 3 363.421 3.530 20 0 FHADHM C[C@@H](SCCOc1ccc(-c2nn[n-]n2)cc1)c1nc2ccccc2o1 ZINC000824757465 609328838 /nfs/dbraw/zinc/32/88/38/609328838.db2.gz XOHNFWBWFHNMEY-GFCCVEGCSA-N -1 3 367.434 3.881 20 0 FHADHM C[C@@H](SCCOc1cccc(-c2nnn[n-]2)c1)c1nc2ccccc2o1 ZINC000824752939 609328948 /nfs/dbraw/zinc/32/89/48/609328948.db2.gz AOAQBXBHOODMCH-GFCCVEGCSA-N -1 3 367.434 3.881 20 0 FHADHM C[C@@H](SCCOc1cccc(-c2nn[n-]n2)c1)c1nc2ccccc2o1 ZINC000824752939 609328950 /nfs/dbraw/zinc/32/89/50/609328950.db2.gz AOAQBXBHOODMCH-GFCCVEGCSA-N -1 3 367.434 3.881 20 0 FHADHM C[C@H](SCCOc1cccc(-c2nnn[n-]2)c1)c1nc2ccccc2o1 ZINC000824752962 609329107 /nfs/dbraw/zinc/32/91/07/609329107.db2.gz AOAQBXBHOODMCH-LBPRGKRZSA-N -1 3 367.434 3.881 20 0 FHADHM C[C@H](SCCOc1cccc(-c2nn[n-]n2)c1)c1nc2ccccc2o1 ZINC000824752962 609329109 /nfs/dbraw/zinc/32/91/09/609329109.db2.gz AOAQBXBHOODMCH-LBPRGKRZSA-N -1 3 367.434 3.881 20 0 FHADHM CC(C)COC[C@@H](N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1F)c1ccco1 ZINC000824266792 609331629 /nfs/dbraw/zinc/33/16/29/609331629.db2.gz QIJNBZPKWLNGLX-SUMWQHHRSA-N -1 3 373.432 3.663 20 0 FHADHM CC(C)COC[C@@H](N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1F)c1ccco1 ZINC000824266792 609331631 /nfs/dbraw/zinc/33/16/31/609331631.db2.gz QIJNBZPKWLNGLX-SUMWQHHRSA-N -1 3 373.432 3.663 20 0 FHADHM C[C@H](Nc1ccc2c(c1)CC(C)(C)O2)c1ccc(-c2nnn[n-]2)cc1F ZINC000824658017 609348771 /nfs/dbraw/zinc/34/87/71/609348771.db2.gz UEFCBIIHAYDIGN-NSHDSACASA-N -1 3 353.401 3.892 20 0 FHADHM C[C@H](Nc1ccc2c(c1)CC(C)(C)O2)c1ccc(-c2nn[n-]n2)cc1F ZINC000824658017 609348772 /nfs/dbraw/zinc/34/87/72/609348772.db2.gz UEFCBIIHAYDIGN-NSHDSACASA-N -1 3 353.401 3.892 20 0 FHADHM C[C@H](Nc1ccc(N2CCCCC2)nc1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824656136 609348786 /nfs/dbraw/zinc/34/87/86/609348786.db2.gz IAKWGDLRXJBUOS-ZDUSSCGKSA-N -1 3 367.432 3.564 20 0 FHADHM C[C@H](Nc1ccc(N2CCCCC2)nc1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824656136 609348788 /nfs/dbraw/zinc/34/87/88/609348788.db2.gz IAKWGDLRXJBUOS-ZDUSSCGKSA-N -1 3 367.432 3.564 20 0 FHADHM CCOc1ccc(OCC)c(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2F)c1 ZINC000825643794 609349606 /nfs/dbraw/zinc/34/96/06/609349606.db2.gz VHQBROSJLQNIAE-LBPRGKRZSA-N -1 3 371.416 3.976 20 0 FHADHM CCOc1ccc(OCC)c(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2F)c1 ZINC000825643794 609349608 /nfs/dbraw/zinc/34/96/08/609349608.db2.gz VHQBROSJLQNIAE-LBPRGKRZSA-N -1 3 371.416 3.976 20 0 FHADHM CCn1ncc2ccc(N[C@H](C)c3ccc(-c4nnn[n-]4)cc3F)cc21 ZINC000825807510 609349694 /nfs/dbraw/zinc/34/96/94/609349694.db2.gz RMAIQWUWGJGBSW-LLVKDONJSA-N -1 3 351.389 3.549 20 0 FHADHM CCn1ncc2ccc(N[C@H](C)c3ccc(-c4nn[n-]n4)cc3F)cc21 ZINC000825807510 609349696 /nfs/dbraw/zinc/34/96/96/609349696.db2.gz RMAIQWUWGJGBSW-LLVKDONJSA-N -1 3 351.389 3.549 20 0 FHADHM COc1ccc(OC(C)C)c(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2F)c1 ZINC000826210136 609349734 /nfs/dbraw/zinc/34/97/34/609349734.db2.gz GBBWADVOCAHQLQ-LBPRGKRZSA-N -1 3 371.416 3.975 20 0 FHADHM COc1ccc(OC(C)C)c(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2F)c1 ZINC000826210136 609349736 /nfs/dbraw/zinc/34/97/36/609349736.db2.gz GBBWADVOCAHQLQ-LBPRGKRZSA-N -1 3 371.416 3.975 20 0 FHADHM C[C@H]1CCCN(C(=O)c2ccccc2Oc2ccccc2-c2nnn[n-]2)C1 ZINC000824936509 609360941 /nfs/dbraw/zinc/36/09/41/609360941.db2.gz IJLHWLWAGRVBLT-AWEZNQCLSA-N -1 3 363.421 3.531 20 0 FHADHM C[C@H]1CCCN(C(=O)c2ccccc2Oc2ccccc2-c2nn[n-]n2)C1 ZINC000824936509 609360944 /nfs/dbraw/zinc/36/09/44/609360944.db2.gz IJLHWLWAGRVBLT-AWEZNQCLSA-N -1 3 363.421 3.531 20 0 FHADHM O=C(Nc1cccc(O)c1)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000826457235 609362397 /nfs/dbraw/zinc/36/23/97/609362397.db2.gz SIGMAJOWOFKFDJ-UHFFFAOYSA-N -1 3 373.372 3.617 20 0 FHADHM O=C(Nc1cccc(O)c1)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000826457235 609362399 /nfs/dbraw/zinc/36/23/99/609362399.db2.gz SIGMAJOWOFKFDJ-UHFFFAOYSA-N -1 3 373.372 3.617 20 0 FHADHM CC(C)[C@@H]1CCN1C(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000824222959 609395829 /nfs/dbraw/zinc/39/58/29/609395829.db2.gz DGVGQLSHRYCYHV-INIZCTEOSA-N -1 3 363.421 3.530 20 0 FHADHM CC(C)[C@@H]1CCN1C(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000824222959 609395832 /nfs/dbraw/zinc/39/58/32/609395832.db2.gz DGVGQLSHRYCYHV-INIZCTEOSA-N -1 3 363.421 3.530 20 0 FHADHM C[C@@H]1CC[C@@]2(CCN(C(=O)Nc3ccc(-c4nnn[n-]4)cc3Cl)C2)C1 ZINC000824919680 609405268 /nfs/dbraw/zinc/40/52/68/609405268.db2.gz WTOIJPDIKLLQPR-PIGZYNQJSA-N -1 3 360.849 3.564 20 0 FHADHM C[C@@H]1CC[C@@]2(CCN(C(=O)Nc3ccc(-c4nn[n-]n4)cc3Cl)C2)C1 ZINC000824919680 609405269 /nfs/dbraw/zinc/40/52/69/609405269.db2.gz WTOIJPDIKLLQPR-PIGZYNQJSA-N -1 3 360.849 3.564 20 0 FHADHM Cc1nc(C(=O)Nc2cccc(-c3nnn[n-]3)c2)c(-c2ccccc2)s1 ZINC000484761641 609407162 /nfs/dbraw/zinc/40/71/62/609407162.db2.gz LRAYELZCSUYDJH-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1nc(C(=O)Nc2cccc(-c3nn[n-]n3)c2)c(-c2ccccc2)s1 ZINC000484761641 609407165 /nfs/dbraw/zinc/40/71/65/609407165.db2.gz LRAYELZCSUYDJH-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM CC(C)Nc1cc(F)ccc1NCCCOc1ccc(-c2nn[n-]n2)cc1 ZINC000824304591 609438429 /nfs/dbraw/zinc/43/84/29/609438429.db2.gz CAGUSCRIMPYJJH-UHFFFAOYSA-N -1 3 370.432 3.707 20 0 FHADHM CC(C)(C)Oc1c(F)cc(NCc2ccc(-c3nnn[n-]3)cc2)cc1F ZINC000824119125 609445071 /nfs/dbraw/zinc/44/50/71/609445071.db2.gz BRVAZZARXHBLAH-UHFFFAOYSA-N -1 3 359.380 3.934 20 0 FHADHM CC(C)(C)Oc1c(F)cc(NCc2ccc(-c3nn[n-]n3)cc2)cc1F ZINC000824119125 609445073 /nfs/dbraw/zinc/44/50/73/609445073.db2.gz BRVAZZARXHBLAH-UHFFFAOYSA-N -1 3 359.380 3.934 20 0 FHADHM Cc1ccccc1CNc1ccn(-c2ccc(-c3nn[n-]n3)cc2Cl)n1 ZINC000826307280 609446281 /nfs/dbraw/zinc/44/62/81/609446281.db2.gz BGVSJLHLCLZYKR-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)c1ccnc(SC(C)(C)C)c1 ZINC000826278865 609450801 /nfs/dbraw/zinc/45/08/01/609450801.db2.gz WKMCRTXIIFVCID-UHFFFAOYSA-N -1 3 368.466 3.713 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)c1ccnc(SC(C)(C)C)c1 ZINC000826278865 609450803 /nfs/dbraw/zinc/45/08/03/609450803.db2.gz WKMCRTXIIFVCID-UHFFFAOYSA-N -1 3 368.466 3.713 20 0 FHADHM C[C@H](Nc1ccc(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)cc1)c1ccccc1 ZINC000824658399 609451971 /nfs/dbraw/zinc/45/19/71/609451971.db2.gz WTTCQEOFPCUWRT-ZDUSSCGKSA-N -1 3 373.420 3.620 20 0 FHADHM C[C@H](Nc1ccc(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)cc1)c1ccccc1 ZINC000824658399 609451973 /nfs/dbraw/zinc/45/19/73/609451973.db2.gz WTTCQEOFPCUWRT-ZDUSSCGKSA-N -1 3 373.420 3.620 20 0 FHADHM Cc1nc(CCSc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)cs1 ZINC000826325544 609452837 /nfs/dbraw/zinc/45/28/37/609452837.db2.gz BJSFYEUYMIAYEX-UHFFFAOYSA-N -1 3 371.413 3.985 20 0 FHADHM Cc1nc(CCSc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)cs1 ZINC000826325544 609452838 /nfs/dbraw/zinc/45/28/38/609452838.db2.gz BJSFYEUYMIAYEX-UHFFFAOYSA-N -1 3 371.413 3.985 20 0 FHADHM Cc1nc(CSc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)cs1 ZINC000826326514 609452922 /nfs/dbraw/zinc/45/29/22/609452922.db2.gz SUJOXTMDCQTSPU-UHFFFAOYSA-N -1 3 357.386 3.943 20 0 FHADHM Cc1nc(CSc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)cs1 ZINC000826326514 609452923 /nfs/dbraw/zinc/45/29/23/609452923.db2.gz SUJOXTMDCQTSPU-UHFFFAOYSA-N -1 3 357.386 3.943 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NCC1=Cc2ccccc2OC1 ZINC000824324591 609478801 /nfs/dbraw/zinc/47/88/01/609478801.db2.gz QRVXXWRKHRQGEM-UHFFFAOYSA-N -1 3 363.421 3.542 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NCC1=Cc2ccccc2OC1 ZINC000824324591 609478802 /nfs/dbraw/zinc/47/88/02/609478802.db2.gz QRVXXWRKHRQGEM-UHFFFAOYSA-N -1 3 363.421 3.542 20 0 FHADHM CSc1c(F)cc(NCc2ccc(F)c(-c3nnn[n-]3)c2)cc1F ZINC000826230003 609481761 /nfs/dbraw/zinc/48/17/61/609481761.db2.gz ZNQXMRHPNJTPJN-UHFFFAOYSA-N -1 3 351.357 3.618 20 0 FHADHM CSc1c(F)cc(NCc2ccc(F)c(-c3nn[n-]n3)c2)cc1F ZINC000826230003 609481764 /nfs/dbraw/zinc/48/17/64/609481764.db2.gz ZNQXMRHPNJTPJN-UHFFFAOYSA-N -1 3 351.357 3.618 20 0 FHADHM COc1cc(CNc2cccc(-c3nnn[n-]3)c2C)c(SC)cc1OC ZINC000826179554 609484846 /nfs/dbraw/zinc/48/48/46/609484846.db2.gz TYPAQMDVSOOTNQ-UHFFFAOYSA-N -1 3 371.466 3.526 20 0 FHADHM COc1cc(CNc2cccc(-c3nn[n-]n3)c2C)c(SC)cc1OC ZINC000826179554 609484849 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FC(F)Oc1ccc(Cl)cc1CN=c1[n-]ncn1Cc1ccccc1 ZINC000547637383 927543610 /nfs/dbraw/zinc/54/36/10/927543610.db2.gz MBFJHBYBCXRROY-UHFFFAOYSA-N -1 3 364.783 3.615 20 0 FHADHM O=C(c1cc([O-])c2ccccc2c1)N(Cc1ccco1)C[C@H]1CCCO1 ZINC000426878242 937183712 /nfs/dbraw/zinc/18/37/12/937183712.db2.gz FJLFWFABBTUWQI-GOSISDBHSA-N -1 3 351.402 3.960 20 0 FHADHM CC[C@H](C)Oc1cc(CN[C@H](C(=O)[O-])c2cccc(F)c2)ccc1OC ZINC000683172830 927756744 /nfs/dbraw/zinc/75/67/44/927756744.db2.gz DVJYJFZNSMZADG-DJJJIMSYSA-N -1 3 361.413 3.927 20 0 FHADHM Cc1nn(-c2ccc(F)cc2)c(C)c1CNCc1cccc(C(=O)[O-])c1 ZINC000683176131 927773185 /nfs/dbraw/zinc/77/31/85/927773185.db2.gz HTRKSJWUBLUZSV-UHFFFAOYSA-N -1 3 353.397 3.616 20 0 FHADHM O=C(Nc1cccc(C2SCCS2)c1)c1cc2c(cc1[O-])OCO2 ZINC000728202885 928193988 /nfs/dbraw/zinc/19/39/88/928193988.db2.gz BYFYTPFTJMAFLU-UHFFFAOYSA-N -1 3 361.444 3.852 20 0 FHADHM Cc1nc(C)c(CCC(=O)Nc2ccc(C)c(OCCC(C)C)c2)c(=O)[n-]1 ZINC000157590039 928304176 /nfs/dbraw/zinc/30/41/76/928304176.db2.gz 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Cc1ccc(-c2ccncc2)cc1[N-]S(=O)(=O)c1ccc2c(c1)CCO2 ZINC000101850730 944435974 /nfs/dbraw/zinc/43/59/74/944435974.db2.gz BZYGYQSEDOBTGC-UHFFFAOYSA-N -1 3 366.442 3.793 20 0 FHADHM CN1CCN(C(=O)c2cc(CCc3ccccc3)ccc2[O-])c2cccnc21 ZINC000436573289 944436022 /nfs/dbraw/zinc/43/60/22/944436022.db2.gz JEBUCEOUABTJKI-UHFFFAOYSA-N -1 3 373.456 3.669 20 0 FHADHM COc1ccc(C(=O)N[C@H](C)c2ccc(-n3nc(C)cc3C)cc2)c([O-])c1 ZINC000436591947 944438175 /nfs/dbraw/zinc/43/81/75/944438175.db2.gz RYCCXOFLTJWPBX-OAHLLOKOSA-N -1 3 365.433 3.694 20 0 FHADHM CC(C)c1ccc(C(=O)NCCc2nc(C(F)(F)F)cs2)c([O-])c1 ZINC000436579275 944444576 /nfs/dbraw/zinc/44/45/76/944444576.db2.gz YVTMUYUWTYYIJL-UHFFFAOYSA-N -1 3 358.385 3.963 20 0 FHADHM Cc1nc(-c2ccc(CCNC(=O)c3ccc(O)cc3[O-])cc2)cs1 ZINC000436603932 944454362 /nfs/dbraw/zinc/45/43/62/944454362.db2.gz NFISFDDODFITQI-UHFFFAOYSA-N -1 3 354.431 3.502 20 0 FHADHM Cc1nc(C)c(CC(=O)N[C@@H](CC2CCCCC2)c2ccccc2)c(=O)[n-]1 ZINC000101877290 944456117 /nfs/dbraw/zinc/45/61/17/944456117.db2.gz AFGGWRNYAVSNJC-FQEVSTJZSA-N -1 3 367.493 3.757 20 0 FHADHM O=C1CCCc2[nH]c(=O)c(-c3nc(-c4ccc([O-])c5ccccc45)no3)cc21 ZINC000436613568 944461964 /nfs/dbraw/zinc/46/19/64/944461964.db2.gz RCPIRWWHRWINOZ-UHFFFAOYSA-N -1 3 373.368 3.882 20 0 FHADHM C[C@@H](COCC(F)(F)F)NC(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436613682 944463092 /nfs/dbraw/zinc/46/30/92/944463092.db2.gz WWJQZPAXRHFDRN-ZDUSSCGKSA-N -1 3 367.367 3.680 20 0 FHADHM CC[C@@H]1CN(C(=O)c2cc(Oc3ccccc3)ccc2[O-])C[C@@H](C)[S@]1=O ZINC000436624558 944466132 /nfs/dbraw/zinc/46/61/32/944466132.db2.gz JWIISJLFONWXEL-HNYKXUSYSA-N -1 3 373.474 3.556 20 0 FHADHM COc1cc(Cl)c(S(=O)(=O)[N-]CCCC(F)(F)F)cc1Cl ZINC000439242092 944470325 /nfs/dbraw/zinc/47/03/25/944470325.db2.gz YWUIUFIDVVCFHR-UHFFFAOYSA-N -1 3 366.188 3.623 20 0 FHADHM Cc1cc(=O)[n-]c(CNc2nc(C)nc3sc4c(c32)CCCCC4)n1 ZINC000894378370 944473946 /nfs/dbraw/zinc/47/39/46/944473946.db2.gz WGMYJUYCLHFLLB-UHFFFAOYSA-N -1 3 355.467 3.685 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)NCc2ccccc2OCCC(C)C)c1 ZINC000436634229 944474814 /nfs/dbraw/zinc/47/48/14/944474814.db2.gz KVLWNFOTPKZAQX-UHFFFAOYSA-N -1 3 370.449 3.706 20 0 FHADHM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2ccc(N3CCOCC3)cc2)cc1 ZINC000007055418 944479530 /nfs/dbraw/zinc/47/95/30/944479530.db2.gz OXFRBLWUBJUTOD-INIZCTEOSA-N -1 3 374.506 3.838 20 0 FHADHM O=C(N[C@@H]1CCO[C@@H](C2CC2)C1)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436654128 944486943 /nfs/dbraw/zinc/48/69/43/944486943.db2.gz DSYIFOPCBHNZKR-WIYYLYMNSA-N -1 3 351.446 3.670 20 0 FHADHM CC(C)COc1ccc(C=C([O-])Nc2nc(-c3ccccc3)ns2)cc1 ZINC000518538213 944489266 /nfs/dbraw/zinc/48/92/66/944489266.db2.gz ZTDJIZLNLWZQQX-UHFFFAOYSA-N -1 3 367.474 3.843 20 0 FHADHM Cn1cc2c(n1)CCC[C@H]2NC(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436674398 944508170 /nfs/dbraw/zinc/50/81/70/944508170.db2.gz HSTJRMFEXWNZML-LJQANCHMSA-N -1 3 361.445 3.524 20 0 FHADHM COC(=O)c1cc(C(=O)[N-]c2nc(-c3ccc(Cl)s3)cs2)no1 ZINC000439300062 944516903 /nfs/dbraw/zinc/51/69/03/944516903.db2.gz QRHDATQOUJCSLG-UHFFFAOYSA-N -1 3 369.811 3.552 20 0 FHADHM CC(C)c1ccc([C@@H](C)CC(=O)NCCNC(=O)c2ccc([O-])cc2)cc1 ZINC000436680601 944519458 /nfs/dbraw/zinc/51/94/58/944519458.db2.gz KONKNPUSCRGAHR-INIZCTEOSA-N -1 3 368.477 3.555 20 0 FHADHM CC[C@@H](C)Oc1cc(-c2noc(-c3cc(OC)c([O-])c(OC)c3)n2)ccn1 ZINC000436688232 944526836 /nfs/dbraw/zinc/52/68/36/944526836.db2.gz KCOSLRMTPWXTNT-LLVKDONJSA-N -1 3 371.393 3.699 20 0 FHADHM Cc1ccccc1-c1cc(=NC(=O)C(=O)Nc2cccc(C(C)C)c2)[nH][n-]1 ZINC000436692794 944531168 /nfs/dbraw/zinc/53/11/68/944531168.db2.gz OJPJAKBXGVEZPP-UHFFFAOYSA-N -1 3 362.433 3.508 20 0 FHADHM CCc1oc2ccccc2c1CN1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436697435 944537887 /nfs/dbraw/zinc/53/78/87/944537887.db2.gz MZRDEQIVBBVTCM-UHFFFAOYSA-N -1 3 364.445 3.659 20 0 FHADHM CC1(C)Cc2ccc(C(=O)Nc3ccc([C@H]4CCOC4)cc3)c([O-])c2O1 ZINC000436700783 944540340 /nfs/dbraw/zinc/54/03/40/944540340.db2.gz XKXSKFDNCJRLFY-HNNXBMFYSA-N -1 3 353.418 3.862 20 0 FHADHM Cc1nc2ccccc2c(SCc2noc(-c3ccccc3[O-])n2)n1 ZINC000436706990 944545814 /nfs/dbraw/zinc/54/58/14/944545814.db2.gz RDFQRYMIERFVST-UHFFFAOYSA-N -1 3 350.403 3.986 20 0 FHADHM CC[C@H](C)N[C@H](CNC(=O)c1cc(F)c([O-])c(Cl)c1)c1ccco1 ZINC000436713935 944552438 /nfs/dbraw/zinc/55/24/38/944552438.db2.gz DMPXAZGXADNSBU-IINYFYTJSA-N -1 3 354.809 3.637 20 0 FHADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CCC[C@@H]1[C@H]1CCCO1 ZINC000436715798 944554559 /nfs/dbraw/zinc/55/45/59/944554559.db2.gz QVQZYAXEBIHIHJ-TZIWHRDSSA-N -1 3 351.446 3.767 20 0 FHADHM C[C@H](NC(=O)c1c[n-]c2ccccc2c1=O)c1cccc(OC(F)F)c1 ZINC000516175562 944560360 /nfs/dbraw/zinc/56/03/60/944560360.db2.gz BEOWGPKAQDXHQR-NSHDSACASA-N -1 3 358.344 3.621 20 0 FHADHM CCN(C[C@@H]1CCCO1)C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436738488 944568472 /nfs/dbraw/zinc/56/84/72/944568472.db2.gz LTQPMYMXUVTRIZ-IBGZPJMESA-N -1 3 353.462 3.819 20 0 FHADHM COc1cc(OC)c(NC(=O)c2cccc(C)c2[O-])cc1Br ZINC000436742383 944572379 /nfs/dbraw/zinc/57/23/79/944572379.db2.gz VJYWJDJLJWFHKY-UHFFFAOYSA-N -1 3 366.211 3.733 20 0 FHADHM Cc1oncc1C(=O)Nc1ccc([O-])c(C(=O)N[C@H](C)CCCC(C)C)c1 ZINC000436730421 944577279 /nfs/dbraw/zinc/57/72/79/944577279.db2.gz WQSAJRUHKSPLRZ-CYBMUJFWSA-N -1 3 373.453 3.886 20 0 FHADHM CN1CCN(C(=O)c2ccc3ccccc3c2[O-])C[C@H]1Cc1ccccc1 ZINC000436731798 944577823 /nfs/dbraw/zinc/57/78/23/944577823.db2.gz MWZOPIGUKZETRV-LJQANCHMSA-N -1 3 360.457 3.544 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(C(=O)NCC(F)(F)F)cc2)c([O-])c1C ZINC000436759289 944582185 /nfs/dbraw/zinc/58/21/85/944582185.db2.gz WLODNWHDJDDTOJ-UHFFFAOYSA-N -1 3 366.339 3.553 20 0 FHADHM CCN(Cc1ccccc1Br)C(=O)c1ccc(OC)cc1[O-] ZINC000436761361 944583810 /nfs/dbraw/zinc/58/38/10/944583810.db2.gz YPQANJPLSCRZLS-UHFFFAOYSA-N -1 3 364.239 3.826 20 0 FHADHM O=C(CCCc1ccc([O-])c(F)c1)N1CCC(F)(c2cccnc2)CC1 ZINC000517766113 944586264 /nfs/dbraw/zinc/58/62/64/944586264.db2.gz OPLZLQNOBFIJKW-UHFFFAOYSA-N -1 3 360.404 3.736 20 0 FHADHM COc1cccc(C(=O)Nc2nnc(SCc3ccccc3)s2)c1[O-] ZINC000436746330 944586508 /nfs/dbraw/zinc/58/65/08/944586508.db2.gz YCQOYHFCNCPRQG-UHFFFAOYSA-N -1 3 373.459 3.797 20 0 FHADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CCC(CCCO)CC1 ZINC000436748833 944587591 /nfs/dbraw/zinc/58/75/91/944587591.db2.gz HQXGVVWIGSIIHZ-UHFFFAOYSA-N -1 3 353.462 3.608 20 0 FHADHM CCN(Cc1cccc(Br)c1)C(=O)c1ccc(OC)cc1[O-] ZINC000436751004 944589971 /nfs/dbraw/zinc/58/99/71/944589971.db2.gz YYBWBMVDIFDVCZ-UHFFFAOYSA-N -1 3 364.239 3.826 20 0 FHADHM CC(=O)Nc1ccc(NC(=O)c2ccc3c(c2[O-])OC(C)(C)C3)cc1Cl ZINC000436776471 944607568 /nfs/dbraw/zinc/60/75/68/944607568.db2.gz JGCSHGUGZPQIFE-UHFFFAOYSA-N -1 3 374.824 3.970 20 0 FHADHM CCCN(C(=O)c1cc(OC)c([O-])c(OC)c1)[C@H]1CCc2ccccc21 ZINC000436784133 944628454 /nfs/dbraw/zinc/62/84/54/944628454.db2.gz VXSFYJPTUSHHRY-KRWDZBQOSA-N -1 3 355.434 3.949 20 0 FHADHM CC[C@@H](Cc1ccc(Cl)cc1)NC(=O)c1cc(NC(C)=O)ccc1[O-] ZINC000436786471 944633997 /nfs/dbraw/zinc/63/39/97/944633997.db2.gz JGIVDBGWYLASFM-HNNXBMFYSA-N -1 3 360.841 3.755 20 0 FHADHM O=C(CCCc1ccc2ccccc2c1)NCc1ccc(-c2nnn[n-]2)cc1 ZINC000538295671 944638125 /nfs/dbraw/zinc/63/81/25/944638125.db2.gz CPERSAACDWLXAX-UHFFFAOYSA-N -1 3 371.444 3.659 20 0 FHADHM O=C(CCCc1ccc2ccccc2c1)NCc1ccc(-c2nn[n-]n2)cc1 ZINC000538295671 944638132 /nfs/dbraw/zinc/63/81/32/944638132.db2.gz CPERSAACDWLXAX-UHFFFAOYSA-N -1 3 371.444 3.659 20 0 FHADHM CC[C@@H](NC(=O)c1cc(NC(C)=O)ccc1[O-])c1ccc(Cl)s1 ZINC000436789311 944639733 /nfs/dbraw/zinc/63/97/33/944639733.db2.gz KKJNCXQWQYOIIJ-GFCCVEGCSA-N -1 3 352.843 3.947 20 0 FHADHM CCN(C)C(=O)c1cccc(NC(=O)c2ccc3c(c2[O-])CCCC3)c1 ZINC000436807999 944662838 /nfs/dbraw/zinc/66/28/38/944662838.db2.gz JYOKZJPCOWTXFX-UHFFFAOYSA-N -1 3 352.434 3.615 20 0 FHADHM COC(=O)c1ccc(-c2nc(CCc3c(Cl)cccc3Cl)no2)[n-]1 ZINC000426399733 944666490 /nfs/dbraw/zinc/66/64/90/944666490.db2.gz CLCFBMVWUPFSAX-UHFFFAOYSA-N -1 3 366.204 3.943 20 0 FHADHM Cc1cccc(C(=O)Nc2ccc(C(=O)N3CCCC[C@H]3C)cc2)c1[O-] ZINC000436810811 944667310 /nfs/dbraw/zinc/66/73/10/944667310.db2.gz YRSKZCDDBNYNEN-OAHLLOKOSA-N -1 3 352.434 3.968 20 0 FHADHM CC(=O)c1cccc(NC(=O)c2cc(Br)cn2C(C)C)c1[O-] ZINC000518740550 944670717 /nfs/dbraw/zinc/67/07/17/944670717.db2.gz GMENPEVIPCMPCP-UHFFFAOYSA-N -1 3 365.227 3.992 20 0 FHADHM CCc1ccc(C(=O)Nc2ccc3[nH]c([C@H]4CCCO4)nc3c2)c([O-])c1 ZINC000436827567 944673297 /nfs/dbraw/zinc/67/32/97/944673297.db2.gz KPYJXTIVMWPEJE-GOSISDBHSA-N -1 3 351.406 3.935 20 0 FHADHM CC(C)N(C(=O)c1cc(CCc2ccccc2)ccc1[O-])[C@H]1CCOC1 ZINC000436832879 944680181 /nfs/dbraw/zinc/68/01/81/944680181.db2.gz TXPMDLKASVDTTE-IBGZPJMESA-N -1 3 353.462 3.817 20 0 FHADHM CC[C@@H](C(=O)N=c1cc([C@@H]2CCCO2)[n-][nH]1)c1cccc(C(F)(F)F)c1 ZINC000473848727 944680760 /nfs/dbraw/zinc/68/07/60/944680760.db2.gz SXBPAOQDPCBRNE-HIFRSBDPSA-N -1 3 367.371 3.834 20 0 FHADHM CCc1ccc(-c2nc(-c3ccc(CN4CCOCC4)cc3)no2)c([O-])c1 ZINC000436837870 944686774 /nfs/dbraw/zinc/68/67/74/944686774.db2.gz LDVZZUAPDLZPLQ-UHFFFAOYSA-N -1 3 365.433 3.504 20 0 FHADHM Cn1cc([C@@H](NCc2cc([O-])cc(F)c2)c2ccc(F)c(Cl)c2)cn1 ZINC000364433272 944689004 /nfs/dbraw/zinc/68/90/04/944689004.db2.gz GRKPKRKEBWDBCR-SFHVURJKSA-N -1 3 363.795 3.937 20 0 FHADHM COc1ccc(NC(=O)c2cc(C)ccc2[O-])cc1Oc1ccc(C)nn1 ZINC000436838759 944704269 /nfs/dbraw/zinc/70/42/69/944704269.db2.gz OALYPIMDEPZEHB-UHFFFAOYSA-N -1 3 365.389 3.852 20 0 FHADHM CO[C@H]1CN(C(=O)c2cc(CCc3ccccc3)ccc2[O-])CC[C@@H]1C ZINC000436842471 944710238 /nfs/dbraw/zinc/71/02/38/944710238.db2.gz WPKOMOGRJBYNCM-KKSFZXQISA-N -1 3 353.462 3.674 20 0 FHADHM C[C@H](NC(=O)c1cc(=O)[n-]c(C2CC2)n1)c1cc(Cl)ccc1Cl ZINC000516313082 944713452 /nfs/dbraw/zinc/71/34/52/944713452.db2.gz JOEMZOZYGDQOPJ-QMMMGPOBSA-N -1 3 352.221 3.857 20 0 FHADHM COc1ccc([C@@H](CCC(=O)[O-])NCc2c[nH]c(-c3ccccc3)n2)cc1 ZINC000426722915 944723719 /nfs/dbraw/zinc/72/37/19/944723719.db2.gz XJCBRBUVVMTFAG-LJQANCHMSA-N -1 3 365.433 3.781 20 0 FHADHM COc1ccc([C@@H](CCC(=O)[O-])NCc2cnc(-c3ccccc3)[nH]2)cc1 ZINC000426722915 944723793 /nfs/dbraw/zinc/72/37/93/944723793.db2.gz XJCBRBUVVMTFAG-LJQANCHMSA-N -1 3 365.433 3.781 20 0 FHADHM COc1cc(CN[C@@H](c2ccccc2)[C@H](C)C(=O)[O-])cc(Cl)c1OC ZINC000426723571 944724670 /nfs/dbraw/zinc/72/46/70/944724670.db2.gz MPQCBCCRBGREHL-YVEFUNNKSA-N -1 3 363.841 3.909 20 0 FHADHM CCC(CC)(CNC(=O)c1cc(OC)c([O-])c(OC)c1)c1ccccc1 ZINC000436868454 944735556 /nfs/dbraw/zinc/73/55/56/944735556.db2.gz JKGFNGXHEVBYPU-UHFFFAOYSA-N -1 3 357.450 3.897 20 0 FHADHM O=C([O-])[C@@H](CSCCOc1ccccc1)NCc1ccsc1Cl ZINC000426731297 944741323 /nfs/dbraw/zinc/74/13/23/944741323.db2.gz OOLJIFMRBYHTQD-CQSZACIVSA-N -1 3 371.911 3.757 20 0 FHADHM O=C([O-])[C@H](CSCCOc1ccccc1)NCc1ccsc1Cl ZINC000426731296 944741798 /nfs/dbraw/zinc/74/17/98/944741798.db2.gz OOLJIFMRBYHTQD-AWEZNQCLSA-N -1 3 371.911 3.757 20 0 FHADHM C[C@H](NC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)C1CCCCC1 ZINC000736124724 944745039 /nfs/dbraw/zinc/74/50/39/944745039.db2.gz HOIUPJMAPPWXJR-JTQLQIEISA-N -1 3 364.906 3.775 20 0 FHADHM C[C@H](NC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)C1CCCCC1 ZINC000736124724 944745056 /nfs/dbraw/zinc/74/50/56/944745056.db2.gz HOIUPJMAPPWXJR-JTQLQIEISA-N -1 3 364.906 3.775 20 0 FHADHM COc1cccc(-c2nc(Cc3cc(Br)cs3)no2)c1[O-] ZINC000436885870 944760658 /nfs/dbraw/zinc/76/06/58/944760658.db2.gz FNSCITZAFSORHP-UHFFFAOYSA-N -1 3 367.224 3.866 20 0 FHADHM c1[n-][nH]c2ncnc(=Nc3ccc(Oc4ccnc5ccccc54)cc3)c1-2 ZINC000500401371 944766681 /nfs/dbraw/zinc/76/66/81/944766681.db2.gz VNUOGIBXDFJCQQ-UHFFFAOYSA-N -1 3 354.373 3.811 20 0 FHADHM Cc1nc(CCNC(=O)c2cc(CCc3ccccc3)ccc2[O-])c(C)o1 ZINC000436904056 944770976 /nfs/dbraw/zinc/77/09/76/944770976.db2.gz PNWLRKLPLIAQIG-UHFFFAOYSA-N -1 3 364.445 3.755 20 0 FHADHM COc1ccc(CN[C@@H](CCC(C)(C)C)C(=O)[O-])c(Br)c1O ZINC000426753502 944774211 /nfs/dbraw/zinc/77/42/11/944774211.db2.gz ITSTWFNZCGDOBP-NSHDSACASA-N -1 3 374.275 3.532 20 0 FHADHM COc1cccc(C(=O)Nc2ccc(Oc3ncccn3)cc2C)c1[O-] ZINC000436907246 944774922 /nfs/dbraw/zinc/77/49/22/944774922.db2.gz 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944806652 /nfs/dbraw/zinc/80/66/52/944806652.db2.gz GDPHQLJFDZVTNX-HNNXBMFYSA-N -1 3 352.203 3.894 20 0 FHADHM COCCCCc1noc(-c2cc(OCc3ccccc3)ccc2[O-])n1 ZINC000436921543 944806950 /nfs/dbraw/zinc/80/69/50/944806950.db2.gz VTXGBTGUENRIRQ-UHFFFAOYSA-N -1 3 354.406 3.990 20 0 FHADHM CCc1ccc([C@@H](NCc2ccc(OC(C)C)c(OC)c2)C(=O)[O-])cc1 ZINC000426795340 944818839 /nfs/dbraw/zinc/81/88/39/944818839.db2.gz WQNPQPREHOTJEI-HXUWFJFHSA-N -1 3 357.450 3.960 20 0 FHADHM CCOc1cc(C=Cc2cc(=O)[n-]c(-c3ccncc3)n2)cc(Cl)c1O ZINC000436932990 944819452 /nfs/dbraw/zinc/81/94/52/944819452.db2.gz PEMDXSMBSXPTAN-ONEGZZNKSA-N -1 3 369.808 3.760 20 0 FHADHM COc1ccc(CN(Cc2ccccc2)C(=O)c2ccc(O)cc2[O-])cc1 ZINC000436939349 944825826 /nfs/dbraw/zinc/82/58/26/944825826.db2.gz YZYCQPUTAHPWJC-UHFFFAOYSA-N -1 3 363.413 3.949 20 0 FHADHM CC(C)c1ccc([C@@H](CC(=O)[O-])NCc2ccc3c(c2)OCCO3)cc1 ZINC000426811695 944833022 /nfs/dbraw/zinc/83/30/22/944833022.db2.gz VIKUCHQUPDTEEF-GOSISDBHSA-N -1 3 355.434 3.887 20 0 FHADHM 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CC(C)Oc1ccccc1[C@H](C)NC(=O)c1c[n-]c2ccccc2c1=O ZINC000516594215 945055849 /nfs/dbraw/zinc/05/58/49/945055849.db2.gz RQUWUJUFNDNHAI-AWEZNQCLSA-N -1 3 350.418 3.806 20 0 FHADHM CC(=O)Nc1ccc([N-]S(=O)(=O)c2cc(C)c(F)cc2F)c(Cl)c1 ZINC000440279391 945372091 /nfs/dbraw/zinc/37/20/91/945372091.db2.gz SKFIFFHQAXQSQV-UHFFFAOYSA-N -1 3 374.796 3.686 20 0 FHADHM COc1cc(Br)c(CN[C@@H](C)CCCCC(=O)[O-])c(OC)c1 ZINC000426631511 945390523 /nfs/dbraw/zinc/39/05/23/945390523.db2.gz YGXWCHLESVRPDG-NSHDSACASA-N -1 3 374.275 3.589 20 0 FHADHM CCOCc1ccc([N-]S(=O)(=O)c2ccc3c(c2)CC(C)(C)O3)cc1 ZINC000440301974 945401827 /nfs/dbraw/zinc/40/18/27/945401827.db2.gz HWGVJTBDRAXOJU-UHFFFAOYSA-N -1 3 361.463 3.737 20 0 FHADHM C[C@H](NC(=O)N1CCC[C@@H](C(C)(C)C)CC1)c1cccc(-c2nnn[n-]2)c1 ZINC000820353094 945428354 /nfs/dbraw/zinc/42/83/54/945428354.db2.gz YBGXKKCKXJSDPI-WMLDXEAASA-N -1 3 370.501 3.786 20 0 FHADHM C[C@H](NC(=O)N1CCC[C@@H](C(C)(C)C)CC1)c1cccc(-c2nn[n-]n2)c1 ZINC000820353094 945428358 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C[C@@H](CO)[C@H]1CCCCN1Cc1nc(=O)c2c(-c3ccco3)csc2[n-]1 ZINC000661447856 946112976 /nfs/dbraw/zinc/11/29/76/946112976.db2.gz ZONCPOMQAYSCIZ-GXTWGEPZSA-N -1 3 373.478 3.640 20 0 FHADHM Fc1cccc(-c2cnc(COc3ccc(-c4nnn[n-]4)cc3Cl)o2)c1 ZINC000822786006 946172788 /nfs/dbraw/zinc/17/27/88/946172788.db2.gz ATIROEBGPCHSTE-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM Fc1cccc(-c2cnc(COc3ccc(-c4nn[n-]n4)cc3Cl)o2)c1 ZINC000822786006 946172791 /nfs/dbraw/zinc/17/27/91/946172791.db2.gz ATIROEBGPCHSTE-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM CCCC[C@@H](COC)[N-]S(=O)(=O)c1ccc(Cl)cc1C(F)(F)F ZINC000522970110 946180731 /nfs/dbraw/zinc/18/07/31/946180731.db2.gz SAPJOYTUHDHIEO-NSHDSACASA-N -1 3 373.824 3.842 20 0 FHADHM O=S(=O)([N-]Cc1ccc(F)cc1F)c1cc(Cl)ccc1Cl ZINC000520155171 946200535 /nfs/dbraw/zinc/20/05/35/946200535.db2.gz UKQCEEFPUOEOSX-UHFFFAOYSA-N -1 3 352.189 3.750 20 0 FHADHM CCNC(=O)c1cccc(NC(=O)c2cc(Cc3ccccc3)ccc2[O-])c1 ZINC000522992394 946205684 /nfs/dbraw/zinc/20/56/84/946205684.db2.gz 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946410690 /nfs/dbraw/zinc/41/06/90/946410690.db2.gz JVBXQDODYWLGIY-UHFFFAOYSA-N -1 3 362.315 3.616 20 0 FHADHM O=S(=O)([N-][C@H]1CCCc2occc21)c1ccc(F)cc1C(F)(F)F ZINC000103153540 946413208 /nfs/dbraw/zinc/41/32/08/946413208.db2.gz CVRVCDPUEFEVKL-LBPRGKRZSA-N -1 3 363.332 3.793 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H]3CCOC34CCCCC4)nc2)n1 ZINC000896992609 946417027 /nfs/dbraw/zinc/41/70/27/946417027.db2.gz VBZLFNSAXWABOE-INIZCTEOSA-N -1 3 354.454 3.710 20 0 FHADHM O=C(Nc1cccc(CC(F)(F)F)c1)Nc1cccc(-c2nnn[n-]2)c1 ZINC000823363902 946418133 /nfs/dbraw/zinc/41/81/33/946418133.db2.gz QXDYRCGDKMKAQN-UHFFFAOYSA-N -1 3 362.315 3.616 20 0 FHADHM O=C(Nc1cccc(CC(F)(F)F)c1)Nc1cccc(-c2nn[n-]n2)c1 ZINC000823363902 946418137 /nfs/dbraw/zinc/41/81/37/946418137.db2.gz QXDYRCGDKMKAQN-UHFFFAOYSA-N -1 3 362.315 3.616 20 0 FHADHM COCc1nc(CNCc2nc(C)ccc2[O-])c(-c2ccccc2)s1 ZINC000441335366 946440734 /nfs/dbraw/zinc/44/07/34/946440734.db2.gz FQQCNOUQXONHHD-UHFFFAOYSA-N -1 3 355.463 3.655 20 0 FHADHM c1ccc2c(c1)cccc2NCc1nnc(-c2cccc(-c3nnn[n-]3)c2)o1 ZINC000823738434 946475124 /nfs/dbraw/zinc/47/51/24/946475124.db2.gz VHUBVFSVPSOMOB-UHFFFAOYSA-N -1 3 369.388 3.682 20 0 FHADHM c1ccc2c(c1)cccc2NCc1nnc(-c2cccc(-c3nn[n-]n3)c2)o1 ZINC000823738434 946475136 /nfs/dbraw/zinc/47/51/36/946475136.db2.gz VHUBVFSVPSOMOB-UHFFFAOYSA-N -1 3 369.388 3.682 20 0 FHADHM CC(C)(C)SCCN[C@H](c1cccc(-c2nnn[n-]2)c1)C(F)(F)F ZINC000824124316 946600059 /nfs/dbraw/zinc/60/00/59/946600059.db2.gz SZTWALVLPVSFLT-GFCCVEGCSA-N -1 3 359.421 3.591 20 0 FHADHM CC(C)(C)SCCN[C@H](c1cccc(-c2nn[n-]n2)c1)C(F)(F)F ZINC000824124316 946600064 /nfs/dbraw/zinc/60/00/64/946600064.db2.gz SZTWALVLPVSFLT-GFCCVEGCSA-N -1 3 359.421 3.591 20 0 FHADHM CC(C)Cn1ncc(N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1C(F)F ZINC000824285051 946643769 /nfs/dbraw/zinc/64/37/69/946643769.db2.gz VAXYPGLUGMWPSA-LLVKDONJSA-N -1 3 361.400 3.830 20 0 FHADHM CC(C)Cn1ncc(N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1C(F)F ZINC000824285051 946643783 /nfs/dbraw/zinc/64/37/83/946643783.db2.gz VAXYPGLUGMWPSA-LLVKDONJSA-N -1 3 361.400 3.830 20 0 FHADHM Brc1cccc(-c2nnn[n-]2)c1NCc1coc2ccccc12 ZINC001573280122 946655471 /nfs/dbraw/zinc/65/54/71/946655471.db2.gz RCONILIETWWOSG-UHFFFAOYSA-N -1 3 370.210 3.988 20 0 FHADHM Brc1cccc(-c2nn[n-]n2)c1NCc1coc2ccccc12 ZINC001573280122 946655473 /nfs/dbraw/zinc/65/54/73/946655473.db2.gz RCONILIETWWOSG-UHFFFAOYSA-N -1 3 370.210 3.988 20 0 FHADHM Brc1ccc(-c2nnn[n-]2)c(Oc2nc3ccccc3o2)c1 ZINC001573280555 946663672 /nfs/dbraw/zinc/66/36/72/946663672.db2.gz UIJPKTIBJBVSFX-UHFFFAOYSA-N -1 3 358.155 3.563 20 0 FHADHM Brc1ccc(-c2nn[n-]n2)c(Oc2nc3ccccc3o2)c1 ZINC001573280555 946663674 /nfs/dbraw/zinc/66/36/74/946663674.db2.gz UIJPKTIBJBVSFX-UHFFFAOYSA-N -1 3 358.155 3.563 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N2CC[C@H](C)C[C@H]2c2ccc(C)o2)c1 ZINC000122913174 946673146 /nfs/dbraw/zinc/67/31/46/946673146.db2.gz KWEZADFIOWPZSM-SJCJKPOMSA-N -1 3 356.422 3.865 20 0 FHADHM C[C@@H](CCCc1ccccc1)C(=O)Nc1ccc(F)cc1-c1nnn[n-]1 ZINC000824400466 946679102 /nfs/dbraw/zinc/67/91/02/946679102.db2.gz ICSRLNLZRSYJLP-ZDUSSCGKSA-N -1 3 353.401 3.603 20 0 FHADHM C[C@@H](CCCc1ccccc1)C(=O)Nc1ccc(F)cc1-c1nn[n-]n1 ZINC000824400466 946679110 /nfs/dbraw/zinc/67/91/10/946679110.db2.gz ICSRLNLZRSYJLP-ZDUSSCGKSA-N -1 3 353.401 3.603 20 0 FHADHM O=C([N-]c1ncn(Cc2ccc(Cl)cc2)n1)c1cc(F)c(F)cc1F ZINC000151991984 946702248 /nfs/dbraw/zinc/70/22/48/946702248.db2.gz SSMNFCIPUAXIFS-UHFFFAOYSA-N -1 3 366.730 3.649 20 0 FHADHM CC(C)Cn1cc(C(=O)Nc2nnc(C(F)(F)F)[n-]2)c2ccccc21 ZINC000050603473 946714404 /nfs/dbraw/zinc/71/44/04/946714404.db2.gz ARFMUSMTGAPYQM-UHFFFAOYSA-N -1 3 351.332 3.687 20 0 FHADHM CC(C)Cn1cc(C(=O)Nc2nc(C(F)(F)F)n[n-]2)c2ccccc21 ZINC000050603473 946714411 /nfs/dbraw/zinc/71/44/11/946714411.db2.gz ARFMUSMTGAPYQM-UHFFFAOYSA-N -1 3 351.332 3.687 20 0 FHADHM CC1(C)CCCN(C(=O)c2cc(=O)c3cc(Br)ccc3[n-]2)C1 ZINC000112686074 946721445 /nfs/dbraw/zinc/72/14/45/946721445.db2.gz NRINANBCHSMUDM-UHFFFAOYSA-N -1 3 363.255 3.553 20 0 FHADHM C[C@@H](NC(=O)[C@@H](C)C1CC1)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824470436 946722307 /nfs/dbraw/zinc/72/23/07/946722307.db2.gz IDNFZGNKEUAQIB-UONOGXRCSA-N -1 3 361.449 3.757 20 0 FHADHM C[C@@H](NC(=O)[C@@H](C)C1CC1)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824470436 946722319 /nfs/dbraw/zinc/72/23/19/946722319.db2.gz IDNFZGNKEUAQIB-UONOGXRCSA-N -1 3 361.449 3.757 20 0 FHADHM C[C@@H](NC(=O)CC1CCC1)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824480201 946733167 /nfs/dbraw/zinc/73/31/67/946733167.db2.gz UOWYDPBFRCJPOK-CQSZACIVSA-N -1 3 361.449 3.901 20 0 FHADHM C[C@@H](NC(=O)CC1CCC1)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824480201 946733178 /nfs/dbraw/zinc/73/31/78/946733178.db2.gz UOWYDPBFRCJPOK-CQSZACIVSA-N -1 3 361.449 3.901 20 0 FHADHM Cc1ccc(Cl)c(S(=O)(=O)[N-]Cc2ccc3c(c2)CCO3)c1Cl ZINC000523106974 946767422 /nfs/dbraw/zinc/76/74/22/946767422.db2.gz UGDGUAPJRXUYTA-UHFFFAOYSA-N -1 3 372.273 3.715 20 0 FHADHM O=c1[n-]c(CN2CCC([C@@H]3CCCCO3)CC2)nc2c3ccccc3oc21 ZINC000661864148 946781318 /nfs/dbraw/zinc/78/13/18/946781318.db2.gz IVLJBOHGPMRWFA-INIZCTEOSA-N -1 3 367.449 3.863 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)CO[C@@H]3CCCC[C@@H]3C)c2)n1 ZINC000112793013 946787971 /nfs/dbraw/zinc/78/79/71/946787971.db2.gz OCTKERNCSVPCHY-KBXCAEBGSA-N -1 3 369.465 3.533 20 0 FHADHM CCN(C(=O)CCc1c(C)nc(C)[n-]c1=O)c1ccc(Cl)c(F)c1 ZINC000441420401 946798761 /nfs/dbraw/zinc/79/87/61/946798761.db2.gz LYEVXJNUWHHDID-UHFFFAOYSA-N -1 3 351.809 3.577 20 0 FHADHM CCCc1c(C(=O)NCc2ccc([O-])c(F)c2)cnn1-c1cccc(C)c1 ZINC000444335500 946803224 /nfs/dbraw/zinc/80/32/24/946803224.db2.gz AGNXRCFRQKCCOZ-UHFFFAOYSA-N -1 3 367.424 3.908 20 0 FHADHM CCC(CC)[C@H]1C[C@@H]([N-]S(=O)(=O)c2cc(C)c(Cl)s2)CCO1 ZINC000473939666 946806282 /nfs/dbraw/zinc/80/62/82/946806282.db2.gz XOMGRSVFGKYWKW-QWHCGFSZSA-N -1 3 365.948 3.972 20 0 FHADHM O=c1[n-]c(CN2CCC[C@@H]([C@H]3CCCCO3)C2)nc2c3ccccc3oc21 ZINC000661876381 946825050 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947166242 /nfs/dbraw/zinc/16/62/42/947166242.db2.gz ADOFHSDWYRABAQ-UHFFFAOYSA-N -1 3 369.856 3.733 20 0 FHADHM CCN(C(=O)Cc1cc(C)ccc1C)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825375924 947166249 /nfs/dbraw/zinc/16/62/49/947166249.db2.gz ADOFHSDWYRABAQ-UHFFFAOYSA-N -1 3 369.856 3.733 20 0 FHADHM CCN(CC)C(=O)N[C@H](C)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000825406048 947176766 /nfs/dbraw/zinc/17/67/66/947176766.db2.gz HIWPOVPAXLQTIM-CQSZACIVSA-N -1 3 364.453 3.646 20 0 FHADHM CCN(CC)C(=O)N[C@H](C)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000825406048 947176770 /nfs/dbraw/zinc/17/67/70/947176770.db2.gz HIWPOVPAXLQTIM-CQSZACIVSA-N -1 3 364.453 3.646 20 0 FHADHM Cc1nc(NC(=O)NN=c2ccc(Cl)n[n-]2)sc1-c1ccccc1 ZINC000125647416 947182406 /nfs/dbraw/zinc/18/24/06/947182406.db2.gz FZAMGKYTFANQRQ-UHFFFAOYSA-N -1 3 360.830 3.711 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N(C)Cc3ccc(F)c(F)c3)nc2)n1 ZINC000301152295 947205546 /nfs/dbraw/zinc/20/55/46/947205546.db2.gz AZZQMVMXDASOSE-UHFFFAOYSA-N -1 3 356.376 3.721 20 0 FHADHM O=C(N=c1cc(-c2ccncc2)[n-][nH]1)c1cccc(OC2CCCCC2)c1 ZINC000523409169 947218598 /nfs/dbraw/zinc/21/85/98/947218598.db2.gz JXUYORHKPRQBET-UHFFFAOYSA-N -1 3 362.433 3.857 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@@H](O)c3ccc(Cl)cc3)nc2)n1 ZINC000301193272 947226375 /nfs/dbraw/zinc/22/63/75/947226375.db2.gz XLJFGRCQQCXROG-MRXNPFEDSA-N -1 3 370.840 3.606 20 0 FHADHM CC[C@@H]1[C@H](C)CCN1C(=O)c1c[n-]c2ccc(Br)cc2c1=O ZINC000444363264 947229352 /nfs/dbraw/zinc/22/93/52/947229352.db2.gz IVKVWRDGIUBMKS-MEBBXXQBSA-N -1 3 363.255 3.551 20 0 FHADHM O=C(Nc1cc(Cl)ccc1[O-])C1CCN(c2ccnc(C3CC3)n2)CC1 ZINC000301246423 947248867 /nfs/dbraw/zinc/24/88/67/947248867.db2.gz OEKKEXSHIZBMLY-UHFFFAOYSA-N -1 3 372.856 3.568 20 0 FHADHM O=C([O-])[C@@H]1CN(Cc2ccc(Cl)cc2Br)C[C@H]1C1CC1 ZINC000652513971 947257677 /nfs/dbraw/zinc/25/76/77/947257677.db2.gz NXSUOZWBVOJRLY-QWHCGFSZSA-N -1 3 358.663 3.645 20 0 FHADHM O=C(c1cc(=O)c2ccccc2[n-]1)N1CCC2(CCc3ccccc3C2)CC1 ZINC000652527598 947270458 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CN(C(=O)CC1CCC(C(F)(F)F)CC1)c1ccccc1-c1nn[n-]n1 ZINC000825812726 947338292 /nfs/dbraw/zinc/33/82/92/947338292.db2.gz SBDHRUIQFUZMNU-UHFFFAOYSA-N -1 3 367.375 3.588 20 0 FHADHM Cc1csc(NC2CCN(C(=O)c3ccc(C(C)C)cc3[O-])CC2)n1 ZINC000331248372 947380933 /nfs/dbraw/zinc/38/09/33/947380933.db2.gz ULPZXOWLRMTRLV-UHFFFAOYSA-N -1 3 359.495 3.997 20 0 FHADHM Cc1cccc(C(=O)Nc2cccc3c2CN(CC(F)(F)F)C3)c1[O-] ZINC000188629887 947504558 /nfs/dbraw/zinc/50/45/58/947504558.db2.gz OXXDCZYBQFDMFB-UHFFFAOYSA-N -1 3 350.340 3.831 20 0 FHADHM CCOC(=O)c1ccc(NC(=O)Cc2ccccc2OC(C)C)c([O-])c1 ZINC000536336810 947533016 /nfs/dbraw/zinc/53/30/16/947533016.db2.gz QIUMWVNOIVARTE-UHFFFAOYSA-N -1 3 357.406 3.537 20 0 FHADHM CCOC(=O)c1ccc(NC(=O)Cc2c(F)cccc2Cl)c([O-])c1 ZINC000536337347 947534392 /nfs/dbraw/zinc/53/43/92/947534392.db2.gz XLMOCFZGJHYEHA-UHFFFAOYSA-N -1 3 351.761 3.543 20 0 FHADHM CC1(C(=O)[O-])CCN(Cc2oc3ccccc3c2Br)CC1 ZINC000662211938 947552727 /nfs/dbraw/zinc/55/27/27/947552727.db2.gz 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MVYSQPZVCSVTES-UWVGGRQHSA-N -1 3 369.284 3.886 20 0 FHADHM FC(F)(F)[C@@H](NCCC1=CCCCC1)c1cccc(-c2nnn[n-]2)c1 ZINC000826366906 948145830 /nfs/dbraw/zinc/14/58/30/948145830.db2.gz COYZAMINFKNEDB-HNNXBMFYSA-N -1 3 351.376 3.950 20 0 FHADHM FC(F)(F)[C@@H](NCCC1=CCCCC1)c1cccc(-c2nn[n-]n2)c1 ZINC000826366906 948145835 /nfs/dbraw/zinc/14/58/35/948145835.db2.gz COYZAMINFKNEDB-HNNXBMFYSA-N -1 3 351.376 3.950 20 0 FHADHM COc1ccc(CN2CCC[C@@H](C(C)(C)C(=O)[O-])C2)cc1Br ZINC000317270163 948146816 /nfs/dbraw/zinc/14/68/16/948146816.db2.gz NNVWUINUCANCEB-CYBMUJFWSA-N -1 3 370.287 3.781 20 0 FHADHM FC1(F)CCC[C@@H](Nc2ccc(Br)cc2-c2nnn[n-]2)C1 ZINC000826370083 948153492 /nfs/dbraw/zinc/15/34/92/948153492.db2.gz CTGSQCYETLQYJN-SECBINFHSA-N -1 3 358.190 3.619 20 0 FHADHM FC1(F)CCC[C@@H](Nc2ccc(Br)cc2-c2nn[n-]n2)C1 ZINC000826370083 948153499 /nfs/dbraw/zinc/15/34/99/948153499.db2.gz CTGSQCYETLQYJN-SECBINFHSA-N -1 3 358.190 3.619 20 0 FHADHM CC[C@H](C)C(=O)N1CCC[C@H](C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)C1 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Cc1ccc([C@H]2OCCC[C@H]2[N-]S(=O)(=O)c2ccc(Cl)s2)cc1 ZINC000467800794 948472933 /nfs/dbraw/zinc/47/29/33/948472933.db2.gz OPRZYKJULNURNT-CZUORRHYSA-N -1 3 371.911 3.909 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N2C[C@@H](c3ccc(C)cc3)C[C@H]2C)c1 ZINC000279087612 948485354 /nfs/dbraw/zinc/48/53/54/948485354.db2.gz UACAIMNECHIMPS-PBHICJAKSA-N -1 3 352.434 3.677 20 0 FHADHM Cc1cc2c(CC(=O)Nc3cccc(-c4nnn[n-]4)c3)csc2s1 ZINC001440736072 948518662 /nfs/dbraw/zinc/51/86/62/948518662.db2.gz JMYVTWRUBHYHKD-UHFFFAOYSA-N -1 3 355.448 3.633 20 0 FHADHM Cc1cc2c(CC(=O)Nc3cccc(-c4nn[n-]n4)c3)csc2s1 ZINC001440736072 948518669 /nfs/dbraw/zinc/51/86/69/948518669.db2.gz JMYVTWRUBHYHKD-UHFFFAOYSA-N -1 3 355.448 3.633 20 0 FHADHM CC(C)c1ccccc1S(=O)(=O)[N-]c1cccc2c1OCC[C@@H]2N(C)C ZINC000432488948 948563794 /nfs/dbraw/zinc/56/37/94/948563794.db2.gz MMVGUKCBSCGQIX-SFHVURJKSA-N -1 3 374.506 3.996 20 0 FHADHM C[C@@H](c1ccc(OC(F)(F)F)cc1)N1CC[C@@](C(=O)[O-])(C(F)(F)F)C1 ZINC000327135833 948572438 /nfs/dbraw/zinc/57/24/38/948572438.db2.gz UHMFINCIFRPDAH-TVQRCGJNSA-N -1 3 371.277 3.985 20 0 FHADHM CC(C)Cc1ccc([C@H](C)C(=O)Nc2ccc(Cc3nnn[n-]3)cc2)cc1 ZINC000429805832 948632065 /nfs/dbraw/zinc/63/20/65/948632065.db2.gz AZFOLTGFVSNNAY-HNNXBMFYSA-N -1 3 363.465 3.731 20 0 FHADHM CC(C)Cc1ccc([C@H](C)C(=O)Nc2ccc(Cc3nn[n-]n3)cc2)cc1 ZINC000429805832 948632075 /nfs/dbraw/zinc/63/20/75/948632075.db2.gz AZFOLTGFVSNNAY-HNNXBMFYSA-N -1 3 363.465 3.731 20 0 FHADHM O=C([N-]c1nnc(C(F)F)s1)c1ccc(C(F)(F)F)nc1Cl ZINC000178548416 948670976 /nfs/dbraw/zinc/67/09/76/948670976.db2.gz IINDTKXQHFWGTL-UHFFFAOYSA-N -1 3 358.679 3.795 20 0 FHADHM C[C@H]([N-]S(=O)(=O)c1ccc(F)cc1F)c1nc(C(C)(C)C)cs1 ZINC000106893400 948710217 /nfs/dbraw/zinc/71/02/17/948710217.db2.gz DYCWGLVKVRWNIB-VIFPVBQESA-N -1 3 360.451 3.758 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)C(C)(C)CC2)c1ccsc1 ZINC001573754245 948739603 /nfs/dbraw/zinc/73/96/03/948739603.db2.gz CYXPLGYTSPCCNT-VIFPVBQESA-N -1 3 373.507 3.956 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)C(C)(C)CC2)c1ccsc1 ZINC001573754245 948739610 /nfs/dbraw/zinc/73/96/10/948739610.db2.gz CYXPLGYTSPCCNT-VIFPVBQESA-N -1 3 373.507 3.956 20 0 FHADHM CC(C)c1ccc2c(c1)CCN(Cc1ccc(F)c(-c3nnn[n-]3)c1)C2 ZINC001574418149 948772261 /nfs/dbraw/zinc/77/22/61/948772261.db2.gz SXZPZLFGQFQBEL-UHFFFAOYSA-N -1 3 351.429 3.688 20 0 FHADHM CC(C)c1cccc(Oc2cc(-c3nnn[n-]3)c(Br)cn2)c1 ZINC001574419304 948781264 /nfs/dbraw/zinc/78/12/64/948781264.db2.gz ADVREAAIUPCPSG-UHFFFAOYSA-N -1 3 360.215 3.940 20 0 FHADHM CC(C)c1cccc(Oc2cc(-c3nn[n-]n3)c(Br)cn2)c1 ZINC001574419304 948781275 /nfs/dbraw/zinc/78/12/75/948781275.db2.gz ADVREAAIUPCPSG-UHFFFAOYSA-N -1 3 360.215 3.940 20 0 FHADHM Cc1c2cc(F)ccc2oc1CNC(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000524018519 948786004 /nfs/dbraw/zinc/78/60/04/948786004.db2.gz ZTNSNMYFRPSTNL-UHFFFAOYSA-N -1 3 350.349 3.652 20 0 FHADHM Cc1ccc(NC(=O)c2ccc(I)cc2)c([O-])c1 ZINC000006839456 210091025 /nfs/dbraw/zinc/09/10/25/210091025.db2.gz QMOZTEHNRMYUIL-UHFFFAOYSA-N -1 3 353.159 3.558 20 0 FHADHM CS(=O)(=O)c1ccc(F)c([N-]C(=O)c2cc(Cl)sc2Cl)c1 ZINC000024594581 211408559 /nfs/dbraw/zinc/40/85/59/211408559.db2.gz WRDHZARAGYOYEU-UHFFFAOYSA-N -1 3 368.238 3.850 20 0 FHADHM O=S(=O)([N-]c1ccc(F)c(F)c1F)c1cccc(OC(F)(F)F)c1 ZINC000022957364 211370897 /nfs/dbraw/zinc/37/08/97/211370897.db2.gz GKYLHSNMFHTJEJ-UHFFFAOYSA-N -1 3 371.258 3.803 20 0 FHADHM Cc1cc(S(=O)(=O)[N-]c2ccc(N(C)C)cc2)ccc1Br ZINC000037385726 211159826 /nfs/dbraw/zinc/15/98/26/211159826.db2.gz XUMMGCJWIATCFU-UHFFFAOYSA-N -1 3 369.284 3.624 20 0 FHADHM CCc1ccc(S(=O)(=O)[N-]c2ccc3nc([C@H]4CCCO4)[nH]c3c2)cc1 ZINC000065857454 221236952 /nfs/dbraw/zinc/23/69/52/221236952.db2.gz RTGIJIDEVUHZRM-GOSISDBHSA-N -1 3 371.462 3.778 20 0 FHADHM COc1ccc(Cl)c([N-]S(=O)(=O)c2ccc(F)c3ncccc23)c1 ZINC000068239320 221313876 /nfs/dbraw/zinc/31/38/76/221313876.db2.gz HDCRUKGAUMMTGC-UHFFFAOYSA-N -1 3 366.801 3.837 20 0 FHADHM CCOc1ccc(S(=O)(=O)[N-]c2ccc(C)c(Br)c2)cc1 ZINC000071848728 221382591 /nfs/dbraw/zinc/38/25/91/221382591.db2.gz ODARJRZLKRGXAD-UHFFFAOYSA-N -1 3 370.268 3.957 20 0 FHADHM CC(=O)c1ccc(S(=O)(=O)[N-]c2ccc3nc(C(C)(C)C)[nH]c3c2)cc1 ZINC000098068706 222225424 /nfs/dbraw/zinc/22/54/24/222225424.db2.gz PRRSAXJVGWVZHY-UHFFFAOYSA-N -1 3 371.462 3.864 20 0 FHADHM O=S(=O)([N-]CC1(c2ccccc2)CCC1)c1ccc(F)cc1Cl ZINC000105766341 222374983 /nfs/dbraw/zinc/37/49/83/222374983.db2.gz CKHKUWHKJOBTKZ-UHFFFAOYSA-N -1 3 353.846 3.879 20 0 FHADHM CC(C)Cc1n[n-]c(=NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)s1 ZINC000503052423 514897790 /nfs/dbraw/zinc/89/77/90/514897790.db2.gz LATDEICEEIATAM-INIZCTEOSA-N -1 3 373.526 3.523 20 0 FHADHM CSC1(CNC(=O)N=c2cc3ccc(Br)cn3[n-]2)CCC1 ZINC000482181532 515598811 /nfs/dbraw/zinc/59/88/11/515598811.db2.gz DHLBWQJSGISNIQ-UHFFFAOYSA-N -1 3 369.288 3.504 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NCCSCC(F)(F)F)nc2)n1 ZINC000539885083 516338083 /nfs/dbraw/zinc/33/80/83/516338083.db2.gz KBENTKCWCFVCIN-UHFFFAOYSA-N -1 3 358.389 3.514 20 0 FHADHM Cc1cccc(CC(=O)N=c2cc([C@H]3CCCO3)[n-][nH]2)c1Br ZINC000529517654 517193274 /nfs/dbraw/zinc/19/32/74/517193274.db2.gz JUWMWPOFKMBUJS-CYBMUJFWSA-N -1 3 364.243 3.513 20 0 FHADHM Cc1nc(-c2ncccn2)sc1C(=O)N=c1cc(-c2ccccc2)[n-][nH]1 ZINC000519998616 517256625 /nfs/dbraw/zinc/25/66/25/517256625.db2.gz WMEOGFPLEQYHGN-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM CN(CCN1CCCC1)C(=O)N=c1[n-]nc(-c2cc3ccccc3o2)s1 ZINC000526064983 517323833 /nfs/dbraw/zinc/32/38/33/517323833.db2.gz AQZHZLZRPZMTOS-UHFFFAOYSA-N -1 3 371.466 3.511 20 0 FHADHM O=C(Cc1ccc2c(c1)COC2)N=c1cc(-c2cc(F)cc(F)c2)[n-][nH]1 ZINC000542655770 517673242 /nfs/dbraw/zinc/67/32/42/517673242.db2.gz LXVCPGOVQRZLIF-UHFFFAOYSA-N -1 3 355.344 3.566 20 0 FHADHM O=C(N=c1cc([C@@H]2CCCO2)[n-][nH]1)c1ccccc1NCc1cccnc1 ZINC000527500704 517713347 /nfs/dbraw/zinc/71/33/47/517713347.db2.gz ARNSOCJCTMFCHK-SFHVURJKSA-N -1 3 363.421 3.521 20 0 FHADHM COc1ccccc1-c1cc(=NC(=O)c2cccnc2NC(C)C)[nH][n-]1 ZINC000608358049 519946214 /nfs/dbraw/zinc/94/62/14/519946214.db2.gz NKMYDPPKPSCGAP-UHFFFAOYSA-N -1 3 351.410 3.553 20 0 FHADHM CC[C@@H]1CCCCN1CCNC(=O)N=c1[n-]nc(Cc2ccccc2)s1 ZINC000603559917 520305124 /nfs/dbraw/zinc/30/51/24/520305124.db2.gz KYVWERDWIUPYLH-MRXNPFEDSA-N -1 3 373.526 3.515 20 0 FHADHM CC(C)Cc1n[n-]c(=NC(=O)NC[C@H]2CCCN2Cc2ccccc2)s1 ZINC000604092500 520448223 /nfs/dbraw/zinc/44/82/23/520448223.db2.gz KFNYUKQSSVCNBE-MRXNPFEDSA-N -1 3 373.526 3.523 20 0 FHADHM Cc1[n-][nH]c(=NC(=O)[C@@H](C)NC(=O)CC(C)(C)C)c1-c1ccc(C)cc1 ZINC000630021069 522583619 /nfs/dbraw/zinc/58/36/19/522583619.db2.gz GFKSSBMNIDMIJH-CQSZACIVSA-N -1 3 356.470 3.573 20 0 FHADHM Cc1[n-][nH]c(=NC(=O)[C@H](C)NC(=O)C2CCCCC2)c1-c1ccccc1F ZINC000634423019 523394477 /nfs/dbraw/zinc/39/44/77/523394477.db2.gz XTBGUTJZHCYJLF-ZDUSSCGKSA-N -1 3 372.444 3.548 20 0 FHADHM Cc1ccccc1-n1cc(C(=O)Nc2ccc(Br)cc2[O-])cn1 ZINC000601713884 567823834 /nfs/dbraw/zinc/82/38/34/567823834.db2.gz VLMGVWNBZBKQDF-UHFFFAOYSA-N -1 3 372.222 3.901 20 0 FHADHM O=C(c1ccccc1[O-])N1CCN(CC2CCC(C(F)(F)F)CC2)CC1 ZINC000185498893 567837849 /nfs/dbraw/zinc/83/78/49/567837849.db2.gz WQUKQFUWHGOXNL-UHFFFAOYSA-N -1 3 370.415 3.519 20 0 FHADHM O=C(c1ccc2c(c1[O-])CCCC2)N1CCO[C@H](c2cccc(F)c2)C1 ZINC000185780752 567863402 /nfs/dbraw/zinc/86/34/02/567863402.db2.gz SHXVTBDFEQGPTE-IBGZPJMESA-N -1 3 355.409 3.624 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2cc(-c3nc(C)co3)ccc2C)cc1 ZINC000161065244 567868114 /nfs/dbraw/zinc/86/81/14/567868114.db2.gz CPVUJUXIYZCSBG-UHFFFAOYSA-N -1 3 358.419 3.768 20 0 FHADHM CSc1ccccc1S(=O)(=O)[N-]c1ccc(C)cc1CN(C)C ZINC000186983933 568036025 /nfs/dbraw/zinc/03/60/25/568036025.db2.gz MXABLSVBFARNSA-UHFFFAOYSA-N -1 3 350.509 3.579 20 0 FHADHM CCOc1ccc(S(=O)(=O)[N-]c2ccc(OCC3CC3)cc2)cc1C ZINC000603166930 568070403 /nfs/dbraw/zinc/07/04/03/568070403.db2.gz DQGZIKBIICKXBW-UHFFFAOYSA-N -1 3 361.463 3.983 20 0 FHADHM C[C@@H](SCCc1nnn[n-]1)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 ZINC000603338467 568089663 /nfs/dbraw/zinc/08/96/63/568089663.db2.gz LCNGLXXTPYGPBE-SSDOTTSWSA-N -1 3 371.253 3.593 20 0 FHADHM C[C@@H](SCCc1nn[n-]n1)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 ZINC000603338467 568089664 /nfs/dbraw/zinc/08/96/64/568089664.db2.gz LCNGLXXTPYGPBE-SSDOTTSWSA-N -1 3 371.253 3.593 20 0 FHADHM O=C(c1cc(Br)ccc1F)N1CCCc2cccc([O-])c21 ZINC000063063863 568177110 /nfs/dbraw/zinc/17/71/10/568177110.db2.gz GILHFRFAEKUDJL-UHFFFAOYSA-N -1 3 350.187 3.887 20 0 FHADHM CCN(Cc1nc(=O)c2c(-c3ccco3)csc2[n-]1)C[C@H]1CCOC1 ZINC000604053725 568207047 /nfs/dbraw/zinc/20/70/47/568207047.db2.gz SWMVRLRNBXJBDU-GFCCVEGCSA-N -1 3 359.451 3.515 20 0 FHADHM Cc1ccc(S(=O)(=O)[N-]Cc2ccccc2OC(F)(F)F)c(F)c1 ZINC000303188340 568256337 /nfs/dbraw/zinc/25/63/37/568256337.db2.gz FDBAPQCHMYQOON-UHFFFAOYSA-N -1 3 363.332 3.511 20 0 FHADHM O=C(CSc1ncnc2sc3c(c21)CCC3)Nc1ccccc1[O-] ZINC000028165074 568264730 /nfs/dbraw/zinc/26/47/30/568264730.db2.gz WZKVDKISOQGDNJ-UHFFFAOYSA-N -1 3 357.460 3.616 20 0 FHADHM CC(C)c1cc(C(=O)N2CCO[C@@]3(CCO[C@@H]3C)C2)c([O-])c(C(C)C)c1 ZINC000408276748 568287943 /nfs/dbraw/zinc/28/79/43/568287943.db2.gz LEOCZMXKFHDUNG-VFNWGFHPSA-N -1 3 361.482 3.659 20 0 FHADHM COc1ccccc1-c1cc(=NC(=O)[C@H](C)SCc2ccccc2)[nH][n-]1 ZINC000604498886 568304934 /nfs/dbraw/zinc/30/49/34/568304934.db2.gz VQBDNOCYXWZDLL-AWEZNQCLSA-N -1 3 367.474 3.768 20 0 FHADHM CSc1ccc([O-])c(C(=O)N2C[C@@H](C)O[C@@H](c3ccc(F)cc3)C2)c1 ZINC000669182681 568312006 /nfs/dbraw/zinc/31/20/06/568312006.db2.gz ILHMUKDUOICMQY-KZULUSFZSA-N -1 3 361.438 3.855 20 0 FHADHM CC1(C)CN(Cc2ccccc2)CC[C@@H]1N=c1[n-]nc(C(F)F)s1 ZINC000390841962 568315676 /nfs/dbraw/zinc/31/56/76/568315676.db2.gz BLXPEISCORDVAE-ZDUSSCGKSA-N -1 3 352.454 3.610 20 0 FHADHM O=C(CSCc1ccc(F)cc1)Nc1n[n-]c(-c2ccccc2F)n1 ZINC000609477109 568324172 /nfs/dbraw/zinc/32/41/72/568324172.db2.gz PVJDJSDIIKUYAC-UHFFFAOYSA-N -1 3 360.389 3.622 20 0 FHADHM COc1ccc2c(c1)[n-]cc(C(=O)N1C[C@@H](c3ccccc3)C[C@H]1C)c2=O ZINC000604605396 568325434 /nfs/dbraw/zinc/32/54/34/568325434.db2.gz LYPAZTVTPONREH-ZBFHGGJFSA-N -1 3 362.429 3.555 20 0 FHADHM O=S(=O)([N-][C@H]1C[C@@H]1c1c(F)cccc1F)c1ccc(Cl)cc1F ZINC000604771907 568363335 /nfs/dbraw/zinc/36/33/35/568363335.db2.gz KLEBUVUWYDVQND-ZANVPECISA-N -1 3 361.772 3.592 20 0 FHADHM Cc1cc(C)cc(-c2cc(=NC(=O)[C@@H](c3ccccc3)n3cccn3)[nH][n-]2)c1 ZINC000604901469 568384755 /nfs/dbraw/zinc/38/47/55/568384755.db2.gz NLOQKTHHAOYMPT-OAQYLSRUSA-N -1 3 371.444 3.540 20 0 FHADHM COC(=O)c1ccc(C)c(S(=O)(=O)[N-]c2ccc(Cl)cc2Cl)c1 ZINC000028196200 568525828 /nfs/dbraw/zinc/52/58/28/568525828.db2.gz LUSXLLBJRUYAOO-UHFFFAOYSA-N -1 3 374.245 3.889 20 0 FHADHM O=S(=O)([N-][C@H]1CSc2ccccc21)c1ccccc1C(F)(F)F ZINC000605164071 568592712 /nfs/dbraw/zinc/59/27/12/568592712.db2.gz HXXYSURCNMRVQQ-LBPRGKRZSA-N -1 3 359.394 3.831 20 0 FHADHM Cc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@@H]3C[C@H]3c3cccc(O)c3)c2)n1 ZINC000365422442 568650914 /nfs/dbraw/zinc/65/09/14/568650914.db2.gz SOSRKCOOEOWMHZ-ZWKOTPCHSA-N -1 3 361.401 3.605 20 0 FHADHM O=C(N[C@@H]1CCc2c1ccc(Cl)c2Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000738034541 598823913 /nfs/dbraw/zinc/82/39/13/598823913.db2.gz HGHPYOCHNUVEGO-CQSZACIVSA-N -1 3 374.231 3.591 20 0 FHADHM O=C(N[C@@H]1CCc2c1ccc(Cl)c2Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000738034541 598823914 /nfs/dbraw/zinc/82/39/14/598823914.db2.gz HGHPYOCHNUVEGO-CQSZACIVSA-N -1 3 374.231 3.591 20 0 FHADHM COc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)[C@@H](C)c1cccc(C)c1 ZINC000737027203 598829541 /nfs/dbraw/zinc/82/95/41/598829541.db2.gz ZTAZNNDAOLFXRZ-NSHDSACASA-N -1 3 372.812 3.546 20 0 FHADHM COc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)[C@@H](C)c1cccc(C)c1 ZINC000737027203 598829542 /nfs/dbraw/zinc/82/95/42/598829542.db2.gz ZTAZNNDAOLFXRZ-NSHDSACASA-N -1 3 372.812 3.546 20 0 FHADHM CC(C)(C)/C=C\C(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000735594480 598833858 /nfs/dbraw/zinc/83/38/58/598833858.db2.gz RWNDVLGHWCKKKR-KTKRTIGZSA-N -1 3 367.478 3.814 20 0 FHADHM CC[C@@H](OC(=O)CSc1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000736380399 598844988 /nfs/dbraw/zinc/84/49/88/598844988.db2.gz FYLARMQQVJBRIF-MRXNPFEDSA-N -1 3 354.435 3.653 20 0 FHADHM CC[C@@H](OC(=O)CSc1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000736380399 598844990 /nfs/dbraw/zinc/84/49/90/598844990.db2.gz FYLARMQQVJBRIF-MRXNPFEDSA-N -1 3 354.435 3.653 20 0 FHADHM CC[C@@H](OC(=O)CSCc1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000736384890 598843792 /nfs/dbraw/zinc/84/37/92/598843792.db2.gz ZWGOOZRPSIIXLS-QGZVFWFLSA-N -1 3 368.462 3.794 20 0 FHADHM CC[C@@H](OC(=O)CSCc1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000736384890 598843793 /nfs/dbraw/zinc/84/37/93/598843793.db2.gz ZWGOOZRPSIIXLS-QGZVFWFLSA-N -1 3 368.462 3.794 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)Nc1cccc2[nH]ccc21 ZINC000738152671 598851632 /nfs/dbraw/zinc/85/16/32/598851632.db2.gz WVMBTELMZWGCEX-UHFFFAOYSA-N -1 3 353.773 3.645 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)Nc1cccc2[nH]ccc21 ZINC000738152671 598851634 /nfs/dbraw/zinc/85/16/34/598851634.db2.gz WVMBTELMZWGCEX-UHFFFAOYSA-N -1 3 353.773 3.645 20 0 FHADHM CCc1nc2ccccc2n1CCNc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736706697 598852888 /nfs/dbraw/zinc/85/28/88/598852888.db2.gz VGOUMRVIULCMAU-UHFFFAOYSA-N -1 3 367.844 3.544 20 0 FHADHM CCc1nc2ccccc2n1CCNc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736706697 598852890 /nfs/dbraw/zinc/85/28/90/598852890.db2.gz VGOUMRVIULCMAU-UHFFFAOYSA-N -1 3 367.844 3.544 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H]1CC[C@@H](C)C[C@@H]1C ZINC000736242959 598853946 /nfs/dbraw/zinc/85/39/46/598853946.db2.gz SRLUTOGLKQQDHI-RVKKMQEKSA-N -1 3 370.501 3.611 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H]1CC[C@@H](C)C[C@@H]1C ZINC000736242959 598853948 /nfs/dbraw/zinc/85/39/48/598853948.db2.gz SRLUTOGLKQQDHI-RVKKMQEKSA-N -1 3 370.501 3.611 20 0 FHADHM C[C@H](NC(=O)c1ccccc1-c1ccccc1-c1nnn[n-]1)C1CCCC1 ZINC000736125353 598865261 /nfs/dbraw/zinc/86/52/61/598865261.db2.gz YDFMJCZBAFIUIA-AWEZNQCLSA-N -1 3 361.449 3.842 20 0 FHADHM C[C@H](NC(=O)c1ccccc1-c1ccccc1-c1nn[n-]n1)C1CCCC1 ZINC000736125353 598865263 /nfs/dbraw/zinc/86/52/63/598865263.db2.gz YDFMJCZBAFIUIA-AWEZNQCLSA-N -1 3 361.449 3.842 20 0 FHADHM Cc1nc(CNCc2cccc(-c3ccc(-c4nnn[n-]4)s3)c2)cs1 ZINC000737478505 598887166 /nfs/dbraw/zinc/88/71/66/598887166.db2.gz VCOZPYSHZQCDFQ-UHFFFAOYSA-N -1 3 368.491 3.650 20 0 FHADHM Cc1nc(CNCc2cccc(-c3ccc(-c4nn[n-]n4)s3)c2)cs1 ZINC000737478505 598887168 /nfs/dbraw/zinc/88/71/68/598887168.db2.gz VCOZPYSHZQCDFQ-UHFFFAOYSA-N -1 3 368.491 3.650 20 0 FHADHM CC[C@@H](c1ccncc1)N(CC)C(=O)Nc1cc(-c2nnn[n-]2)ccc1C ZINC000736394244 598904754 /nfs/dbraw/zinc/90/47/54/598904754.db2.gz BXXSUSCJNKTCEH-KRWDZBQOSA-N -1 3 365.441 3.575 20 0 FHADHM CC[C@@H](c1ccncc1)N(CC)C(=O)Nc1cc(-c2nn[n-]n2)ccc1C ZINC000736394244 598904755 /nfs/dbraw/zinc/90/47/55/598904755.db2.gz BXXSUSCJNKTCEH-KRWDZBQOSA-N -1 3 365.441 3.575 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)NC1C[C@@H](C)C[C@H](C)C1 ZINC000736222521 598907744 /nfs/dbraw/zinc/90/77/44/598907744.db2.gz CSIWKZCJHCZFOQ-GJZGRUSLSA-N -1 3 370.501 3.611 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)NC1C[C@@H](C)C[C@H](C)C1 ZINC000736222521 598907746 /nfs/dbraw/zinc/90/77/46/598907746.db2.gz CSIWKZCJHCZFOQ-GJZGRUSLSA-N -1 3 370.501 3.611 20 0 FHADHM CCO[C@@H](C)c1nc(COc2ccc(-c3nnn[n-]3)cc2Cl)cs1 ZINC000736615693 598912568 /nfs/dbraw/zinc/91/25/68/598912568.db2.gz KWNPIJASBYXRRU-VIFPVBQESA-N -1 3 365.846 3.653 20 0 FHADHM CCO[C@@H](C)c1nc(COc2ccc(-c3nn[n-]n3)cc2Cl)cs1 ZINC000736615693 598912570 /nfs/dbraw/zinc/91/25/70/598912570.db2.gz KWNPIJASBYXRRU-VIFPVBQESA-N -1 3 365.846 3.653 20 0 FHADHM CC[C@H](NC(=O)Nc1ccc(-c2nnn[n-]2)cc1)c1ccc(Cl)s1 ZINC000736363560 598920362 /nfs/dbraw/zinc/92/03/62/598920362.db2.gz NTKFGGGMSSVGJT-NSHDSACASA-N -1 3 362.846 3.854 20 0 FHADHM CC[C@H](NC(=O)Nc1ccc(-c2nn[n-]n2)cc1)c1ccc(Cl)s1 ZINC000736363560 598920364 /nfs/dbraw/zinc/92/03/64/598920364.db2.gz NTKFGGGMSSVGJT-NSHDSACASA-N -1 3 362.846 3.854 20 0 FHADHM Fc1ccc([C@H]2CCCN2c2ncc(-c3nnn[n-]3)cc2Cl)cc1F ZINC000737652927 598942873 /nfs/dbraw/zinc/94/28/73/598942873.db2.gz XVLLQJJLYMVTBT-CQSZACIVSA-N -1 3 362.771 3.535 20 0 FHADHM Fc1ccc([C@H]2CCCN2c2ncc(-c3nn[n-]n3)cc2Cl)cc1F ZINC000737652927 598942875 /nfs/dbraw/zinc/94/28/75/598942875.db2.gz XVLLQJJLYMVTBT-CQSZACIVSA-N -1 3 362.771 3.535 20 0 FHADHM CCCCC[C@@H](C)NC(=O)c1c(Cl)cc(-c2nnn[n-]2)cc1Cl ZINC000825268378 607832990 /nfs/dbraw/zinc/83/29/90/607832990.db2.gz UIVZDFPFCIYSOA-SECBINFHSA-N -1 3 356.257 3.872 20 0 FHADHM CCCCC[C@@H](C)NC(=O)c1c(Cl)cc(-c2nn[n-]n2)cc1Cl ZINC000825268378 607832991 /nfs/dbraw/zinc/83/29/91/607832991.db2.gz UIVZDFPFCIYSOA-SECBINFHSA-N -1 3 356.257 3.872 20 0 FHADHM c1ccc(OCC2CC2)c(NCCCOc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000738436635 598981961 /nfs/dbraw/zinc/98/19/61/598981961.db2.gz UFSFTFLWNQMPPJ-UHFFFAOYSA-N -1 3 365.437 3.537 20 0 FHADHM CC[C@H](OC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1cccc(OC)c1 ZINC000736379705 599027830 /nfs/dbraw/zinc/02/78/30/599027830.db2.gz CVYRBBKVRQUKOV-DXRVJIQQSA-N -1 3 364.405 3.583 20 0 FHADHM CC[C@H](OC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1cccc(OC)c1 ZINC000736379705 599027832 /nfs/dbraw/zinc/02/78/32/599027832.db2.gz CVYRBBKVRQUKOV-DXRVJIQQSA-N -1 3 364.405 3.583 20 0 FHADHM C[C@H](Sc1ccc(-c2nnn[n-]2)cn1)c1ncc(-c2ccccc2)o1 ZINC000736192886 599032404 /nfs/dbraw/zinc/03/24/04/599032404.db2.gz NAVXCKSLOFLGMY-NSHDSACASA-N -1 3 350.407 3.770 20 0 FHADHM C[C@H](Sc1ccc(-c2nn[n-]n2)cn1)c1ncc(-c2ccccc2)o1 ZINC000736192886 599032406 /nfs/dbraw/zinc/03/24/06/599032406.db2.gz NAVXCKSLOFLGMY-NSHDSACASA-N -1 3 350.407 3.770 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(NCCc2ccc(Cl)cc2)n1 ZINC000737635475 599037178 /nfs/dbraw/zinc/03/71/78/599037178.db2.gz HJQIQKNRYIXOOJ-UHFFFAOYSA-N -1 3 368.750 3.589 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(NCCc2ccc(Cl)cc2)n1 ZINC000737635475 599037180 /nfs/dbraw/zinc/03/71/80/599037180.db2.gz HJQIQKNRYIXOOJ-UHFFFAOYSA-N -1 3 368.750 3.589 20 0 FHADHM C[C@@H]1CN(c2c(Cl)cccc2-c2nnn[n-]2)C[C@@H](c2ccc(F)cc2)O1 ZINC000820768345 599038808 /nfs/dbraw/zinc/03/88/08/599038808.db2.gz MWIHIFUVERPACQ-BZNIZROVSA-N -1 3 373.819 3.626 20 0 FHADHM C[C@@H]1CN(c2c(Cl)cccc2-c2nn[n-]n2)C[C@@H](c2ccc(F)cc2)O1 ZINC000820768345 599038810 /nfs/dbraw/zinc/03/88/10/599038810.db2.gz MWIHIFUVERPACQ-BZNIZROVSA-N -1 3 373.819 3.626 20 0 FHADHM CC(C)c1csc([C@@H]2CCCN(c3ccc(F)cc3-c3nnn[n-]3)C2)n1 ZINC000820197841 599043502 /nfs/dbraw/zinc/04/35/02/599043502.db2.gz NVJOCBWSQKIBSK-GFCCVEGCSA-N -1 3 372.473 3.970 20 0 FHADHM CC(C)c1csc([C@@H]2CCCN(c3ccc(F)cc3-c3nn[n-]n3)C2)n1 ZINC000820197841 599043505 /nfs/dbraw/zinc/04/35/05/599043505.db2.gz NVJOCBWSQKIBSK-GFCCVEGCSA-N -1 3 372.473 3.970 20 0 FHADHM CC1(C)CN(c2nc(C(F)(F)F)ccc2-c2nnn[n-]2)[C@@H]1c1ccccc1 ZINC000736215044 599046182 /nfs/dbraw/zinc/04/61/82/599046182.db2.gz ZUKIYSRKEFROSF-CQSZACIVSA-N -1 3 374.370 3.868 20 0 FHADHM CC1(C)CN(c2nc(C(F)(F)F)ccc2-c2nn[n-]n2)[C@@H]1c1ccccc1 ZINC000736215044 599046185 /nfs/dbraw/zinc/04/61/85/599046185.db2.gz ZUKIYSRKEFROSF-CQSZACIVSA-N -1 3 374.370 3.868 20 0 FHADHM Cc1ccc2c(c1)CC[C@H]2Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000737379349 599050039 /nfs/dbraw/zinc/05/00/39/599050039.db2.gz WBANIQGLJLBVCE-CYBMUJFWSA-N -1 3 360.343 3.688 20 0 FHADHM Cc1ccc2c(c1)CC[C@H]2Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000737379349 599050042 /nfs/dbraw/zinc/05/00/42/599050042.db2.gz WBANIQGLJLBVCE-CYBMUJFWSA-N -1 3 360.343 3.688 20 0 FHADHM COc1cccc(F)c1[C@@H](C)Nc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000821873112 599055280 /nfs/dbraw/zinc/05/52/80/599055280.db2.gz ROZBHOCJBQACSS-LLVKDONJSA-N -1 3 364.384 3.736 20 0 FHADHM COc1cccc(F)c1[C@@H](C)Nc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000821873112 599055283 /nfs/dbraw/zinc/05/52/83/599055283.db2.gz ROZBHOCJBQACSS-LLVKDONJSA-N -1 3 364.384 3.736 20 0 FHADHM C[C@H]1Cc2ccccc2[C@H]1Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000736296468 599056226 /nfs/dbraw/zinc/05/62/26/599056226.db2.gz HKXLJSHEBBHODD-XPTSAGLGSA-N -1 3 360.343 3.626 20 0 FHADHM C[C@H]1Cc2ccccc2[C@H]1Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000736296468 599056229 /nfs/dbraw/zinc/05/62/29/599056229.db2.gz HKXLJSHEBBHODD-XPTSAGLGSA-N -1 3 360.343 3.626 20 0 FHADHM C[C@H](OC(=O)c1sccc1-c1nnn[n-]1)c1ncc(-c2ccccc2)o1 ZINC000736165165 599056448 /nfs/dbraw/zinc/05/64/48/599056448.db2.gz SEWNIMLNAXGDQM-JTQLQIEISA-N -1 3 367.390 3.501 20 0 FHADHM COc1ccc(-c2ccc(CNc3ncccc3-c3nnn[n-]3)cc2)cc1 ZINC000821727735 599057634 /nfs/dbraw/zinc/05/76/34/599057634.db2.gz NPVAPBHKDAPJOT-UHFFFAOYSA-N -1 3 358.405 3.549 20 0 FHADHM COc1ccc(-c2ccc(CNc3ncccc3-c3nn[n-]n3)cc2)cc1 ZINC000821727735 599057636 /nfs/dbraw/zinc/05/76/36/599057636.db2.gz NPVAPBHKDAPJOT-UHFFFAOYSA-N -1 3 358.405 3.549 20 0 FHADHM Clc1cc(N2CC[C@@H](COCc3ccccc3)C2)ccc1-c1nnn[n-]1 ZINC000822567701 599062932 /nfs/dbraw/zinc/06/29/32/599062932.db2.gz FOAMHIQHDXOBRH-OAHLLOKOSA-N -1 3 369.856 3.563 20 0 FHADHM Clc1cc(N2CC[C@@H](COCc3ccccc3)C2)ccc1-c1nn[n-]n1 ZINC000822567701 599062935 /nfs/dbraw/zinc/06/29/35/599062935.db2.gz FOAMHIQHDXOBRH-OAHLLOKOSA-N -1 3 369.856 3.563 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCCCC2)c1ccco1 ZINC000735568726 599069757 /nfs/dbraw/zinc/06/97/57/599069757.db2.gz AHVJIGQWLXTYCH-LLVKDONJSA-N -1 3 371.466 3.922 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCCCC2)c1ccco1 ZINC000735568726 599069760 /nfs/dbraw/zinc/06/97/60/599069760.db2.gz AHVJIGQWLXTYCH-LLVKDONJSA-N -1 3 371.466 3.922 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@H]1C[C@H]1C1CCCCC1 ZINC000736481156 599070451 /nfs/dbraw/zinc/07/04/51/599070451.db2.gz UYCSZANLFZUQQQ-OALUTQOASA-N -1 3 367.497 3.822 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@H]1C[C@H]1C1CCCCC1 ZINC000736481156 599070453 /nfs/dbraw/zinc/07/04/53/599070453.db2.gz UYCSZANLFZUQQQ-OALUTQOASA-N -1 3 367.497 3.822 20 0 FHADHM Cc1ccc([C@@H]2CCCCN2C(=O)C=Cc2ccccc2-c2nnn[n-]2)cc1 ZINC000737329821 599082885 /nfs/dbraw/zinc/08/28/85/599082885.db2.gz LDVAPCHWMUOLIO-ODLZTCLXSA-N -1 3 373.460 3.942 20 0 FHADHM Cc1ccc([C@@H]2CCCCN2C(=O)C=Cc2ccccc2-c2nn[n-]n2)cc1 ZINC000737329821 599082887 /nfs/dbraw/zinc/08/28/87/599082887.db2.gz LDVAPCHWMUOLIO-ODLZTCLXSA-N -1 3 373.460 3.942 20 0 FHADHM Fc1cccc(N2CC[C@H](CSc3ccccc3)C2)c1-c1nnn[n-]1 ZINC000822792451 599089098 /nfs/dbraw/zinc/08/90/98/599089098.db2.gz WWTHQARCMSTHNY-ZDUSSCGKSA-N -1 3 355.442 3.624 20 0 FHADHM Fc1cccc(N2CC[C@H](CSc3ccccc3)C2)c1-c1nn[n-]n1 ZINC000822792451 599089101 /nfs/dbraw/zinc/08/91/01/599089101.db2.gz WWTHQARCMSTHNY-ZDUSSCGKSA-N -1 3 355.442 3.624 20 0 FHADHM CSCCCSc1nc2c(c(-c3ccco3)c1-c1nnn[n-]1)CCC2 ZINC000821969848 599123428 /nfs/dbraw/zinc/12/34/28/599123428.db2.gz GDJFUCRCCKNOJQ-UHFFFAOYSA-N -1 3 373.507 3.856 20 0 FHADHM CC(=CC(=O)Nc1cccc(-c2nnn[n-]2)c1)c1cccc(C(F)(F)F)c1 ZINC000742501631 599131768 /nfs/dbraw/zinc/13/17/68/599131768.db2.gz PIXDHGNVVVXQNV-FLIBITNWSA-N -1 3 373.338 3.928 20 0 FHADHM CC(=CC(=O)Nc1cccc(-c2nn[n-]n2)c1)c1cccc(C(F)(F)F)c1 ZINC000742501631 599131770 /nfs/dbraw/zinc/13/17/70/599131770.db2.gz PIXDHGNVVVXQNV-FLIBITNWSA-N -1 3 373.338 3.928 20 0 FHADHM c1ccc(Oc2cccc(NCCOc3ccc(-c4nn[n-]n4)cc3)c2)nc1 ZINC000823792066 599133682 /nfs/dbraw/zinc/13/36/82/599133682.db2.gz OPJJFNBVYRFPPE-UHFFFAOYSA-N -1 3 374.404 3.545 20 0 FHADHM Cc1cccc([C@H](C)NC(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)c1C ZINC000737386300 599147922 /nfs/dbraw/zinc/14/79/22/599147922.db2.gz BOHLHVCNQKOUSL-LBPRGKRZSA-N -1 3 354.389 3.505 20 0 FHADHM Cc1cccc([C@H](C)NC(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)c1C ZINC000737386300 599147923 /nfs/dbraw/zinc/14/79/23/599147923.db2.gz BOHLHVCNQKOUSL-LBPRGKRZSA-N -1 3 354.389 3.505 20 0 FHADHM Cc1nc(C2CCCC2)sc1C(=O)N(C)c1cccc(-c2nnn[n-]2)c1 ZINC000822431892 599147440 /nfs/dbraw/zinc/14/74/40/599147440.db2.gz OATBLBSRQBQGEM-UHFFFAOYSA-N -1 3 368.466 3.566 20 0 FHADHM Cc1nc(C2CCCC2)sc1C(=O)N(C)c1cccc(-c2nn[n-]n2)c1 ZINC000822431892 599147441 /nfs/dbraw/zinc/14/74/41/599147441.db2.gz OATBLBSRQBQGEM-UHFFFAOYSA-N -1 3 368.466 3.566 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)c1cccc(-c2cscn2)c1 ZINC000822220371 599149183 /nfs/dbraw/zinc/14/91/83/599149183.db2.gz OCDQDMOQBRJRFM-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cccc(-c2cscn2)c1 ZINC000822220371 599149185 /nfs/dbraw/zinc/14/91/85/599149185.db2.gz OCDQDMOQBRJRFM-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1nc(C2CCCC2)sc1C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000822431692 599151958 /nfs/dbraw/zinc/15/19/58/599151958.db2.gz GLFSDPJXUTWHIN-UHFFFAOYSA-N -1 3 372.429 3.681 20 0 FHADHM Cc1nc(C2CCCC2)sc1C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000822431692 599151961 /nfs/dbraw/zinc/15/19/61/599151961.db2.gz GLFSDPJXUTWHIN-UHFFFAOYSA-N -1 3 372.429 3.681 20 0 FHADHM Cc1ccc(C)c(SCc2nnc(-c3ccc(-c4nnn[n-]4)cc3)o2)c1 ZINC000737326487 599159414 /nfs/dbraw/zinc/15/94/14/599159414.db2.gz OWKCDLLHRANNPG-UHFFFAOYSA-N -1 3 364.434 3.826 20 0 FHADHM Cc1ccc(C)c(SCc2nnc(-c3ccc(-c4nn[n-]n4)cc3)o2)c1 ZINC000737326487 599159417 /nfs/dbraw/zinc/15/94/17/599159417.db2.gz OWKCDLLHRANNPG-UHFFFAOYSA-N -1 3 364.434 3.826 20 0 FHADHM Cc1cccc(SCc2nnc(-c3cccc(-c4nnn[n-]4)c3)o2)c1 ZINC000737409218 599165127 /nfs/dbraw/zinc/16/51/27/599165127.db2.gz BXGHLGGCMVFITP-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM Cc1cccc(SCc2nnc(-c3cccc(-c4nn[n-]n4)c3)o2)c1 ZINC000737409218 599165129 /nfs/dbraw/zinc/16/51/29/599165129.db2.gz BXGHLGGCMVFITP-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM CCSc1ccccc1OC(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000736667377 599164921 /nfs/dbraw/zinc/16/49/21/599164921.db2.gz OPRJHFCLSNHSPB-UHFFFAOYSA-N -1 3 372.475 3.676 20 0 FHADHM CCSc1ccccc1OC(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000736667377 599164923 /nfs/dbraw/zinc/16/49/23/599164923.db2.gz OPRJHFCLSNHSPB-UHFFFAOYSA-N -1 3 372.475 3.676 20 0 FHADHM CC(C)c1ccccc1NC(=O)CSc1ccc(-c2nnn[n-]2)cc1F ZINC000735931764 599170068 /nfs/dbraw/zinc/17/00/68/599170068.db2.gz DKFHFRCZLHORGA-UHFFFAOYSA-N -1 3 371.441 3.860 20 0 FHADHM CC(C)c1ccccc1NC(=O)CSc1ccc(-c2nn[n-]n2)cc1F ZINC000735931764 599170070 /nfs/dbraw/zinc/17/00/70/599170070.db2.gz DKFHFRCZLHORGA-UHFFFAOYSA-N -1 3 371.441 3.860 20 0 FHADHM Cc1ccccc1-c1noc(CSc2ccc(-c3nnn[n-]3)cc2F)n1 ZINC000737417822 599171752 /nfs/dbraw/zinc/17/17/52/599171752.db2.gz LRXLMRGIRXLUGK-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM Cc1ccccc1-c1noc(CSc2ccc(-c3nn[n-]n3)cc2F)n1 ZINC000737417822 599171755 /nfs/dbraw/zinc/17/17/55/599171755.db2.gz LRXLMRGIRXLUGK-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM CCCCCC[C@H](C)NC(=O)CSc1ccc(-c2nnn[n-]2)cc1F ZINC000736448399 599172955 /nfs/dbraw/zinc/17/29/55/599172955.db2.gz YEGGGJYESYLZPX-LBPRGKRZSA-N -1 3 365.478 3.573 20 0 FHADHM CCCCCC[C@H](C)NC(=O)CSc1ccc(-c2nn[n-]n2)cc1F ZINC000736448399 599172958 /nfs/dbraw/zinc/17/29/58/599172958.db2.gz YEGGGJYESYLZPX-LBPRGKRZSA-N -1 3 365.478 3.573 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N2CCCC[C@@H]2c2ccco2)n1 ZINC000737633973 599174144 /nfs/dbraw/zinc/17/41/44/599174144.db2.gz XBKNBGTUXMIMBL-LLVKDONJSA-N -1 3 364.331 3.605 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N2CCCC[C@@H]2c2ccco2)n1 ZINC000737633973 599174146 /nfs/dbraw/zinc/17/41/46/599174146.db2.gz XBKNBGTUXMIMBL-LLVKDONJSA-N -1 3 364.331 3.605 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(-c2nnn[n-]2)cc1)c1ccccc1C(F)(F)F ZINC000607818794 599177072 /nfs/dbraw/zinc/17/70/72/599177072.db2.gz WRROAXFWRFYXBN-SNVBAGLBSA-N -1 3 361.327 3.628 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(-c2nn[n-]n2)cc1)c1ccccc1C(F)(F)F ZINC000607818794 599177075 /nfs/dbraw/zinc/17/70/75/599177075.db2.gz WRROAXFWRFYXBN-SNVBAGLBSA-N -1 3 361.327 3.628 20 0 FHADHM C[C@@H](C(=O)Nc1cccc(-c2nnn[n-]2)c1)c1ccccc1C(F)(F)F ZINC000607884792 599177319 /nfs/dbraw/zinc/17/73/19/599177319.db2.gz AHBVDBZUWIKUDH-SNVBAGLBSA-N -1 3 361.327 3.628 20 0 FHADHM C[C@@H](C(=O)Nc1cccc(-c2nn[n-]n2)c1)c1ccccc1C(F)(F)F ZINC000607884792 599177322 /nfs/dbraw/zinc/17/73/22/599177322.db2.gz AHBVDBZUWIKUDH-SNVBAGLBSA-N -1 3 361.327 3.628 20 0 FHADHM O=C(Nc1sc2c(c1-c1nnn[n-]1)CCC2)c1cc2cccc(F)c2o1 ZINC000738210457 599179268 /nfs/dbraw/zinc/17/92/68/599179268.db2.gz PPSHQRHOBHEFAG-UHFFFAOYSA-N -1 3 369.381 3.555 20 0 FHADHM O=C(Nc1sc2c(c1-c1nn[n-]n1)CCC2)c1cc2cccc(F)c2o1 ZINC000738210457 599179270 /nfs/dbraw/zinc/17/92/70/599179270.db2.gz PPSHQRHOBHEFAG-UHFFFAOYSA-N -1 3 369.381 3.555 20 0 FHADHM CC[C@@H](Cc1ccc(Cl)cc1)NC(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000736352374 599180998 /nfs/dbraw/zinc/18/09/98/599180998.db2.gz LCXCTXKKDRZVKP-HNNXBMFYSA-N -1 3 370.844 3.663 20 0 FHADHM CC[C@@H](Cc1ccc(Cl)cc1)NC(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000736352374 599181002 /nfs/dbraw/zinc/18/10/02/599181002.db2.gz LCXCTXKKDRZVKP-HNNXBMFYSA-N -1 3 370.844 3.663 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@H]2CCSc3ccccc32)s1 ZINC000736679036 599184950 /nfs/dbraw/zinc/18/49/50/599184950.db2.gz JGLFJTLRACJYRV-LBPRGKRZSA-N -1 3 371.491 3.709 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@H]2CCSc3ccccc32)s1 ZINC000736679036 599184953 /nfs/dbraw/zinc/18/49/53/599184953.db2.gz JGLFJTLRACJYRV-LBPRGKRZSA-N -1 3 371.491 3.709 20 0 FHADHM Cc1ccccc1[C@H](C)CC(=O)OCc1ccc(-c2nnn[n-]2)cc1F ZINC000737420226 599186303 /nfs/dbraw/zinc/18/63/03/599186303.db2.gz HQKPSMPERCGXLI-CYBMUJFWSA-N -1 3 354.385 3.551 20 0 FHADHM Cc1ccccc1[C@H](C)CC(=O)OCc1ccc(-c2nn[n-]n2)cc1F ZINC000737420226 599186305 /nfs/dbraw/zinc/18/63/05/599186305.db2.gz HQKPSMPERCGXLI-CYBMUJFWSA-N -1 3 354.385 3.551 20 0 FHADHM CC(C)(C)[C@@H]1CCCN(C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)CC1 ZINC000735596535 599187488 /nfs/dbraw/zinc/18/74/88/599187488.db2.gz KAWKNSOOTVMPJF-GFCCVEGCSA-N -1 3 360.437 3.686 20 0 FHADHM CC(C)(C)[C@@H]1CCCN(C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)CC1 ZINC000735596535 599187491 /nfs/dbraw/zinc/18/74/91/599187491.db2.gz KAWKNSOOTVMPJF-GFCCVEGCSA-N -1 3 360.437 3.686 20 0 FHADHM CN(C(=O)c1cccc(-c2nnn[n-]2)c1)c1ccc(-c2ccccc2)cc1 ZINC000821574746 599192758 /nfs/dbraw/zinc/19/27/58/599192758.db2.gz VPYJMDXVHHFNAQ-UHFFFAOYSA-N -1 3 355.401 3.810 20 0 FHADHM CN(C(=O)c1cccc(-c2nn[n-]n2)c1)c1ccc(-c2ccccc2)cc1 ZINC000821574746 599192761 /nfs/dbraw/zinc/19/27/61/599192761.db2.gz VPYJMDXVHHFNAQ-UHFFFAOYSA-N -1 3 355.401 3.810 20 0 FHADHM CN(C(=O)c1cccc(Oc2ccc(Cl)cc2-c2nnn[n-]2)c1)C1CC1 ZINC000736740813 599194172 /nfs/dbraw/zinc/19/41/72/599194172.db2.gz FTVOTEDTCYKQCD-UHFFFAOYSA-N -1 3 369.812 3.547 20 0 FHADHM CN(C(=O)c1cccc(Oc2ccc(Cl)cc2-c2nn[n-]n2)c1)C1CC1 ZINC000736740813 599194175 /nfs/dbraw/zinc/19/41/75/599194175.db2.gz FTVOTEDTCYKQCD-UHFFFAOYSA-N -1 3 369.812 3.547 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)Nc1cccc(CC(F)(F)F)c1 ZINC000822936545 599198093 /nfs/dbraw/zinc/19/80/93/599198093.db2.gz VKKKKNXWLCWOOA-CMDGGOBGSA-N -1 3 373.338 3.623 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)Nc1cccc(CC(F)(F)F)c1 ZINC000822936545 599198095 /nfs/dbraw/zinc/19/80/95/599198095.db2.gz VKKKKNXWLCWOOA-CMDGGOBGSA-N -1 3 373.338 3.623 20 0 FHADHM CCc1ccc([C@H]2C[C@@H](C)CCN2C(=O)c2ccc(-c3nnn[n-]3)cc2)o1 ZINC000821482006 599220961 /nfs/dbraw/zinc/22/09/61/599220961.db2.gz PDINWDCGTPJKHA-SUMWQHHRSA-N -1 3 365.437 3.636 20 0 FHADHM CCc1ccc([C@H]2C[C@@H](C)CCN2C(=O)c2ccc(-c3nn[n-]n3)cc2)o1 ZINC000821482006 599220964 /nfs/dbraw/zinc/22/09/64/599220964.db2.gz PDINWDCGTPJKHA-SUMWQHHRSA-N -1 3 365.437 3.636 20 0 FHADHM C[C@H](SCC(=O)N(C1CC1)C1CCCC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820548470 599222576 /nfs/dbraw/zinc/22/25/76/599222576.db2.gz ALCRKMWQPYLNDA-ZDUSSCGKSA-N -1 3 371.510 3.595 20 0 FHADHM C[C@H](SCC(=O)N(C1CC1)C1CCCC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820548470 599222579 /nfs/dbraw/zinc/22/25/79/599222579.db2.gz ALCRKMWQPYLNDA-ZDUSSCGKSA-N -1 3 371.510 3.595 20 0 FHADHM CCOc1ccccc1OCCSCc1ccccc1-c1nnn[n-]1 ZINC000821437717 599223021 /nfs/dbraw/zinc/22/30/21/599223021.db2.gz REWBUVNJBVZVLF-UHFFFAOYSA-N -1 3 356.451 3.578 20 0 FHADHM CCOc1ccccc1OCCSCc1ccccc1-c1nn[n-]n1 ZINC000821437717 599223022 /nfs/dbraw/zinc/22/30/22/599223022.db2.gz REWBUVNJBVZVLF-UHFFFAOYSA-N -1 3 356.451 3.578 20 0 FHADHM CC[C@H](Cc1ccc(C)cc1)N(CC)C(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000736355101 599233163 /nfs/dbraw/zinc/23/31/63/599233163.db2.gz XSGUHPBPIHOOBY-LJQANCHMSA-N -1 3 363.465 3.659 20 0 FHADHM CC[C@H](Cc1ccc(C)cc1)N(CC)C(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC000736355101 599233164 /nfs/dbraw/zinc/23/31/64/599233164.db2.gz XSGUHPBPIHOOBY-LJQANCHMSA-N -1 3 363.465 3.659 20 0 FHADHM CC(C)c1ccc(NC(=S)NCc2cc(-c3nnn[n-]3)ccc2F)cc1 ZINC000820192578 599227832 /nfs/dbraw/zinc/22/78/32/599227832.db2.gz UWXXMKLXNICSCD-UHFFFAOYSA-N -1 3 370.457 3.616 20 0 FHADHM CC(C)c1ccc(NC(=S)NCc2cc(-c3nn[n-]n3)ccc2F)cc1 ZINC000820192578 599227834 /nfs/dbraw/zinc/22/78/34/599227834.db2.gz UWXXMKLXNICSCD-UHFFFAOYSA-N -1 3 370.457 3.616 20 0 FHADHM Cc1c(NC(=O)c2cc(C(F)(F)F)ccc2F)cccc1-c1nnn[n-]1 ZINC000822110086 607266657 /nfs/dbraw/zinc/26/66/57/607266657.db2.gz VDYHVPJBAHLHRT-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM Cc1c(NC(=O)c2cc(C(F)(F)F)ccc2F)cccc1-c1nn[n-]n1 ZINC000822110086 607266658 /nfs/dbraw/zinc/26/66/58/607266658.db2.gz VDYHVPJBAHLHRT-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM C[C@@H](NC(=S)Nc1ccccc1Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000820403702 599237701 /nfs/dbraw/zinc/23/77/01/599237701.db2.gz LGMOCFQCPHCKKC-SNVBAGLBSA-N -1 3 358.858 3.568 20 0 FHADHM C[C@@H](NC(=S)Nc1ccccc1Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000820403702 599237703 /nfs/dbraw/zinc/23/77/03/599237703.db2.gz LGMOCFQCPHCKKC-SNVBAGLBSA-N -1 3 358.858 3.568 20 0 FHADHM C[C@H]1CN(C(=O)Nc2ccc(-c3nnn[n-]3)cc2)CC[C@@H]1c1ccccc1 ZINC000820742918 599240579 /nfs/dbraw/zinc/24/05/79/599240579.db2.gz NSTMVLFLSGJCAA-KSSFIOAISA-N -1 3 362.437 3.524 20 0 FHADHM C[C@H]1CN(C(=O)Nc2ccc(-c3nn[n-]n3)cc2)CC[C@@H]1c1ccccc1 ZINC000820742918 599240581 /nfs/dbraw/zinc/24/05/81/599240581.db2.gz NSTMVLFLSGJCAA-KSSFIOAISA-N -1 3 362.437 3.524 20 0 FHADHM Cc1ccc([C@H]2CCCCN2C(=O)Nc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000822233153 599241307 /nfs/dbraw/zinc/24/13/07/599241307.db2.gz ITTARPMJSRLDNX-GOSISDBHSA-N -1 3 362.437 3.934 20 0 FHADHM Cc1ccc([C@H]2CCCCN2C(=O)Nc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000822233153 599241309 /nfs/dbraw/zinc/24/13/09/599241309.db2.gz ITTARPMJSRLDNX-GOSISDBHSA-N -1 3 362.437 3.934 20 0 FHADHM Cc1c(NC(=O)[C@@H](C)CSc2ccc(F)cc2)cccc1-c1nnn[n-]1 ZINC000822060749 607270252 /nfs/dbraw/zinc/27/02/52/607270252.db2.gz IYNHJWRYRWDPLY-NSHDSACASA-N -1 3 371.441 3.681 20 0 FHADHM Cc1c(NC(=O)[C@@H](C)CSc2ccc(F)cc2)cccc1-c1nn[n-]n1 ZINC000822060749 607270253 /nfs/dbraw/zinc/27/02/53/607270253.db2.gz IYNHJWRYRWDPLY-NSHDSACASA-N -1 3 371.441 3.681 20 0 FHADHM CC(C)c1ccccc1NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820198415 599242269 /nfs/dbraw/zinc/24/22/69/599242269.db2.gz VEPXPJKZNTWPDH-CYBMUJFWSA-N -1 3 350.426 3.873 20 0 FHADHM CC(C)c1ccccc1NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820198415 599242270 /nfs/dbraw/zinc/24/22/70/599242270.db2.gz VEPXPJKZNTWPDH-CYBMUJFWSA-N -1 3 350.426 3.873 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc(F)c(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820379394 599243316 /nfs/dbraw/zinc/24/33/16/599243316.db2.gz CECJLNIXRWGNCQ-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc(F)c(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820379394 599243317 /nfs/dbraw/zinc/24/33/17/599243317.db2.gz CECJLNIXRWGNCQ-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM Cc1cccc(C(C)C)c1NC(=O)NCc1cc(-c2nnn[n-]2)ccc1F ZINC000822288672 599244046 /nfs/dbraw/zinc/24/40/46/599244046.db2.gz FYMBPHDBCPBQQV-UHFFFAOYSA-N -1 3 368.416 3.759 20 0 FHADHM Cc1cccc(C(C)C)c1NC(=O)NCc1cc(-c2nn[n-]n2)ccc1F ZINC000822288672 599244048 /nfs/dbraw/zinc/24/40/48/599244048.db2.gz FYMBPHDBCPBQQV-UHFFFAOYSA-N -1 3 368.416 3.759 20 0 FHADHM Cc1cccc([C@H]2CCCN2C(=O)Nc2cccc(-c3nnn[n-]3)c2)c1C ZINC000822299688 599246432 /nfs/dbraw/zinc/24/64/32/599246432.db2.gz RGMAMYQSWTYBBA-GOSISDBHSA-N -1 3 362.437 3.853 20 0 FHADHM Cc1cccc([C@H]2CCCN2C(=O)Nc2cccc(-c3nn[n-]n3)c2)c1C ZINC000822299688 599246434 /nfs/dbraw/zinc/24/64/34/599246434.db2.gz RGMAMYQSWTYBBA-GOSISDBHSA-N -1 3 362.437 3.853 20 0 FHADHM CCC[C@]1(C)CCCN(C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)C1 ZINC000821028640 599250105 /nfs/dbraw/zinc/25/01/05/599250105.db2.gz XTDJWJGDMUACAT-QGZVFWFLSA-N -1 3 362.865 3.954 20 0 FHADHM CCC[C@]1(C)CCCN(C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)C1 ZINC000821028640 599250107 /nfs/dbraw/zinc/25/01/07/599250107.db2.gz XTDJWJGDMUACAT-QGZVFWFLSA-N -1 3 362.865 3.954 20 0 FHADHM Cc1c(NC(=O)N[C@H](C)c2ccc(F)c(Cl)c2)cccc1-c1nnn[n-]1 ZINC000822090665 607281606 /nfs/dbraw/zinc/28/16/06/607281606.db2.gz LPFHIIXIEFZUEZ-SNVBAGLBSA-N -1 3 374.807 3.850 20 0 FHADHM Cc1c(NC(=O)N[C@H](C)c2ccc(F)c(Cl)c2)cccc1-c1nn[n-]n1 ZINC000822090665 607281607 /nfs/dbraw/zinc/28/16/07/607281607.db2.gz LPFHIIXIEFZUEZ-SNVBAGLBSA-N -1 3 374.807 3.850 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@H](C(C)(C)C)CC2)cccc1-c1nnn[n-]1 ZINC000822084552 607282211 /nfs/dbraw/zinc/28/22/11/607282211.db2.gz MSBTTWFUUFOLLZ-AWEZNQCLSA-N -1 3 356.474 3.855 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@H](C(C)(C)C)CC2)cccc1-c1nn[n-]n1 ZINC000822084552 607282212 /nfs/dbraw/zinc/28/22/12/607282212.db2.gz MSBTTWFUUFOLLZ-AWEZNQCLSA-N -1 3 356.474 3.855 20 0 FHADHM Cc1cc([C@@H](C)NC(=O)Nc2cccc(-c3nnn[n-]3)c2C)ccc1F ZINC000822191811 607282888 /nfs/dbraw/zinc/28/28/88/607282888.db2.gz RNFNSDZEBIWJIU-GFCCVEGCSA-N -1 3 354.389 3.505 20 0 FHADHM Cc1cc([C@@H](C)NC(=O)Nc2cccc(-c3nn[n-]n3)c2C)ccc1F ZINC000822191811 607282889 /nfs/dbraw/zinc/28/28/89/607282889.db2.gz RNFNSDZEBIWJIU-GFCCVEGCSA-N -1 3 354.389 3.505 20 0 FHADHM Cc1c(NC(=O)N(C)CCCCc2ccccc2)cccc1-c1nnn[n-]1 ZINC000822075662 607287440 /nfs/dbraw/zinc/28/74/40/607287440.db2.gz HKGQRHFBEVLJEM-UHFFFAOYSA-N -1 3 364.453 3.662 20 0 FHADHM Cc1c(NC(=O)N(C)CCCCc2ccccc2)cccc1-c1nn[n-]n1 ZINC000822075662 607287441 /nfs/dbraw/zinc/28/74/41/607287441.db2.gz HKGQRHFBEVLJEM-UHFFFAOYSA-N -1 3 364.453 3.662 20 0 FHADHM C[C@H](NC(=O)Nc1ccc(Cl)c(F)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820380671 599254098 /nfs/dbraw/zinc/25/40/98/599254098.db2.gz YFVOLNGYPAGPCT-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM C[C@H](NC(=O)Nc1ccc(Cl)c(F)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820380671 599254101 /nfs/dbraw/zinc/25/41/01/599254101.db2.gz YFVOLNGYPAGPCT-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM Cc1c(NC(=O)NC2(c3ccc(F)cc3)CCC2)cccc1-c1nnn[n-]1 ZINC000822090726 607283312 /nfs/dbraw/zinc/28/33/12/607283312.db2.gz MKYQXRJJJSBZHL-UHFFFAOYSA-N -1 3 366.400 3.515 20 0 FHADHM Cc1c(NC(=O)NC2(c3ccc(F)cc3)CCC2)cccc1-c1nn[n-]n1 ZINC000822090726 607283313 /nfs/dbraw/zinc/28/33/13/607283313.db2.gz MKYQXRJJJSBZHL-UHFFFAOYSA-N -1 3 366.400 3.515 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@@H]2c2cccs2)cccc1-c1nnn[n-]1 ZINC000822083501 607284120 /nfs/dbraw/zinc/28/41/20/607284120.db2.gz BSHNCMGSBIGNBX-CQSZACIVSA-N -1 3 354.439 3.606 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@@H]2c2cccs2)cccc1-c1nn[n-]n1 ZINC000822083501 607284121 /nfs/dbraw/zinc/28/41/21/607284121.db2.gz BSHNCMGSBIGNBX-CQSZACIVSA-N -1 3 354.439 3.606 20 0 FHADHM Cc1c(NC(=O)N(C)[C@@H]2CCCc3ccccc32)cccc1-c1nnn[n-]1 ZINC000822076799 607285335 /nfs/dbraw/zinc/28/53/35/607285335.db2.gz RZBTWOCYTHFCOM-GOSISDBHSA-N -1 3 362.437 3.716 20 0 FHADHM Cc1c(NC(=O)N(C)[C@@H]2CCCc3ccccc32)cccc1-c1nn[n-]n1 ZINC000822076799 607285336 /nfs/dbraw/zinc/28/53/36/607285336.db2.gz RZBTWOCYTHFCOM-GOSISDBHSA-N -1 3 362.437 3.716 20 0 FHADHM Cc1c(NC(=O)c2cc(Cl)cc3cccnc32)cccc1-c1nnn[n-]1 ZINC000822109337 607294204 /nfs/dbraw/zinc/29/42/04/607294204.db2.gz QPHVTGKHTDBSMS-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1c(NC(=O)c2cc(Cl)cc3cccnc32)cccc1-c1nn[n-]n1 ZINC000822109337 607294205 /nfs/dbraw/zinc/29/42/05/607294205.db2.gz QPHVTGKHTDBSMS-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1c(NC(=O)c2cc(F)c(Cl)cc2Cl)cccc1-c1nnn[n-]1 ZINC000822110124 607295941 /nfs/dbraw/zinc/29/59/41/607295941.db2.gz WHRQWGOHIQFTFB-UHFFFAOYSA-N -1 3 366.183 3.873 20 0 FHADHM Cc1c(NC(=O)c2cc(F)c(Cl)cc2Cl)cccc1-c1nn[n-]n1 ZINC000822110124 607295942 /nfs/dbraw/zinc/29/59/42/607295942.db2.gz WHRQWGOHIQFTFB-UHFFFAOYSA-N -1 3 366.183 3.873 20 0 FHADHM Cc1c(NC(=O)[C@@H](C)Sc2ccccc2Cl)cccc1-c1nnn[n-]1 ZINC000822061668 607296561 /nfs/dbraw/zinc/29/65/61/607296561.db2.gz UJIHNVIHJNSJNY-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM Cc1c(NC(=O)[C@@H](C)Sc2ccccc2Cl)cccc1-c1nn[n-]n1 ZINC000822061668 607296562 /nfs/dbraw/zinc/29/65/62/607296562.db2.gz UJIHNVIHJNSJNY-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM Cc1c(NC(=O)c2cc(C(C)C)n(C(C)(C)C)n2)cccc1-c1nnn[n-]1 ZINC000822109289 607296926 /nfs/dbraw/zinc/29/69/26/607296926.db2.gz PEONWCXMLANTLN-UHFFFAOYSA-N -1 3 367.457 3.502 20 0 FHADHM Cc1c(NC(=O)c2cc(C(C)C)n(C(C)(C)C)n2)cccc1-c1nn[n-]n1 ZINC000822109289 607296927 /nfs/dbraw/zinc/29/69/27/607296927.db2.gz PEONWCXMLANTLN-UHFFFAOYSA-N -1 3 367.457 3.502 20 0 FHADHM C[C@@H](NC(=O)c1ccc(-c2nnn[n-]2)cc1)c1cccc(Cl)c1Cl ZINC000736116491 599261352 /nfs/dbraw/zinc/26/13/52/599261352.db2.gz AVZGFUZAVYBJJN-SECBINFHSA-N -1 3 362.220 3.665 20 0 FHADHM C[C@@H](NC(=O)c1ccc(-c2nn[n-]n2)cc1)c1cccc(Cl)c1Cl ZINC000736116491 599261354 /nfs/dbraw/zinc/26/13/54/599261354.db2.gz AVZGFUZAVYBJJN-SECBINFHSA-N -1 3 362.220 3.665 20 0 FHADHM O[C@@H]1CCCC[C@@H]1CCCNc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000823706934 607306738 /nfs/dbraw/zinc/30/67/38/607306738.db2.gz RVUDSWQYUJCNLA-IAQYHMDHSA-N -1 3 369.391 3.629 20 0 FHADHM O[C@@H]1CCCC[C@@H]1CCCNc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000823706934 607306739 /nfs/dbraw/zinc/30/67/39/607306739.db2.gz RVUDSWQYUJCNLA-IAQYHMDHSA-N -1 3 369.391 3.629 20 0 FHADHM FC(F)Oc1ccc(NCc2cc(-c3nnn[n-]3)cs2)cc1Cl ZINC000822733157 607308419 /nfs/dbraw/zinc/30/84/19/607308419.db2.gz RFGJVKJKXPMVMB-UHFFFAOYSA-N -1 3 357.773 3.795 20 0 FHADHM FC(F)Oc1ccc(NCc2cc(-c3nn[n-]n3)cs2)cc1Cl ZINC000822733157 607308420 /nfs/dbraw/zinc/30/84/20/607308420.db2.gz RFGJVKJKXPMVMB-UHFFFAOYSA-N -1 3 357.773 3.795 20 0 FHADHM COc1ccc(CNc2cccc(OC3CCCC3)c2)cc1-c1nnn[n-]1 ZINC000821824523 607308984 /nfs/dbraw/zinc/30/89/84/607308984.db2.gz LSHBVLZMBKLAKE-UHFFFAOYSA-N -1 3 365.437 3.809 20 0 FHADHM COc1ccc(CNc2cccc(OC3CCCC3)c2)cc1-c1nn[n-]n1 ZINC000821824523 607308985 /nfs/dbraw/zinc/30/89/85/607308985.db2.gz LSHBVLZMBKLAKE-UHFFFAOYSA-N -1 3 365.437 3.809 20 0 FHADHM COc1ccc(CNc2ccc3oc(C4CC4)nc3c2)cc1-c1nnn[n-]1 ZINC000821821707 607309855 /nfs/dbraw/zinc/30/98/55/607309855.db2.gz SCSNVPLKVBRNQZ-UHFFFAOYSA-N -1 3 362.393 3.506 20 0 FHADHM COc1ccc(CNc2ccc3oc(C4CC4)nc3c2)cc1-c1nn[n-]n1 ZINC000821821707 607309856 /nfs/dbraw/zinc/30/98/56/607309856.db2.gz SCSNVPLKVBRNQZ-UHFFFAOYSA-N -1 3 362.393 3.506 20 0 FHADHM COc1ccc(CNc2ccc(SC(F)F)cc2)cc1-c1nnn[n-]1 ZINC000821821262 607310665 /nfs/dbraw/zinc/31/06/65/607310665.db2.gz CSNAHTQYWNXKNC-UHFFFAOYSA-N -1 3 363.393 3.802 20 0 FHADHM COc1ccc(CNc2ccc(SC(F)F)cc2)cc1-c1nn[n-]n1 ZINC000821821262 607310666 /nfs/dbraw/zinc/31/06/66/607310666.db2.gz CSNAHTQYWNXKNC-UHFFFAOYSA-N -1 3 363.393 3.802 20 0 FHADHM Fc1ccc(OCC(F)(F)F)c(NCc2ccc(-c3nnn[n-]3)s2)c1 ZINC000822783026 607311833 /nfs/dbraw/zinc/31/18/33/607311833.db2.gz QUKVDWRAWZHQGS-UHFFFAOYSA-N -1 3 373.335 3.621 20 0 FHADHM O[C@@H]1CCCC[C@@H]1CCCNc1ccc(C(F)(F)F)cc1-c1nnn[n-]1 ZINC000823704561 607306329 /nfs/dbraw/zinc/30/63/29/607306329.db2.gz CBUZXMVSDNPKEE-IAQYHMDHSA-N -1 3 369.391 3.629 20 0 FHADHM O[C@@H]1CCCC[C@@H]1CCCNc1ccc(C(F)(F)F)cc1-c1nn[n-]n1 ZINC000823704561 607306330 /nfs/dbraw/zinc/30/63/30/607306330.db2.gz CBUZXMVSDNPKEE-IAQYHMDHSA-N -1 3 369.391 3.629 20 0 FHADHM Cc1ccc(NCc2cc(-c3nnn[n-]3)cs2)cc1NC(=O)C(C)(C)C ZINC000822254143 607317173 /nfs/dbraw/zinc/31/71/73/607317173.db2.gz BBXYGYGFILAGDH-UHFFFAOYSA-N -1 3 370.482 3.833 20 0 FHADHM Cc1ccc(NCc2cc(-c3nn[n-]n3)cs2)cc1NC(=O)C(C)(C)C ZINC000822254143 607317174 /nfs/dbraw/zinc/31/71/74/607317174.db2.gz BBXYGYGFILAGDH-UHFFFAOYSA-N -1 3 370.482 3.833 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1ccc(CC)cc1 ZINC000736488400 599277391 /nfs/dbraw/zinc/27/73/91/599277391.db2.gz OAMGHDLTTWGERB-UHFFFAOYSA-N -1 3 350.426 3.503 20 0 FHADHM CCSCc1cccc(NCc2ccc(OC)c(-c3nnn[n-]3)c2)c1 ZINC000821460729 607318379 /nfs/dbraw/zinc/31/83/79/607318379.db2.gz BFSDKZPBVGVZMO-UHFFFAOYSA-N -1 3 355.467 3.741 20 0 FHADHM CCSCc1cccc(NCc2ccc(OC)c(-c3nn[n-]n3)c2)c1 ZINC000821460729 607318380 /nfs/dbraw/zinc/31/83/80/607318380.db2.gz BFSDKZPBVGVZMO-UHFFFAOYSA-N -1 3 355.467 3.741 20 0 FHADHM Cc1occc1-c1nnc(S[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)o1 ZINC000737551570 599288275 /nfs/dbraw/zinc/28/82/75/599288275.db2.gz JCZOZXTWOWSMEU-JTQLQIEISA-N -1 3 354.395 3.671 20 0 FHADHM Cc1occc1-c1nnc(S[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)o1 ZINC000737551570 599288277 /nfs/dbraw/zinc/28/82/77/599288277.db2.gz JCZOZXTWOWSMEU-JTQLQIEISA-N -1 3 354.395 3.671 20 0 FHADHM CCN(c1ccc(C(=O)Nc2cccc(-c3nnn[n-]3)c2C)cc1)C(C)C ZINC000821230869 607321749 /nfs/dbraw/zinc/32/17/49/607321749.db2.gz SXHTYKOQHUPJBI-UHFFFAOYSA-N -1 3 364.453 3.662 20 0 FHADHM CCN(c1ccc(C(=O)Nc2cccc(-c3nn[n-]n3)c2C)cc1)C(C)C ZINC000821230869 607321750 /nfs/dbraw/zinc/32/17/50/607321750.db2.gz SXHTYKOQHUPJBI-UHFFFAOYSA-N -1 3 364.453 3.662 20 0 FHADHM Cc1nccn1-c1ccc([C@@H](C)Nc2ccc(F)cc2-c2nnn[n-]2)cc1 ZINC000822479282 607328935 /nfs/dbraw/zinc/32/89/35/607328935.db2.gz ZXWXAZUEZMFJLJ-GFCCVEGCSA-N -1 3 363.400 3.673 20 0 FHADHM Cc1nccn1-c1ccc([C@@H](C)Nc2ccc(F)cc2-c2nn[n-]n2)cc1 ZINC000822479282 607328936 /nfs/dbraw/zinc/32/89/36/607328936.db2.gz ZXWXAZUEZMFJLJ-GFCCVEGCSA-N -1 3 363.400 3.673 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)N[C@H](c1ccccc1)C1CCC1 ZINC000737798577 598232269 /nfs/dbraw/zinc/23/22/69/598232269.db2.gz MGMZSEXRDIIMRO-CLEWGBKMSA-N -1 3 359.433 3.538 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)N[C@H](c1ccccc1)C1CCC1 ZINC000737798577 598232270 /nfs/dbraw/zinc/23/22/70/598232270.db2.gz MGMZSEXRDIIMRO-CLEWGBKMSA-N -1 3 359.433 3.538 20 0 FHADHM Fc1cccc(C=C2CCN(c3cccc(F)c3-c3nnn[n-]3)CC2)c1 ZINC000737666425 598240187 /nfs/dbraw/zinc/24/01/87/598240187.db2.gz LBSZLTZVRFJHIN-UHFFFAOYSA-N -1 3 353.376 3.829 20 0 FHADHM Fc1cccc(C=C2CCN(c3cccc(F)c3-c3nn[n-]n3)CC2)c1 ZINC000737666425 598240189 /nfs/dbraw/zinc/24/01/89/598240189.db2.gz LBSZLTZVRFJHIN-UHFFFAOYSA-N -1 3 353.376 3.829 20 0 FHADHM CC(C)CC(=O)Nc1cccc(CNc2ccc(-c3nn[n-]n3)cc2F)c1 ZINC000735755111 598241351 /nfs/dbraw/zinc/24/13/51/598241351.db2.gz CCRSMQZZERWDEP-UHFFFAOYSA-N -1 3 368.416 3.603 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1NC[C@H]1CCN(c2ccc(Cl)cc2)C1 ZINC000737641756 598242199 /nfs/dbraw/zinc/24/21/99/598242199.db2.gz XXRGXIJZQSIPIM-GFCCVEGCSA-N -1 3 372.835 3.598 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1NCc1ccc(Oc2ccccc2)nc1 ZINC000737643232 598244885 /nfs/dbraw/zinc/24/48/85/598244885.db2.gz DIDBKLOYELEUCC-UHFFFAOYSA-N -1 3 362.368 3.805 20 0 FHADHM CCC[C@H](NC(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccccn1 ZINC000736431549 598263856 /nfs/dbraw/zinc/26/38/56/598263856.db2.gz MLMJLGLXTRAIBR-HNNXBMFYSA-N -1 3 371.832 3.578 20 0 FHADHM CCC[C@H](NC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccccn1 ZINC000736431549 598263858 /nfs/dbraw/zinc/26/38/58/598263858.db2.gz MLMJLGLXTRAIBR-HNNXBMFYSA-N -1 3 371.832 3.578 20 0 FHADHM CC[C@@H](SCC(=O)Nc1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000736393536 598273171 /nfs/dbraw/zinc/27/31/71/598273171.db2.gz ZJZUOLZWTGAWAM-MRXNPFEDSA-N -1 3 353.451 3.690 20 0 FHADHM CC[C@@H](SCC(=O)Nc1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000736393536 598273172 /nfs/dbraw/zinc/27/31/72/598273172.db2.gz ZJZUOLZWTGAWAM-MRXNPFEDSA-N -1 3 353.451 3.690 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1Oc1nc(C(F)F)nc2ccccc21 ZINC000737031942 598274029 /nfs/dbraw/zinc/27/40/29/598274029.db2.gz HWPJJACLDQNJTA-UHFFFAOYSA-N -1 3 370.319 3.548 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1Oc1nc(C(F)F)nc2ccccc21 ZINC000737031942 598274030 /nfs/dbraw/zinc/27/40/30/598274030.db2.gz HWPJJACLDQNJTA-UHFFFAOYSA-N -1 3 370.319 3.548 20 0 FHADHM Fc1ccc(OCCNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)cc1 ZINC000737656934 598276032 /nfs/dbraw/zinc/27/60/32/598276032.db2.gz QYZKOZZXEUBXRK-UHFFFAOYSA-N -1 3 367.306 3.516 20 0 FHADHM Fc1ccc(OCCNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)cc1 ZINC000737656934 598276033 /nfs/dbraw/zinc/27/60/33/598276033.db2.gz QYZKOZZXEUBXRK-UHFFFAOYSA-N -1 3 367.306 3.516 20 0 FHADHM Cc1nc(-c2ccsc2)ccc1C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000101853256 598295224 /nfs/dbraw/zinc/29/52/24/598295224.db2.gz WCSMQFLQWDHFTL-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1nc(-c2ccsc2)ccc1C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000101853256 598295225 /nfs/dbraw/zinc/29/52/25/598295225.db2.gz WCSMQFLQWDHFTL-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1nc(-c2ccsc2)ccc1C(=O)Oc1ccc(-c2nn[n-]n2)cc1 ZINC000737464790 598296354 /nfs/dbraw/zinc/29/63/54/598296354.db2.gz YBNBSINRRKQQNP-UHFFFAOYSA-N -1 3 363.402 3.518 20 0 FHADHM O=C(Oc1ccc(-c2ccc(-c3nnn[n-]3)cc2)cc1)C1(C(F)(F)F)CC1 ZINC000738251507 598296493 /nfs/dbraw/zinc/29/64/93/598296493.db2.gz PPKMAAGGJYIBRM-UHFFFAOYSA-N -1 3 374.322 3.782 20 0 FHADHM O=C(Oc1ccc(-c2ccc(-c3nn[n-]n3)cc2)cc1)C1(C(F)(F)F)CC1 ZINC000738251507 598296495 /nfs/dbraw/zinc/29/64/95/598296495.db2.gz PPKMAAGGJYIBRM-UHFFFAOYSA-N -1 3 374.322 3.782 20 0 FHADHM CCCc1sc(C(=O)NCc2ccc(-c3nnn[n-]3)cc2F)cc1CC ZINC000736499419 598304646 /nfs/dbraw/zinc/30/46/46/598304646.db2.gz DZUQZJBCOWAWFS-UHFFFAOYSA-N -1 3 373.457 3.512 20 0 FHADHM CCCc1sc(C(=O)NCc2ccc(-c3nn[n-]n3)cc2F)cc1CC ZINC000736499419 598304648 /nfs/dbraw/zinc/30/46/48/598304648.db2.gz DZUQZJBCOWAWFS-UHFFFAOYSA-N -1 3 373.457 3.512 20 0 FHADHM C[C@H](OC(=O)CCc1ccc(-c2nnn[n-]2)cc1)c1cnc2ccccc2c1 ZINC000736152325 598306411 /nfs/dbraw/zinc/30/64/11/598306411.db2.gz SSMSPAVNOPJHDI-AWEZNQCLSA-N -1 3 373.416 3.652 20 0 FHADHM C[C@H](OC(=O)CCc1ccc(-c2nn[n-]n2)cc1)c1cnc2ccccc2c1 ZINC000736152325 598306413 /nfs/dbraw/zinc/30/64/13/598306413.db2.gz SSMSPAVNOPJHDI-AWEZNQCLSA-N -1 3 373.416 3.652 20 0 FHADHM Cc1cc(F)ccc1C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCCC2 ZINC000822205690 607349488 /nfs/dbraw/zinc/34/94/88/607349488.db2.gz FIGSXDHXBFAVNH-UHFFFAOYSA-N -1 3 371.441 3.897 20 0 FHADHM Cc1cc(F)ccc1C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCCC2 ZINC000822205690 607349490 /nfs/dbraw/zinc/34/94/90/607349490.db2.gz FIGSXDHXBFAVNH-UHFFFAOYSA-N -1 3 371.441 3.897 20 0 FHADHM Cc1cccc(C)c1NC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000737390492 598317785 /nfs/dbraw/zinc/31/77/85/598317785.db2.gz QQLKBCFPNYGISN-UHFFFAOYSA-N -1 3 358.858 3.946 20 0 FHADHM Cc1cccc(C)c1NC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000737390492 598317787 /nfs/dbraw/zinc/31/77/87/598317787.db2.gz QQLKBCFPNYGISN-UHFFFAOYSA-N -1 3 358.858 3.946 20 0 FHADHM CC[C@H]1CCCC[C@@H]1NC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736400692 598320318 /nfs/dbraw/zinc/32/03/18/598320318.db2.gz RKSNXBFCLURBND-HZMBPMFUSA-N -1 3 364.906 3.775 20 0 FHADHM CC[C@H]1CCCC[C@@H]1NC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736400692 598320320 /nfs/dbraw/zinc/32/03/20/598320320.db2.gz RKSNXBFCLURBND-HZMBPMFUSA-N -1 3 364.906 3.775 20 0 FHADHM Cc1ccc(N(C)C(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1C ZINC000737348444 598322550 /nfs/dbraw/zinc/32/25/50/598322550.db2.gz ZOEMQZKTAARWMS-UHFFFAOYSA-N -1 3 372.885 3.970 20 0 FHADHM Cc1ccc(N(C)C(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1C ZINC000737348444 598322551 /nfs/dbraw/zinc/32/25/51/598322551.db2.gz ZOEMQZKTAARWMS-UHFFFAOYSA-N -1 3 372.885 3.970 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H]2CCCc3sccc32)c1-c1nnn[n-]1 ZINC000821465047 607350656 /nfs/dbraw/zinc/35/06/56/607350656.db2.gz AIEAJFNSNWXLQQ-LBPRGKRZSA-N -1 3 373.507 3.919 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H]2CCCc3sccc32)c1-c1nn[n-]n1 ZINC000821465047 607350658 /nfs/dbraw/zinc/35/06/58/607350658.db2.gz AIEAJFNSNWXLQQ-LBPRGKRZSA-N -1 3 373.507 3.919 20 0 FHADHM c1ccc(-c2nnc(SCc3ccccc3-c3nnn[n-]3)s2)cc1 ZINC000738423602 598360041 /nfs/dbraw/zinc/36/00/41/598360041.db2.gz QPMOYWSTFLBPLN-UHFFFAOYSA-N -1 3 352.448 3.678 20 0 FHADHM c1ccc(-c2nnc(SCc3ccccc3-c3nn[n-]n3)s2)cc1 ZINC000738423602 598360043 /nfs/dbraw/zinc/36/00/43/598360043.db2.gz QPMOYWSTFLBPLN-UHFFFAOYSA-N -1 3 352.448 3.678 20 0 FHADHM CCC(C)(C)C(=O)Nc1cccc(OCc2cccc(-c3nnn[n-]3)c2)c1 ZINC000736315488 598365276 /nfs/dbraw/zinc/36/52/76/598365276.db2.gz ZZPBFMCJYSURLZ-UHFFFAOYSA-N -1 3 365.437 3.820 20 0 FHADHM CCC(C)(C)C(=O)Nc1cccc(OCc2cccc(-c3nn[n-]n3)c2)c1 ZINC000736315488 598365278 /nfs/dbraw/zinc/36/52/78/598365278.db2.gz ZZPBFMCJYSURLZ-UHFFFAOYSA-N -1 3 365.437 3.820 20 0 FHADHM Cc1cccc(CC(=O)Nc2sc3c(c2-c2nnn[n-]2)CC[C@@H](C)C3)c1 ZINC000737392138 598365480 /nfs/dbraw/zinc/36/54/80/598365480.db2.gz PAPNRJXWQLZWAF-GFCCVEGCSA-N -1 3 367.478 3.543 20 0 FHADHM Cc1cccc(CC(=O)Nc2sc3c(c2-c2nn[n-]n2)CC[C@@H](C)C3)c1 ZINC000737392138 598365481 /nfs/dbraw/zinc/36/54/81/598365481.db2.gz PAPNRJXWQLZWAF-GFCCVEGCSA-N -1 3 367.478 3.543 20 0 FHADHM Cc1nnc(Nc2ccc(SC(C)(C)C)cc2)c(-c2nnn[n-]2)c1C ZINC000737532472 598368347 /nfs/dbraw/zinc/36/83/47/598368347.db2.gz IVWLDXRDLFTILJ-UHFFFAOYSA-N -1 3 355.471 3.908 20 0 FHADHM Cc1nnc(Nc2ccc(SC(C)(C)C)cc2)c(-c2nn[n-]n2)c1C ZINC000737532472 598368348 /nfs/dbraw/zinc/36/83/48/598368348.db2.gz IVWLDXRDLFTILJ-UHFFFAOYSA-N -1 3 355.471 3.908 20 0 FHADHM CC1(C)CCN(C(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)CC1 ZINC000736211133 598385549 /nfs/dbraw/zinc/38/55/49/598385549.db2.gz LFNXHJBGYPORSW-UHFFFAOYSA-N -1 3 361.449 3.796 20 0 FHADHM CC1(C)CCN(C(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)CC1 ZINC000736211133 598385551 /nfs/dbraw/zinc/38/55/51/598385551.db2.gz LFNXHJBGYPORSW-UHFFFAOYSA-N -1 3 361.449 3.796 20 0 FHADHM C[C@H](Nc1ncc(-c2nnn[n-]2)cc1Cl)c1ccc2c(c1)CCCC2 ZINC000736138182 598386308 /nfs/dbraw/zinc/38/63/08/598386308.db2.gz OSAJKQNHDNPPIM-NSHDSACASA-N -1 3 354.845 3.967 20 0 FHADHM C[C@H](Nc1ncc(-c2nn[n-]n2)cc1Cl)c1ccc2c(c1)CCCC2 ZINC000736138182 598386309 /nfs/dbraw/zinc/38/63/09/598386309.db2.gz OSAJKQNHDNPPIM-NSHDSACASA-N -1 3 354.845 3.967 20 0 FHADHM Cc1ccc(C)c(CSCCC(=O)Nc2cccc(-c3nnn[n-]3)c2)c1 ZINC000737321411 598393065 /nfs/dbraw/zinc/39/30/65/598393065.db2.gz FFQJWAFDTZHBDZ-UHFFFAOYSA-N -1 3 367.478 3.746 20 0 FHADHM Cc1ccc(C)c(CSCCC(=O)Nc2cccc(-c3nn[n-]n3)c2)c1 ZINC000737321411 598393066 /nfs/dbraw/zinc/39/30/66/598393066.db2.gz FFQJWAFDTZHBDZ-UHFFFAOYSA-N -1 3 367.478 3.746 20 0 FHADHM CC1(C)CCN(c2c(-c3nnn[n-]3)cnc3c(F)ccc(Cl)c32)CC1 ZINC000736211289 598394480 /nfs/dbraw/zinc/39/44/80/598394480.db2.gz OGZMIKQOXHSQDS-UHFFFAOYSA-N -1 3 360.824 3.834 20 0 FHADHM CC1(C)CCN(c2c(-c3nn[n-]n3)cnc3c(F)ccc(Cl)c32)CC1 ZINC000736211289 598394482 /nfs/dbraw/zinc/39/44/82/598394482.db2.gz OGZMIKQOXHSQDS-UHFFFAOYSA-N -1 3 360.824 3.834 20 0 FHADHM CC(C)N(C(=S)Nc1ccc(Cl)nc1)c1cccc(-c2nnn[n-]2)c1 ZINC000735856565 598416301 /nfs/dbraw/zinc/41/63/01/598416301.db2.gz LBBIXRXVCOEKBF-UHFFFAOYSA-N -1 3 373.873 3.527 20 0 FHADHM CC(C)N(C(=S)Nc1ccc(Cl)nc1)c1cccc(-c2nn[n-]n2)c1 ZINC000735856565 598416303 /nfs/dbraw/zinc/41/63/03/598416303.db2.gz LBBIXRXVCOEKBF-UHFFFAOYSA-N -1 3 373.873 3.527 20 0 FHADHM CCN(C(=O)[C@H](C)Sc1ccc(-c2nnn[n-]2)cc1)C1CCCCC1 ZINC000736501237 598416749 /nfs/dbraw/zinc/41/67/49/598416749.db2.gz BHFSLHGFEYYNFS-ZDUSSCGKSA-N -1 3 359.499 3.529 20 0 FHADHM CCN(C(=O)[C@H](C)Sc1ccc(-c2nn[n-]n2)cc1)C1CCCCC1 ZINC000736501237 598416750 /nfs/dbraw/zinc/41/67/50/598416750.db2.gz BHFSLHGFEYYNFS-ZDUSSCGKSA-N -1 3 359.499 3.529 20 0 FHADHM CCN(C(=O)c1cc(C)ccc1F)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736505424 598416851 /nfs/dbraw/zinc/41/68/51/598416851.db2.gz ILWJIAMIQHKHDQ-ZDUSSCGKSA-N -1 3 353.401 3.538 20 0 FHADHM CCN(C(=O)c1cc(C)ccc1F)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736505424 598416853 /nfs/dbraw/zinc/41/68/53/598416853.db2.gz ILWJIAMIQHKHDQ-ZDUSSCGKSA-N -1 3 353.401 3.538 20 0 FHADHM CC(C)[C@H](Sc1ccccc1)C(=O)OCc1cccc(-c2nnn[n-]2)c1 ZINC000735733582 598425364 /nfs/dbraw/zinc/42/53/64/598425364.db2.gz BNWWIJUIWNEREE-KRWDZBQOSA-N -1 3 368.462 3.727 20 0 FHADHM CC(C)[C@H](Sc1ccccc1)C(=O)OCc1cccc(-c2nn[n-]n2)c1 ZINC000735733582 598425366 /nfs/dbraw/zinc/42/53/66/598425366.db2.gz BNWWIJUIWNEREE-KRWDZBQOSA-N -1 3 368.462 3.727 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)NC1CCCCCCC1 ZINC000735875563 598428095 /nfs/dbraw/zinc/42/80/95/598428095.db2.gz WALFVVDCDQVBGQ-UHFFFAOYSA-N -1 3 370.501 3.900 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)NC1CCCCCCC1 ZINC000735875563 598428096 /nfs/dbraw/zinc/42/80/96/598428096.db2.gz WALFVVDCDQVBGQ-UHFFFAOYSA-N -1 3 370.501 3.900 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)NC[C@H]1CCCC[C@H]1C ZINC000736271835 598429794 /nfs/dbraw/zinc/42/97/94/598429794.db2.gz OTWWQICOEISXDM-CRAIPNDOSA-N -1 3 370.501 3.613 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)NC[C@H]1CCCC[C@H]1C ZINC000736271835 598429795 /nfs/dbraw/zinc/42/97/95/598429795.db2.gz OTWWQICOEISXDM-CRAIPNDOSA-N -1 3 370.501 3.613 20 0 FHADHM Cc1cc(C)cc([C@H](C)NC(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)c1 ZINC000737253041 598431590 /nfs/dbraw/zinc/43/15/90/598431590.db2.gz OGKFTFWXMKLIFF-LBPRGKRZSA-N -1 3 354.389 3.505 20 0 FHADHM Cc1cc(C)cc([C@H](C)NC(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)c1 ZINC000737253041 598431591 /nfs/dbraw/zinc/43/15/91/598431591.db2.gz OGKFTFWXMKLIFF-LBPRGKRZSA-N -1 3 354.389 3.505 20 0 FHADHM O=C(Nc1ccccc1-c1nnn[n-]1)[C@H]1C[C@H]1c1cccc2ccccc21 ZINC000738190195 598435660 /nfs/dbraw/zinc/43/56/60/598435660.db2.gz AZXJMYCHUKPJFQ-ROUUACIJSA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1ccccc1-c1nn[n-]n1)[C@H]1C[C@H]1c1cccc2ccccc21 ZINC000738190195 598435662 /nfs/dbraw/zinc/43/56/62/598435662.db2.gz AZXJMYCHUKPJFQ-ROUUACIJSA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1ccccc1-c1nnn[n-]1)[C@@H]1C[C@@H]1c1cccc2ccccc21 ZINC000738190194 598436015 /nfs/dbraw/zinc/43/60/15/598436015.db2.gz AZXJMYCHUKPJFQ-QZTJIDSGSA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1ccccc1-c1nn[n-]n1)[C@@H]1C[C@@H]1c1cccc2ccccc21 ZINC000738190194 598436016 /nfs/dbraw/zinc/43/60/16/598436016.db2.gz AZXJMYCHUKPJFQ-QZTJIDSGSA-N -1 3 355.401 3.762 20 0 FHADHM COc1ccccc1C(C)=CC(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000737141967 598442759 /nfs/dbraw/zinc/44/27/59/598442759.db2.gz LFGTWUMTBRLHMG-PKNBQFBNSA-N -1 3 369.812 3.571 20 0 FHADHM COc1ccccc1C(C)=CC(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000737141967 598442761 /nfs/dbraw/zinc/44/27/61/598442761.db2.gz LFGTWUMTBRLHMG-PKNBQFBNSA-N -1 3 369.812 3.571 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)ccc1OCCSc1ccc(F)cc1 ZINC000736625391 598471424 /nfs/dbraw/zinc/47/14/24/598471424.db2.gz DZRLHQODMFNABH-UHFFFAOYSA-N -1 3 360.414 3.576 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)ccc1OCCSc1ccc(F)cc1 ZINC000736625391 598471426 /nfs/dbraw/zinc/47/14/26/598471426.db2.gz DZRLHQODMFNABH-UHFFFAOYSA-N -1 3 360.414 3.576 20 0 FHADHM CCc1ccccc1NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000736702904 598474471 /nfs/dbraw/zinc/47/44/71/598474471.db2.gz YOGKNLCCIMVRTK-UHFFFAOYSA-N -1 3 362.437 3.626 20 0 FHADHM CCc1ccccc1NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000736702904 598474472 /nfs/dbraw/zinc/47/44/72/598474472.db2.gz YOGKNLCCIMVRTK-UHFFFAOYSA-N -1 3 362.437 3.626 20 0 FHADHM CC[C@@H]1CCCC[C@@H]1NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000736401420 598478027 /nfs/dbraw/zinc/47/80/27/598478027.db2.gz WLKGYDQKDVEZRL-QAPCUYQASA-N -1 3 368.485 3.510 20 0 FHADHM CC[C@@H]1CCCC[C@@H]1NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000736401420 598478028 /nfs/dbraw/zinc/47/80/28/598478028.db2.gz WLKGYDQKDVEZRL-QAPCUYQASA-N -1 3 368.485 3.510 20 0 FHADHM C[C@H](OC(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1)c1cccc(-c2nnn[n-]2)c1 ZINC000736151167 598484049 /nfs/dbraw/zinc/48/40/49/598484049.db2.gz LDAFMERHAMLEHD-GDLCADMTSA-N -1 3 368.359 3.840 20 0 FHADHM C[C@H](OC(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1)c1cccc(-c2nn[n-]n2)c1 ZINC000736151167 598484051 /nfs/dbraw/zinc/48/40/51/598484051.db2.gz LDAFMERHAMLEHD-GDLCADMTSA-N -1 3 368.359 3.840 20 0 FHADHM C[C@@H](OC(=O)/C=C/Sc1ccccc1)c1cccc(-c2nnn[n-]2)c1 ZINC000736153671 598489030 /nfs/dbraw/zinc/48/90/30/598489030.db2.gz RIBDHIWEBWRBOS-OCHBPSSRSA-N -1 3 352.419 3.777 20 0 FHADHM C[C@@H](OC(=O)/C=C/Sc1ccccc1)c1cccc(-c2nn[n-]n2)c1 ZINC000736153671 598489032 /nfs/dbraw/zinc/48/90/32/598489032.db2.gz RIBDHIWEBWRBOS-OCHBPSSRSA-N -1 3 352.419 3.777 20 0 FHADHM CC(=CC(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C)c1ccc(F)cc1 ZINC000735446623 598490410 /nfs/dbraw/zinc/49/04/10/598490410.db2.gz CETZHXIVASGFLH-XFXZXTDPSA-N -1 3 368.416 3.604 20 0 FHADHM CC(=CC(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C)c1ccc(F)cc1 ZINC000735446623 598490411 /nfs/dbraw/zinc/49/04/11/598490411.db2.gz CETZHXIVASGFLH-XFXZXTDPSA-N -1 3 368.416 3.604 20 0 FHADHM C[C@H](OC(=O)CCn1ccc2ccccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000736147652 598491320 /nfs/dbraw/zinc/49/13/20/598491320.db2.gz DUGJOGZYLQEWIV-AWEZNQCLSA-N -1 3 361.405 3.516 20 0 FHADHM C[C@H](OC(=O)CCn1ccc2ccccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000736147652 598491321 /nfs/dbraw/zinc/49/13/21/598491321.db2.gz DUGJOGZYLQEWIV-AWEZNQCLSA-N -1 3 361.405 3.516 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)Cc1cccc(Cl)c1 ZINC000736481140 598494779 /nfs/dbraw/zinc/49/47/79/598494779.db2.gz UPQGQZFIACWYBJ-UHFFFAOYSA-N -1 3 369.856 3.501 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)Cc1cccc(Cl)c1 ZINC000736481140 598494780 /nfs/dbraw/zinc/49/47/80/598494780.db2.gz UPQGQZFIACWYBJ-UHFFFAOYSA-N -1 3 369.856 3.501 20 0 FHADHM FC(F)Oc1ccccc1CNc1ccc(Cl)cc1-c1nnn[n-]1 ZINC000737640076 598508352 /nfs/dbraw/zinc/50/83/52/598508352.db2.gz ZIPLTOXTKYNPSU-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM FC(F)Oc1ccccc1CNc1ccc(Cl)cc1-c1nn[n-]n1 ZINC000737640076 598508354 /nfs/dbraw/zinc/50/83/54/598508354.db2.gz ZIPLTOXTKYNPSU-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H](C)Cc2cccc(F)c2)c1-c1nnn[n-]1 ZINC000736669315 598515225 /nfs/dbraw/zinc/51/52/25/598515225.db2.gz DFEFHTPIIQEGRY-SNVBAGLBSA-N -1 3 373.457 3.755 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H](C)Cc2cccc(F)c2)c1-c1nn[n-]n1 ZINC000736669315 598515227 /nfs/dbraw/zinc/51/52/27/598515227.db2.gz DFEFHTPIIQEGRY-SNVBAGLBSA-N -1 3 373.457 3.755 20 0 FHADHM CCc1c(C)sc(NC(=O)C=Cc2cccc(F)c2)c1-c1nnn[n-]1 ZINC000736671178 598517099 /nfs/dbraw/zinc/51/70/99/598517099.db2.gz TUNCBQRCGBHQMK-BQYQJAHWSA-N -1 3 357.414 3.590 20 0 FHADHM CCc1c(C)sc(NC(=O)C=Cc2cccc(F)c2)c1-c1nn[n-]n1 ZINC000736671178 598517101 /nfs/dbraw/zinc/51/71/01/598517101.db2.gz TUNCBQRCGBHQMK-BQYQJAHWSA-N -1 3 357.414 3.590 20 0 FHADHM c1cc(-c2ccc(-c3nnn[n-]3)cc2)ccc1OCc1noc2c1CCCC2 ZINC000738405422 598532665 /nfs/dbraw/zinc/53/26/65/598532665.db2.gz PBNHFUWIUQISIH-UHFFFAOYSA-N -1 3 373.416 3.980 20 0 FHADHM c1cc(-c2ccc(-c3nn[n-]n3)cc2)ccc1OCc1noc2c1CCCC2 ZINC000738405422 598532667 /nfs/dbraw/zinc/53/26/67/598532667.db2.gz PBNHFUWIUQISIH-UHFFFAOYSA-N -1 3 373.416 3.980 20 0 FHADHM O=C(Oc1ccc(-c2nnn[n-]2)cc1)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000738250178 598533919 /nfs/dbraw/zinc/53/39/19/598533919.db2.gz DNJRJQYIDFXUSM-RTBURBONSA-N -1 3 356.385 3.729 20 0 FHADHM O=C(Oc1ccc(-c2nn[n-]n2)cc1)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000738250178 598533921 /nfs/dbraw/zinc/53/39/21/598533921.db2.gz DNJRJQYIDFXUSM-RTBURBONSA-N -1 3 356.385 3.729 20 0 FHADHM Cc1ccc(C)c(CC(=O)N(CC(C)C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737321611 598541317 /nfs/dbraw/zinc/54/13/17/598541317.db2.gz GQTAVNHMAYEQSM-UHFFFAOYSA-N -1 3 363.465 3.715 20 0 FHADHM Cc1ccc(C)c(CC(=O)N(CC(C)C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737321611 598541318 /nfs/dbraw/zinc/54/13/18/598541318.db2.gz GQTAVNHMAYEQSM-UHFFFAOYSA-N -1 3 363.465 3.715 20 0 FHADHM CC[C@H](C)C(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)cc1C ZINC000736318877 598541713 /nfs/dbraw/zinc/54/17/13/598541713.db2.gz FLRBBWLSFUNDNC-ZDUSSCGKSA-N -1 3 365.437 3.739 20 0 FHADHM CC[C@H](C)C(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)cc1C ZINC000736318877 598541715 /nfs/dbraw/zinc/54/17/15/598541715.db2.gz FLRBBWLSFUNDNC-ZDUSSCGKSA-N -1 3 365.437 3.739 20 0 FHADHM CC[C@@H](C)C(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)cc1C ZINC000736318875 598541734 /nfs/dbraw/zinc/54/17/34/598541734.db2.gz FLRBBWLSFUNDNC-CYBMUJFWSA-N -1 3 365.437 3.739 20 0 FHADHM CC[C@@H](C)C(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)cc1C ZINC000736318875 598541736 /nfs/dbraw/zinc/54/17/36/598541736.db2.gz FLRBBWLSFUNDNC-CYBMUJFWSA-N -1 3 365.437 3.739 20 0 FHADHM O=C(OCc1ccc(-c2nnn[n-]2)cc1)[C@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000738236300 598544610 /nfs/dbraw/zinc/54/46/10/598544610.db2.gz ITVKJHUYVMZIRP-PMACEKPBSA-N -1 3 370.412 3.867 20 0 FHADHM O=C(OCc1ccc(-c2nn[n-]n2)cc1)[C@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000738236300 598544612 /nfs/dbraw/zinc/54/46/12/598544612.db2.gz ITVKJHUYVMZIRP-PMACEKPBSA-N -1 3 370.412 3.867 20 0 FHADHM CCCc1ccc(C(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(F)F)cc1 ZINC000736496872 598545057 /nfs/dbraw/zinc/54/50/57/598545057.db2.gz KCUWHNXZHLCAKO-UHFFFAOYSA-N -1 3 373.363 3.673 20 0 FHADHM CCCc1ccc(C(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(F)F)cc1 ZINC000736496872 598545059 /nfs/dbraw/zinc/54/50/59/598545059.db2.gz KCUWHNXZHLCAKO-UHFFFAOYSA-N -1 3 373.363 3.673 20 0 FHADHM C[C@@H]1CCCC[C@H]1CC(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(F)F ZINC000736263447 598545139 /nfs/dbraw/zinc/54/51/39/598545139.db2.gz QUNYUJHKCBWSSE-MNOVXSKESA-N -1 3 365.384 3.623 20 0 FHADHM C[C@@H]1CCCC[C@H]1CC(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(F)F ZINC000736263447 598545141 /nfs/dbraw/zinc/54/51/41/598545141.db2.gz QUNYUJHKCBWSSE-MNOVXSKESA-N -1 3 365.384 3.623 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1)NC1CCCC1 ZINC000738174427 598562548 /nfs/dbraw/zinc/56/25/48/598562548.db2.gz ZFHGTMRVEMBPOD-UHFFFAOYSA-N -1 3 364.409 3.723 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1)NC1CCCC1 ZINC000738174427 598562549 /nfs/dbraw/zinc/56/25/49/598562549.db2.gz ZFHGTMRVEMBPOD-UHFFFAOYSA-N -1 3 364.409 3.723 20 0 FHADHM O=C(Nc1ccccc1-c1nnn[n-]1)[C@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000738192828 598572406 /nfs/dbraw/zinc/57/24/06/598572406.db2.gz XIIBVXKUVUMIHP-NEPJUHHUSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1ccccc1-c1nn[n-]n1)[C@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000738192828 598572408 /nfs/dbraw/zinc/57/24/08/598572408.db2.gz XIIBVXKUVUMIHP-NEPJUHHUSA-N -1 3 374.231 3.916 20 0 FHADHM C[C@H](Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)c1nc2ccccc2[nH]1 ZINC000736139943 598577660 /nfs/dbraw/zinc/57/76/60/598577660.db2.gz SBMGFYZOSVFCAK-VIFPVBQESA-N -1 3 373.342 3.935 20 0 FHADHM C[C@H](Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)c1nc2ccccc2[nH]1 ZINC000736139943 598577661 /nfs/dbraw/zinc/57/76/61/598577661.db2.gz SBMGFYZOSVFCAK-VIFPVBQESA-N -1 3 373.342 3.935 20 0 FHADHM CC[C@H](C)C(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)c(F)c1 ZINC000736320971 598591882 /nfs/dbraw/zinc/59/18/82/598591882.db2.gz ZYCSGQPHBIURIY-LBPRGKRZSA-N -1 3 369.400 3.569 20 0 FHADHM CC[C@H](C)C(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)c(F)c1 ZINC000736320971 598591884 /nfs/dbraw/zinc/59/18/84/598591884.db2.gz ZYCSGQPHBIURIY-LBPRGKRZSA-N -1 3 369.400 3.569 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1N[C@H](c1ccccc1)c1ccccn1 ZINC000737558931 598592377 /nfs/dbraw/zinc/59/23/77/598592377.db2.gz SBTOSPHMXIBKTG-MRXNPFEDSA-N -1 3 363.812 3.512 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1N[C@H](c1ccccc1)c1ccccn1 ZINC000737558931 598592378 /nfs/dbraw/zinc/59/23/78/598592378.db2.gz SBTOSPHMXIBKTG-MRXNPFEDSA-N -1 3 363.812 3.512 20 0 FHADHM c1ccc(SC2(CNc3ncccc3-c3nnn[n-]3)CCCC2)cc1 ZINC000738433314 598594687 /nfs/dbraw/zinc/59/46/87/598594687.db2.gz PYIALLTUYHUHEP-UHFFFAOYSA-N -1 3 352.467 3.779 20 0 FHADHM c1ccc(SC2(CNc3ncccc3-c3nn[n-]n3)CCCC2)cc1 ZINC000738433314 598594688 /nfs/dbraw/zinc/59/46/88/598594688.db2.gz PYIALLTUYHUHEP-UHFFFAOYSA-N -1 3 352.467 3.779 20 0 FHADHM CCC[C@@H]1CCCC[C@@H]1NC(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736435455 598617330 /nfs/dbraw/zinc/61/73/30/598617330.db2.gz LTKYZUIUXOQLDR-UNEWFSDZSA-N -1 3 356.474 3.586 20 0 FHADHM CCC[C@@H]1CCCC[C@@H]1NC(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736435455 598617332 /nfs/dbraw/zinc/61/73/32/598617332.db2.gz LTKYZUIUXOQLDR-UNEWFSDZSA-N -1 3 356.474 3.586 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccc(Cl)s1 ZINC000736117539 598624569 /nfs/dbraw/zinc/62/45/69/598624569.db2.gz PZYMBMWAMNHHGX-SSDOTTSWSA-N -1 3 366.809 3.603 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccc(Cl)s1 ZINC000736117539 598624572 /nfs/dbraw/zinc/62/45/72/598624572.db2.gz PZYMBMWAMNHHGX-SSDOTTSWSA-N -1 3 366.809 3.603 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)N[C@@H]1CCCCc2ccccc21 ZINC000738166453 598628667 /nfs/dbraw/zinc/62/86/67/598628667.db2.gz JQDFGUOBPFHVNY-QGZVFWFLSA-N -1 3 366.400 3.595 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)N[C@@H]1CCCCc2ccccc21 ZINC000738166453 598628668 /nfs/dbraw/zinc/62/86/68/598628668.db2.gz JQDFGUOBPFHVNY-QGZVFWFLSA-N -1 3 366.400 3.595 20 0 FHADHM Cc1ccc(-c2nnc(SCc3ccc(F)cc3-c3nnn[n-]3)o2)cc1 ZINC000737287654 598643036 /nfs/dbraw/zinc/64/30/36/598643036.db2.gz FVUZSSSMKCTTAK-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM Cc1ccc(-c2nnc(SCc3ccc(F)cc3-c3nn[n-]n3)o2)cc1 ZINC000737287654 598643038 /nfs/dbraw/zinc/64/30/38/598643038.db2.gz FVUZSSSMKCTTAK-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM CCC[C@@H](NC(=O)CSc1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000736430484 598648498 /nfs/dbraw/zinc/64/84/98/598648498.db2.gz MMNIFVXHEAOXCA-QGZVFWFLSA-N -1 3 367.478 3.616 20 0 FHADHM CCC[C@@H](NC(=O)CSc1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000736430484 598648499 /nfs/dbraw/zinc/64/84/99/598648499.db2.gz MMNIFVXHEAOXCA-QGZVFWFLSA-N -1 3 367.478 3.616 20 0 FHADHM CC(C)(C)[C@@H]1CCCC[C@H]1NC(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000735597659 598651384 /nfs/dbraw/zinc/65/13/84/598651384.db2.gz RNOZMXQKPPUPTE-HZPDHXFCSA-N -1 3 373.526 3.680 20 0 FHADHM CC(C)(C)[C@@H]1CCCC[C@H]1NC(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000735597659 598651386 /nfs/dbraw/zinc/65/13/86/598651386.db2.gz RNOZMXQKPPUPTE-HZPDHXFCSA-N -1 3 373.526 3.680 20 0 FHADHM CC(C)CCN(C(=O)CSc1ccc(-c2nnn[n-]2)cc1)C1CCCC1 ZINC000735796521 598651718 /nfs/dbraw/zinc/65/17/18/598651718.db2.gz CVUDJRHMIQGWRH-UHFFFAOYSA-N -1 3 373.526 3.776 20 0 FHADHM CC(C)CCN(C(=O)CSc1ccc(-c2nn[n-]n2)cc1)C1CCCC1 ZINC000735796521 598651720 /nfs/dbraw/zinc/65/17/20/598651720.db2.gz CVUDJRHMIQGWRH-UHFFFAOYSA-N -1 3 373.526 3.776 20 0 FHADHM CCN(C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)C(C)C ZINC000736507980 598655099 /nfs/dbraw/zinc/65/50/99/598655099.db2.gz HUTBDHCBRMEMHS-UHFFFAOYSA-N -1 3 351.410 3.530 20 0 FHADHM CCN(C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)C(C)C ZINC000736507980 598655101 /nfs/dbraw/zinc/65/51/01/598655101.db2.gz HUTBDHCBRMEMHS-UHFFFAOYSA-N -1 3 351.410 3.530 20 0 FHADHM CC[C@H](C)[C@H](C)NC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736328294 598656532 /nfs/dbraw/zinc/65/65/32/598656532.db2.gz HCOBTYCXSMHLHN-KBPBESRZSA-N -1 3 365.437 3.823 20 0 FHADHM CC[C@H](C)[C@H](C)NC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736328294 598656533 /nfs/dbraw/zinc/65/65/33/598656533.db2.gz HCOBTYCXSMHLHN-KBPBESRZSA-N -1 3 365.437 3.823 20 0 FHADHM CC[C@@H](C)[C@H](C)NC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736328296 598656664 /nfs/dbraw/zinc/65/66/64/598656664.db2.gz HCOBTYCXSMHLHN-KGLIPLIRSA-N -1 3 365.437 3.823 20 0 FHADHM CC[C@@H](C)[C@H](C)NC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736328296 598656665 /nfs/dbraw/zinc/65/66/65/598656665.db2.gz HCOBTYCXSMHLHN-KGLIPLIRSA-N -1 3 365.437 3.823 20 0 FHADHM Clc1cc(NCc2ccccc2Br)ccc1-c1nn[n-]n1 ZINC000737563891 598666695 /nfs/dbraw/zinc/66/66/95/598666695.db2.gz IABOBNBOLSZTDN-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM Clc1cc(NCc2ccccc2Br)ccc1-c1nnn[n-]1 ZINC000737563891 598666693 /nfs/dbraw/zinc/66/66/93/598666693.db2.gz IABOBNBOLSZTDN-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM Clc1cc(NCc2sccc2Br)ccc1-c1nnn[n-]1 ZINC000737565016 598668720 /nfs/dbraw/zinc/66/87/20/598668720.db2.gz MJWAPAMILDJZIG-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM Clc1cc(NCc2sccc2Br)ccc1-c1nn[n-]n1 ZINC000737565016 598668722 /nfs/dbraw/zinc/66/87/22/598668722.db2.gz MJWAPAMILDJZIG-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM Cc1cc(Br)ccc1CNc1ccc(-c2nn[n-]n2)cc1F ZINC000737230004 598675737 /nfs/dbraw/zinc/67/57/37/598675737.db2.gz BLOYANOZJNZOPN-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM COc1ccccc1Oc1ccc(CNc2ccc(-c3nnn[n-]3)cn2)cc1 ZINC000737156740 598676977 /nfs/dbraw/zinc/67/69/77/598676977.db2.gz ZCDIZMZCLZCILF-UHFFFAOYSA-N -1 3 374.404 3.675 20 0 FHADHM COc1ccccc1Oc1ccc(CNc2ccc(-c3nn[n-]n3)cn2)cc1 ZINC000737156740 598676979 /nfs/dbraw/zinc/67/69/79/598676979.db2.gz ZCDIZMZCLZCILF-UHFFFAOYSA-N -1 3 374.404 3.675 20 0 FHADHM Cc1ccc(SCCC(=O)OCc2ccc(F)cc2-c2nnn[n-]2)cc1 ZINC000737369350 598702213 /nfs/dbraw/zinc/70/22/13/598702213.db2.gz RVDKRCGAHYDGQJ-UHFFFAOYSA-N -1 3 372.425 3.540 20 0 FHADHM Cc1ccc(SCCC(=O)OCc2ccc(F)cc2-c2nn[n-]n2)cc1 ZINC000737369350 598702214 /nfs/dbraw/zinc/70/22/14/598702214.db2.gz RVDKRCGAHYDGQJ-UHFFFAOYSA-N -1 3 372.425 3.540 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nnn[n-]1)c1cc2c(cccc2F)s1 ZINC000738232124 598702384 /nfs/dbraw/zinc/70/23/84/598702384.db2.gz PLLRVLCUYDDJLH-UHFFFAOYSA-N -1 3 372.356 3.717 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nn[n-]n1)c1cc2c(cccc2F)s1 ZINC000738232124 598702387 /nfs/dbraw/zinc/70/23/87/598702387.db2.gz PLLRVLCUYDDJLH-UHFFFAOYSA-N -1 3 372.356 3.717 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N(CC1CC1)C1CCCCC1 ZINC000737291126 598730138 /nfs/dbraw/zinc/73/01/38/598730138.db2.gz IAPDSPSWXJLKAB-UHFFFAOYSA-N -1 3 354.458 3.752 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N(CC1CC1)C1CCCCC1 ZINC000737291126 598730139 /nfs/dbraw/zinc/73/01/39/598730139.db2.gz IAPDSPSWXJLKAB-UHFFFAOYSA-N -1 3 354.458 3.752 20 0 FHADHM C[C@H](OC(=O)CCCCOc1cccc(-c2nnn[n-]2)c1)c1cccs1 ZINC000736150886 598735264 /nfs/dbraw/zinc/73/52/64/598735264.db2.gz OPCJAUNXWQXBBS-ZDUSSCGKSA-N -1 3 372.450 3.782 20 0 FHADHM C[C@H](OC(=O)CCCCOc1cccc(-c2nn[n-]n2)c1)c1cccs1 ZINC000736150886 598735266 /nfs/dbraw/zinc/73/52/66/598735266.db2.gz OPCJAUNXWQXBBS-ZDUSSCGKSA-N -1 3 372.450 3.782 20 0 FHADHM CCN(C(=O)[C@H](C)Cc1ccccc1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736503604 598741761 /nfs/dbraw/zinc/74/17/61/598741761.db2.gz YRERQYZSUDCKBY-HZPDHXFCSA-N -1 3 363.465 3.655 20 0 FHADHM CCN(C(=O)[C@H](C)Cc1ccccc1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736503604 598741762 /nfs/dbraw/zinc/74/17/62/598741762.db2.gz YRERQYZSUDCKBY-HZPDHXFCSA-N -1 3 363.465 3.655 20 0 FHADHM O=C(C[C@H]1CCc2ccccc2C1)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000737817597 598742334 /nfs/dbraw/zinc/74/23/34/598742334.db2.gz CPNLOTNGZXPCMQ-LBPRGKRZSA-N -1 3 367.840 3.654 20 0 FHADHM O=C(C[C@H]1CCc2ccccc2C1)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000737817597 598742335 /nfs/dbraw/zinc/74/23/35/598742335.db2.gz CPNLOTNGZXPCMQ-LBPRGKRZSA-N -1 3 367.840 3.654 20 0 FHADHM C[C@H](Sc1ccccc1Cl)C(=O)Nc1sccc1-c1nnn[n-]1 ZINC000736190339 598756561 /nfs/dbraw/zinc/75/65/61/598756561.db2.gz DBNIVPUBPJTYOS-QMMMGPOBSA-N -1 3 365.871 3.701 20 0 FHADHM C[C@H](Sc1ccccc1Cl)C(=O)Nc1sccc1-c1nn[n-]n1 ZINC000736190339 598756563 /nfs/dbraw/zinc/75/65/63/598756563.db2.gz DBNIVPUBPJTYOS-QMMMGPOBSA-N -1 3 365.871 3.701 20 0 FHADHM Cc1cc(C=Cc2ccc(-c3nnn[n-]3)cn2)ccc1Oc1cccnc1 ZINC000737262813 598761876 /nfs/dbraw/zinc/76/18/76/598761876.db2.gz PZZQPZDQFYSBFF-DAXSKMNVSA-N -1 3 356.389 3.928 20 0 FHADHM Cc1cc(C=Cc2ccc(-c3nn[n-]n3)cn2)ccc1Oc1cccnc1 ZINC000737262813 598761877 /nfs/dbraw/zinc/76/18/77/598761877.db2.gz PZZQPZDQFYSBFF-DAXSKMNVSA-N -1 3 356.389 3.928 20 0 FHADHM CC[C@H](Cc1ccccc1)C(=O)Nc1sc(C)c(C)c1-c1nnn[n-]1 ZINC000736351148 598763112 /nfs/dbraw/zinc/76/31/12/598763112.db2.gz OKVYVUAUJFLUJE-CQSZACIVSA-N -1 3 355.467 3.752 20 0 FHADHM CC[C@H](Cc1ccccc1)C(=O)Nc1sc(C)c(C)c1-c1nn[n-]n1 ZINC000736351148 598763114 /nfs/dbraw/zinc/76/31/14/598763114.db2.gz OKVYVUAUJFLUJE-CQSZACIVSA-N -1 3 355.467 3.752 20 0 FHADHM CC[C@@H](Cc1ccccc1)C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000736351189 598763204 /nfs/dbraw/zinc/76/32/04/598763204.db2.gz PGXXCFKVZWZNMH-ZDUSSCGKSA-N -1 3 355.829 3.728 20 0 FHADHM CC[C@@H](Cc1ccccc1)C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000736351189 598763205 /nfs/dbraw/zinc/76/32/05/598763205.db2.gz PGXXCFKVZWZNMH-ZDUSSCGKSA-N -1 3 355.829 3.728 20 0 FHADHM CCC(CC)n1ccc(CSCc2cc(-c3nnn[n-]3)ccc2OC)n1 ZINC000820898265 607368873 /nfs/dbraw/zinc/36/88/73/607368873.db2.gz XRSGJMHZGIGCQS-UHFFFAOYSA-N -1 3 372.498 3.866 20 0 FHADHM CCC(CC)n1ccc(CSCc2cc(-c3nn[n-]n3)ccc2OC)n1 ZINC000820898265 607368874 /nfs/dbraw/zinc/36/88/74/607368874.db2.gz XRSGJMHZGIGCQS-UHFFFAOYSA-N -1 3 372.498 3.866 20 0 FHADHM Cc1ccccc1COc1cccc(Nc2ccc(-c3nnn[n-]3)cn2)c1 ZINC000737428218 598789017 /nfs/dbraw/zinc/78/90/17/598789017.db2.gz NJAWETPQEMCQNI-UHFFFAOYSA-N -1 3 358.405 3.893 20 0 FHADHM Cc1ccccc1COc1cccc(Nc2ccc(-c3nn[n-]n3)cn2)c1 ZINC000737428218 598789019 /nfs/dbraw/zinc/78/90/19/598789019.db2.gz NJAWETPQEMCQNI-UHFFFAOYSA-N -1 3 358.405 3.893 20 0 FHADHM CC[C@@H](C)NC(=S)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736327322 598789204 /nfs/dbraw/zinc/78/92/04/598789204.db2.gz QUWYMSRHAORKIC-GFCCVEGCSA-N -1 3 368.466 3.744 20 0 FHADHM CC[C@@H](C)NC(=S)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736327322 598789205 /nfs/dbraw/zinc/78/92/05/598789205.db2.gz QUWYMSRHAORKIC-GFCCVEGCSA-N -1 3 368.466 3.744 20 0 FHADHM CC(C)[C@H](c1ccccc1)N(C)C(=O)CCc1ccc(-c2nnn[n-]2)cc1 ZINC000735736720 598790999 /nfs/dbraw/zinc/79/09/99/598790999.db2.gz VRPRRDVVCRXBFP-HXUWFJFHSA-N -1 3 363.465 3.655 20 0 FHADHM CC(C)[C@H](c1ccccc1)N(C)C(=O)CCc1ccc(-c2nn[n-]n2)cc1 ZINC000735736720 598791000 /nfs/dbraw/zinc/79/10/00/598791000.db2.gz VRPRRDVVCRXBFP-HXUWFJFHSA-N -1 3 363.465 3.655 20 0 FHADHM Clc1ccc(NC2CCN(c3ccccc3)CC2)c(-c2nnn[n-]2)c1 ZINC000737574025 598794980 /nfs/dbraw/zinc/79/49/80/598794980.db2.gz JULYXPRRTZIASW-UHFFFAOYSA-N -1 3 354.845 3.601 20 0 FHADHM Clc1ccc(NC2CCN(c3ccccc3)CC2)c(-c2nn[n-]n2)c1 ZINC000737574025 598794982 /nfs/dbraw/zinc/79/49/82/598794982.db2.gz JULYXPRRTZIASW-UHFFFAOYSA-N -1 3 354.845 3.601 20 0 FHADHM Fc1ccc([C@H]2CCCN2Cc2cc(-c3nn[n-]n3)ccc2F)cc1F ZINC000737652616 598797663 /nfs/dbraw/zinc/79/76/63/598797663.db2.gz VPVHBCHIGPKGLO-QGZVFWFLSA-N -1 3 359.355 3.621 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)N1CCC[C@@H]1c1ccc(F)c(F)c1 ZINC000738150959 598799715 /nfs/dbraw/zinc/79/97/15/598799715.db2.gz DQGNOZPNILKVRW-MRXNPFEDSA-N -1 3 370.363 3.514 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)N1CCC[C@@H]1c1ccc(F)c(F)c1 ZINC000738150959 598799717 /nfs/dbraw/zinc/79/97/17/598799717.db2.gz DQGNOZPNILKVRW-MRXNPFEDSA-N -1 3 370.363 3.514 20 0 FHADHM CC(C)c1nc(COc2ccc(-c3ccc(-c4nnn[n-]4)cc3)cc2)no1 ZINC000735941111 598809326 /nfs/dbraw/zinc/80/93/26/598809326.db2.gz XCPGZKFKORQQGO-UHFFFAOYSA-N -1 3 362.393 3.619 20 0 FHADHM CC(C)c1nc(COc2ccc(-c3ccc(-c4nn[n-]n4)cc3)cc2)no1 ZINC000735941111 598809327 /nfs/dbraw/zinc/80/93/27/598809327.db2.gz XCPGZKFKORQQGO-UHFFFAOYSA-N -1 3 362.393 3.619 20 0 FHADHM CC(C)n1cc([C@@H](C)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)cn1 ZINC000736140397 598816176 /nfs/dbraw/zinc/81/61/76/598816176.db2.gz VMFROYAOVQXJJN-SNVBAGLBSA-N -1 3 365.363 3.836 20 0 FHADHM CC(C)n1cc([C@@H](C)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)cn1 ZINC000736140397 598816177 /nfs/dbraw/zinc/81/61/77/598816177.db2.gz VMFROYAOVQXJJN-SNVBAGLBSA-N -1 3 365.363 3.836 20 0 FHADHM CCN(C(=O)c1coc2ccccc12)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736508777 598821443 /nfs/dbraw/zinc/82/14/43/598821443.db2.gz NEQQPKMTLDMZFP-CYBMUJFWSA-N -1 3 361.405 3.836 20 0 FHADHM CCN(C(=O)c1coc2ccccc12)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736508777 598821444 /nfs/dbraw/zinc/82/14/44/598821444.db2.gz NEQQPKMTLDMZFP-CYBMUJFWSA-N -1 3 361.405 3.836 20 0 FHADHM CCC[C@@H](CC1CCCC1)C(=O)Oc1ccc(-c2nnn[n-]2)cc1OC ZINC000736422195 598821482 /nfs/dbraw/zinc/82/14/82/598821482.db2.gz IXDJVAKHOVKQSN-HNNXBMFYSA-N -1 3 358.442 3.777 20 0 FHADHM CCC[C@@H](CC1CCCC1)C(=O)Oc1ccc(-c2nn[n-]n2)cc1OC ZINC000736422195 598821483 /nfs/dbraw/zinc/82/14/83/598821483.db2.gz IXDJVAKHOVKQSN-HNNXBMFYSA-N -1 3 358.442 3.777 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NC(=O)c1coc2ccccc12 ZINC000735906768 598822451 /nfs/dbraw/zinc/82/24/51/598822451.db2.gz WJKAZTSDGMPVOC-UHFFFAOYSA-N -1 3 363.377 3.652 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NC(=O)c1coc2ccccc12 ZINC000735906768 598822452 /nfs/dbraw/zinc/82/24/52/598822452.db2.gz WJKAZTSDGMPVOC-UHFFFAOYSA-N -1 3 363.377 3.652 20 0 FHADHM CCc1c(C)sc(NC(=O)c2coc3ccccc23)c1-c1nnn[n-]1 ZINC000736678240 598822614 /nfs/dbraw/zinc/82/26/14/598822614.db2.gz AYEICIRMPWYDJH-UHFFFAOYSA-N -1 3 353.407 3.798 20 0 FHADHM CCc1c(C)sc(NC(=O)c2coc3ccccc23)c1-c1nn[n-]n1 ZINC000736678240 598822615 /nfs/dbraw/zinc/82/26/15/598822615.db2.gz AYEICIRMPWYDJH-UHFFFAOYSA-N -1 3 353.407 3.798 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nnn[n-]2)c1)c1ccccc1OC1CCC1 ZINC000738164293 599293210 /nfs/dbraw/zinc/29/32/10/599293210.db2.gz UBJJIWHPQNERFK-UHFFFAOYSA-N -1 3 369.812 3.704 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nn[n-]n2)c1)c1ccccc1OC1CCC1 ZINC000738164293 599293211 /nfs/dbraw/zinc/29/32/11/599293211.db2.gz UBJJIWHPQNERFK-UHFFFAOYSA-N -1 3 369.812 3.704 20 0 FHADHM CC(C)Oc1c(Cl)cccc1NCCOc1ccc(-c2nn[n-]n2)cc1 ZINC000735905287 599305393 /nfs/dbraw/zinc/30/53/93/599305393.db2.gz ZRZZMRQPGNSSMW-UHFFFAOYSA-N -1 3 373.844 3.798 20 0 FHADHM CN(C(=O)c1cc(F)c(Cl)cc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000736746932 599305728 /nfs/dbraw/zinc/30/57/28/599305728.db2.gz COPZWAZIFWUDPM-UHFFFAOYSA-N -1 3 366.183 3.589 20 0 FHADHM CN(C(=O)c1cc(F)c(Cl)cc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000736746932 599305729 /nfs/dbraw/zinc/30/57/29/599305729.db2.gz COPZWAZIFWUDPM-UHFFFAOYSA-N -1 3 366.183 3.589 20 0 FHADHM CC(=O)Nc1cccc(CS[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000735489125 599325119 /nfs/dbraw/zinc/32/51/19/599325119.db2.gz WYOJINXMJPUVQB-GFCCVEGCSA-N -1 3 353.451 3.820 20 0 FHADHM CC(=O)Nc1cccc(CS[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735489125 599325122 /nfs/dbraw/zinc/32/51/22/599325122.db2.gz WYOJINXMJPUVQB-GFCCVEGCSA-N -1 3 353.451 3.820 20 0 FHADHM C[C@H](SC[C@H]1OCCc2ccccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000736187426 599325759 /nfs/dbraw/zinc/32/57/59/599325759.db2.gz AIXDRRRFUXBIPB-SCLBCKFNSA-N -1 3 352.463 3.975 20 0 FHADHM C[C@H](SC[C@H]1OCCc2ccccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000736187426 599325760 /nfs/dbraw/zinc/32/57/60/599325760.db2.gz AIXDRRRFUXBIPB-SCLBCKFNSA-N -1 3 352.463 3.975 20 0 FHADHM CC(C)(C)OC(=O)c1ccc(CSc2ccc(-c3nnn[n-]3)cn2)cc1 ZINC000819945703 607368848 /nfs/dbraw/zinc/36/88/48/607368848.db2.gz ALKACXGCIAVDTH-UHFFFAOYSA-N -1 3 369.450 3.509 20 0 FHADHM CC(C)(C)OC(=O)c1ccc(CSc2ccc(-c3nn[n-]n3)cn2)cc1 ZINC000819945703 607368849 /nfs/dbraw/zinc/36/88/49/607368849.db2.gz ALKACXGCIAVDTH-UHFFFAOYSA-N -1 3 369.450 3.509 20 0 FHADHM C[C@@H](NC(=O)CS[C@H](C)c1ccc(-c2nnn[n-]2)cc1)c1cccs1 ZINC000736103795 599327904 /nfs/dbraw/zinc/32/79/04/599327904.db2.gz FEPWHSRZEXOTQK-VXGBXAGGSA-N -1 3 373.507 3.600 20 0 FHADHM C[C@@H](NC(=O)CS[C@H](C)c1ccc(-c2nn[n-]n2)cc1)c1cccs1 ZINC000736103795 599327907 /nfs/dbraw/zinc/32/79/07/599327907.db2.gz FEPWHSRZEXOTQK-VXGBXAGGSA-N -1 3 373.507 3.600 20 0 FHADHM Cc1ccc(-c2nc(CNc3cc(-c4nnn[n-]4)ccc3C)cs2)o1 ZINC000737288070 599328984 /nfs/dbraw/zinc/32/89/84/599328984.db2.gz JRZBDVWVZMQEIX-UHFFFAOYSA-N -1 3 352.423 3.812 20 0 FHADHM Cc1ccc(-c2nc(CNc3cc(-c4nn[n-]n4)ccc3C)cs2)o1 ZINC000737288070 599328987 /nfs/dbraw/zinc/32/89/87/599328987.db2.gz JRZBDVWVZMQEIX-UHFFFAOYSA-N -1 3 352.423 3.812 20 0 FHADHM Cc1ccccc1NC(=O)CS[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000737436299 599329120 /nfs/dbraw/zinc/32/91/20/599329120.db2.gz RAJKTCLKBNXPFF-CYBMUJFWSA-N -1 3 353.451 3.608 20 0 FHADHM Cc1ccccc1NC(=O)CS[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000737436299 599329121 /nfs/dbraw/zinc/32/91/21/599329121.db2.gz RAJKTCLKBNXPFF-CYBMUJFWSA-N -1 3 353.451 3.608 20 0 FHADHM c1ccc(OC2CCCC2)c(NCCOc2cccc(-c3nnn[n-]3)c2)c1 ZINC000738418376 599329527 /nfs/dbraw/zinc/32/95/27/599329527.db2.gz GBBLVGIORNULJC-UHFFFAOYSA-N -1 3 365.437 3.679 20 0 FHADHM c1ccc(OC2CCCC2)c(NCCOc2cccc(-c3nn[n-]n3)c2)c1 ZINC000738418376 599329530 /nfs/dbraw/zinc/32/95/30/599329530.db2.gz GBBLVGIORNULJC-UHFFFAOYSA-N -1 3 365.437 3.679 20 0 FHADHM Fc1cc(NCc2ccccc2-c2nnn[n-]2)ccc1OC1CCCC1 ZINC000737648576 599331604 /nfs/dbraw/zinc/33/16/04/599331604.db2.gz AXNFBOHWWMKCIS-UHFFFAOYSA-N -1 3 353.401 3.939 20 0 FHADHM Fc1cc(NCc2ccccc2-c2nn[n-]n2)ccc1OC1CCCC1 ZINC000737648576 599331607 /nfs/dbraw/zinc/33/16/07/599331607.db2.gz AXNFBOHWWMKCIS-UHFFFAOYSA-N -1 3 353.401 3.939 20 0 FHADHM Cc1cc(NCc2ccc(-c3nnn[n-]3)cc2F)ccc1C(F)(F)F ZINC000737280616 599333054 /nfs/dbraw/zinc/33/30/54/599333054.db2.gz NFDZNVITRDOAFK-UHFFFAOYSA-N -1 3 351.307 3.945 20 0 FHADHM Cc1cc(NCc2ccc(-c3nn[n-]n3)cc2F)ccc1C(F)(F)F ZINC000737280616 599333055 /nfs/dbraw/zinc/33/30/55/599333055.db2.gz NFDZNVITRDOAFK-UHFFFAOYSA-N -1 3 351.307 3.945 20 0 FHADHM C[C@H](Sc1cc(-c2nnn[n-]2)ccn1)c1ncc(-c2ccccc2)o1 ZINC000736190061 599339466 /nfs/dbraw/zinc/33/94/66/599339466.db2.gz FNDISWZQXCKFQF-NSHDSACASA-N -1 3 350.407 3.770 20 0 FHADHM C[C@H](Sc1cc(-c2nn[n-]n2)ccn1)c1ncc(-c2ccccc2)o1 ZINC000736190061 599339469 /nfs/dbraw/zinc/33/94/69/599339469.db2.gz FNDISWZQXCKFQF-NSHDSACASA-N -1 3 350.407 3.770 20 0 FHADHM CSc1cccc(NC(=O)[C@H](C)Sc2ccccc2-c2nnn[n-]2)c1 ZINC000821983112 599342701 /nfs/dbraw/zinc/34/27/01/599342701.db2.gz DTEYSQPWPYRWAZ-NSHDSACASA-N -1 3 371.491 3.708 20 0 FHADHM CSc1cccc(NC(=O)[C@H](C)Sc2ccccc2-c2nn[n-]n2)c1 ZINC000821983112 599342704 /nfs/dbraw/zinc/34/27/04/599342704.db2.gz DTEYSQPWPYRWAZ-NSHDSACASA-N -1 3 371.491 3.708 20 0 FHADHM COc1ccc(-c2cc(CSc3ccccc3-c3nnn[n-]3)on2)cc1 ZINC000821728596 599343104 /nfs/dbraw/zinc/34/31/04/599343104.db2.gz XFNZBENGBPYXNH-UHFFFAOYSA-N -1 3 365.418 3.823 20 0 FHADHM COc1ccc(-c2cc(CSc3ccccc3-c3nn[n-]n3)on2)cc1 ZINC000821728596 599343107 /nfs/dbraw/zinc/34/31/07/599343107.db2.gz XFNZBENGBPYXNH-UHFFFAOYSA-N -1 3 365.418 3.823 20 0 FHADHM CCc1cc2c(ncnc2N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)s1 ZINC000821476910 599352182 /nfs/dbraw/zinc/35/21/82/599352182.db2.gz UQSYWFBGSNZCIZ-JTQLQIEISA-N -1 3 351.439 3.607 20 0 FHADHM CCc1cc2c(ncnc2N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)s1 ZINC000821476910 599352186 /nfs/dbraw/zinc/35/21/86/599352186.db2.gz UQSYWFBGSNZCIZ-JTQLQIEISA-N -1 3 351.439 3.607 20 0 FHADHM C[C@@H](c1ncc(-c2ccccc2)o1)N(C)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000736200617 599362881 /nfs/dbraw/zinc/36/28/81/599362881.db2.gz AKWTXGBCYWOHKA-AWEZNQCLSA-N -1 3 360.421 3.715 20 0 FHADHM Cc1ccc(NC(=O)C(C)C)cc1N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000822242293 599368050 /nfs/dbraw/zinc/36/80/50/599368050.db2.gz HDPSAAGLNFTWRE-CQSZACIVSA-N -1 3 364.453 3.943 20 0 FHADHM Cc1ccc(NC(=O)C(C)C)cc1N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000822242293 599368053 /nfs/dbraw/zinc/36/80/53/599368053.db2.gz HDPSAAGLNFTWRE-CQSZACIVSA-N -1 3 364.453 3.943 20 0 FHADHM COc1ccccc1CSCc1cn2ccccc2c1-c1nnn[n-]1 ZINC000737153089 599369669 /nfs/dbraw/zinc/36/96/69/599369669.db2.gz PPSMWFBYPYXARP-UHFFFAOYSA-N -1 3 351.435 3.561 20 0 FHADHM COc1ccccc1CSCc1cn2ccccc2c1-c1nn[n-]n1 ZINC000737153089 599369670 /nfs/dbraw/zinc/36/96/70/599369670.db2.gz PPSMWFBYPYXARP-UHFFFAOYSA-N -1 3 351.435 3.561 20 0 FHADHM Clc1ccc([C@H](NCc2ccc(-c3nnn[n-]3)o2)c2ccccc2)cc1 ZINC000822573922 599394984 /nfs/dbraw/zinc/39/49/84/599394984.db2.gz KYQKQBUILFKSOE-GOSISDBHSA-N -1 3 365.824 3.992 20 0 FHADHM Clc1ccc([C@H](NCc2ccc(-c3nn[n-]n3)o2)c2ccccc2)cc1 ZINC000822573922 599394986 /nfs/dbraw/zinc/39/49/86/599394986.db2.gz KYQKQBUILFKSOE-GOSISDBHSA-N -1 3 365.824 3.992 20 0 FHADHM CN(Cc1ccccc1Cl)c1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000736828530 599395643 /nfs/dbraw/zinc/39/56/43/599395643.db2.gz NGKQEUYZELQYIS-UHFFFAOYSA-N -1 3 350.813 3.705 20 0 FHADHM CN(Cc1ccccc1Cl)c1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000736828530 599395645 /nfs/dbraw/zinc/39/56/45/599395645.db2.gz NGKQEUYZELQYIS-UHFFFAOYSA-N -1 3 350.813 3.705 20 0 FHADHM COc1ccc([C@@H](C)Nc2cc(-c3nnn[n-]3)c3ccccc3n2)cc1F ZINC000737074704 599397840 /nfs/dbraw/zinc/39/78/40/599397840.db2.gz KAYNPQUIWXWSJZ-LLVKDONJSA-N -1 3 364.384 3.736 20 0 FHADHM COc1ccc([C@@H](C)Nc2cc(-c3nn[n-]n3)c3ccccc3n2)cc1F ZINC000737074704 599397842 /nfs/dbraw/zinc/39/78/42/599397842.db2.gz KAYNPQUIWXWSJZ-LLVKDONJSA-N -1 3 364.384 3.736 20 0 FHADHM C[C@@H](NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(Cl)cc1 ZINC000820353389 599398285 /nfs/dbraw/zinc/39/82/85/599398285.db2.gz ZPVBKQDGQVPKAG-VXGBXAGGSA-N -1 3 370.844 3.642 20 0 FHADHM C[C@@H](NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(Cl)cc1 ZINC000820353389 599398288 /nfs/dbraw/zinc/39/82/88/599398288.db2.gz ZPVBKQDGQVPKAG-VXGBXAGGSA-N -1 3 370.844 3.642 20 0 FHADHM C[C@@H](NC(=O)N[C@H](C)c1ccccc1Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000820352349 599398599 /nfs/dbraw/zinc/39/85/99/599398599.db2.gz UWPJJDUWTJOOHB-VXGBXAGGSA-N -1 3 370.844 3.642 20 0 FHADHM C[C@@H](NC(=O)N[C@H](C)c1ccccc1Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000820352349 599398603 /nfs/dbraw/zinc/39/86/03/599398603.db2.gz UWPJJDUWTJOOHB-VXGBXAGGSA-N -1 3 370.844 3.642 20 0 FHADHM CC(C)Oc1ccc(NCc2ccn(C3CCCC3)n2)cc1-c1nnn[n-]1 ZINC000820173939 607373913 /nfs/dbraw/zinc/37/39/13/607373913.db2.gz NPHXBCPBXRNPNA-UHFFFAOYSA-N -1 3 367.457 3.578 20 0 FHADHM CC(C)Oc1ccc(NCc2ccn(C3CCCC3)n2)cc1-c1nn[n-]n1 ZINC000820173939 607373914 /nfs/dbraw/zinc/37/39/14/607373914.db2.gz NPHXBCPBXRNPNA-UHFFFAOYSA-N -1 3 367.457 3.578 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(NCc2ccnc(OC3CCCC3)c2)c1 ZINC000737570633 599407267 /nfs/dbraw/zinc/40/72/67/599407267.db2.gz JCUUQLXKDUPZPF-UHFFFAOYSA-N -1 3 370.844 3.849 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(NCc2ccnc(OC3CCCC3)c2)c1 ZINC000737570633 599407268 /nfs/dbraw/zinc/40/72/68/599407268.db2.gz JCUUQLXKDUPZPF-UHFFFAOYSA-N -1 3 370.844 3.849 20 0 FHADHM C[C@H](CNc1cc(-c2nnn[n-]2)c2ccccc2n1)COCc1ccccc1 ZINC000736024928 599415877 /nfs/dbraw/zinc/41/58/77/599415877.db2.gz CNEPUNIRVKLQQD-OAHLLOKOSA-N -1 3 374.448 3.680 20 0 FHADHM C[C@H](CNc1cc(-c2nn[n-]n2)c2ccccc2n1)COCc1ccccc1 ZINC000736024928 599415880 /nfs/dbraw/zinc/41/58/80/599415880.db2.gz CNEPUNIRVKLQQD-OAHLLOKOSA-N -1 3 374.448 3.680 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@@H]1NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820073843 599432294 /nfs/dbraw/zinc/43/22/94/599432294.db2.gz WJAGNYQMLZCYQB-MPGHIAIKSA-N -1 3 370.501 3.832 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@@H]1NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820073843 599432295 /nfs/dbraw/zinc/43/22/95/599432295.db2.gz WJAGNYQMLZCYQB-MPGHIAIKSA-N -1 3 370.501 3.832 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(NCc2ccc(Br)cc2)c1 ZINC000737571113 599433018 /nfs/dbraw/zinc/43/30/18/599433018.db2.gz SCVSQVVOEFUURA-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(NCc2ccc(Br)cc2)c1 ZINC000737571113 599433022 /nfs/dbraw/zinc/43/30/22/599433022.db2.gz SCVSQVVOEFUURA-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM CCC[C@@H]1CCCC[C@H]1NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821039807 599434034 /nfs/dbraw/zinc/43/40/34/599434034.db2.gz HHRAHRCMYPRPPC-CKEIUWERSA-N -1 3 356.474 3.586 20 0 FHADHM CCC[C@@H]1CCCC[C@H]1NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821039807 599434038 /nfs/dbraw/zinc/43/40/38/599434038.db2.gz HHRAHRCMYPRPPC-CKEIUWERSA-N -1 3 356.474 3.586 20 0 FHADHM C[C@@H]1C[C@@H](c2ccccc2)CN1c1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000736235026 599438179 /nfs/dbraw/zinc/43/81/79/599438179.db2.gz LNONLOIXTUQAKS-GDBMZVCRSA-N -1 3 356.433 3.797 20 0 FHADHM C[C@@H]1C[C@@H](c2ccccc2)CN1c1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000736235026 599438181 /nfs/dbraw/zinc/43/81/81/599438181.db2.gz LNONLOIXTUQAKS-GDBMZVCRSA-N -1 3 356.433 3.797 20 0 FHADHM C[C@H](Nc1ncc(-c2nnn[n-]2)cc1Cl)c1ccc(F)cc1Cl ZINC000736138831 599440209 /nfs/dbraw/zinc/44/02/09/599440209.db2.gz RWDYQKFJFUGDBR-ZETCQYMHSA-N -1 3 353.188 3.881 20 0 FHADHM C[C@H](Nc1ncc(-c2nn[n-]n2)cc1Cl)c1ccc(F)cc1Cl ZINC000736138831 599440211 /nfs/dbraw/zinc/44/02/11/599440211.db2.gz RWDYQKFJFUGDBR-ZETCQYMHSA-N -1 3 353.188 3.881 20 0 FHADHM C[C@@H](CCC1CCCCC1)NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820243013 599441201 /nfs/dbraw/zinc/44/12/01/599441201.db2.gz SXIMFZDKQAYCEF-GJZGRUSLSA-N -1 3 370.501 3.976 20 0 FHADHM C[C@@H](CCC1CCCCC1)NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820243013 599441203 /nfs/dbraw/zinc/44/12/03/599441203.db2.gz SXIMFZDKQAYCEF-GJZGRUSLSA-N -1 3 370.501 3.976 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H](C)C1CCCCC1 ZINC000821104412 599445878 /nfs/dbraw/zinc/44/58/78/599445878.db2.gz CAQGSFPPBFHXEQ-HNNXBMFYSA-N -1 3 370.501 3.757 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H](C)C1CCCCC1 ZINC000821104412 599445880 /nfs/dbraw/zinc/44/58/80/599445880.db2.gz CAQGSFPPBFHXEQ-HNNXBMFYSA-N -1 3 370.501 3.757 20 0 FHADHM CCOc1ccc([C@@H](C)Nc2ccc(F)cc2-c2nnn[n-]2)cc1OCC ZINC000821418040 599464791 /nfs/dbraw/zinc/46/47/91/599464791.db2.gz VFTVDDBOBSWAON-GFCCVEGCSA-N -1 3 371.416 3.976 20 0 FHADHM CCOc1ccc([C@@H](C)Nc2ccc(F)cc2-c2nn[n-]n2)cc1OCC ZINC000821418040 599464793 /nfs/dbraw/zinc/46/47/93/599464793.db2.gz VFTVDDBOBSWAON-GFCCVEGCSA-N -1 3 371.416 3.976 20 0 FHADHM C[C@@H](NC(=O)NCCCCC1CCCC1)c1cccc(-c2nnn[n-]2)c1 ZINC000820365239 599468094 /nfs/dbraw/zinc/46/80/94/599468094.db2.gz INWIMNATGCNXOP-CQSZACIVSA-N -1 3 356.474 3.587 20 0 FHADHM C[C@@H](NC(=O)NCCCCC1CCCC1)c1cccc(-c2nn[n-]n2)c1 ZINC000820365239 599468097 /nfs/dbraw/zinc/46/80/97/599468097.db2.gz INWIMNATGCNXOP-CQSZACIVSA-N -1 3 356.474 3.587 20 0 FHADHM CCCOc1ccc([C@H](C)Nc2ccc(F)cc2-c2nnn[n-]2)cc1OC ZINC000821134098 599479750 /nfs/dbraw/zinc/47/97/50/599479750.db2.gz NSSAKKZTLZCCRR-LBPRGKRZSA-N -1 3 371.416 3.976 20 0 FHADHM CCCOc1ccc([C@H](C)Nc2ccc(F)cc2-c2nn[n-]n2)cc1OC ZINC000821134098 599479753 /nfs/dbraw/zinc/47/97/53/599479753.db2.gz NSSAKKZTLZCCRR-LBPRGKRZSA-N -1 3 371.416 3.976 20 0 FHADHM Cc1cccc([C@@H](C)NC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1C ZINC000822288547 599482195 /nfs/dbraw/zinc/48/21/95/599482195.db2.gz BBTPYLVFQAFKHI-LSDHHAIUSA-N -1 3 364.453 3.605 20 0 FHADHM Cc1cccc([C@@H](C)NC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1C ZINC000822288547 599482197 /nfs/dbraw/zinc/48/21/97/599482197.db2.gz BBTPYLVFQAFKHI-LSDHHAIUSA-N -1 3 364.453 3.605 20 0 FHADHM Fc1ccc(N2CC[C@@H](CNc3c(Cl)cccc3-c3nnn[n-]3)C2)cc1 ZINC000822779541 599493902 /nfs/dbraw/zinc/49/39/02/599493902.db2.gz WCFBMYLLJBFMIG-LBPRGKRZSA-N -1 3 372.835 3.598 20 0 FHADHM Fc1ccc(N2CC[C@@H](CNc3c(Cl)cccc3-c3nn[n-]n3)C2)cc1 ZINC000822779541 599493904 /nfs/dbraw/zinc/49/39/04/599493904.db2.gz WCFBMYLLJBFMIG-LBPRGKRZSA-N -1 3 372.835 3.598 20 0 FHADHM CC(C)CC(=O)Nc1cccc(CNc2ccc(F)cc2-c2nnn[n-]2)c1 ZINC000820051784 599494788 /nfs/dbraw/zinc/49/47/88/599494788.db2.gz WKGFUKUEUVQCON-UHFFFAOYSA-N -1 3 368.416 3.603 20 0 FHADHM CC(C)CC(=O)Nc1cccc(CNc2ccc(F)cc2-c2nn[n-]n2)c1 ZINC000820051784 599494789 /nfs/dbraw/zinc/49/47/89/599494789.db2.gz WKGFUKUEUVQCON-UHFFFAOYSA-N -1 3 368.416 3.603 20 0 FHADHM CC(C)Sc1ccc(C(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000820184212 599500913 /nfs/dbraw/zinc/50/09/13/599500913.db2.gz XIZVWZQCSMAHFI-CYBMUJFWSA-N -1 3 367.478 3.858 20 0 FHADHM CC(C)Sc1ccc(C(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000820184212 599500915 /nfs/dbraw/zinc/50/09/15/599500915.db2.gz XIZVWZQCSMAHFI-CYBMUJFWSA-N -1 3 367.478 3.858 20 0 FHADHM C[C@@H](C[C@H](O)c1ccc(F)cc1)Nc1cc(Cl)ccc1-c1nnn[n-]1 ZINC000820232975 607381642 /nfs/dbraw/zinc/38/16/42/607381642.db2.gz ISNLEXPAKVPVAS-QFYYESIMSA-N -1 3 361.808 3.583 20 0 FHADHM C[C@@H](C[C@H](O)c1ccc(F)cc1)Nc1cc(Cl)ccc1-c1nn[n-]n1 ZINC000820232975 607381644 /nfs/dbraw/zinc/38/16/44/607381644.db2.gz ISNLEXPAKVPVAS-QFYYESIMSA-N -1 3 361.808 3.583 20 0 FHADHM Cc1c2cccc(F)c2oc1C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000822020947 599508169 /nfs/dbraw/zinc/50/81/69/599508169.db2.gz ORWFQLISUOTOLE-NSHDSACASA-N -1 3 365.368 3.551 20 0 FHADHM Cc1c2cccc(F)c2oc1C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000822020947 599508171 /nfs/dbraw/zinc/50/81/71/599508171.db2.gz ORWFQLISUOTOLE-NSHDSACASA-N -1 3 365.368 3.551 20 0 FHADHM C[C@@H](NC(=O)C(C)(C)c1ccc(Cl)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000820314391 599510619 /nfs/dbraw/zinc/51/06/19/599510619.db2.gz IDTMZAUDOWTARY-GFCCVEGCSA-N -1 3 369.856 3.675 20 0 FHADHM C[C@@H](NC(=O)C(C)(C)c1ccc(Cl)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000820314391 599510620 /nfs/dbraw/zinc/51/06/20/599510620.db2.gz IDTMZAUDOWTARY-GFCCVEGCSA-N -1 3 369.856 3.675 20 0 FHADHM FC(F)(F)c1cc(-c2nn[n-]n2)ccc1NCCCOC1CCCC1 ZINC000737625564 599522398 /nfs/dbraw/zinc/52/23/98/599522398.db2.gz BXOYOBUPUCVLRV-UHFFFAOYSA-N -1 3 355.364 3.647 20 0 FHADHM CC[C@@H](CC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(C)cc1 ZINC000820882575 599536977 /nfs/dbraw/zinc/53/69/77/599536977.db2.gz UKRQNUPKYDSDGS-HOTGVXAUSA-N -1 3 363.465 3.936 20 0 FHADHM CC[C@@H](CC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(C)cc1 ZINC000820882575 599536979 /nfs/dbraw/zinc/53/69/79/599536979.db2.gz UKRQNUPKYDSDGS-HOTGVXAUSA-N -1 3 363.465 3.936 20 0 FHADHM COc1ccccc1[C@H]1CCN(c2ccc(-c3nnn[n-]3)c(Cl)c2)C1 ZINC000737149548 599537534 /nfs/dbraw/zinc/53/75/34/599537534.db2.gz XGRSEIPDVOMEEI-LBPRGKRZSA-N -1 3 355.829 3.523 20 0 FHADHM COc1ccccc1[C@H]1CCN(c2ccc(-c3nn[n-]n3)c(Cl)c2)C1 ZINC000737149548 599537536 /nfs/dbraw/zinc/53/75/36/599537536.db2.gz XGRSEIPDVOMEEI-LBPRGKRZSA-N -1 3 355.829 3.523 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)C1(c2cccs2)CCCCC1 ZINC000119183589 599538506 /nfs/dbraw/zinc/53/85/06/599538506.db2.gz XIPOENBRSCBVMH-UHFFFAOYSA-N -1 3 353.451 3.769 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)C1(c2cccs2)CCCCC1 ZINC000119183589 599538507 /nfs/dbraw/zinc/53/85/07/599538507.db2.gz XIPOENBRSCBVMH-UHFFFAOYSA-N -1 3 353.451 3.769 20 0 FHADHM CCc1ccc([C@H](C)CC(=O)N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000736684624 599541895 /nfs/dbraw/zinc/54/18/95/599541895.db2.gz BHLHVZOZODHXJE-CABCVRRESA-N -1 3 363.465 3.800 20 0 FHADHM CCc1ccc([C@H](C)CC(=O)N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000736684624 599541897 /nfs/dbraw/zinc/54/18/97/599541897.db2.gz BHLHVZOZODHXJE-CABCVRRESA-N -1 3 363.465 3.800 20 0 FHADHM CCc1ccc([C@@H](C)CC(=O)N(C)c2ccc(-c3nnn[n-]3)cc2F)cc1 ZINC000736686825 599544770 /nfs/dbraw/zinc/54/47/70/599544770.db2.gz LEYIDHLTXFPWBO-ZDUSSCGKSA-N -1 3 367.428 3.725 20 0 FHADHM CCc1ccc([C@@H](C)CC(=O)N(C)c2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000736686825 599544773 /nfs/dbraw/zinc/54/47/73/599544773.db2.gz LEYIDHLTXFPWBO-ZDUSSCGKSA-N -1 3 367.428 3.725 20 0 FHADHM CCN(C(=O)Nc1ccc(C)s1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821153397 599550658 /nfs/dbraw/zinc/55/06/58/599550658.db2.gz APFCMMSWXVZOBV-GFCCVEGCSA-N -1 3 356.455 3.852 20 0 FHADHM CCN(C(=O)Nc1ccc(C)s1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821153397 599550659 /nfs/dbraw/zinc/55/06/59/599550659.db2.gz APFCMMSWXVZOBV-GFCCVEGCSA-N -1 3 356.455 3.852 20 0 FHADHM Clc1ccc2ncc(-c3nnn[n-]3)c(N3CC[C@@H](c4ccco4)C3)c2c1 ZINC000822581573 599551080 /nfs/dbraw/zinc/55/10/80/599551080.db2.gz KFPKSANTRHYSTA-LLVKDONJSA-N -1 3 366.812 3.655 20 0 FHADHM Clc1ccc2ncc(-c3nn[n-]n3)c(N3CC[C@@H](c4ccco4)C3)c2c1 ZINC000822581573 599551082 /nfs/dbraw/zinc/55/10/82/599551082.db2.gz KFPKSANTRHYSTA-LLVKDONJSA-N -1 3 366.812 3.655 20 0 FHADHM Cc1cc(NC(=O)c2sccc2-c2nnn[n-]2)ccc1C(F)(F)F ZINC000822209481 599558461 /nfs/dbraw/zinc/55/84/61/599558461.db2.gz KTCVDVKREZZREA-UHFFFAOYSA-N -1 3 353.329 3.508 20 0 FHADHM Cc1cc(NC(=O)c2sccc2-c2nn[n-]n2)ccc1C(F)(F)F ZINC000822209481 599558463 /nfs/dbraw/zinc/55/84/63/599558463.db2.gz KTCVDVKREZZREA-UHFFFAOYSA-N -1 3 353.329 3.508 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1N[C@@H]1CCCN(c2ccccc2)C1 ZINC000822581143 599560765 /nfs/dbraw/zinc/56/07/65/599560765.db2.gz BYJRQVUTNMOBIG-CYBMUJFWSA-N -1 3 354.845 3.601 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1N[C@@H]1CCCN(c2ccccc2)C1 ZINC000822581143 599560767 /nfs/dbraw/zinc/56/07/67/599560767.db2.gz BYJRQVUTNMOBIG-CYBMUJFWSA-N -1 3 354.845 3.601 20 0 FHADHM CCC[C@@H](C)NC(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736422553 599562101 /nfs/dbraw/zinc/56/21/01/599562101.db2.gz IYESNFKWQPHOMK-CYBMUJFWSA-N -1 3 350.426 3.529 20 0 FHADHM Cc1ccccc1[C@H]1C[C@@H](C)N(C(=O)Nc2ccc(-c3nnn[n-]3)cc2)C1 ZINC000737424890 599599667 /nfs/dbraw/zinc/59/96/67/599599667.db2.gz YVNPRQITHXIGOP-ZBFHGGJFSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1ccccc1[C@H]1C[C@@H](C)N(C(=O)Nc2ccc(-c3nn[n-]n3)cc2)C1 ZINC000737424890 599599668 /nfs/dbraw/zinc/59/96/68/599599668.db2.gz YVNPRQITHXIGOP-ZBFHGGJFSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)Nc2ccc(-c3nnn[n-]3)cc2)C1 ZINC000737424888 599600117 /nfs/dbraw/zinc/60/01/17/599600117.db2.gz YVNPRQITHXIGOP-GOEBONIOSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)Nc2ccc(-c3nn[n-]n3)cc2)C1 ZINC000737424888 599600119 /nfs/dbraw/zinc/60/01/19/599600119.db2.gz YVNPRQITHXIGOP-GOEBONIOSA-N -1 3 362.437 3.585 20 0 FHADHM CCc1ccc([C@H](C)CC(=O)OCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736687434 599605681 /nfs/dbraw/zinc/60/56/81/599605681.db2.gz MQTRKBVZXQXSBM-CQSZACIVSA-N -1 3 350.422 3.666 20 0 FHADHM CCc1ccc([C@H](C)CC(=O)OCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736687434 599605684 /nfs/dbraw/zinc/60/56/84/599605684.db2.gz MQTRKBVZXQXSBM-CQSZACIVSA-N -1 3 350.422 3.666 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CCCC[C@H]1[C@H](C)CC ZINC000736633870 599610116 /nfs/dbraw/zinc/61/01/16/599610116.db2.gz FVGGJSCRDZALDF-CJNGLKHVSA-N -1 3 372.473 3.698 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CCCC[C@H]1[C@H](C)CC ZINC000736633870 599610117 /nfs/dbraw/zinc/61/01/17/599610117.db2.gz FVGGJSCRDZALDF-CJNGLKHVSA-N -1 3 372.473 3.698 20 0 FHADHM Cc1sc(NC(=O)[C@@H](C)CCc2cccc(F)c2)c(-c2nnn[n-]2)c1C ZINC000822557978 599628655 /nfs/dbraw/zinc/62/86/55/599628655.db2.gz LFYLDQBDSCTVPD-JTQLQIEISA-N -1 3 373.457 3.892 20 0 FHADHM Cc1sc(NC(=O)[C@@H](C)CCc2cccc(F)c2)c(-c2nn[n-]n2)c1C ZINC000822557978 599628656 /nfs/dbraw/zinc/62/86/56/599628656.db2.gz LFYLDQBDSCTVPD-JTQLQIEISA-N -1 3 373.457 3.892 20 0 FHADHM CC(C)[C@@H](C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccccc1 ZINC000820017563 599629320 /nfs/dbraw/zinc/62/93/20/599629320.db2.gz ZYGKWNKVDQOJFT-MRXNPFEDSA-N -1 3 355.829 3.898 20 0 FHADHM CC(C)[C@@H](C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccccc1 ZINC000820017563 599629321 /nfs/dbraw/zinc/62/93/21/599629321.db2.gz ZYGKWNKVDQOJFT-MRXNPFEDSA-N -1 3 355.829 3.898 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)C1(c2ccccc2)CC1 ZINC000823303132 599635035 /nfs/dbraw/zinc/63/50/35/599635035.db2.gz DPLJEVCXSQCZRY-UHFFFAOYSA-N -1 3 373.338 3.556 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)C1(c2ccccc2)CC1 ZINC000823303132 599635036 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20 0 FHADHM Cc1sc(NC(=O)[C@H](C)CCOc2ccccc2)c(-c2nn[n-]n2)c1C ZINC000822559063 599689960 /nfs/dbraw/zinc/68/99/60/599689960.db2.gz VHHIBGOSBBNLHP-LLVKDONJSA-N -1 3 371.466 3.589 20 0 FHADHM Cc1ccccc1-c1cnc(CNc2ccc(F)c(-c3nnn[n-]3)c2)o1 ZINC000822340655 599691550 /nfs/dbraw/zinc/69/15/50/599691550.db2.gz BJQLNFWABKPQAM-UHFFFAOYSA-N -1 3 350.357 3.581 20 0 FHADHM Cc1ccccc1-c1cnc(CNc2ccc(F)c(-c3nn[n-]n3)c2)o1 ZINC000822340655 599691551 /nfs/dbraw/zinc/69/15/51/599691551.db2.gz BJQLNFWABKPQAM-UHFFFAOYSA-N -1 3 350.357 3.581 20 0 FHADHM COc1cccc(CN(Cc2cc(C)c(C(=O)[O-])o2)C2CCC(O)CC2)c1 ZINC000738097852 599799606 /nfs/dbraw/zinc/79/96/06/599799606.db2.gz RXTZBPHMJKEBFO-UHFFFAOYSA-N -1 3 373.449 3.601 20 0 FHADHM CC(C)Oc1ccc(NC(=O)C(C)(C)c2ccccc2)cc1-c1nnn[n-]1 ZINC000820161368 607398308 /nfs/dbraw/zinc/39/83/08/607398308.db2.gz WVABFPCZAGVPPH-UHFFFAOYSA-N -1 3 365.437 3.570 20 0 FHADHM CC(C)Oc1ccc(NC(=O)C(C)(C)c2ccccc2)cc1-c1nn[n-]n1 ZINC000820161368 607398309 /nfs/dbraw/zinc/39/83/09/607398309.db2.gz WVABFPCZAGVPPH-UHFFFAOYSA-N -1 3 365.437 3.570 20 0 FHADHM Cc1ccsc1CCCC(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000826316573 607401770 /nfs/dbraw/zinc/40/17/70/607401770.db2.gz RXEKOMIFOJQKGB-CYBMUJFWSA-N -1 3 356.451 3.864 20 0 FHADHM Cc1ccsc1CCCC(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000826316573 607401771 /nfs/dbraw/zinc/40/17/71/607401771.db2.gz RXEKOMIFOJQKGB-CYBMUJFWSA-N -1 3 356.451 3.864 20 0 FHADHM CN(Cc1c2ccccc2sc1C(=O)[O-])Cc1ccc2c(c1)OCO2 ZINC000737487940 599936389 /nfs/dbraw/zinc/93/63/89/599936389.db2.gz UGUMMJXIWPFCJN-UHFFFAOYSA-N -1 3 355.415 3.960 20 0 FHADHM Cc1cc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)ccc1C(=O)[O-] ZINC000237823041 599949073 /nfs/dbraw/zinc/94/90/73/599949073.db2.gz IHVOSAKQVKGTIA-INIZCTEOSA-N -1 3 370.424 3.683 20 0 FHADHM C[C@@H](C(=O)[O-])N1CCN([C@H](c2ccccc2)c2ccccc2Cl)CC1 ZINC000237528345 599951827 /nfs/dbraw/zinc/95/18/27/599951827.db2.gz QRKFLISBANSTPF-HNAYVOBHSA-N -1 3 358.869 3.520 20 0 FHADHM CN(C)Cc1cccc(NC(=O)Nc2cccc(CSCC(=O)[O-])c2)c1 ZINC000737369959 599987151 /nfs/dbraw/zinc/98/71/51/599987151.db2.gz BITVDSCLIWVDQK-UHFFFAOYSA-N -1 3 373.478 3.710 20 0 FHADHM CN(C)Cc1ccc(C(=O)Nc2cccc(CSCCC(=O)[O-])c2)cc1 ZINC000737370991 600066968 /nfs/dbraw/zinc/06/69/68/600066968.db2.gz UYOUCUJUGGITJH-UHFFFAOYSA-N -1 3 372.490 3.708 20 0 FHADHM O=C([O-])[C@@H]1CCCN([C@H](C(=O)c2c[nH]c3ccccc23)c2ccccc2)C1 ZINC000263573525 600100525 /nfs/dbraw/zinc/10/05/25/600100525.db2.gz MLVHHGBPDCQWEI-UZLBHIALSA-N -1 3 362.429 3.889 20 0 FHADHM CC(C)[C@H](NCC(=O)N1CCC(C(=O)[O-])CC1)c1ccc(C(C)(C)C)cc1 ZINC000736388765 600115452 /nfs/dbraw/zinc/11/54/52/600115452.db2.gz DXHSWUFRIWNJPN-FQEVSTJZSA-N -1 3 374.525 3.594 20 0 FHADHM CC[C@@](NCc1cc(=O)oc2cc(C)c(C)cc12)(C(=O)[O-])c1ccccc1 ZINC000736918673 600127250 /nfs/dbraw/zinc/12/72/50/600127250.db2.gz VQQYOEUYKAVPOG-QFIPXVFZSA-N -1 3 365.429 3.890 20 0 FHADHM CC[C@](NCc1cc(=O)oc2cc(C)ccc12)(C(=O)[O-])c1ccccc1 ZINC000736917500 600127367 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Cc1ccsc1CCCC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000826316086 607428783 /nfs/dbraw/zinc/42/87/83/607428783.db2.gz CQHKHVKYYWVFAR-UHFFFAOYSA-N -1 3 361.858 3.851 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@H]2C[C@@H]2c2sccc2C)s1 ZINC000825694651 607430177 /nfs/dbraw/zinc/43/01/77/607430177.db2.gz YHGYWRWLWRFFIH-QWRGUYRKSA-N -1 3 359.480 3.603 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@H]2C[C@@H]2c2sccc2C)s1 ZINC000825694651 607430179 /nfs/dbraw/zinc/43/01/79/607430179.db2.gz YHGYWRWLWRFFIH-QWRGUYRKSA-N -1 3 359.480 3.603 20 0 FHADHM C[C@H](Sc1ccc(Cl)cc1)C(=O)N(C)c1ccc(-c2nnn[n-]2)cc1 ZINC000824754027 607437860 /nfs/dbraw/zinc/43/78/60/607437860.db2.gz HJHZHDUGABWYAW-NSHDSACASA-N -1 3 373.869 3.664 20 0 FHADHM C[C@H](Sc1ccc(Cl)cc1)C(=O)N(C)c1ccc(-c2nn[n-]n2)cc1 ZINC000824754027 607437861 /nfs/dbraw/zinc/43/78/61/607437861.db2.gz HJHZHDUGABWYAW-NSHDSACASA-N -1 3 373.869 3.664 20 0 FHADHM CN(C)c1cccc([C@@H]2CCCN2Cn2ncc3cc(C(=O)[O-])ccc32)c1 ZINC000737385767 600396267 /nfs/dbraw/zinc/39/62/67/600396267.db2.gz JSYQYKSSUWEWHV-IBGZPJMESA-N -1 3 364.449 3.595 20 0 FHADHM O=C([O-])[C@H](NCc1ccc(N2CCCCCC2)nc1)c1ccc(F)cc1 ZINC000739501356 600425227 /nfs/dbraw/zinc/42/52/27/600425227.db2.gz XBBASRGJESZFBJ-LJQANCHMSA-N -1 3 357.429 3.517 20 0 FHADHM O=C([O-])[C@@H](NCc1cccc(NC(=O)C2CCCC2)c1)c1ccc(F)cc1 ZINC000739483336 600426774 /nfs/dbraw/zinc/42/67/74/600426774.db2.gz DYCJIEUXEOFFCG-IBGZPJMESA-N -1 3 370.424 3.870 20 0 FHADHM O=C([O-])c1sc2ccccc2c1CN1CCCN(CC(F)(F)F)CC1 ZINC000740278115 600436499 /nfs/dbraw/zinc/43/64/99/600436499.db2.gz DVQSRVJCZOHFKC-UHFFFAOYSA-N -1 3 372.412 3.670 20 0 FHADHM c1ccc(-c2nnn[n-]2)c(CSCc2noc(C3CCCCC3)n2)c1 ZINC000823773247 607474458 /nfs/dbraw/zinc/47/44/58/607474458.db2.gz SGORZACAYPJEPV-UHFFFAOYSA-N -1 3 356.455 3.731 20 0 FHADHM c1ccc(-c2nn[n-]n2)c(CSCc2noc(C3CCCCC3)n2)c1 ZINC000823773247 607474459 /nfs/dbraw/zinc/47/44/59/607474459.db2.gz SGORZACAYPJEPV-UHFFFAOYSA-N -1 3 356.455 3.731 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1CNc1ccc2oc(C3CC3)nc2c1 ZINC000822744078 607475799 /nfs/dbraw/zinc/47/57/99/607475799.db2.gz LFYKHHRTZKZAGZ-UHFFFAOYSA-N -1 3 350.357 3.637 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CNc1ccc2oc(C3CC3)nc2c1 ZINC000822744078 607475800 /nfs/dbraw/zinc/47/58/00/607475800.db2.gz LFYKHHRTZKZAGZ-UHFFFAOYSA-N -1 3 350.357 3.637 20 0 FHADHM O=C([O-])c1ccc(OCCN2CCC[C@H]2c2ccc(O)cc2)c(Cl)c1 ZINC000833321516 600991477 /nfs/dbraw/zinc/99/14/77/600991477.db2.gz WGJAOYAFPRQBPQ-KRWDZBQOSA-N -1 3 361.825 3.960 20 0 FHADHM CC(C)[C@H](NCc1ccc(-c2nn[n-]n2)cc1F)c1ccc(F)cc1F ZINC000820028288 607486853 /nfs/dbraw/zinc/48/68/53/607486853.db2.gz YGKDITPSBBJTKZ-KRWDZBQOSA-N -1 3 361.371 3.771 20 0 FHADHM C[C@](CO)(NCc1csc(-c2ccc(C(=O)[O-])cc2)n1)C1CCCCC1 ZINC000827512978 601029015 /nfs/dbraw/zinc/02/90/15/601029015.db2.gz VHNKKJYNJDWHFM-HXUWFJFHSA-N -1 3 374.506 3.929 20 0 FHADHM Cc1ccc(NCc2ccc(-c3nnn[n-]3)cc2F)cc1-c1ncco1 ZINC000822254227 607491297 /nfs/dbraw/zinc/49/12/97/607491297.db2.gz 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Cc1ccc2c(CN[C@H](c3ccccc3)[C@@H](C)C(=O)[O-])cc(=O)oc2c1C ZINC000832962626 601205657 /nfs/dbraw/zinc/20/56/57/601205657.db2.gz ZIJUUJKZDOFKNE-QRWLVFNGSA-N -1 3 365.429 3.961 20 0 FHADHM CCN(C(=O)c1cnc(C(C)C)s1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821160666 607498817 /nfs/dbraw/zinc/49/88/17/607498817.db2.gz OIMZDUWAGOFZIG-LBPRGKRZSA-N -1 3 370.482 3.670 20 0 FHADHM CCN(C(=O)c1cnc(C(C)C)s1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821160666 607498818 /nfs/dbraw/zinc/49/88/18/607498818.db2.gz OIMZDUWAGOFZIG-LBPRGKRZSA-N -1 3 370.482 3.670 20 0 FHADHM C[C@@H](CSCc1ccccc1)C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000820294134 607500299 /nfs/dbraw/zinc/50/02/99/607500299.db2.gz RDEDFCKIKAZWCI-LBPRGKRZSA-N -1 3 371.441 3.514 20 0 FHADHM C[C@@H](CSCc1ccccc1)C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000820294134 607500300 /nfs/dbraw/zinc/50/03/00/607500300.db2.gz RDEDFCKIKAZWCI-LBPRGKRZSA-N -1 3 371.441 3.514 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cnc(C(C)C)s1 ZINC000825332612 607510286 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ZINC000828664868 602219568 /nfs/dbraw/zinc/21/95/68/602219568.db2.gz JMYZEWKRDNCNNJ-INIZCTEOSA-N -1 3 367.243 3.837 20 0 FHADHM CN(C)Cc1cccc(NC(=O)N[C@H](c2ccccc2)C(C)(C)C(=O)[O-])c1 ZINC000830619986 602234149 /nfs/dbraw/zinc/23/41/49/602234149.db2.gz LNROZMXCGGQRPU-GOSISDBHSA-N -1 3 369.465 3.722 20 0 FHADHM C[C@H](c1ccc(C(=O)[O-])o1)N1CCC[C@H]([C@H](C)NC(=O)OC(C)(C)C)C1 ZINC000827688512 602246272 /nfs/dbraw/zinc/24/62/72/602246272.db2.gz XQCXXEVYJDYPRQ-MJBXVCDLSA-N -1 3 366.458 3.664 20 0 FHADHM CCc1ccc([C@H](CNC(=O)Nc2ccc(C(=O)[O-])c(F)c2)N(C)C)cc1 ZINC000830239519 602369114 /nfs/dbraw/zinc/36/91/14/602369114.db2.gz YMNPXDMNJWQJAV-SFHVURJKSA-N -1 3 373.428 3.511 20 0 FHADHM CCc1ccc([C@H](CNC(=O)c2ccc(F)c(NC(=O)[O-])c2)N(C)C)cc1 ZINC000739544941 602493785 /nfs/dbraw/zinc/49/37/85/602493785.db2.gz YBZXDJNAFMXEHO-SFHVURJKSA-N -1 3 373.428 3.511 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)c1ccc(Cl)c(C(F)(F)F)c1 ZINC000119713863 607570132 /nfs/dbraw/zinc/57/01/32/607570132.db2.gz NXUGCRHDELSKJH-UHFFFAOYSA-N -1 3 367.718 3.791 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)c1ccc(Cl)c(C(F)(F)F)c1 ZINC000119713863 607570134 /nfs/dbraw/zinc/57/01/34/607570134.db2.gz NXUGCRHDELSKJH-UHFFFAOYSA-N -1 3 367.718 3.791 20 0 FHADHM CC[C@@H](SC)C(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000825159132 607577879 /nfs/dbraw/zinc/57/78/79/607577879.db2.gz JNORARGVMGCONX-MRXNPFEDSA-N -1 3 369.450 3.739 20 0 FHADHM CC[C@@H](SC)C(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000825159132 607577880 /nfs/dbraw/zinc/57/78/80/607577880.db2.gz JNORARGVMGCONX-MRXNPFEDSA-N -1 3 369.450 3.739 20 0 FHADHM COc1ccccc1[C@H](NC[C@H]1CCCN(C(=O)[O-])C1)c1ccccc1 ZINC000739967944 603275313 /nfs/dbraw/zinc/27/53/13/603275313.db2.gz GIFKITQSTLICJX-OXQOHEQNSA-N -1 3 354.450 3.764 20 0 FHADHM C[C@H]1C[C@@H](NC(=O)Nc2ccc(NC(=O)[O-])cc2)CN1Cc1ccccc1 ZINC000825794699 603988552 /nfs/dbraw/zinc/98/85/52/603988552.db2.gz OPVDXBRIMNIRBU-KBXCAEBGSA-N -1 3 368.437 3.561 20 0 FHADHM Cc1ccc([C@H]2CCCN2C(=O)c2ccc(-c3nnn[n-]3)cc2C)cc1C ZINC000826285863 607672599 /nfs/dbraw/zinc/67/25/99/607672599.db2.gz LWOFIZPEFQEFQI-LJQANCHMSA-N -1 3 361.449 3.769 20 0 FHADHM Cc1ccc([C@H]2CCCN2C(=O)c2ccc(-c3nn[n-]n3)cc2C)cc1C ZINC000826285863 607672601 /nfs/dbraw/zinc/67/26/01/607672601.db2.gz LWOFIZPEFQEFQI-LJQANCHMSA-N -1 3 361.449 3.769 20 0 FHADHM Cc1[nH]c2ccc(Cl)cc2c1C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000153192306 607680902 /nfs/dbraw/zinc/68/09/02/607680902.db2.gz SFAZNHMVERZWQC-UHFFFAOYSA-N -1 3 352.785 3.562 20 0 FHADHM Cc1[nH]c2ccc(Cl)cc2c1C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000153192306 607680903 /nfs/dbraw/zinc/68/09/03/607680903.db2.gz SFAZNHMVERZWQC-UHFFFAOYSA-N -1 3 352.785 3.562 20 0 FHADHM Cc1c([C@H](C)N[C@H]2CCCN(C(=O)[O-])C2)cnn1-c1cccc(Cl)c1 ZINC000832854116 604286727 /nfs/dbraw/zinc/28/67/27/604286727.db2.gz UITJXPADZGNIKE-WFASDCNBSA-N -1 3 362.861 3.627 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N[C@@H](c1ccc(F)cc1)C1CCC1 ZINC000826246708 607684703 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CCc1ccc([C@@H]2CCCCN2C(=O)c2ccc(-c3nnn[n-]3)cc2C)o1 ZINC000825705151 607694824 /nfs/dbraw/zinc/69/48/24/607694824.db2.gz XDCLRBQKNGPJBG-KRWDZBQOSA-N -1 3 365.437 3.698 20 0 FHADHM CCc1ccc([C@@H]2CCCCN2C(=O)c2ccc(-c3nn[n-]n3)cc2C)o1 ZINC000825705151 607694826 /nfs/dbraw/zinc/69/48/26/607694826.db2.gz XDCLRBQKNGPJBG-KRWDZBQOSA-N -1 3 365.437 3.698 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1CC[C@H](C)[C@H]1c1cccc(F)c1 ZINC000826244370 607699836 /nfs/dbraw/zinc/69/98/36/607699836.db2.gz PMBWONJHIXIAKR-SGTLLEGYSA-N -1 3 365.412 3.538 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1CC[C@H](C)[C@H]1c1cccc(F)c1 ZINC000826244370 607699838 /nfs/dbraw/zinc/69/98/38/607699838.db2.gz PMBWONJHIXIAKR-SGTLLEGYSA-N -1 3 365.412 3.538 20 0 FHADHM COc1ccc([C@@H]2CCCN2Cc2ccc(O[C@H](C)C(=O)[O-])cc2)cc1 ZINC000833731680 604516279 /nfs/dbraw/zinc/51/62/79/604516279.db2.gz BVEDUSOZCKJNIZ-QRWLVFNGSA-N -1 3 355.434 3.884 20 0 FHADHM CC[C@@H](NCC1CCN(C(=O)[O-])CC1)c1nc(C(F)(F)F)cs1 ZINC000826620194 604517840 /nfs/dbraw/zinc/51/78/40/604517840.db2.gz POQFXKNQRYCFAS-SNVBAGLBSA-N -1 3 351.394 3.593 20 0 FHADHM C[C@@]1(C(=O)[O-])CCN(Cc2coc(-c3ccc(C(F)(F)F)cc3)n2)C1 ZINC000566015159 604611930 /nfs/dbraw/zinc/61/19/30/604611930.db2.gz LYCMBBXMHQFCMX-MRXNPFEDSA-N -1 3 354.328 3.657 20 0 FHADHM O=C([O-])[C@@H]1CC12CCN(Cc1ccccc1OCc1ccccc1)CC2 ZINC000656190937 604649365 /nfs/dbraw/zinc/64/93/65/604649365.db2.gz VLXLNCZQIQVGCX-IBGZPJMESA-N -1 3 351.446 3.952 20 0 FHADHM COc1cc(F)cc(CN[C@H](C(=O)[O-])c2cccc(Br)c2)c1 ZINC000833729105 604686517 /nfs/dbraw/zinc/68/65/17/604686517.db2.gz NHAGIDCKPZZMCQ-HNNXBMFYSA-N -1 3 368.202 3.512 20 0 FHADHM C[C@H](c1ccccc1)N(Cc1ccccc1)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC000824773074 607710116 /nfs/dbraw/zinc/71/01/16/607710116.db2.gz YBXIUBNQCKOOQA-OAHLLOKOSA-N -1 3 372.432 3.598 20 0 FHADHM C[C@H](c1ccccc1)N(Cc1ccccc1)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC000824773074 607710118 /nfs/dbraw/zinc/71/01/18/607710118.db2.gz YBXIUBNQCKOOQA-OAHLLOKOSA-N -1 3 372.432 3.598 20 0 FHADHM c1sc(-c2ccccc2)nc1CNC1(c2cccc(-c3nn[n-]n3)c2)CC1 ZINC000826519473 607705606 /nfs/dbraw/zinc/70/56/06/607705606.db2.gz ZVYJFASXOLHYFG-UHFFFAOYSA-N -1 3 374.473 3.769 20 0 FHADHM Cc1[nH]c2ccc(Cl)cc2c1C(=O)Nc1cc(-c2nnn[n-]2)ccc1C ZINC000826278214 607711656 /nfs/dbraw/zinc/71/16/56/607711656.db2.gz UPKAJRDRDACGLY-UHFFFAOYSA-N -1 3 366.812 3.871 20 0 FHADHM Cc1[nH]c2ccc(Cl)cc2c1C(=O)Nc1cc(-c2nn[n-]n2)ccc1C ZINC000826278214 607711658 /nfs/dbraw/zinc/71/16/58/607711658.db2.gz UPKAJRDRDACGLY-UHFFFAOYSA-N -1 3 366.812 3.871 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1SCc1nc(C(F)(F)F)cs1 ZINC000826371991 607713586 /nfs/dbraw/zinc/71/35/86/607713586.db2.gz BREIQJIVNLOGJM-UHFFFAOYSA-N -1 3 361.349 3.773 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1SCc1nc(C(F)(F)F)cs1 ZINC000826371991 607713588 /nfs/dbraw/zinc/71/35/88/607713588.db2.gz BREIQJIVNLOGJM-UHFFFAOYSA-N -1 3 361.349 3.773 20 0 FHADHM CN(C(=O)CN[C@H](c1ccccc1)C(C)(C)C)c1ccccc1C(=O)[O-] ZINC000833685715 604922425 /nfs/dbraw/zinc/92/24/25/604922425.db2.gz KWTDVQCBLUXWCZ-LJQANCHMSA-N -1 3 354.450 3.725 20 0 FHADHM CC(C)(C(=O)[O-])[C@@H]1CCCN(Cc2coc(-c3c(F)cccc3F)n2)C1 ZINC000833418814 604940666 /nfs/dbraw/zinc/94/06/66/604940666.db2.gz BBGXBIHIYRIVGP-GFCCVEGCSA-N -1 3 364.392 3.943 20 0 FHADHM CC(C)(C(=O)[O-])[C@@H]1CCCN(Cc2cc(F)ccc2Br)C1 ZINC000135033738 604944841 /nfs/dbraw/zinc/94/48/41/604944841.db2.gz PPZGPXKIVOQJSQ-GFCCVEGCSA-N -1 3 358.251 3.911 20 0 FHADHM Cc1nc(-c2ccc([C@@H](C)N[C@H](C(=O)[O-])c3cccnc3)cc2)cs1 ZINC000832990628 604973931 /nfs/dbraw/zinc/97/39/31/604973931.db2.gz HICWMDOMNAKJBU-XIKOKIGWSA-N -1 3 353.447 3.990 20 0 FHADHM CC(C)Sc1ccc(Cl)cc1NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC000824338247 607726744 /nfs/dbraw/zinc/72/67/44/607726744.db2.gz UZQSUHYCIYCVFL-UHFFFAOYSA-N -1 3 362.846 3.601 20 0 FHADHM CC(C)Sc1ccc(Cl)cc1NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC000824338247 607726746 /nfs/dbraw/zinc/72/67/46/607726746.db2.gz UZQSUHYCIYCVFL-UHFFFAOYSA-N -1 3 362.846 3.601 20 0 FHADHM O=C([O-])[C@H](NCc1ccc(-c2ccc3c(c2)CCCO3)cc1)c1cccnc1 ZINC000833166511 605000135 /nfs/dbraw/zinc/00/01/35/605000135.db2.gz QFKYVOOOTJKYEJ-JOCHJYFZSA-N -1 3 374.440 3.989 20 0 FHADHM COc1cccc(CN(Cc2ccccc2CC(=O)[O-])C[C@@H]2CCCO2)c1 ZINC000833735847 605065344 /nfs/dbraw/zinc/06/53/44/605065344.db2.gz ZCSRFDMPWOVPGW-NRFANRHFSA-N -1 3 369.461 3.504 20 0 FHADHM Cc1noc(C)c1[C@@H](C)CNc1ccc(C(F)(F)F)cc1-c1nnn[n-]1 ZINC000826339132 607734379 /nfs/dbraw/zinc/73/43/79/607734379.db2.gz SJUSZMQMUWFCPS-QMMMGPOBSA-N -1 3 366.347 3.706 20 0 FHADHM Cc1noc(C)c1[C@@H](C)CNc1ccc(C(F)(F)F)cc1-c1nn[n-]n1 ZINC000826339132 607734380 /nfs/dbraw/zinc/73/43/80/607734380.db2.gz SJUSZMQMUWFCPS-QMMMGPOBSA-N -1 3 366.347 3.706 20 0 FHADHM CC(C)(C(=O)[O-])[C@H](NCc1cc(F)cc2c1OCOC2)c1ccccc1 ZINC000833414356 605180129 /nfs/dbraw/zinc/18/01/29/605180129.db2.gz MESFURYZALWBLS-GOSISDBHSA-N -1 3 359.397 3.634 20 0 FHADHM C[C@H](CC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(F)cc1F ZINC000824384584 607745360 /nfs/dbraw/zinc/74/53/60/607745360.db2.gz FFUMOHUIHMINRR-NEPJUHHUSA-N -1 3 371.391 3.516 20 0 FHADHM C[C@H](CC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(F)cc1F ZINC000824384584 607745361 /nfs/dbraw/zinc/74/53/61/607745361.db2.gz FFUMOHUIHMINRR-NEPJUHHUSA-N -1 3 371.391 3.516 20 0 FHADHM CN(Cc1ccc(Br)cc1)Cc1ccc(OCC(=O)[O-])cc1 ZINC000833693939 605293800 /nfs/dbraw/zinc/29/38/00/605293800.db2.gz BHNQQJUZILXWPM-UHFFFAOYSA-N -1 3 364.239 3.545 20 0 FHADHM CC1([C@H]2CCCN([C@@H](C(=O)[O-])c3ccc(Cl)cc3Cl)C2)OCCO1 ZINC000833563134 605442589 /nfs/dbraw/zinc/44/25/89/605442589.db2.gz DEPWFSWYPOWZOC-XHDPSFHLSA-N -1 3 374.264 3.594 20 0 FHADHM Cc1oc(-c2ccsc2)nc1CN1C[C@@H]2CCC[C@H](NC(=O)[O-])[C@@H]2C1 ZINC000833934605 605450088 /nfs/dbraw/zinc/45/00/88/605450088.db2.gz MLDPVTPIGSWWIC-CFVMTHIKSA-N -1 3 361.467 3.580 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)N1CC[C@@H]1c1cccc(F)c1 ZINC000826452425 607757906 /nfs/dbraw/zinc/75/79/06/607757906.db2.gz SUTRYTWEPZDCFR-OAHLLOKOSA-N -1 3 372.791 3.638 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)N1CC[C@@H]1c1cccc(F)c1 ZINC000826452425 607757907 /nfs/dbraw/zinc/75/79/07/607757907.db2.gz SUTRYTWEPZDCFR-OAHLLOKOSA-N -1 3 372.791 3.638 20 0 FHADHM O=C(Nc1nc(-c2cccc(-c3nnn[n-]3)c2)cs1)[C@@H]1CC12CCCC2 ZINC000826459723 607769870 /nfs/dbraw/zinc/76/98/70/607769870.db2.gz XBFIEVOHHILTIZ-ZDUSSCGKSA-N -1 3 366.450 3.509 20 0 FHADHM O=C(Nc1nc(-c2cccc(-c3nn[n-]n3)c2)cs1)[C@@H]1CC12CCCC2 ZINC000826459723 607769871 /nfs/dbraw/zinc/76/98/71/607769871.db2.gz XBFIEVOHHILTIZ-ZDUSSCGKSA-N -1 3 366.450 3.509 20 0 FHADHM C[C@H](C(=O)Nc1nc(-c2cccc(-c3nnn[n-]3)c2)cs1)C(C)(C)C ZINC000824045098 607770140 /nfs/dbraw/zinc/77/01/40/607770140.db2.gz GFZCUQBNTVNDFT-SNVBAGLBSA-N -1 3 356.455 3.611 20 0 FHADHM C[C@H](C(=O)Nc1nc(-c2cccc(-c3nn[n-]n3)c2)cs1)C(C)(C)C ZINC000824045098 607770141 /nfs/dbraw/zinc/77/01/41/607770141.db2.gz GFZCUQBNTVNDFT-SNVBAGLBSA-N -1 3 356.455 3.611 20 0 FHADHM Cn1cc(CN2CCC([C@H]3CCCN3C(=O)[O-])CC2)c(-c2cccs2)n1 ZINC000833950122 605989755 /nfs/dbraw/zinc/98/97/55/605989755.db2.gz ZDKAXMYJHYKTHD-MRXNPFEDSA-N -1 3 374.510 3.503 20 0 FHADHM Cn1cc(CN2CCC([C@@H]3CCCN3C(=O)[O-])CC2)c(-c2cccs2)n1 ZINC000833950118 605989995 /nfs/dbraw/zinc/98/99/95/605989995.db2.gz ZDKAXMYJHYKTHD-INIZCTEOSA-N -1 3 374.510 3.503 20 0 FHADHM CC[C@@H]1CN(C(=O)c2sccc2-c2nnn[n-]2)CC[C@H]1c1ccccc1 ZINC000820994990 606031058 /nfs/dbraw/zinc/03/10/58/606031058.db2.gz LVRCQXIVVNCDGC-UKRRQHHQSA-N -1 3 367.478 3.584 20 0 FHADHM CC[C@@H]1CN(C(=O)c2sccc2-c2nn[n-]n2)CC[C@H]1c1ccccc1 ZINC000820994990 606031063 /nfs/dbraw/zinc/03/10/63/606031063.db2.gz LVRCQXIVVNCDGC-UKRRQHHQSA-N -1 3 367.478 3.584 20 0 FHADHM CCCOCc1ccccc1CNc1nc2ccccc2cc1-c1nnn[n-]1 ZINC000821128502 606050393 /nfs/dbraw/zinc/05/03/93/606050393.db2.gz VWSFXPRJVJYYSH-UHFFFAOYSA-N -1 3 374.448 3.954 20 0 FHADHM CCCOCc1ccccc1CNc1nc2ccccc2cc1-c1nn[n-]n1 ZINC000821128502 606050397 /nfs/dbraw/zinc/05/03/97/606050397.db2.gz VWSFXPRJVJYYSH-UHFFFAOYSA-N -1 3 374.448 3.954 20 0 FHADHM CC[C@@H](C)Oc1ccc(C(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000820876030 606116855 /nfs/dbraw/zinc/11/68/55/606116855.db2.gz KJMFYYRQMOOABQ-ZIAGYGMSSA-N -1 3 365.437 3.535 20 0 FHADHM CC[C@@H](C)Oc1ccc(C(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000820876030 606116857 /nfs/dbraw/zinc/11/68/57/606116857.db2.gz KJMFYYRQMOOABQ-ZIAGYGMSSA-N -1 3 365.437 3.535 20 0 FHADHM CCc1ccc(C(C)(C)C(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000821476375 606117087 /nfs/dbraw/zinc/11/70/87/606117087.db2.gz NMQRUARNDNSPMF-AWEZNQCLSA-N -1 3 363.465 3.584 20 0 FHADHM CCc1ccc(C(C)(C)C(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000821476375 606117089 /nfs/dbraw/zinc/11/70/89/606117089.db2.gz NMQRUARNDNSPMF-AWEZNQCLSA-N -1 3 363.465 3.584 20 0 FHADHM COc1ccc([C@H](C)CC(=O)O[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000821777121 606127805 /nfs/dbraw/zinc/12/78/05/606127805.db2.gz APMWEKKHVZYMTH-ZIAGYGMSSA-N -1 3 366.421 3.673 20 0 FHADHM COc1ccc([C@H](C)CC(=O)O[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000821777121 606127806 /nfs/dbraw/zinc/12/78/06/606127806.db2.gz APMWEKKHVZYMTH-ZIAGYGMSSA-N -1 3 366.421 3.673 20 0 FHADHM Cc1cc(F)cc2c1ncc(-c1nnn[n-]1)c2N1Cc2ccccc2[C@H]1C ZINC000822204450 606137644 /nfs/dbraw/zinc/13/76/44/606137644.db2.gz PAYYZQOWGDTKQV-GFCCVEGCSA-N -1 3 360.396 3.944 20 0 FHADHM Cc1cc(F)cc2c1ncc(-c1nn[n-]n1)c2N1Cc2ccccc2[C@H]1C ZINC000822204450 606137646 /nfs/dbraw/zinc/13/76/46/606137646.db2.gz PAYYZQOWGDTKQV-GFCCVEGCSA-N -1 3 360.396 3.944 20 0 FHADHM C[C@H](OC(=O)Cc1cccc(-c2nnn[n-]2)c1)c1ccc(F)c(Cl)c1 ZINC000820502798 606142160 /nfs/dbraw/zinc/14/21/60/606142160.db2.gz WACKJPSLNQYJOX-JTQLQIEISA-N -1 3 360.776 3.506 20 0 FHADHM C[C@H](OC(=O)Cc1cccc(-c2nn[n-]n2)c1)c1ccc(F)c(Cl)c1 ZINC000820502798 606142161 /nfs/dbraw/zinc/14/21/61/606142161.db2.gz WACKJPSLNQYJOX-JTQLQIEISA-N -1 3 360.776 3.506 20 0 FHADHM CO[C@H](C)c1nc(CSCc2ccc(F)cc2-c2nnn[n-]2)cs1 ZINC000821675331 606179769 /nfs/dbraw/zinc/17/97/69/606179769.db2.gz IYSDNCLAVLXPNS-SECBINFHSA-N -1 3 365.459 3.603 20 0 FHADHM CO[C@H](C)c1nc(CSCc2ccc(F)cc2-c2nn[n-]n2)cs1 ZINC000821675331 606179770 /nfs/dbraw/zinc/17/97/70/606179770.db2.gz IYSDNCLAVLXPNS-SECBINFHSA-N -1 3 365.459 3.603 20 0 FHADHM COc1cccc(C(C)=CC(=O)Nc2sc(C)c(C)c2-c2nnn[n-]2)c1 ZINC000821859370 606209145 /nfs/dbraw/zinc/20/91/45/606209145.db2.gz NNWOJOBDBDOKJU-CSKARUKUSA-N -1 3 369.450 3.596 20 0 FHADHM COc1cccc(C(C)=CC(=O)Nc2sc(C)c(C)c2-c2nn[n-]n2)c1 ZINC000821859370 606209146 /nfs/dbraw/zinc/20/91/46/606209146.db2.gz NNWOJOBDBDOKJU-CSKARUKUSA-N -1 3 369.450 3.596 20 0 FHADHM Cc1cccc(Oc2ccccc2NC(=O)c2cc(-c3nnn[n-]3)cn2C)c1 ZINC000822331417 606210647 /nfs/dbraw/zinc/21/06/47/606210647.db2.gz GAUHCZKKZMBKTL-UHFFFAOYSA-N -1 3 374.404 3.558 20 0 FHADHM Cc1cccc(Oc2ccccc2NC(=O)c2cc(-c3nn[n-]n3)cn2C)c1 ZINC000822331417 606210649 /nfs/dbraw/zinc/21/06/49/606210649.db2.gz GAUHCZKKZMBKTL-UHFFFAOYSA-N -1 3 374.404 3.558 20 0 FHADHM CC[C@H](NCc1cc(-c2nnn[n-]2)cs1)c1nc(C(F)(F)F)cs1 ZINC000820926358 606224374 /nfs/dbraw/zinc/22/43/74/606224374.db2.gz RMRRJYPPECBTJL-VIFPVBQESA-N -1 3 374.417 3.644 20 0 FHADHM CC[C@H](NCc1cc(-c2nn[n-]n2)cs1)c1nc(C(F)(F)F)cs1 ZINC000820926358 606224376 /nfs/dbraw/zinc/22/43/76/606224376.db2.gz RMRRJYPPECBTJL-VIFPVBQESA-N -1 3 374.417 3.644 20 0 FHADHM C[C@@H]1[C@H](c2ccccc2)CCN1c1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000820643653 606233602 /nfs/dbraw/zinc/23/36/02/606233602.db2.gz YCYPNXRITZIUKT-DGCLKSJQSA-N -1 3 374.370 3.663 20 0 FHADHM C[C@@H]1[C@H](c2ccccc2)CCN1c1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000820643653 606233603 /nfs/dbraw/zinc/23/36/03/606233603.db2.gz YCYPNXRITZIUKT-DGCLKSJQSA-N -1 3 374.370 3.663 20 0 FHADHM CC[C@H](C)Sc1ccc(NC(=O)c2cc(-c3nnn[n-]3)cn2C)c(C)c1 ZINC000820882116 606238814 /nfs/dbraw/zinc/23/88/14/606238814.db2.gz KABMPGPAJKZDSN-LBPRGKRZSA-N -1 3 370.482 3.657 20 0 FHADHM CC[C@H](C)Sc1ccc(NC(=O)c2cc(-c3nn[n-]n3)cn2C)c(C)c1 ZINC000820882116 606238816 /nfs/dbraw/zinc/23/88/16/606238816.db2.gz KABMPGPAJKZDSN-LBPRGKRZSA-N -1 3 370.482 3.657 20 0 FHADHM CC(C)n1c2ccccc2nc1[C@@H]1CCCN1c1ccc(-c2nnn[n-]2)cn1 ZINC000820211249 606239872 /nfs/dbraw/zinc/23/98/72/606239872.db2.gz FLHDCYUWXQQQLQ-KRWDZBQOSA-N -1 3 374.452 3.534 20 0 FHADHM CC(C)n1c2ccccc2nc1[C@@H]1CCCN1c1ccc(-c2nn[n-]n2)cn1 ZINC000820211249 606239873 /nfs/dbraw/zinc/23/98/73/606239873.db2.gz FLHDCYUWXQQQLQ-KRWDZBQOSA-N -1 3 374.452 3.534 20 0 FHADHM CC(C)[C@H](CC(=O)Nc1ccc(F)cc1-c1nnn[n-]1)c1ccccc1 ZINC000820020667 606272015 /nfs/dbraw/zinc/27/20/15/606272015.db2.gz JOSUHLJFLRGZCG-HNNXBMFYSA-N -1 3 353.401 3.774 20 0 FHADHM CC(C)[C@H](CC(=O)Nc1ccc(F)cc1-c1nn[n-]n1)c1ccccc1 ZINC000820020667 606272016 /nfs/dbraw/zinc/27/20/16/606272016.db2.gz JOSUHLJFLRGZCG-HNNXBMFYSA-N -1 3 353.401 3.774 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)c1cccc(Cl)c1Cl ZINC000823347252 606273413 /nfs/dbraw/zinc/27/34/13/606273413.db2.gz VEGCMYYSWNPJJS-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)c1cccc(Cl)c1Cl ZINC000823347252 606273414 /nfs/dbraw/zinc/27/34/14/606273414.db2.gz VEGCMYYSWNPJJS-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM C[C@H](Sc1cccc(-c2nnn[n-]2)c1)c1nnc(-c2ccccc2)o1 ZINC000820555398 606324122 /nfs/dbraw/zinc/32/41/22/606324122.db2.gz KXSMGVUPHAGREL-NSHDSACASA-N -1 3 350.407 3.770 20 0 FHADHM C[C@H](Sc1cccc(-c2nn[n-]n2)c1)c1nnc(-c2ccccc2)o1 ZINC000820555398 606324123 /nfs/dbraw/zinc/32/41/23/606324123.db2.gz KXSMGVUPHAGREL-NSHDSACASA-N -1 3 350.407 3.770 20 0 FHADHM O=C(CSc1cccc(-c2nnn[n-]2)c1)C12CC3CC(CC(C3)C1)C2 ZINC000823070691 606324953 /nfs/dbraw/zinc/32/49/53/606324953.db2.gz JYOSEFDKNFMVGW-UHFFFAOYSA-N -1 3 354.479 3.744 20 0 FHADHM O=C(CSc1cccc(-c2nn[n-]n2)c1)C12CC3CC(CC(C3)C1)C2 ZINC000823070691 606324955 /nfs/dbraw/zinc/32/49/55/606324955.db2.gz JYOSEFDKNFMVGW-UHFFFAOYSA-N -1 3 354.479 3.744 20 0 FHADHM C[C@@H](OC(=O)C/C=C/c1ccc(F)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820489071 606342139 /nfs/dbraw/zinc/34/21/39/606342139.db2.gz ZAMJNHQCEMTHNX-YWVDXFKGSA-N -1 3 352.369 3.714 20 0 FHADHM 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CCC1(CNC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)CC(C)C)CCC1 ZINC000820961756 606534046 /nfs/dbraw/zinc/53/40/46/606534046.db2.gz ACRDWNHNXOEQAB-UHFFFAOYSA-N -1 3 370.501 3.615 20 0 FHADHM CC[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000820938704 606538155 /nfs/dbraw/zinc/53/81/55/606538155.db2.gz MEPYFHPMBQOXIA-CVEARBPZSA-N -1 3 367.478 3.727 20 0 FHADHM CC[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000820938704 606538157 /nfs/dbraw/zinc/53/81/57/606538157.db2.gz MEPYFHPMBQOXIA-CVEARBPZSA-N -1 3 367.478 3.727 20 0 FHADHM O=C(c1cc(-c2nnn[n-]2)cs1)N1CCC[C@H]1c1ccccc1Cl ZINC000823472139 606539153 /nfs/dbraw/zinc/53/91/53/606539153.db2.gz BGKSGPKPKXZCID-ZDUSSCGKSA-N -1 3 359.842 3.559 20 0 FHADHM O=C(c1cc(-c2nn[n-]n2)cs1)N1CCC[C@H]1c1ccccc1Cl ZINC000823472139 606539154 /nfs/dbraw/zinc/53/91/54/606539154.db2.gz BGKSGPKPKXZCID-ZDUSSCGKSA-N -1 3 359.842 3.559 20 0 FHADHM CCC(=O)c1ccc(OCc2ccc(-c3nnn[n-]3)cc2OC(F)F)cc1 ZINC000820842129 606588522 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Cn1ccc2c1cccc2NCc1ccc(-c2nn[n-]n2)cc1OC(F)F ZINC000822690351 606597352 /nfs/dbraw/zinc/59/73/52/606597352.db2.gz WWORVXKBDGZQLQ-UHFFFAOYSA-N -1 3 370.363 3.572 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@@H](C)c1ccc2ccccc2c1 ZINC000821756340 606602901 /nfs/dbraw/zinc/60/29/01/606602901.db2.gz NRKWVIXCJQHHHT-ZDUSSCGKSA-N -1 3 373.416 3.771 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@@H](C)c1ccc2ccccc2c1 ZINC000821756340 606602902 /nfs/dbraw/zinc/60/29/02/606602902.db2.gz NRKWVIXCJQHHHT-ZDUSSCGKSA-N -1 3 373.416 3.771 20 0 FHADHM O=C(c1cccc(-c2nnn[n-]2)c1)N1CCCCC[C@H]1/C=C/c1ccccc1 ZINC000823487733 606626719 /nfs/dbraw/zinc/62/67/19/606626719.db2.gz GYHSNWBFAOBXOB-AIGDTVQASA-N -1 3 373.460 3.965 20 0 FHADHM O=C(c1cccc(-c2nn[n-]n2)c1)N1CCCCC[C@H]1/C=C/c1ccccc1 ZINC000823487733 606626721 /nfs/dbraw/zinc/62/67/21/606626721.db2.gz GYHSNWBFAOBXOB-AIGDTVQASA-N -1 3 373.460 3.965 20 0 FHADHM CCCC[C@@H](CCC)CNC(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000821041137 606632744 /nfs/dbraw/zinc/63/27/44/606632744.db2.gz ZQWCASBNXXFPSN-OAHLLOKOSA-N -1 3 358.490 3.615 20 0 FHADHM CCCC[C@@H](CCC)CNC(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000821041137 606632745 /nfs/dbraw/zinc/63/27/45/606632745.db2.gz ZQWCASBNXXFPSN-OAHLLOKOSA-N -1 3 358.490 3.615 20 0 FHADHM CC(C)c1cnc(CSCCCOc2ccc(-c3nn[n-]n3)cc2)o1 ZINC000820196826 606636824 /nfs/dbraw/zinc/63/68/24/606636824.db2.gz DHXVDDSKEQZQTR-UHFFFAOYSA-N -1 3 359.455 3.680 20 0 FHADHM Clc1cccc(-c2cnc(CNc3cccc(-c4nnn[n-]4)c3)o2)c1 ZINC000822581402 606659915 /nfs/dbraw/zinc/65/99/15/606659915.db2.gz HJVNKECEJHTROK-UHFFFAOYSA-N -1 3 352.785 3.787 20 0 FHADHM Clc1cccc(-c2cnc(CNc3cccc(-c4nn[n-]n4)c3)o2)c1 ZINC000822581402 606659916 /nfs/dbraw/zinc/65/99/16/606659916.db2.gz HJVNKECEJHTROK-UHFFFAOYSA-N -1 3 352.785 3.787 20 0 FHADHM CC[C@H](C)c1ccccc1OC(=O)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000820882524 606665204 /nfs/dbraw/zinc/66/52/04/606665204.db2.gz SKUUODNRKVXYKT-JTQLQIEISA-N -1 3 358.348 3.878 20 0 FHADHM CC[C@H](C)c1ccccc1OC(=O)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000820882524 606665205 /nfs/dbraw/zinc/66/52/05/606665205.db2.gz SKUUODNRKVXYKT-JTQLQIEISA-N -1 3 358.348 3.878 20 0 FHADHM C[C@@H](OC1CCCCCC1)C(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820518679 606735518 /nfs/dbraw/zinc/73/55/18/606735518.db2.gz IWYYBXZFFTWULE-ZIAGYGMSSA-N -1 3 358.442 3.599 20 0 FHADHM C[C@@H](OC1CCCCCC1)C(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820518679 606735520 /nfs/dbraw/zinc/73/55/20/606735520.db2.gz IWYYBXZFFTWULE-ZIAGYGMSSA-N -1 3 358.442 3.599 20 0 FHADHM C[C@H](OC(=O)CCCc1ccc(F)c(F)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820496687 606747151 /nfs/dbraw/zinc/74/71/51/606747151.db2.gz NYWRXNUJGTUTIM-LBPRGKRZSA-N -1 3 372.375 3.772 20 0 FHADHM C[C@H](OC(=O)CCCc1ccc(F)c(F)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820496687 606747153 /nfs/dbraw/zinc/74/71/53/606747153.db2.gz NYWRXNUJGTUTIM-LBPRGKRZSA-N -1 3 372.375 3.772 20 0 FHADHM O=C(O[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000823391824 606748319 /nfs/dbraw/zinc/74/83/19/606748319.db2.gz GPDBPQZETNJKBH-DMDPSCGWSA-N -1 3 362.380 3.661 20 0 FHADHM O=C(O[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000823391824 606748320 /nfs/dbraw/zinc/74/83/20/606748320.db2.gz GPDBPQZETNJKBH-DMDPSCGWSA-N -1 3 362.380 3.661 20 0 FHADHM C[C@@H](OC(=O)[C@H](C)OC1CCCCCC1)c1cccc(-c2nnn[n-]2)c1 ZINC000820519232 606759599 /nfs/dbraw/zinc/75/95/99/606759599.db2.gz QTKAGTPUKNDVOT-KGLIPLIRSA-N -1 3 358.442 3.599 20 0 FHADHM C[C@@H](OC(=O)[C@H](C)OC1CCCCCC1)c1cccc(-c2nn[n-]n2)c1 ZINC000820519232 606759600 /nfs/dbraw/zinc/75/96/00/606759600.db2.gz QTKAGTPUKNDVOT-KGLIPLIRSA-N -1 3 358.442 3.599 20 0 FHADHM Fc1ccc(-c2cnc(COc3cc(Cl)ccc3-c3nnn[n-]3)o2)cc1 ZINC000822753058 606781647 /nfs/dbraw/zinc/78/16/47/606781647.db2.gz AZSLKILWIRYAEJ-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM Fc1ccc(-c2cnc(COc3cc(Cl)ccc3-c3nn[n-]n3)o2)cc1 ZINC000822753058 606781649 /nfs/dbraw/zinc/78/16/49/606781649.db2.gz AZSLKILWIRYAEJ-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM CCO[C@H](C)c1nc(COc2cc(Cl)ccc2-c2nnn[n-]2)cs1 ZINC000821345918 606782127 /nfs/dbraw/zinc/78/21/27/606782127.db2.gz AAUODHJRTWQZIM-SECBINFHSA-N -1 3 365.846 3.653 20 0 FHADHM CCO[C@H](C)c1nc(COc2cc(Cl)ccc2-c2nn[n-]n2)cs1 ZINC000821345918 606782131 /nfs/dbraw/zinc/78/21/31/606782131.db2.gz AAUODHJRTWQZIM-SECBINFHSA-N -1 3 365.846 3.653 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(OCc2cc(-c3ccccc3)no2)c1 ZINC000822568466 606782984 /nfs/dbraw/zinc/78/29/84/606782984.db2.gz ROFGZRIQUQRSHH-UHFFFAOYSA-N -1 3 353.769 3.754 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(OCc2cc(-c3ccccc3)no2)c1 ZINC000822568466 606782987 /nfs/dbraw/zinc/78/29/87/606782987.db2.gz ROFGZRIQUQRSHH-UHFFFAOYSA-N -1 3 353.769 3.754 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(OCc2csc(-c3ccccn3)n2)c1 ZINC000822573801 606785793 /nfs/dbraw/zinc/78/57/93/606785793.db2.gz JAZVSZTWVMUKDU-UHFFFAOYSA-N -1 3 370.825 3.618 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(OCc2csc(-c3ccccn3)n2)c1 ZINC000822573801 606785794 /nfs/dbraw/zinc/78/57/94/606785794.db2.gz JAZVSZTWVMUKDU-UHFFFAOYSA-N -1 3 370.825 3.618 20 0 FHADHM CCCN(CC)C(=O)c1ccc(Oc2ccc(-c3nnn[n-]3)cc2C)cc1 ZINC000821094493 606785848 /nfs/dbraw/zinc/78/58/48/606785848.db2.gz KSPSVBQPCLBPMG-UHFFFAOYSA-N -1 3 365.437 3.840 20 0 FHADHM CCCN(CC)C(=O)c1ccc(Oc2ccc(-c3nn[n-]n3)cc2C)cc1 ZINC000821094493 606785849 /nfs/dbraw/zinc/78/58/49/606785849.db2.gz KSPSVBQPCLBPMG-UHFFFAOYSA-N -1 3 365.437 3.840 20 0 FHADHM CC(C)CN(C(=O)c1cccc(C(C)C)n1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820081654 606800704 /nfs/dbraw/zinc/80/07/04/606800704.db2.gz PMILXQQGKWVQGF-UHFFFAOYSA-N -1 3 364.453 3.688 20 0 FHADHM CC(C)CN(C(=O)c1cccc(C(C)C)n1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820081654 606800705 /nfs/dbraw/zinc/80/07/05/606800705.db2.gz PMILXQQGKWVQGF-UHFFFAOYSA-N -1 3 364.453 3.688 20 0 FHADHM CC(C)=C(C)C(=O)Nc1sc2c(c1-c1nnn[n-]1)-c1ccccc1CC2 ZINC000820004741 606847415 /nfs/dbraw/zinc/84/74/15/606847415.db2.gz ADVOTCUGTFOQCC-UHFFFAOYSA-N -1 3 365.462 3.989 20 0 FHADHM CC(C)=C(C)C(=O)Nc1sc2c(c1-c1nn[n-]n1)-c1ccccc1CC2 ZINC000820004741 606847416 /nfs/dbraw/zinc/84/74/16/606847416.db2.gz ADVOTCUGTFOQCC-UHFFFAOYSA-N -1 3 365.462 3.989 20 0 FHADHM O=C(c1cccc(-c2nnn[n-]2)c1)N(c1ccc(F)cc1)C1CCCC1 ZINC000823488551 606856425 /nfs/dbraw/zinc/85/64/25/606856425.db2.gz PJHCNVRABCHAEO-UHFFFAOYSA-N -1 3 351.385 3.595 20 0 FHADHM O=C(c1cccc(-c2nn[n-]n2)c1)N(c1ccc(F)cc1)C1CCCC1 ZINC000823488551 606856426 /nfs/dbraw/zinc/85/64/26/606856426.db2.gz PJHCNVRABCHAEO-UHFFFAOYSA-N -1 3 351.385 3.595 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1cc(F)c(C)cc1F ZINC000821104993 606861147 /nfs/dbraw/zinc/86/11/47/606861147.db2.gz UROWDDUGMWRTIG-UHFFFAOYSA-N -1 3 371.391 3.506 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1cc(F)c(C)cc1F ZINC000821104993 606861149 /nfs/dbraw/zinc/86/11/49/606861149.db2.gz UROWDDUGMWRTIG-UHFFFAOYSA-N -1 3 371.391 3.506 20 0 FHADHM Cl/C=C(/Cl)CNc1ccccc1Oc1ncccc1-c1nnn[n-]1 ZINC000822563705 606864495 /nfs/dbraw/zinc/86/44/95/606864495.db2.gz MDQAETHJXOPXGU-CSKARUKUSA-N -1 3 363.208 3.785 20 0 FHADHM Cc1ccc(CNCc2ccc(-c3nnn[n-]3)o2)c(OCCCC(C)C)c1 ZINC000822238752 606868729 /nfs/dbraw/zinc/86/87/29/606868729.db2.gz SNMKBNMAUHQJAK-UHFFFAOYSA-N -1 3 369.469 3.873 20 0 FHADHM Cc1ccc(CNCc2ccc(-c3nn[n-]n3)o2)c(OCCCC(C)C)c1 ZINC000822238752 606868730 /nfs/dbraw/zinc/86/87/30/606868730.db2.gz SNMKBNMAUHQJAK-UHFFFAOYSA-N -1 3 369.469 3.873 20 0 FHADHM C[C@H]1CC[C@H](C)N1C(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000820686575 606914044 /nfs/dbraw/zinc/91/40/44/606914044.db2.gz YKMYIWZSDXLFJW-KBPBESRZSA-N -1 3 362.437 3.623 20 0 FHADHM C[C@@H]1CC[C@@H](C)N1C(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000820686577 606914131 /nfs/dbraw/zinc/91/41/31/606914131.db2.gz YKMYIWZSDXLFJW-ZIAGYGMSSA-N -1 3 362.437 3.623 20 0 FHADHM Cc1ccc(-c2nnc([C@H](C)Oc3ccc(-c4nn[n-]n4)cc3)o2)cc1C ZINC000822213867 606925037 /nfs/dbraw/zinc/92/50/37/606925037.db2.gz DVHCZROOWOXCQZ-ZDUSSCGKSA-N -1 3 362.393 3.674 20 0 FHADHM Fc1ccc(CNc2ccc(Br)cc2F)cc1-c1nnn[n-]1 ZINC000822748152 606926234 /nfs/dbraw/zinc/92/62/34/606926234.db2.gz KIFAPJGXPMTSCS-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1ccc(CNc2ccc(Br)cc2F)cc1-c1nn[n-]n1 ZINC000822748152 606926235 /nfs/dbraw/zinc/92/62/35/606926235.db2.gz KIFAPJGXPMTSCS-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM COc1ccc(NCc2ccc(F)c(-c3nnn[n-]3)c2)c(C(F)(F)F)c1 ZINC000821835353 606927519 /nfs/dbraw/zinc/92/75/19/606927519.db2.gz IIMJAAAEJSPMCN-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM COc1ccc(NCc2ccc(F)c(-c3nn[n-]n3)c2)c(C(F)(F)F)c1 ZINC000821835353 606927520 /nfs/dbraw/zinc/92/75/20/606927520.db2.gz IIMJAAAEJSPMCN-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM Cc1c(Br)cccc1NCc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000822015312 606929536 /nfs/dbraw/zinc/92/95/36/606929536.db2.gz HVBRJGYHVCJLKB-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Cc1c(Br)cccc1NCc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000822015312 606929537 /nfs/dbraw/zinc/92/95/37/606929537.db2.gz HVBRJGYHVCJLKB-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Fc1ccc(CNc2ccc(Br)c(F)c2)cc1-c1nnn[n-]1 ZINC000822753950 606931759 /nfs/dbraw/zinc/93/17/59/606931759.db2.gz SWPZSDCXXZCZDQ-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1ccc(CNc2ccc(Br)c(F)c2)cc1-c1nn[n-]n1 ZINC000822753950 606931760 /nfs/dbraw/zinc/93/17/60/606931760.db2.gz SWPZSDCXXZCZDQ-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM CN(C(=O)[C@@H]1C[C@@H]1C1CCCCC1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821569528 606958727 /nfs/dbraw/zinc/95/87/27/606958727.db2.gz NDXKLGINPXKTDB-HUUCEWRRSA-N -1 3 359.861 3.699 20 0 FHADHM CN(C(=O)[C@@H]1C[C@@H]1C1CCCCC1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821569528 606958728 /nfs/dbraw/zinc/95/87/28/606958728.db2.gz NDXKLGINPXKTDB-HUUCEWRRSA-N -1 3 359.861 3.699 20 0 FHADHM Cc1ccc(NC(=O)C(C)(C)Oc2ccc(-c3nnn[n-]3)cc2)c(Cl)c1 ZINC000822242765 606978023 /nfs/dbraw/zinc/97/80/23/606978023.db2.gz XCZZHUZJPICUHN-UHFFFAOYSA-N -1 3 371.828 3.625 20 0 FHADHM Cc1ccc(NC(=O)C(C)(C)Oc2ccc(-c3nn[n-]n3)cc2)c(Cl)c1 ZINC000822242765 606978025 /nfs/dbraw/zinc/97/80/25/606978025.db2.gz XCZZHUZJPICUHN-UHFFFAOYSA-N -1 3 371.828 3.625 20 0 FHADHM Cc1cc(Cl)ccc1C(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000822202373 606992519 /nfs/dbraw/zinc/99/25/19/606992519.db2.gz XEQFSTGFPUSSCG-UHFFFAOYSA-N -1 3 367.840 3.633 20 0 FHADHM Cc1cc(Cl)ccc1C(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000822202373 606992521 /nfs/dbraw/zinc/99/25/21/606992521.db2.gz XEQFSTGFPUSSCG-UHFFFAOYSA-N -1 3 367.840 3.633 20 0 FHADHM Cc1ccccc1[C@H](C)CC(=O)OCc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000822345478 607000071 /nfs/dbraw/zinc/00/00/71/607000071.db2.gz JTYQLTCPBNFEJK-CYBMUJFWSA-N -1 3 354.385 3.551 20 0 FHADHM Cc1ccccc1[C@H](C)CC(=O)OCc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000822345478 607000073 /nfs/dbraw/zinc/00/00/73/607000073.db2.gz JTYQLTCPBNFEJK-CYBMUJFWSA-N -1 3 354.385 3.551 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)Nc1cc(F)cc(F)c1 ZINC000821104769 607009321 /nfs/dbraw/zinc/00/93/21/607009321.db2.gz PULJSOPNJUUMPT-UHFFFAOYSA-N -1 3 372.379 3.589 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)Nc1cc(F)cc(F)c1 ZINC000821104769 607009323 /nfs/dbraw/zinc/00/93/23/607009323.db2.gz PULJSOPNJUUMPT-UHFFFAOYSA-N -1 3 372.379 3.589 20 0 FHADHM Fc1cccc(-c2cnc(CSc3cccc(-c4nnn[n-]4)c3)o2)c1 ZINC000822786967 607015675 /nfs/dbraw/zinc/01/56/75/607015675.db2.gz QWVRNYCFCFXEFC-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM Fc1cccc(-c2cnc(CSc3cccc(-c4nn[n-]n4)c3)o2)c1 ZINC000822786967 607015677 /nfs/dbraw/zinc/01/56/77/607015677.db2.gz QWVRNYCFCFXEFC-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM COC(=O)c1cc2cc(CSc3cccc(-c4nnn[n-]4)c3)ccc2o1 ZINC000821668832 607016730 /nfs/dbraw/zinc/01/67/30/607016730.db2.gz LADHJCPLVSSGLY-UHFFFAOYSA-N -1 3 366.402 3.692 20 0 FHADHM COC(=O)c1cc2cc(CSc3cccc(-c4nn[n-]n4)c3)ccc2o1 ZINC000821668832 607016731 /nfs/dbraw/zinc/01/67/31/607016731.db2.gz LADHJCPLVSSGLY-UHFFFAOYSA-N -1 3 366.402 3.692 20 0 FHADHM Cc1cc(C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)ccc1Cl ZINC000822167369 607023669 /nfs/dbraw/zinc/02/36/69/607023669.db2.gz DDMWHGZUXVGRGH-UHFFFAOYSA-N -1 3 367.840 3.633 20 0 FHADHM Cc1cc(C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)ccc1Cl ZINC000822167369 607023671 /nfs/dbraw/zinc/02/36/71/607023671.db2.gz DDMWHGZUXVGRGH-UHFFFAOYSA-N -1 3 367.840 3.633 20 0 FHADHM CCC(=CC(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)nc1)CC ZINC000820831905 607025228 /nfs/dbraw/zinc/02/52/28/607025228.db2.gz DZRMALMEQRPCCV-UHFFFAOYSA-N -1 3 364.409 3.739 20 0 FHADHM CCC(=CC(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)nc1)CC ZINC000820831905 607025229 /nfs/dbraw/zinc/02/52/29/607025229.db2.gz DZRMALMEQRPCCV-UHFFFAOYSA-N -1 3 364.409 3.739 20 0 FHADHM CCCCc1noc([C@H](C)SCc2cc(F)ccc2-c2nnn[n-]2)n1 ZINC000821082195 607034252 /nfs/dbraw/zinc/03/42/52/607034252.db2.gz IGLHPXIKXLNYGO-JTQLQIEISA-N -1 3 362.434 3.726 20 0 FHADHM CCCCc1noc([C@H](C)SCc2cc(F)ccc2-c2nn[n-]n2)n1 ZINC000821082195 607034254 /nfs/dbraw/zinc/03/42/54/607034254.db2.gz IGLHPXIKXLNYGO-JTQLQIEISA-N -1 3 362.434 3.726 20 0 FHADHM C[C@@H](c1nc2ccccc2s1)N(C)Cc1cc(F)ccc1-c1nn[n-]n1 ZINC000820570584 607056116 /nfs/dbraw/zinc/05/61/16/607056116.db2.gz NEWNFUCRMUUWRA-NSHDSACASA-N -1 3 368.441 3.809 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NC(=O)CCc1ccc(Cl)cc1 ZINC000821304763 607101046 /nfs/dbraw/zinc/10/10/46/607101046.db2.gz QICATBTVPNESLZ-UHFFFAOYSA-N -1 3 370.844 3.523 20 0 FHADHM O=C(Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)[C@H]1CC12CCC2 ZINC000823367201 607126006 /nfs/dbraw/zinc/12/60/06/607126006.db2.gz GAUNNEVKIMPVKX-QGZVFWFLSA-N -1 3 361.405 3.788 20 0 FHADHM O=C(Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)[C@H]1CC12CCC2 ZINC000823367201 607126008 /nfs/dbraw/zinc/12/60/08/607126008.db2.gz GAUNNEVKIMPVKX-QGZVFWFLSA-N -1 3 361.405 3.788 20 0 FHADHM C[C@H](OC(=O)/C=C\SCc1ccco1)c1cccc(-c2nnn[n-]2)c1 ZINC000820489092 607130364 /nfs/dbraw/zinc/13/03/64/607130364.db2.gz ZELIJTBEJHMNKG-UPZNUWHASA-N -1 3 356.407 3.511 20 0 FHADHM C[C@H](OC(=O)/C=C\SCc1ccco1)c1cccc(-c2nn[n-]n2)c1 ZINC000820489092 607130365 /nfs/dbraw/zinc/13/03/65/607130365.db2.gz ZELIJTBEJHMNKG-UPZNUWHASA-N -1 3 356.407 3.511 20 0 FHADHM O=C(NC1(c2c(Cl)cccc2Cl)CC1)c1cccc(-c2nnn[n-]2)c1 ZINC000823139277 607133795 /nfs/dbraw/zinc/13/37/95/607133795.db2.gz BMBMXVQXPYWZTL-UHFFFAOYSA-N -1 3 374.231 3.593 20 0 FHADHM O=C(NC1(c2c(Cl)cccc2Cl)CC1)c1cccc(-c2nn[n-]n2)c1 ZINC000823139277 607133797 /nfs/dbraw/zinc/13/37/97/607133797.db2.gz BMBMXVQXPYWZTL-UHFFFAOYSA-N -1 3 374.231 3.593 20 0 FHADHM CC(C)c1ccccc1NC(=O)[C@H](C)Oc1ccc(-c2nnn[n-]2)cc1F ZINC000820536453 607134114 /nfs/dbraw/zinc/13/41/14/607134114.db2.gz UAVIEPBBDBSJOW-LBPRGKRZSA-N -1 3 369.400 3.535 20 0 FHADHM CC(C)c1ccccc1NC(=O)[C@H](C)Oc1ccc(-c2nn[n-]n2)cc1F ZINC000820536453 607134116 /nfs/dbraw/zinc/13/41/16/607134116.db2.gz UAVIEPBBDBSJOW-LBPRGKRZSA-N -1 3 369.400 3.535 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1OCc1coc(-c2cccc(Cl)c2)n1 ZINC000822748362 607138443 /nfs/dbraw/zinc/13/84/43/607138443.db2.gz VWERTYZGUYJLSZ-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1OCc1coc(-c2cccc(Cl)c2)n1 ZINC000822748362 607138445 /nfs/dbraw/zinc/13/84/45/607138445.db2.gz VWERTYZGUYJLSZ-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1OCc1ccc(OCC(F)(F)F)cc1 ZINC000822748354 607138631 /nfs/dbraw/zinc/13/86/31/607138631.db2.gz VPXMQXSAVUXQAZ-UHFFFAOYSA-N -1 3 368.290 3.526 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1OCc1ccc(OCC(F)(F)F)cc1 ZINC000822748354 607138632 /nfs/dbraw/zinc/13/86/32/607138632.db2.gz VPXMQXSAVUXQAZ-UHFFFAOYSA-N -1 3 368.290 3.526 20 0 FHADHM CC(C)CC[C@@H]1CCCN1C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000820073359 607140610 /nfs/dbraw/zinc/14/06/10/607140610.db2.gz SSGYGWCFYNMYBD-HNNXBMFYSA-N -1 3 373.505 3.856 20 0 FHADHM CC(C)CC[C@@H]1CCCN1C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000820073359 607140612 /nfs/dbraw/zinc/14/06/12/607140612.db2.gz SSGYGWCFYNMYBD-HNNXBMFYSA-N -1 3 373.505 3.856 20 0 FHADHM CCC[C@H](C)[C@@H]1CCCN1C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000821016409 607140842 /nfs/dbraw/zinc/14/08/42/607140842.db2.gz WFAXCVYFNKHEKV-ZFWWWQNUSA-N -1 3 373.505 3.856 20 0 FHADHM CCC[C@H](C)[C@@H]1CCCN1C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000821016409 607140844 /nfs/dbraw/zinc/14/08/44/607140844.db2.gz WFAXCVYFNKHEKV-ZFWWWQNUSA-N -1 3 373.505 3.856 20 0 FHADHM O=C(NCc1ccc(-c2nnn[n-]2)cc1)N1CCC[C@@H]1CCC1CCCC1 ZINC000823246644 607154067 /nfs/dbraw/zinc/15/40/67/607154067.db2.gz YOWNJXHAPXPRMO-GOSISDBHSA-N -1 3 368.485 3.511 20 0 FHADHM O=C(NCc1ccc(-c2nn[n-]n2)cc1)N1CCC[C@@H]1CCC1CCCC1 ZINC000823246644 607154068 /nfs/dbraw/zinc/15/40/68/607154068.db2.gz YOWNJXHAPXPRMO-GOSISDBHSA-N -1 3 368.485 3.511 20 0 FHADHM O=C(NCc1ccc(-c2nnn[n-]2)cc1)N1CCC[C@H]1CCC1CCCC1 ZINC000823246645 607154084 /nfs/dbraw/zinc/15/40/84/607154084.db2.gz YOWNJXHAPXPRMO-SFHVURJKSA-N -1 3 368.485 3.511 20 0 FHADHM O=C(NCc1ccc(-c2nn[n-]n2)cc1)N1CCC[C@H]1CCC1CCCC1 ZINC000823246645 607154085 /nfs/dbraw/zinc/15/40/85/607154085.db2.gz YOWNJXHAPXPRMO-SFHVURJKSA-N -1 3 368.485 3.511 20 0 FHADHM Cc1cc(-c2nn[n-]n2)cc(C)c1OCc1ncc(-c2cccs2)o1 ZINC000822136270 607158499 /nfs/dbraw/zinc/15/84/99/607158499.db2.gz KDIGOBMLSQKHPG-UHFFFAOYSA-N -1 3 353.407 3.779 20 0 FHADHM CCCCC[C@@H]1CCCN1C(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000821049982 607165205 /nfs/dbraw/zinc/16/52/05/607165205.db2.gz OROAKVIBUUYAIK-QGZVFWFLSA-N -1 3 373.526 3.671 20 0 FHADHM CCCCC[C@@H]1CCCN1C(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000821049982 607165206 /nfs/dbraw/zinc/16/52/06/607165206.db2.gz OROAKVIBUUYAIK-QGZVFWFLSA-N -1 3 373.526 3.671 20 0 FHADHM Cc1nc([C@@H](C)Nc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)cs1 ZINC000822427106 607173968 /nfs/dbraw/zinc/17/39/68/607173968.db2.gz CQZYCDGWGCDBBN-SSDOTTSWSA-N -1 3 354.361 3.824 20 0 FHADHM Cc1nc([C@@H](C)Nc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)cs1 ZINC000822427106 607173969 /nfs/dbraw/zinc/17/39/69/607173969.db2.gz CQZYCDGWGCDBBN-SSDOTTSWSA-N -1 3 354.361 3.824 20 0 FHADHM O=C(C=Cc1ccc(Cl)cc1)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822928283 607189162 /nfs/dbraw/zinc/18/91/62/607189162.db2.gz GEFRLJNMHWKLLK-FPYGCLRLSA-N -1 3 360.204 3.825 20 0 FHADHM O=C(C=Cc1ccc(Cl)cc1)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822928283 607189163 /nfs/dbraw/zinc/18/91/63/607189163.db2.gz GEFRLJNMHWKLLK-FPYGCLRLSA-N -1 3 360.204 3.825 20 0 FHADHM O=C(C=Cc1ccc(Cl)cc1)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822928282 607189192 /nfs/dbraw/zinc/18/91/92/607189192.db2.gz GEFRLJNMHWKLLK-BAQGIRSFSA-N -1 3 360.204 3.825 20 0 FHADHM O=C(C=Cc1ccc(Cl)cc1)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822928282 607189193 /nfs/dbraw/zinc/18/91/93/607189193.db2.gz GEFRLJNMHWKLLK-BAQGIRSFSA-N -1 3 360.204 3.825 20 0 FHADHM Cc1cccc([C@H](C)CNC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)c1 ZINC000822288749 607196721 /nfs/dbraw/zinc/19/67/21/607196721.db2.gz IJDPYRNMTSDKAL-GFCCVEGCSA-N -1 3 370.844 3.754 20 0 FHADHM Cc1cccc([C@H](C)CNC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)c1 ZINC000822288749 607196722 /nfs/dbraw/zinc/19/67/22/607196722.db2.gz IJDPYRNMTSDKAL-GFCCVEGCSA-N -1 3 370.844 3.754 20 0 FHADHM Cc1ccc([C@@H](C)NC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)s1 ZINC000822229557 607199316 /nfs/dbraw/zinc/19/93/16/607199316.db2.gz XELUHRREHJOQON-SECBINFHSA-N -1 3 362.846 3.773 20 0 FHADHM Cc1ccc([C@@H](C)NC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)s1 ZINC000822229557 607199317 /nfs/dbraw/zinc/19/93/17/607199317.db2.gz XELUHRREHJOQON-SECBINFHSA-N -1 3 362.846 3.773 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)c(N[C@@H](C)c2ccccc2Br)n1 ZINC000822215074 607226619 /nfs/dbraw/zinc/22/66/19/607226619.db2.gz KUXJNXVCRZQOOV-JTQLQIEISA-N -1 3 359.231 3.506 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)c(N[C@@H](C)c2ccccc2Br)n1 ZINC000822215074 607226620 /nfs/dbraw/zinc/22/66/20/607226620.db2.gz KUXJNXVCRZQOOV-JTQLQIEISA-N -1 3 359.231 3.506 20 0 FHADHM CCc1cc(C)c(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CC[C@H](C)C3)o1 ZINC000821470705 607235580 /nfs/dbraw/zinc/23/55/80/607235580.db2.gz SGJXJNAJFLPVII-VIFPVBQESA-N -1 3 371.466 3.769 20 0 FHADHM CCc1cc(C)c(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CC[C@H](C)C3)o1 ZINC000821470705 607235581 /nfs/dbraw/zinc/23/55/81/607235581.db2.gz SGJXJNAJFLPVII-VIFPVBQESA-N -1 3 371.466 3.769 20 0 FHADHM Cc1cc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CC[C@@H](C)C3)oc1C ZINC000822184635 607235779 /nfs/dbraw/zinc/23/57/79/607235779.db2.gz YLDZIDOGBFTEGB-MRVPVSSYSA-N -1 3 357.439 3.515 20 0 FHADHM Cc1cc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CC[C@@H](C)C3)oc1C ZINC000822184635 607235780 /nfs/dbraw/zinc/23/57/80/607235780.db2.gz YLDZIDOGBFTEGB-MRVPVSSYSA-N -1 3 357.439 3.515 20 0 FHADHM Cc1cc(C(=O)N(Cc2ccco2)c2ccccc2-c2nnn[n-]2)oc1C ZINC000822169157 607237541 /nfs/dbraw/zinc/23/75/41/607237541.db2.gz YTOIENJEMJNWPN-UHFFFAOYSA-N -1 3 363.377 3.517 20 0 FHADHM Cc1cc(C(=O)N(Cc2ccco2)c2ccccc2-c2nn[n-]n2)oc1C ZINC000822169157 607237542 /nfs/dbraw/zinc/23/75/42/607237542.db2.gz YTOIENJEMJNWPN-UHFFFAOYSA-N -1 3 363.377 3.517 20 0 FHADHM Cc1ccc(C(C)(C)C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000822227601 607240917 /nfs/dbraw/zinc/24/09/17/607240917.db2.gz OUJJUZLWMPZIFI-UHFFFAOYSA-N -1 3 355.829 3.745 20 0 FHADHM Cc1ccc(C(C)(C)C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000822227601 607240918 /nfs/dbraw/zinc/24/09/18/607240918.db2.gz OUJJUZLWMPZIFI-UHFFFAOYSA-N -1 3 355.829 3.745 20 0 FHADHM Cc1c2cc(F)ccc2oc1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822021085 607242480 /nfs/dbraw/zinc/24/24/80/607242480.db2.gz UVSBWNBYJRTCQF-UHFFFAOYSA-N -1 3 371.759 3.966 20 0 FHADHM Cc1c2cc(F)ccc2oc1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822021085 607242481 /nfs/dbraw/zinc/24/24/81/607242481.db2.gz UVSBWNBYJRTCQF-UHFFFAOYSA-N -1 3 371.759 3.966 20 0 FHADHM CC(C)[C@H](C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccccc1 ZINC000820017298 607243239 /nfs/dbraw/zinc/24/32/39/607243239.db2.gz UZRVKPTZLJMFRV-INIZCTEOSA-N -1 3 355.829 3.898 20 0 FHADHM CC(C)[C@H](C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccccc1 ZINC000820017298 607243240 /nfs/dbraw/zinc/24/32/40/607243240.db2.gz UZRVKPTZLJMFRV-INIZCTEOSA-N -1 3 355.829 3.898 20 0 FHADHM CCc1ccc([C@@H](C)C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000821476094 607243486 /nfs/dbraw/zinc/24/34/86/607243486.db2.gz HBFMHDVOPHNEBT-LLVKDONJSA-N -1 3 355.829 3.825 20 0 FHADHM CCc1ccc([C@@H](C)C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000821476094 607243487 /nfs/dbraw/zinc/24/34/87/607243487.db2.gz HBFMHDVOPHNEBT-LLVKDONJSA-N -1 3 355.829 3.825 20 0 FHADHM CCc1ccc([C@H](C)C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000821476095 607243513 /nfs/dbraw/zinc/24/35/13/607243513.db2.gz HBFMHDVOPHNEBT-NSHDSACASA-N -1 3 355.829 3.825 20 0 FHADHM CCc1ccc([C@H](C)C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000821476095 607243514 /nfs/dbraw/zinc/24/35/14/607243514.db2.gz HBFMHDVOPHNEBT-NSHDSACASA-N -1 3 355.829 3.825 20 0 FHADHM CC[C@@H](OC1CCCCC1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820937628 607243581 /nfs/dbraw/zinc/24/35/81/607243581.db2.gz ANLRTICGNKJOIK-OAHLLOKOSA-N -1 3 363.849 3.587 20 0 FHADHM CC[C@@H](OC1CCCCC1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820937628 607243582 /nfs/dbraw/zinc/24/35/82/607243582.db2.gz ANLRTICGNKJOIK-OAHLLOKOSA-N -1 3 363.849 3.587 20 0 FHADHM CC[C@@H](C)c1ccccc1OCC(=O)Oc1ccc(-c2nnn[n-]2)cc1F ZINC000820881800 607250552 /nfs/dbraw/zinc/25/05/52/607250552.db2.gz DBGSMYILWLGELH-GFCCVEGCSA-N -1 3 370.384 3.504 20 0 FHADHM CC[C@@H](C)c1ccccc1OCC(=O)Oc1ccc(-c2nn[n-]n2)cc1F ZINC000820881800 607250553 /nfs/dbraw/zinc/25/05/53/607250553.db2.gz DBGSMYILWLGELH-GFCCVEGCSA-N -1 3 370.384 3.504 20 0 FHADHM CC[C@@H](CC(=O)Oc1ccc(-c2nnn[n-]2)cc1F)c1ccc(OC)cc1 ZINC000825081122 607791522 /nfs/dbraw/zinc/79/15/22/607791522.db2.gz GMRFKSJJQMKRKL-LBPRGKRZSA-N -1 3 370.384 3.504 20 0 FHADHM CC[C@@H](CC(=O)Oc1ccc(-c2nn[n-]n2)cc1F)c1ccc(OC)cc1 ZINC000825081122 607791523 /nfs/dbraw/zinc/79/15/23/607791523.db2.gz GMRFKSJJQMKRKL-LBPRGKRZSA-N -1 3 370.384 3.504 20 0 FHADHM CCN(C(=O)C[C@H](C)c1ccc(F)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825366664 607799917 /nfs/dbraw/zinc/79/99/17/607799917.db2.gz DELLATIZJYZMGI-ZDUSSCGKSA-N -1 3 353.401 3.553 20 0 FHADHM CCN(C(=O)C[C@H](C)c1ccc(F)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825366664 607799918 /nfs/dbraw/zinc/79/99/18/607799918.db2.gz DELLATIZJYZMGI-ZDUSSCGKSA-N -1 3 353.401 3.553 20 0 FHADHM CCc1c(C)sc(NC(=O)C[C@@H](C)c2c(C)noc2C)c1-c1nnn[n-]1 ZINC000825688036 607826969 /nfs/dbraw/zinc/82/69/69/607826969.db2.gz QHWSBCBOECKKDG-MRVPVSSYSA-N -1 3 374.470 3.536 20 0 FHADHM CCc1c(C)sc(NC(=O)C[C@@H](C)c2c(C)noc2C)c1-c1nn[n-]n1 ZINC000825688036 607826970 /nfs/dbraw/zinc/82/69/70/607826970.db2.gz QHWSBCBOECKKDG-MRVPVSSYSA-N -1 3 374.470 3.536 20 0 FHADHM COc1cccc(F)c1[C@@H](C)Nc1ccc2cc(-c3nnn[n-]3)ccc2n1 ZINC000826216472 607842080 /nfs/dbraw/zinc/84/20/80/607842080.db2.gz AENFJQMVUPXEHL-LLVKDONJSA-N -1 3 364.384 3.736 20 0 FHADHM COc1cccc(F)c1[C@@H](C)Nc1ccc2cc(-c3nn[n-]n3)ccc2n1 ZINC000826216472 607842081 /nfs/dbraw/zinc/84/20/81/607842081.db2.gz AENFJQMVUPXEHL-LLVKDONJSA-N -1 3 364.384 3.736 20 0 FHADHM Cc1c(C(=O)N(C)c2ccc(-c3nnn[n-]3)cc2)cccc1-c1ccccn1 ZINC000826234260 607861398 /nfs/dbraw/zinc/86/13/98/607861398.db2.gz OGPKOOJIHCHUJB-UHFFFAOYSA-N -1 3 370.416 3.514 20 0 FHADHM Cc1c(C(=O)N(C)c2ccc(-c3nn[n-]n3)cc2)cccc1-c1ccccn1 ZINC000826234260 607861399 /nfs/dbraw/zinc/86/13/99/607861399.db2.gz OGPKOOJIHCHUJB-UHFFFAOYSA-N -1 3 370.416 3.514 20 0 FHADHM CCN(C(=O)CCc1ccsc1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825372263 607878706 /nfs/dbraw/zinc/87/87/06/607878706.db2.gz UQHDNUUEVMOKLQ-UHFFFAOYSA-N -1 3 361.858 3.567 20 0 FHADHM CCN(C(=O)CCc1ccsc1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825372263 607878707 /nfs/dbraw/zinc/87/87/07/607878707.db2.gz UQHDNUUEVMOKLQ-UHFFFAOYSA-N -1 3 361.858 3.567 20 0 FHADHM CS[C@@H](C)CC(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)cc1 ZINC000826224507 607934372 /nfs/dbraw/zinc/93/43/72/607934372.db2.gz GSAYWULNXKYOQH-LBPRGKRZSA-N -1 3 369.450 3.739 20 0 FHADHM CS[C@@H](C)CC(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)cc1 ZINC000826224507 607934373 /nfs/dbraw/zinc/93/43/73/607934373.db2.gz GSAYWULNXKYOQH-LBPRGKRZSA-N -1 3 369.450 3.739 20 0 FHADHM CS[C@@H](C)CC(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000826224691 607938111 /nfs/dbraw/zinc/93/81/11/607938111.db2.gz KCMMITGNNUOXKK-LBPRGKRZSA-N -1 3 369.450 3.739 20 0 FHADHM CS[C@@H](C)CC(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000826224691 607938112 /nfs/dbraw/zinc/93/81/12/607938112.db2.gz KCMMITGNNUOXKK-LBPRGKRZSA-N -1 3 369.450 3.739 20 0 FHADHM C[C@@H](C(=O)N1CCc2ccc(-c3nnn[n-]3)cc21)c1ccc2ccccc2c1 ZINC000824039281 607949794 /nfs/dbraw/zinc/94/97/94/607949794.db2.gz DAGOZXANQNFEBI-CQSZACIVSA-N -1 3 369.428 3.713 20 0 FHADHM C[C@@H](C(=O)N1CCc2ccc(-c3nn[n-]n3)cc21)c1ccc2ccccc2c1 ZINC000824039281 607949795 /nfs/dbraw/zinc/94/97/95/607949795.db2.gz DAGOZXANQNFEBI-CQSZACIVSA-N -1 3 369.428 3.713 20 0 FHADHM CS[C@@H](C)CC(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCCCC2 ZINC000826224946 607962282 /nfs/dbraw/zinc/96/22/82/607962282.db2.gz PQNUFMZSGNYVIJ-JTQLQIEISA-N -1 3 365.528 3.667 20 0 FHADHM CS[C@@H](C)CC(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCCCC2 ZINC000826224946 607962283 /nfs/dbraw/zinc/96/22/83/607962283.db2.gz PQNUFMZSGNYVIJ-JTQLQIEISA-N -1 3 365.528 3.667 20 0 FHADHM Clc1cc(N2CCc3c4ccccc4[nH]c3C2)ccc1-c1nnn[n-]1 ZINC000826350708 607968974 /nfs/dbraw/zinc/96/89/74/607968974.db2.gz HTLAGBKVIBCUFK-UHFFFAOYSA-N -1 3 350.813 3.564 20 0 FHADHM Clc1cc(N2CCc3c4ccccc4[nH]c3C2)ccc1-c1nn[n-]n1 ZINC000826350708 607968975 /nfs/dbraw/zinc/96/89/75/607968975.db2.gz HTLAGBKVIBCUFK-UHFFFAOYSA-N -1 3 350.813 3.564 20 0 FHADHM Cc1ccc(-c2ncco2)cc1NCc1ccc(-c2nnn[n-]2)cc1F ZINC000826273853 607977460 /nfs/dbraw/zinc/97/74/60/607977460.db2.gz XCAOBILDIGVDEH-UHFFFAOYSA-N -1 3 350.357 3.581 20 0 FHADHM Cc1ccc(-c2ncco2)cc1NCc1ccc(-c2nn[n-]n2)cc1F ZINC000826273853 607977461 /nfs/dbraw/zinc/97/74/61/607977461.db2.gz XCAOBILDIGVDEH-UHFFFAOYSA-N -1 3 350.357 3.581 20 0 FHADHM Cc1ccc(-c2ncco2)cc1NCc1cc(-c2nnn[n-]2)ccc1F ZINC000826273890 607982755 /nfs/dbraw/zinc/98/27/55/607982755.db2.gz YSXOYECFTUMJTR-UHFFFAOYSA-N -1 3 350.357 3.581 20 0 FHADHM Cc1ccc(-c2ncco2)cc1NCc1cc(-c2nn[n-]n2)ccc1F ZINC000826273890 607982756 /nfs/dbraw/zinc/98/27/56/607982756.db2.gz YSXOYECFTUMJTR-UHFFFAOYSA-N -1 3 350.357 3.581 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000823942812 607985943 /nfs/dbraw/zinc/98/59/43/607985943.db2.gz JOIBKDNQUWCGMZ-SUIFULHWSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000823942812 607985944 /nfs/dbraw/zinc/98/59/44/607985944.db2.gz JOIBKDNQUWCGMZ-SUIFULHWSA-N -1 3 367.840 3.801 20 0 FHADHM Fc1ccc(C2(NCc3ccc(-c4nn[n-]n4)cc3F)CCCC2)c(F)c1 ZINC000826374233 608028438 /nfs/dbraw/zinc/02/84/38/608028438.db2.gz QVROULXSEIQMMR-UHFFFAOYSA-N -1 3 373.382 3.843 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1CNc1cc(C)ccc1Br ZINC000826184270 608048744 /nfs/dbraw/zinc/04/87/44/608048744.db2.gz QUGDLEIKOXERHZ-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CNc1cc(C)ccc1Br ZINC000826184270 608048745 /nfs/dbraw/zinc/04/87/45/608048745.db2.gz QUGDLEIKOXERHZ-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM Cc1csc([C@H](C)Nc2ccc(-c3nn[n-]n3)cc2Br)n1 ZINC000826320099 608048796 /nfs/dbraw/zinc/04/87/96/608048796.db2.gz GJOVGSKWRUQERM-QMMMGPOBSA-N -1 3 365.260 3.567 20 0 FHADHM FC1(F)CCC[C@H](Nc2ccc(-c3nn[n-]n3)cc2Br)C1 ZINC000826370305 608051626 /nfs/dbraw/zinc/05/16/26/608051626.db2.gz MTHHEPBXAPHWNB-VIFPVBQESA-N -1 3 358.190 3.619 20 0 FHADHM C[C@H](OC(=O)CCCc1cc(F)ccc1F)c1cccc(-c2nnn[n-]2)c1 ZINC000824713494 608075363 /nfs/dbraw/zinc/07/53/63/608075363.db2.gz IUKRWYIBOLHPJY-LBPRGKRZSA-N -1 3 372.375 3.772 20 0 FHADHM C[C@H](OC(=O)CCCc1cc(F)ccc1F)c1cccc(-c2nn[n-]n2)c1 ZINC000824713494 608075364 /nfs/dbraw/zinc/07/53/64/608075364.db2.gz IUKRWYIBOLHPJY-LBPRGKRZSA-N -1 3 372.375 3.772 20 0 FHADHM CCCCNc1ccccc1C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825290986 608115465 /nfs/dbraw/zinc/11/54/65/608115465.db2.gz KZGCLQDHSATROO-CQSZACIVSA-N -1 3 364.453 3.570 20 0 FHADHM CCCCNc1ccccc1C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825290986 608115466 /nfs/dbraw/zinc/11/54/66/608115466.db2.gz KZGCLQDHSATROO-CQSZACIVSA-N -1 3 364.453 3.570 20 0 FHADHM CCSc1cccc(C(=O)Nc2sc(C)c(C)c2-c2nnn[n-]2)c1 ZINC000825675165 608122821 /nfs/dbraw/zinc/12/28/21/608122821.db2.gz YPIHLGOYNUIBFE-UHFFFAOYSA-N -1 3 359.480 3.909 20 0 FHADHM CCSc1cccc(C(=O)Nc2sc(C)c(C)c2-c2nn[n-]n2)c1 ZINC000825675165 608122822 /nfs/dbraw/zinc/12/28/22/608122822.db2.gz YPIHLGOYNUIBFE-UHFFFAOYSA-N -1 3 359.480 3.909 20 0 FHADHM Cc1sc(NC(=O)[C@H](C)c2c(F)cccc2F)c(-c2nnn[n-]2)c1C ZINC000826349888 608122927 /nfs/dbraw/zinc/12/29/27/608122927.db2.gz YPBWRFNDDVPGOL-MRVPVSSYSA-N -1 3 363.393 3.565 20 0 FHADHM Cc1sc(NC(=O)[C@H](C)c2c(F)cccc2F)c(-c2nn[n-]n2)c1C ZINC000826349888 608122928 /nfs/dbraw/zinc/12/29/28/608122928.db2.gz YPBWRFNDDVPGOL-MRVPVSSYSA-N -1 3 363.393 3.565 20 0 FHADHM CC(C)(C)[C@H]1C[C@@H](Nc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)CCO1 ZINC000824080476 608149973 /nfs/dbraw/zinc/14/99/73/608149973.db2.gz XXNPLGNLMGLIRN-SMDDNHRTSA-N -1 3 369.391 3.891 20 0 FHADHM CC(C)(C)[C@H]1C[C@@H](Nc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)CCO1 ZINC000824080476 608149974 /nfs/dbraw/zinc/14/99/74/608149974.db2.gz XXNPLGNLMGLIRN-SMDDNHRTSA-N -1 3 369.391 3.891 20 0 FHADHM O=C(N[C@@H]1CC12CCCCC2)c1ccccc1-c1ccccc1-c1nnn[n-]1 ZINC000826428609 608165403 /nfs/dbraw/zinc/16/54/03/608165403.db2.gz GXPUJSFJCPYAMD-LJQANCHMSA-N -1 3 373.460 3.986 20 0 FHADHM O=C(N[C@@H]1CC12CCCCC2)c1ccccc1-c1ccccc1-c1nn[n-]n1 ZINC000826428609 608165405 /nfs/dbraw/zinc/16/54/05/608165405.db2.gz GXPUJSFJCPYAMD-LJQANCHMSA-N -1 3 373.460 3.986 20 0 FHADHM C[C@H](Oc1ccccc1Cl)C(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000824756111 608183367 /nfs/dbraw/zinc/18/33/67/608183367.db2.gz NTKKAWFCPZUEMB-RYUDHWBXSA-N -1 3 372.812 3.592 20 0 FHADHM C[C@H](Oc1ccccc1Cl)C(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000824756111 608183368 /nfs/dbraw/zinc/18/33/68/608183368.db2.gz NTKKAWFCPZUEMB-RYUDHWBXSA-N -1 3 372.812 3.592 20 0 FHADHM CCc1nsc(Oc2ccc(Oc3ccc(-c4nnn[n-]4)cc3)cc2)n1 ZINC000825777159 608188669 /nfs/dbraw/zinc/18/86/69/608188669.db2.gz PKALCIIFMAAWIV-UHFFFAOYSA-N -1 3 366.406 3.865 20 0 FHADHM CCc1nsc(Oc2ccc(Oc3ccc(-c4nn[n-]n4)cc3)cc2)n1 ZINC000825777159 608188670 /nfs/dbraw/zinc/18/86/70/608188670.db2.gz PKALCIIFMAAWIV-UHFFFAOYSA-N -1 3 366.406 3.865 20 0 FHADHM C[C@H](c1ccccc1)n1ccc(Nc2snc(Cl)c2-c2nnn[n-]2)n1 ZINC000824770499 608189723 /nfs/dbraw/zinc/18/97/23/608189723.db2.gz LHDAYNDTFSXMSI-SECBINFHSA-N -1 3 372.845 3.526 20 0 FHADHM CCOc1ccc([C@@H](C)Nc2ccc3cc(-c4nnn[n-]4)ccc3n2)cc1 ZINC000825637905 608221900 /nfs/dbraw/zinc/22/19/00/608221900.db2.gz AZVYHVBGSUDTAT-CYBMUJFWSA-N -1 3 360.421 3.987 20 0 FHADHM CCOc1ccc([C@@H](C)Nc2ccc3cc(-c4nn[n-]n4)ccc3n2)cc1 ZINC000825637905 608221901 /nfs/dbraw/zinc/22/19/01/608221901.db2.gz AZVYHVBGSUDTAT-CYBMUJFWSA-N -1 3 360.421 3.987 20 0 FHADHM Cc1cccc([C@H](Nc2nc(C)cc(C)c2-c2nnn[n-]2)c2ccccn2)c1 ZINC000826297194 608230771 /nfs/dbraw/zinc/23/07/71/608230771.db2.gz YLINDCYPLCEDNP-IBGZPJMESA-N -1 3 371.448 3.783 20 0 FHADHM Cc1cccc([C@H](Nc2nc(C)cc(C)c2-c2nn[n-]n2)c2ccccn2)c1 ZINC000826297194 608230772 /nfs/dbraw/zinc/23/07/72/608230772.db2.gz YLINDCYPLCEDNP-IBGZPJMESA-N -1 3 371.448 3.783 20 0 FHADHM Fc1cc(F)c(F)c(CNc2ccc3cc(-c4nnn[n-]4)ccc3n2)c1F ZINC000826373075 608232737 /nfs/dbraw/zinc/23/27/37/608232737.db2.gz YLZGHCWXBLUAED-UHFFFAOYSA-N -1 3 374.301 3.583 20 0 FHADHM Fc1cc(F)c(F)c(CNc2ccc3cc(-c4nn[n-]n4)ccc3n2)c1F ZINC000826373075 608232739 /nfs/dbraw/zinc/23/27/39/608232739.db2.gz YLZGHCWXBLUAED-UHFFFAOYSA-N -1 3 374.301 3.583 20 0 FHADHM C[C@@H](Nc1ccc2cc(-c3nnn[n-]3)ccc2n1)c1cccc(F)c1F ZINC000824662687 608235479 /nfs/dbraw/zinc/23/54/79/608235479.db2.gz PLOVRLPMBASGGN-SNVBAGLBSA-N -1 3 352.348 3.866 20 0 FHADHM C[C@@H](Nc1ccc2cc(-c3nn[n-]n3)ccc2n1)c1cccc(F)c1F ZINC000824662687 608235481 /nfs/dbraw/zinc/23/54/81/608235481.db2.gz PLOVRLPMBASGGN-SNVBAGLBSA-N -1 3 352.348 3.866 20 0 FHADHM CC(C)[C@H]1C[C@H](Nc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)CCO1 ZINC000824215008 608242362 /nfs/dbraw/zinc/24/23/62/608242362.db2.gz JITUFMHQFKXHJX-BXUZGUMPSA-N -1 3 355.364 3.501 20 0 FHADHM CC(C)[C@H]1C[C@H](Nc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)CCO1 ZINC000824215008 608242364 /nfs/dbraw/zinc/24/23/64/608242364.db2.gz JITUFMHQFKXHJX-BXUZGUMPSA-N -1 3 355.364 3.501 20 0 FHADHM O=C(CSCc1ccc(-c2nnn[n-]2)cc1)Nc1ccc(C2CC2)cc1 ZINC000826420674 608245367 /nfs/dbraw/zinc/24/53/67/608245367.db2.gz WMJYZBLHWSCOLI-UHFFFAOYSA-N -1 3 365.462 3.616 20 0 FHADHM O=C(CSCc1ccc(-c2nn[n-]n2)cc1)Nc1ccc(C2CC2)cc1 ZINC000826420674 608245369 /nfs/dbraw/zinc/24/53/69/608245369.db2.gz WMJYZBLHWSCOLI-UHFFFAOYSA-N -1 3 365.462 3.616 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccc2[nH]ccc2c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824716573 608248035 /nfs/dbraw/zinc/24/80/35/608248035.db2.gz YGMWBTUSMJAHCP-FOWFJEMPSA-N -1 3 359.389 3.666 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccc2[nH]ccc2c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824716573 608248036 /nfs/dbraw/zinc/24/80/36/608248036.db2.gz YGMWBTUSMJAHCP-FOWFJEMPSA-N -1 3 359.389 3.666 20 0 FHADHM CCCCn1c(C)c(C)nc1SCc1ccc(-c2nnn[n-]2)cc1OC ZINC000825296751 608261679 /nfs/dbraw/zinc/26/16/79/608261679.db2.gz UVQHSQLQJBBKQU-UHFFFAOYSA-N -1 3 372.498 3.781 20 0 FHADHM CCCCn1c(C)c(C)nc1SCc1ccc(-c2nn[n-]n2)cc1OC ZINC000825296751 608261680 /nfs/dbraw/zinc/26/16/80/608261680.db2.gz UVQHSQLQJBBKQU-UHFFFAOYSA-N -1 3 372.498 3.781 20 0 FHADHM C[C@H]1CCC[C@H](OCCCCCC(=O)Nc2ccccc2-c2nnn[n-]2)C1 ZINC000824930059 608261815 /nfs/dbraw/zinc/26/18/15/608261815.db2.gz ZXLSGAQKMQIAPO-HOTGVXAUSA-N -1 3 371.485 3.961 20 0 FHADHM C[C@H]1CCC[C@H](OCCCCCC(=O)Nc2ccccc2-c2nn[n-]n2)C1 ZINC000824930059 608261816 /nfs/dbraw/zinc/26/18/16/608261816.db2.gz ZXLSGAQKMQIAPO-HOTGVXAUSA-N -1 3 371.485 3.961 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)c1ccccc1COC(C)(C)C ZINC000826278875 608301071 /nfs/dbraw/zinc/30/10/71/608301071.db2.gz WSVPDZNEASDSEW-UHFFFAOYSA-N -1 3 365.437 3.743 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)c1ccccc1COC(C)(C)C ZINC000826278875 608301072 /nfs/dbraw/zinc/30/10/72/608301072.db2.gz WSVPDZNEASDSEW-UHFFFAOYSA-N -1 3 365.437 3.743 20 0 FHADHM O=C(CC1CCCC1)NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000826404013 608304145 /nfs/dbraw/zinc/30/41/45/608304145.db2.gz LLJKOKNVQGFOPB-UHFFFAOYSA-N -1 3 361.449 3.730 20 0 FHADHM O=C(CC1CCCC1)NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000826404013 608304147 /nfs/dbraw/zinc/30/41/47/608304147.db2.gz LLJKOKNVQGFOPB-UHFFFAOYSA-N -1 3 361.449 3.730 20 0 FHADHM O=C(Nc1ccc(COc2ccccc2)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000826453680 608309328 /nfs/dbraw/zinc/30/93/28/608309328.db2.gz VJGJEIQWUMMJMN-UHFFFAOYSA-N -1 3 371.400 3.698 20 0 FHADHM O=C(Nc1ccc(COc2ccccc2)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000826453680 608309329 /nfs/dbraw/zinc/30/93/29/608309329.db2.gz VJGJEIQWUMMJMN-UHFFFAOYSA-N -1 3 371.400 3.698 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CNc1ccc(F)c(C(F)(F)F)c1 ZINC000826170492 608319840 /nfs/dbraw/zinc/31/98/40/608319840.db2.gz BWIAVPMQDAJHBN-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CNc1ccc(F)c(C(F)(F)F)c1 ZINC000826170492 608319843 /nfs/dbraw/zinc/31/98/43/608319843.db2.gz BWIAVPMQDAJHBN-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM CC(C)(C)OCc1ccccc1C(=O)OCc1ccc(-c2nnn[n-]2)cc1 ZINC000824119768 608325242 /nfs/dbraw/zinc/32/52/42/608325242.db2.gz PWPUMZBVAUJAMQ-UHFFFAOYSA-N -1 3 366.421 3.539 20 0 FHADHM CC(C)(C)OCc1ccccc1C(=O)OCc1ccc(-c2nn[n-]n2)cc1 ZINC000824119768 608325243 /nfs/dbraw/zinc/32/52/43/608325243.db2.gz PWPUMZBVAUJAMQ-UHFFFAOYSA-N -1 3 366.421 3.539 20 0 FHADHM CCN(C(=O)c1cccc(C)c1F)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825385567 608345572 /nfs/dbraw/zinc/34/55/72/608345572.db2.gz LCVDQDPRFBHUFJ-UHFFFAOYSA-N -1 3 359.792 3.634 20 0 FHADHM CCN(C(=O)c1cccc(C)c1F)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825385567 608345574 /nfs/dbraw/zinc/34/55/74/608345574.db2.gz LCVDQDPRFBHUFJ-UHFFFAOYSA-N -1 3 359.792 3.634 20 0 FHADHM Fc1cccc([C@H]2CCCN2c2ccc3cc(-c4nnn[n-]4)ccc3n2)c1 ZINC000826376575 608371973 /nfs/dbraw/zinc/37/19/73/608371973.db2.gz JRMCZHYXUOVSOV-GOSISDBHSA-N -1 3 360.396 3.896 20 0 FHADHM Fc1cccc([C@H]2CCCN2c2ccc3cc(-c4nn[n-]n4)ccc3n2)c1 ZINC000826376575 608371975 /nfs/dbraw/zinc/37/19/75/608371975.db2.gz JRMCZHYXUOVSOV-GOSISDBHSA-N -1 3 360.396 3.896 20 0 FHADHM C[C@H](O)c1ccc(CNc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)cc1 ZINC000824707530 608372689 /nfs/dbraw/zinc/37/26/89/608372689.db2.gz SHKDXROGFVZZGQ-JTQLQIEISA-N -1 3 363.343 3.551 20 0 FHADHM C[C@H](O)c1ccc(CNc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)cc1 ZINC000824707530 608372691 /nfs/dbraw/zinc/37/26/91/608372691.db2.gz SHKDXROGFVZZGQ-JTQLQIEISA-N -1 3 363.343 3.551 20 0 FHADHM Fc1cc(NCc2ccccc2-c2nnn[n-]2)cc(F)c1Br ZINC000826372738 608389182 /nfs/dbraw/zinc/38/91/82/608389182.db2.gz JPKWIUMLOKLCBZ-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1cc(NCc2ccccc2-c2nn[n-]n2)cc(F)c1Br ZINC000826372738 608389184 /nfs/dbraw/zinc/38/91/84/608389184.db2.gz JPKWIUMLOKLCBZ-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM FC(F)(F)c1cccnc1N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000826369086 608442709 /nfs/dbraw/zinc/44/27/09/608442709.db2.gz LYPPOXGGPOSMSH-UHFFFAOYSA-N -1 3 372.354 3.574 20 0 FHADHM FC(F)(F)c1cccnc1N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000826369086 608442711 /nfs/dbraw/zinc/44/27/11/608442711.db2.gz LYPPOXGGPOSMSH-UHFFFAOYSA-N -1 3 372.354 3.574 20 0 FHADHM Cc1ccc(NCc2ccc(-c3nnn[n-]3)s2)c(Br)c1 ZINC000826291490 608450254 /nfs/dbraw/zinc/45/02/54/608450254.db2.gz IXXBAPSEQKOUDW-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM CCOc1ccccc1[C@H](CC)NCc1cccc(-c2nnn[n-]2)c1F ZINC000825653626 608458399 /nfs/dbraw/zinc/45/83/99/608458399.db2.gz GRSLYZIRWXHRPZ-INIZCTEOSA-N -1 3 355.417 3.645 20 0 FHADHM Cc1oc(-c2ccsc2)nc1CN[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000826340579 608460535 /nfs/dbraw/zinc/46/05/35/608460535.db2.gz DDIDNDGUYWBIQS-LLVKDONJSA-N -1 3 366.450 3.742 20 0 FHADHM C[C@@H](NCc1coc(-c2ccc(F)cc2)n1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824625714 608462729 /nfs/dbraw/zinc/46/27/29/608462729.db2.gz JEROVLGATNMKOT-GFCCVEGCSA-N -1 3 364.384 3.512 20 0 FHADHM CC(C)c1nc(CN2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)cs1 ZINC000824358227 608465296 /nfs/dbraw/zinc/46/52/96/608465296.db2.gz CPEIZCSOILYVNK-UHFFFAOYSA-N -1 3 366.494 3.736 20 0 FHADHM CC(C)c1nc(CN2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)cs1 ZINC000824358227 608465297 /nfs/dbraw/zinc/46/52/97/608465297.db2.gz CPEIZCSOILYVNK-UHFFFAOYSA-N -1 3 366.494 3.736 20 0 FHADHM Fc1c(CNc2ccccc2N2CCCCCC2)cccc1-c1nnn[n-]1 ZINC000826370932 608481363 /nfs/dbraw/zinc/48/13/63/608481363.db2.gz MBEOTEODBZHWIJ-UHFFFAOYSA-N -1 3 366.444 3.998 20 0 FHADHM Fc1c(CNc2ccccc2N2CCCCCC2)cccc1-c1nn[n-]n1 ZINC000826370932 608481365 /nfs/dbraw/zinc/48/13/65/608481365.db2.gz MBEOTEODBZHWIJ-UHFFFAOYSA-N -1 3 366.444 3.998 20 0 FHADHM O=C(c1coc2ccccc12)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000826475161 608486377 /nfs/dbraw/zinc/48/63/77/608486377.db2.gz VUPIFIMJGUTSFL-UHFFFAOYSA-N -1 3 371.400 3.542 20 0 FHADHM O=C(c1coc2ccccc12)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000826475161 608486378 /nfs/dbraw/zinc/48/63/78/608486378.db2.gz VUPIFIMJGUTSFL-UHFFFAOYSA-N -1 3 371.400 3.542 20 0 FHADHM CCN(Cc1cc(F)c(F)cc1F)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825428421 608552000 /nfs/dbraw/zinc/55/20/00/608552000.db2.gz MKLCCAUIFFYFPO-NSHDSACASA-N -1 3 361.371 3.867 20 0 FHADHM FC(F)(F)c1ccc(N2CCC(c3cccnc3)CC2)c(-c2nnn[n-]2)c1 ZINC000826368193 608554300 /nfs/dbraw/zinc/55/43/00/608554300.db2.gz GFRQYTVYDUUFNS-UHFFFAOYSA-N -1 3 374.370 3.665 20 0 FHADHM FC(F)(F)c1ccc(N2CCC(c3cccnc3)CC2)c(-c2nn[n-]n2)c1 ZINC000826368193 608554302 /nfs/dbraw/zinc/55/43/02/608554302.db2.gz GFRQYTVYDUUFNS-UHFFFAOYSA-N -1 3 374.370 3.665 20 0 FHADHM CC(C)c1ccc(C(=O)Nc2nc3c(cc2-c2nnn[n-]2)CCCC3)cc1 ZINC000824347843 608569754 /nfs/dbraw/zinc/56/97/54/608569754.db2.gz PHRNWZJTNMRYEI-UHFFFAOYSA-N -1 3 362.437 3.516 20 0 FHADHM CC(C)c1ccc(C(=O)Nc2nc3c(cc2-c2nn[n-]n2)CCCC3)cc1 ZINC000824347843 608569756 /nfs/dbraw/zinc/56/97/56/608569756.db2.gz PHRNWZJTNMRYEI-UHFFFAOYSA-N -1 3 362.437 3.516 20 0 FHADHM Clc1cc(Cl)c2ncnc(OCc3ccc(-c4nnn[n-]4)cc3)c2c1 ZINC000826350709 608678213 /nfs/dbraw/zinc/67/82/13/608678213.db2.gz HXRQFOGQMKWEJU-UHFFFAOYSA-N -1 3 373.203 3.696 20 0 FHADHM Clc1cc(Cl)c2ncnc(OCc3ccc(-c4nn[n-]n4)cc3)c2c1 ZINC000826350709 608678215 /nfs/dbraw/zinc/67/82/15/608678215.db2.gz HXRQFOGQMKWEJU-UHFFFAOYSA-N -1 3 373.203 3.696 20 0 FHADHM c1sc(CN2CCc3cc(-c4ccccc4)oc3C2)cc1-c1nn[n-]n1 ZINC000826519177 608752884 /nfs/dbraw/zinc/75/28/84/608752884.db2.gz NHCMOLXUXRPDKQ-UHFFFAOYSA-N -1 3 363.446 3.747 20 0 FHADHM C[C@@H](Nc1cnccc1-c1nnn[n-]1)c1c(Cl)ccc(F)c1Cl ZINC000824662209 608776191 /nfs/dbraw/zinc/77/61/91/608776191.db2.gz FTWLBDAOJCUPHL-SSDOTTSWSA-N -1 3 353.188 3.881 20 0 FHADHM C[C@@H](Nc1cnccc1-c1nn[n-]n1)c1c(Cl)ccc(F)c1Cl ZINC000824662209 608776193 /nfs/dbraw/zinc/77/61/93/608776193.db2.gz FTWLBDAOJCUPHL-SSDOTTSWSA-N -1 3 353.188 3.881 20 0 FHADHM Fc1cc(F)c(CN2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)cc1F ZINC000826371984 608857819 /nfs/dbraw/zinc/85/78/19/608857819.db2.gz BMAHSWLCVPGNDC-UHFFFAOYSA-N -1 3 371.366 3.573 20 0 FHADHM Fc1cc(F)c(CN2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)cc1F ZINC000826371984 608857822 /nfs/dbraw/zinc/85/78/22/608857822.db2.gz BMAHSWLCVPGNDC-UHFFFAOYSA-N -1 3 371.366 3.573 20 0 FHADHM CC[C@@H](C)Oc1cc(CNc2ccc(-c3nn[n-]n3)cc2)ccc1OC ZINC000825075581 608867909 /nfs/dbraw/zinc/86/79/09/608867909.db2.gz QDMFCPLHWLAROD-CYBMUJFWSA-N -1 3 353.426 3.665 20 0 FHADHM C[C@@H](N[C@@H](c1ccccc1)c1ccncc1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824540201 609136498 /nfs/dbraw/zinc/13/64/98/609136498.db2.gz SYGOEOKSEOWLEN-VLIAUNLRSA-N -1 3 374.423 3.841 20 0 FHADHM C[C@@H](N[C@@H](c1ccccc1)c1ccncc1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824540201 609136499 /nfs/dbraw/zinc/13/64/99/609136499.db2.gz SYGOEOKSEOWLEN-VLIAUNLRSA-N -1 3 374.423 3.841 20 0 FHADHM C[C@@H](N[C@H](c1ccccc1)c1cccnc1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824537416 609139545 /nfs/dbraw/zinc/13/95/45/609139545.db2.gz DXKYXNQJWFUKPR-JLTOFOAXSA-N -1 3 374.423 3.841 20 0 FHADHM C[C@@H](N[C@H](c1ccccc1)c1cccnc1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824537416 609139546 /nfs/dbraw/zinc/13/95/46/609139546.db2.gz DXKYXNQJWFUKPR-JLTOFOAXSA-N -1 3 374.423 3.841 20 0 FHADHM COc1cc(OC)c(N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1Cl ZINC000826181078 609158596 /nfs/dbraw/zinc/15/85/96/609158596.db2.gz KEIBOTNVVALMKI-JTQLQIEISA-N -1 3 359.817 3.710 20 0 FHADHM COc1cc(OC)c(N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1Cl ZINC000826181078 609158598 /nfs/dbraw/zinc/15/85/98/609158598.db2.gz KEIBOTNVVALMKI-JTQLQIEISA-N -1 3 359.817 3.710 20 0 FHADHM CC(=O)Nc1cc(N[C@@H]2CCCc3cc(-c4nnn[n-]4)ccc32)ccc1C ZINC000823999844 609165362 /nfs/dbraw/zinc/16/53/62/609165362.db2.gz JHADXLSEHQBWHG-GOSISDBHSA-N -1 3 362.437 3.623 20 0 FHADHM CC(=O)Nc1cc(N[C@@H]2CCCc3cc(-c4nn[n-]n4)ccc32)ccc1C ZINC000823999844 609165363 /nfs/dbraw/zinc/16/53/63/609165363.db2.gz JHADXLSEHQBWHG-GOSISDBHSA-N -1 3 362.437 3.623 20 0 FHADHM CCOc1cc(N[C@@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)ccc1OC ZINC000825615805 609174265 /nfs/dbraw/zinc/17/42/65/609174265.db2.gz LKXJBQCFQMHPHS-NSHDSACASA-N -1 3 357.389 3.586 20 0 FHADHM CCOc1cc(N[C@@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)ccc1OC ZINC000825615805 609174266 /nfs/dbraw/zinc/17/42/66/609174266.db2.gz LKXJBQCFQMHPHS-NSHDSACASA-N -1 3 357.389 3.586 20 0 FHADHM Clc1ccccc1C1=CCN(Cc2cc(-c3nnn[n-]3)cs2)CC1 ZINC000826353394 609174607 /nfs/dbraw/zinc/17/46/07/609174607.db2.gz NJXKPXZGUKVYHV-UHFFFAOYSA-N -1 3 357.870 3.871 20 0 FHADHM Clc1ccccc1C1=CCN(Cc2cc(-c3nn[n-]n3)cs2)CC1 ZINC000826353394 609174608 /nfs/dbraw/zinc/17/46/08/609174608.db2.gz NJXKPXZGUKVYHV-UHFFFAOYSA-N -1 3 357.870 3.871 20 0 FHADHM C[C@@H](Nc1cccc(N2CCCCC2=O)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824662679 609175702 /nfs/dbraw/zinc/17/57/02/609175702.db2.gz PIFFJFZSXRFLOV-CQSZACIVSA-N -1 3 362.437 3.557 20 0 FHADHM C[C@@H](Nc1cccc(N2CCCCC2=O)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824662679 609175703 /nfs/dbraw/zinc/17/57/03/609175703.db2.gz PIFFJFZSXRFLOV-CQSZACIVSA-N -1 3 362.437 3.557 20 0 FHADHM COc1c(C)cnc(CS[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1C ZINC000826167257 609183575 /nfs/dbraw/zinc/18/35/75/609183575.db2.gz WHQNFBPPDVUSOH-CYBMUJFWSA-N -1 3 355.467 3.882 20 0 FHADHM COc1c(C)cnc(CS[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1C ZINC000826167257 609183576 /nfs/dbraw/zinc/18/35/76/609183576.db2.gz WHQNFBPPDVUSOH-CYBMUJFWSA-N -1 3 355.467 3.882 20 0 FHADHM Cc1cccnc1CSCc1ccc(-c2nnn[n-]2)cc1OC(F)F ZINC000826308542 609183907 /nfs/dbraw/zinc/18/39/07/609183907.db2.gz FAVNTWGGKJVFKD-UHFFFAOYSA-N -1 3 363.393 3.605 20 0 FHADHM Cc1cccnc1CSCc1ccc(-c2nn[n-]n2)cc1OC(F)F ZINC000826308542 609183908 /nfs/dbraw/zinc/18/39/08/609183908.db2.gz FAVNTWGGKJVFKD-UHFFFAOYSA-N -1 3 363.393 3.605 20 0 FHADHM COCCOc1ccc(N[C@@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)c(C)c1 ZINC000826162587 609236935 /nfs/dbraw/zinc/23/69/35/609236935.db2.gz JCPPBEXLAWFUPV-ZDUSSCGKSA-N -1 3 371.416 3.513 20 0 FHADHM COCCOc1ccc(N[C@@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)c(C)c1 ZINC000826162587 609236936 /nfs/dbraw/zinc/23/69/36/609236936.db2.gz JCPPBEXLAWFUPV-ZDUSSCGKSA-N -1 3 371.416 3.513 20 0 FHADHM Cc1cc(C)cc(CCC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)c1 ZINC000826264254 609237441 /nfs/dbraw/zinc/23/74/41/609237441.db2.gz HRKSWEGTBCZUBS-UHFFFAOYSA-N -1 3 355.829 3.708 20 0 FHADHM Cc1cc(C)cc(CCC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)c1 ZINC000826264254 609237442 /nfs/dbraw/zinc/23/74/42/609237442.db2.gz HRKSWEGTBCZUBS-UHFFFAOYSA-N -1 3 355.829 3.708 20 0 FHADHM CCCCCC[C@@H](C)Nc1ccc(N2CCC(O)CC2)c(-c2nnn[n-]2)c1 ZINC000825271708 609242413 /nfs/dbraw/zinc/24/24/13/609242413.db2.gz MLQUDXKYNVIGJM-OAHLLOKOSA-N -1 3 372.517 3.599 20 0 FHADHM CCCCCC[C@@H](C)Nc1ccc(N2CCC(O)CC2)c(-c2nn[n-]n2)c1 ZINC000825271708 609242415 /nfs/dbraw/zinc/24/24/15/609242415.db2.gz MLQUDXKYNVIGJM-OAHLLOKOSA-N -1 3 372.517 3.599 20 0 FHADHM COCCCOc1ccccc1N[C@H](C)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000826157396 609276835 /nfs/dbraw/zinc/27/68/35/609276835.db2.gz UBGUZMPLICZXFX-CYBMUJFWSA-N -1 3 371.416 3.594 20 0 FHADHM COCCCOc1ccccc1N[C@H](C)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000826157396 609276837 /nfs/dbraw/zinc/27/68/37/609276837.db2.gz UBGUZMPLICZXFX-CYBMUJFWSA-N -1 3 371.416 3.594 20 0 FHADHM Cc1cc(C)n(-c2cccc(N[C@H](C)c3ccc(-c4nnn[n-]4)cc3)c2)n1 ZINC000826264856 609277032 /nfs/dbraw/zinc/27/70/32/609277032.db2.gz CFTKTFANBCHUEA-OAHLLOKOSA-N -1 3 359.437 3.842 20 0 FHADHM Cc1cc(C)n(-c2cccc(N[C@H](C)c3ccc(-c4nn[n-]n4)cc3)c2)n1 ZINC000826264856 609277034 /nfs/dbraw/zinc/27/70/34/609277034.db2.gz CFTKTFANBCHUEA-OAHLLOKOSA-N -1 3 359.437 3.842 20 0 FHADHM CCOc1ccc(OC)cc1N[C@H]1CCCc2cc(-c3nnn[n-]3)ccc21 ZINC000825643103 609278009 /nfs/dbraw/zinc/27/80/09/609278009.db2.gz ITQSJLKXIIKXNU-KRWDZBQOSA-N -1 3 365.437 3.764 20 0 FHADHM CCOc1ccc(OC)cc1N[C@H]1CCCc2cc(-c3nn[n-]n3)ccc21 ZINC000825643103 609278011 /nfs/dbraw/zinc/27/80/11/609278011.db2.gz ITQSJLKXIIKXNU-KRWDZBQOSA-N -1 3 365.437 3.764 20 0 FHADHM C[C@H](Nc1ccc2c(cnn2C(F)F)c1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824655777 609279530 /nfs/dbraw/zinc/27/95/30/609279530.db2.gz FTOFBFWQBHZTRM-VIFPVBQESA-N -1 3 373.342 3.924 20 0 FHADHM C[C@H](Nc1ccc2c(cnn2C(F)F)c1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824655777 609279531 /nfs/dbraw/zinc/27/95/31/609279531.db2.gz FTOFBFWQBHZTRM-VIFPVBQESA-N -1 3 373.342 3.924 20 0 FHADHM COc1ccc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c(Br)c1 ZINC000826210613 609281723 /nfs/dbraw/zinc/28/17/23/609281723.db2.gz YATARCMVMGVJRN-JTQLQIEISA-N -1 3 374.242 3.811 20 0 FHADHM COc1ccc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c(Br)c1 ZINC000826210613 609281725 /nfs/dbraw/zinc/28/17/25/609281725.db2.gz YATARCMVMGVJRN-JTQLQIEISA-N -1 3 374.242 3.811 20 0 FHADHM Cc1c2ccccc2oc1CNC(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000826236395 609299943 /nfs/dbraw/zinc/29/99/43/609299943.db2.gz KHDKHHSEKXXPDO-UHFFFAOYSA-N -1 3 367.796 3.505 20 0 FHADHM Cc1c2ccccc2oc1CNC(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000826236395 609299944 /nfs/dbraw/zinc/29/99/44/609299944.db2.gz KHDKHHSEKXXPDO-UHFFFAOYSA-N -1 3 367.796 3.505 20 0 FHADHM O=C(Nc1ccccc1OCC1CC1)c1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000826457927 609300744 /nfs/dbraw/zinc/30/07/44/609300744.db2.gz VVUAAZTTWGUWFN-UHFFFAOYSA-N -1 3 369.812 3.561 20 0 FHADHM O=C(Nc1ccccc1OCC1CC1)c1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000826457927 609300745 /nfs/dbraw/zinc/30/07/45/609300745.db2.gz VVUAAZTTWGUWFN-UHFFFAOYSA-N -1 3 369.812 3.561 20 0 FHADHM O=C(c1ccc(Cl)c(-c2nnn[n-]2)c1)N(CC1CCC1)c1ccccc1 ZINC000826472181 609302150 /nfs/dbraw/zinc/30/21/50/609302150.db2.gz AQCRUOCPSWNPQY-UHFFFAOYSA-N -1 3 367.840 3.967 20 0 FHADHM O=C(c1ccc(Cl)c(-c2nn[n-]n2)c1)N(CC1CCC1)c1ccccc1 ZINC000826472181 609302152 /nfs/dbraw/zinc/30/21/52/609302152.db2.gz AQCRUOCPSWNPQY-UHFFFAOYSA-N -1 3 367.840 3.967 20 0 FHADHM Clc1ccc(C2=CCN(c3ccc(-c4nnn[n-]4)nc3)CC2)cc1Cl ZINC000826351389 609312400 /nfs/dbraw/zinc/31/24/00/609312400.db2.gz KRAGTFVNBGUGEF-UHFFFAOYSA-N -1 3 373.247 3.862 20 0 FHADHM Clc1ccc(C2=CCN(c3ccc(-c4nn[n-]n4)nc3)CC2)cc1Cl ZINC000826351389 609312401 /nfs/dbraw/zinc/31/24/01/609312401.db2.gz KRAGTFVNBGUGEF-UHFFFAOYSA-N -1 3 373.247 3.862 20 0 FHADHM C[C@@H]1CCN(C(=O)c2ccccc2Oc2ccccc2-c2nnn[n-]2)[C@H]1C ZINC000824956460 609327428 /nfs/dbraw/zinc/32/74/28/609327428.db2.gz RKIYUYMANZQZPU-KGLIPLIRSA-N -1 3 363.421 3.530 20 0 FHADHM C[C@@H]1CCN(C(=O)c2ccccc2Oc2ccccc2-c2nn[n-]n2)[C@H]1C ZINC000824956460 609327429 /nfs/dbraw/zinc/32/74/29/609327429.db2.gz RKIYUYMANZQZPU-KGLIPLIRSA-N -1 3 363.421 3.530 20 0 FHADHM Cc1cncc(NC(=O)c2ccccc2Oc2ccccc2-c2nnn[n-]2)c1 ZINC000826319892 609327523 /nfs/dbraw/zinc/32/75/23/609327523.db2.gz XVUHRRSQKRIDJL-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1cncc(NC(=O)c2ccccc2Oc2ccccc2-c2nn[n-]n2)c1 ZINC000826319892 609327524 /nfs/dbraw/zinc/32/75/24/609327524.db2.gz XVUHRRSQKRIDJL-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM c1cc(CSCCCOc2ccc(-c3nn[n-]n3)cc2)cc2c1COC2 ZINC000826518840 609330190 /nfs/dbraw/zinc/33/01/90/609330190.db2.gz ZNNOBAZGPUDPFY-UHFFFAOYSA-N -1 3 368.462 3.599 20 0 FHADHM CC(=O)Nc1ccc(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2F)cc1Cl ZINC000823999943 609345684 /nfs/dbraw/zinc/34/56/84/609345684.db2.gz OCGLNEQXLUXXFM-SECBINFHSA-N -1 3 374.807 3.791 20 0 FHADHM CC(=O)Nc1ccc(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2F)cc1Cl ZINC000823999943 609345686 /nfs/dbraw/zinc/34/56/86/609345686.db2.gz OCGLNEQXLUXXFM-SECBINFHSA-N -1 3 374.807 3.791 20 0 FHADHM C[C@H](N[C@H]1CCCOc2c(F)cccc21)c1ccc(-c2nn[n-]n2)cc1F ZINC000824546923 609348175 /nfs/dbraw/zinc/34/81/75/609348175.db2.gz LUAUUUIZKJCVSH-GTNSWQLSSA-N -1 3 371.391 3.709 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NCc1c(Cl)ccc2cccnc21 ZINC000826278883 609367079 /nfs/dbraw/zinc/36/70/79/609367079.db2.gz XAUZGCHXVCWUQS-UHFFFAOYSA-N -1 3 350.813 3.989 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NCc1c(Cl)ccc2cccnc21 ZINC000826278883 609367081 /nfs/dbraw/zinc/36/70/81/609367081.db2.gz XAUZGCHXVCWUQS-UHFFFAOYSA-N -1 3 350.813 3.989 20 0 FHADHM Clc1cc(NC2CSC2)ccc1OCc1cccc(-c2nnn[n-]2)c1 ZINC000826350862 609440629 /nfs/dbraw/zinc/44/06/29/609440629.db2.gz OEMYFDJOXFNRGR-UHFFFAOYSA-N -1 3 373.869 3.626 20 0 FHADHM Clc1cc(NC2CSC2)ccc1OCc1cccc(-c2nn[n-]n2)c1 ZINC000826350862 609440630 /nfs/dbraw/zinc/44/06/30/609440630.db2.gz OEMYFDJOXFNRGR-UHFFFAOYSA-N -1 3 373.869 3.626 20 0 FHADHM Cc1ncc(CSc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)s1 ZINC000826330290 609451517 /nfs/dbraw/zinc/45/15/17/609451517.db2.gz NHSIPAQNDZOJAQ-UHFFFAOYSA-N -1 3 357.386 3.943 20 0 FHADHM Cc1ncc(CSc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)s1 ZINC000826330290 609451519 /nfs/dbraw/zinc/45/15/19/609451519.db2.gz NHSIPAQNDZOJAQ-UHFFFAOYSA-N -1 3 357.386 3.943 20 0 FHADHM CCCc1nc(CSc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)no1 ZINC000825353307 609452198 /nfs/dbraw/zinc/45/21/98/609452198.db2.gz UQCDHQLSRQKSKD-UHFFFAOYSA-N -1 3 370.360 3.513 20 0 FHADHM CCCc1nc(CSc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)no1 ZINC000825353307 609452201 /nfs/dbraw/zinc/45/22/01/609452201.db2.gz UQCDHQLSRQKSKD-UHFFFAOYSA-N -1 3 370.360 3.513 20 0 FHADHM Clc1ccc([C@H](Nc2nc3ccccn3c2-c2nnn[n-]2)C2CC2)cc1 ZINC000826351239 609457964 /nfs/dbraw/zinc/45/79/64/609457964.db2.gz DZFKWPMGSOXDBM-OAHLLOKOSA-N -1 3 365.828 3.731 20 0 FHADHM Clc1ccc([C@H](Nc2nc3ccccn3c2-c2nn[n-]n2)C2CC2)cc1 ZINC000826351239 609457966 /nfs/dbraw/zinc/45/79/66/609457966.db2.gz DZFKWPMGSOXDBM-OAHLLOKOSA-N -1 3 365.828 3.731 20 0 FHADHM CC(C)Oc1c(F)cc(NCc2cc(-c3nnn[n-]3)ccc2F)cc1F ZINC000824315728 609479760 /nfs/dbraw/zinc/47/97/60/609479760.db2.gz WKOWOAHBZNZWSQ-UHFFFAOYSA-N -1 3 363.343 3.683 20 0 FHADHM CC(C)Oc1c(F)cc(NCc2cc(-c3nn[n-]n3)ccc2F)cc1F ZINC000824315728 609479762 /nfs/dbraw/zinc/47/97/62/609479762.db2.gz WKOWOAHBZNZWSQ-UHFFFAOYSA-N -1 3 363.343 3.683 20 0 FHADHM COc1ccc2cc(CNc3cc(-c4nnn[n-]4)ccc3OC)ccc2c1 ZINC000826213017 609482137 /nfs/dbraw/zinc/48/21/37/609482137.db2.gz IROJWMWGSZRWQX-UHFFFAOYSA-N -1 3 361.405 3.649 20 0 FHADHM COc1ccc2cc(CNc3cc(-c4nn[n-]n4)ccc3OC)ccc2c1 ZINC000826213017 609482140 /nfs/dbraw/zinc/48/21/40/609482140.db2.gz IROJWMWGSZRWQX-UHFFFAOYSA-N -1 3 361.405 3.649 20 0 FHADHM CCOC(=O)Nc1ccc(NC/C=C\c2ccccc2)cc1-c1nnn[n-]1 ZINC000825553022 609487832 /nfs/dbraw/zinc/48/78/32/609487832.db2.gz IDCCDNMRJFPXPY-TWGQIWQCSA-N -1 3 364.409 3.560 20 0 FHADHM CCOC(=O)Nc1ccc(NC/C=C\c2ccccc2)cc1-c1nn[n-]n1 ZINC000825553022 609487834 /nfs/dbraw/zinc/48/78/34/609487834.db2.gz IDCCDNMRJFPXPY-TWGQIWQCSA-N -1 3 364.409 3.560 20 0 FHADHM CC[C@H](C)[C@@H](C)C(=O)Nc1nc(-c2ccc(-c3nnn[n-]3)cc2)cs1 ZINC000825049365 609506176 /nfs/dbraw/zinc/50/61/76/609506176.db2.gz BFVQXNCXFFVZJG-WDEREUQCSA-N -1 3 356.455 3.611 20 0 FHADHM CC[C@H](C)[C@@H](C)C(=O)Nc1nc(-c2ccc(-c3nn[n-]n3)cc2)cs1 ZINC000825049365 609506179 /nfs/dbraw/zinc/50/61/79/609506179.db2.gz BFVQXNCXFFVZJG-WDEREUQCSA-N -1 3 356.455 3.611 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)/C(C)=C(/C)CC ZINC000825605268 609512202 /nfs/dbraw/zinc/51/22/02/609512202.db2.gz SYZRHQHJUKTMKG-KTKRTIGZSA-N -1 3 350.806 3.571 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)/C(C)=C(/C)CC ZINC000825605268 609512205 /nfs/dbraw/zinc/51/22/05/609512205.db2.gz SYZRHQHJUKTMKG-KTKRTIGZSA-N -1 3 350.806 3.571 20 0 FHADHM CC[C@H](C)[C@H](C)C(=O)N(Cc1ccco1)c1ccccc1-c1nnn[n-]1 ZINC000825051833 609525318 /nfs/dbraw/zinc/52/53/18/609525318.db2.gz SPYAVQOGUMMUSD-KBPBESRZSA-N -1 3 353.426 3.675 20 0 FHADHM CC[C@H](C)[C@H](C)C(=O)N(Cc1ccco1)c1ccccc1-c1nn[n-]n1 ZINC000825051833 609525319 /nfs/dbraw/zinc/52/53/19/609525319.db2.gz SPYAVQOGUMMUSD-KBPBESRZSA-N -1 3 353.426 3.675 20 0 FHADHM CC/C(C)=C(\C)C(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)nc1 ZINC000825052438 609529888 /nfs/dbraw/zinc/52/98/88/609529888.db2.gz WNHVPFORLJBGRY-OUKQBFOZSA-N -1 3 364.409 3.739 20 0 FHADHM COc1cc([C@H](C)Nc2nccc(C)c2-c2nnn[n-]2)ccc1OC(C)C ZINC000826177758 609532857 /nfs/dbraw/zinc/53/28/57/609532857.db2.gz UHTHTTAPBNWHKS-ZDUSSCGKSA-N -1 3 368.441 3.539 20 0 FHADHM COc1cc([C@H](C)Nc2nccc(C)c2-c2nn[n-]n2)ccc1OC(C)C ZINC000826177758 609532859 /nfs/dbraw/zinc/53/28/59/609532859.db2.gz UHTHTTAPBNWHKS-ZDUSSCGKSA-N -1 3 368.441 3.539 20 0 FHADHM Cc1c(Cl)cnc(N2CCC[C@H]2c2cccc(F)c2)c1-c1nnn[n-]1 ZINC000826237698 609538997 /nfs/dbraw/zinc/53/89/97/609538997.db2.gz IWKGCPOXOKYTMP-AWEZNQCLSA-N -1 3 358.808 3.704 20 0 FHADHM Cc1c(Cl)cnc(N2CCC[C@H]2c2cccc(F)c2)c1-c1nn[n-]n1 ZINC000826237698 609538998 /nfs/dbraw/zinc/53/89/98/609538998.db2.gz IWKGCPOXOKYTMP-AWEZNQCLSA-N -1 3 358.808 3.704 20 0 FHADHM Cc1c(Cl)cnc(N[C@@H](c2ccccc2)[C@@H]2CCCO2)c1-c1nnn[n-]1 ZINC000826239153 609545656 /nfs/dbraw/zinc/54/56/56/609545656.db2.gz YWXSARRLTSGHJM-HOCLYGCPSA-N -1 3 370.844 3.556 20 0 FHADHM Cc1c(Cl)cnc(N[C@@H](c2ccccc2)[C@@H]2CCCO2)c1-c1nn[n-]n1 ZINC000826239153 609545658 /nfs/dbraw/zinc/54/56/58/609545658.db2.gz YWXSARRLTSGHJM-HOCLYGCPSA-N -1 3 370.844 3.556 20 0 FHADHM Cc1ccc([C@@H]2CCCCN2c2ncc(Cl)c(C)c2-c2nnn[n-]2)o1 ZINC000826285945 609559274 /nfs/dbraw/zinc/55/92/74/609559274.db2.gz OONNDTFVAYEWJH-ZDUSSCGKSA-N -1 3 358.833 3.857 20 0 FHADHM Cc1ccc([C@@H]2CCCCN2c2ncc(Cl)c(C)c2-c2nn[n-]n2)o1 ZINC000826285945 609559276 /nfs/dbraw/zinc/55/92/76/609559276.db2.gz OONNDTFVAYEWJH-ZDUSSCGKSA-N -1 3 358.833 3.857 20 0 FHADHM C[C@H]1CC[C@@H](C(F)(F)F)CN1c1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000824907239 609576393 /nfs/dbraw/zinc/57/63/93/609576393.db2.gz HEDVZPQFINGLQW-WDEREUQCSA-N -1 3 362.359 3.582 20 0 FHADHM C[C@H]1CC[C@@H](C(F)(F)F)CN1c1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000824907239 609576394 /nfs/dbraw/zinc/57/63/94/609576394.db2.gz HEDVZPQFINGLQW-WDEREUQCSA-N -1 3 362.359 3.582 20 0 FHADHM Cc1ccc(C(F)(F)C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000826284605 609596334 /nfs/dbraw/zinc/59/63/34/609596334.db2.gz YWGUPSJCMNZBLY-UHFFFAOYSA-N -1 3 363.755 3.559 20 0 FHADHM Cc1ccc(C(F)(F)C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000826284605 609596336 /nfs/dbraw/zinc/59/63/36/609596336.db2.gz YWGUPSJCMNZBLY-UHFFFAOYSA-N -1 3 363.755 3.559 20 0 FHADHM CC[C@H](C)[C@@H](C)C(=O)Nc1nc(-c2cccc(-c3nnn[n-]3)c2)cs1 ZINC000825051290 609599229 /nfs/dbraw/zinc/59/92/29/609599229.db2.gz NEXRTEXOBSQQBJ-WDEREUQCSA-N -1 3 356.455 3.611 20 0 FHADHM CC[C@H](C)[C@@H](C)C(=O)Nc1nc(-c2cccc(-c3nn[n-]n3)c2)cs1 ZINC000825051290 609599231 /nfs/dbraw/zinc/59/92/31/609599231.db2.gz NEXRTEXOBSQQBJ-WDEREUQCSA-N -1 3 356.455 3.611 20 0 FHADHM Cc1nc(-c2ccc([C@@H](C)Nc3ncccc3-c3nnn[n-]3)cc2)cs1 ZINC000826322534 609606646 /nfs/dbraw/zinc/60/66/46/609606646.db2.gz QVTZDIZHZKFVEY-LLVKDONJSA-N -1 3 363.450 3.867 20 0 FHADHM Cc1nc(-c2ccc([C@@H](C)Nc3ncccc3-c3nn[n-]n3)cc2)cs1 ZINC000826322534 609606648 /nfs/dbraw/zinc/60/66/48/609606648.db2.gz QVTZDIZHZKFVEY-LLVKDONJSA-N -1 3 363.450 3.867 20 0 FHADHM c1cc(NCc2ccc(-c3nnn[n-]3)cc2)cc(C2SCCS2)c1 ZINC000826516920 609613716 /nfs/dbraw/zinc/61/37/16/609613716.db2.gz IEQHHRIMCHWIRN-UHFFFAOYSA-N -1 3 355.492 3.957 20 0 FHADHM c1cc(NCc2ccc(-c3nn[n-]n3)cc2)cc(C2SCCS2)c1 ZINC000826516920 609613717 /nfs/dbraw/zinc/61/37/17/609613717.db2.gz IEQHHRIMCHWIRN-UHFFFAOYSA-N -1 3 355.492 3.957 20 0 FHADHM O=C(OCc1ccc(Cl)cc1-c1nnn[n-]1)c1ccc(C(F)F)cc1 ZINC000826465363 609618950 /nfs/dbraw/zinc/61/89/50/609618950.db2.gz JUVOHVFPQJESCI-UHFFFAOYSA-N -1 3 364.739 3.815 20 0 FHADHM O=C(OCc1ccc(Cl)cc1-c1nn[n-]n1)c1ccc(C(F)F)cc1 ZINC000826465363 609618951 /nfs/dbraw/zinc/61/89/51/609618951.db2.gz JUVOHVFPQJESCI-UHFFFAOYSA-N -1 3 364.739 3.815 20 0 FHADHM C[C@H]1CC(C)(C)c2ccccc2N1C(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000824874587 609622605 /nfs/dbraw/zinc/62/26/05/609622605.db2.gz DYMRGZFLENMJCD-NSHDSACASA-N -1 3 353.451 3.645 20 0 FHADHM C[C@H]1CC(C)(C)c2ccccc2N1C(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000824874587 609622607 /nfs/dbraw/zinc/62/26/07/609622607.db2.gz DYMRGZFLENMJCD-NSHDSACASA-N -1 3 353.451 3.645 20 0 FHADHM Cc1cnc(C2CCN(C(=O)c3cc(=O)c4ccccc4[n-]3)CC2)s1 ZINC000277992097 936321630 /nfs/dbraw/zinc/32/16/30/936321630.db2.gz KWIAYXBASZBPRG-UHFFFAOYSA-N -1 3 353.447 3.725 20 0 FHADHM CCc1ncsc1C([O-])=C(C#N)C(=O)Nc1c(CC)cccc1CC ZINC000160162617 927070681 /nfs/dbraw/zinc/07/06/81/927070681.db2.gz CJUWMSFUECKOBK-CQSZACIVSA-N -1 3 355.463 3.791 20 0 FHADHM O=S(=O)([N-]CC[C@@H]1CC1(F)F)c1cc(C(F)(F)F)ccc1Cl ZINC000621302593 927076051 /nfs/dbraw/zinc/07/60/51/927076051.db2.gz HZXXRCYQVSRKMY-MRVPVSSYSA-N -1 3 363.735 3.682 20 0 FHADHM Fc1cc(Br)cc(-c2noc(-c3cc(Cl)n[n-]3)n2)c1F ZINC001213500165 927196627 /nfs/dbraw/zinc/19/66/27/927196627.db2.gz AAOQOROHPXUKQZ-UHFFFAOYSA-N -1 3 361.533 3.821 20 0 FHADHM Cc1nc(C)c(CCC(=O)N2CCc3ccccc3-c3ccccc32)c(=O)[n-]1 ZINC000583132532 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935069750 /nfs/dbraw/zinc/06/97/50/935069750.db2.gz NXRRJPOAYBZFSD-MRXNPFEDSA-N -1 3 365.355 3.757 20 0 FHADHM Cc1c2cc(F)ccc2oc1S(=O)(=O)[N-][C@H](C)c1ccc2n[nH]cc2c1 ZINC000511051906 935088968 /nfs/dbraw/zinc/08/89/68/935088968.db2.gz MWYKPBMIHQCXGU-LLVKDONJSA-N -1 3 373.409 3.796 20 0 FHADHM COc1ccc([O-])c(C(=O)Nc2ccc(N3CCSCC3)cc2C)c1 ZINC000123523873 935103293 /nfs/dbraw/zinc/10/32/93/935103293.db2.gz FZLHZDFDSGXWCC-UHFFFAOYSA-N -1 3 358.463 3.515 20 0 FHADHM COc1ccc([O-])c(C(=O)Nc2cccc(NC(=O)c3cccs3)c2)c1 ZINC000119985851 935144922 /nfs/dbraw/zinc/14/49/22/935144922.db2.gz KKWXVPUKJABAFX-UHFFFAOYSA-N -1 3 368.414 3.967 20 0 FHADHM O=C(NC[C@H](Cc1ccccc1)C(F)(F)F)c1cc(=O)c2ccccc2[n-]1 ZINC000427089840 945079958 /nfs/dbraw/zinc/07/99/58/945079958.db2.gz RATQGFMPVPFCNV-AWEZNQCLSA-N -1 3 374.362 3.679 20 0 FHADHM COc1ccc(Cl)cc1NCCC(=O)Nc1cccc(C(C)=O)c1[O-] ZINC000582055053 935186354 /nfs/dbraw/zinc/18/63/54/935186354.db2.gz NVQZQDVLLMNOFS-UHFFFAOYSA-N -1 3 362.813 3.698 20 0 FHADHM CC(C)c1ccc(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)c([O-])c1 ZINC000051401627 935186373 /nfs/dbraw/zinc/18/63/73/935186373.db2.gz OBSQIDHYLWUQEL-UHFFFAOYSA-N -1 3 366.461 3.682 20 0 FHADHM CO[C@H]1C[C@H](CC(=O)[O-])N(Cc2ccc(Oc3ccccc3)c(F)c2)C1 ZINC000582068623 935206993 /nfs/dbraw/zinc/20/69/93/935206993.db2.gz VNVOJJAGRIKEIL-WBVHZDCISA-N -1 3 359.397 3.682 20 0 FHADHM [O-]c1cccc(CN2CCc3ncc(Cl)cc3C2)c1Br ZINC001140553089 935285860 /nfs/dbraw/zinc/28/58/60/935285860.db2.gz UBAICBGCLXDSIX-UHFFFAOYSA-N -1 3 353.647 3.761 20 0 FHADHM Cn1nccc1C1C[C@H]2CC[C@@H](C1)N2C(=O)CCCc1ccc([O-])c(F)c1 ZINC000582134576 935317704 /nfs/dbraw/zinc/31/77/04/935317704.db2.gz KURTZSDRQVAPIC-ALOPSCKCSA-N -1 3 371.456 3.525 20 0 FHADHM CC[C@@]1(c2ccc(NCc3c([O-])cccc3Cl)cc2)CCC(=O)NC1=O ZINC000159064736 935376536 /nfs/dbraw/zinc/37/65/36/935376536.db2.gz RJUYRZICLDRCOA-FQEVSTJZSA-N -1 3 372.852 3.742 20 0 FHADHM COc1cccc([C@@H](CC(=O)[O-])NCc2ccc(SC)c(OC)c2)c1 ZINC000277515303 935404540 /nfs/dbraw/zinc/40/45/40/935404540.db2.gz YKDSHSBXNOIQSM-MRXNPFEDSA-N -1 3 361.463 3.731 20 0 FHADHM Cc1sc2[n-]c([C@@H](C)OC(=O)c3ccnn3C3CCC3)nc(=O)c2c1C ZINC000923878476 935513035 /nfs/dbraw/zinc/51/30/35/935513035.db2.gz YVUIUHIEZMZJGK-SNVBAGLBSA-N -1 3 372.450 3.853 20 0 FHADHM Cc1ccc([O-])c(C(=O)Nc2ccc3c(c2)N(C(=O)C(C)(C)C)CCO3)c1 ZINC000055973930 935524283 /nfs/dbraw/zinc/52/42/83/935524283.db2.gz AKDZHOYZFMEERO-UHFFFAOYSA-N -1 3 368.433 3.724 20 0 FHADHM C[C@@H](NCc1nc2c3ccccc3oc2c(=O)[n-]1)c1ccc2n[nH]cc2c1 ZINC000507285589 945109752 /nfs/dbraw/zinc/10/97/52/945109752.db2.gz ZPNTVXHDJRZYMT-LLVKDONJSA-N -1 3 359.389 3.809 20 0 FHADHM O=C(Nc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)c1cc([O-])ccc1Cl ZINC000277615940 935732850 /nfs/dbraw/zinc/73/28/50/935732850.db2.gz IDZVVAIOARGZJZ-QZTJIDSGSA-N -1 3 361.825 3.980 20 0 FHADHM Cc1cc(O[C@H](C)C(=O)Nc2ccc(-c3nnn[n-]3)cc2)ccc1C(C)C ZINC000519098501 945120644 /nfs/dbraw/zinc/12/06/44/945120644.db2.gz MOXBGZIRYCNUDM-CQSZACIVSA-N -1 3 365.437 3.705 20 0 FHADHM Cc1cc(O[C@H](C)C(=O)Nc2ccc(-c3nn[n-]n3)cc2)ccc1C(C)C ZINC000519098501 945120648 /nfs/dbraw/zinc/12/06/48/945120648.db2.gz MOXBGZIRYCNUDM-CQSZACIVSA-N -1 3 365.437 3.705 20 0 FHADHM O=C([O-])[C@@H]1[C@H]2CCC[C@@H]2CN1Cc1csc(CCc2ccccc2)n1 ZINC000582551960 935818980 /nfs/dbraw/zinc/81/89/80/935818980.db2.gz SSXUEUOAXFRQFA-AYBZRNKSSA-N -1 3 356.491 3.613 20 0 FHADHM O=C(Nc1ccc(Br)cc1[O-])c1ccccc1-n1cccn1 ZINC000127915412 935840877 /nfs/dbraw/zinc/84/08/77/935840877.db2.gz PCHJYOFYYONKJZ-UHFFFAOYSA-N -1 3 358.195 3.593 20 0 FHADHM Cc1sc2[n-]c([C@H](C)OC(=O)c3scnc3Cl)nc(=O)c2c1C ZINC000051801681 935892793 /nfs/dbraw/zinc/89/27/93/935892793.db2.gz MWPWGXOMJSZHCA-LURJTMIESA-N -1 3 369.855 3.629 20 0 FHADHM CCCC[C@H](NC=C1C(=O)[N-]C(=O)c2ccccc21)c1ccc(OC)cc1 ZINC000728501730 935966908 /nfs/dbraw/zinc/96/69/08/935966908.db2.gz RGHGTXLWUSFJNO-STIKNRRDSA-N -1 3 364.445 3.827 20 0 FHADHM CC(=O)Nc1cc(S(=O)(=O)[N-]c2ccc(F)c(C3CC3)c2)ccc1C ZINC000685002855 935975099 /nfs/dbraw/zinc/97/50/99/935975099.db2.gz QKCDUEMGDBLBSV-UHFFFAOYSA-N -1 3 362.426 3.771 20 0 FHADHM Cc1ncc([N-]S(=O)(=O)Cc2ccccc2C(F)(F)F)c(C2CC2)n1 ZINC000685007492 935982708 /nfs/dbraw/zinc/98/27/08/935982708.db2.gz QBIJCSUCYFMZOR-UHFFFAOYSA-N -1 3 371.384 3.623 20 0 FHADHM CCC1(O)CCN(C(=O)c2cc(CCc3ccccc3)ccc2[O-])CC1 ZINC000075135122 936004546 /nfs/dbraw/zinc/00/45/46/936004546.db2.gz NAAGJCYAFGGGAV-UHFFFAOYSA-N -1 3 353.462 3.555 20 0 FHADHM [O-]c1ccc(F)c(CN[C@H]2CCN(c3ccc(Cl)c(F)c3)C2)c1F ZINC000511796616 945140128 /nfs/dbraw/zinc/14/01/28/945140128.db2.gz YYWJWLOSHABWPO-JTQLQIEISA-N -1 3 356.775 3.831 20 0 FHADHM Cc1noc([C@H]2CCCCN2Cc2nc3c4ccccc4oc3c(=O)[n-]2)n1 ZINC000560539185 936047064 /nfs/dbraw/zinc/04/70/64/936047064.db2.gz ATPSZEUVJPNNRW-CYBMUJFWSA-N -1 3 365.393 3.500 20 0 FHADHM CCN(C(C)=O)c1ccc(NCc2cccc([O-])c2Br)cn1 ZINC000657578144 936051206 /nfs/dbraw/zinc/05/12/06/936051206.db2.gz CNWMKUHIBXVOPQ-UHFFFAOYSA-N -1 3 364.243 3.535 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N(C)C[C@@H]3CCc4ccccc43)nc2)n1 ZINC000664615958 945144970 /nfs/dbraw/zinc/14/49/70/945144970.db2.gz IPDDDFCXLLQJIB-KRWDZBQOSA-N -1 3 360.461 3.973 20 0 FHADHM CCc1ccc([C@H](CN=c2nc([C@@H](C)OC)[n-]s2)N(CC)CC)cc1 ZINC000431504612 936268116 /nfs/dbraw/zinc/26/81/16/936268116.db2.gz GKCJLWRLUSNTHC-PBHICJAKSA-N -1 3 362.543 3.725 20 0 FHADHM CCc1ccc([C@@H](CN=c2nc([C@@H](C)OC)[n-]s2)N(CC)CC)cc1 ZINC000431504614 936268281 /nfs/dbraw/zinc/26/82/81/936268281.db2.gz GKCJLWRLUSNTHC-RHSMWYFYSA-N -1 3 362.543 3.725 20 0 FHADHM O=C(NCc1ccc([O-])c(F)c1)N1CCC(OCC2CCCCC2)CC1 ZINC000583727285 938378626 /nfs/dbraw/zinc/37/86/26/938378626.db2.gz PPWPHEDXGZRWEG-UHFFFAOYSA-N -1 3 364.461 3.802 20 0 FHADHM Cc1ccc(-c2nc(NC(=O)[C@@H](C)CSCc3ccccc3)n[n-]2)o1 ZINC000440006269 945170765 /nfs/dbraw/zinc/17/07/65/945170765.db2.gz WAWCSNXPXSKETC-LBPRGKRZSA-N -1 3 356.451 3.881 20 0 FHADHM Cc1nocc1S(=O)(=O)[N-]CC1(c2ccc(F)cc2Cl)CCCC1 ZINC001211600263 938445208 /nfs/dbraw/zinc/44/52/08/938445208.db2.gz CAPRCWUADKRFGC-UHFFFAOYSA-N -1 3 372.849 3.566 20 0 FHADHM Cc1ccsc1[C@H](Cc1ccccc1)NCc1cc(C(=O)[O-])nn1C ZINC000635309728 938478907 /nfs/dbraw/zinc/47/89/07/938478907.db2.gz SUSSXDLOCBSVRE-INIZCTEOSA-N -1 3 355.463 3.562 20 0 FHADHM CCOc1ccc(S(=O)(=O)[N-]c2ccc([C@@H]3CCOC3)cc2)c(C)c1 ZINC000583912888 938480757 /nfs/dbraw/zinc/48/07/57/938480757.db2.gz BDKXAAUSLRXUNU-MRXNPFEDSA-N -1 3 361.463 3.698 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)c3cc4c([nH]3)CCCC4)c2)n1 ZINC000583974774 938512324 /nfs/dbraw/zinc/51/23/24/938512324.db2.gz JRCYROAZMUEBGU-UHFFFAOYSA-N -1 3 362.433 3.871 20 0 FHADHM COc1ccc2oc([C@H](C)NC(=O)N=c3cc4ccccn4[n-]3)c(C)c2c1 ZINC000562295793 938524392 /nfs/dbraw/zinc/52/43/92/938524392.db2.gz NONBWIIKKDWIJK-ZDUSSCGKSA-N -1 3 364.405 3.702 20 0 FHADHM Cc1csc(C[N-]S(=O)(=O)c2ccc(C(F)(F)F)cc2Cl)n1 ZINC000151480149 938552857 /nfs/dbraw/zinc/55/28/57/938552857.db2.gz BNMITTIHLGLMON-UHFFFAOYSA-N -1 3 370.805 3.602 20 0 FHADHM O=C(NCc1ccc([O-])c(F)c1)c1ccc(NC(=O)c2ccccc2)cc1 ZINC000132990986 938553128 /nfs/dbraw/zinc/55/31/28/938553128.db2.gz WLEOEHTYJGIGJX-UHFFFAOYSA-N -1 3 364.376 3.714 20 0 FHADHM CN(C)Cc1ccsc1C(=O)Nc1cc(Br)ccc1[O-] ZINC000536210321 938587727 /nfs/dbraw/zinc/58/77/27/938587727.db2.gz VJJBEJNKFGIDMF-UHFFFAOYSA-N -1 3 355.257 3.530 20 0 FHADHM O=C(NCc1ccc([O-])c(Br)c1)c1cncc2ccccc21 ZINC000151607542 938600689 /nfs/dbraw/zinc/60/06/89/938600689.db2.gz MCYOOVCNHKQFHV-UHFFFAOYSA-N -1 3 357.207 3.633 20 0 FHADHM O=C(NCc1ccc([O-])c(F)c1)N[C@H](c1ccccc1)c1ccncc1 ZINC000158914200 938600806 /nfs/dbraw/zinc/60/08/06/938600806.db2.gz IYNFQJQETWOHPF-LJQANCHMSA-N -1 3 351.381 3.515 20 0 FHADHM O=C([O-])[C@@H]1[C@@H]2CCC[C@@H]2CN1Cc1cc(Cl)cc(Br)c1 ZINC000565112224 938651107 /nfs/dbraw/zinc/65/11/07/938651107.db2.gz QVULSECGKBLVEN-HONMWMINSA-N -1 3 358.663 3.788 20 0 FHADHM COC(=O)c1cc(C)nc2nc(S[C@H]3C=CCCCCC3)[n-]c(=O)c12 ZINC000584278611 938666004 /nfs/dbraw/zinc/66/60/04/938666004.db2.gz WAMMDAZIUADONU-LBPRGKRZSA-N -1 3 359.451 3.806 20 0 FHADHM O=C(c1c([O-])cccc1O)N1CCC[C@@H](COc2ccccc2Cl)C1 ZINC000092126090 938911499 /nfs/dbraw/zinc/91/14/99/938911499.db2.gz RTVWEMKKGXNIRQ-CYBMUJFWSA-N -1 3 361.825 3.682 20 0 FHADHM O=C(c1c([O-])cccc1O)N1CCC[C@H](COc2ccccc2Cl)C1 ZINC000092126092 938911680 /nfs/dbraw/zinc/91/16/80/938911680.db2.gz RTVWEMKKGXNIRQ-ZDUSSCGKSA-N -1 3 361.825 3.682 20 0 FHADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CCCC[C@@H]1CCO ZINC000093940993 938932064 /nfs/dbraw/zinc/93/20/64/938932064.db2.gz YBMQYWPAJWYIMO-LJQANCHMSA-N -1 3 353.462 3.555 20 0 FHADHM CC(=O)Nc1ccc(Cl)c(NC(=O)c2ccc3c(c2[O-])OC(C)(C)C3)c1 ZINC000094036686 938932857 /nfs/dbraw/zinc/93/28/57/938932857.db2.gz NIDGHRRWDXCTGB-UHFFFAOYSA-N -1 3 374.824 3.970 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2cccc(Br)c2C)cc1 ZINC000171013087 938935316 /nfs/dbraw/zinc/93/53/16/938935316.db2.gz AMAUEEDPYSROOJ-UHFFFAOYSA-N -1 3 356.241 3.567 20 0 FHADHM O=C(N=c1cc(-c2cc(F)cc(F)c2)[n-][nH]1)c1ccn(C2CCCCC2)n1 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Cc1ccc(CNCc2c(F)ccc([O-])c2F)c(OC[C@H]2CCCO2)c1 ZINC000511643676 943980865 /nfs/dbraw/zinc/98/08/65/943980865.db2.gz AZOCABDFQTWTIV-OAHLLOKOSA-N -1 3 363.404 3.826 20 0 FHADHM Cc1cc(F)c(CNC[C@H](Cc2ccccc2Cl)C(=O)[O-])c(F)c1 ZINC000424620349 944015676 /nfs/dbraw/zinc/01/56/76/944015676.db2.gz OPJBSWRKWMCHEH-ZDUSSCGKSA-N -1 3 353.796 3.960 20 0 FHADHM O=C(Nc1ccc(Oc2ccccc2F)nc1)c1cc(F)cc2n[n-]nc21 ZINC000505075362 944018099 /nfs/dbraw/zinc/01/80/99/944018099.db2.gz DWUIVQKSPXVGCA-UHFFFAOYSA-N -1 3 367.315 3.676 20 0 FHADHM COC(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2OCC2CCC2)[n-]1 ZINC000505102439 944040737 /nfs/dbraw/zinc/04/07/37/944040737.db2.gz AHYKGDRBPNIXPS-UHFFFAOYSA-N -1 3 362.813 3.886 20 0 FHADHM CC(F)(F)c1cccc([N-]S(=O)(=O)c2ccc3c(c2)CCCO3)c1 ZINC000436161682 944066788 /nfs/dbraw/zinc/06/67/88/944066788.db2.gz PHUUZCXGROASMJ-UHFFFAOYSA-N -1 3 353.390 3.924 20 0 FHADHM Cc1cn2cc(C(=O)[N-]c3nnc(CC4CCCCC4)s3)sc2n1 ZINC000505201520 944132127 /nfs/dbraw/zinc/13/21/27/944132127.db2.gz 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COc1ccc(C(=O)N2CCCC2)cc1NC(=O)c1ccc(C)c(C)c1[O-] ZINC000436540217 944418436 /nfs/dbraw/zinc/41/84/36/944418436.db2.gz OPESWTIVIITART-UHFFFAOYSA-N -1 3 368.433 3.506 20 0 FHADHM CC1(C2([N-]S(=O)(=O)c3ccc(Cl)cc3C(F)(F)F)CC2)CC1 ZINC001211842642 944426501 /nfs/dbraw/zinc/42/65/01/944426501.db2.gz DUUGNBOVVQNGCH-UHFFFAOYSA-N -1 3 353.793 3.970 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc([C@H](C)N3CCOCC3)cc2)c([O-])c1C ZINC000436567087 944432254 /nfs/dbraw/zinc/43/22/54/944432254.db2.gz XSLUSPKKPNNPIT-INIZCTEOSA-N -1 3 354.450 3.655 20 0 FHADHM C[S@@](=O)c1ccc(NC(=O)c2cc(Cc3ccccc3)ccc2[O-])cc1 ZINC000436591780 944438166 /nfs/dbraw/zinc/43/81/66/944438166.db2.gz RKIYWSHVXZKTDT-AREMUKBSSA-N -1 3 365.454 3.973 20 0 FHADHM CC[C@H](C)C(=O)Nc1cccc(CNC(=O)c2ccc(C(C)=O)c([O-])c2)c1 ZINC000436593613 944438988 /nfs/dbraw/zinc/43/89/88/944438988.db2.gz CYOILXWUKPTICS-ZDUSSCGKSA-N -1 3 368.433 3.509 20 0 FHADHM COCc1nc(CNC(=O)c2cc(Oc3ccccc3)ccc2[O-])cs1 ZINC000436598658 944442737 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O=C(c1ccccc1[O-])N1CCN(Cc2c(Cl)cccc2Cl)CC1 ZINC000436696194 944537243 /nfs/dbraw/zinc/53/72/43/944537243.db2.gz HSSNNRVZUHNPAN-UHFFFAOYSA-N -1 3 365.260 3.657 20 0 FHADHM Cn1cncc1C(=O)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000436707419 944547864 /nfs/dbraw/zinc/54/78/64/944547864.db2.gz RLALHYMIKTYWRI-UHFFFAOYSA-N -1 3 350.403 3.655 20 0 FHADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1CCC[C@@H]1[C@H]1CCCO1 ZINC000436711426 944551956 /nfs/dbraw/zinc/55/19/56/944551956.db2.gz HSNIUEXGVOURJA-UYAOXDASSA-N -1 3 353.418 3.968 20 0 FHADHM Cc1ccc(C(=O)N[C@H](c2nccn2C)c2ccc(Cl)cc2)c([O-])c1 ZINC000436716007 944554634 /nfs/dbraw/zinc/55/46/34/944554634.db2.gz NSLGPDDBRILTRH-KRWDZBQOSA-N -1 3 355.825 3.607 20 0 FHADHM O=S(=O)([N-]c1ccc(Br)cc1Cl)c1ccsc1 ZINC000506555771 944564099 /nfs/dbraw/zinc/56/40/99/944564099.db2.gz PVKLIIWDCGHELK-UHFFFAOYSA-N -1 3 352.662 3.965 20 0 FHADHM CCc1ccc(C(=O)Nc2ccc(N(C(C)=O)[C@H]3C[C@@H]3C)cc2)c([O-])c1 ZINC000436735834 944565736 /nfs/dbraw/zinc/56/57/36/944565736.db2.gz DOIWKUOKNXLDCZ-DJJJIMSYSA-N -1 3 352.434 3.968 20 0 FHADHM CC[C@@H](c1ccccc1OC)N(C)C(=O)c1cc(OC)c([O-])c(OC)c1 ZINC000436737440 944567432 /nfs/dbraw/zinc/56/74/32/944567432.db2.gz JOHIDAXIDUIWEZ-HNNXBMFYSA-N -1 3 359.422 3.641 20 0 FHADHM Cc1oncc1C(=O)Nc1ccc([O-])c(C(=O)N2CCCCC(C)(C)C2)c1 ZINC000438394157 944574549 /nfs/dbraw/zinc/57/45/49/944574549.db2.gz HNCFUFMKWFQSAQ-UHFFFAOYSA-N -1 3 371.437 3.593 20 0 FHADHM CC(C)c1ccc(C(=O)N(Cc2ccccc2)CC2(CO)CC2)c([O-])c1 ZINC000436730072 944575294 /nfs/dbraw/zinc/57/52/94/944575294.db2.gz JICCDFSWPQWQGX-UHFFFAOYSA-N -1 3 353.462 3.931 20 0 FHADHM COc1cccc(C(=O)Nc2ccc(C)c(C(=O)N3CCCCC3)c2)c1[O-] ZINC000436730428 944577147 /nfs/dbraw/zinc/57/71/47/944577147.db2.gz WSKDKMBSOKYWAT-UHFFFAOYSA-N -1 3 368.433 3.588 20 0 FHADHM O=C(NC[C@H](c1ccco1)N1CCCC1)c1ccc2ccccc2c1[O-] ZINC000436757980 944580127 /nfs/dbraw/zinc/58/01/27/944580127.db2.gz WYIGQFOIWLMYKS-GOSISDBHSA-N -1 3 350.418 3.705 20 0 FHADHM COc1ccc(C(=O)N[C@H](C)Cc2cccc(Br)c2)c([O-])c1 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Cc1cccc(C)c1[N-]S(=O)(=O)c1ccc(NC(=O)CC2CC2)cc1 ZINC000516370156 944770433 /nfs/dbraw/zinc/77/04/33/944770433.db2.gz GOHAHIJILNKZAQ-UHFFFAOYSA-N -1 3 358.463 3.843 20 0 FHADHM COc1ccc(C(=O)NCCCO[C@H]2CCCc3ccccc32)c([O-])c1 ZINC000436903949 944772973 /nfs/dbraw/zinc/77/29/73/944772973.db2.gz JTYWXAGHPNCDNA-FQEVSTJZSA-N -1 3 355.434 3.615 20 0 FHADHM C[C@@]1(C(=O)[O-])CCCC[C@H]1NCc1csc(COc2ccccc2)n1 ZINC000426752932 944772936 /nfs/dbraw/zinc/77/29/36/944772936.db2.gz GHBSSYLMTPOPED-VQIMIIECSA-N -1 3 360.479 3.845 20 0 FHADHM COc1ccc([C@@H](CCC(=O)[O-])NCc2cnn(-c3ccccc3)c2)cc1 ZINC000426753040 944773314 /nfs/dbraw/zinc/77/33/14/944773314.db2.gz CCADERGYGKIEJK-HXUWFJFHSA-N -1 3 365.433 3.577 20 0 FHADHM COc1ccc([C@H](CCC(=O)[O-])NCc2cc3ccccc3[nH]c2=O)cc1 ZINC000426753587 944774401 /nfs/dbraw/zinc/77/44/01/944774401.db2.gz JKCGCEVISVTINY-SFHVURJKSA-N -1 3 366.417 3.645 20 0 FHADHM COc1cc(CN[C@H](C(=O)[O-])c2cc(C)cc(C)c2)cc(Cl)c1OC ZINC000426761605 944784482 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CCN(Cc1cccc(NC(=O)c2ccc3c(c2[O-])CCCC3)c1)C(C)=O ZINC000436951371 944818225 /nfs/dbraw/zinc/81/82/25/944818225.db2.gz QAYHQTNDHJEJST-UHFFFAOYSA-N -1 3 366.461 3.892 20 0 FHADHM O=C(c1ccccc1[O-])N1CCC(Nc2ccc(C(F)(F)F)cn2)CC1 ZINC000436941936 944828316 /nfs/dbraw/zinc/82/83/16/944828316.db2.gz GXKSCNGGEWNDEI-UHFFFAOYSA-N -1 3 365.355 3.523 20 0 FHADHM CCOc1cc(CN[C@H](C(=O)[O-])c2cccs2)cc(Cl)c1OC ZINC000426812586 944834886 /nfs/dbraw/zinc/83/48/86/944834886.db2.gz RBBFDQHARBZNDN-AWEZNQCLSA-N -1 3 355.843 3.724 20 0 FHADHM CC(C)CCOc1ccccc1CNC(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000506641020 944840094 /nfs/dbraw/zinc/84/00/94/944840094.db2.gz DHQNTGFOSPYCBF-UHFFFAOYSA-N -1 3 364.445 3.883 20 0 FHADHM COCCCCC[N-]S(=O)(=O)c1csc(-c2ccc(Cl)cc2)n1 ZINC000500416762 944842175 /nfs/dbraw/zinc/84/21/75/944842175.db2.gz PGCUUEBRAGNEJN-UHFFFAOYSA-N -1 3 374.915 3.559 20 0 FHADHM O=C(NCCCOC[C@@H]1CCCO1)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436951955 944847310 /nfs/dbraw/zinc/84/73/10/944847310.db2.gz 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946683477 /nfs/dbraw/zinc/68/34/77/946683477.db2.gz QAJHTVSNRVDMRK-HOTGVXAUSA-N -1 3 363.465 3.703 20 0 FHADHM CSc1ccc([O-])c(C(=O)N2CCCN(c3ccccc3F)CC2)c1 ZINC000614788442 946708886 /nfs/dbraw/zinc/70/88/86/946708886.db2.gz VRUWMXKLKUWRQD-UHFFFAOYSA-N -1 3 360.454 3.606 20 0 FHADHM Cc1cc(C)n(-c2ccc([N-]S(=O)(=O)c3cc(F)ccc3C)cc2)n1 ZINC000614780694 946710885 /nfs/dbraw/zinc/71/08/85/946710885.db2.gz IAXFPORNAKJXLV-UHFFFAOYSA-N -1 3 359.426 3.737 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2cccc(-c3nc(C)cs3)c2)cc1 ZINC000102321029 946711170 /nfs/dbraw/zinc/71/11/70/946711170.db2.gz KQNBSZSWUFMUPZ-UHFFFAOYSA-N -1 3 360.460 3.928 20 0 FHADHM O=C(Nc1nnc(C(F)(F)F)[n-]1)c1csc(-c2cccc(Cl)c2)n1 ZINC000050603568 946714066 /nfs/dbraw/zinc/71/40/66/946714066.db2.gz ZVEIXZQHDGZEMV-UHFFFAOYSA-N -1 3 373.747 3.853 20 0 FHADHM O=C(Nc1nc(C(F)(F)F)n[n-]1)c1csc(-c2cccc(Cl)c2)n1 ZINC000050603568 946714072 /nfs/dbraw/zinc/71/40/72/946714072.db2.gz ZVEIXZQHDGZEMV-UHFFFAOYSA-N -1 3 373.747 3.853 20 0 FHADHM CCOc1cc(CN2CCC(CCC(=O)[O-])CC2)ccc1OC(F)F ZINC000327005698 946738817 /nfs/dbraw/zinc/73/88/17/946738817.db2.gz BKEDGGAQBHUKHP-UHFFFAOYSA-N -1 3 357.397 3.764 20 0 FHADHM C[C@H](NC(=O)N1CC=CCC1)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824492457 946742033 /nfs/dbraw/zinc/74/20/33/946742033.db2.gz ZFLYOBOSPQWZCD-HNNXBMFYSA-N -1 3 374.448 3.566 20 0 FHADHM C[C@H](NC(=O)N1CC=CCC1)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824492457 946742042 /nfs/dbraw/zinc/74/20/42/946742042.db2.gz ZFLYOBOSPQWZCD-HNNXBMFYSA-N -1 3 374.448 3.566 20 0 FHADHM C[C@@H](NC(=O)c1ccoc1)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824521210 946757353 /nfs/dbraw/zinc/75/73/53/946757353.db2.gz HZOPRLJQVXVQNU-CYBMUJFWSA-N -1 3 359.389 3.618 20 0 FHADHM C[C@@H](NC(=O)c1ccoc1)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824521210 946757364 /nfs/dbraw/zinc/75/73/64/946757364.db2.gz HZOPRLJQVXVQNU-CYBMUJFWSA-N -1 3 359.389 3.618 20 0 FHADHM Cc1cccc(C2(C(=O)Nc3ccc(Cc4nnn[n-]4)cc3)CCCC2)c1 ZINC000473932452 946777903 /nfs/dbraw/zinc/77/79/03/946777903.db2.gz LTQVOASLZUWNBH-UHFFFAOYSA-N -1 3 361.449 3.549 20 0 FHADHM Cc1cccc(C2(C(=O)Nc3ccc(Cc4nn[n-]n4)cc3)CCCC2)c1 ZINC000473932452 946777908 /nfs/dbraw/zinc/77/79/08/946777908.db2.gz LTQVOASLZUWNBH-UHFFFAOYSA-N -1 3 361.449 3.549 20 0 FHADHM C[C@H](N[C@H](c1cccc(F)c1)c1ccccn1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824540084 946779297 /nfs/dbraw/zinc/77/92/97/946779297.db2.gz RKCHRFYCGKTBHV-VBKZILBWSA-N -1 3 374.423 3.841 20 0 FHADHM CCOc1cc(CNC(C)(C)c2nc(C)cc(=O)[n-]2)ccc1OCC(C)C ZINC000628374560 946781362 /nfs/dbraw/zinc/78/13/62/946781362.db2.gz PYRWJCRWLRYKOJ-UHFFFAOYSA-N -1 3 373.497 3.949 20 0 FHADHM Cc1cc(S(=O)(=O)[N-]Cc2cccc(-c3ncc[nH]3)c2)sc1Cl ZINC000473936280 946818429 /nfs/dbraw/zinc/81/84/29/946818429.db2.gz HQUAHWCFJCNWHO-UHFFFAOYSA-N -1 3 367.883 3.579 20 0 FHADHM O=c1[n-]c(CN2CCC[C@@H]([C@@H]3CCCCO3)C2)nc2c3ccccc3oc21 ZINC000661876384 946825914 /nfs/dbraw/zinc/82/59/14/946825914.db2.gz RGAVENVHIPRCEK-ZBFHGGJFSA-N -1 3 367.449 3.863 20 0 FHADHM C[C@@H](Nc1ccc(N2CCCC2)cc1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824657962 946886351 /nfs/dbraw/zinc/88/63/51/946886351.db2.gz TVRXVDCFCRUTCH-CYBMUJFWSA-N -1 3 352.417 3.779 20 0 FHADHM C[C@@H](Nc1ccc(N2CCCC2)cc1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824657962 946886364 /nfs/dbraw/zinc/88/63/64/946886364.db2.gz TVRXVDCFCRUTCH-CYBMUJFWSA-N -1 3 352.417 3.779 20 0 FHADHM O=C(Nc1cccc(CNCc2ncccc2[O-])c1)c1ccc(Cl)cc1 ZINC000475341490 946911016 /nfs/dbraw/zinc/91/10/16/946911016.db2.gz CEZPGCKXQUEGTJ-UHFFFAOYSA-N -1 3 367.836 3.983 20 0 FHADHM C[C@@H](NC(=O)C1CC(C)C1)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824867636 946962672 /nfs/dbraw/zinc/96/26/72/946962672.db2.gz PUHZAYSIWKHGAM-SHYRYGCCSA-N -1 3 361.449 3.757 20 0 FHADHM C[C@@H](NC(=O)C1CC(C)C1)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824867636 946962679 /nfs/dbraw/zinc/96/26/79/946962679.db2.gz PUHZAYSIWKHGAM-SHYRYGCCSA-N -1 3 361.449 3.757 20 0 FHADHM CN(CCOc1ccc(Br)cc1)Cc1ccc(C(=O)[O-])s1 ZINC000652375877 946974807 /nfs/dbraw/zinc/97/48/07/946974807.db2.gz FIVMHIBAGAMRJB-UHFFFAOYSA-N -1 3 370.268 3.720 20 0 FHADHM Cc1nc(C)c(CC(=O)N2C[C@@H](c3ccccc3)c3ccccc32)c(=O)[n-]1 ZINC000444513018 946984477 /nfs/dbraw/zinc/98/44/77/946984477.db2.gz NXNZDDZJHTUGRO-IBGZPJMESA-N -1 3 359.429 3.520 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CC[C@H](C)C2)c1ccccc1 ZINC000824966632 947006999 /nfs/dbraw/zinc/00/69/99/947006999.db2.gz CTKBUPGFEIVXIO-RYUDHWBXSA-N -1 3 367.478 3.795 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CC[C@H](C)C2)c1ccccc1 ZINC000824966632 947007011 /nfs/dbraw/zinc/00/70/11/947007011.db2.gz CTKBUPGFEIVXIO-RYUDHWBXSA-N -1 3 367.478 3.795 20 0 FHADHM Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)N(C)Cc1ccc(F)c(Cl)c1 ZINC000432265302 947020984 /nfs/dbraw/zinc/02/09/84/947020984.db2.gz RRUVKSYTVRBHRG-UHFFFAOYSA-N -1 3 365.836 3.853 20 0 FHADHM O=C([O-])[C@@H]1CN(C(=O)c2cccc(CN3CCCCC3)c2)c2ccccc21 ZINC000909579911 947129510 /nfs/dbraw/zinc/12/95/10/947129510.db2.gz KQTRATFUARMXDG-LJQANCHMSA-N -1 3 364.445 3.501 20 0 FHADHM CCCOc1ccc([C@H](C)Nc2nccc(C)c2-c2nnn[n-]2)cc1OC ZINC000825339372 947158915 /nfs/dbraw/zinc/15/89/15/947158915.db2.gz XYUSWLNRNFTWSG-ZDUSSCGKSA-N -1 3 368.441 3.541 20 0 FHADHM CCCOc1ccc([C@H](C)Nc2nccc(C)c2-c2nn[n-]n2)cc1OC ZINC000825339372 947158921 /nfs/dbraw/zinc/15/89/21/947158921.db2.gz XYUSWLNRNFTWSG-ZDUSSCGKSA-N -1 3 368.441 3.541 20 0 FHADHM C[C@@H]1CCCCN(C(=O)c2c[n-]c3ccc(Br)cc3c2=O)C1 ZINC000444362410 947179828 /nfs/dbraw/zinc/17/98/28/947179828.db2.gz HCMXYZJPZRLAQK-LLVKDONJSA-N -1 3 363.255 3.553 20 0 FHADHM CCNc1ccc(Cl)cc1NC(=O)CCc1ccc(-c2nnn[n-]2)cc1 ZINC000825481272 947200191 /nfs/dbraw/zinc/20/01/91/947200191.db2.gz VLAGKQBOBGWSHY-UHFFFAOYSA-N -1 3 370.844 3.523 20 0 FHADHM CCNc1ccc(Cl)cc1NC(=O)CCc1ccc(-c2nn[n-]n2)cc1 ZINC000825481272 947200206 /nfs/dbraw/zinc/20/02/06/947200206.db2.gz VLAGKQBOBGWSHY-UHFFFAOYSA-N -1 3 370.844 3.523 20 0 FHADHM COc1cccc(C(=O)c2ccc(C(=O)Nc3nc(C)ccc3[O-])cc2)c1 ZINC000444769281 947204973 /nfs/dbraw/zinc/20/49/73/947204973.db2.gz HUSJZZQNJCRLOE-UHFFFAOYSA-N -1 3 362.385 3.588 20 0 FHADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)[C@H]1CCCN(CC(F)(F)F)C1 ZINC000330533427 947211466 /nfs/dbraw/zinc/21/14/66/947211466.db2.gz ULOZPQNNXYYVTG-VIFPVBQESA-N -1 3 370.293 3.624 20 0 FHADHM O=S(=O)([N-]Cc1ccn(C2CCCC2)n1)c1cc(Cl)ccc1Cl ZINC000125669796 947256896 /nfs/dbraw/zinc/25/68/96/947256896.db2.gz VNZYTCVMGOYSIJ-UHFFFAOYSA-N -1 3 374.293 3.784 20 0 FHADHM CC(C)[C@@H]1C[C@H](CC(=O)Nc2cc(Br)ccc2[O-])CCO1 ZINC000330805726 947278050 /nfs/dbraw/zinc/27/80/50/947278050.db2.gz JRMKRNOZMKPNDD-ABAIWWIYSA-N -1 3 356.260 3.935 20 0 FHADHM Cc1cn2cc([N-]S(=O)(=O)c3ccc(F)c(C(F)(F)F)c3)ccc2n1 ZINC000523459755 947281989 /nfs/dbraw/zinc/28/19/89/947281989.db2.gz VMAUGLRMNHQIRU-UHFFFAOYSA-N -1 3 373.331 3.601 20 0 FHADHM CCc1c(C)sc(NC(=O)CCCc2ccsc2)c1-c1nnn[n-]1 ZINC000825687348 947289659 /nfs/dbraw/zinc/28/96/59/947289659.db2.gz HIQGUBYMPHHLPZ-UHFFFAOYSA-N -1 3 361.496 3.822 20 0 FHADHM CCc1c(C)sc(NC(=O)CCCc2ccsc2)c1-c1nn[n-]n1 ZINC000825687348 947289664 /nfs/dbraw/zinc/28/96/64/947289664.db2.gz HIQGUBYMPHHLPZ-UHFFFAOYSA-N -1 3 361.496 3.822 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@H](O)c3ccccc3Cl)nc2)n1 ZINC000301359181 947306318 /nfs/dbraw/zinc/30/63/18/947306318.db2.gz OAWGBAYBXHEPPO-INIZCTEOSA-N -1 3 370.840 3.606 20 0 FHADHM CN(C[C@H]1CC=CCC1)C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825908532 947366307 /nfs/dbraw/zinc/36/63/07/947366307.db2.gz JBOMPKPVCAGBRU-NSHDSACASA-N -1 3 362.890 3.505 20 0 FHADHM CN(C[C@H]1CC=CCC1)C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825908532 947366319 /nfs/dbraw/zinc/36/63/19/947366319.db2.gz JBOMPKPVCAGBRU-NSHDSACASA-N -1 3 362.890 3.505 20 0 FHADHM COCCOc1ccc(-c2nnn[n-]2)cc1N[C@H](C)c1ccccc1Cl ZINC000826162158 947509566 /nfs/dbraw/zinc/50/95/66/947509566.db2.gz PLFHBBLASHHTFK-GFCCVEGCSA-N -1 3 373.844 3.718 20 0 FHADHM COCCOc1ccc(-c2nn[n-]n2)cc1N[C@H](C)c1ccccc1Cl ZINC000826162158 947509578 /nfs/dbraw/zinc/50/95/78/947509578.db2.gz PLFHBBLASHHTFK-GFCCVEGCSA-N -1 3 373.844 3.718 20 0 FHADHM COc1cc(C(=O)N(C)[C@H](C)CSc2ccccc2)cc(OC)c1[O-] ZINC000652622501 947523861 /nfs/dbraw/zinc/52/38/61/947523861.db2.gz MEAYNWBHDVRAQY-CYBMUJFWSA-N -1 3 361.463 3.662 20 0 FHADHM CCOC(=O)c1ccc(NC(=O)[C@@H]2CCCC[C@H]2C(F)(F)F)c([O-])c1 ZINC000536337346 947534858 /nfs/dbraw/zinc/53/48/58/947534858.db2.gz XLIAWFYQCPNCOX-VXGBXAGGSA-N -1 3 359.344 3.876 20 0 FHADHM C[C@H]1CCN(Cc2oc3ccccc3c2Br)C[C@@H]1C(=O)[O-] ZINC000662211017 947543931 /nfs/dbraw/zinc/54/39/31/947543931.db2.gz CDHWTQABKRCUJD-JQWIXIFHSA-N -1 3 352.228 3.738 20 0 FHADHM C[C@H]1CCN(Cc2oc3ccccc3c2Br)C[C@H]1C(=O)[O-] ZINC000662211016 947544313 /nfs/dbraw/zinc/54/43/13/947544313.db2.gz CDHWTQABKRCUJD-CMPLNLGQSA-N -1 3 352.228 3.738 20 0 FHADHM COC1CCC(N(C)C(=O)Nc2ccc(-c3cc(=O)[n-]c(C)n3)cc2)CC1 ZINC000523731985 947552584 /nfs/dbraw/zinc/55/25/84/947552584.db2.gz KHRMJASMBXSQPQ-UHFFFAOYSA-N -1 3 370.453 3.579 20 0 FHADHM O=C([O-])CC[C@H](CNCc1cccc(Br)c1F)C(F)(F)F ZINC000663261550 947584423 /nfs/dbraw/zinc/58/44/23/947584423.db2.gz KWWFIOMDCPYBQW-SECBINFHSA-N -1 3 372.156 3.721 20 0 FHADHM COc1cc(CN[C@H](C(=O)[O-])c2cccc(C(F)(F)F)c2)ccc1C ZINC000663263003 947592987 /nfs/dbraw/zinc/59/29/87/947592987.db2.gz XGUDRMCDBIAIHP-INIZCTEOSA-N -1 3 353.340 3.938 20 0 FHADHM [O-]c1cncc(/C=C/c2nc(Cc3nc4ccccc4n3C(F)F)no2)c1 ZINC000445207286 947604741 /nfs/dbraw/zinc/60/47/41/947604741.db2.gz YJZUDLJXLIWDPX-AATRIKPKSA-N -1 3 369.331 3.676 20 0 FHADHM CSc1ccc(C)c(NC(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)c1 ZINC000826230564 947674275 /nfs/dbraw/zinc/67/42/75/947674275.db2.gz ZGSNOKYFEROGDS-UHFFFAOYSA-N -1 3 358.402 3.680 20 0 FHADHM CSc1ccc(C)c(NC(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)c1 ZINC000826230564 947674287 /nfs/dbraw/zinc/67/42/87/947674287.db2.gz ZGSNOKYFEROGDS-UHFFFAOYSA-N -1 3 358.402 3.680 20 0 FHADHM CC(=Cc1ccc(C)cc1)C(=O)Nc1ccc(Cl)cc1-c1nnn[n-]1 ZINC001573366922 947749489 /nfs/dbraw/zinc/74/94/89/947749489.db2.gz VLIWJCQKZQUKMF-FMIVXFBMSA-N -1 3 353.813 3.871 20 0 FHADHM CC(=Cc1ccc(C)cc1)C(=O)Nc1ccc(Cl)cc1-c1nn[n-]n1 ZINC001573366922 947749495 /nfs/dbraw/zinc/74/94/95/947749495.db2.gz VLIWJCQKZQUKMF-FMIVXFBMSA-N -1 3 353.813 3.871 20 0 FHADHM Cc1ccc(C2CCN(c3cc(-c4nnn[n-]4)nc4ccccc43)CC2)cn1 ZINC000826285625 947822551 /nfs/dbraw/zinc/82/25/51/947822551.db2.gz FHARZZGFGIKYPG-UHFFFAOYSA-N -1 3 371.448 3.502 20 0 FHADHM CCc1onc(C)c1C(=O)[N-]c1nnc(Cc2ccc(Cl)cc2)s1 ZINC000189783728 947836730 /nfs/dbraw/zinc/83/67/30/947836730.db2.gz PBKWHKGAQGQYAD-UHFFFAOYSA-N -1 3 362.842 3.893 20 0 FHADHM CCCCOc1ccc(C(=O)NCC(=O)Nc2c(C)cccc2C)c([O-])c1 ZINC000190011642 947909978 /nfs/dbraw/zinc/90/99/78/947909978.db2.gz KZAKUGSWWQZIRR-UHFFFAOYSA-N -1 3 370.449 3.556 20 0 FHADHM C[C@@H](C(=O)NC(C)(C)Cc1ccc(-c2nnn[n-]2)cc1)[C@@H](C)C(C)(C)C ZINC001573652495 947939371 /nfs/dbraw/zinc/93/93/71/947939371.db2.gz CUUJADNLBBAFNQ-ZIAGYGMSSA-N -1 3 357.502 3.622 20 0 FHADHM C[C@@H](C(=O)NC(C)(C)Cc1ccc(-c2nn[n-]n2)cc1)[C@@H](C)C(C)(C)C ZINC001573652495 947939376 /nfs/dbraw/zinc/93/93/76/947939376.db2.gz CUUJADNLBBAFNQ-ZIAGYGMSSA-N -1 3 357.502 3.622 20 0 FHADHM Cc1nc(C(C)C)sc1[C@H](C)OC(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000826323396 947945978 /nfs/dbraw/zinc/94/59/78/947945978.db2.gz CIHJVXARVFFHAF-NSHDSACASA-N -1 3 357.439 3.673 20 0 FHADHM Cc1nc(C(C)C)sc1[C@H](C)OC(=O)c1cccc(-c2nn[n-]n2)c1 ZINC000826323396 947945982 /nfs/dbraw/zinc/94/59/82/947945982.db2.gz CIHJVXARVFFHAF-NSHDSACASA-N -1 3 357.439 3.673 20 0 FHADHM Cc1nc(C(C)C)sc1[C@H](C)OC(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000826323920 947947056 /nfs/dbraw/zinc/94/70/56/947947056.db2.gz XKFULDIMLILZLU-NSHDSACASA-N -1 3 357.439 3.673 20 0 FHADHM Cc1nc(C(C)C)sc1[C@H](C)OC(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC000826323920 947947062 /nfs/dbraw/zinc/94/70/62/947947062.db2.gz XKFULDIMLILZLU-NSHDSACASA-N -1 3 357.439 3.673 20 0 FHADHM Cc1cc([C@H]2CCCN2Cc2nc3c4ccccc4oc3c(=O)[n-]2)no1 ZINC000027886318 947953786 /nfs/dbraw/zinc/95/37/86/947953786.db2.gz DVJBENHJBMTLLT-CQSZACIVSA-N -1 3 350.378 3.715 20 0 FHADHM Cc1cc(C)c(C(=O)CCCC(=O)N[N-]C(=O)c2ccccc2F)c(C)c1 ZINC000053999261 948134568 /nfs/dbraw/zinc/13/45/68/948134568.db2.gz APHMSEBYGYXAPX-UHFFFAOYSA-N -1 3 370.424 3.565 20 0 FHADHM FC(F)(F)c1ccc(NCc2ccc(Cl)cn2)c(-c2nnn[n-]2)c1 ZINC000826368955 948151354 /nfs/dbraw/zinc/15/13/54/948151354.db2.gz HOOTYNJZNMDZHJ-UHFFFAOYSA-N -1 3 354.723 3.546 20 0 FHADHM FC(F)(F)c1ccc(NCc2ccc(Cl)cn2)c(-c2nn[n-]n2)c1 ZINC000826368955 948151360 /nfs/dbraw/zinc/15/13/60/948151360.db2.gz HOOTYNJZNMDZHJ-UHFFFAOYSA-N -1 3 354.723 3.546 20 0 FHADHM Fc1ccc(F)c(CN[C@H](c2cccc(-c3nnn[n-]3)c2)C(F)(F)F)c1 ZINC000826374927 948162728 /nfs/dbraw/zinc/16/27/28/948162728.db2.gz RWNWRPOKZJINHH-CQSZACIVSA-N -1 3 369.297 3.538 20 0 FHADHM Fc1ccc(F)c(CN[C@H](c2cccc(-c3nn[n-]n3)c2)C(F)(F)F)c1 ZINC000826374927 948162735 /nfs/dbraw/zinc/16/27/35/948162735.db2.gz RWNWRPOKZJINHH-CQSZACIVSA-N -1 3 369.297 3.538 20 0 FHADHM Fc1ccc(CN[C@H](c2cccc(-c3nnn[n-]3)c2)C(F)(F)F)c(F)c1 ZINC000826375101 948163229 /nfs/dbraw/zinc/16/32/29/948163229.db2.gz ZNJNDSYNKKJBLI-CQSZACIVSA-N -1 3 369.297 3.538 20 0 FHADHM Fc1ccc(CN[C@H](c2cccc(-c3nn[n-]n3)c2)C(F)(F)F)c(F)c1 ZINC000826375101 948163236 /nfs/dbraw/zinc/16/32/36/948163236.db2.gz ZNJNDSYNKKJBLI-CQSZACIVSA-N -1 3 369.297 3.538 20 0 FHADHM CCc1ccc(C(C)(C)CNC(=O)c2cc(OC)c([O-])c(OC)c2)cc1 ZINC000152323949 948220692 /nfs/dbraw/zinc/22/06/92/948220692.db2.gz UIWRRWWJVSSMAO-UHFFFAOYSA-N -1 3 357.450 3.679 20 0 FHADHM C[C@@H](OC(C)(C)C)[C@H](NCc1ccc(F)c(Cl)c1Cl)C(=O)[O-] ZINC000417582147 948293361 /nfs/dbraw/zinc/29/33/61/948293361.db2.gz HOQBPRZVKVMUIG-OQPBUACISA-N -1 3 352.233 3.879 20 0 FHADHM CCC(=O)c1cccc(S(=O)(=O)[N-][C@@H](C2CCCC2)C(F)(F)F)c1 ZINC000544664128 948299483 /nfs/dbraw/zinc/29/94/83/948299483.db2.gz CMFPFIXHQVWAQA-HNNXBMFYSA-N -1 3 363.401 3.679 20 0 FHADHM CC(C)(C)OC(=O)CC[C@@H](NCc1ccc(Cl)cc1Cl)C(=O)[O-] ZINC000417628451 948362307 /nfs/dbraw/zinc/36/23/07/948362307.db2.gz URKMBQWTUYSHEO-CYBMUJFWSA-N -1 3 362.253 3.658 20 0 FHADHM O=S(=O)([N-]Cc1ccccc1OC1CCCC1)c1ccc(F)cc1F ZINC000614619367 948397428 /nfs/dbraw/zinc/39/74/28/948397428.db2.gz DSKBAFZEMTZJFK-UHFFFAOYSA-N -1 3 367.417 3.765 20 0 FHADHM O=C(Nc1cc(-c2nnn[n-]2)ccc1F)c1cc(Cl)cc(Cl)c1 ZINC001129611076 948469417 /nfs/dbraw/zinc/46/94/17/948469417.db2.gz UPDKPEHXOSHSBG-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1cc(-c2nn[n-]n2)ccc1F)c1cc(Cl)cc(Cl)c1 ZINC001129611076 948469419 /nfs/dbraw/zinc/46/94/19/948469419.db2.gz UPDKPEHXOSHSBG-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM CC(C)[C@@H](C(=O)Nc1cc(-c2nnn[n-]2)ccc1F)c1ccc(F)cc1 ZINC001275482814 948496193 /nfs/dbraw/zinc/49/61/93/948496193.db2.gz BYSLGLSGZSNBMI-MRXNPFEDSA-N -1 3 357.364 3.523 20 0 FHADHM CC(C)[C@@H](C(=O)Nc1cc(-c2nn[n-]n2)ccc1F)c1ccc(F)cc1 ZINC001275482814 948496198 /nfs/dbraw/zinc/49/61/98/948496198.db2.gz BYSLGLSGZSNBMI-MRXNPFEDSA-N -1 3 357.364 3.523 20 0 FHADHM CCCc1ccc(S(=O)(=O)[N-]c2cccc3c2OCC[C@H]3N(C)C)cc1 ZINC000432474249 948529495 /nfs/dbraw/zinc/52/94/95/948529495.db2.gz 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FHADHM CCOc1ncc(C(=O)[N-]c2nnc(Cc3ccccc3)s2)cc1Cl ZINC000601937460 567880754 /nfs/dbraw/zinc/88/07/54/567880754.db2.gz IPHPUTSRQRCSJK-UHFFFAOYSA-N -1 3 374.853 3.828 20 0 FHADHM COc1ccc([C@@H](C)[N-]S(=O)(=O)c2ccccc2SC)cc1F ZINC000186888239 567997703 /nfs/dbraw/zinc/99/77/03/567997703.db2.gz QRVOJYTZWAFJCD-LLVKDONJSA-N -1 3 355.456 3.596 20 0 FHADHM O=C(c1cc(F)ccc1Br)N1CCCc2cccc([O-])c21 ZINC000063063774 568148605 /nfs/dbraw/zinc/14/86/05/568148605.db2.gz XVMZXTIAPKGCBW-UHFFFAOYSA-N -1 3 350.187 3.887 20 0 FHADHM C[C@@H]([N-]S(=O)(=O)c1cccnc1C(F)(F)F)[C@H](C)c1ccccc1 ZINC000672388626 568171476 /nfs/dbraw/zinc/17/14/76/568171476.db2.gz DFQRMHHQIVLPSQ-NWDGAFQWSA-N -1 3 358.385 3.571 20 0 FHADHM CSCc1c2ccccc2oc1C(=O)Nc1nnc(-c2ccccn2)[n-]1 ZINC000603904692 568180730 /nfs/dbraw/zinc/18/07/30/568180730.db2.gz POUCJGJEEXRYHR-UHFFFAOYSA-N -1 3 365.418 3.728 20 0 FHADHM CSCc1c2ccccc2oc1C(=O)Nc1nc(-c2ccccn2)n[n-]1 ZINC000603904692 568180731 /nfs/dbraw/zinc/18/07/31/568180731.db2.gz POUCJGJEEXRYHR-UHFFFAOYSA-N -1 3 365.418 3.728 20 0 FHADHM COc1ccccc1-c1cc(=NC(=O)CSCc2ccc(F)cc2)[nH][n-]1 ZINC000604498915 568304918 /nfs/dbraw/zinc/30/49/18/568304918.db2.gz NHGRFTGTLUDYIQ-UHFFFAOYSA-N -1 3 371.437 3.518 20 0 FHADHM CC(C)c1ccc(C(=O)N2CCN(c3cccc(F)c3F)CC2)c([O-])c1 ZINC000604601814 568323830 /nfs/dbraw/zinc/32/38/30/568323830.db2.gz HNKSYQPZZHKARO-UHFFFAOYSA-N -1 3 360.404 3.756 20 0 FHADHM Cc1c(C(=O)Nc2cc(Cl)cc(C)c2[O-])nnn1-c1ccc(C)cc1 ZINC000604901939 568385019 /nfs/dbraw/zinc/38/50/19/568385019.db2.gz HULKQKCBRSXDMN-UHFFFAOYSA-N -1 3 356.813 3.804 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2ccccc2N2CCCC2)c(C)c1C ZINC000605075251 568553548 /nfs/dbraw/zinc/55/35/48/568553548.db2.gz WNEJRAKGPAUFCU-UHFFFAOYSA-N -1 3 360.479 3.713 20 0 FHADHM CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OCC(=O)[N-]c1nncn1Cc1ccccc1 ZINC000605117169 568573043 /nfs/dbraw/zinc/57/30/43/568573043.db2.gz NNUCWEZTDBUYQT-NZSAHSFTSA-N -1 3 370.497 3.742 20 0 FHADHM Cc1ccc([N-]S(C)(=O)=O)c(NC(=O)C2CC3(C2)CCCCC3)c1 ZINC000669204406 568641744 /nfs/dbraw/zinc/64/17/44/568641744.db2.gz IQRHRFFGXGVIGE-UHFFFAOYSA-N -1 3 350.484 3.666 20 0 FHADHM O=C(c1cc(OCc2ccccc2)ccc1[O-])N1CC[C@@H]1C(F)(F)F ZINC000647753948 568709477 /nfs/dbraw/zinc/70/94/77/568709477.db2.gz ZBJPUVFTVSVEHV-MRXNPFEDSA-N -1 3 351.324 3.748 20 0 FHADHM CC[C@H](OC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1ccc(F)cc1F ZINC000736380384 598823671 /nfs/dbraw/zinc/82/36/71/598823671.db2.gz FSGOFWMESZQYEN-JEZWAEDTSA-N -1 3 370.359 3.853 20 0 FHADHM CC[C@H](OC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1ccc(F)cc1F ZINC000736380384 598823672 /nfs/dbraw/zinc/82/36/72/598823672.db2.gz FSGOFWMESZQYEN-JEZWAEDTSA-N -1 3 370.359 3.853 20 0 FHADHM CC(C)[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736103505 598829016 /nfs/dbraw/zinc/82/90/16/598829016.db2.gz YTUCMQBODNGGOA-BEFAXECRSA-N -1 3 363.465 3.559 20 0 FHADHM CC(C)[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736103505 598829018 /nfs/dbraw/zinc/82/90/18/598829018.db2.gz YTUCMQBODNGGOA-BEFAXECRSA-N -1 3 363.465 3.559 20 0 FHADHM CCCCSCCC(=O)N(CCC)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000736463080 598830429 /nfs/dbraw/zinc/83/04/29/598830429.db2.gz MNBIHYIVFITVNQ-UHFFFAOYSA-N -1 3 361.515 3.529 20 0 FHADHM CCCCSCCC(=O)N(CCC)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000736463080 598830430 /nfs/dbraw/zinc/83/04/30/598830430.db2.gz MNBIHYIVFITVNQ-UHFFFAOYSA-N -1 3 361.515 3.529 20 0 FHADHM Cc1cccc([C@@H](C)C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)c1 ZINC000737386219 598831658 /nfs/dbraw/zinc/83/16/58/598831658.db2.gz XGBNUVJQEYXUDP-MRXNPFEDSA-N -1 3 363.465 3.716 20 0 FHADHM Cc1cccc([C@@H](C)C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)c1 ZINC000737386219 598831659 /nfs/dbraw/zinc/83/16/59/598831659.db2.gz XGBNUVJQEYXUDP-MRXNPFEDSA-N -1 3 363.465 3.716 20 0 FHADHM CC1(C(=O)NCc2cccc(-c3ccc(-c4nnn[n-]4)s3)c2)CCCC1 ZINC000736204374 598833625 /nfs/dbraw/zinc/83/36/25/598833625.db2.gz QYCLSKWVQAHSQZ-UHFFFAOYSA-N -1 3 367.478 3.792 20 0 FHADHM C[C@@H](NCc1ccc(-c2nn[n-]n2)o1)c1cc(F)c(Cl)cc1Cl ZINC000820432880 599389866 /nfs/dbraw/zinc/38/98/66/599389866.db2.gz SZRKWZMGHCCILW-SSDOTTSWSA-N -1 3 356.188 3.756 20 0 FHADHM O=C(Nc1ccc(COC2CCCC2)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000738158460 598839515 /nfs/dbraw/zinc/83/95/15/598839515.db2.gz HBOBTPYWFIHIOP-UHFFFAOYSA-N -1 3 363.421 3.578 20 0 FHADHM O=C(Nc1ccc(COC2CCCC2)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000738158460 598839516 /nfs/dbraw/zinc/83/95/16/598839516.db2.gz HBOBTPYWFIHIOP-UHFFFAOYSA-N -1 3 363.421 3.578 20 0 FHADHM CC[C@H](OC(=O)CSCc1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000736384888 598843767 /nfs/dbraw/zinc/84/37/67/598843767.db2.gz ZWGOOZRPSIIXLS-KRWDZBQOSA-N -1 3 368.462 3.794 20 0 FHADHM CC[C@H](OC(=O)CSCc1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000736384888 598843768 /nfs/dbraw/zinc/84/37/68/598843768.db2.gz ZWGOOZRPSIIXLS-KRWDZBQOSA-N -1 3 368.462 3.794 20 0 FHADHM Cc1cc(C)cc(NC(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(F)F)c1 ZINC000737249724 598852894 /nfs/dbraw/zinc/85/28/94/598852894.db2.gz CFJRIICTSUMULF-UHFFFAOYSA-N -1 3 374.351 3.729 20 0 FHADHM Cc1cc(C)cc(NC(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(F)F)c1 ZINC000737249724 598852896 /nfs/dbraw/zinc/85/28/96/598852896.db2.gz CFJRIICTSUMULF-UHFFFAOYSA-N -1 3 374.351 3.729 20 0 FHADHM CCc1cc(NCc2cccc(-c3ccc(-c4nnn[n-]4)s3)c2)ncn1 ZINC000736677862 598854152 /nfs/dbraw/zinc/85/41/52/598854152.db2.gz PSHJHKCHEONIDQ-UHFFFAOYSA-N -1 3 363.450 3.560 20 0 FHADHM C[C@H](Nc1cccc(F)c1-c1nnn[n-]1)c1ncc(-c2ccccc2)o1 ZINC000736140115 598855109 /nfs/dbraw/zinc/85/51/09/598855109.db2.gz YAHLBTBAPYGAAI-NSHDSACASA-N -1 3 350.357 3.834 20 0 FHADHM C[C@H](Nc1cccc(F)c1-c1nn[n-]n1)c1ncc(-c2ccccc2)o1 ZINC000736140115 598855111 /nfs/dbraw/zinc/85/51/11/598855111.db2.gz YAHLBTBAPYGAAI-NSHDSACASA-N -1 3 350.357 3.834 20 0 FHADHM Clc1cc(NCc2ccccc2OCC2CC2)ccc1-c1nnn[n-]1 ZINC000737565858 598856122 /nfs/dbraw/zinc/85/61/22/598856122.db2.gz RUZLWKHUJDFUCX-UHFFFAOYSA-N -1 3 355.829 3.921 20 0 FHADHM Clc1cc(NCc2ccccc2OCC2CC2)ccc1-c1nn[n-]n1 ZINC000737565858 598856123 /nfs/dbraw/zinc/85/61/23/598856123.db2.gz RUZLWKHUJDFUCX-UHFFFAOYSA-N -1 3 355.829 3.921 20 0 FHADHM CCSc1cccc(NC(=O)CCc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736667268 598865142 /nfs/dbraw/zinc/86/51/42/598865142.db2.gz MWOAPBQIFKMGJE-UHFFFAOYSA-N -1 3 353.451 3.550 20 0 FHADHM CCSc1cccc(NC(=O)CCc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736667268 598865144 /nfs/dbraw/zinc/86/51/44/598865144.db2.gz MWOAPBQIFKMGJE-UHFFFAOYSA-N -1 3 353.451 3.550 20 0 FHADHM CCSc1cccc(NC(=O)N(C)Cc2cccc(-c3nnn[n-]3)c2)c1 ZINC000736666503 598879704 /nfs/dbraw/zinc/87/97/04/598879704.db2.gz JVUQAUYLDVXGNQ-UHFFFAOYSA-N -1 3 368.466 3.643 20 0 FHADHM CCSc1cccc(NC(=O)N(C)Cc2cccc(-c3nn[n-]n3)c2)c1 ZINC000736666503 598879705 /nfs/dbraw/zinc/87/97/05/598879705.db2.gz JVUQAUYLDVXGNQ-UHFFFAOYSA-N -1 3 368.466 3.643 20 0 FHADHM Cc1csc(CNCc2cccc(-c3ccc(-c4nnn[n-]4)s3)c2)n1 ZINC000737453796 598887527 /nfs/dbraw/zinc/88/75/27/598887527.db2.gz ZVWBSYCSKGVLFJ-UHFFFAOYSA-N -1 3 368.491 3.650 20 0 FHADHM Cc1csc(CNCc2cccc(-c3ccc(-c4nn[n-]n4)s3)c2)n1 ZINC000737453796 598887529 /nfs/dbraw/zinc/88/75/29/598887529.db2.gz ZVWBSYCSKGVLFJ-UHFFFAOYSA-N -1 3 368.491 3.650 20 0 FHADHM CC(C)(C)OCCSc1nc(-c2ccccc2)ccc1-c1nnn[n-]1 ZINC000735639424 598901837 /nfs/dbraw/zinc/90/18/37/598901837.db2.gz GQIAOPSKQLOZFW-UHFFFAOYSA-N -1 3 355.467 3.836 20 0 FHADHM CC(C)(C)OCCSc1nc(-c2ccccc2)ccc1-c1nn[n-]n1 ZINC000735639424 598901839 /nfs/dbraw/zinc/90/18/39/598901839.db2.gz GQIAOPSKQLOZFW-UHFFFAOYSA-N -1 3 355.467 3.836 20 0 FHADHM Cc1ncc(CSc2nc(-c3ccccc3)ccc2-c2nnn[n-]2)s1 ZINC000737492013 598902165 /nfs/dbraw/zinc/90/21/65/598902165.db2.gz PFVWSLOXHCTRHT-UHFFFAOYSA-N -1 3 366.475 3.986 20 0 FHADHM Cc1ncc(CSc2nc(-c3ccccc3)ccc2-c2nn[n-]n2)s1 ZINC000737492013 598902166 /nfs/dbraw/zinc/90/21/66/598902166.db2.gz PFVWSLOXHCTRHT-UHFFFAOYSA-N -1 3 366.475 3.986 20 0 FHADHM Cc1cc(CSc2nc(-c3ccccc3)ccc2-c2nnn[n-]2)no1 ZINC000737262700 598902220 /nfs/dbraw/zinc/90/22/20/598902220.db2.gz FTSLEJQYWGIWCE-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM Cc1cc(CSc2nc(-c3ccccc3)ccc2-c2nn[n-]n2)no1 ZINC000737262700 598902222 /nfs/dbraw/zinc/90/22/22/598902222.db2.gz FTSLEJQYWGIWCE-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM Cc1cc(CSc2nc(-c3ccccc3)ccc2-c2nnn[n-]2)on1 ZINC000737264054 598902560 /nfs/dbraw/zinc/90/25/60/598902560.db2.gz NDZOUABCSGOUKT-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM Cc1cc(CSc2nc(-c3ccccc3)ccc2-c2nn[n-]n2)on1 ZINC000737264054 598902561 /nfs/dbraw/zinc/90/25/61/598902561.db2.gz NDZOUABCSGOUKT-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM CC[C@@H](CC1CCCCC1)C(=O)Oc1ccc(-c2nnn[n-]2)cc1OC ZINC000736350418 598903237 /nfs/dbraw/zinc/90/32/37/598903237.db2.gz NIASYTSEVGUBOR-AWEZNQCLSA-N -1 3 358.442 3.777 20 0 FHADHM CC[C@@H](CC1CCCCC1)C(=O)Oc1ccc(-c2nn[n-]n2)cc1OC ZINC000736350418 598903239 /nfs/dbraw/zinc/90/32/39/598903239.db2.gz NIASYTSEVGUBOR-AWEZNQCLSA-N -1 3 358.442 3.777 20 0 FHADHM COc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)[C@@H](C)CC1CCCC1 ZINC000737024418 598903611 /nfs/dbraw/zinc/90/36/11/598903611.db2.gz HUKIKQFDZQAXFM-JTQLQIEISA-N -1 3 364.833 3.651 20 0 FHADHM COc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)[C@@H](C)CC1CCCC1 ZINC000737024418 598903612 /nfs/dbraw/zinc/90/36/12/598903612.db2.gz HUKIKQFDZQAXFM-JTQLQIEISA-N -1 3 364.833 3.651 20 0 FHADHM C[C@@H]1CCCCCN1C(=O)c1ccccc1-c1ccccc1-c1nnn[n-]1 ZINC000736265433 598907230 /nfs/dbraw/zinc/90/72/30/598907230.db2.gz AOIFFNXHLRVTFR-OAHLLOKOSA-N -1 3 361.449 3.938 20 0 FHADHM C[C@@H]1CCCCCN1C(=O)c1ccccc1-c1ccccc1-c1nn[n-]n1 ZINC000736265433 598907232 /nfs/dbraw/zinc/90/72/32/598907232.db2.gz AOIFFNXHLRVTFR-OAHLLOKOSA-N -1 3 361.449 3.938 20 0 FHADHM COc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)C=C1CCC(C)CC1 ZINC000737027190 598926648 /nfs/dbraw/zinc/92/66/48/598926648.db2.gz ZQEODJPDPUPDHG-UHFFFAOYSA-N -1 3 362.817 3.571 20 0 FHADHM COc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)C=C1CCC(C)CC1 ZINC000737027190 598926649 /nfs/dbraw/zinc/92/66/49/598926649.db2.gz ZQEODJPDPUPDHG-UHFFFAOYSA-N -1 3 362.817 3.571 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1N(Cc1ccco1)Cc1cccs1 ZINC000737564553 598935908 /nfs/dbraw/zinc/93/59/08/598935908.db2.gz QYKJFFWHJYKISN-UHFFFAOYSA-N -1 3 372.841 3.776 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1N(Cc1ccco1)Cc1cccs1 ZINC000737564553 598935909 /nfs/dbraw/zinc/93/59/09/598935909.db2.gz QYKJFFWHJYKISN-UHFFFAOYSA-N -1 3 372.841 3.776 20 0 FHADHM COc1ccc([C@@H](Nc2ncc(-c3nnn[n-]3)cc2Cl)C(C)C)cc1 ZINC000737073507 598935955 /nfs/dbraw/zinc/93/59/55/598935955.db2.gz CMRXPSGOMFCXKF-HNNXBMFYSA-N -1 3 358.833 3.733 20 0 FHADHM COc1ccc([C@@H](Nc2ncc(-c3nn[n-]n3)cc2Cl)C(C)C)cc1 ZINC000737073507 598935957 /nfs/dbraw/zinc/93/59/57/598935957.db2.gz CMRXPSGOMFCXKF-HNNXBMFYSA-N -1 3 358.833 3.733 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1Nc1ccc(OC2CCCC2)cc1 ZINC000737557090 598937626 /nfs/dbraw/zinc/93/76/26/598937626.db2.gz BNEVROLPPLJWCX-UHFFFAOYSA-N -1 3 356.817 3.980 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1Nc1ccc(OC2CCCC2)cc1 ZINC000737557090 598937627 /nfs/dbraw/zinc/93/76/27/598937627.db2.gz BNEVROLPPLJWCX-UHFFFAOYSA-N -1 3 356.817 3.980 20 0 FHADHM CC(C)C[C@H]1CCCCCN1C(=O)C=Cc1ccccc1-c1nnn[n-]1 ZINC000735796171 598943456 /nfs/dbraw/zinc/94/34/56/598943456.db2.gz VVQVNZANZMHXHF-FMQWLBJXSA-N -1 3 353.470 3.697 20 0 FHADHM CC(C)C[C@H]1CCCCCN1C(=O)C=Cc1ccccc1-c1nn[n-]n1 ZINC000735796171 598943458 /nfs/dbraw/zinc/94/34/58/598943458.db2.gz VVQVNZANZMHXHF-FMQWLBJXSA-N -1 3 353.470 3.697 20 0 FHADHM Fc1cccc(Cl)c1[C@H]1C[C@H]1Nc1ncc(-c2nnn[n-]2)cc1Cl ZINC000737659970 598972249 /nfs/dbraw/zinc/97/22/49/598972249.db2.gz GWECQIHHLVGQEL-QPUJVOFHSA-N -1 3 365.199 3.676 20 0 FHADHM Fc1cccc(Cl)c1[C@H]1C[C@H]1Nc1ncc(-c2nn[n-]n2)cc1Cl ZINC000737659970 598972251 /nfs/dbraw/zinc/97/22/51/598972251.db2.gz GWECQIHHLVGQEL-QPUJVOFHSA-N -1 3 365.199 3.676 20 0 FHADHM Cc1cc(C)c(-c2nnn[n-]2)c(N[C@@H]2C[C@H]2c2c(F)cccc2Cl)n1 ZINC000737243790 598972299 /nfs/dbraw/zinc/97/22/99/598972299.db2.gz BGZQNZVIVGKUGH-ZWNOBZJWSA-N -1 3 358.808 3.639 20 0 FHADHM Cc1cc(C)c(-c2nn[n-]n2)c(N[C@@H]2C[C@H]2c2c(F)cccc2Cl)n1 ZINC000737243790 598972301 /nfs/dbraw/zinc/97/23/01/598972301.db2.gz BGZQNZVIVGKUGH-ZWNOBZJWSA-N -1 3 358.808 3.639 20 0 FHADHM Cc1sc(NC(=O)C[C@H]2CCc3ccccc32)c(-c2nnn[n-]2)c1C ZINC000737563659 599016173 /nfs/dbraw/zinc/01/61/73/599016173.db2.gz RGJINAVHWCMSCN-CYBMUJFWSA-N -1 3 353.451 3.604 20 0 FHADHM Cc1sc(NC(=O)C[C@H]2CCc3ccccc32)c(-c2nn[n-]n2)c1C ZINC000737563659 599016175 /nfs/dbraw/zinc/01/61/75/599016175.db2.gz RGJINAVHWCMSCN-CYBMUJFWSA-N -1 3 353.451 3.604 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccnc2ccccc12)c1cccc(-c2nnn[n-]2)c1 ZINC000736153118 599026608 /nfs/dbraw/zinc/02/66/08/599026608.db2.gz QADNEZCHLLSCHA-ATWMFIQVSA-N -1 3 371.400 3.733 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccnc2ccccc12)c1cccc(-c2nn[n-]n2)c1 ZINC000736153118 599026610 /nfs/dbraw/zinc/02/66/10/599026610.db2.gz QADNEZCHLLSCHA-ATWMFIQVSA-N -1 3 371.400 3.733 20 0 FHADHM Cc1sc(NC(=O)Cc2c[nH]c3c2cccc3C)c(-c2nnn[n-]2)c1C ZINC000737563650 599035803 /nfs/dbraw/zinc/03/58/03/599035803.db2.gz ODPKQWCBRFHBBB-UHFFFAOYSA-N -1 3 366.450 3.516 20 0 FHADHM Cc1sc(NC(=O)Cc2c[nH]c3c2cccc3C)c(-c2nn[n-]n2)c1C ZINC000737563650 599035804 /nfs/dbraw/zinc/03/58/04/599035804.db2.gz ODPKQWCBRFHBBB-UHFFFAOYSA-N -1 3 366.450 3.516 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(NCc2cccc(Cl)c2)n1 ZINC000737635860 599037151 /nfs/dbraw/zinc/03/71/51/599037151.db2.gz NZYHMRVHJCTKCP-UHFFFAOYSA-N -1 3 354.723 3.546 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(NCc2cccc(Cl)c2)n1 ZINC000737635860 599037154 /nfs/dbraw/zinc/03/71/54/599037154.db2.gz NZYHMRVHJCTKCP-UHFFFAOYSA-N -1 3 354.723 3.546 20 0 FHADHM CC[C@H](CNc1nc(C(F)(F)F)ccc1-c1nnn[n-]1)c1ccccc1 ZINC000736351498 599039257 /nfs/dbraw/zinc/03/92/57/599039257.db2.gz QJIAATIWPWENAE-LLVKDONJSA-N -1 3 362.359 3.886 20 0 FHADHM CC[C@H](CNc1nc(C(F)(F)F)ccc1-c1nn[n-]n1)c1ccccc1 ZINC000736351498 599039261 /nfs/dbraw/zinc/03/92/61/599039261.db2.gz QJIAATIWPWENAE-LLVKDONJSA-N -1 3 362.359 3.886 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N[C@@H](c2ccccc2)C2CC2)n1 ZINC000737633244 599042132 /nfs/dbraw/zinc/04/21/32/599042132.db2.gz PLTWAQZUMLWHNI-AWEZNQCLSA-N -1 3 360.343 3.844 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N[C@@H](c2ccccc2)C2CC2)n1 ZINC000737633244 599042135 /nfs/dbraw/zinc/04/21/35/599042135.db2.gz PLTWAQZUMLWHNI-AWEZNQCLSA-N -1 3 360.343 3.844 20 0 FHADHM CC1(C)[C@H](Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)[C@@H]2CCCO[C@H]21 ZINC000820582909 599043530 /nfs/dbraw/zinc/04/35/30/599043530.db2.gz AOWCEPQABJTLTO-IACUBPJLSA-N -1 3 367.375 3.501 20 0 FHADHM CC1(C)[C@H](Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)[C@@H]2CCCO[C@H]21 ZINC000820582909 599043533 /nfs/dbraw/zinc/04/35/33/599043533.db2.gz AOWCEPQABJTLTO-IACUBPJLSA-N -1 3 367.375 3.501 20 0 FHADHM C[C@H](Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1)c1cc(F)ccc1F ZINC000736138758 599044310 /nfs/dbraw/zinc/04/43/10/599044310.db2.gz RFQUETSBIRTQHQ-ZETCQYMHSA-N -1 3 370.285 3.732 20 0 FHADHM C[C@H](Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1)c1cc(F)ccc1F ZINC000736138758 599044313 /nfs/dbraw/zinc/04/43/13/599044313.db2.gz RFQUETSBIRTQHQ-ZETCQYMHSA-N -1 3 370.285 3.732 20 0 FHADHM Cc1ccc([C@H](C)N(C)c2nc(C(F)(F)F)ccc2-c2nnn[n-]2)cc1 ZINC000737320287 599044883 /nfs/dbraw/zinc/04/48/83/599044883.db2.gz JYJBNVKUXSSEBT-NSHDSACASA-N -1 3 362.359 3.786 20 0 FHADHM Cc1ccc([C@H](C)N(C)c2nc(C(F)(F)F)ccc2-c2nn[n-]n2)cc1 ZINC000737320287 599044886 /nfs/dbraw/zinc/04/48/86/599044886.db2.gz JYJBNVKUXSSEBT-NSHDSACASA-N -1 3 362.359 3.786 20 0 FHADHM Cc1ccccc1[C@@H]1CCCN1c1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000737420242 599047165 /nfs/dbraw/zinc/04/71/65/599047165.db2.gz DTWOJRSRZZVCRQ-AWEZNQCLSA-N -1 3 374.370 3.930 20 0 FHADHM Cc1ccccc1[C@@H]1CCCN1c1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000737420242 599047167 /nfs/dbraw/zinc/04/71/67/599047167.db2.gz DTWOJRSRZZVCRQ-AWEZNQCLSA-N -1 3 374.370 3.930 20 0 FHADHM C[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2Cl)CC[C@H]1c1ccccc1 ZINC000820774322 599050973 /nfs/dbraw/zinc/05/09/73/599050973.db2.gz ANWQOIZOAUOMRG-IUODEOHRSA-N -1 3 354.845 3.545 20 0 FHADHM C[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2Cl)CC[C@H]1c1ccccc1 ZINC000820774322 599050975 /nfs/dbraw/zinc/05/09/75/599050975.db2.gz ANWQOIZOAUOMRG-IUODEOHRSA-N -1 3 354.845 3.545 20 0 FHADHM Cc1ccc2c(c1)[C@@H](Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1)CC2 ZINC000737372461 599054382 /nfs/dbraw/zinc/05/43/82/599054382.db2.gz YIQIWHOGVQOACJ-ZDUSSCGKSA-N -1 3 360.343 3.688 20 0 FHADHM Cc1ccc2c(c1)[C@@H](Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1)CC2 ZINC000737372461 599054385 /nfs/dbraw/zinc/05/43/85/599054385.db2.gz YIQIWHOGVQOACJ-ZDUSSCGKSA-N -1 3 360.343 3.688 20 0 FHADHM Clc1ccc(N2CC[C@@H](COCc3ccccc3)C2)c(-c2nnn[n-]2)c1 ZINC000822574380 599063100 /nfs/dbraw/zinc/06/31/00/599063100.db2.gz TXODNUCAEMVRJF-OAHLLOKOSA-N -1 3 369.856 3.563 20 0 FHADHM Clc1ccc(N2CC[C@@H](COCc3ccccc3)C2)c(-c2nn[n-]n2)c1 ZINC000822574380 599063103 /nfs/dbraw/zinc/06/31/03/599063103.db2.gz TXODNUCAEMVRJF-OAHLLOKOSA-N -1 3 369.856 3.563 20 0 FHADHM Fc1ccc(NCCc2c[nH]c3ccc(Cl)cc23)c(-c2nnn[n-]2)c1 ZINC000822782672 599066526 /nfs/dbraw/zinc/06/65/26/599066526.db2.gz ACUVLDRMXXINGQ-UHFFFAOYSA-N -1 3 356.792 3.795 20 0 FHADHM Fc1ccc(NCCc2c[nH]c3ccc(Cl)cc23)c(-c2nn[n-]n2)c1 ZINC000822782672 599066528 /nfs/dbraw/zinc/06/65/28/599066528.db2.gz ACUVLDRMXXINGQ-UHFFFAOYSA-N -1 3 356.792 3.795 20 0 FHADHM O=C([C@H]1C[C@H]1C1CCCCC1)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000737781416 599069299 /nfs/dbraw/zinc/06/92/99/599069299.db2.gz APEFNLJRHJDYCV-OALUTQOASA-N -1 3 365.481 3.574 20 0 FHADHM O=C([C@H]1C[C@H]1C1CCCCC1)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000737781416 599069302 /nfs/dbraw/zinc/06/93/02/599069302.db2.gz APEFNLJRHJDYCV-OALUTQOASA-N -1 3 365.481 3.574 20 0 FHADHM C[C@H]1CCCN(C(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)[C@H]1C ZINC000736264320 599081828 /nfs/dbraw/zinc/08/18/28/599081828.db2.gz CVUWYTBSAYYNID-GJZGRUSLSA-N -1 3 361.449 3.794 20 0 FHADHM C[C@H]1CCCN(C(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)[C@H]1C ZINC000736264320 599081831 /nfs/dbraw/zinc/08/18/31/599081831.db2.gz CVUWYTBSAYYNID-GJZGRUSLSA-N -1 3 361.449 3.794 20 0 FHADHM C[C@H](CNc1ccc(-c2nn[n-]n2)cc1)Oc1cccc(Br)c1 ZINC000820274261 599086929 /nfs/dbraw/zinc/08/69/29/599086929.db2.gz FYKGHGGGVQXNJM-LLVKDONJSA-N -1 3 374.242 3.509 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1N1CC[C@@H](CSc2ccccc2)C1 ZINC000822563455 599087942 /nfs/dbraw/zinc/08/79/42/599087942.db2.gz JVPFZTRTTWMOAV-GFCCVEGCSA-N -1 3 372.885 3.534 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1N1CC[C@@H](CSc2ccccc2)C1 ZINC000822563455 599087943 /nfs/dbraw/zinc/08/79/43/599087943.db2.gz JVPFZTRTTWMOAV-GFCCVEGCSA-N -1 3 372.885 3.534 20 0 FHADHM CN(CCc1cccs1)c1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000821607424 599087986 /nfs/dbraw/zinc/08/79/86/599087986.db2.gz NRGAOANZZQEVER-UHFFFAOYSA-N -1 3 353.373 3.626 20 0 FHADHM CN(CCc1cccs1)c1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000821607424 599087989 /nfs/dbraw/zinc/08/79/89/599087989.db2.gz NRGAOANZZQEVER-UHFFFAOYSA-N -1 3 353.373 3.626 20 0 FHADHM Cc1cc(NC(=O)CCc2ccc(-c3nnn[n-]3)cc2)ccc1OC(C)C ZINC000737271240 599091332 /nfs/dbraw/zinc/09/13/32/599091332.db2.gz LYFVVFUYSXTENG-UHFFFAOYSA-N -1 3 365.437 3.534 20 0 FHADHM Cc1cc(NC(=O)CCc2ccc(-c3nn[n-]n3)cc2)ccc1OC(C)C ZINC000737271240 599091335 /nfs/dbraw/zinc/09/13/35/599091335.db2.gz LYFVVFUYSXTENG-UHFFFAOYSA-N -1 3 365.437 3.534 20 0 FHADHM C[C@@H](NC(=O)N[C@@H](C)CCC1CCCCC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000735986971 599103203 /nfs/dbraw/zinc/10/32/03/599103203.db2.gz UZAJUALQMALWTD-LSDHHAIUSA-N -1 3 370.501 3.976 20 0 FHADHM C[C@@H](NC(=O)N[C@@H](C)CCC1CCCCC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000735986971 599103205 /nfs/dbraw/zinc/10/32/05/599103205.db2.gz UZAJUALQMALWTD-LSDHHAIUSA-N -1 3 370.501 3.976 20 0 FHADHM Cc1ccc(NC(=O)CSc2ccccc2-c2nnn[n-]2)c(Cl)c1 ZINC000737356327 599110739 /nfs/dbraw/zinc/11/07/39/599110739.db2.gz FMDNLSDQCQDOHX-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1ccc(NC(=O)CSc2ccccc2-c2nn[n-]n2)c(Cl)c1 ZINC000737356327 599110741 /nfs/dbraw/zinc/11/07/41/599110741.db2.gz FMDNLSDQCQDOHX-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM CCO[C@@H]1C[C@@H](Nc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)C12CCC2 ZINC000736614956 599119555 /nfs/dbraw/zinc/11/95/55/599119555.db2.gz WHSFOCLSFKMPBZ-ZIAGYGMSSA-N -1 3 367.375 3.645 20 0 FHADHM Cc1ccc(-c2cnc(CSc3cc(-c4nnn[n-]4)ccn3)o2)cc1 ZINC000822214280 599125148 /nfs/dbraw/zinc/12/51/48/599125148.db2.gz XTZHZWWTIYOSLG-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM Cc1ccc(-c2cnc(CSc3cc(-c4nn[n-]n4)ccn3)o2)cc1 ZINC000822214280 599125149 /nfs/dbraw/zinc/12/51/49/599125149.db2.gz XTZHZWWTIYOSLG-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM CC(C)[C@@H](C)S[C@@H](C)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820550767 599130938 /nfs/dbraw/zinc/13/09/38/599130938.db2.gz YRROZZQCTSRPQR-ZJUUUORDSA-N -1 3 353.879 3.625 20 0 FHADHM CC(C)[C@@H](C)S[C@@H](C)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820550767 599130941 /nfs/dbraw/zinc/13/09/41/599130941.db2.gz YRROZZQCTSRPQR-ZJUUUORDSA-N -1 3 353.879 3.625 20 0 FHADHM c1ccc(Oc2cccc(NCCOc3cccc(-c4nnn[n-]4)c3)c2)nc1 ZINC000823791832 599134018 /nfs/dbraw/zinc/13/40/18/599134018.db2.gz JXONSPLGCMUAKA-UHFFFAOYSA-N -1 3 374.404 3.545 20 0 FHADHM c1ccc(Oc2cccc(NCCOc3cccc(-c4nn[n-]n4)c3)c2)nc1 ZINC000823791832 599134020 /nfs/dbraw/zinc/13/40/20/599134020.db2.gz JXONSPLGCMUAKA-UHFFFAOYSA-N -1 3 374.404 3.545 20 0 FHADHM COc1ccc(C=Cc2nc3cc(Cl)ccc3o2)cc1-c1nnn[n-]1 ZINC000737080809 599153162 /nfs/dbraw/zinc/15/31/62/599153162.db2.gz HOIMNRUQXNWTEJ-XVNBXDOJSA-N -1 3 353.769 3.840 20 0 FHADHM COc1ccc(C=Cc2nc3cc(Cl)ccc3o2)cc1-c1nn[n-]n1 ZINC000737080809 599153165 /nfs/dbraw/zinc/15/31/65/599153165.db2.gz HOIMNRUQXNWTEJ-XVNBXDOJSA-N -1 3 353.769 3.840 20 0 FHADHM Clc1ccc(SCc2nnc(-c3cccc(-c4nnn[n-]4)c3)o2)cc1 ZINC000737574109 599160510 /nfs/dbraw/zinc/16/05/10/599160510.db2.gz QEZNNCQPOZAZRK-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1ccc(SCc2nnc(-c3cccc(-c4nn[n-]n4)c3)o2)cc1 ZINC000737574109 599160513 /nfs/dbraw/zinc/16/05/13/599160513.db2.gz QEZNNCQPOZAZRK-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)C[C@@H](C)c1ccccc1C ZINC000736633886 599160695 /nfs/dbraw/zinc/16/06/95/599160695.db2.gz FXUYYDQVPYILDV-CQSZACIVSA-N -1 3 365.437 3.706 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)C[C@@H](C)c1ccccc1C ZINC000736633886 599160696 /nfs/dbraw/zinc/16/06/96/599160696.db2.gz FXUYYDQVPYILDV-CQSZACIVSA-N -1 3 365.437 3.706 20 0 FHADHM Cc1ccc([C@H]2CCC[C@H]2N(C)C(=O)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000822233029 599161697 /nfs/dbraw/zinc/16/16/97/599161697.db2.gz GMHFPGFLOKURAD-RTBURBONSA-N -1 3 361.449 3.583 20 0 FHADHM Cc1ccc([C@H]2CCC[C@H]2N(C)C(=O)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000822233029 599161698 /nfs/dbraw/zinc/16/16/98/599161698.db2.gz GMHFPGFLOKURAD-RTBURBONSA-N -1 3 361.449 3.583 20 0 FHADHM Cc1ccccc1SCc1nnc(-c2ccc(-c3nnn[n-]3)cc2)o1 ZINC000737432319 599164587 /nfs/dbraw/zinc/16/45/87/599164587.db2.gz VFARKKZUITZDFY-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM Cc1ccccc1SCc1nnc(-c2ccc(-c3nn[n-]n3)cc2)o1 ZINC000737432319 599164590 /nfs/dbraw/zinc/16/45/90/599164590.db2.gz VFARKKZUITZDFY-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM Cc1cccc(SCc2nnc(-c3ccc(-c4nnn[n-]4)cc3)o2)c1 ZINC000737410086 599164826 /nfs/dbraw/zinc/16/48/26/599164826.db2.gz FCFQBYNMMCMZIO-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM Cc1cccc(SCc2nnc(-c3ccc(-c4nn[n-]n4)cc3)o2)c1 ZINC000737410086 599164829 /nfs/dbraw/zinc/16/48/29/599164829.db2.gz FCFQBYNMMCMZIO-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM c1cc(-c2nnn[n-]2)cc(-c2nnc(CSCC3CCCCC3)o2)c1 ZINC000738404260 599166100 /nfs/dbraw/zinc/16/61/00/599166100.db2.gz AUWRQYHCMIADBZ-UHFFFAOYSA-N -1 3 356.455 3.730 20 0 FHADHM c1cc(-c2nn[n-]n2)cc(-c2nnc(CSCC3CCCCC3)o2)c1 ZINC000738404260 599166101 /nfs/dbraw/zinc/16/61/01/599166101.db2.gz AUWRQYHCMIADBZ-UHFFFAOYSA-N -1 3 356.455 3.730 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1SCc1nccn1Cc1ccccc1 ZINC000737643832 599171910 /nfs/dbraw/zinc/17/19/10/599171910.db2.gz GNFBNTIEMBOJAD-UHFFFAOYSA-N -1 3 366.425 3.543 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1SCc1nccn1Cc1ccccc1 ZINC000737643832 599171915 /nfs/dbraw/zinc/17/19/15/599171915.db2.gz GNFBNTIEMBOJAD-UHFFFAOYSA-N -1 3 366.425 3.543 20 0 FHADHM Cc1ccc([C@@H]2CCCN2c2nc(C(F)(F)F)ccc2-c2nnn[n-]2)o1 ZINC000737331498 599172817 /nfs/dbraw/zinc/17/28/17/599172817.db2.gz NAOCLNZSAJKRSY-NSHDSACASA-N -1 3 364.331 3.523 20 0 FHADHM Cc1ccc([C@@H]2CCCN2c2nc(C(F)(F)F)ccc2-c2nn[n-]n2)o1 ZINC000737331498 599172818 /nfs/dbraw/zinc/17/28/18/599172818.db2.gz NAOCLNZSAJKRSY-NSHDSACASA-N -1 3 364.331 3.523 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1 ZINC000460694665 599177004 /nfs/dbraw/zinc/17/70/04/599177004.db2.gz PPAQZTGXTHVQSY-GJZGRUSLSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1 ZINC000460694665 599177006 /nfs/dbraw/zinc/17/70/06/599177006.db2.gz PPAQZTGXTHVQSY-GJZGRUSLSA-N -1 3 374.231 3.916 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1)c1cccc(Cl)c1 ZINC000735561055 599178894 /nfs/dbraw/zinc/17/88/94/599178894.db2.gz UTSZMQSHMOIRFG-SECBINFHSA-N -1 3 362.220 3.916 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1)c1cccc(Cl)c1 ZINC000735561055 599178897 /nfs/dbraw/zinc/17/88/97/599178897.db2.gz UTSZMQSHMOIRFG-SECBINFHSA-N -1 3 362.220 3.916 20 0 FHADHM C[C@H](C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1cccc(Cl)c1 ZINC000735550724 599179315 /nfs/dbraw/zinc/17/93/15/599179315.db2.gz KSGCBEZRCOHIRX-VIFPVBQESA-N -1 3 362.220 3.916 20 0 FHADHM C[C@H](C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1cccc(Cl)c1 ZINC000735550724 599179317 /nfs/dbraw/zinc/17/93/17/599179317.db2.gz KSGCBEZRCOHIRX-VIFPVBQESA-N -1 3 362.220 3.916 20 0 FHADHM O=C(Nc1ccccc1-c1nnn[n-]1)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1 ZINC000738190326 599178510 /nfs/dbraw/zinc/17/85/10/599178510.db2.gz CSUOFBDOTWXAMF-UONOGXRCSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1ccccc1-c1nn[n-]n1)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1 ZINC000738190326 599178512 /nfs/dbraw/zinc/17/85/12/599178512.db2.gz CSUOFBDOTWXAMF-UONOGXRCSA-N -1 3 374.231 3.916 20 0 FHADHM Cc1sc(NC(=O)[C@@H](C)c2cccc(Cl)c2)c(-c2nnn[n-]2)c1C ZINC000737560837 599178524 /nfs/dbraw/zinc/17/85/24/599178524.db2.gz HTFZKSAWOOYNSX-VIFPVBQESA-N -1 3 361.858 3.941 20 0 FHADHM Cc1sc(NC(=O)[C@@H](C)c2cccc(Cl)c2)c(-c2nn[n-]n2)c1C ZINC000737560837 599178527 /nfs/dbraw/zinc/17/85/27/599178527.db2.gz HTFZKSAWOOYNSX-VIFPVBQESA-N -1 3 361.858 3.941 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@@H]2CCSc3ccccc32)s1 ZINC000736679034 599184787 /nfs/dbraw/zinc/18/47/87/599184787.db2.gz JGLFJTLRACJYRV-GFCCVEGCSA-N -1 3 371.491 3.709 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@@H]2CCSc3ccccc32)s1 ZINC000736679034 599184789 /nfs/dbraw/zinc/18/47/89/599184789.db2.gz JGLFJTLRACJYRV-GFCCVEGCSA-N -1 3 371.491 3.709 20 0 FHADHM C[C@H](CC(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1cccc(F)c1 ZINC000735974873 599189603 /nfs/dbraw/zinc/18/96/03/599189603.db2.gz CUXYZALYFRLHHZ-CHWSQXEVSA-N -1 3 354.385 3.804 20 0 FHADHM C[C@H](CC(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1cccc(F)c1 ZINC000735974873 599189606 /nfs/dbraw/zinc/18/96/06/599189606.db2.gz CUXYZALYFRLHHZ-CHWSQXEVSA-N -1 3 354.385 3.804 20 0 FHADHM Cc1ccccc1[C@H](C)CC(=O)OCc1cc(-c2nnn[n-]2)ccc1F ZINC000737419187 599186377 /nfs/dbraw/zinc/18/63/77/599186377.db2.gz DQCCPPHXVNLAEF-CYBMUJFWSA-N -1 3 354.385 3.551 20 0 FHADHM Cc1ccccc1[C@H](C)CC(=O)OCc1cc(-c2nn[n-]n2)ccc1F ZINC000737419187 599186378 /nfs/dbraw/zinc/18/63/78/599186378.db2.gz DQCCPPHXVNLAEF-CYBMUJFWSA-N -1 3 354.385 3.551 20 0 FHADHM C[C@H](NC(=O)N1CCC[C@@H](C(C)(C)C)CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736113520 599187403 /nfs/dbraw/zinc/18/74/03/599187403.db2.gz OWUIMUIOJYQZQM-WMLDXEAASA-N -1 3 370.501 3.786 20 0 FHADHM C[C@H](NC(=O)N1CCC[C@@H](C(C)(C)C)CC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736113520 599187406 /nfs/dbraw/zinc/18/74/06/599187406.db2.gz OWUIMUIOJYQZQM-WMLDXEAASA-N -1 3 370.501 3.786 20 0 FHADHM Cc1ccncc1C(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737446738 599190214 /nfs/dbraw/zinc/19/02/14/599190214.db2.gz YFVDTCULJQOEQH-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccncc1C(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737446738 599190217 /nfs/dbraw/zinc/19/02/17/599190217.db2.gz YFVDTCULJQOEQH-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM CCc1noc(-c2cccc(Oc3ccc(Cl)cc3-c3nnn[n-]3)c2)n1 ZINC000736711193 599192962 /nfs/dbraw/zinc/19/29/62/599192962.db2.gz QJHKZELOSGFPRU-UHFFFAOYSA-N -1 3 368.784 3.925 20 0 FHADHM CCc1noc(-c2cccc(Oc3ccc(Cl)cc3-c3nn[n-]n3)c2)n1 ZINC000736711193 599192965 /nfs/dbraw/zinc/19/29/65/599192965.db2.gz QJHKZELOSGFPRU-UHFFFAOYSA-N -1 3 368.784 3.925 20 0 FHADHM O=C(NCC(C1CC1)C1CC1)c1ccccc1-c1ccccc1-c1nnn[n-]1 ZINC000823162366 599198402 /nfs/dbraw/zinc/19/84/02/599198402.db2.gz TWZAEVGQKBXGSU-UHFFFAOYSA-N -1 3 373.460 3.700 20 0 FHADHM O=C(NCC(C1CC1)C1CC1)c1ccccc1-c1ccccc1-c1nn[n-]n1 ZINC000823162366 599198405 /nfs/dbraw/zinc/19/84/05/599198405.db2.gz TWZAEVGQKBXGSU-UHFFFAOYSA-N -1 3 373.460 3.700 20 0 FHADHM CC(C)C(=O)N(Cc1ccc(Cl)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000735684453 599209270 /nfs/dbraw/zinc/20/92/70/599209270.db2.gz NNAHIXNBTLDQBY-UHFFFAOYSA-N -1 3 355.829 3.709 20 0 FHADHM CC(C)C(=O)N(Cc1ccc(Cl)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000735684453 599209273 /nfs/dbraw/zinc/20/92/73/599209273.db2.gz NNAHIXNBTLDQBY-UHFFFAOYSA-N -1 3 355.829 3.709 20 0 FHADHM CCc1ccc([C@@H]2C[C@H](C)CCN2C(=O)c2cccc(-c3nnn[n-]3)c2)o1 ZINC000821482514 599220678 /nfs/dbraw/zinc/22/06/78/599220678.db2.gz SEKAQZAYGKTODU-DYVFJYSZSA-N -1 3 365.437 3.636 20 0 FHADHM CCc1ccc([C@@H]2C[C@H](C)CCN2C(=O)c2cccc(-c3nn[n-]n3)c2)o1 ZINC000821482514 599220679 /nfs/dbraw/zinc/22/06/79/599220679.db2.gz SEKAQZAYGKTODU-DYVFJYSZSA-N -1 3 365.437 3.636 20 0 FHADHM CC(C)[C@H]1CCCCN1C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000735751643 599221773 /nfs/dbraw/zinc/22/17/73/599221773.db2.gz WHYYJHMTHPDFKR-CQSZACIVSA-N -1 3 364.906 3.727 20 0 FHADHM CC(C)[C@H]1CCCCN1C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000735751643 599221775 /nfs/dbraw/zinc/22/17/75/599221775.db2.gz WHYYJHMTHPDFKR-CQSZACIVSA-N -1 3 364.906 3.727 20 0 FHADHM COc1cccc(CCCSCCOc2ccccc2-c2nnn[n-]2)c1 ZINC000821867384 599223598 /nfs/dbraw/zinc/22/35/98/599223598.db2.gz DVQMJQMTQGMNHS-UHFFFAOYSA-N -1 3 370.478 3.620 20 0 FHADHM COc1cccc(CCCSCCOc2ccccc2-c2nn[n-]n2)c1 ZINC000821867384 599223601 /nfs/dbraw/zinc/22/36/01/599223601.db2.gz DVQMJQMTQGMNHS-UHFFFAOYSA-N -1 3 370.478 3.620 20 0 FHADHM CCOc1ccccc1OCCSCc1cccc(-c2nnn[n-]2)c1 ZINC000821438013 599226217 /nfs/dbraw/zinc/22/62/17/599226217.db2.gz SBCNKFWUFMUPHA-UHFFFAOYSA-N -1 3 356.451 3.578 20 0 FHADHM CCOc1ccccc1OCCSCc1cccc(-c2nn[n-]n2)c1 ZINC000821438013 599226222 /nfs/dbraw/zinc/22/62/22/599226222.db2.gz SBCNKFWUFMUPHA-UHFFFAOYSA-N -1 3 356.451 3.578 20 0 FHADHM O=C(Nc1nc(C=Cc2ccccc2)cs1)c1ccc(-c2nnn[n-]2)cc1 ZINC000738211477 599227369 /nfs/dbraw/zinc/22/73/69/599227369.db2.gz NRGCQYXHZDGIKP-WDZFZDKYSA-N -1 3 374.429 3.746 20 0 FHADHM O=C(Nc1nc(C=Cc2ccccc2)cs1)c1ccc(-c2nn[n-]n2)cc1 ZINC000738211477 599227371 /nfs/dbraw/zinc/22/73/71/599227371.db2.gz NRGCQYXHZDGIKP-WDZFZDKYSA-N -1 3 374.429 3.746 20 0 FHADHM Cc1ccc(NC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1Cl ZINC000822248946 599236610 /nfs/dbraw/zinc/23/66/10/599236610.db2.gz VSNMZNNUIXKVIL-LLVKDONJSA-N -1 3 356.817 3.711 20 0 FHADHM Cc1ccc(NC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1Cl ZINC000822248946 599236611 /nfs/dbraw/zinc/23/66/11/599236611.db2.gz VSNMZNNUIXKVIL-LLVKDONJSA-N -1 3 356.817 3.711 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N[C@H]1CC(C)(C)c2ccccc21 ZINC000822217867 607266813 /nfs/dbraw/zinc/26/68/13/607266813.db2.gz QBAUEZHVXONMKF-KRWDZBQOSA-N -1 3 362.437 3.719 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N[C@H]1CC(C)(C)c2ccccc21 ZINC000822217867 607266814 /nfs/dbraw/zinc/26/68/14/607266814.db2.gz QBAUEZHVXONMKF-KRWDZBQOSA-N -1 3 362.437 3.719 20 0 FHADHM Cc1c(NC(=O)[C@H](C)CCc2ccccc2F)cccc1-c1nnn[n-]1 ZINC000822060438 607267100 /nfs/dbraw/zinc/26/71/00/607267100.db2.gz HJGKSBISSCHAEA-GFCCVEGCSA-N -1 3 353.401 3.522 20 0 FHADHM Cc1c(NC(=O)[C@H](C)CCc2ccccc2F)cccc1-c1nn[n-]n1 ZINC000822060438 607267101 /nfs/dbraw/zinc/26/71/01/607267101.db2.gz HJGKSBISSCHAEA-GFCCVEGCSA-N -1 3 353.401 3.522 20 0 FHADHM CC[C@@H]1CCCN(C(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(C)C)CC1 ZINC000736402032 599240835 /nfs/dbraw/zinc/24/08/35/599240835.db2.gz LDBQKHGLZBMSGD-CQSZACIVSA-N -1 3 372.473 3.698 20 0 FHADHM CC[C@@H]1CCCN(C(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(C)C)CC1 ZINC000736402032 599240837 /nfs/dbraw/zinc/24/08/37/599240837.db2.gz LDBQKHGLZBMSGD-CQSZACIVSA-N -1 3 372.473 3.698 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)NC1CC(c2cccc(Cl)c2)C1 ZINC000823309000 599242394 /nfs/dbraw/zinc/24/23/94/599242394.db2.gz OVLZJSJFPYYKMC-UHFFFAOYSA-N -1 3 368.828 3.588 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)NC1CC(c2cccc(Cl)c2)C1 ZINC000823309000 599242397 /nfs/dbraw/zinc/24/23/97/599242397.db2.gz OVLZJSJFPYYKMC-UHFFFAOYSA-N -1 3 368.828 3.588 20 0 FHADHM Cc1c(NC(=O)CSc2ccc(Cl)cc2)cccc1-c1nnn[n-]1 ZINC000822076697 607270708 /nfs/dbraw/zinc/27/07/08/607270708.db2.gz QTLDUIMRDOWIKU-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1c(NC(=O)CSc2ccc(Cl)cc2)cccc1-c1nn[n-]n1 ZINC000822076697 607270709 /nfs/dbraw/zinc/27/07/09/607270709.db2.gz QTLDUIMRDOWIKU-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM CC[C@H](NC(=O)Nc1ccc(-c2nnn[n-]2)cc1)C(C)(C)c1ccccc1 ZINC000820920630 599242931 /nfs/dbraw/zinc/24/29/31/599242931.db2.gz RPZHPJDAPAFODB-KRWDZBQOSA-N -1 3 364.453 3.745 20 0 FHADHM CC[C@H](NC(=O)Nc1ccc(-c2nn[n-]n2)cc1)C(C)(C)c1ccccc1 ZINC000820920630 599242933 /nfs/dbraw/zinc/24/29/33/599242933.db2.gz RPZHPJDAPAFODB-KRWDZBQOSA-N -1 3 364.453 3.745 20 0 FHADHM C[C@H](NC(=O)Nc1ccc(F)c(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820379395 599243049 /nfs/dbraw/zinc/24/30/49/599243049.db2.gz CECJLNIXRWGNCQ-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM C[C@H](NC(=O)Nc1ccc(F)c(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820379395 599243051 /nfs/dbraw/zinc/24/30/51/599243051.db2.gz CECJLNIXRWGNCQ-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM C[C@@H]1C[C@@H](c2ccccc2F)N(C(=O)Nc2cccc(-c3nnn[n-]3)c2)C1 ZINC000820669163 599245770 /nfs/dbraw/zinc/24/57/70/599245770.db2.gz ZGOQJVSTYIJBNO-PXAZEXFGSA-N -1 3 366.400 3.621 20 0 FHADHM C[C@@H]1C[C@@H](c2ccccc2F)N(C(=O)Nc2cccc(-c3nn[n-]n3)c2)C1 ZINC000820669163 599245771 /nfs/dbraw/zinc/24/57/71/599245771.db2.gz ZGOQJVSTYIJBNO-PXAZEXFGSA-N -1 3 366.400 3.621 20 0 FHADHM S=C(Nc1ccccc1-c1nnn[n-]1)NC(C1CCCC1)C1CCCC1 ZINC000738410479 599246938 /nfs/dbraw/zinc/24/69/38/599246938.db2.gz ZESUXROUWLTNDD-UHFFFAOYSA-N -1 3 370.526 3.902 20 0 FHADHM S=C(Nc1ccccc1-c1nn[n-]n1)NC(C1CCCC1)C1CCCC1 ZINC000738410479 599246941 /nfs/dbraw/zinc/24/69/41/599246941.db2.gz ZESUXROUWLTNDD-UHFFFAOYSA-N -1 3 370.526 3.902 20 0 FHADHM CCCCCN(C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)C(C)C ZINC000821056701 599249757 /nfs/dbraw/zinc/24/97/57/599249757.db2.gz WRQJMHTZJXHCTL-UHFFFAOYSA-N -1 3 350.854 3.953 20 0 FHADHM CCCCCN(C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)C(C)C ZINC000821056701 599249759 /nfs/dbraw/zinc/24/97/59/599249759.db2.gz WRQJMHTZJXHCTL-UHFFFAOYSA-N -1 3 350.854 3.953 20 0 FHADHM C[C@H](NC(=O)Nc1cccc(Cl)c1F)c1cccc(-c2nnn[n-]2)c1 ZINC000820380583 599249986 /nfs/dbraw/zinc/24/99/86/599249986.db2.gz WPKVTCPNODEUQB-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM C[C@H](NC(=O)Nc1cccc(Cl)c1F)c1cccc(-c2nn[n-]n2)c1 ZINC000820380583 599249989 /nfs/dbraw/zinc/24/99/89/599249989.db2.gz WPKVTCPNODEUQB-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM Cc1c(NC(=O)N[C@@H](C)c2ccc(Cl)cc2)cccc1-c1nnn[n-]1 ZINC000822091052 607280154 /nfs/dbraw/zinc/28/01/54/607280154.db2.gz NEVGNUOYSBYSRN-NSHDSACASA-N -1 3 356.817 3.711 20 0 FHADHM Cc1c(NC(=O)N[C@@H](C)c2ccc(Cl)cc2)cccc1-c1nn[n-]n1 ZINC000822091052 607280155 /nfs/dbraw/zinc/28/01/55/607280155.db2.gz NEVGNUOYSBYSRN-NSHDSACASA-N -1 3 356.817 3.711 20 0 FHADHM Cc1c(NC(=O)N[C@H](C)c2ccc(F)cc2Cl)cccc1-c1nnn[n-]1 ZINC000822092713 607280785 /nfs/dbraw/zinc/28/07/85/607280785.db2.gz YQLSFQLAEXGEPK-SNVBAGLBSA-N -1 3 374.807 3.850 20 0 FHADHM Cc1c(NC(=O)N[C@H](C)c2ccc(F)cc2Cl)cccc1-c1nn[n-]n1 ZINC000822092713 607280786 /nfs/dbraw/zinc/28/07/86/607280786.db2.gz YQLSFQLAEXGEPK-SNVBAGLBSA-N -1 3 374.807 3.850 20 0 FHADHM Cc1c(NC(=O)N2CC[C@@H](c3ccccc3)[C@H]2C)cccc1-c1nnn[n-]1 ZINC000822084906 607288203 /nfs/dbraw/zinc/28/82/03/607288203.db2.gz RVCUWGJOAMZYOA-RHSMWYFYSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1c(NC(=O)N2CC[C@@H](c3ccccc3)[C@H]2C)cccc1-c1nn[n-]n1 ZINC000822084906 607288204 /nfs/dbraw/zinc/28/82/04/607288204.db2.gz RVCUWGJOAMZYOA-RHSMWYFYSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1c(NC(=O)N(C)CCc2ccc(Cl)cc2)cccc1-c1nnn[n-]1 ZINC000822077769 607283131 /nfs/dbraw/zinc/28/31/31/607283131.db2.gz XFYUGTQESRYMIV-UHFFFAOYSA-N -1 3 370.844 3.535 20 0 FHADHM Cc1c(NC(=O)N(C)CCc2ccc(Cl)cc2)cccc1-c1nn[n-]n1 ZINC000822077769 607283132 /nfs/dbraw/zinc/28/31/32/607283132.db2.gz XFYUGTQESRYMIV-UHFFFAOYSA-N -1 3 370.844 3.535 20 0 FHADHM Cc1cccc2c1ncc(-c1nnn[n-]1)c2N1Cc2ccccc2[C@@H](C)C1 ZINC000737407634 599256945 /nfs/dbraw/zinc/25/69/45/599256945.db2.gz DIDFOTIVQNHAOA-AWEZNQCLSA-N -1 3 356.433 3.847 20 0 FHADHM Cc1cccc2c1ncc(-c1nn[n-]n1)c2N1Cc2ccccc2[C@@H](C)C1 ZINC000737407634 599256948 /nfs/dbraw/zinc/25/69/48/599256948.db2.gz DIDFOTIVQNHAOA-AWEZNQCLSA-N -1 3 356.433 3.847 20 0 FHADHM Cc1c(NC(=O)NC(C)(C)CCc2ccccc2)cccc1-c1nnn[n-]1 ZINC000822092363 607284787 /nfs/dbraw/zinc/28/47/87/607284787.db2.gz WYCULHILKTWARJ-UHFFFAOYSA-N -1 3 364.453 3.708 20 0 FHADHM Cc1c(NC(=O)NC(C)(C)CCc2ccccc2)cccc1-c1nn[n-]n1 ZINC000822092363 607284788 /nfs/dbraw/zinc/28/47/88/607284788.db2.gz WYCULHILKTWARJ-UHFFFAOYSA-N -1 3 364.453 3.708 20 0 FHADHM Cc1c(NC(=O)N(C)[C@H](C)c2cc(F)ccc2F)cccc1-c1nnn[n-]1 ZINC000822077814 607286242 /nfs/dbraw/zinc/28/62/42/607286242.db2.gz YMCPHZKCWMTHPG-LLVKDONJSA-N -1 3 372.379 3.678 20 0 FHADHM Cc1c(NC(=O)N(C)[C@H](C)c2cc(F)ccc2F)cccc1-c1nn[n-]n1 ZINC000822077814 607286243 /nfs/dbraw/zinc/28/62/43/607286243.db2.gz YMCPHZKCWMTHPG-LLVKDONJSA-N -1 3 372.379 3.678 20 0 FHADHM CCN(Cc1ccccc1C)C(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000821231179 607287024 /nfs/dbraw/zinc/28/70/24/607287024.db2.gz XJVRCFOUYMNDBD-UHFFFAOYSA-N -1 3 350.426 3.538 20 0 FHADHM CCN(Cc1ccccc1C)C(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000821231179 607287025 /nfs/dbraw/zinc/28/70/25/607287025.db2.gz XJVRCFOUYMNDBD-UHFFFAOYSA-N -1 3 350.426 3.538 20 0 FHADHM CCSc1cccc(NC(=O)Nc2cccc(-c3nnn[n-]3)c2C)c1 ZINC000821462212 607291157 /nfs/dbraw/zinc/29/11/57/607291157.db2.gz XENGKABTWMNJLA-UHFFFAOYSA-N -1 3 354.439 3.931 20 0 FHADHM CCSc1cccc(NC(=O)Nc2cccc(-c3nn[n-]n3)c2C)c1 ZINC000821462212 607291158 /nfs/dbraw/zinc/29/11/58/607291158.db2.gz XENGKABTWMNJLA-UHFFFAOYSA-N -1 3 354.439 3.931 20 0 FHADHM CCc1ccc([C@H]2CCCN2C(=O)Nc2cccc(-c3nnn[n-]3)c2C)o1 ZINC000821481757 607292162 /nfs/dbraw/zinc/29/21/62/607292162.db2.gz NFLRNMVEZNZPRE-MRXNPFEDSA-N -1 3 366.425 3.700 20 0 FHADHM CCc1ccc([C@H]2CCCN2C(=O)Nc2cccc(-c3nn[n-]n3)c2C)o1 ZINC000821481757 607292163 /nfs/dbraw/zinc/29/21/63/607292163.db2.gz NFLRNMVEZNZPRE-MRXNPFEDSA-N -1 3 366.425 3.700 20 0 FHADHM Cc1c(NC(=O)N2CCC3(CCCCC3)CC2)cccc1-c1nnn[n-]1 ZINC000822084560 607292463 /nfs/dbraw/zinc/29/24/63/607292463.db2.gz NAHWVTCQEVXLBV-UHFFFAOYSA-N -1 3 354.458 3.753 20 0 FHADHM Cc1c(NC(=O)N2CCC3(CCCCC3)CC2)cccc1-c1nn[n-]n1 ZINC000822084560 607292464 /nfs/dbraw/zinc/29/24/64/607292464.db2.gz NAHWVTCQEVXLBV-UHFFFAOYSA-N -1 3 354.458 3.753 20 0 FHADHM Cc1c(NC(=O)N(Cc2ccc(F)cc2)C(C)C)cccc1-c1nnn[n-]1 ZINC000822084687 607292504 /nfs/dbraw/zinc/29/25/04/607292504.db2.gz NTHHUBQPHFOOQF-UHFFFAOYSA-N -1 3 368.416 3.757 20 0 FHADHM Cc1c(NC(=O)N(Cc2ccc(F)cc2)C(C)C)cccc1-c1nn[n-]n1 ZINC000822084687 607292505 /nfs/dbraw/zinc/29/25/05/607292505.db2.gz NTHHUBQPHFOOQF-UHFFFAOYSA-N -1 3 368.416 3.757 20 0 FHADHM Cc1c(NC(=O)NCc2cc3ccccc3s2)cccc1-c1nnn[n-]1 ZINC000822102549 607292864 /nfs/dbraw/zinc/29/28/64/607292864.db2.gz BCNXTZFPFKWEJL-UHFFFAOYSA-N -1 3 364.434 3.712 20 0 FHADHM Cc1c(NC(=O)NCc2cc3ccccc3s2)cccc1-c1nn[n-]n1 ZINC000822102549 607292865 /nfs/dbraw/zinc/29/28/65/607292865.db2.gz BCNXTZFPFKWEJL-UHFFFAOYSA-N -1 3 364.434 3.712 20 0 FHADHM O=C(Nc1ccc(F)cc1OC1CCCC1)c1cc(-c2nnn[n-]2)cs1 ZINC000823346487 607294629 /nfs/dbraw/zinc/29/46/29/607294629.db2.gz OAWAISJNTHYRCJ-UHFFFAOYSA-N -1 3 373.413 3.641 20 0 FHADHM O=C(Nc1ccc(F)cc1OC1CCCC1)c1cc(-c2nn[n-]n2)cs1 ZINC000823346487 607294630 /nfs/dbraw/zinc/29/46/30/607294630.db2.gz OAWAISJNTHYRCJ-UHFFFAOYSA-N -1 3 373.413 3.641 20 0 FHADHM Cc1cc(Cl)ccc1O[C@H](C)C(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000822202247 607295203 /nfs/dbraw/zinc/29/52/03/607295203.db2.gz SCXRLXPLWMAMAA-GFCCVEGCSA-N -1 3 371.828 3.543 20 0 FHADHM Cc1cc(Cl)ccc1O[C@H](C)C(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000822202247 607295204 /nfs/dbraw/zinc/29/52/04/607295204.db2.gz SCXRLXPLWMAMAA-GFCCVEGCSA-N -1 3 371.828 3.543 20 0 FHADHM Cc1nc2ccccc2c(C)c1CC(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000822462610 607297626 /nfs/dbraw/zinc/29/76/26/607297626.db2.gz JMDNNQBLUHKMDU-UHFFFAOYSA-N -1 3 372.432 3.521 20 0 FHADHM Cc1nc2ccccc2c(C)c1CC(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000822462610 607297627 /nfs/dbraw/zinc/29/76/27/607297627.db2.gz JMDNNQBLUHKMDU-UHFFFAOYSA-N -1 3 372.432 3.521 20 0 FHADHM CCN(C(=O)CCCC[C@@H](C)C(C)=O)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821154786 607299766 /nfs/dbraw/zinc/29/97/66/607299766.db2.gz RNRHRFSUUPGLAY-CABCVRRESA-N -1 3 371.485 3.562 20 0 FHADHM CCN(C(=O)CCCC[C@@H](C)C(C)=O)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821154786 607299767 /nfs/dbraw/zinc/29/97/67/607299767.db2.gz RNRHRFSUUPGLAY-CABCVRRESA-N -1 3 371.485 3.562 20 0 FHADHM C[C@H](NC(=O)c1sccc1-c1nnn[n-]1)c1cccc(Cl)c1Cl ZINC000736124920 599261324 /nfs/dbraw/zinc/26/13/24/599261324.db2.gz IWRUWFFDSJVSHT-ZETCQYMHSA-N -1 3 368.249 3.726 20 0 FHADHM C[C@H](NC(=O)c1sccc1-c1nn[n-]n1)c1cccc(Cl)c1Cl ZINC000736124920 599261326 /nfs/dbraw/zinc/26/13/26/599261326.db2.gz IWRUWFFDSJVSHT-ZETCQYMHSA-N -1 3 368.249 3.726 20 0 FHADHM COc1ccc(CNc2ccc(OC3CCCC3)cc2)cc1-c1nnn[n-]1 ZINC000821821221 607309120 /nfs/dbraw/zinc/30/91/20/607309120.db2.gz BZTXQZLKSOQOHI-UHFFFAOYSA-N -1 3 365.437 3.809 20 0 FHADHM COc1ccc(CNc2ccc(OC3CCCC3)cc2)cc1-c1nn[n-]n1 ZINC000821821221 607309121 /nfs/dbraw/zinc/30/91/21/607309121.db2.gz BZTXQZLKSOQOHI-UHFFFAOYSA-N -1 3 365.437 3.809 20 0 FHADHM c1cc(NCc2ccc(-c3nnn[n-]3)cc2)cc2c1OC1(CCCCC1)O2 ZINC000823743065 607311312 /nfs/dbraw/zinc/31/13/12/607311312.db2.gz RVGXKXNKSSJSQZ-UHFFFAOYSA-N -1 3 363.421 3.910 20 0 FHADHM c1cc(NCc2ccc(-c3nn[n-]n3)cc2)cc2c1OC1(CCCCC1)O2 ZINC000823743065 607311313 /nfs/dbraw/zinc/31/13/13/607311313.db2.gz RVGXKXNKSSJSQZ-UHFFFAOYSA-N -1 3 363.421 3.910 20 0 FHADHM CC[C@H](C)C[C@@H](C)NC(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(C)C ZINC000820869456 599264890 /nfs/dbraw/zinc/26/48/90/599264890.db2.gz HAZRWBQTEKLUIS-QWHCGFSZSA-N -1 3 360.462 3.600 20 0 FHADHM CC[C@H](C)C[C@@H](C)NC(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(C)C ZINC000820869456 599264891 /nfs/dbraw/zinc/26/48/91/599264891.db2.gz HAZRWBQTEKLUIS-QWHCGFSZSA-N -1 3 360.462 3.600 20 0 FHADHM FC(F)Oc1ccc(NCc2cccc(-c3nnn[n-]3)c2)c2cccnc12 ZINC000822737468 607314784 /nfs/dbraw/zinc/31/47/84/607314784.db2.gz WKPPTPSQZFGVDG-UHFFFAOYSA-N -1 3 368.347 3.628 20 0 FHADHM FC(F)Oc1ccc(NCc2cccc(-c3nn[n-]n3)c2)c2cccnc12 ZINC000822737468 607314785 /nfs/dbraw/zinc/31/47/85/607314785.db2.gz WKPPTPSQZFGVDG-UHFFFAOYSA-N -1 3 368.347 3.628 20 0 FHADHM c1cc(-c2nnn[n-]2)sc1CNc1ccccc1OCc1cscn1 ZINC000823791574 607316683 /nfs/dbraw/zinc/31/66/83/607316683.db2.gz FOCICMKSJFPJIR-UHFFFAOYSA-N -1 3 370.463 3.576 20 0 FHADHM Clc1cc(N2CCC[C@H]2c2ccc3c(c2)OCO3)ccc1-c1nnn[n-]1 ZINC000737565642 599266645 /nfs/dbraw/zinc/26/66/45/599266645.db2.gz NRLLPKTYRQDVAF-HNNXBMFYSA-N -1 3 369.812 3.590 20 0 FHADHM Clc1cc(N2CCC[C@H]2c2ccc3c(c2)OCO3)ccc1-c1nn[n-]n1 ZINC000737565642 599266648 /nfs/dbraw/zinc/26/66/48/599266648.db2.gz NRLLPKTYRQDVAF-HNNXBMFYSA-N -1 3 369.812 3.590 20 0 FHADHM COc1ccc(CNc2ccccc2SC(C)C)cc1-c1nnn[n-]1 ZINC000821825184 607317757 /nfs/dbraw/zinc/31/77/57/607317757.db2.gz UEHXLMYHKYVIBP-UHFFFAOYSA-N -1 3 355.467 3.988 20 0 FHADHM COc1ccc(CNc2ccccc2SC(C)C)cc1-c1nn[n-]n1 ZINC000821825184 607317758 /nfs/dbraw/zinc/31/77/58/607317758.db2.gz UEHXLMYHKYVIBP-UHFFFAOYSA-N -1 3 355.467 3.988 20 0 FHADHM CCCCN1CCc2ccc(NCc3ccc(-c4nnn[n-]4)s3)cc21 ZINC000821066661 607318115 /nfs/dbraw/zinc/31/81/15/607318115.db2.gz VUSTUAXAUNXWHN-UHFFFAOYSA-N -1 3 354.483 3.703 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)C=C(C)c1ccccc1 ZINC000736487409 599276699 /nfs/dbraw/zinc/27/66/99/599276699.db2.gz GJGKWLFIFANEAA-OWBHPGMISA-N -1 3 362.437 3.731 20 0 FHADHM CSCc1ccc(NC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000821970816 599277820 /nfs/dbraw/zinc/27/78/20/599277820.db2.gz SOLZRIXDUJNNCQ-LBPRGKRZSA-N -1 3 368.466 3.612 20 0 FHADHM CSCc1ccc(NC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000821970816 599277822 /nfs/dbraw/zinc/27/78/22/599277822.db2.gz SOLZRIXDUJNNCQ-LBPRGKRZSA-N -1 3 368.466 3.612 20 0 FHADHM c1sc(CNc2cccc(N3CCCCCC3)c2)cc1-c1nnn[n-]1 ZINC000823757486 607318238 /nfs/dbraw/zinc/31/82/38/607318238.db2.gz QXFQPSPFYHWDDC-UHFFFAOYSA-N -1 3 354.483 3.921 20 0 FHADHM c1sc(CNc2cccc(N3CCCCCC3)c2)cc1-c1nn[n-]n1 ZINC000823757486 607318239 /nfs/dbraw/zinc/31/82/39/607318239.db2.gz QXFQPSPFYHWDDC-UHFFFAOYSA-N -1 3 354.483 3.921 20 0 FHADHM CCOc1ccc2[nH]c(S[C@H](C)c3ccc(-c4nn[n-]n4)cc3)nc2c1 ZINC000736652254 599285483 /nfs/dbraw/zinc/28/54/83/599285483.db2.gz WDZUFRGYDZWXJG-LLVKDONJSA-N -1 3 366.450 3.995 20 0 FHADHM CCOc1ccc2[nH]c(S[C@@H](C)c3ccc(-c4nn[n-]n4)cc3)nc2c1 ZINC000736652258 599285741 /nfs/dbraw/zinc/28/57/41/599285741.db2.gz WDZUFRGYDZWXJG-NSHDSACASA-N -1 3 366.450 3.995 20 0 FHADHM C[C@H](Sc1nccn1Cc1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736190972 599286656 /nfs/dbraw/zinc/28/66/56/599286656.db2.gz GJCZMULRGGDUFE-AWEZNQCLSA-N -1 3 362.462 3.965 20 0 FHADHM C[C@H](Sc1nccn1Cc1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736190972 599286658 /nfs/dbraw/zinc/28/66/58/599286658.db2.gz GJCZMULRGGDUFE-AWEZNQCLSA-N -1 3 362.462 3.965 20 0 FHADHM COC(=O)c1cccc(CS[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736948674 599290215 /nfs/dbraw/zinc/29/02/15/599290215.db2.gz OHVGEOOTQGOVDZ-GFCCVEGCSA-N -1 3 354.435 3.648 20 0 FHADHM COC(=O)c1cccc(CS[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736948674 599290217 /nfs/dbraw/zinc/29/02/17/599290217.db2.gz OHVGEOOTQGOVDZ-GFCCVEGCSA-N -1 3 354.435 3.648 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1ccc(C(F)(F)F)c(C)c1 ZINC000826250142 607338891 /nfs/dbraw/zinc/33/88/91/607338891.db2.gz MPLKSTGZDOAHOK-UHFFFAOYSA-N -1 3 361.327 3.755 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1ccc(C(F)(F)F)c(C)c1 ZINC000826250142 607338892 /nfs/dbraw/zinc/33/88/92/607338892.db2.gz MPLKSTGZDOAHOK-UHFFFAOYSA-N -1 3 361.327 3.755 20 0 FHADHM CCSc1ccc(Cl)cc1NC(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000736666522 598234643 /nfs/dbraw/zinc/23/46/43/598234643.db2.gz KMOUJQGERFWNRM-UHFFFAOYSA-N -1 3 359.842 3.884 20 0 FHADHM CCSc1ccc(Cl)cc1NC(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC000736666522 598234644 /nfs/dbraw/zinc/23/46/44/598234644.db2.gz KMOUJQGERFWNRM-UHFFFAOYSA-N -1 3 359.842 3.884 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1NCc1ccc(OC(F)(F)F)cc1 ZINC000737645300 598236433 /nfs/dbraw/zinc/23/64/33/598236433.db2.gz WOFSUVVLHIYPFW-UHFFFAOYSA-N -1 3 353.279 3.517 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1NCc1ccccc1OC1CCCC1 ZINC000737644636 598239530 /nfs/dbraw/zinc/23/95/30/598239530.db2.gz JFMYPTVJJRGXCY-UHFFFAOYSA-N -1 3 353.401 3.939 20 0 FHADHM Fc1ccc(Br)c(CNc2ccc(-c3nn[n-]n3)cc2F)c1 ZINC000737651308 598241054 /nfs/dbraw/zinc/24/10/54/598241054.db2.gz RMSQHMIHAQVWEE-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1ccc(CNc2ccc(-c3nn[n-]n3)cc2F)c(Br)c1 ZINC000737651498 598241266 /nfs/dbraw/zinc/24/12/66/598241266.db2.gz XGTXGJRFZKUVGY-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nnn[n-]2)c1)[C@@H]1CCCc2sccc21 ZINC000823332946 607348631 /nfs/dbraw/zinc/34/86/31/607348631.db2.gz VKKPHFJMGXKVAL-LLVKDONJSA-N -1 3 359.842 3.640 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nn[n-]n2)c1)[C@@H]1CCCc2sccc21 ZINC000823332946 607348633 /nfs/dbraw/zinc/34/86/33/607348633.db2.gz VKKPHFJMGXKVAL-LLVKDONJSA-N -1 3 359.842 3.640 20 0 FHADHM COc1ccc2cc([C@H](C)C(=O)Nc3cccc(-c4nnn[n-]4)c3)ccc2c1 ZINC000546741199 598287333 /nfs/dbraw/zinc/28/73/33/598287333.db2.gz LESMIQSCVCVMCN-ZDUSSCGKSA-N -1 3 373.416 3.771 20 0 FHADHM COc1ccc2cc([C@H](C)C(=O)Nc3cccc(-c4nn[n-]n4)c3)ccc2c1 ZINC000546741199 598287336 /nfs/dbraw/zinc/28/73/36/598287336.db2.gz LESMIQSCVCVMCN-ZDUSSCGKSA-N -1 3 373.416 3.771 20 0 FHADHM CCN(Cc1c(F)cccc1F)C(=O)Nc1cc(-c2nnn[n-]2)ccc1C ZINC000736556052 598292609 /nfs/dbraw/zinc/29/26/09/598292609.db2.gz UJFPSJHVDOGKHS-UHFFFAOYSA-N -1 3 372.379 3.507 20 0 FHADHM CCN(Cc1c(F)cccc1F)C(=O)Nc1cc(-c2nn[n-]n2)ccc1C ZINC000736556052 598292611 /nfs/dbraw/zinc/29/26/11/598292611.db2.gz UJFPSJHVDOGKHS-UHFFFAOYSA-N -1 3 372.379 3.507 20 0 FHADHM CC(C)(C)OCc1cccc(CNc2ccc(-c3nn[n-]n3)cc2F)c1 ZINC000735639650 598298537 /nfs/dbraw/zinc/29/85/37/598298537.db2.gz LMLWVRSVSRMPTH-UHFFFAOYSA-N -1 3 355.417 3.933 20 0 FHADHM S=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)Nc1ccccc1Cl ZINC000738409178 598316612 /nfs/dbraw/zinc/31/66/12/598316612.db2.gz RGYNVFYXRXYROE-UHFFFAOYSA-N -1 3 365.249 3.982 20 0 FHADHM S=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)Nc1ccccc1Cl ZINC000738409178 598316614 /nfs/dbraw/zinc/31/66/14/598316614.db2.gz RGYNVFYXRXYROE-UHFFFAOYSA-N -1 3 365.249 3.982 20 0 FHADHM Fc1ccc(-c2ccc(CNCc3ccc(-c4nnn[n-]4)cc3F)o2)cc1 ZINC000737653316 598316717 /nfs/dbraw/zinc/31/67/17/598316717.db2.gz QYDFKQZIYXSQMI-UHFFFAOYSA-N -1 3 367.359 3.695 20 0 FHADHM Fc1ccc(-c2ccc(CNCc3ccc(-c4nn[n-]n4)cc3F)o2)cc1 ZINC000737653316 598316719 /nfs/dbraw/zinc/31/67/19/598316719.db2.gz QYDFKQZIYXSQMI-UHFFFAOYSA-N -1 3 367.359 3.695 20 0 FHADHM C[C@@H]1CCC[C@@H](NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)[C@H]1C ZINC000736249122 598317358 /nfs/dbraw/zinc/31/73/58/598317358.db2.gz FDQRFAIOCIZMAI-ISTVAULSSA-N -1 3 364.906 3.631 20 0 FHADHM C[C@@H]1CCC[C@@H](NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)[C@H]1C ZINC000736249122 598317360 /nfs/dbraw/zinc/31/73/60/598317360.db2.gz FDQRFAIOCIZMAI-ISTVAULSSA-N -1 3 364.906 3.631 20 0 FHADHM Cc1cc(C)cc(NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c1 ZINC000737250751 598317690 /nfs/dbraw/zinc/31/76/90/598317690.db2.gz OKSLQMREVLGTEX-UHFFFAOYSA-N -1 3 358.858 3.946 20 0 FHADHM Cc1cc(C)cc(NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c1 ZINC000737250751 598317691 /nfs/dbraw/zinc/31/76/91/598317691.db2.gz OKSLQMREVLGTEX-UHFFFAOYSA-N -1 3 358.858 3.946 20 0 FHADHM Fc1ccc(NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c(F)c1 ZINC000737661503 598317755 /nfs/dbraw/zinc/31/77/55/598317755.db2.gz XQNXIYNUJULYPA-UHFFFAOYSA-N -1 3 366.784 3.607 20 0 FHADHM Fc1ccc(NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c(F)c1 ZINC000737661503 598317757 /nfs/dbraw/zinc/31/77/57/598317757.db2.gz XQNXIYNUJULYPA-UHFFFAOYSA-N -1 3 366.784 3.607 20 0 FHADHM C[C@H]1CCC[C@@H](N(C)C(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)C1 ZINC000736247110 598318307 /nfs/dbraw/zinc/31/83/07/598318307.db2.gz AALYXPLVBKMRAZ-CMPLNLGQSA-N -1 3 364.906 3.727 20 0 FHADHM C[C@H]1CCC[C@@H](N(C)C(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)C1 ZINC000736247110 598318308 /nfs/dbraw/zinc/31/83/08/598318308.db2.gz AALYXPLVBKMRAZ-CMPLNLGQSA-N -1 3 364.906 3.727 20 0 FHADHM Fc1cc(F)cc(NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c1 ZINC000737650340 598318763 /nfs/dbraw/zinc/31/87/63/598318763.db2.gz HPOSBEQPNZRIIA-UHFFFAOYSA-N -1 3 366.784 3.607 20 0 FHADHM Fc1cc(F)cc(NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c1 ZINC000737650340 598318765 /nfs/dbraw/zinc/31/87/65/598318765.db2.gz HPOSBEQPNZRIIA-UHFFFAOYSA-N -1 3 366.784 3.607 20 0 FHADHM C[C@@H]1CN(C(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c2ccccc21 ZINC000736288368 598320054 /nfs/dbraw/zinc/32/00/54/598320054.db2.gz AZYYEVOCKMWDLV-SNVBAGLBSA-N -1 3 370.869 3.841 20 0 FHADHM C[C@@H]1CN(C(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c2ccccc21 ZINC000736288368 598320056 /nfs/dbraw/zinc/32/00/56/598320056.db2.gz AZYYEVOCKMWDLV-SNVBAGLBSA-N -1 3 370.869 3.841 20 0 FHADHM COc1ccc(Cl)cc1COc1ccc(-c2nnn[n-]2)cc1Cl ZINC000737098242 598322520 /nfs/dbraw/zinc/32/25/20/598322520.db2.gz AAEKFUSBXCJZNE-UHFFFAOYSA-N -1 3 351.193 3.761 20 0 FHADHM COc1ccc(Cl)cc1COc1ccc(-c2nn[n-]n2)cc1Cl ZINC000737098242 598322522 /nfs/dbraw/zinc/32/25/22/598322522.db2.gz AAEKFUSBXCJZNE-UHFFFAOYSA-N -1 3 351.193 3.761 20 0 FHADHM O=C(c1ccccc1-c1ccccc1-c1nnn[n-]1)N1Cc2ccccc2C1 ZINC000738279975 598360047 /nfs/dbraw/zinc/36/00/47/598360047.db2.gz ZCEOSOZPQATLON-UHFFFAOYSA-N -1 3 367.412 3.690 20 0 FHADHM O=C(c1ccccc1-c1ccccc1-c1nn[n-]n1)N1Cc2ccccc2C1 ZINC000738279975 598360049 /nfs/dbraw/zinc/36/00/49/598360049.db2.gz ZCEOSOZPQATLON-UHFFFAOYSA-N -1 3 367.412 3.690 20 0 FHADHM Cc1sc(NC(=O)C[C@@H](C)c2ccccc2F)c(-c2nnn[n-]2)c1C ZINC000737562403 598366001 /nfs/dbraw/zinc/36/60/01/598366001.db2.gz MXDYSNGJLXXRIZ-SECBINFHSA-N -1 3 359.430 3.816 20 0 FHADHM Cc1sc(NC(=O)C[C@@H](C)c2ccccc2F)c(-c2nn[n-]n2)c1C ZINC000737562403 598366002 /nfs/dbraw/zinc/36/60/02/598366002.db2.gz MXDYSNGJLXXRIZ-SECBINFHSA-N -1 3 359.430 3.816 20 0 FHADHM c1cc2c(ncnc2Nc2ccc(Oc3ccccc3-c3nnn[n-]3)cc2)[nH]1 ZINC000738425794 598391869 /nfs/dbraw/zinc/39/18/69/598391869.db2.gz NZZYKTXZSAUXKE-UHFFFAOYSA-N -1 3 370.376 3.674 20 0 FHADHM c1cc2c(ncnc2Nc2ccc(Oc3ccccc3-c3nn[n-]n3)cc2)[nH]1 ZINC000738425794 598391871 /nfs/dbraw/zinc/39/18/71/598391871.db2.gz NZZYKTXZSAUXKE-UHFFFAOYSA-N -1 3 370.376 3.674 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1NCc1ccc(OC2CCCC2)cc1 ZINC000737558913 598393583 /nfs/dbraw/zinc/39/35/83/598393583.db2.gz RQFJAKQHRGJCOR-UHFFFAOYSA-N -1 3 370.844 3.849 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1NCc1ccc(OC2CCCC2)cc1 ZINC000737558913 598393585 /nfs/dbraw/zinc/39/35/85/598393585.db2.gz RQFJAKQHRGJCOR-UHFFFAOYSA-N -1 3 370.844 3.849 20 0 FHADHM C[C@H]1CCc2c(sc(NC(=O)CC3=CCCCC3)c2-c2nnn[n-]2)C1 ZINC000736279739 598393794 /nfs/dbraw/zinc/39/37/94/598393794.db2.gz MCZBLLPPXNIAHD-NSHDSACASA-N -1 3 357.483 3.882 20 0 FHADHM C[C@H]1CCc2c(sc(NC(=O)CC3=CCCCC3)c2-c2nn[n-]n2)C1 ZINC000736279739 598393796 /nfs/dbraw/zinc/39/37/96/598393796.db2.gz MCZBLLPPXNIAHD-NSHDSACASA-N -1 3 357.483 3.882 20 0 FHADHM C[C@H](OC(=O)Cc1ccc(-c2nnn[n-]2)cc1)c1ccc(F)cc1Cl ZINC000737196457 598416613 /nfs/dbraw/zinc/41/66/13/598416613.db2.gz KAVATYSQOMIJAC-JTQLQIEISA-N -1 3 360.776 3.506 20 0 FHADHM C[C@H](OC(=O)Cc1ccc(-c2nn[n-]n2)cc1)c1ccc(F)cc1Cl ZINC000737196457 598416614 /nfs/dbraw/zinc/41/66/14/598416614.db2.gz KAVATYSQOMIJAC-JTQLQIEISA-N -1 3 360.776 3.506 20 0 FHADHM O=C(C[C@H]1C=CCC1)Nc1ccccc1NCc1ccc(-c2nnn[n-]2)cc1 ZINC000737811398 598418235 /nfs/dbraw/zinc/41/82/35/598418235.db2.gz AXVUSDRGSJECEN-HNNXBMFYSA-N -1 3 374.448 3.774 20 0 FHADHM O=C(C[C@H]1C=CCC1)Nc1ccccc1NCc1ccc(-c2nn[n-]n2)cc1 ZINC000737811398 598418236 /nfs/dbraw/zinc/41/82/36/598418236.db2.gz AXVUSDRGSJECEN-HNNXBMFYSA-N -1 3 374.448 3.774 20 0 FHADHM COc1ccccc1-c1nc(CNc2cccc(-c3nnn[n-]3)c2)cs1 ZINC000737143953 598420409 /nfs/dbraw/zinc/42/04/09/598420409.db2.gz WXHZXLJNRTXHKN-UHFFFAOYSA-N -1 3 364.434 3.611 20 0 FHADHM COc1ccccc1-c1nc(CNc2cccc(-c3nn[n-]n3)c2)cs1 ZINC000737143953 598420411 /nfs/dbraw/zinc/42/04/11/598420411.db2.gz WXHZXLJNRTXHKN-UHFFFAOYSA-N -1 3 364.434 3.611 20 0 FHADHM Cc1ccc(F)cc1NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C(C)C ZINC000737347785 598426766 /nfs/dbraw/zinc/42/67/66/598426766.db2.gz RBXQSGZYFNTKLI-UHFFFAOYSA-N -1 3 368.416 3.757 20 0 FHADHM Cc1ccc(F)cc1NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C(C)C ZINC000737347785 598426767 /nfs/dbraw/zinc/42/67/67/598426767.db2.gz RBXQSGZYFNTKLI-UHFFFAOYSA-N -1 3 368.416 3.757 20 0 FHADHM Cc1ccc(C)c(NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)c1 ZINC000737326472 598426795 /nfs/dbraw/zinc/42/67/95/598426795.db2.gz OIFYLAUKECDKJE-UHFFFAOYSA-N -1 3 364.453 3.926 20 0 FHADHM Cc1ccc(C)c(NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)c1 ZINC000737326472 598426797 /nfs/dbraw/zinc/42/67/97/598426797.db2.gz OIFYLAUKECDKJE-UHFFFAOYSA-N -1 3 364.453 3.926 20 0 FHADHM C[C@H](NC(=O)Nc1ccc(-c2nnn[n-]2)cc1)c1cc2ccccc2s1 ZINC000736119330 598428501 /nfs/dbraw/zinc/42/85/01/598428501.db2.gz XOVHWFBVDFEXFE-NSHDSACASA-N -1 3 364.434 3.964 20 0 FHADHM C[C@H](NC(=O)Nc1ccc(-c2nn[n-]n2)cc1)c1cc2ccccc2s1 ZINC000736119330 598428503 /nfs/dbraw/zinc/42/85/03/598428503.db2.gz XOVHWFBVDFEXFE-NSHDSACASA-N -1 3 364.434 3.964 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)NC[C@H]1CCC[C@@H](C)C1 ZINC000736247314 598429518 /nfs/dbraw/zinc/42/95/18/598429518.db2.gz BKMCGXBNTLHDIG-WBVHZDCISA-N -1 3 370.501 3.613 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)NC[C@H]1CCC[C@@H](C)C1 ZINC000736247314 598429519 /nfs/dbraw/zinc/42/95/19/598429519.db2.gz BKMCGXBNTLHDIG-WBVHZDCISA-N -1 3 370.501 3.613 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)[C@@H]1C[C@@H]1c1cccc2ccccc21 ZINC000107542737 598435233 /nfs/dbraw/zinc/43/52/33/598435233.db2.gz FKHVVGCUUVTSIL-RTBURBONSA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)[C@@H]1C[C@@H]1c1cccc2ccccc21 ZINC000107542737 598435236 /nfs/dbraw/zinc/43/52/36/598435236.db2.gz FKHVVGCUUVTSIL-RTBURBONSA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Oc1ccc(-c2nnn[n-]2)cc1)[C@@H]1C[C@@H]1c1cccc2ccccc21 ZINC000738251895 598436179 /nfs/dbraw/zinc/43/61/79/598436179.db2.gz STUHRMLDURRKSZ-RTBURBONSA-N -1 3 356.385 3.729 20 0 FHADHM O=C(Oc1ccc(-c2nn[n-]n2)cc1)[C@@H]1C[C@@H]1c1cccc2ccccc21 ZINC000738251895 598436182 /nfs/dbraw/zinc/43/61/82/598436182.db2.gz STUHRMLDURRKSZ-RTBURBONSA-N -1 3 356.385 3.729 20 0 FHADHM COc1ccc(CCCCCC(=O)Nc2sccc2-c2nnn[n-]2)cc1 ZINC000737087471 598441000 /nfs/dbraw/zinc/44/10/00/598441000.db2.gz HPAGMTFSBNROLH-UHFFFAOYSA-N -1 3 371.466 3.678 20 0 FHADHM COc1ccc(CCCCCC(=O)Nc2sccc2-c2nn[n-]n2)cc1 ZINC000737087471 598441001 /nfs/dbraw/zinc/44/10/01/598441001.db2.gz HPAGMTFSBNROLH-UHFFFAOYSA-N -1 3 371.466 3.678 20 0 FHADHM Clc1cccc(-c2cnc(COc3ccc(-c4nn[n-]n4)cc3)o2)c1 ZINC000737573969 598453984 /nfs/dbraw/zinc/45/39/84/598453984.db2.gz IMLHTNRUIILGBV-UHFFFAOYSA-N -1 3 353.769 3.754 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)N1CCC[C@@H](c2ccccc2)CC1 ZINC000738178284 598468861 /nfs/dbraw/zinc/46/88/61/598468861.db2.gz IWTUTMFPCSHGEO-MRXNPFEDSA-N -1 3 362.437 3.668 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)N1CCC[C@@H](c2ccccc2)CC1 ZINC000738178284 598468862 /nfs/dbraw/zinc/46/88/62/598468862.db2.gz IWTUTMFPCSHGEO-MRXNPFEDSA-N -1 3 362.437 3.668 20 0 FHADHM CCCCCC[C@@H](C)NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000736444089 598476188 /nfs/dbraw/zinc/47/61/88/598476188.db2.gz CNMIFODLTDOZSU-OAHLLOKOSA-N -1 3 370.501 3.900 20 0 FHADHM CCCCCC[C@@H](C)NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000736444089 598476189 /nfs/dbraw/zinc/47/61/89/598476189.db2.gz CNMIFODLTDOZSU-OAHLLOKOSA-N -1 3 370.501 3.900 20 0 FHADHM Cc1nc(C(C)(C)C)sc1C(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000737467973 598483398 /nfs/dbraw/zinc/48/33/98/598483398.db2.gz MGHCUVJFGNIJFU-LLVKDONJSA-N -1 3 371.466 3.847 20 0 FHADHM Cc1nc(C(C)(C)C)sc1C(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000737467973 598483399 /nfs/dbraw/zinc/48/33/99/598483399.db2.gz MGHCUVJFGNIJFU-LLVKDONJSA-N -1 3 371.466 3.847 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)C=Cc1ccc(Cl)cc1 ZINC000735656150 598487928 /nfs/dbraw/zinc/48/79/28/598487928.db2.gz VSYFKZKSWYILFX-TWGQIWQCSA-N -1 3 370.844 3.729 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)C=Cc1ccc(Cl)cc1 ZINC000735656150 598487931 /nfs/dbraw/zinc/48/79/31/598487931.db2.gz VSYFKZKSWYILFX-TWGQIWQCSA-N -1 3 370.844 3.729 20 0 FHADHM C[C@H](CC(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C)c1ccccc1F ZINC000735976935 598489876 /nfs/dbraw/zinc/48/98/76/598489876.db2.gz QSCVKRQKVGEADV-GFCCVEGCSA-N -1 3 370.432 3.695 20 0 FHADHM C[C@H](CC(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C)c1ccccc1F ZINC000735976935 598489877 /nfs/dbraw/zinc/48/98/77/598489877.db2.gz QSCVKRQKVGEADV-GFCCVEGCSA-N -1 3 370.432 3.695 20 0 FHADHM CCc1ccc([C@H](C)C(=O)Nc2cc(-c3nnn[n-]3)cn2C(C)(C)C)cc1 ZINC000736690938 598491259 /nfs/dbraw/zinc/49/12/59/598491259.db2.gz WYOCXZUYNNRUJP-ZDUSSCGKSA-N -1 3 366.469 3.728 20 0 FHADHM CCc1ccc([C@H](C)C(=O)Nc2cc(-c3nn[n-]n3)cn2C(C)(C)C)cc1 ZINC000736690938 598491261 /nfs/dbraw/zinc/49/12/61/598491261.db2.gz WYOCXZUYNNRUJP-ZDUSSCGKSA-N -1 3 366.469 3.728 20 0 FHADHM CC[C@@H](CC(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C)c1ccccc1 ZINC000736331825 598491391 /nfs/dbraw/zinc/49/13/91/598491391.db2.gz LTANPIIJFWWFGM-AWEZNQCLSA-N -1 3 366.469 3.946 20 0 FHADHM CC[C@@H](CC(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C)c1ccccc1 ZINC000736331825 598491392 /nfs/dbraw/zinc/49/13/92/598491392.db2.gz LTANPIIJFWWFGM-AWEZNQCLSA-N -1 3 366.469 3.946 20 0 FHADHM C[C@@H](OC(=O)CCn1ccc2ccccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000736147653 598491496 /nfs/dbraw/zinc/49/14/96/598491496.db2.gz DUGJOGZYLQEWIV-CQSZACIVSA-N -1 3 361.405 3.516 20 0 FHADHM C[C@@H](OC(=O)CCn1ccc2ccccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000736147653 598491497 /nfs/dbraw/zinc/49/14/97/598491497.db2.gz DUGJOGZYLQEWIV-CQSZACIVSA-N -1 3 361.405 3.516 20 0 FHADHM C[C@@H](OC(=O)Cc1ccc2c(c1)CCCC2)c1cccc(-c2nnn[n-]2)c1 ZINC000736154711 598491967 /nfs/dbraw/zinc/49/19/67/598491967.db2.gz AOEPSGXYCRXYSQ-CQSZACIVSA-N -1 3 362.433 3.592 20 0 FHADHM C[C@@H](OC(=O)Cc1ccc2c(c1)CCCC2)c1cccc(-c2nn[n-]n2)c1 ZINC000736154711 598491970 /nfs/dbraw/zinc/49/19/70/598491970.db2.gz AOEPSGXYCRXYSQ-CQSZACIVSA-N -1 3 362.433 3.592 20 0 FHADHM Cc1ccc(OCCCC(=O)O[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000737364898 598492474 /nfs/dbraw/zinc/49/24/74/598492474.db2.gz HFDONEACPNBBOT-OAHLLOKOSA-N -1 3 366.421 3.639 20 0 FHADHM Cc1ccc(OCCCC(=O)O[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000737364898 598492475 /nfs/dbraw/zinc/49/24/75/598492475.db2.gz HFDONEACPNBBOT-OAHLLOKOSA-N -1 3 366.421 3.639 20 0 FHADHM Cc1ncccc1C(=O)Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1 ZINC000737501028 598493541 /nfs/dbraw/zinc/49/35/41/598493541.db2.gz HIIYJYOVYFCBOW-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1ncccc1C(=O)Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1 ZINC000737501028 598493542 /nfs/dbraw/zinc/49/35/42/598493542.db2.gz HIIYJYOVYFCBOW-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM O=C(Nc1cccc(Sc2ccccc2)c1)c1ccc(-c2nnn[n-]2)cn1 ZINC000738186444 598495653 /nfs/dbraw/zinc/49/56/53/598495653.db2.gz ZGRPSGQFAZINQP-UHFFFAOYSA-N -1 3 374.429 3.665 20 0 FHADHM O=C(Nc1cccc(Sc2ccccc2)c1)c1ccc(-c2nn[n-]n2)cn1 ZINC000738186444 598495655 /nfs/dbraw/zinc/49/56/55/598495655.db2.gz ZGRPSGQFAZINQP-UHFFFAOYSA-N -1 3 374.429 3.665 20 0 FHADHM COc1ccccc1[C@H](NCc1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000737149695 598512334 /nfs/dbraw/zinc/51/23/34/598512334.db2.gz YQSXEPDCIKPZRF-OAQYLSRUSA-N -1 3 371.444 3.755 20 0 FHADHM CC[C@@H](Cc1ccccc1)NC(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736349552 598532560 /nfs/dbraw/zinc/53/25/60/598532560.db2.gz GOWKGMUSTGXIRQ-ZDUSSCGKSA-N -1 3 370.844 3.663 20 0 FHADHM CC[C@@H](Cc1ccccc1)NC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736349552 598532562 /nfs/dbraw/zinc/53/25/62/598532562.db2.gz GOWKGMUSTGXIRQ-ZDUSSCGKSA-N -1 3 370.844 3.663 20 0 FHADHM Cc1cc(OCc2cccc(-c3nnn[n-]3)c2)ccc1NC(=O)C(C)(C)C ZINC000737278648 598542454 /nfs/dbraw/zinc/54/24/54/598542454.db2.gz CHPUSGZYOGRCKC-UHFFFAOYSA-N -1 3 365.437 3.739 20 0 FHADHM Cc1cc(OCc2cccc(-c3nn[n-]n3)c2)ccc1NC(=O)C(C)(C)C ZINC000737278648 598542455 /nfs/dbraw/zinc/54/24/55/598542455.db2.gz CHPUSGZYOGRCKC-UHFFFAOYSA-N -1 3 365.437 3.739 20 0 FHADHM Cc1oc(-c2ccccc2)nc1COc1ccc(-c2nnn[n-]2)c(F)c1 ZINC000737548118 598549043 /nfs/dbraw/zinc/54/90/43/598549043.db2.gz MUOULMSUNMECRV-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM Cc1oc(-c2ccccc2)nc1COc1ccc(-c2nn[n-]n2)c(F)c1 ZINC000737548118 598549044 /nfs/dbraw/zinc/54/90/44/598549044.db2.gz MUOULMSUNMECRV-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM Cc1cc(C)c(C)c(C(=O)COc2ccc(-c3nnn[n-]3)c(F)c2)c1C ZINC000737247713 598549389 /nfs/dbraw/zinc/54/93/89/598549389.db2.gz ZRIIEJXIBAUYBA-UHFFFAOYSA-N -1 3 354.385 3.501 20 0 FHADHM Cc1cc(C)c(C)c(C(=O)COc2ccc(-c3nn[n-]n3)c(F)c2)c1C ZINC000737247713 598549390 /nfs/dbraw/zinc/54/93/90/598549390.db2.gz ZRIIEJXIBAUYBA-UHFFFAOYSA-N -1 3 354.385 3.501 20 0 FHADHM CSC[C@H](C)C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCCCC2 ZINC000737180860 598553617 /nfs/dbraw/zinc/55/36/17/598553617.db2.gz SEWNYHIXJJZARO-JTQLQIEISA-N -1 3 365.528 3.525 20 0 FHADHM CSC[C@H](C)C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCCCC2 ZINC000737180860 598553618 /nfs/dbraw/zinc/55/36/18/598553618.db2.gz SEWNYHIXJJZARO-JTQLQIEISA-N -1 3 365.528 3.525 20 0 FHADHM c1cc2c(ncnc2Nc2ccc(Oc3cccc(-c4nnn[n-]4)c3)cc2)[nH]1 ZINC000738422408 598557711 /nfs/dbraw/zinc/55/77/11/598557711.db2.gz XZNSTGXVMCHOHK-UHFFFAOYSA-N -1 3 370.376 3.674 20 0 FHADHM c1cc2c(ncnc2Nc2ccc(Oc3cccc(-c4nn[n-]n4)c3)cc2)[nH]1 ZINC000738422408 598557713 /nfs/dbraw/zinc/55/77/13/598557713.db2.gz XZNSTGXVMCHOHK-UHFFFAOYSA-N -1 3 370.376 3.674 20 0 FHADHM Cc1ccc(CN(C)C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)s1 ZINC000737339805 598559323 /nfs/dbraw/zinc/55/93/23/598559323.db2.gz BNSQCJXOSFVVQE-UHFFFAOYSA-N -1 3 362.846 3.554 20 0 FHADHM Cc1ccc(CN(C)C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)s1 ZINC000737339805 598559325 /nfs/dbraw/zinc/55/93/25/598559325.db2.gz BNSQCJXOSFVVQE-UHFFFAOYSA-N -1 3 362.846 3.554 20 0 FHADHM C[C@H](Nc1nc2ccccn2c1-c1nnn[n-]1)c1ccc2c(c1)CCCC2 ZINC000736136023 598566062 /nfs/dbraw/zinc/56/60/62/598566062.db2.gz DBCYFGSRVCPHER-ZDUSSCGKSA-N -1 3 359.437 3.566 20 0 FHADHM C[C@H](Nc1nc2ccccn2c1-c1nn[n-]n1)c1ccc2c(c1)CCCC2 ZINC000736136023 598566063 /nfs/dbraw/zinc/56/60/63/598566063.db2.gz DBCYFGSRVCPHER-ZDUSSCGKSA-N -1 3 359.437 3.566 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)CCCCCc1cccs1 ZINC000737057833 598570117 /nfs/dbraw/zinc/57/01/17/598570117.db2.gz JSQPIKXRDKYKOR-UHFFFAOYSA-N -1 3 371.466 3.678 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)CCCCCc1cccs1 ZINC000737057833 598570119 /nfs/dbraw/zinc/57/01/19/598570119.db2.gz JSQPIKXRDKYKOR-UHFFFAOYSA-N -1 3 371.466 3.678 20 0 FHADHM CC[C@H](C)c1ccccc1OCC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000736325694 598587240 /nfs/dbraw/zinc/58/72/40/598587240.db2.gz GSUYOSDWJWTORE-LBPRGKRZSA-N -1 3 369.400 3.537 20 0 FHADHM CC[C@H](C)c1ccccc1OCC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000736325694 598587242 /nfs/dbraw/zinc/58/72/42/598587242.db2.gz GSUYOSDWJWTORE-LBPRGKRZSA-N -1 3 369.400 3.537 20 0 FHADHM CCCCC(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)c(F)c1 ZINC000736438384 598593217 /nfs/dbraw/zinc/59/32/17/598593217.db2.gz JMHRFXJBOFRZSS-UHFFFAOYSA-N -1 3 369.400 3.714 20 0 FHADHM CCCCC(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)c(F)c1 ZINC000736438384 598593219 /nfs/dbraw/zinc/59/32/19/598593219.db2.gz JMHRFXJBOFRZSS-UHFFFAOYSA-N -1 3 369.400 3.714 20 0 FHADHM C[C@@H](Oc1ccc(-c2nn[n-]n2)cc1)c1nc(-c2ccc(Cl)cc2)no1 ZINC000736166898 598608736 /nfs/dbraw/zinc/60/87/36/598608736.db2.gz AAEFZFJMFBOCKD-SNVBAGLBSA-N -1 3 368.784 3.710 20 0 FHADHM Clc1cccc(Cl)c1-c1noc(Cc2ccc(-c3nnn[n-]3)cc2)n1 ZINC000737573279 598608902 /nfs/dbraw/zinc/60/89/02/598608902.db2.gz FMSLSZDYPJZDPF-UHFFFAOYSA-N -1 3 373.203 3.814 20 0 FHADHM Clc1cccc(Cl)c1-c1noc(Cc2ccc(-c3nn[n-]n3)cc2)n1 ZINC000737573279 598608904 /nfs/dbraw/zinc/60/89/04/598608904.db2.gz FMSLSZDYPJZDPF-UHFFFAOYSA-N -1 3 373.203 3.814 20 0 FHADHM Clc1ccccc1Cc1noc(C=Cc2ccccc2-c2nnn[n-]2)n1 ZINC000737585077 598610066 /nfs/dbraw/zinc/61/00/66/598610066.db2.gz YGTLIWBMYFNVHP-MDZDMXLPSA-N -1 3 364.796 3.664 20 0 FHADHM Clc1ccccc1Cc1noc(C=Cc2ccccc2-c2nn[n-]n2)n1 ZINC000737585077 598610067 /nfs/dbraw/zinc/61/00/67/598610067.db2.gz YGTLIWBMYFNVHP-MDZDMXLPSA-N -1 3 364.796 3.664 20 0 FHADHM Clc1cccc(Cc2noc(C=Cc3ccccc3-c3nnn[n-]3)n2)c1 ZINC000737573928 598612651 /nfs/dbraw/zinc/61/26/51/598612651.db2.gz HGYNVZCWYBQMNH-HJWRWDBZSA-N -1 3 364.796 3.664 20 0 FHADHM Clc1cccc(Cc2noc(C=Cc3ccccc3-c3nn[n-]n3)n2)c1 ZINC000737573928 598612652 /nfs/dbraw/zinc/61/26/52/598612652.db2.gz HGYNVZCWYBQMNH-HJWRWDBZSA-N -1 3 364.796 3.664 20 0 FHADHM O=C(c1ccccc1-c1ccccc1-c1nnn[n-]1)N1CCC2(CC2)CC1 ZINC000738279466 598612667 /nfs/dbraw/zinc/61/26/67/598612667.db2.gz SVVRUKDMSDSRBL-UHFFFAOYSA-N -1 3 359.433 3.550 20 0 FHADHM O=C(c1ccccc1-c1ccccc1-c1nn[n-]n1)N1CCC2(CC2)CC1 ZINC000738279466 598612668 /nfs/dbraw/zinc/61/26/68/598612668.db2.gz SVVRUKDMSDSRBL-UHFFFAOYSA-N -1 3 359.433 3.550 20 0 FHADHM CCC[C@@H]1CCCC[C@@H]1NC(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736435452 598617437 /nfs/dbraw/zinc/61/74/37/598617437.db2.gz LTKYZUIUXOQLDR-LXZKKBNFSA-N -1 3 356.474 3.586 20 0 FHADHM CCC[C@@H]1CCCC[C@@H]1NC(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736435452 598617439 /nfs/dbraw/zinc/61/74/39/598617439.db2.gz LTKYZUIUXOQLDR-LXZKKBNFSA-N -1 3 356.474 3.586 20 0 FHADHM Cc1cccc([C@H]2CCCN2C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)c1 ZINC000737389705 598626301 /nfs/dbraw/zinc/62/63/01/598626301.db2.gz NNCZPDNHEXRLIZ-QGZVFWFLSA-N -1 3 366.400 3.683 20 0 FHADHM Cc1cccc([C@H]2CCCN2C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)c1 ZINC000737389705 598626303 /nfs/dbraw/zinc/62/63/03/598626303.db2.gz NNCZPDNHEXRLIZ-QGZVFWFLSA-N -1 3 366.400 3.683 20 0 FHADHM Cc1ccc([C@H](C)N(C)C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)cc1 ZINC000737322347 598629138 /nfs/dbraw/zinc/62/91/38/598629138.db2.gz YPRZVFHVXKMOQW-LBPRGKRZSA-N -1 3 354.389 3.539 20 0 FHADHM Cc1ccc([C@H](C)N(C)C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)cc1 ZINC000737322347 598629139 /nfs/dbraw/zinc/62/91/39/598629139.db2.gz YPRZVFHVXKMOQW-LBPRGKRZSA-N -1 3 354.389 3.539 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(NCc2cccnc2OC2CCCC2)c1 ZINC000737570235 598633390 /nfs/dbraw/zinc/63/33/90/598633390.db2.gz DPECUJFOJQSRCM-UHFFFAOYSA-N -1 3 370.844 3.849 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(NCc2cccnc2OC2CCCC2)c1 ZINC000737570235 598633391 /nfs/dbraw/zinc/63/33/91/598633391.db2.gz DPECUJFOJQSRCM-UHFFFAOYSA-N -1 3 370.844 3.849 20 0 FHADHM Fc1ccc(CSc2nc(-c3ccccc3)c[nH]2)c(-c2nnn[n-]2)c1 ZINC000737649141 598645157 /nfs/dbraw/zinc/64/51/57/598645157.db2.gz LXJPQNRACDLUES-UHFFFAOYSA-N -1 3 352.398 3.688 20 0 FHADHM Fc1ccc(CSc2nc(-c3ccccc3)c[nH]2)c(-c2nn[n-]n2)c1 ZINC000737649141 598645158 /nfs/dbraw/zinc/64/51/58/598645158.db2.gz LXJPQNRACDLUES-UHFFFAOYSA-N -1 3 352.398 3.688 20 0 FHADHM CCc1ccc(NC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736690254 598645205 /nfs/dbraw/zinc/64/52/05/598645205.db2.gz IEGAFXVMKJYYBO-UHFFFAOYSA-N -1 3 365.437 3.617 20 0 FHADHM CCc1ccc(NC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736690254 598645207 /nfs/dbraw/zinc/64/52/07/598645207.db2.gz IEGAFXVMKJYYBO-UHFFFAOYSA-N -1 3 365.437 3.617 20 0 FHADHM CC(C)(C)CC(C)(C)NC(=O)CCCCOc1cccc(-c2nnn[n-]2)c1 ZINC000735593608 598647557 /nfs/dbraw/zinc/64/75/57/598647557.db2.gz LFUOWKLADZEMOX-UHFFFAOYSA-N -1 3 373.501 3.747 20 0 FHADHM CC(C)(C)CC(C)(C)NC(=O)CCCCOc1cccc(-c2nn[n-]n2)c1 ZINC000735593608 598647559 /nfs/dbraw/zinc/64/75/59/598647559.db2.gz LFUOWKLADZEMOX-UHFFFAOYSA-N -1 3 373.501 3.747 20 0 FHADHM CC(C)[C@@H](CC(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000736103693 598652012 /nfs/dbraw/zinc/65/20/12/598652012.db2.gz XSQNTEGMOAKYJR-HNAYVOBHSA-N -1 3 363.465 3.874 20 0 FHADHM CC(C)[C@@H](CC(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000736103693 598652014 /nfs/dbraw/zinc/65/20/14/598652014.db2.gz XSQNTEGMOAKYJR-HNAYVOBHSA-N -1 3 363.465 3.874 20 0 FHADHM CC1CCC(N(C(=O)CSc2ccc(-c3nnn[n-]3)cc2)C2CC2)CC1 ZINC000736236719 598652229 /nfs/dbraw/zinc/65/22/29/598652229.db2.gz LXNXGWNWPBZDAG-UHFFFAOYSA-N -1 3 371.510 3.529 20 0 FHADHM CC1CCC(N(C(=O)CSc2ccc(-c3nn[n-]n3)cc2)C2CC2)CC1 ZINC000736236719 598652230 /nfs/dbraw/zinc/65/22/30/598652230.db2.gz LXNXGWNWPBZDAG-UHFFFAOYSA-N -1 3 371.510 3.529 20 0 FHADHM CC[C@H]1CCCC[C@H]1NC(=O)CCCCOc1cccc(-c2nnn[n-]2)c1 ZINC000736400205 598652483 /nfs/dbraw/zinc/65/24/83/598652483.db2.gz MZVUHOGOJRDNAE-MAUKXSAKSA-N -1 3 371.485 3.501 20 0 FHADHM CC[C@H]1CCCC[C@H]1NC(=O)CCCCOc1cccc(-c2nn[n-]n2)c1 ZINC000736400205 598652484 /nfs/dbraw/zinc/65/24/84/598652484.db2.gz MZVUHOGOJRDNAE-MAUKXSAKSA-N -1 3 371.485 3.501 20 0 FHADHM CCCCC1CCC(NC(=O)CSc2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000736441476 598656653 /nfs/dbraw/zinc/65/66/53/598656653.db2.gz QOFJXMAOGWTFQZ-UHFFFAOYSA-N -1 3 373.526 3.824 20 0 FHADHM CCCCC1CCC(NC(=O)CSc2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000736441476 598656655 /nfs/dbraw/zinc/65/66/55/598656655.db2.gz QOFJXMAOGWTFQZ-UHFFFAOYSA-N -1 3 373.526 3.824 20 0 FHADHM CCCC[C@@H](NC(=O)c1ccc(-c2nnn[n-]2)cc1)c1ccc(OC)cc1 ZINC000736436748 598661763 /nfs/dbraw/zinc/66/17/63/598661763.db2.gz GHXVASREIINTKG-GOSISDBHSA-N -1 3 365.437 3.537 20 0 FHADHM CCCC[C@@H](NC(=O)c1ccc(-c2nn[n-]n2)cc1)c1ccc(OC)cc1 ZINC000736436748 598661765 /nfs/dbraw/zinc/66/17/65/598661765.db2.gz GHXVASREIINTKG-GOSISDBHSA-N -1 3 365.437 3.537 20 0 FHADHM C[C@H]1CCCN(C(=O)c2cccc(Oc3ccc(-c4nnn[n-]4)cc3)c2)C1 ZINC000736264472 598662930 /nfs/dbraw/zinc/66/29/30/598662930.db2.gz DQZVGSJLRBNUSC-AWEZNQCLSA-N -1 3 363.421 3.531 20 0 FHADHM C[C@H]1CCCN(C(=O)c2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)C1 ZINC000736264472 598662932 /nfs/dbraw/zinc/66/29/32/598662932.db2.gz DQZVGSJLRBNUSC-AWEZNQCLSA-N -1 3 363.421 3.531 20 0 FHADHM CC[C@@H]1CCCN1C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736402587 598668386 /nfs/dbraw/zinc/66/83/86/598668386.db2.gz OKOIVAAUOIBZCE-MRXNPFEDSA-N -1 3 363.421 3.674 20 0 FHADHM CC[C@@H]1CCCN1C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736402587 598668388 /nfs/dbraw/zinc/66/83/88/598668388.db2.gz OKOIVAAUOIBZCE-MRXNPFEDSA-N -1 3 363.421 3.674 20 0 FHADHM COc1cc(Cl)ccc1CNc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000737046396 598673596 /nfs/dbraw/zinc/67/35/96/598673596.db2.gz CGSYDJCWBBFHDH-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM COc1cc(Cl)ccc1CNc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000737046396 598673597 /nfs/dbraw/zinc/67/35/97/598673597.db2.gz CGSYDJCWBBFHDH-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM Fc1ccc(CSCc2noc(-c3ccsc3)n2)c(-c2nn[n-]n2)c1 ZINC000737651868 598697226 /nfs/dbraw/zinc/69/72/26/598697226.db2.gz ZAIKJQMCIGRWLY-UHFFFAOYSA-N -1 3 374.426 3.551 20 0 FHADHM Fc1ccc(CSCc2noc(-c3ccsc3)n2)c(-c2nnn[n-]2)c1 ZINC000737651868 598697225 /nfs/dbraw/zinc/69/72/25/598697225.db2.gz ZAIKJQMCIGRWLY-UHFFFAOYSA-N -1 3 374.426 3.551 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nnn[n-]1)c1ccc(Cl)cc1Cl ZINC000738235613 598704377 /nfs/dbraw/zinc/70/43/77/598704377.db2.gz OCQOXPHKTDPQIS-UHFFFAOYSA-N -1 3 367.167 3.670 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nn[n-]n1)c1ccc(Cl)cc1Cl ZINC000738235613 598704379 /nfs/dbraw/zinc/70/43/79/598704379.db2.gz OCQOXPHKTDPQIS-UHFFFAOYSA-N -1 3 367.167 3.670 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nnn[n-]1)c1cc2sccc2s1 ZINC000738234354 598710584 /nfs/dbraw/zinc/71/05/84/598710584.db2.gz COQSECNHQZAWGG-UHFFFAOYSA-N -1 3 360.395 3.639 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nn[n-]n1)c1cc2sccc2s1 ZINC000738234354 598710586 /nfs/dbraw/zinc/71/05/86/598710586.db2.gz COQSECNHQZAWGG-UHFFFAOYSA-N -1 3 360.395 3.639 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nnn[n-]1)[C@@H]1C[C@@H]1c1cccc(Cl)c1 ZINC000738232094 598711654 /nfs/dbraw/zinc/71/16/54/598711654.db2.gz PBZALBGHACRAPD-GDBMZVCRSA-N -1 3 372.787 3.506 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nn[n-]n1)[C@@H]1C[C@@H]1c1cccc(Cl)c1 ZINC000738232094 598711655 /nfs/dbraw/zinc/71/16/55/598711655.db2.gz PBZALBGHACRAPD-GDBMZVCRSA-N -1 3 372.787 3.506 20 0 FHADHM COc1ccccc1[C@@H](C)CC(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000737143743 598727619 /nfs/dbraw/zinc/72/76/19/598727619.db2.gz YZSIJHCKWUBSOI-UONOGXRCSA-N -1 3 366.421 3.673 20 0 FHADHM COc1ccccc1[C@@H](C)CC(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000737143743 598727621 /nfs/dbraw/zinc/72/76/21/598727621.db2.gz YZSIJHCKWUBSOI-UONOGXRCSA-N -1 3 366.421 3.673 20 0 FHADHM O=C(OCc1ccoc1)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000738232920 598727905 /nfs/dbraw/zinc/72/79/05/598727905.db2.gz AVXUARDIUZAADC-UHFFFAOYSA-N -1 3 362.345 3.609 20 0 FHADHM O=C(OCc1ccoc1)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000738232920 598727906 /nfs/dbraw/zinc/72/79/06/598727906.db2.gz AVXUARDIUZAADC-UHFFFAOYSA-N -1 3 362.345 3.609 20 0 FHADHM CCC(=CC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1)c1ccccc1 ZINC000736301828 598734509 /nfs/dbraw/zinc/73/45/09/598734509.db2.gz CCJQSVDUCOMOLU-VKAVYKQESA-N -1 3 373.460 3.851 20 0 FHADHM CCC(=CC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1)c1ccccc1 ZINC000736301828 598734510 /nfs/dbraw/zinc/73/45/10/598734510.db2.gz CCJQSVDUCOMOLU-VKAVYKQESA-N -1 3 373.460 3.851 20 0 FHADHM O=C(CCSc1ccc(-c2nnn[n-]2)cc1)Nc1cccc(Cl)c1 ZINC000737850218 598734919 /nfs/dbraw/zinc/73/49/19/598734919.db2.gz NHDACYKSTQGVFL-UHFFFAOYSA-N -1 3 359.842 3.641 20 0 FHADHM O=C(CCSc1ccc(-c2nn[n-]n2)cc1)Nc1cccc(Cl)c1 ZINC000737850218 598734920 /nfs/dbraw/zinc/73/49/20/598734920.db2.gz NHDACYKSTQGVFL-UHFFFAOYSA-N -1 3 359.842 3.641 20 0 FHADHM CC/C=C\CCOC(=O)c1ccc(Oc2ccc(-c3nnn[n-]3)cn2)cc1 ZINC000736408669 598735376 /nfs/dbraw/zinc/73/53/76/598735376.db2.gz GGUDMSQFTHVDEH-ARJAWSKDSA-N -1 3 365.393 3.567 20 0 FHADHM CC/C=C\CCOC(=O)c1ccc(Oc2ccc(-c3nn[n-]n3)cn2)cc1 ZINC000736408669 598735377 /nfs/dbraw/zinc/73/53/77/598735377.db2.gz GGUDMSQFTHVDEH-ARJAWSKDSA-N -1 3 365.393 3.567 20 0 FHADHM O=C(C[C@@H]1CCc2ccccc2C1)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000737817594 598742375 /nfs/dbraw/zinc/74/23/75/598742375.db2.gz CPNLOTNGZXPCMQ-GFCCVEGCSA-N -1 3 367.840 3.654 20 0 FHADHM O=C(C[C@@H]1CCc2ccccc2C1)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000737817594 598742376 /nfs/dbraw/zinc/74/23/76/598742376.db2.gz CPNLOTNGZXPCMQ-GFCCVEGCSA-N -1 3 367.840 3.654 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)Nc1cccc(Oc2ccncc2)c1 ZINC000738151591 598758584 /nfs/dbraw/zinc/75/85/84/598758584.db2.gz MPSGUDWNPCXSAV-UHFFFAOYSA-N -1 3 373.376 3.698 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)Nc1cccc(Oc2ccncc2)c1 ZINC000738151591 598758586 /nfs/dbraw/zinc/75/85/86/598758586.db2.gz MPSGUDWNPCXSAV-UHFFFAOYSA-N -1 3 373.376 3.698 20 0 FHADHM C[C@@H](SCc1ccccc1)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736189168 598762344 /nfs/dbraw/zinc/76/23/44/598762344.db2.gz BDXVKFZDWILKQM-LLVKDONJSA-N -1 3 373.869 3.781 20 0 FHADHM C[C@@H](SCc1ccccc1)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736189168 598762345 /nfs/dbraw/zinc/76/23/45/598762345.db2.gz BDXVKFZDWILKQM-LLVKDONJSA-N -1 3 373.869 3.781 20 0 FHADHM CC(C)(CCCc1ccccc1)C(=O)Oc1ccc(-c2nnn[n-]2)cc1 ZINC000735664457 598789753 /nfs/dbraw/zinc/78/97/53/598789753.db2.gz JFRRNEQGEOCSMG-UHFFFAOYSA-N -1 3 350.422 3.821 20 0 FHADHM CC(C)(CCCc1ccccc1)C(=O)Oc1ccc(-c2nn[n-]n2)cc1 ZINC000735664457 598789754 /nfs/dbraw/zinc/78/97/54/598789754.db2.gz JFRRNEQGEOCSMG-UHFFFAOYSA-N -1 3 350.422 3.821 20 0 FHADHM CC(C)[C@@H](c1ccccc1)N(C)C(=O)CCc1ccc(-c2nnn[n-]2)cc1 ZINC000735736717 598791053 /nfs/dbraw/zinc/79/10/53/598791053.db2.gz VRPRRDVVCRXBFP-FQEVSTJZSA-N -1 3 363.465 3.655 20 0 FHADHM CC(C)[C@@H](c1ccccc1)N(C)C(=O)CCc1ccc(-c2nn[n-]n2)cc1 ZINC000735736717 598791054 /nfs/dbraw/zinc/79/10/54/598791054.db2.gz VRPRRDVVCRXBFP-FQEVSTJZSA-N -1 3 363.465 3.655 20 0 FHADHM CCCCOc1ncccc1CNc1ccc(Cl)cc1-c1nnn[n-]1 ZINC000736462132 598794301 /nfs/dbraw/zinc/79/43/01/598794301.db2.gz ABWGFJOETANFPT-UHFFFAOYSA-N -1 3 358.833 3.706 20 0 FHADHM CCCCOc1ncccc1CNc1ccc(Cl)cc1-c1nn[n-]n1 ZINC000736462132 598794303 /nfs/dbraw/zinc/79/43/03/598794303.db2.gz ABWGFJOETANFPT-UHFFFAOYSA-N -1 3 358.833 3.706 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1CNc1ccc(C)c(Br)c1 ZINC000821736848 607369105 /nfs/dbraw/zinc/36/91/05/607369105.db2.gz PDHXCYDAYXYBFQ-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CNc1ccc(C)c(Br)c1 ZINC000821736848 607369107 /nfs/dbraw/zinc/36/91/07/607369107.db2.gz PDHXCYDAYXYBFQ-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM CC[C@@H](OC1CCCC1)C(=O)N(CC)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736380648 598802562 /nfs/dbraw/zinc/80/25/62/598802562.db2.gz XNSYTLYJNINDIM-RDTXWAMCSA-N -1 3 371.485 3.514 20 0 FHADHM CC[C@@H](OC1CCCC1)C(=O)N(CC)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736380648 598802563 /nfs/dbraw/zinc/80/25/63/598802563.db2.gz XNSYTLYJNINDIM-RDTXWAMCSA-N -1 3 371.485 3.514 20 0 FHADHM O=C(Nc1ccc(Cl)cc1-n1cccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000738163335 598807650 /nfs/dbraw/zinc/80/76/50/598807650.db2.gz LZXNNUDZEBFNLR-UHFFFAOYSA-N -1 3 364.796 3.563 20 0 FHADHM O=C(Nc1ccc(Cl)cc1-n1cccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000738163335 598807653 /nfs/dbraw/zinc/80/76/53/598807653.db2.gz LZXNNUDZEBFNLR-UHFFFAOYSA-N -1 3 364.796 3.563 20 0 FHADHM Clc1ccc(CN(c2ncccc2-c2nnn[n-]2)C2CC2)cc1Cl ZINC000737577241 598815424 /nfs/dbraw/zinc/81/54/24/598815424.db2.gz VFRZOEPRDFYUQI-UHFFFAOYSA-N -1 3 361.236 3.738 20 0 FHADHM Clc1ccc(CN(c2ncccc2-c2nn[n-]n2)C2CC2)cc1Cl ZINC000737577241 598815426 /nfs/dbraw/zinc/81/54/26/598815426.db2.gz VFRZOEPRDFYUQI-UHFFFAOYSA-N -1 3 361.236 3.738 20 0 FHADHM Cc1ccc(C(=O)Nc2cccc(Oc3ccc(-c4nnn[n-]4)cc3)c2)o1 ZINC000737316577 598821624 /nfs/dbraw/zinc/82/16/24/598821624.db2.gz ZBTUKVZYKPCQDA-UHFFFAOYSA-N -1 3 361.361 3.813 20 0 FHADHM Cc1ccc(C(=O)Nc2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)o1 ZINC000737316577 598821626 /nfs/dbraw/zinc/82/16/26/598821626.db2.gz ZBTUKVZYKPCQDA-UHFFFAOYSA-N -1 3 361.361 3.813 20 0 FHADHM CCN(C(=O)c1coc2ccccc12)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736508779 598821657 /nfs/dbraw/zinc/82/16/57/598821657.db2.gz NEQQPKMTLDMZFP-ZDUSSCGKSA-N -1 3 361.405 3.836 20 0 FHADHM CCN(C(=O)c1coc2ccccc12)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736508779 598821658 /nfs/dbraw/zinc/82/16/58/598821658.db2.gz NEQQPKMTLDMZFP-ZDUSSCGKSA-N -1 3 361.405 3.836 20 0 FHADHM C[C@H](NC(=O)Nc1ncc(C(C)(C)C)s1)c1cccc(-c2nnn[n-]2)c1 ZINC000820380754 599296383 /nfs/dbraw/zinc/29/63/83/599296383.db2.gz ZMRMEFKKVPUTPI-JTQLQIEISA-N -1 3 371.470 3.503 20 0 FHADHM C[C@H](NC(=O)Nc1ncc(C(C)(C)C)s1)c1cccc(-c2nn[n-]n2)c1 ZINC000820380754 599296385 /nfs/dbraw/zinc/29/63/85/599296385.db2.gz ZMRMEFKKVPUTPI-JTQLQIEISA-N -1 3 371.470 3.503 20 0 FHADHM CCN(C(=O)[C@@H](C)SCc1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736502990 599309287 /nfs/dbraw/zinc/30/92/87/599309287.db2.gz RQBQTRAWPBJVSG-CQSZACIVSA-N -1 3 367.478 3.542 20 0 FHADHM CCN(C(=O)[C@@H](C)SCc1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736502990 599309290 /nfs/dbraw/zinc/30/92/90/599309290.db2.gz RQBQTRAWPBJVSG-CQSZACIVSA-N -1 3 367.478 3.542 20 0 FHADHM Clc1ccc(NCc2csc(Br)c2)cc1-c1nn[n-]n1 ZINC000737576224 599326468 /nfs/dbraw/zinc/32/64/68/599326468.db2.gz YYVPYMBEHRWGRX-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM Clc1ccc(NCc2csc(Br)c2)cc1-c1nnn[n-]1 ZINC000737576224 599326466 /nfs/dbraw/zinc/32/64/66/599326466.db2.gz YYVPYMBEHRWGRX-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM C[C@@H](SCc1nc(-c2ccccc2)no1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736194277 599326452 /nfs/dbraw/zinc/32/64/52/599326452.db2.gz YYQWSQNOVGJMIF-GFCCVEGCSA-N -1 3 364.434 3.911 20 0 FHADHM C[C@@H](SCc1nc(-c2ccccc2)no1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736194277 599326455 /nfs/dbraw/zinc/32/64/55/599326455.db2.gz YYQWSQNOVGJMIF-GFCCVEGCSA-N -1 3 364.434 3.911 20 0 FHADHM COC(=O)c1cc(CS[C@H](C)c2ccc(-c3nnn[n-]3)cc2)oc1C ZINC000736950776 599326537 /nfs/dbraw/zinc/32/65/37/599326537.db2.gz NRKQJTGGJOKMDK-LLVKDONJSA-N -1 3 358.423 3.549 20 0 FHADHM COC(=O)c1cc(CS[C@H](C)c2ccc(-c3nn[n-]n3)cc2)oc1C ZINC000736950776 599326538 /nfs/dbraw/zinc/32/65/38/599326538.db2.gz NRKQJTGGJOKMDK-LLVKDONJSA-N -1 3 358.423 3.549 20 0 FHADHM CCc1ccccc1NC(=O)CS[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736702663 599328699 /nfs/dbraw/zinc/32/86/99/599328699.db2.gz SYHMKUDQLJSGSG-ZDUSSCGKSA-N -1 3 367.478 3.862 20 0 FHADHM CCc1ccccc1NC(=O)CS[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736702663 599328702 /nfs/dbraw/zinc/32/87/02/599328702.db2.gz SYHMKUDQLJSGSG-ZDUSSCGKSA-N -1 3 367.478 3.862 20 0 FHADHM C[C@H](S[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)C(=O)NCC1CCCCC1 ZINC000736190348 599328725 /nfs/dbraw/zinc/32/87/25/599328725.db2.gz RKASBGPRBUJSEB-KBPBESRZSA-N -1 3 373.526 3.746 20 0 FHADHM C[C@H](S[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)C(=O)NCC1CCCCC1 ZINC000736190348 599328728 /nfs/dbraw/zinc/32/87/28/599328728.db2.gz RKASBGPRBUJSEB-KBPBESRZSA-N -1 3 373.526 3.746 20 0 FHADHM c1ccc(Oc2ccc(NCCOc3cccc(-c4nnn[n-]4)c3)cc2)nc1 ZINC000738433327 599332562 /nfs/dbraw/zinc/33/25/62/599332562.db2.gz QAZUXALXOJGWAU-UHFFFAOYSA-N -1 3 374.404 3.545 20 0 FHADHM c1ccc(Oc2ccc(NCCOc3cccc(-c4nn[n-]n4)c3)cc2)nc1 ZINC000738433327 599332564 /nfs/dbraw/zinc/33/25/64/599332564.db2.gz QAZUXALXOJGWAU-UHFFFAOYSA-N -1 3 374.404 3.545 20 0 FHADHM CC(C)c1ccccc1NC(=O)CSc1ccccc1-c1nnn[n-]1 ZINC000820197141 599344623 /nfs/dbraw/zinc/34/46/23/599344623.db2.gz GVLCKBNJGAWNPZ-UHFFFAOYSA-N -1 3 353.451 3.721 20 0 FHADHM CC(C)c1ccccc1NC(=O)CSc1ccccc1-c1nn[n-]n1 ZINC000820197141 599344625 /nfs/dbraw/zinc/34/46/25/599344625.db2.gz GVLCKBNJGAWNPZ-UHFFFAOYSA-N -1 3 353.451 3.721 20 0 FHADHM Clc1ccc(-c2nc(CSc3ccccc3-c3nnn[n-]3)no2)cc1 ZINC000822568620 599345184 /nfs/dbraw/zinc/34/51/84/599345184.db2.gz UHJAKXOIEYQCPJ-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1ccc(-c2nc(CSc3ccccc3-c3nn[n-]n3)no2)cc1 ZINC000822568620 599345187 /nfs/dbraw/zinc/34/51/87/599345187.db2.gz UHJAKXOIEYQCPJ-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Cc1cc(C)c(NC(=O)CSc2ccccc2-c2nnn[n-]2)c(C)c1 ZINC000822194152 599345753 /nfs/dbraw/zinc/34/57/53/599345753.db2.gz KXXYEGFBXVDGQG-UHFFFAOYSA-N -1 3 353.451 3.523 20 0 FHADHM Cc1cc(C)c(NC(=O)CSc2ccccc2-c2nn[n-]n2)c(C)c1 ZINC000822194152 599345757 /nfs/dbraw/zinc/34/57/57/599345757.db2.gz KXXYEGFBXVDGQG-UHFFFAOYSA-N -1 3 353.451 3.523 20 0 FHADHM C[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000736240632 599348475 /nfs/dbraw/zinc/34/84/75/599348475.db2.gz VPVQLIGKUDHPDT-UMVBOHGHSA-N -1 3 371.489 3.608 20 0 FHADHM C[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000736240632 599348476 /nfs/dbraw/zinc/34/84/76/599348476.db2.gz VPVQLIGKUDHPDT-UMVBOHGHSA-N -1 3 371.489 3.608 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1CNc1cc(Br)ccc1C ZINC000821731829 607370964 /nfs/dbraw/zinc/37/09/64/607370964.db2.gz HHWPPZVGAJNUJL-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CNc1cc(Br)ccc1C ZINC000821731829 607370966 /nfs/dbraw/zinc/37/09/66/607370966.db2.gz HHWPPZVGAJNUJL-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM C[C@@H](N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ncc(-c2ccccc2)o1 ZINC000820414562 599366780 /nfs/dbraw/zinc/36/67/80/599366780.db2.gz ZFDIDDSRTZNANI-UONOGXRCSA-N -1 3 360.421 3.934 20 0 FHADHM C[C@H](Nc1ccc(F)c(Br)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820456817 599386568 /nfs/dbraw/zinc/38/65/68/599386568.db2.gz WDBGEYDZECRCMW-VIFPVBQESA-N -1 3 362.206 3.941 20 0 FHADHM C[C@H](Nc1ccc(F)c(Br)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820456817 599386571 /nfs/dbraw/zinc/38/65/71/599386571.db2.gz WDBGEYDZECRCMW-VIFPVBQESA-N -1 3 362.206 3.941 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1COc1ccc(OCC(F)(F)F)cc1 ZINC000822743632 599389435 /nfs/dbraw/zinc/38/94/35/599389435.db2.gz BCAJZGJWMGZAKT-UHFFFAOYSA-N -1 3 368.290 3.526 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1COc1ccc(OCC(F)(F)F)cc1 ZINC000822743632 599389437 /nfs/dbraw/zinc/38/94/37/599389437.db2.gz BCAJZGJWMGZAKT-UHFFFAOYSA-N -1 3 368.290 3.526 20 0 FHADHM C[C@@H](NCc1csc(-c2cccs2)n1)c1cccc(-c2nn[n-]n2)c1 ZINC000820437836 599392909 /nfs/dbraw/zinc/39/29/09/599392909.db2.gz DLPIIAMKCSCMTA-LLVKDONJSA-N -1 3 368.491 3.903 20 0 FHADHM C[C@@H](Nc1cc(-c2nnn[n-]2)c2ccccc2n1)c1ccc(F)c(F)c1 ZINC000736139970 599394108 /nfs/dbraw/zinc/39/41/08/599394108.db2.gz SIKJOLCQMVFSBC-SNVBAGLBSA-N -1 3 352.348 3.866 20 0 FHADHM C[C@@H](Nc1cc(-c2nn[n-]n2)c2ccccc2n1)c1ccc(F)c(F)c1 ZINC000736139970 599394111 /nfs/dbraw/zinc/39/41/11/599394111.db2.gz SIKJOLCQMVFSBC-SNVBAGLBSA-N -1 3 352.348 3.866 20 0 FHADHM COc1ccc([C@H](C)Nc2cc(-c3nnn[n-]3)c3ccccc3n2)cc1F ZINC000737074707 599397584 /nfs/dbraw/zinc/39/75/84/599397584.db2.gz KAYNPQUIWXWSJZ-NSHDSACASA-N -1 3 364.384 3.736 20 0 FHADHM COc1ccc([C@H](C)Nc2cc(-c3nn[n-]n3)c3ccccc3n2)cc1F ZINC000737074707 599397587 /nfs/dbraw/zinc/39/75/87/599397587.db2.gz KAYNPQUIWXWSJZ-NSHDSACASA-N -1 3 364.384 3.736 20 0 FHADHM CC(C)[C@H](NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000820356943 599400943 /nfs/dbraw/zinc/40/09/43/599400943.db2.gz CYCTVFUJMRPXDZ-KSSFIOAISA-N -1 3 364.453 3.624 20 0 FHADHM CC(C)[C@H](NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000820356943 599400946 /nfs/dbraw/zinc/40/09/46/599400946.db2.gz CYCTVFUJMRPXDZ-KSSFIOAISA-N -1 3 364.453 3.624 20 0 FHADHM Cc1ccc2[nH]c3c(c2c1)CN(c1cc(Cl)ccc1-c1nnn[n-]1)CC3 ZINC000737372935 599404783 /nfs/dbraw/zinc/40/47/83/599404783.db2.gz MWCBNEXIDYFBKG-UHFFFAOYSA-N -1 3 364.840 3.873 20 0 FHADHM Cc1ccc2[nH]c3c(c2c1)CN(c1cc(Cl)ccc1-c1nn[n-]n1)CC3 ZINC000737372935 599404785 /nfs/dbraw/zinc/40/47/85/599404785.db2.gz MWCBNEXIDYFBKG-UHFFFAOYSA-N -1 3 364.840 3.873 20 0 FHADHM CCCOc1ccc(CNc2cc(-c3nnn[n-]3)c3ccccc3n2)cc1 ZINC000736489943 599411828 /nfs/dbraw/zinc/41/18/28/599411828.db2.gz FXWIGNVVEZMCLO-UHFFFAOYSA-N -1 3 360.421 3.816 20 0 FHADHM CCCOc1ccc(CNc2cc(-c3nn[n-]n3)c3ccccc3n2)cc1 ZINC000736489943 599411832 /nfs/dbraw/zinc/41/18/32/599411832.db2.gz FXWIGNVVEZMCLO-UHFFFAOYSA-N -1 3 360.421 3.816 20 0 FHADHM CCOc1ccccc1[C@H](C)Nc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000736654278 599419897 /nfs/dbraw/zinc/41/98/97/599419897.db2.gz ISXVULQZLOJJRV-ZDUSSCGKSA-N -1 3 360.421 3.987 20 0 FHADHM CCOc1ccccc1[C@H](C)Nc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000736654278 599419898 /nfs/dbraw/zinc/41/98/98/599419898.db2.gz ISXVULQZLOJJRV-ZDUSSCGKSA-N -1 3 360.421 3.987 20 0 FHADHM CCOc1cccc([C@@H](C)Nc2cc(-c3nnn[n-]3)c3ccccc3n2)c1 ZINC000736654027 599420111 /nfs/dbraw/zinc/42/01/11/599420111.db2.gz HNRHWDJZXACNBN-CYBMUJFWSA-N -1 3 360.421 3.987 20 0 FHADHM CCOc1cccc([C@@H](C)Nc2cc(-c3nn[n-]n3)c3ccccc3n2)c1 ZINC000736654027 599420112 /nfs/dbraw/zinc/42/01/12/599420112.db2.gz HNRHWDJZXACNBN-CYBMUJFWSA-N -1 3 360.421 3.987 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(NCCc2ccc3ccccc3n2)c1 ZINC000737570927 599420825 /nfs/dbraw/zinc/42/08/25/599420825.db2.gz LXJAOXKSBIMSNP-UHFFFAOYSA-N -1 3 350.813 3.723 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(NCCc2ccc3ccccc3n2)c1 ZINC000737570927 599420826 /nfs/dbraw/zinc/42/08/26/599420826.db2.gz LXJAOXKSBIMSNP-UHFFFAOYSA-N -1 3 350.813 3.723 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CSc1nc(-c2ccccc2)c[nH]1 ZINC000821752509 607378168 /nfs/dbraw/zinc/37/81/68/607378168.db2.gz OAZGRNSSBQXCPP-UHFFFAOYSA-N -1 3 364.434 3.558 20 0 FHADHM Clc1ccc2c(c1Cl)CC[C@@H]2NCc1ccc(-c2nnn[n-]2)o1 ZINC000822581235 599437769 /nfs/dbraw/zinc/43/77/69/599437769.db2.gz FHZPZTIMSMGQML-LBPRGKRZSA-N -1 3 350.209 3.544 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)C(C)(C)c1cccc(Cl)c1 ZINC000737290357 599465669 /nfs/dbraw/zinc/46/56/69/599465669.db2.gz UGSXPGRGZIDYDQ-UHFFFAOYSA-N -1 3 355.829 3.745 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)C(C)(C)c1cccc(Cl)c1 ZINC000737290357 599465671 /nfs/dbraw/zinc/46/56/71/599465671.db2.gz UGSXPGRGZIDYDQ-UHFFFAOYSA-N -1 3 355.829 3.745 20 0 FHADHM CO[C@H](CNc1ccc(-c2nn[n-]n2)cc1C(F)(F)F)c1ccccc1 ZINC000821677126 599469240 /nfs/dbraw/zinc/46/92/40/599469240.db2.gz PEBNOLSWCZXMQI-OAHLLOKOSA-N -1 3 363.343 3.685 20 0 FHADHM Fc1ccc(C[C@@H]2CCN(c3ccc(-c4nnn[n-]4)c(Cl)c3)C2)cc1 ZINC000737647019 599473086 /nfs/dbraw/zinc/47/30/86/599473086.db2.gz CBYTYKKGYNHXNX-ZDUSSCGKSA-N -1 3 357.820 3.728 20 0 FHADHM Fc1ccc(C[C@@H]2CCN(c3ccc(-c4nn[n-]n4)c(Cl)c3)C2)cc1 ZINC000737647019 599473088 /nfs/dbraw/zinc/47/30/88/599473088.db2.gz CBYTYKKGYNHXNX-ZDUSSCGKSA-N -1 3 357.820 3.728 20 0 FHADHM CC[C@@H](NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(C)cc1 ZINC000820921130 599473900 /nfs/dbraw/zinc/47/39/00/599473900.db2.gz WFBDMDKUZJBLKP-KBXCAEBGSA-N -1 3 364.453 3.687 20 0 FHADHM CC[C@@H](NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(C)cc1 ZINC000820921130 599473902 /nfs/dbraw/zinc/47/39/02/599473902.db2.gz WFBDMDKUZJBLKP-KBXCAEBGSA-N -1 3 364.453 3.687 20 0 FHADHM CCO[C@@H](C)c1nc(CN(C)[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cs1 ZINC000736616642 599475440 /nfs/dbraw/zinc/47/54/40/599475440.db2.gz OPKNQQNUHFTWGV-STQMWFEESA-N -1 3 372.498 3.614 20 0 FHADHM CCO[C@@H](C)c1nc(CN(C)[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cs1 ZINC000736616642 599475441 /nfs/dbraw/zinc/47/54/41/599475441.db2.gz OPKNQQNUHFTWGV-STQMWFEESA-N -1 3 372.498 3.614 20 0 FHADHM COc1cc(C)c([C@H](C)Nc2ccc(F)cc2-c2nnn[n-]2)cc1OC ZINC000821708663 599477496 /nfs/dbraw/zinc/47/74/96/599477496.db2.gz VLCOJFZYMRLSRO-NSHDSACASA-N -1 3 357.389 3.505 20 0 FHADHM COc1cc(C)c([C@H](C)Nc2ccc(F)cc2-c2nn[n-]n2)cc1OC ZINC000821708663 599477500 /nfs/dbraw/zinc/47/75/00/599477500.db2.gz VLCOJFZYMRLSRO-NSHDSACASA-N -1 3 357.389 3.505 20 0 FHADHM Fc1ccc(NCc2ccnc(Oc3ccccc3)c2)c(-c2nnn[n-]2)c1 ZINC000822783120 599478740 /nfs/dbraw/zinc/47/87/40/599478740.db2.gz VVNPWWZTZPYERQ-UHFFFAOYSA-N -1 3 362.368 3.805 20 0 FHADHM Fc1ccc(NCc2ccnc(Oc3ccccc3)c2)c(-c2nn[n-]n2)c1 ZINC000822783120 599478743 /nfs/dbraw/zinc/47/87/43/599478743.db2.gz VVNPWWZTZPYERQ-UHFFFAOYSA-N -1 3 362.368 3.805 20 0 FHADHM C[C@@H](NC(=O)N1CCC[C@@H]1C1CCCCC1)c1cccc(-c2nnn[n-]2)c1 ZINC000820352296 599486017 /nfs/dbraw/zinc/48/60/17/599486017.db2.gz TUJYAOMQXKKCQE-RDTXWAMCSA-N -1 3 368.485 3.682 20 0 FHADHM C[C@@H](NC(=O)N1CCC[C@@H]1C1CCCCC1)c1cccc(-c2nn[n-]n2)c1 ZINC000820352296 599486019 /nfs/dbraw/zinc/48/60/19/599486019.db2.gz TUJYAOMQXKKCQE-RDTXWAMCSA-N -1 3 368.485 3.682 20 0 FHADHM Fc1ccc(NCc2ccccc2OC2CCCC2)c(-c2nnn[n-]2)c1 ZINC000822783128 599487543 /nfs/dbraw/zinc/48/75/43/599487543.db2.gz WIIRAKVWGBVFEI-UHFFFAOYSA-N -1 3 353.401 3.939 20 0 FHADHM Fc1ccc(NCc2ccccc2OC2CCCC2)c(-c2nn[n-]n2)c1 ZINC000822783128 599487546 /nfs/dbraw/zinc/48/75/46/599487546.db2.gz WIIRAKVWGBVFEI-UHFFFAOYSA-N -1 3 353.401 3.939 20 0 FHADHM CC(C)[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820313168 599497824 /nfs/dbraw/zinc/49/78/24/599497824.db2.gz BLFPLOCZVUSPDZ-DNVCBOLYSA-N -1 3 363.465 3.559 20 0 FHADHM CC(C)[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820313168 599497827 /nfs/dbraw/zinc/49/78/27/599497827.db2.gz BLFPLOCZVUSPDZ-DNVCBOLYSA-N -1 3 363.465 3.559 20 0 FHADHM CC(C)Sc1ccc(C(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000820184214 599501206 /nfs/dbraw/zinc/50/12/06/599501206.db2.gz XIZVWZQCSMAHFI-ZDUSSCGKSA-N -1 3 367.478 3.858 20 0 FHADHM CC(C)Sc1ccc(C(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000820184214 599501207 /nfs/dbraw/zinc/50/12/07/599501207.db2.gz XIZVWZQCSMAHFI-ZDUSSCGKSA-N -1 3 367.478 3.858 20 0 FHADHM CCCCOc1ccc(C(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000821077657 599506863 /nfs/dbraw/zinc/50/68/63/599506863.db2.gz PCZZTYBQSHWOEB-CQSZACIVSA-N -1 3 365.437 3.537 20 0 FHADHM CCCCOc1ccc(C(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000821077657 599506864 /nfs/dbraw/zinc/50/68/64/599506864.db2.gz PCZZTYBQSHWOEB-CQSZACIVSA-N -1 3 365.437 3.537 20 0 FHADHM C[C@H](NC(=O)CCCc1ccc(Cl)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000820322405 599508852 /nfs/dbraw/zinc/50/88/52/599508852.db2.gz SCMIVZOMXQZOLD-ZDUSSCGKSA-N -1 3 369.856 3.720 20 0 FHADHM C[C@H](NC(=O)CCCc1ccc(Cl)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000820322405 599508855 /nfs/dbraw/zinc/50/88/55/599508855.db2.gz SCMIVZOMXQZOLD-ZDUSSCGKSA-N -1 3 369.856 3.720 20 0 FHADHM Cc1csc([C@H]2CCCN(c3ccc(Cl)cc3-c3nnn[n-]3)C2)n1 ZINC000822408922 599509038 /nfs/dbraw/zinc/50/90/38/599509038.db2.gz ISQHFZQVJOFJQT-NSHDSACASA-N -1 3 360.874 3.669 20 0 FHADHM Cc1csc([C@H]2CCCN(c3ccc(Cl)cc3-c3nn[n-]n3)C2)n1 ZINC000822408922 599509041 /nfs/dbraw/zinc/50/90/41/599509041.db2.gz ISQHFZQVJOFJQT-NSHDSACASA-N -1 3 360.874 3.669 20 0 FHADHM Cc1nc([C@H]2CCCN(c3c(Cl)cccc3-c3nnn[n-]3)C2)sc1C ZINC000822436757 599509235 /nfs/dbraw/zinc/50/92/35/599509235.db2.gz QJTFRLLQPPTSTD-LBPRGKRZSA-N -1 3 374.901 3.977 20 0 FHADHM Cc1nc([C@H]2CCCN(c3c(Cl)cccc3-c3nn[n-]n3)C2)sc1C ZINC000822436757 599509237 /nfs/dbraw/zinc/50/92/37/599509237.db2.gz QJTFRLLQPPTSTD-LBPRGKRZSA-N -1 3 374.901 3.977 20 0 FHADHM Cc1nc([C@H]2CCCN(c3ccc(Cl)cc3-c3nnn[n-]3)C2)sc1C ZINC000822435856 599509292 /nfs/dbraw/zinc/50/92/92/599509292.db2.gz CQXKUUHXAMSHHI-LBPRGKRZSA-N -1 3 374.901 3.977 20 0 FHADHM Cc1nc([C@H]2CCCN(c3ccc(Cl)cc3-c3nn[n-]n3)C2)sc1C ZINC000822435856 599509293 /nfs/dbraw/zinc/50/92/93/599509293.db2.gz CQXKUUHXAMSHHI-LBPRGKRZSA-N -1 3 374.901 3.977 20 0 FHADHM C[C@H](C[C@@H](O)c1ccc(F)cc1)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820235627 607381804 /nfs/dbraw/zinc/38/18/04/607381804.db2.gz TXKCIGNPGMSSPU-QLJPJBMISA-N -1 3 361.808 3.583 20 0 FHADHM C[C@H](C[C@@H](O)c1ccc(F)cc1)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820235627 607381806 /nfs/dbraw/zinc/38/18/06/607381806.db2.gz TXKCIGNPGMSSPU-QLJPJBMISA-N -1 3 361.808 3.583 20 0 FHADHM COc1ccc(CNc2ccc(F)cc2-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000821821769 599516369 /nfs/dbraw/zinc/51/63/69/599516369.db2.gz VYFQSLAOYYIEKX-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM COc1ccc(CNc2ccc(F)cc2-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000821821769 599516370 /nfs/dbraw/zinc/51/63/70/599516370.db2.gz VYFQSLAOYYIEKX-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM CCOc1cccc(CNc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)c1 ZINC000736655006 599519932 /nfs/dbraw/zinc/51/99/32/599519932.db2.gz OWAPOWPGYWLZLC-UHFFFAOYSA-N -1 3 363.343 3.896 20 0 FHADHM COc1cccc(CCNc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)c1 ZINC000737132142 599521324 /nfs/dbraw/zinc/52/13/24/599521324.db2.gz WRYFOEGCCOFOPS-UHFFFAOYSA-N -1 3 363.343 3.549 20 0 FHADHM C[C@H](NC(=O)c1cc2c(s1)CC[C@H](C)C2)c1cccc(-c2nnn[n-]2)c1 ZINC000820735596 599522189 /nfs/dbraw/zinc/52/21/89/599522189.db2.gz TXPYEGYXHBXJJD-RYUDHWBXSA-N -1 3 367.478 3.544 20 0 FHADHM C[C@H](NC(=O)c1cc2c(s1)CC[C@H](C)C2)c1cccc(-c2nn[n-]n2)c1 ZINC000820735596 599522190 /nfs/dbraw/zinc/52/21/90/599522190.db2.gz TXPYEGYXHBXJJD-RYUDHWBXSA-N -1 3 367.478 3.544 20 0 FHADHM Fc1ccc(N[C@@H]2CCc3c2cccc3Br)c(-c2nnn[n-]2)c1 ZINC000822778813 599522416 /nfs/dbraw/zinc/52/24/16/599522416.db2.gz ODKDXZARYQUVOM-CQSZACIVSA-N -1 3 374.217 3.868 20 0 FHADHM Fc1ccc(N[C@@H]2CCc3c2cccc3Br)c(-c2nn[n-]n2)c1 ZINC000822778813 599522418 /nfs/dbraw/zinc/52/24/18/599522418.db2.gz ODKDXZARYQUVOM-CQSZACIVSA-N -1 3 374.217 3.868 20 0 FHADHM C[C@H](NC(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820321773 599526337 /nfs/dbraw/zinc/52/63/37/599526337.db2.gz MGWLCLONKTTWFC-JECHBYEQSA-N -1 3 367.840 3.501 20 0 FHADHM C[C@H](NC(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820321773 599526341 /nfs/dbraw/zinc/52/63/41/599526341.db2.gz MGWLCLONKTTWFC-JECHBYEQSA-N -1 3 367.840 3.501 20 0 FHADHM CS[C@@H]1CCC[C@H](Nc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)C1 ZINC000737180961 599526721 /nfs/dbraw/zinc/52/67/21/599526721.db2.gz URCPSSBPNUZVOO-WDEREUQCSA-N -1 3 357.405 3.972 20 0 FHADHM Cc1cccc2c1CCN(c1c(-c3nnn[n-]3)cnc3c(C)cc(F)cc31)C2 ZINC000822340675 599528839 /nfs/dbraw/zinc/52/88/39/599528839.db2.gz BZNBHMIPYVRSLG-UHFFFAOYSA-N -1 3 374.423 3.734 20 0 FHADHM Cc1cccc2c1CCN(c1c(-c3nn[n-]n3)cnc3c(C)cc(F)cc31)C2 ZINC000822340675 599528841 /nfs/dbraw/zinc/52/88/41/599528841.db2.gz BZNBHMIPYVRSLG-UHFFFAOYSA-N -1 3 374.423 3.734 20 0 FHADHM Fc1cccc([C@@H]2CCN(c3c(-c4nnn[n-]4)cnc4ccccc43)C2)c1 ZINC000822786065 599529964 /nfs/dbraw/zinc/52/99/64/599529964.db2.gz BZIPQCYTHBQCPN-CQSZACIVSA-N -1 3 360.396 3.548 20 0 FHADHM Fc1cccc([C@@H]2CCN(c3c(-c4nn[n-]n4)cnc4ccccc43)C2)c1 ZINC000822786065 599529967 /nfs/dbraw/zinc/52/99/67/599529967.db2.gz BZIPQCYTHBQCPN-CQSZACIVSA-N -1 3 360.396 3.548 20 0 FHADHM CC[C@H](CC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(C)cc1 ZINC000820882576 599537006 /nfs/dbraw/zinc/53/70/06/599537006.db2.gz UKRQNUPKYDSDGS-HZPDHXFCSA-N -1 3 363.465 3.936 20 0 FHADHM CC[C@H](CC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(C)cc1 ZINC000820882576 599537008 /nfs/dbraw/zinc/53/70/08/599537008.db2.gz UKRQNUPKYDSDGS-HZPDHXFCSA-N -1 3 363.465 3.936 20 0 FHADHM CC[C@H](CC(=O)Oc1ccc(-c2nnn[n-]2)cc1OC)c1ccc(C)cc1 ZINC000736335083 599538866 /nfs/dbraw/zinc/53/88/66/599538866.db2.gz PHWGMZUIYBAREZ-CQSZACIVSA-N -1 3 366.421 3.673 20 0 FHADHM CC[C@H](CC(=O)Oc1ccc(-c2nn[n-]n2)cc1OC)c1ccc(C)cc1 ZINC000736335083 599538869 /nfs/dbraw/zinc/53/88/69/599538869.db2.gz PHWGMZUIYBAREZ-CQSZACIVSA-N -1 3 366.421 3.673 20 0 FHADHM O=C(CC/C=C\c1ccccc1)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000737825080 599540487 /nfs/dbraw/zinc/54/04/87/599540487.db2.gz JQGFYMDPGWYYAC-YWEYNIOJSA-N -1 3 353.813 3.952 20 0 FHADHM O=C(CC/C=C\c1ccccc1)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000737825080 599540490 /nfs/dbraw/zinc/54/04/90/599540490.db2.gz JQGFYMDPGWYYAC-YWEYNIOJSA-N -1 3 353.813 3.952 20 0 FHADHM CCc1ccc([C@H](C)CC(=O)N(C)Cc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736687669 599542310 /nfs/dbraw/zinc/54/23/10/599542310.db2.gz OLNYOQHFPYSYCP-OAHLLOKOSA-N -1 3 363.465 3.581 20 0 FHADHM CCc1ccc([C@H](C)CC(=O)N(C)Cc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736687669 599542312 /nfs/dbraw/zinc/54/23/12/599542312.db2.gz OLNYOQHFPYSYCP-OAHLLOKOSA-N -1 3 363.465 3.581 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)CC/C=C/c1ccccc1 ZINC000735661976 599544161 /nfs/dbraw/zinc/54/41/61/599544161.db2.gz ZAFBMTJSABDYAA-YRNVUSSQSA-N -1 3 364.453 3.855 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)CC/C=C/c1ccccc1 ZINC000735661976 599544162 /nfs/dbraw/zinc/54/41/62/599544162.db2.gz ZAFBMTJSABDYAA-YRNVUSSQSA-N -1 3 364.453 3.855 20 0 FHADHM CC[C@@H](C)[C@@H]1CCCCN1C(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000736326618 599547522 /nfs/dbraw/zinc/54/75/22/599547522.db2.gz BVECNAYVZKCXOA-PBHICJAKSA-N -1 3 373.526 3.527 20 0 FHADHM CC[C@@H](C)[C@@H]1CCCCN1C(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000736326618 599547524 /nfs/dbraw/zinc/54/75/24/599547524.db2.gz BVECNAYVZKCXOA-PBHICJAKSA-N -1 3 373.526 3.527 20 0 FHADHM CCSCc1cccc(NC(=O)Nc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000821462279 599550751 /nfs/dbraw/zinc/55/07/51/599550751.db2.gz YBSPKWFVTKPHSP-UHFFFAOYSA-N -1 3 354.439 3.764 20 0 FHADHM CCSCc1cccc(NC(=O)Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000821462279 599550753 /nfs/dbraw/zinc/55/07/53/599550753.db2.gz YBSPKWFVTKPHSP-UHFFFAOYSA-N -1 3 354.439 3.764 20 0 FHADHM Cc1ccc([C@@H]2CCCCN2C(=O)Nc2ccc(-c3nnn[n-]3)cc2)o1 ZINC000822233218 599551385 /nfs/dbraw/zinc/55/13/85/599551385.db2.gz KSUPEGLEGBNWOI-HNNXBMFYSA-N -1 3 352.398 3.527 20 0 FHADHM Cc1ccc([C@@H]2CCCCN2C(=O)Nc2ccc(-c3nn[n-]n3)cc2)o1 ZINC000822233218 599551387 /nfs/dbraw/zinc/55/13/87/599551387.db2.gz KSUPEGLEGBNWOI-HNNXBMFYSA-N -1 3 352.398 3.527 20 0 FHADHM Cc1ccc([C@H]2[C@@H](C)CCCN2C(=O)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000737332979 599558364 /nfs/dbraw/zinc/55/83/64/599558364.db2.gz ZGZCIOYLOVBFBB-HNAYVOBHSA-N -1 3 361.449 3.789 20 0 FHADHM Cc1ccc([C@H]2[C@@H](C)CCCN2C(=O)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000737332979 599558366 /nfs/dbraw/zinc/55/83/66/599558366.db2.gz ZGZCIOYLOVBFBB-HNAYVOBHSA-N -1 3 361.449 3.789 20 0 FHADHM Cc1ccc([C@H]2CCCCCN2C(=O)c2ccc(-c3nnn[n-]3)cc2)o1 ZINC000737327748 599560034 /nfs/dbraw/zinc/56/00/34/599560034.db2.gz ABMKULFEKCHALB-MRXNPFEDSA-N -1 3 351.410 3.526 20 0 FHADHM Cc1ccc([C@H]2CCCCCN2C(=O)c2ccc(-c3nn[n-]n3)cc2)o1 ZINC000737327748 599560035 /nfs/dbraw/zinc/56/00/35/599560035.db2.gz ABMKULFEKCHALB-MRXNPFEDSA-N -1 3 351.410 3.526 20 0 FHADHM C[C@H]1C[C@H](c2ccc(F)cc2)CN1c1c(-c2nnn[n-]2)cnc2ccccc21 ZINC000820668823 599563854 /nfs/dbraw/zinc/56/38/54/599563854.db2.gz XBXYNAVXMQFAAT-ZFWWWQNUSA-N -1 3 374.423 3.936 20 0 FHADHM C[C@H]1C[C@H](c2ccc(F)cc2)CN1c1c(-c2nn[n-]n2)cnc2ccccc21 ZINC000820668823 599563856 /nfs/dbraw/zinc/56/38/56/599563856.db2.gz XBXYNAVXMQFAAT-ZFWWWQNUSA-N -1 3 374.423 3.936 20 0 FHADHM CCC[C@H](C)N(C)C(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736425706 599564907 /nfs/dbraw/zinc/56/49/07/599564907.db2.gz XJKDXUIONKEINW-AWEZNQCLSA-N -1 3 364.453 3.871 20 0 FHADHM CC1(C)CCCN1C(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736212059 599567150 /nfs/dbraw/zinc/56/71/50/599567150.db2.gz VXRIXTNGENLNCV-UHFFFAOYSA-N -1 3 362.437 3.625 20 0 FHADHM Cc1ccccc1[C@H]1C[C@@H](C)N(C(=O)Nc2cccc(-c3nnn[n-]3)c2)C1 ZINC000737421774 599599785 /nfs/dbraw/zinc/59/97/85/599599785.db2.gz NIQLTMFQXXYAAV-ZBFHGGJFSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1ccccc1[C@H]1C[C@@H](C)N(C(=O)Nc2cccc(-c3nn[n-]n3)c2)C1 ZINC000737421774 599599787 /nfs/dbraw/zinc/59/97/87/599599787.db2.gz NIQLTMFQXXYAAV-ZBFHGGJFSA-N -1 3 362.437 3.585 20 0 FHADHM CC(C)(C)[C@H]1CCc2c(sc(NC(=O)C=CC3CC3)c2-c2nn[n-]n2)C1 ZINC000819908201 599629207 /nfs/dbraw/zinc/62/92/07/599629207.db2.gz XUOXVASGUNLFEU-LZGFCCKTSA-N -1 3 371.510 3.984 20 0 FHADHM CC(C)(C)[C@H]1CCc2c(sc(NC(=O)/C=C/C3CC3)c2-c2nn[n-]n2)C1 ZINC000819908201 599629208 /nfs/dbraw/zinc/62/92/08/599629208.db2.gz XUOXVASGUNLFEU-LZGFCCKTSA-N -1 3 371.510 3.984 20 0 FHADHM C[C@H](CCc1ccccc1F)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820252417 599629368 /nfs/dbraw/zinc/62/93/68/599629368.db2.gz AIJKSSHSBCCUKK-LLVKDONJSA-N -1 3 373.819 3.867 20 0 FHADHM C[C@H](CCc1ccccc1F)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820252417 599629369 /nfs/dbraw/zinc/62/93/69/599629369.db2.gz AIJKSSHSBCCUKK-LLVKDONJSA-N -1 3 373.819 3.867 20 0 FHADHM Cc1cccc(C)c1C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000822293542 599633210 /nfs/dbraw/zinc/63/32/10/599633210.db2.gz BKOIINUXTIBMDI-UHFFFAOYSA-N -1 3 361.327 3.755 20 0 FHADHM Cc1cccc(C)c1C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000822293542 599633211 /nfs/dbraw/zinc/63/32/11/599633211.db2.gz BKOIINUXTIBMDI-UHFFFAOYSA-N -1 3 361.327 3.755 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)c1ccc2cc[nH]c2c1 ZINC000823303572 599634429 /nfs/dbraw/zinc/63/44/29/599634429.db2.gz NDFWKNAMFABYSR-UHFFFAOYSA-N -1 3 372.310 3.619 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)c1ccc2cc[nH]c2c1 ZINC000823303572 599634430 /nfs/dbraw/zinc/63/44/30/599634430.db2.gz NDFWKNAMFABYSR-UHFFFAOYSA-N -1 3 372.310 3.619 20 0 FHADHM Cc1cc(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)c(C)s1 ZINC000822177284 599634793 /nfs/dbraw/zinc/63/47/93/599634793.db2.gz XAPGLZFIVLBPAA-UHFFFAOYSA-N -1 3 367.356 3.816 20 0 FHADHM Cc1cc(C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)c(C)s1 ZINC000822177284 599634794 /nfs/dbraw/zinc/63/47/94/599634794.db2.gz XAPGLZFIVLBPAA-UHFFFAOYSA-N -1 3 367.356 3.816 20 0 FHADHM O=C(C=C1CCCCC1)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000822923826 599634917 /nfs/dbraw/zinc/63/49/17/599634917.db2.gz VKUPVEPNCSTJMN-UHFFFAOYSA-N -1 3 351.332 3.715 20 0 FHADHM O=C(C=C1CCCCC1)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000822923826 599634918 /nfs/dbraw/zinc/63/49/18/599634918.db2.gz VKUPVEPNCSTJMN-UHFFFAOYSA-N -1 3 351.332 3.715 20 0 FHADHM CC(C)[C@H]1CC[C@@H](C)C[C@H]1NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820683428 599667078 /nfs/dbraw/zinc/66/70/78/599667078.db2.gz AZSRRQVEJFWHPT-DTTOXWODSA-N -1 3 370.501 3.688 20 0 FHADHM CC(C)[C@H]1CC[C@@H](C)C[C@H]1NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820683428 599667079 /nfs/dbraw/zinc/66/70/79/599667079.db2.gz AZSRRQVEJFWHPT-DTTOXWODSA-N -1 3 370.501 3.688 20 0 FHADHM C[C@H](NC(=O)N[C@H]1CCCC[C@H]1C(C)(C)C)c1cccc(-c2nnn[n-]2)c1 ZINC000820357336 599668052 /nfs/dbraw/zinc/66/80/52/599668052.db2.gz GKRLXARXAZBYRT-XKQJLSEDSA-N -1 3 370.501 3.832 20 0 FHADHM C[C@H](NC(=O)N[C@H]1CCCC[C@H]1C(C)(C)C)c1cccc(-c2nn[n-]n2)c1 ZINC000820357336 599668053 /nfs/dbraw/zinc/66/80/53/599668053.db2.gz GKRLXARXAZBYRT-XKQJLSEDSA-N -1 3 370.501 3.832 20 0 FHADHM COc1ccc2cc([C@@H](C)OC(=O)c3cccc(-c4nnn[n-]4)c3)ccc2c1 ZINC000821854810 599684400 /nfs/dbraw/zinc/68/44/00/599684400.db2.gz WINMQQWCVJACRT-CYBMUJFWSA-N -1 3 374.400 3.947 20 0 FHADHM COc1ccc2cc([C@@H](C)OC(=O)c3cccc(-c4nn[n-]n4)c3)ccc2c1 ZINC000821854810 599684401 /nfs/dbraw/zinc/68/44/01/599684401.db2.gz WINMQQWCVJACRT-CYBMUJFWSA-N -1 3 374.400 3.947 20 0 FHADHM COc1ccc(C2CCN(c3cc(Cl)ccc3-c3nnn[n-]3)CC2)cc1 ZINC000821786765 599685762 /nfs/dbraw/zinc/68/57/62/599685762.db2.gz IZCOWLSTVMKHKC-UHFFFAOYSA-N -1 3 369.856 3.913 20 0 FHADHM COc1ccc(C2CCN(c3cc(Cl)ccc3-c3nn[n-]n3)CC2)cc1 ZINC000821786765 599685763 /nfs/dbraw/zinc/68/57/63/599685763.db2.gz IZCOWLSTVMKHKC-UHFFFAOYSA-N -1 3 369.856 3.913 20 0 FHADHM CC(C)CN(C(=O)c1ccc(C(C)C)nc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820081295 607393008 /nfs/dbraw/zinc/39/30/08/607393008.db2.gz ARNYPBKDWLNZRO-UHFFFAOYSA-N -1 3 364.453 3.688 20 0 FHADHM CC(C)CN(C(=O)c1ccc(C(C)C)nc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820081295 607393009 /nfs/dbraw/zinc/39/30/09/607393009.db2.gz ARNYPBKDWLNZRO-UHFFFAOYSA-N -1 3 364.453 3.688 20 0 FHADHM C[C@H](N[C@@H](c1ccccc1)C1CCC1)C(=O)NCc1ccc(C(=O)[O-])cc1 ZINC000736661647 599792800 /nfs/dbraw/zinc/79/28/00/599792800.db2.gz GOEHKCIXAVAHBB-YWZLYKJASA-N -1 3 366.461 3.521 20 0 FHADHM Cc1cccc([C@@H](C)C(=O)Nc2ccc(OC(C)C)c(-c3nnn[n-]3)c2)c1 ZINC000822289113 607397827 /nfs/dbraw/zinc/39/78/27/607397827.db2.gz RQXUEASUDAFFRE-CQSZACIVSA-N -1 3 365.437 3.705 20 0 FHADHM Cc1cccc([C@@H](C)C(=O)Nc2ccc(OC(C)C)c(-c3nn[n-]n3)c2)c1 ZINC000822289113 607397829 /nfs/dbraw/zinc/39/78/29/607397829.db2.gz RQXUEASUDAFFRE-CQSZACIVSA-N -1 3 365.437 3.705 20 0 FHADHM CC(C)Oc1ccc(NC(=O)c2ccc(C(F)F)cc2)cc1-c1nnn[n-]1 ZINC000820170208 607400360 /nfs/dbraw/zinc/40/03/60/607400360.db2.gz UQAYRZSYIJPYTR-UHFFFAOYSA-N -1 3 373.363 3.844 20 0 FHADHM CC(C)Oc1ccc(NC(=O)c2ccc(C(F)F)cc2)cc1-c1nn[n-]n1 ZINC000820170208 607400361 /nfs/dbraw/zinc/40/03/61/607400361.db2.gz UQAYRZSYIJPYTR-UHFFFAOYSA-N -1 3 373.363 3.844 20 0 FHADHM C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCCCN1Cc1cccc(C(=O)[O-])c1 ZINC000736649477 599850187 /nfs/dbraw/zinc/85/01/87/599850187.db2.gz GUQSPSYIHGVITN-PBHICJAKSA-N -1 3 362.470 3.653 20 0 FHADHM O=C([O-])c1ccc(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)o1 ZINC000563966478 599851461 /nfs/dbraw/zinc/85/14/61/599851461.db2.gz JQGBNEGJPWEWAQ-CYBMUJFWSA-N -1 3 371.368 3.547 20 0 FHADHM O=C([O-])N1CCC[C@@H](NCc2ccc(-c3nc4ccccc4s3)o2)C1 ZINC000739928584 599860878 /nfs/dbraw/zinc/86/08/78/599860878.db2.gz VAZWDAAUIAESNU-GFCCVEGCSA-N -1 3 357.435 3.788 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)O[C@@H](CC(C)C)c1ccccn1 ZINC000826251334 607403016 /nfs/dbraw/zinc/40/30/16/607403016.db2.gz MIDYMHHXPJIPJN-KRWDZBQOSA-N -1 3 351.410 3.514 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)O[C@@H](CC(C)C)c1ccccn1 ZINC000826251334 607403017 /nfs/dbraw/zinc/40/30/17/607403017.db2.gz MIDYMHHXPJIPJN-KRWDZBQOSA-N -1 3 351.410 3.514 20 0 FHADHM CCN(CC)[C@H](CNC(=O)c1cccc(NC(=O)[O-])c1)c1ccsc1 ZINC000737086436 599930477 /nfs/dbraw/zinc/93/04/77/599930477.db2.gz XTVBYBZMAPJQSY-MRXNPFEDSA-N -1 3 361.467 3.651 20 0 FHADHM Cc1oc(C(=O)[O-])cc1CN1CCC([C@@H](O)c2ccc(Cl)cc2)CC1 ZINC000738957361 600014651 /nfs/dbraw/zinc/01/46/51/600014651.db2.gz JXIPNIGQJISYTI-SFHVURJKSA-N -1 3 363.841 3.885 20 0 FHADHM C[C@H](CC(=O)NC1(c2cccc(-c3nnn[n-]3)c2)CC1)C1CCCCC1 ZINC000824385109 607417161 /nfs/dbraw/zinc/41/71/61/607417161.db2.gz LUDJYCXJGUHSSP-CQSZACIVSA-N -1 3 353.470 3.579 20 0 FHADHM C[C@H](CC(=O)NC1(c2cccc(-c3nn[n-]n3)c2)CC1)C1CCCCC1 ZINC000824385109 607417163 /nfs/dbraw/zinc/41/71/63/607417163.db2.gz LUDJYCXJGUHSSP-CQSZACIVSA-N -1 3 353.470 3.579 20 0 FHADHM C[C@H](C(=O)Nc1cccc(CSCCC(=O)[O-])c1)N1[C@H](C)CC[C@H]1C ZINC000736762752 600109597 /nfs/dbraw/zinc/10/95/97/600109597.db2.gz LUQJMMNZNHOKHN-RBSFLKMASA-N -1 3 364.511 3.594 20 0 FHADHM CC(C)(C)c1ccc(C(=O)NC2(c3cccc(-c4nnn[n-]4)c3)CC2)cc1 ZINC000824135919 607423318 /nfs/dbraw/zinc/42/33/18/607423318.db2.gz KJOZMKUVDOOSIN-UHFFFAOYSA-N -1 3 361.449 3.583 20 0 FHADHM CC(C)(C)c1ccc(C(=O)NC2(c3cccc(-c4nn[n-]n4)c3)CC2)cc1 ZINC000824135919 607423319 /nfs/dbraw/zinc/42/33/19/607423319.db2.gz KJOZMKUVDOOSIN-UHFFFAOYSA-N -1 3 361.449 3.583 20 0 FHADHM CC(C)Oc1ccc(NC(=O)N[C@@H](C)c2cccs2)cc1-c1nnn[n-]1 ZINC000820164132 607423769 /nfs/dbraw/zinc/42/37/69/607423769.db2.gz DREALPBPDXAVKZ-NSHDSACASA-N -1 3 372.454 3.598 20 0 FHADHM CC(C)Oc1ccc(NC(=O)N[C@@H](C)c2cccs2)cc1-c1nn[n-]n1 ZINC000820164132 607423771 /nfs/dbraw/zinc/42/37/71/607423771.db2.gz DREALPBPDXAVKZ-NSHDSACASA-N -1 3 372.454 3.598 20 0 FHADHM O=C(NC1(c2cccc(-c3nnn[n-]3)c2)CC1)c1csc2ccccc12 ZINC000826428550 607424786 /nfs/dbraw/zinc/42/47/86/607424786.db2.gz FBKSSMGLNXDHEH-UHFFFAOYSA-N -1 3 361.430 3.501 20 0 FHADHM O=C(NC1(c2cccc(-c3nn[n-]n3)c2)CC1)c1csc2ccccc12 ZINC000826428550 607424787 /nfs/dbraw/zinc/42/47/87/607424787.db2.gz FBKSSMGLNXDHEH-UHFFFAOYSA-N -1 3 361.430 3.501 20 0 FHADHM CC(C)Oc1ccc(NC(=O)N(C2CC2)C2CCCC2)cc1-c1nnn[n-]1 ZINC000820164034 607425454 /nfs/dbraw/zinc/42/54/54/607425454.db2.gz AZVCGMMFHBPZEG-UHFFFAOYSA-N -1 3 370.457 3.593 20 0 FHADHM CC(C)Oc1ccc(NC(=O)N(C2CC2)C2CCCC2)cc1-c1nn[n-]n1 ZINC000820164034 607425456 /nfs/dbraw/zinc/42/54/56/607425456.db2.gz AZVCGMMFHBPZEG-UHFFFAOYSA-N -1 3 370.457 3.593 20 0 FHADHM CC1CCC(N2CCN(C(=O)Nc3cccc(NC(=O)[O-])c3)CC2)CC1 ZINC000736769245 600182081 /nfs/dbraw/zinc/18/20/81/600182081.db2.gz QGWXYVUHCDBWBY-UHFFFAOYSA-N -1 3 360.458 3.505 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1CCSc2ccc(Cl)cc21 ZINC000826245822 607430810 /nfs/dbraw/zinc/43/08/10/607430810.db2.gz IZQPPZVSWUTPPA-UHFFFAOYSA-N -1 3 371.853 3.581 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1CCSc2ccc(Cl)cc21 ZINC000826245822 607430812 /nfs/dbraw/zinc/43/08/12/607430812.db2.gz IZQPPZVSWUTPPA-UHFFFAOYSA-N -1 3 371.853 3.581 20 0 FHADHM C[C@@H]1CCCC[C@@]1(CNC(=O)OC(C)(C)C)NCc1ccc(C(=O)[O-])o1 ZINC000387861910 600315731 /nfs/dbraw/zinc/31/57/31/600315731.db2.gz NIKCDFKUWWACBM-YJYMSZOUSA-N -1 3 366.458 3.541 20 0 FHADHM C[C@H]1CN2CCCC[C@@H]2CN1Cc1csc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000736822089 600321814 /nfs/dbraw/zinc/32/18/14/600321814.db2.gz PBVXATYXKVMZQF-KBXCAEBGSA-N -1 3 371.506 3.567 20 0 FHADHM CCC[C@@](C)(NCc1csc(-c2ccc(OC)c(OC)c2)n1)C(=O)[O-] ZINC000736962830 600322502 /nfs/dbraw/zinc/32/25/02/600322502.db2.gz PGBNQZUFKDWPJM-GOSISDBHSA-N -1 3 364.467 3.560 20 0 FHADHM CN(C(=O)[C@H]1C[C@@H]1c1cccc2ccccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000825811738 607437033 /nfs/dbraw/zinc/43/70/33/607437033.db2.gz AIYWVGPISIWJJJ-UXHICEINSA-N -1 3 369.428 3.786 20 0 FHADHM CN(C(=O)[C@H]1C[C@@H]1c1cccc2ccccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000825811738 607437034 /nfs/dbraw/zinc/43/70/34/607437034.db2.gz AIYWVGPISIWJJJ-UXHICEINSA-N -1 3 369.428 3.786 20 0 FHADHM CCc1ccc([C@H](CNC(=O)Nc2ccc(F)c(C(=O)[O-])c2)N(C)C)cc1 ZINC000737259857 600384289 /nfs/dbraw/zinc/38/42/89/600384289.db2.gz ZGNQTRDDRUVENT-SFHVURJKSA-N -1 3 373.428 3.511 20 0 FHADHM O=C([O-])[C@@H](NCc1ccc(OCC(F)(F)F)cc1)c1ccc(F)cc1 ZINC000426814696 600420631 /nfs/dbraw/zinc/42/06/31/600420631.db2.gz AMEXZAODMGOTBO-HNNXBMFYSA-N -1 3 357.303 3.682 20 0 FHADHM CN(C(=O)c1ccc(Oc2ccccc2)o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825830522 607443294 /nfs/dbraw/zinc/44/32/94/607443294.db2.gz URQJFHJWZVSWQB-UHFFFAOYSA-N -1 3 361.361 3.529 20 0 FHADHM CN(C(=O)c1ccc(Oc2ccccc2)o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825830522 607443296 /nfs/dbraw/zinc/44/32/96/607443296.db2.gz URQJFHJWZVSWQB-UHFFFAOYSA-N -1 3 361.361 3.529 20 0 FHADHM COCc1cccc(CN[C@H](C(=O)[O-])c2ccc(Br)cc2)c1 ZINC000426796617 600423165 /nfs/dbraw/zinc/42/31/65/600423165.db2.gz CNWQXLVNPPMUEB-INIZCTEOSA-N -1 3 364.239 3.511 20 0 FHADHM CCOc1cccc(CN[C@H](C(=O)[O-])c2ccc(Br)cc2)c1 ZINC000426803721 600423819 /nfs/dbraw/zinc/42/38/19/600423819.db2.gz OVVDMCVXOFKGEA-INIZCTEOSA-N -1 3 364.239 3.763 20 0 FHADHM CC[C@H](C)C(=O)Nc1cccc(CN[C@@H](C(=O)[O-])c2ccc(F)cc2)c1 ZINC000736870172 600424704 /nfs/dbraw/zinc/42/47/04/600424704.db2.gz JWZBTTCBKFQIEN-SCLBCKFNSA-N -1 3 358.413 3.726 20 0 FHADHM CN(C(=O)c1cc2cccc(Cl)c2o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825825567 607443486 /nfs/dbraw/zinc/44/34/86/607443486.db2.gz FFDKQBSJKNAWOO-UHFFFAOYSA-N -1 3 353.769 3.543 20 0 FHADHM CN(C(=O)c1cc2cccc(Cl)c2o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825825567 607443488 /nfs/dbraw/zinc/44/34/88/607443488.db2.gz FFDKQBSJKNAWOO-UHFFFAOYSA-N -1 3 353.769 3.543 20 0 FHADHM O=C([O-])[C@H](NCc1cccc(OCC(F)F)c1)c1cccc(Cl)c1 ZINC000739501168 600433693 /nfs/dbraw/zinc/43/36/93/600433693.db2.gz SSEBMSMCJFRGFH-MRXNPFEDSA-N -1 3 355.768 3.899 20 0 FHADHM Cc1[nH]c(C(=O)CN2CCC[C@H]2Cc2ccccc2C)c(C)c1C(=O)[O-] ZINC000738769356 600509063 /nfs/dbraw/zinc/50/90/63/600509063.db2.gz VFDYYUHEAPQYOU-KRWDZBQOSA-N -1 3 354.450 3.528 20 0 FHADHM Cc1cccc([C@@H](C)N[C@H]2CCN(c3sccc3C(=O)[O-])C2=O)c1C ZINC000832966300 600694233 /nfs/dbraw/zinc/69/42/33/600694233.db2.gz MJFQFCCSVGSUNH-CJNGLKHVSA-N -1 3 358.463 3.519 20 0 FHADHM O=C([O-])[C@H](NCCC(=O)N1CCCCCC1)c1ccc(Cl)cc1Cl ZINC000833166283 600745883 /nfs/dbraw/zinc/74/58/83/600745883.db2.gz GQRPQSBHKXSTHJ-MRXNPFEDSA-N -1 3 373.280 3.501 20 0 FHADHM C[C@@H](NCc1cccc(OCC(=O)[O-])c1)c1ccc(OC(F)F)cc1 ZINC000827740950 600749907 /nfs/dbraw/zinc/74/99/07/600749907.db2.gz GGVFZYYDFYYJRN-GFCCVEGCSA-N -1 3 351.349 3.602 20 0 FHADHM Cc1nc2ccc(Br)cc2c(N2CCC[C@H](C(=O)[O-])C2)c1C ZINC000833004788 600824151 /nfs/dbraw/zinc/82/41/51/600824151.db2.gz ZYUGYPBFTVBYKQ-LBPRGKRZSA-N -1 3 363.255 3.915 20 0 FHADHM CN(C(=O)Nc1cccc(C(=O)[O-])c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000388538063 600867106 /nfs/dbraw/zinc/86/71/06/600867106.db2.gz SUYYBBWFJIMMTC-IBGZPJMESA-N -1 3 367.449 3.513 20 0 FHADHM CC(C)N(CCC(=O)[O-])Cc1ncc(-c2ccccc2Br)o1 ZINC000652478479 600954270 /nfs/dbraw/zinc/95/42/70/600954270.db2.gz GCVQHMAGUMCCMN-UHFFFAOYSA-N -1 3 367.243 3.789 20 0 FHADHM COc1ccc(C2CCN(Cn3ncc4cc(C(=O)[O-])ccc43)CC2)cc1 ZINC000832273187 601055154 /nfs/dbraw/zinc/05/51/54/601055154.db2.gz PARHOZWIHNCRGB-UHFFFAOYSA-N -1 3 365.433 3.580 20 0 FHADHM Cc1ccc(NC(=O)c2oc3ccccc3c2CN(C)C)cc1C(=O)[O-] ZINC000832948734 601066918 /nfs/dbraw/zinc/06/69/18/601066918.db2.gz BPGLOSKGYRAUMR-UHFFFAOYSA-N -1 3 352.390 3.753 20 0 FHADHM C[C@H](c1ccccc1Cl)N(Cc1ccnc(-c2nnn[n-]2)c1)C1CC1 ZINC000824770040 607494062 /nfs/dbraw/zinc/49/40/62/607494062.db2.gz CWBDSQRMZWAQLK-GFCCVEGCSA-N -1 3 354.845 3.641 20 0 FHADHM C[C@H](c1ccccc1Cl)N(Cc1ccnc(-c2nn[n-]n2)c1)C1CC1 ZINC000824770040 607494064 /nfs/dbraw/zinc/49/40/64/607494064.db2.gz CWBDSQRMZWAQLK-GFCCVEGCSA-N -1 3 354.845 3.641 20 0 FHADHM Cc1cc2oc(=O)cc(CN[C@H](c3ccccc3)[C@@H](C)C(=O)[O-])c2cc1C ZINC000832906846 601203384 /nfs/dbraw/zinc/20/33/84/601203384.db2.gz YTESCEMOVWOKSA-VFNWGFHPSA-N -1 3 365.429 3.961 20 0 FHADHM C[C@H]1CN(Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)C[C@@H]1C(=O)[O-] ZINC000828465976 601519141 /nfs/dbraw/zinc/51/91/41/601519141.db2.gz ZVTLPYJYGXHUBH-HZMBPMFUSA-N -1 3 370.396 3.981 20 0 FHADHM CCC(CC)n1ccc(CN(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)n1 ZINC000825114613 607518998 /nfs/dbraw/zinc/51/89/98/607518998.db2.gz OMHGRWFMFHYOFI-UHFFFAOYSA-N -1 3 365.485 3.589 20 0 FHADHM CCC(CC)n1ccc(CN(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)n1 ZINC000825114613 607518999 /nfs/dbraw/zinc/51/89/99/607518999.db2.gz OMHGRWFMFHYOFI-UHFFFAOYSA-N -1 3 365.485 3.589 20 0 FHADHM CC(C)[C@H](NC(=O)CN[C@H](c1ccccc1)[C@H](C)C(=O)[O-])c1ccccc1 ZINC000826693256 601650675 /nfs/dbraw/zinc/65/06/75/601650675.db2.gz FMIHNVNFWMUFKD-NDXORKPFSA-N -1 3 368.477 3.552 20 0 FHADHM CC(C)(C)OC(=O)Nc1cccc(COc2cccc(-c3nnn[n-]3)c2)c1 ZINC000824114479 607522094 /nfs/dbraw/zinc/52/20/94/607522094.db2.gz SUWJKVYDCAOMPC-UHFFFAOYSA-N -1 3 367.409 3.793 20 0 FHADHM CC(C)(C)OC(=O)Nc1cccc(COc2cccc(-c3nn[n-]n3)c2)c1 ZINC000824114479 607522095 /nfs/dbraw/zinc/52/20/95/607522095.db2.gz SUWJKVYDCAOMPC-UHFFFAOYSA-N -1 3 367.409 3.793 20 0 FHADHM O=C([O-])c1sccc1CNC1(c2ccc(Cl)cc2)CCOCC1 ZINC000833348157 601824729 /nfs/dbraw/zinc/82/47/29/601824729.db2.gz BQGDBCMQLMRLFB-UHFFFAOYSA-N -1 3 351.855 3.895 20 0 FHADHM O=C([O-])c1ccc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1F ZINC000833318295 601876412 /nfs/dbraw/zinc/87/64/12/601876412.db2.gz CVQKHOODXSDRGF-AWEZNQCLSA-N -1 3 374.387 3.514 20 0 FHADHM CN(Cc1cccc2cccnc21)[C@@H](C(=O)[O-])c1cc(F)c(F)c(F)c1 ZINC000830851504 601906544 /nfs/dbraw/zinc/90/65/44/601906544.db2.gz AIPATEJEGSIWNC-GOSISDBHSA-N -1 3 360.335 3.910 20 0 FHADHM C[C@@H](NCC(C)(C)C(=O)[O-])c1nnc(-c2ccc(Cl)c(Cl)c2)o1 ZINC000827735318 602129929 /nfs/dbraw/zinc/12/99/29/602129929.db2.gz UJQDIZDXEIQXIL-MRVPVSSYSA-N -1 3 358.225 3.805 20 0 FHADHM COc1ccc(CNc2ccc(Oc3ccccn3)cc2)cc1-c1nnn[n-]1 ZINC000826203827 607550978 /nfs/dbraw/zinc/55/09/78/607550978.db2.gz HZCKVAZULCWNBA-UHFFFAOYSA-N -1 3 374.404 3.675 20 0 FHADHM COc1ccc(CNc2ccc(Oc3ccccn3)cc2)cc1-c1nn[n-]n1 ZINC000826203827 607550980 /nfs/dbraw/zinc/55/09/80/607550980.db2.gz HZCKVAZULCWNBA-UHFFFAOYSA-N -1 3 374.404 3.675 20 0 FHADHM CCOc1ccc([C@@H](C)N[C@H](C(=O)[O-])c2cc(OC)cc(OC)c2)cc1 ZINC000830063889 602165411 /nfs/dbraw/zinc/16/54/11/602165411.db2.gz LUVHAPRTGHLFKC-YJYMSZOUSA-N -1 3 359.422 3.579 20 0 FHADHM COc1cc(OC)cc([C@H](NCc2ccccc2C(F)(F)F)C(=O)[O-])c1 ZINC000832056513 602169802 /nfs/dbraw/zinc/16/98/02/602169802.db2.gz FJAKMHQEMBXJAH-INIZCTEOSA-N -1 3 369.339 3.638 20 0 FHADHM CN(C(=O)Nc1cccc(NC(=O)[O-])c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000830507811 602363493 /nfs/dbraw/zinc/36/34/93/602363493.db2.gz PDSWJLMCGPYNLU-SFHVURJKSA-N -1 3 368.437 3.515 20 0 FHADHM C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2ccc(NC(=O)[O-])cc2)C1 ZINC000739056256 602604008 /nfs/dbraw/zinc/60/40/08/602604008.db2.gz CWARDSDQRZZRJV-KSSFIOAISA-N -1 3 368.437 3.734 20 0 FHADHM CC[C@@H](SC)C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000825159989 607578097 /nfs/dbraw/zinc/57/80/97/607578097.db2.gz VTVVXWZKWGPGDZ-MRXNPFEDSA-N -1 3 369.450 3.739 20 0 FHADHM CC[C@@H](SC)C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000825159989 607578099 /nfs/dbraw/zinc/57/80/99/607578099.db2.gz VTVVXWZKWGPGDZ-MRXNPFEDSA-N -1 3 369.450 3.739 20 0 FHADHM O=C([O-])N[C@H](CNCc1csc(Br)c1)c1ccccc1 ZINC000832141531 603176670 /nfs/dbraw/zinc/17/66/70/603176670.db2.gz SUKOWUAUPPQWMI-GFCCVEGCSA-N -1 3 355.257 3.609 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N[C@@H](c1ccc(Cl)cc1)C1CC1 ZINC000826246382 607651511 /nfs/dbraw/zinc/65/15/11/607651511.db2.gz CJKLOTSTOCAUQA-QGZVFWFLSA-N -1 3 367.840 3.710 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N[C@@H](c1ccc(Cl)cc1)C1CC1 ZINC000826246382 607651513 /nfs/dbraw/zinc/65/15/13/607651513.db2.gz CJKLOTSTOCAUQA-QGZVFWFLSA-N -1 3 367.840 3.710 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1ccc(Cl)c2ncccc12 ZINC000826249948 607655438 /nfs/dbraw/zinc/65/54/38/607655438.db2.gz CMXLVKULHWCFNP-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1ccc(Cl)c2ncccc12 ZINC000826249948 607655439 /nfs/dbraw/zinc/65/54/39/607655439.db2.gz CMXLVKULHWCFNP-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1ccsc1[C@H]1C[C@H]1C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000826316324 607655773 /nfs/dbraw/zinc/65/57/73/607655773.db2.gz KJOYMDGMGQYQJD-WDEREUQCSA-N -1 3 359.842 3.632 20 0 FHADHM Cc1ccsc1[C@H]1C[C@H]1C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000826316324 607655775 /nfs/dbraw/zinc/65/57/75/607655775.db2.gz KJOYMDGMGQYQJD-WDEREUQCSA-N -1 3 359.842 3.632 20 0 FHADHM Cc1cc(C(F)(F)F)c(-c2nnn[n-]2)c(SC[C@H](C)C(F)(F)F)n1 ZINC000826262278 607657175 /nfs/dbraw/zinc/65/71/75/607657175.db2.gz KJBFJYYWCZYMTO-YFKPBYRVSA-N -1 3 371.310 3.879 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N(Cc1ccccc1)CC1CCC1 ZINC000826244449 607669826 /nfs/dbraw/zinc/66/98/26/607669826.db2.gz SONPQQFRMQCXHG-UHFFFAOYSA-N -1 3 361.449 3.618 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N(Cc1ccccc1)CC1CCC1 ZINC000826244449 607669827 /nfs/dbraw/zinc/66/98/27/607669827.db2.gz SONPQQFRMQCXHG-UHFFFAOYSA-N -1 3 361.449 3.618 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N[C@H](c1ccc(F)cc1)C1CCC1 ZINC000826246709 607684773 /nfs/dbraw/zinc/68/47/73/607684773.db2.gz JVWRPRYLMUMBCU-SFHVURJKSA-N -1 3 365.412 3.585 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N[C@H](c1ccc(F)cc1)C1CCC1 ZINC000826246709 607684775 /nfs/dbraw/zinc/68/47/75/607684775.db2.gz JVWRPRYLMUMBCU-SFHVURJKSA-N -1 3 365.412 3.585 20 0 FHADHM FC(F)(F)c1csc(CNc2ccc(-c3nn[n-]n3)cc2Cl)n1 ZINC000826369368 607686171 /nfs/dbraw/zinc/68/61/71/607686171.db2.gz ZMDMFDARMIBRSG-UHFFFAOYSA-N -1 3 360.752 3.608 20 0 FHADHM Cc1cc([C@H](C)N2CCC(CNC(=O)OC(C)(C)C)CC2)oc1C(=O)[O-] ZINC000832871161 604384691 /nfs/dbraw/zinc/38/46/91/604384691.db2.gz PGEBPCQVWKDWIE-ZDUSSCGKSA-N -1 3 366.458 3.584 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1CCCCC[C@H]1c1ccco1 ZINC000826245221 607694232 /nfs/dbraw/zinc/69/42/32/607694232.db2.gz QVYWCXAJDWUPJZ-INIZCTEOSA-N -1 3 351.410 3.526 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1CCCCC[C@H]1c1ccco1 ZINC000826245221 607694234 /nfs/dbraw/zinc/69/42/34/607694234.db2.gz QVYWCXAJDWUPJZ-INIZCTEOSA-N -1 3 351.410 3.526 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1CCCC[C@H]1c1ccc(F)cc1 ZINC000826245253 607699744 /nfs/dbraw/zinc/69/97/44/607699744.db2.gz SDTQGNLDLYHZAC-SFHVURJKSA-N -1 3 365.412 3.682 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1CCCC[C@H]1c1ccc(F)cc1 ZINC000826245253 607699746 /nfs/dbraw/zinc/69/97/46/607699746.db2.gz SDTQGNLDLYHZAC-SFHVURJKSA-N -1 3 365.412 3.682 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1CC[C@@H](C)[C@H]1c1cccc(F)c1 ZINC000826244371 607699945 /nfs/dbraw/zinc/69/99/45/607699945.db2.gz PMBWONJHIXIAKR-XIKOKIGWSA-N -1 3 365.412 3.538 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1CC[C@@H](C)[C@H]1c1cccc(F)c1 ZINC000826244371 607699947 /nfs/dbraw/zinc/69/99/47/607699947.db2.gz PMBWONJHIXIAKR-XIKOKIGWSA-N -1 3 365.412 3.538 20 0 FHADHM C[C@@H](Oc1ccc(CN2CCC(N(C)c3ccccc3)CC2)cc1)C(=O)[O-] ZINC000833541781 604620759 /nfs/dbraw/zinc/62/07/59/604620759.db2.gz NOKJBURMNOSEHP-QGZVFWFLSA-N -1 3 368.477 3.639 20 0 FHADHM CCc1cccc(CC(=O)N(CC)[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000825723210 607705313 /nfs/dbraw/zinc/70/53/13/607705313.db2.gz UPPQBORWDOUIQY-OAHLLOKOSA-N -1 3 363.465 3.581 20 0 FHADHM CCc1cccc(CC(=O)N(CC)[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000825723210 607705315 /nfs/dbraw/zinc/70/53/15/607705315.db2.gz UPPQBORWDOUIQY-OAHLLOKOSA-N -1 3 363.465 3.581 20 0 FHADHM C[C@H](C(=O)[O-])[C@H](NC[C@H]1CC(c2ccc(Cl)cc2)=NO1)c1ccccc1 ZINC000833406107 604716916 /nfs/dbraw/zinc/71/69/16/604716916.db2.gz ATGJZWWPDSNRJL-IRWQIABSSA-N -1 3 372.852 3.885 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1CCC[C@H]1CCC1CCCC1 ZINC000826244992 607710257 /nfs/dbraw/zinc/71/02/57/607710257.db2.gz KIYXBWGJUVMTAV-KRWDZBQOSA-N -1 3 353.470 3.750 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1CCC[C@H]1CCC1CCCC1 ZINC000826244992 607710259 /nfs/dbraw/zinc/71/02/59/607710259.db2.gz KIYXBWGJUVMTAV-KRWDZBQOSA-N -1 3 353.470 3.750 20 0 FHADHM Cc1cc(SC(C)(C)C)ccc1NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC000826272298 607720711 /nfs/dbraw/zinc/72/07/11/607720711.db2.gz CJSFTQGJXTVHOP-UHFFFAOYSA-N -1 3 356.455 3.646 20 0 FHADHM Cc1cc(SC(C)(C)C)ccc1NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC000826272298 607720714 /nfs/dbraw/zinc/72/07/14/607720714.db2.gz CJSFTQGJXTVHOP-UHFFFAOYSA-N -1 3 356.455 3.646 20 0 FHADHM CCc1nc2c(s1)[C@@H](NCc1ccc(CCNC(=O)[O-])cc1)CCC2 ZINC000827636891 604942770 /nfs/dbraw/zinc/94/27/70/604942770.db2.gz PAVIZPWEVFKZOW-HNNXBMFYSA-N -1 3 359.495 3.683 20 0 FHADHM CC(C)(C(=O)[O-])[C@@H]1CCCN(Cc2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000326833466 604951569 /nfs/dbraw/zinc/95/15/69/604951569.db2.gz LVWDXQZAYYYSAY-CYBMUJFWSA-N -1 3 363.845 3.713 20 0 FHADHM CC(C)(C(=O)[O-])[C@H]1CCCN(Cc2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000326833467 604952010 /nfs/dbraw/zinc/95/20/10/604952010.db2.gz LVWDXQZAYYYSAY-ZDUSSCGKSA-N -1 3 363.845 3.713 20 0 FHADHM C/C(=C\CN1CCC[C@H](Cc2nc(C3CCCCCC3)no2)C1)C(=O)[O-] ZINC000833381974 605150651 /nfs/dbraw/zinc/15/06/51/605150651.db2.gz GBKNMXLMIDXRRY-AAGJOFLKSA-N -1 3 361.486 3.793 20 0 FHADHM CC(C)(C(=O)[O-])[C@H](NCC(=O)Nc1ccc2c(c1)CCC2)c1ccccc1 ZINC000833411470 605175230 /nfs/dbraw/zinc/17/52/30/605175230.db2.gz CAULQAZTRYPKTK-HXUWFJFHSA-N -1 3 366.461 3.556 20 0 FHADHM CC(C)(C(=O)[O-])[C@H](NCC(=O)Nc1cccc(Cl)c1)c1ccccc1 ZINC000833415485 605184851 /nfs/dbraw/zinc/18/48/51/605184851.db2.gz WBBQBFSOCGXKDP-QGZVFWFLSA-N -1 3 360.841 3.720 20 0 FHADHM Cc1oc(-c2cccs2)nc1CN1C[C@@H]2CCC[C@H](NC(=O)[O-])[C@H]2C1 ZINC000833934426 605438284 /nfs/dbraw/zinc/43/82/84/605438284.db2.gz JWIOFUJVYUXQTP-IHRRRGAJSA-N -1 3 361.467 3.580 20 0 FHADHM CC1([C@@H]2CCCN([C@@H](C(=O)[O-])c3cc(Cl)cc(Cl)c3)C2)OCCO1 ZINC000833565174 605444132 /nfs/dbraw/zinc/44/41/32/605444132.db2.gz YMJJJZUVHILCNW-IUODEOHRSA-N -1 3 374.264 3.594 20 0 FHADHM Cc1oc(-c2ccccc2)nc1CN1C[C@@H]2CCC[C@H](NC(=O)[O-])[C@@H]2C1 ZINC000833937381 605450225 /nfs/dbraw/zinc/45/02/25/605450225.db2.gz WFROTDUTQWDZED-BBWFWOEESA-N -1 3 355.438 3.518 20 0 FHADHM CCOC(=O)Nc1ccc(NC(=O)CCCC(C)(C)C)cc1-c1nnn[n-]1 ZINC000825531957 607760913 /nfs/dbraw/zinc/76/09/13/607760913.db2.gz NLXUPGWVKJTQMY-UHFFFAOYSA-N -1 3 374.445 3.590 20 0 FHADHM CCOC(=O)Nc1ccc(NC(=O)CCCC(C)(C)C)cc1-c1nn[n-]n1 ZINC000825531957 607760914 /nfs/dbraw/zinc/76/09/14/607760914.db2.gz NLXUPGWVKJTQMY-UHFFFAOYSA-N -1 3 374.445 3.590 20 0 FHADHM Cc1c(NC(=O)N2CC[C@@H]2c2ccc(Cl)cc2)cccc1-c1nnn[n-]1 ZINC000826241366 607765054 /nfs/dbraw/zinc/76/50/54/607765054.db2.gz AYRJFZGNRAKIHM-MRXNPFEDSA-N -1 3 368.828 3.807 20 0 FHADHM Cc1c(NC(=O)N2CC[C@@H]2c2ccc(Cl)cc2)cccc1-c1nn[n-]n1 ZINC000826241366 607765055 /nfs/dbraw/zinc/76/50/55/607765055.db2.gz AYRJFZGNRAKIHM-MRXNPFEDSA-N -1 3 368.828 3.807 20 0 FHADHM C[C@H](NC(=O)Nc1cccc2ccsc21)c1cccc(-c2nnn[n-]2)c1 ZINC000824507049 607767741 /nfs/dbraw/zinc/76/77/41/607767741.db2.gz SLBFGGFZASIZMV-NSHDSACASA-N -1 3 364.434 3.964 20 0 FHADHM C[C@H](NC(=O)Nc1cccc2ccsc21)c1cccc(-c2nn[n-]n2)c1 ZINC000824507049 607767742 /nfs/dbraw/zinc/76/77/42/607767742.db2.gz SLBFGGFZASIZMV-NSHDSACASA-N -1 3 364.434 3.964 20 0 FHADHM O=C([O-])N1CCC([C@@H](NCc2cccc(CO)c2)c2ccc(F)cc2)CC1 ZINC000834074285 605983178 /nfs/dbraw/zinc/98/31/78/605983178.db2.gz MEJTVYWNBPXUOA-FQEVSTJZSA-N -1 3 372.440 3.539 20 0 FHADHM Cn1cc(CN[C@@H]2C[C@@H](NC(=O)[O-])c3ccccc32)c(-c2ccccc2)n1 ZINC000833946740 605984160 /nfs/dbraw/zinc/98/41/60/605984160.db2.gz LVDRNFDCECRCOM-RTBURBONSA-N -1 3 362.433 3.630 20 0 FHADHM CC[C@H]1CN(C(=O)c2sccc2-c2nnn[n-]2)CC[C@@H]1c1ccccc1 ZINC000820994991 606030730 /nfs/dbraw/zinc/03/07/30/606030730.db2.gz LVRCQXIVVNCDGC-ZFWWWQNUSA-N -1 3 367.478 3.584 20 0 FHADHM CC[C@H]1CN(C(=O)c2sccc2-c2nn[n-]n2)CC[C@@H]1c1ccccc1 ZINC000820994991 606030736 /nfs/dbraw/zinc/03/07/36/606030736.db2.gz LVRCQXIVVNCDGC-ZFWWWQNUSA-N -1 3 367.478 3.584 20 0 FHADHM CCO[C@@H](CCNc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)C(C)C ZINC000821351030 606040384 /nfs/dbraw/zinc/04/03/84/606040384.db2.gz IZVAMOXFLFAESG-AWEZNQCLSA-N -1 3 357.380 3.749 20 0 FHADHM CCO[C@@H](CCNc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)C(C)C ZINC000821351030 606040388 /nfs/dbraw/zinc/04/03/88/606040388.db2.gz IZVAMOXFLFAESG-AWEZNQCLSA-N -1 3 357.380 3.749 20 0 FHADHM C[C@H](C(=O)Nc1ccccc1-c1nnn[n-]1)c1ccc(Cl)c(Cl)c1 ZINC000819877315 606099490 /nfs/dbraw/zinc/09/94/90/606099490.db2.gz SZAQSYVPBFFUOW-VIFPVBQESA-N -1 3 362.220 3.916 20 0 FHADHM C[C@H](C(=O)Nc1ccccc1-c1nn[n-]n1)c1ccc(Cl)c(Cl)c1 ZINC000819877315 606099492 /nfs/dbraw/zinc/09/94/92/606099492.db2.gz SZAQSYVPBFFUOW-VIFPVBQESA-N -1 3 362.220 3.916 20 0 FHADHM CCN(C(=O)c1cccc2[nH]ccc21)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821160621 606136433 /nfs/dbraw/zinc/13/64/33/606136433.db2.gz NQNWAHFZILQFPH-CYBMUJFWSA-N -1 3 360.421 3.571 20 0 FHADHM CCN(C(=O)c1cccc2[nH]ccc21)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821160621 606136434 /nfs/dbraw/zinc/13/64/34/606136434.db2.gz NQNWAHFZILQFPH-CYBMUJFWSA-N -1 3 360.421 3.571 20 0 FHADHM C[C@@H](c1ccc(Cl)cc1)[C@H](C)N(C)C(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000820562697 606149209 /nfs/dbraw/zinc/14/92/09/606149209.db2.gz ILWMCNYQMADADX-OLZOCXBDSA-N -1 3 369.856 3.784 20 0 FHADHM C[C@@H](c1ccc(Cl)cc1)[C@H](C)N(C)C(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC000820562697 606149211 /nfs/dbraw/zinc/14/92/11/606149211.db2.gz ILWMCNYQMADADX-OLZOCXBDSA-N -1 3 369.856 3.784 20 0 FHADHM Fc1cccc(-c2cnc(CNc3ccc(Cl)c(-c4nnn[n-]4)c3)o2)c1 ZINC000822787107 606156118 /nfs/dbraw/zinc/15/61/18/606156118.db2.gz VRKYEOKCGPJIDP-UHFFFAOYSA-N -1 3 370.775 3.926 20 0 FHADHM Fc1cccc(-c2cnc(CNc3ccc(Cl)c(-c4nn[n-]n4)c3)o2)c1 ZINC000822787107 606156119 /nfs/dbraw/zinc/15/61/19/606156119.db2.gz VRKYEOKCGPJIDP-UHFFFAOYSA-N -1 3 370.775 3.926 20 0 FHADHM O=C(C/C=C/c1ccc(F)cc1)Nc1sc2c(c1-c1nnn[n-]1)CCC2 ZINC000822945576 606175125 /nfs/dbraw/zinc/17/51/25/606175125.db2.gz KHYOJJDIEFAWIU-HNQUOIGGSA-N -1 3 369.425 3.598 20 0 FHADHM O=C(C/C=C/c1ccc(F)cc1)Nc1sc2c(c1-c1nn[n-]n1)CCC2 ZINC000822945576 606175126 /nfs/dbraw/zinc/17/51/26/606175126.db2.gz KHYOJJDIEFAWIU-HNQUOIGGSA-N -1 3 369.425 3.598 20 0 FHADHM c1ccc2c(c1)nc(N1CCSC3(CCCCC3)C1)cc2-c1nnn[n-]1 ZINC000823792052 606200968 /nfs/dbraw/zinc/20/09/68/606200968.db2.gz NYXLXVAQHIQXFB-UHFFFAOYSA-N -1 3 366.494 3.671 20 0 FHADHM c1ccc2c(c1)nc(N1CCSC3(CCCCC3)C1)cc2-c1nn[n-]n1 ZINC000823792052 606200970 /nfs/dbraw/zinc/20/09/70/606200970.db2.gz NYXLXVAQHIQXFB-UHFFFAOYSA-N -1 3 366.494 3.671 20 0 FHADHM c1ccc2c(c1)ncc(-c1nnn[n-]1)c2N1CCSC2(CCCCC2)C1 ZINC000823798145 606201093 /nfs/dbraw/zinc/20/10/93/606201093.db2.gz UQBKSLGFKDPFOM-UHFFFAOYSA-N -1 3 366.494 3.671 20 0 FHADHM c1ccc2c(c1)ncc(-c1nn[n-]n1)c2N1CCSC2(CCCCC2)C1 ZINC000823798145 606201095 /nfs/dbraw/zinc/20/10/95/606201095.db2.gz UQBKSLGFKDPFOM-UHFFFAOYSA-N -1 3 366.494 3.671 20 0 FHADHM CC(C)=C(C)C(=O)Nc1ccc(Oc2ncccc2-c2nnn[n-]2)cc1C ZINC000820005370 606201881 /nfs/dbraw/zinc/20/18/81/606201881.db2.gz OVNICXPZCPVYLV-UHFFFAOYSA-N -1 3 364.409 3.657 20 0 FHADHM CC(C)n1c2ccccc2nc1[C@H]1CCCN1c1ncccc1-c1nnn[n-]1 ZINC000820211622 606239818 /nfs/dbraw/zinc/23/98/18/606239818.db2.gz TVLIUBCDQZULCV-QGZVFWFLSA-N -1 3 374.452 3.534 20 0 FHADHM CC(C)n1c2ccccc2nc1[C@H]1CCCN1c1ncccc1-c1nn[n-]n1 ZINC000820211622 606239819 /nfs/dbraw/zinc/23/98/19/606239819.db2.gz TVLIUBCDQZULCV-QGZVFWFLSA-N -1 3 374.452 3.534 20 0 FHADHM CCCCNC(=O)c1ccc(Sc2ccccc2-c2nnn[n-]2)cc1 ZINC000821071468 606246748 /nfs/dbraw/zinc/24/67/48/606246748.db2.gz FVACYXIUQBAPGG-UHFFFAOYSA-N -1 3 353.451 3.548 20 0 FHADHM CCCCNC(=O)c1ccc(Sc2ccccc2-c2nn[n-]n2)cc1 ZINC000821071468 606246749 /nfs/dbraw/zinc/24/67/49/606246749.db2.gz FVACYXIUQBAPGG-UHFFFAOYSA-N -1 3 353.451 3.548 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1)[C@H]1C[C@@H]1C1CC1 ZINC000823350384 606252692 /nfs/dbraw/zinc/25/26/92/606252692.db2.gz LDKPQDDNTMGTMN-MSOLQXFVSA-N -1 3 361.405 3.644 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1)[C@H]1C[C@@H]1C1CC1 ZINC000823350384 606252695 /nfs/dbraw/zinc/25/26/95/606252695.db2.gz LDKPQDDNTMGTMN-MSOLQXFVSA-N -1 3 361.405 3.644 20 0 FHADHM CCCCN(C(=O)c1cc(-c2nnn[n-]2)cn1C)[C@@H](CC)c1ccccc1 ZINC000821062178 606253093 /nfs/dbraw/zinc/25/30/93/606253093.db2.gz VGCHUENQAKDIFO-KRWDZBQOSA-N -1 3 366.469 3.599 20 0 FHADHM CCCCN(C(=O)c1cc(-c2nn[n-]n2)cn1C)[C@@H](CC)c1ccccc1 ZINC000821062178 606253094 /nfs/dbraw/zinc/25/30/94/606253094.db2.gz VGCHUENQAKDIFO-KRWDZBQOSA-N -1 3 366.469 3.599 20 0 FHADHM CC(C)CN(C)C(=O)c1ccc(Sc2ccccc2-c2nnn[n-]2)cc1 ZINC000820081866 606254066 /nfs/dbraw/zinc/25/40/66/606254066.db2.gz ZDCNINQYOBILRI-UHFFFAOYSA-N -1 3 367.478 3.746 20 0 FHADHM CC(C)CN(C)C(=O)c1ccc(Sc2ccccc2-c2nn[n-]n2)cc1 ZINC000820081866 606254067 /nfs/dbraw/zinc/25/40/67/606254067.db2.gz ZDCNINQYOBILRI-UHFFFAOYSA-N -1 3 367.478 3.746 20 0 FHADHM Cc1c(C(=O)Nc2ccc(F)cc2-c2nnn[n-]2)sc2cccc(F)c12 ZINC000822020872 606261970 /nfs/dbraw/zinc/26/19/70/606261970.db2.gz LSQGXXLHOHKQJA-UHFFFAOYSA-N -1 3 371.372 3.920 20 0 FHADHM Cc1c(C(=O)Nc2ccc(F)cc2-c2nn[n-]n2)sc2cccc(F)c12 ZINC000822020872 606261972 /nfs/dbraw/zinc/26/19/72/606261972.db2.gz LSQGXXLHOHKQJA-UHFFFAOYSA-N -1 3 371.372 3.920 20 0 FHADHM CC[C@H](C)c1ccccc1OCC(=O)Nc1ccc(F)cc1-c1nnn[n-]1 ZINC000820882762 606269653 /nfs/dbraw/zinc/26/96/53/606269653.db2.gz ZYKCAUZANJOVAZ-LBPRGKRZSA-N -1 3 369.400 3.537 20 0 FHADHM CC[C@H](C)c1ccccc1OCC(=O)Nc1ccc(F)cc1-c1nn[n-]n1 ZINC000820882762 606269654 /nfs/dbraw/zinc/26/96/54/606269654.db2.gz ZYKCAUZANJOVAZ-LBPRGKRZSA-N -1 3 369.400 3.537 20 0 FHADHM O=C(CCc1ccc2ccccc2c1)Nc1ccc(F)cc1-c1nnn[n-]1 ZINC000822983719 606270302 /nfs/dbraw/zinc/27/03/02/606270302.db2.gz SRIYRMRLZPLETB-UHFFFAOYSA-N -1 3 361.380 3.730 20 0 FHADHM O=C(CCc1ccc2ccccc2c1)Nc1ccc(F)cc1-c1nn[n-]n1 ZINC000822983719 606270303 /nfs/dbraw/zinc/27/03/03/606270303.db2.gz SRIYRMRLZPLETB-UHFFFAOYSA-N -1 3 361.380 3.730 20 0 FHADHM Cc1ccc2c(CC(=O)Nc3ccc(F)cc3-c3nnn[n-]3)coc2c1C ZINC000822274644 606273087 /nfs/dbraw/zinc/27/30/87/606273087.db2.gz DOHZWHXPEXNXAQ-UHFFFAOYSA-N -1 3 365.368 3.550 20 0 FHADHM Cc1ccc2c(CC(=O)Nc3ccc(F)cc3-c3nn[n-]n3)coc2c1C ZINC000822274644 606273088 /nfs/dbraw/zinc/27/30/88/606273088.db2.gz DOHZWHXPEXNXAQ-UHFFFAOYSA-N -1 3 365.368 3.550 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NCc1ncc(C(C)(C)C)o1 ZINC000820155414 606308999 /nfs/dbraw/zinc/30/89/99/606308999.db2.gz PPOCKFIKFYQESI-UHFFFAOYSA-N -1 3 356.430 3.552 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NCc1ncc(C(C)(C)C)o1 ZINC000820155414 606309001 /nfs/dbraw/zinc/30/90/01/606309001.db2.gz PPOCKFIKFYQESI-UHFFFAOYSA-N -1 3 356.430 3.552 20 0 FHADHM C[C@@H](Oc1ccccc1NC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1ccccc1 ZINC000820550614 606321390 /nfs/dbraw/zinc/32/13/90/606321390.db2.gz XPYUVNNUIODKGP-CYBMUJFWSA-N -1 3 374.404 3.587 20 0 FHADHM C[C@@H](Oc1ccccc1NC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1ccccc1 ZINC000820550614 606321391 /nfs/dbraw/zinc/32/13/91/606321391.db2.gz XPYUVNNUIODKGP-CYBMUJFWSA-N -1 3 374.404 3.587 20 0 FHADHM CCCCCN(Cc1ccc(Cl)cc1)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC000821056462 606322892 /nfs/dbraw/zinc/32/28/92/606322892.db2.gz SFFHRLODYCFBDI-UHFFFAOYSA-N -1 3 372.860 3.681 20 0 FHADHM CCCCCN(Cc1ccc(Cl)cc1)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC000821056462 606322895 /nfs/dbraw/zinc/32/28/95/606322895.db2.gz SFFHRLODYCFBDI-UHFFFAOYSA-N -1 3 372.860 3.681 20 0 FHADHM C[C@@H](Sc1cccc(-c2nnn[n-]2)c1)c1nnc(-c2cccs2)o1 ZINC000820557330 606327242 /nfs/dbraw/zinc/32/72/42/606327242.db2.gz YLRCTVMFAPECEO-SECBINFHSA-N -1 3 356.436 3.832 20 0 FHADHM C[C@@H](Sc1cccc(-c2nn[n-]n2)c1)c1nnc(-c2cccs2)o1 ZINC000820557330 606327244 /nfs/dbraw/zinc/32/72/44/606327244.db2.gz YLRCTVMFAPECEO-SECBINFHSA-N -1 3 356.436 3.832 20 0 FHADHM CCC(CC)N(CC(C)C)C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820898004 606330852 /nfs/dbraw/zinc/33/08/52/606330852.db2.gz RYJYXQUIJIEIPT-CQSZACIVSA-N -1 3 358.490 3.784 20 0 FHADHM CCC(CC)N(CC(C)C)C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820898004 606330853 /nfs/dbraw/zinc/33/08/53/606330853.db2.gz RYJYXQUIJIEIPT-CQSZACIVSA-N -1 3 358.490 3.784 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)Nc1ccc(OC2CCC2)c(F)c1 ZINC000823363880 606335051 /nfs/dbraw/zinc/33/50/51/606335051.db2.gz PZMQYICOODBYRX-UHFFFAOYSA-N -1 3 368.372 3.581 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)Nc1ccc(OC2CCC2)c(F)c1 ZINC000823363880 606335053 /nfs/dbraw/zinc/33/50/53/606335053.db2.gz PZMQYICOODBYRX-UHFFFAOYSA-N -1 3 368.372 3.581 20 0 FHADHM C[C@@H](OC(=O)c1cc2cc(F)ccc2o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820508261 606341070 /nfs/dbraw/zinc/34/10/70/606341070.db2.gz NGOYAJOKTAROOG-SNVBAGLBSA-N -1 3 352.325 3.670 20 0 FHADHM C[C@@H](OC(=O)c1cc2cc(F)ccc2o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820508261 606341072 /nfs/dbraw/zinc/34/10/72/606341072.db2.gz NGOYAJOKTAROOG-SNVBAGLBSA-N -1 3 352.325 3.670 20 0 FHADHM C[C@@H](OC(=O)c1cnc(-c2ccco2)s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820518361 606342630 /nfs/dbraw/zinc/34/26/30/606342630.db2.gz BYYDKPSPHXQAFF-SNVBAGLBSA-N -1 3 367.390 3.501 20 0 FHADHM C[C@@H](OC(=O)c1cnc(-c2ccco2)s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820518361 606342632 /nfs/dbraw/zinc/34/26/32/606342632.db2.gz BYYDKPSPHXQAFF-SNVBAGLBSA-N -1 3 367.390 3.501 20 0 FHADHM C[C@H](OC(=O)c1cnc(-c2ccco2)s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820518360 606342696 /nfs/dbraw/zinc/34/26/96/606342696.db2.gz BYYDKPSPHXQAFF-JTQLQIEISA-N -1 3 367.390 3.501 20 0 FHADHM C[C@H](OC(=O)c1cnc(-c2ccco2)s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820518360 606342698 /nfs/dbraw/zinc/34/26/98/606342698.db2.gz BYYDKPSPHXQAFF-JTQLQIEISA-N -1 3 367.390 3.501 20 0 FHADHM C[C@@H](OC(=O)[C@@H]1CCSc2ccccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488467 606345988 /nfs/dbraw/zinc/34/59/88/606345988.db2.gz OKGDRZPNRCUYFX-MLGOLLRUSA-N -1 3 366.446 3.751 20 0 FHADHM C[C@@H](OC(=O)[C@@H]1CCSc2ccccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488467 606345990 /nfs/dbraw/zinc/34/59/90/606345990.db2.gz OKGDRZPNRCUYFX-MLGOLLRUSA-N -1 3 366.446 3.751 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccc2ccccc2n1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488942 606349286 /nfs/dbraw/zinc/34/92/86/606349286.db2.gz XCDQPYRZCPIYPD-FNDVETGQSA-N -1 3 371.400 3.733 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccc2ccccc2n1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488942 606349287 /nfs/dbraw/zinc/34/92/87/606349287.db2.gz XCDQPYRZCPIYPD-FNDVETGQSA-N -1 3 371.400 3.733 20 0 FHADHM Cc1ccc(CN(C(=O)Nc2ccc(F)cc2-c2nnn[n-]2)C(C)C)s1 ZINC000822236208 606351460 /nfs/dbraw/zinc/35/14/60/606351460.db2.gz OEBWFLVJLUATIN-UHFFFAOYSA-N -1 3 374.445 3.818 20 0 FHADHM Cc1ccc(CN(C(=O)Nc2ccc(F)cc2-c2nn[n-]n2)C(C)C)s1 ZINC000822236208 606351461 /nfs/dbraw/zinc/35/14/61/606351461.db2.gz OEBWFLVJLUATIN-UHFFFAOYSA-N -1 3 374.445 3.818 20 0 FHADHM Cc1cccc2c(CC(=O)O[C@@H](C)c3ccc(-c4nnn[n-]4)cc3)c[nH]c21 ZINC000822332374 606351887 /nfs/dbraw/zinc/35/18/87/606351887.db2.gz PAIVEBFUFFIZAY-ZDUSSCGKSA-N -1 3 361.405 3.503 20 0 FHADHM Cc1cccc2c(CC(=O)O[C@@H](C)c3ccc(-c4nn[n-]n4)cc3)c[nH]c21 ZINC000822332374 606351889 /nfs/dbraw/zinc/35/18/89/606351889.db2.gz PAIVEBFUFFIZAY-ZDUSSCGKSA-N -1 3 361.405 3.503 20 0 FHADHM CCOc1ccccc1CCC(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821430991 606355044 /nfs/dbraw/zinc/35/50/44/606355044.db2.gz JONRXWSJKCRFAN-AWEZNQCLSA-N -1 3 366.421 3.502 20 0 FHADHM CCOc1ccccc1CCC(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821430991 606355047 /nfs/dbraw/zinc/35/50/47/606355047.db2.gz JONRXWSJKCRFAN-AWEZNQCLSA-N -1 3 366.421 3.502 20 0 FHADHM CS[C@H](C(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000821943963 606356905 /nfs/dbraw/zinc/35/69/05/606356905.db2.gz YPWLQYMNXYQOED-WBMJQRKESA-N -1 3 354.435 3.575 20 0 FHADHM CS[C@H](C(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000821943963 606356906 /nfs/dbraw/zinc/35/69/06/606356906.db2.gz YPWLQYMNXYQOED-WBMJQRKESA-N -1 3 354.435 3.575 20 0 FHADHM O=C(NCc1cc2ccccc2s1)Nc1ccc(F)cc1-c1nnn[n-]1 ZINC000823246444 606358422 /nfs/dbraw/zinc/35/84/22/606358422.db2.gz PJVMCYLSOFICRM-UHFFFAOYSA-N -1 3 368.397 3.542 20 0 FHADHM O=C(NCc1cc2ccccc2s1)Nc1ccc(F)cc1-c1nn[n-]n1 ZINC000823246444 606358424 /nfs/dbraw/zinc/35/84/24/606358424.db2.gz PJVMCYLSOFICRM-UHFFFAOYSA-N -1 3 368.397 3.542 20 0 FHADHM C[C@H](OC(=O)[C@H]1C[C@@H]1c1ccc(F)c(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820489000 606359145 /nfs/dbraw/zinc/35/91/45/606359145.db2.gz XTLNRPFUAKFZJT-VQISRLSMSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@H]1C[C@@H]1c1ccc(F)c(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820489000 606359146 /nfs/dbraw/zinc/35/91/46/606359146.db2.gz XTLNRPFUAKFZJT-VQISRLSMSA-N -1 3 370.359 3.553 20 0 FHADHM Cc1cncc(C(=O)Oc2ccc(Oc3ccc(-c4nn[n-]n4)cc3)cc2)c1 ZINC000822399642 606361142 /nfs/dbraw/zinc/36/11/42/606361142.db2.gz LSUZMLNVYWPAGX-UHFFFAOYSA-N -1 3 373.372 3.582 20 0 FHADHM CS/C=C\C(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1 ZINC000821956371 606363055 /nfs/dbraw/zinc/36/30/55/606363055.db2.gz NEVNKYLQQHTZTJ-HJWRWDBZSA-N -1 3 371.397 3.613 20 0 FHADHM CS/C=C\C(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1 ZINC000821956371 606363056 /nfs/dbraw/zinc/36/30/56/606363056.db2.gz NEVNKYLQQHTZTJ-HJWRWDBZSA-N -1 3 371.397 3.613 20 0 FHADHM CCCC[C@@H](CCC)NC(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000821043659 606367460 /nfs/dbraw/zinc/36/74/60/606367460.db2.gz RPLUBTUINKFVBD-MRXNPFEDSA-N -1 3 361.515 3.575 20 0 FHADHM CCCC[C@@H](CCC)NC(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000821043659 606367462 /nfs/dbraw/zinc/36/74/62/606367462.db2.gz RPLUBTUINKFVBD-MRXNPFEDSA-N -1 3 361.515 3.575 20 0 FHADHM CCCN1C(=O)c2ccc(Cl)cc2N[C@H]1c1ccc(-c2nnn[n-]2)s1 ZINC000821110023 606393365 /nfs/dbraw/zinc/39/33/65/606393365.db2.gz VUAGFSCLGTURLG-OAHLLOKOSA-N -1 3 374.857 3.558 20 0 FHADHM CN(C(=O)c1cc(Cl)ccc1F)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821573222 606414974 /nfs/dbraw/zinc/41/49/74/606414974.db2.gz GJJGBNDKOPWVBE-UHFFFAOYSA-N -1 3 366.183 3.589 20 0 FHADHM CN(C(=O)c1cc(Cl)ccc1F)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821573222 606414976 /nfs/dbraw/zinc/41/49/76/606414976.db2.gz GJJGBNDKOPWVBE-UHFFFAOYSA-N -1 3 366.183 3.589 20 0 FHADHM Fc1cc(F)c(F)c(CNc2cc(Cl)ccc2-c2nnn[n-]2)c1F ZINC000822753095 606431813 /nfs/dbraw/zinc/43/18/13/606431813.db2.gz CZJWUXCTJSMNNA-UHFFFAOYSA-N -1 3 357.698 3.689 20 0 FHADHM Fc1cc(F)c(F)c(CNc2cc(Cl)ccc2-c2nn[n-]n2)c1F ZINC000822753095 606431815 /nfs/dbraw/zinc/43/18/15/606431815.db2.gz CZJWUXCTJSMNNA-UHFFFAOYSA-N -1 3 357.698 3.689 20 0 FHADHM COc1ccc(OC)c([C@H](C)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c1 ZINC000821843048 606443303 /nfs/dbraw/zinc/44/33/03/606443303.db2.gz YCQPPYGRSFTUJJ-JTQLQIEISA-N -1 3 359.817 3.710 20 0 FHADHM COc1ccc(OC)c([C@H](C)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c1 ZINC000821843048 606443304 /nfs/dbraw/zinc/44/33/04/606443304.db2.gz YCQPPYGRSFTUJJ-JTQLQIEISA-N -1 3 359.817 3.710 20 0 FHADHM C[C@H](NC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1c(F)cccc1Cl ZINC000820321941 606444310 /nfs/dbraw/zinc/44/43/10/606444310.db2.gz OMRLNNXAFBSTRI-JUDLJHIGSA-N -1 3 371.803 3.550 20 0 FHADHM C[C@H](NC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1c(F)cccc1Cl ZINC000820321941 606444312 /nfs/dbraw/zinc/44/43/12/606444312.db2.gz OMRLNNXAFBSTRI-JUDLJHIGSA-N -1 3 371.803 3.550 20 0 FHADHM FC(F)(F)c1cc(N2CCC[C@H]2c2cccnc2)ccc1-c1nnn[n-]1 ZINC000822723822 606445099 /nfs/dbraw/zinc/44/50/99/606445099.db2.gz QAAFKVUFVLBCIQ-HNNXBMFYSA-N -1 3 360.343 3.622 20 0 FHADHM FC(F)(F)c1cc(N2CCC[C@H]2c2cccnc2)ccc1-c1nn[n-]n1 ZINC000822723822 606445100 /nfs/dbraw/zinc/44/51/00/606445100.db2.gz QAAFKVUFVLBCIQ-HNNXBMFYSA-N -1 3 360.343 3.622 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)cc1CNc1cccc(OC2CCCC2)c1 ZINC000822761236 606445265 /nfs/dbraw/zinc/44/52/65/606445265.db2.gz DHGQPWBXHLTDJU-UHFFFAOYSA-N -1 3 353.401 3.939 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CNc1cccc(OC2CCCC2)c1 ZINC000822761236 606445267 /nfs/dbraw/zinc/44/52/67/606445267.db2.gz DHGQPWBXHLTDJU-UHFFFAOYSA-N -1 3 353.401 3.939 20 0 FHADHM CCC1(CNC(=O)c2cccc(Oc3ccc(-c4nnn[n-]4)cc3)c2)CC1 ZINC000820962455 606448313 /nfs/dbraw/zinc/44/83/13/606448313.db2.gz RYPWMYQPBHHYNF-UHFFFAOYSA-N -1 3 363.421 3.579 20 0 FHADHM CCC1(CNC(=O)c2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)CC1 ZINC000820962455 606448315 /nfs/dbraw/zinc/44/83/15/606448315.db2.gz RYPWMYQPBHHYNF-UHFFFAOYSA-N -1 3 363.421 3.579 20 0 FHADHM COc1ccc([C@@H](C)N(C)c2cc(-c3nnn[n-]3)c3ccccc3n2)cc1 ZINC000821777571 606450331 /nfs/dbraw/zinc/45/03/31/606450331.db2.gz IHXJKSYGVSYFNR-CYBMUJFWSA-N -1 3 360.421 3.621 20 0 FHADHM COc1ccc([C@@H](C)N(C)c2cc(-c3nn[n-]n3)c3ccccc3n2)cc1 ZINC000821777571 606450333 /nfs/dbraw/zinc/45/03/33/606450333.db2.gz IHXJKSYGVSYFNR-CYBMUJFWSA-N -1 3 360.421 3.621 20 0 FHADHM CCOCCOc1c(Cl)cccc1NCc1cccc(-c2nnn[n-]2)c1 ZINC000821384310 606452162 /nfs/dbraw/zinc/45/21/62/606452162.db2.gz UPUQDNOGBGFMMI-UHFFFAOYSA-N -1 3 373.844 3.548 20 0 FHADHM CCOCCOc1c(Cl)cccc1NCc1cccc(-c2nn[n-]n2)c1 ZINC000821384310 606452163 /nfs/dbraw/zinc/45/21/63/606452163.db2.gz UPUQDNOGBGFMMI-UHFFFAOYSA-N -1 3 373.844 3.548 20 0 FHADHM O=C(Nc1ccc(Oc2ccccc2)cc1)c1cc(-c2nnn[n-]2)cs1 ZINC000823357685 606476297 /nfs/dbraw/zinc/47/62/97/606476297.db2.gz YGLQTSGPHQSADX-UHFFFAOYSA-N -1 3 363.402 3.973 20 0 FHADHM O=C(Nc1ccc(Oc2ccccc2)cc1)c1cc(-c2nn[n-]n2)cs1 ZINC000823357685 606476298 /nfs/dbraw/zinc/47/62/98/606476298.db2.gz YGLQTSGPHQSADX-UHFFFAOYSA-N -1 3 363.402 3.973 20 0 FHADHM C[C@@H](NC(=O)c1cc(-c2nnn[n-]2)cs1)c1ccc(Cl)c(Cl)c1 ZINC000820390314 606481582 /nfs/dbraw/zinc/48/15/82/606481582.db2.gz HBFXJBGZQFFDNP-SSDOTTSWSA-N -1 3 368.249 3.726 20 0 FHADHM C[C@@H](NC(=O)c1cc(-c2nn[n-]n2)cs1)c1ccc(Cl)c(Cl)c1 ZINC000820390314 606481583 /nfs/dbraw/zinc/48/15/83/606481583.db2.gz HBFXJBGZQFFDNP-SSDOTTSWSA-N -1 3 368.249 3.726 20 0 FHADHM CC(C)[C@H](NC(=O)c1cc(-c2nnn[n-]2)cs1)c1ccc(Cl)cc1 ZINC000820027006 606486444 /nfs/dbraw/zinc/48/64/44/606486444.db2.gz PFENAWGWXUFXIV-AWEZNQCLSA-N -1 3 361.858 3.709 20 0 FHADHM CC(C)[C@H](NC(=O)c1cc(-c2nn[n-]n2)cs1)c1ccc(Cl)cc1 ZINC000820027006 606486446 /nfs/dbraw/zinc/48/64/46/606486446.db2.gz PFENAWGWXUFXIV-AWEZNQCLSA-N -1 3 361.858 3.709 20 0 FHADHM Cc1cc(C)c(C(=O)N(Cc2ccco2)c2ccccc2-c2nnn[n-]2)o1 ZINC000822193321 606507068 /nfs/dbraw/zinc/50/70/68/606507068.db2.gz SJVIMLHZFAUOGJ-UHFFFAOYSA-N -1 3 363.377 3.517 20 0 FHADHM Cc1cc(C)c(C(=O)N(Cc2ccco2)c2ccccc2-c2nn[n-]n2)o1 ZINC000822193321 606507070 /nfs/dbraw/zinc/50/70/70/606507070.db2.gz SJVIMLHZFAUOGJ-UHFFFAOYSA-N -1 3 363.377 3.517 20 0 FHADHM O=C(N[C@@H](c1ccc(Cl)cc1)C1CCC1)c1cc(-c2nnn[n-]2)cs1 ZINC000823139503 606508109 /nfs/dbraw/zinc/50/81/09/606508109.db2.gz GNGXBDVSVINTNH-OAHLLOKOSA-N -1 3 373.869 3.853 20 0 FHADHM O=C(N[C@@H](c1ccc(Cl)cc1)C1CCC1)c1cc(-c2nn[n-]n2)cs1 ZINC000823139503 606508111 /nfs/dbraw/zinc/50/81/11/606508111.db2.gz GNGXBDVSVINTNH-OAHLLOKOSA-N -1 3 373.869 3.853 20 0 FHADHM C[C@@H](NC(=O)c1cc(-c2nnn[n-]2)cs1)c1csc2ccccc21 ZINC000820390554 606508913 /nfs/dbraw/zinc/50/89/13/606508913.db2.gz IJMLLJCXNXARSK-SECBINFHSA-N -1 3 355.448 3.634 20 0 FHADHM C[C@@H](NC(=O)c1cc(-c2nn[n-]n2)cs1)c1csc2ccccc21 ZINC000820390554 606508915 /nfs/dbraw/zinc/50/89/15/606508915.db2.gz IJMLLJCXNXARSK-SECBINFHSA-N -1 3 355.448 3.634 20 0 FHADHM CC(C)(C)C[C@H](NC(=O)Cc1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000819906094 606509215 /nfs/dbraw/zinc/50/92/15/606509215.db2.gz CMTLJOWPWKASIR-SFHVURJKSA-N -1 3 363.465 3.703 20 0 FHADHM CC(C)(C)C[C@H](NC(=O)Cc1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000819906094 606509216 /nfs/dbraw/zinc/50/92/16/606509216.db2.gz CMTLJOWPWKASIR-SFHVURJKSA-N -1 3 363.465 3.703 20 0 FHADHM Cc1ccc([C@H]2CCC[C@H]2N(C)C(=O)c2cc(-c3nnn[n-]3)cs2)cc1 ZINC000822232944 606519839 /nfs/dbraw/zinc/51/98/39/606519839.db2.gz FDQNKUKHWREQDW-HZPDHXFCSA-N -1 3 367.478 3.645 20 0 FHADHM Cc1ccc([C@H]2CCC[C@H]2N(C)C(=O)c2cc(-c3nn[n-]n3)cs2)cc1 ZINC000822232944 606519840 /nfs/dbraw/zinc/51/98/40/606519840.db2.gz FDQNKUKHWREQDW-HZPDHXFCSA-N -1 3 367.478 3.645 20 0 FHADHM C[C@@H](NC(=O)Cc1cccc(-c2nnn[n-]2)c1)c1cc2ccccc2s1 ZINC000820334176 606555037 /nfs/dbraw/zinc/55/50/37/606555037.db2.gz KJKCXFBBPPNDEI-GFCCVEGCSA-N -1 3 363.446 3.501 20 0 FHADHM C[C@@H](NC(=O)Cc1cccc(-c2nn[n-]n2)c1)c1cc2ccccc2s1 ZINC000820334176 606555038 /nfs/dbraw/zinc/55/50/38/606555038.db2.gz KJKCXFBBPPNDEI-GFCCVEGCSA-N -1 3 363.446 3.501 20 0 FHADHM COc1ccccc1SCc1ccc(-c2nnn[n-]2)cc1OC(F)F ZINC000821903462 606591220 /nfs/dbraw/zinc/59/12/20/606591220.db2.gz GSSNNHJWOKHRDP-UHFFFAOYSA-N -1 3 364.377 3.769 20 0 FHADHM COc1ccccc1SCc1ccc(-c2nn[n-]n2)cc1OC(F)F ZINC000821903462 606591222 /nfs/dbraw/zinc/59/12/22/606591222.db2.gz GSSNNHJWOKHRDP-UHFFFAOYSA-N -1 3 364.377 3.769 20 0 FHADHM FC(F)Oc1cc(-c2nnn[n-]2)ccc1COc1cccc2ncccc21 ZINC000822733308 606595377 /nfs/dbraw/zinc/59/53/77/606595377.db2.gz XEDYGGKCTLDZSU-UHFFFAOYSA-N -1 3 369.331 3.595 20 0 FHADHM FC(F)Oc1cc(-c2nn[n-]n2)ccc1COc1cccc2ncccc21 ZINC000822733308 606595379 /nfs/dbraw/zinc/59/53/79/606595379.db2.gz XEDYGGKCTLDZSU-UHFFFAOYSA-N -1 3 369.331 3.595 20 0 FHADHM c1sc(CCc2ccccc2)nc1COc1ccccc1-c1nnn[n-]1 ZINC000823780206 606601668 /nfs/dbraw/zinc/60/16/68/606601668.db2.gz PXYLTRXORBLUIP-UHFFFAOYSA-N -1 3 363.446 3.687 20 0 FHADHM c1sc(CCc2ccccc2)nc1COc1ccccc1-c1nn[n-]n1 ZINC000823780206 606601669 /nfs/dbraw/zinc/60/16/69/606601669.db2.gz PXYLTRXORBLUIP-UHFFFAOYSA-N -1 3 363.446 3.687 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)C[C@H](C)c2cccc(OC)c2)s1 ZINC000821465419 606601987 /nfs/dbraw/zinc/60/19/87/606601987.db2.gz GLHWLJSDUUSVNP-NSHDSACASA-N -1 3 371.466 3.632 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)C[C@H](C)c2cccc(OC)c2)s1 ZINC000821465419 606601989 /nfs/dbraw/zinc/60/19/89/606601989.db2.gz GLHWLJSDUUSVNP-NSHDSACASA-N -1 3 371.466 3.632 20 0 FHADHM C[C@H](C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccc(Cl)s1 ZINC000820315578 606625807 /nfs/dbraw/zinc/62/58/07/606625807.db2.gz OMKCREZDWKVRDM-UWVGGRQHSA-N -1 3 361.858 3.563 20 0 FHADHM C[C@H](C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccc(Cl)s1 ZINC000820315578 606625808 /nfs/dbraw/zinc/62/58/08/606625808.db2.gz OMKCREZDWKVRDM-UWVGGRQHSA-N -1 3 361.858 3.563 20 0 FHADHM Cc1cccc(Cl)c1NC(=O)[C@H](C)Sc1ccc(-c2nnn[n-]2)cc1 ZINC000822304352 606639703 /nfs/dbraw/zinc/63/97/03/606639703.db2.gz UMHKALKDTGJFMH-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM Cc1cccc(Cl)c1NC(=O)[C@H](C)Sc1ccc(-c2nn[n-]n2)cc1 ZINC000822304352 606639704 /nfs/dbraw/zinc/63/97/04/606639704.db2.gz UMHKALKDTGJFMH-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM O=C(Oc1ccc(Cl)c(Cl)c1)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000823453863 606663421 /nfs/dbraw/zinc/66/34/21/606663421.db2.gz CJEOJBGAVZMJSV-UHFFFAOYSA-N -1 3 371.130 3.671 20 0 FHADHM O=C(Oc1ccc(Cl)c(Cl)c1)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000823453863 606663422 /nfs/dbraw/zinc/66/34/22/606663422.db2.gz CJEOJBGAVZMJSV-UHFFFAOYSA-N -1 3 371.130 3.671 20 0 FHADHM CCN(C(=O)CCO[C@H](C)CC(C)C)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821153856 606670541 /nfs/dbraw/zinc/67/05/41/606670541.db2.gz FTEZEZBHNDNINK-CVEARBPZSA-N -1 3 373.501 3.618 20 0 FHADHM CCN(C(=O)CCO[C@H](C)CC(C)C)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821153856 606670542 /nfs/dbraw/zinc/67/05/42/606670542.db2.gz FTEZEZBHNDNINK-CVEARBPZSA-N -1 3 373.501 3.618 20 0 FHADHM CCCCC1CCC(NC(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)CC1 ZINC000821042401 606673418 /nfs/dbraw/zinc/67/34/18/606673418.db2.gz ANHVQMXQSAPAJG-UHFFFAOYSA-N -1 3 363.412 3.624 20 0 FHADHM CCCCC1CCC(NC(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)CC1 ZINC000821042401 606673419 /nfs/dbraw/zinc/67/34/19/606673419.db2.gz ANHVQMXQSAPAJG-UHFFFAOYSA-N -1 3 363.412 3.624 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)Nc2cc(-c3nnn[n-]3)ccc2C)cc1F ZINC000822228954 606696738 /nfs/dbraw/zinc/69/67/38/606696738.db2.gz JKGGIIXRDSRFLU-LBPRGKRZSA-N -1 3 354.389 3.505 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)Nc2cc(-c3nn[n-]n3)ccc2C)cc1F ZINC000822228954 606696739 /nfs/dbraw/zinc/69/67/39/606696739.db2.gz JKGGIIXRDSRFLU-LBPRGKRZSA-N -1 3 354.389 3.505 20 0 FHADHM COCC[C@@H](C)Sc1nc2c(c(-c3ccco3)c1-c1nnn[n-]1)CCC2 ZINC000821685504 606704171 /nfs/dbraw/zinc/70/41/71/606704171.db2.gz GGPMZTUOADVHRA-LLVKDONJSA-N -1 3 371.466 3.528 20 0 FHADHM C[C@@H](Nc1c(F)cc(-c2nnn[n-]2)cc1F)c1cccc(N2CCCC2)c1 ZINC000820450430 606732815 /nfs/dbraw/zinc/73/28/15/606732815.db2.gz KMRQYYRHAGIYTL-GFCCVEGCSA-N -1 3 370.407 3.918 20 0 FHADHM C[C@@H](Nc1c(F)cc(-c2nn[n-]n2)cc1F)c1cccc(N2CCCC2)c1 ZINC000820450430 606732817 /nfs/dbraw/zinc/73/28/17/606732817.db2.gz KMRQYYRHAGIYTL-GFCCVEGCSA-N -1 3 370.407 3.918 20 0 FHADHM CC1(C(=O)Nc2ccc(Oc3ccccc3-c3nnn[n-]3)c(F)c2)CC1 ZINC000820577016 606734074 /nfs/dbraw/zinc/73/40/74/606734074.db2.gz GVIQBQAIVCVVJK-UHFFFAOYSA-N -1 3 353.357 3.537 20 0 FHADHM CC1(C(=O)Nc2ccc(Oc3ccccc3-c3nn[n-]n3)c(F)c2)CC1 ZINC000820577016 606734076 /nfs/dbraw/zinc/73/40/76/606734076.db2.gz GVIQBQAIVCVVJK-UHFFFAOYSA-N -1 3 353.357 3.537 20 0 FHADHM Fc1cccc([C@@H](NCc2ccc(-c3nnn[n-]3)s2)c2ccccc2)c1 ZINC000822787081 606734372 /nfs/dbraw/zinc/73/43/72/606734372.db2.gz UUMKZHXSYAKNBT-SFHVURJKSA-N -1 3 365.437 3.947 20 0 FHADHM CCc1oc(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)cc1C ZINC000821559053 606735149 /nfs/dbraw/zinc/73/51/49/606735149.db2.gz QQIKWAISYUSGAO-UHFFFAOYSA-N -1 3 365.315 3.602 20 0 FHADHM CCc1oc(C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)cc1C ZINC000821559053 606735150 /nfs/dbraw/zinc/73/51/50/606735150.db2.gz QQIKWAISYUSGAO-UHFFFAOYSA-N -1 3 365.315 3.602 20 0 FHADHM Cc1c(NC(=O)c2sccc2-c2nnn[n-]2)cccc1C(F)(F)F ZINC000822116084 606739382 /nfs/dbraw/zinc/73/93/82/606739382.db2.gz NCBIJVQXRSKZIH-UHFFFAOYSA-N -1 3 353.329 3.508 20 0 FHADHM Cc1c(NC(=O)c2sccc2-c2nn[n-]n2)cccc1C(F)(F)F ZINC000822116084 606739383 /nfs/dbraw/zinc/73/93/83/606739383.db2.gz NCBIJVQXRSKZIH-UHFFFAOYSA-N -1 3 353.329 3.508 20 0 FHADHM CC(C)C[C@H](OC(=O)CCc1ccc(-c2nnn[n-]2)cc1)c1ccccn1 ZINC000820063657 606763804 /nfs/dbraw/zinc/76/38/04/606763804.db2.gz YELQBKPJLFVYBI-SFHVURJKSA-N -1 3 365.437 3.525 20 0 FHADHM CC(C)C[C@H](OC(=O)CCc1ccc(-c2nn[n-]n2)cc1)c1ccccn1 ZINC000820063657 606763806 /nfs/dbraw/zinc/76/38/06/606763806.db2.gz YELQBKPJLFVYBI-SFHVURJKSA-N -1 3 365.437 3.525 20 0 FHADHM CC(C)C[C@H](OC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1ccccn1 ZINC000820062167 606763886 /nfs/dbraw/zinc/76/38/86/606763886.db2.gz IMANUKQMIOJHJT-LENZSSGSSA-N -1 3 363.421 3.606 20 0 FHADHM CC(C)C[C@H](OC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1ccccn1 ZINC000820062167 606763888 /nfs/dbraw/zinc/76/38/88/606763888.db2.gz IMANUKQMIOJHJT-LENZSSGSSA-N -1 3 363.421 3.606 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CCCC[C@@H]1CCC(C)C ZINC000822217361 606770914 /nfs/dbraw/zinc/77/09/14/606770914.db2.gz BZZKAYQQAFLYKP-MRXNPFEDSA-N -1 3 356.474 3.998 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CCCC[C@@H]1CCC(C)C ZINC000822217361 606770915 /nfs/dbraw/zinc/77/09/15/606770915.db2.gz BZZKAYQQAFLYKP-MRXNPFEDSA-N -1 3 356.474 3.998 20 0 FHADHM CC(C)Sc1ccccc1NC(=O)NCc1cccc(-c2nnn[n-]2)c1 ZINC000820183494 606771537 /nfs/dbraw/zinc/77/15/37/606771537.db2.gz FYQJKWLLNPRADC-UHFFFAOYSA-N -1 3 368.466 3.689 20 0 FHADHM CC(C)Sc1ccccc1NC(=O)NCc1cccc(-c2nn[n-]n2)c1 ZINC000820183494 606771538 /nfs/dbraw/zinc/77/15/38/606771538.db2.gz FYQJKWLLNPRADC-UHFFFAOYSA-N -1 3 368.466 3.689 20 0 FHADHM Fc1cccc(-c2cnc(COc3cc(Cl)ccc3-c3nnn[n-]3)o2)c1 ZINC000822786784 606779247 /nfs/dbraw/zinc/77/92/47/606779247.db2.gz PNUVPRZLXCOFCW-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM Fc1cccc(-c2cnc(COc3cc(Cl)ccc3-c3nn[n-]n3)o2)c1 ZINC000822786784 606779251 /nfs/dbraw/zinc/77/92/51/606779251.db2.gz PNUVPRZLXCOFCW-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM CCCC[C@@H](NC(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1)C1CCC1 ZINC000821043141 606789568 /nfs/dbraw/zinc/78/95/68/606789568.db2.gz LXCSDHLVYWORST-CXAGYDPISA-N -1 3 356.474 3.586 20 0 FHADHM CCCC[C@@H](NC(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1)C1CCC1 ZINC000821043141 606789570 /nfs/dbraw/zinc/78/95/70/606789570.db2.gz LXCSDHLVYWORST-CXAGYDPISA-N -1 3 356.474 3.586 20 0 FHADHM CC(C)CN(CC(C)(C)C)C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820081513 606810930 /nfs/dbraw/zinc/81/09/30/606810930.db2.gz JTODKYITMIMPTH-AWEZNQCLSA-N -1 3 358.490 3.641 20 0 FHADHM CC(C)CN(CC(C)(C)C)C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820081513 606810932 /nfs/dbraw/zinc/81/09/32/606810932.db2.gz JTODKYITMIMPTH-AWEZNQCLSA-N -1 3 358.490 3.641 20 0 FHADHM CC(C)c1ccc(N(C)C(=S)Nc2ccccc2-c2nnn[n-]2)cc1 ZINC000820192519 606835546 /nfs/dbraw/zinc/83/55/46/606835546.db2.gz RGLRLXSWWZEJNQ-UHFFFAOYSA-N -1 3 352.467 3.823 20 0 FHADHM CC(C)c1ccc(N(C)C(=S)Nc2ccccc2-c2nn[n-]n2)cc1 ZINC000820192519 606835548 /nfs/dbraw/zinc/83/55/48/606835548.db2.gz RGLRLXSWWZEJNQ-UHFFFAOYSA-N -1 3 352.467 3.823 20 0 FHADHM Cc1ccc(-c2cncc(C(=O)N(C)c3cccc(-c4nnn[n-]4)c3)c2)cc1 ZINC000822214237 606862977 /nfs/dbraw/zinc/86/29/77/606862977.db2.gz VRHJOJNKDNBUSC-UHFFFAOYSA-N -1 3 370.416 3.514 20 0 FHADHM Cc1ccc(-c2cncc(C(=O)N(C)c3cccc(-c4nn[n-]n4)c3)c2)cc1 ZINC000822214237 606862978 /nfs/dbraw/zinc/86/29/78/606862978.db2.gz VRHJOJNKDNBUSC-UHFFFAOYSA-N -1 3 370.416 3.514 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NCc1ccn(C2CCCC2)n1 ZINC000820155562 606863357 /nfs/dbraw/zinc/86/33/57/606863357.db2.gz RXTAEKVUJKREOS-UHFFFAOYSA-N -1 3 367.457 3.578 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NCc1ccn(C2CCCC2)n1 ZINC000820155562 606863358 /nfs/dbraw/zinc/86/33/58/606863358.db2.gz RXTAEKVUJKREOS-UHFFFAOYSA-N -1 3 367.457 3.578 20 0 FHADHM CC(C)C[C@@H]1CCCCN1C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820063230 606870470 /nfs/dbraw/zinc/87/04/70/606870470.db2.gz UMSKVGLMVCVJFM-YOEHRIQHSA-N -1 3 356.474 3.538 20 0 FHADHM CC(C)C[C@@H]1CCCCN1C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820063230 606870472 /nfs/dbraw/zinc/87/04/72/606870472.db2.gz UMSKVGLMVCVJFM-YOEHRIQHSA-N -1 3 356.474 3.538 20 0 FHADHM Cc1cc(C(F)(F)F)c(-c2nnn[n-]2)c(S[C@@H](C)C(F)(F)F)n1 ZINC000822191927 606902617 /nfs/dbraw/zinc/90/26/17/606902617.db2.gz UVTIREWWZTVVTJ-YFKPBYRVSA-N -1 3 357.283 3.632 20 0 FHADHM CC(C)(C)NC(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000819921865 606907145 /nfs/dbraw/zinc/90/71/45/606907145.db2.gz CDFGARUFMFFNBR-UHFFFAOYSA-N -1 3 352.398 3.579 20 0 FHADHM CC(C)(C)NC(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000819921865 606907147 /nfs/dbraw/zinc/90/71/47/606907147.db2.gz CDFGARUFMFFNBR-UHFFFAOYSA-N -1 3 352.398 3.579 20 0 FHADHM Fc1ccc(CNc2ccc(OCC(F)(F)F)cc2)cc1-c1nnn[n-]1 ZINC000822771410 606928004 /nfs/dbraw/zinc/92/80/04/606928004.db2.gz HEDAWWFJYQADGI-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM Fc1ccc(CNc2ccc(OCC(F)(F)F)cc2)cc1-c1nn[n-]n1 ZINC000822771410 606928005 /nfs/dbraw/zinc/92/80/05/606928005.db2.gz HEDAWWFJYQADGI-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM Fc1ccc(CNc2ccc(F)c(C(F)(F)F)c2)cc1-c1nnn[n-]1 ZINC000822771997 606929950 /nfs/dbraw/zinc/92/99/50/606929950.db2.gz OEDSBWZANRPHKI-UHFFFAOYSA-N -1 3 355.270 3.776 20 0 FHADHM Fc1ccc(CNc2ccc(F)c(C(F)(F)F)c2)cc1-c1nn[n-]n1 ZINC000822771997 606929952 /nfs/dbraw/zinc/92/99/52/606929952.db2.gz OEDSBWZANRPHKI-UHFFFAOYSA-N -1 3 355.270 3.776 20 0 FHADHM CCc1nnc(S[C@H](C)c2ccccc2OC)c(-c2nnn[n-]2)c1CC ZINC000821548704 606938905 /nfs/dbraw/zinc/93/89/05/606938905.db2.gz UQPUFSFIEUARHX-LLVKDONJSA-N -1 3 370.482 3.643 20 0 FHADHM CCc1nnc(S[C@H](C)c2ccccc2OC)c(-c2nn[n-]n2)c1CC ZINC000821548704 606938906 /nfs/dbraw/zinc/93/89/06/606938906.db2.gz UQPUFSFIEUARHX-LLVKDONJSA-N -1 3 370.482 3.643 20 0 FHADHM COc1ccc(CNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)c(F)c1 ZINC000821821216 606946919 /nfs/dbraw/zinc/94/69/19/606946919.db2.gz BXLWYJNVXVDYOJ-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM COc1ccc(CNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)c(F)c1 ZINC000821821216 606946921 /nfs/dbraw/zinc/94/69/21/606946921.db2.gz BXLWYJNVXVDYOJ-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM Cc1sc(NC(=O)c2cccc(Cl)c2F)c(-c2nnn[n-]2)c1C ZINC000822562664 606956046 /nfs/dbraw/zinc/95/60/46/606956046.db2.gz CVQJQNFGAHGOGS-UHFFFAOYSA-N -1 3 351.794 3.590 20 0 FHADHM Cc1sc(NC(=O)c2cccc(Cl)c2F)c(-c2nn[n-]n2)c1C ZINC000822562664 606956048 /nfs/dbraw/zinc/95/60/48/606956048.db2.gz CVQJQNFGAHGOGS-UHFFFAOYSA-N -1 3 351.794 3.590 20 0 FHADHM CN(C(=O)c1cccc(C(F)F)c1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821574612 606961501 /nfs/dbraw/zinc/96/15/01/606961501.db2.gz OOIIKDVHHQFWNG-UHFFFAOYSA-N -1 3 363.755 3.734 20 0 FHADHM CN(C(=O)c1cccc(C(F)F)c1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821574612 606961503 /nfs/dbraw/zinc/96/15/03/606961503.db2.gz OOIIKDVHHQFWNG-UHFFFAOYSA-N -1 3 363.755 3.734 20 0 FHADHM Cc1ccc(/C=C\CC(=O)N(C)c2cc(Cl)ccc2-c2nnn[n-]2)cc1 ZINC000822233425 606965688 /nfs/dbraw/zinc/96/56/88/606965688.db2.gz OQTPALWOCDHGHK-ARJAWSKDSA-N -1 3 367.840 3.895 20 0 FHADHM Cc1ccc(/C=C\CC(=O)N(C)c2cc(Cl)ccc2-c2nn[n-]n2)cc1 ZINC000822233425 606965690 /nfs/dbraw/zinc/96/56/90/606965690.db2.gz OQTPALWOCDHGHK-ARJAWSKDSA-N -1 3 367.840 3.895 20 0 FHADHM Cc1ccccc1[C@@H](C)SCC(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000822344887 606989556 /nfs/dbraw/zinc/98/95/56/606989556.db2.gz CMKKBJJEHMKINW-CYBMUJFWSA-N -1 3 353.451 3.608 20 0 FHADHM Cc1ccccc1[C@@H](C)SCC(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000822344887 606989557 /nfs/dbraw/zinc/98/95/57/606989557.db2.gz CMKKBJJEHMKINW-CYBMUJFWSA-N -1 3 353.451 3.608 20 0 FHADHM Fc1ccc(CSc2nc(-c3ccccc3)c[nH]2)cc1-c1nnn[n-]1 ZINC000822775279 607009295 /nfs/dbraw/zinc/00/92/95/607009295.db2.gz UFYLEYHSDCYYCD-UHFFFAOYSA-N -1 3 352.398 3.688 20 0 FHADHM Fc1ccc(CSc2nc(-c3ccccc3)c[nH]2)cc1-c1nn[n-]n1 ZINC000822775279 607009297 /nfs/dbraw/zinc/00/92/97/607009297.db2.gz UFYLEYHSDCYYCD-UHFFFAOYSA-N -1 3 352.398 3.688 20 0 FHADHM CC(C)[C@H](Sc1cccc(-c2nnn[n-]2)c1)C(=O)N(C)c1ccccc1 ZINC000820033861 607011856 /nfs/dbraw/zinc/01/18/56/607011856.db2.gz ZATXGEWTXWBOBU-KRWDZBQOSA-N -1 3 367.478 3.646 20 0 FHADHM CC(C)[C@H](Sc1cccc(-c2nn[n-]n2)c1)C(=O)N(C)c1ccccc1 ZINC000820033861 607011857 /nfs/dbraw/zinc/01/18/57/607011857.db2.gz ZATXGEWTXWBOBU-KRWDZBQOSA-N -1 3 367.478 3.646 20 0 FHADHM COC(=O)[C@H](Sc1cccc(-c2nnn[n-]2)c1)c1cccc(Cl)c1 ZINC000821650311 607014860 /nfs/dbraw/zinc/01/48/60/607014860.db2.gz OQBAPDCXPHEMJC-CQSZACIVSA-N -1 3 360.826 3.527 20 0 FHADHM COC(=O)[C@H](Sc1cccc(-c2nn[n-]n2)c1)c1cccc(Cl)c1 ZINC000821650311 607014861 /nfs/dbraw/zinc/01/48/61/607014861.db2.gz OQBAPDCXPHEMJC-CQSZACIVSA-N -1 3 360.826 3.527 20 0 FHADHM CC=C(C=CC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)CC(C)C)CC ZINC000820827695 607015258 /nfs/dbraw/zinc/01/52/58/607015258.db2.gz WAQOOKPKEHGXFV-IJBGFTGUSA-N -1 3 353.470 3.764 20 0 FHADHM CC=C(C=CC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)CC(C)C)CC ZINC000820827695 607015260 /nfs/dbraw/zinc/01/52/60/607015260.db2.gz WAQOOKPKEHGXFV-IJBGFTGUSA-N -1 3 353.470 3.764 20 0 FHADHM Cc1ccc(CSCCC(=O)Nc2ccccc2-c2nnn[n-]2)cc1C ZINC000822239732 607017712 /nfs/dbraw/zinc/01/77/12/607017712.db2.gz BQHCVKHBTWBJGQ-UHFFFAOYSA-N -1 3 367.478 3.746 20 0 FHADHM Cc1ccc(CSCCC(=O)Nc2ccccc2-c2nn[n-]n2)cc1C ZINC000822239732 607017713 /nfs/dbraw/zinc/01/77/13/607017713.db2.gz BQHCVKHBTWBJGQ-UHFFFAOYSA-N -1 3 367.478 3.746 20 0 FHADHM COc1ccc(CNc2nc3ccccc3cc2-c2nnn[n-]2)cc1Cl ZINC000821824515 607038599 /nfs/dbraw/zinc/03/85/99/607038599.db2.gz LDBZUDPKOJBWLE-UHFFFAOYSA-N -1 3 366.812 3.689 20 0 FHADHM COc1ccc(CNc2nc3ccccc3cc2-c2nn[n-]n2)cc1Cl ZINC000821824515 607038600 /nfs/dbraw/zinc/03/86/00/607038600.db2.gz LDBZUDPKOJBWLE-UHFFFAOYSA-N -1 3 366.812 3.689 20 0 FHADHM C[C@H](c1nc2ccccc2s1)N(C)Cc1cc(F)ccc1-c1nn[n-]n1 ZINC000820570583 607055987 /nfs/dbraw/zinc/05/59/87/607055987.db2.gz NEWNFUCRMUUWRA-LLVKDONJSA-N -1 3 368.441 3.809 20 0 FHADHM C[C@H](NC(=O)N(C1CC1)C1CCC(C)CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820690026 607065168 /nfs/dbraw/zinc/06/51/68/607065168.db2.gz FPFSHVDQOYDGRQ-UUCFBXCCSA-N -1 3 368.485 3.680 20 0 FHADHM C[C@H](NC(=O)N(C1CC1)C1CCC(C)CC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820690026 607065170 /nfs/dbraw/zinc/06/51/70/607065170.db2.gz FPFSHVDQOYDGRQ-UUCFBXCCSA-N -1 3 368.485 3.680 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NC(=O)C[C@@H](C)c1ccc(F)cc1 ZINC000821292858 607101568 /nfs/dbraw/zinc/10/15/68/607101568.db2.gz FPLDAMHAJAVGET-GFCCVEGCSA-N -1 3 368.416 3.570 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cc(SC)ccc1C ZINC000821304645 607102154 /nfs/dbraw/zinc/10/21/54/607102154.db2.gz PLKSFDLNYSHWJZ-UHFFFAOYSA-N -1 3 368.466 3.581 20 0 FHADHM C[C@H]1CN(c2c(Cl)cccc2-c2nnn[n-]2)C[C@@H](c2ccsc2)O1 ZINC000820768742 607116108 /nfs/dbraw/zinc/11/61/08/607116108.db2.gz PBYVUYMOBVOBTI-HZMBPMFUSA-N -1 3 361.858 3.548 20 0 FHADHM C[C@H]1CN(c2c(Cl)cccc2-c2nn[n-]n2)C[C@@H](c2ccsc2)O1 ZINC000820768742 607116110 /nfs/dbraw/zinc/11/61/10/607116110.db2.gz PBYVUYMOBVOBTI-HZMBPMFUSA-N -1 3 361.858 3.548 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(N2CCC3(CC2)OCc2ccccc23)c1 ZINC000822567935 607119440 /nfs/dbraw/zinc/11/94/40/607119440.db2.gz JBCYWVYJXZBQSO-UHFFFAOYSA-N -1 3 367.840 3.546 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(N2CCC3(CC2)OCc2ccccc23)c1 ZINC000822567935 607119442 /nfs/dbraw/zinc/11/94/42/607119442.db2.gz JBCYWVYJXZBQSO-UHFFFAOYSA-N -1 3 367.840 3.546 20 0 FHADHM Clc1cc(-c2nn[n-]n2)ccc1NCc1coc(-c2cccs2)n1 ZINC000822564194 607126224 /nfs/dbraw/zinc/12/62/24/607126224.db2.gz VYVARGUVPOKUIY-UHFFFAOYSA-N -1 3 358.814 3.849 20 0 FHADHM FC(F)(F)c1cc(N[C@H]2CCOC3(CCCC3)C2)ccc1-c1nnn[n-]1 ZINC000822723973 607130160 /nfs/dbraw/zinc/13/01/60/607130160.db2.gz VCWQZHHGANECKR-LBPRGKRZSA-N -1 3 367.375 3.789 20 0 FHADHM FC(F)(F)c1cc(N[C@H]2CCOC3(CCCC3)C2)ccc1-c1nn[n-]n1 ZINC000822723973 607130161 /nfs/dbraw/zinc/13/01/61/607130161.db2.gz VCWQZHHGANECKR-LBPRGKRZSA-N -1 3 367.375 3.789 20 0 FHADHM FC(F)(F)c1ccc2oc(COc3cccc(-c4nnn[n-]4)c3)nc2c1 ZINC000822728401 607145988 /nfs/dbraw/zinc/14/59/88/607145988.db2.gz IFHSIXNMTIBMKO-UHFFFAOYSA-N -1 3 361.283 3.606 20 0 FHADHM FC(F)(F)c1ccc2oc(COc3cccc(-c4nn[n-]n4)c3)nc2c1 ZINC000822728401 607145989 /nfs/dbraw/zinc/14/59/89/607145989.db2.gz IFHSIXNMTIBMKO-UHFFFAOYSA-N -1 3 361.283 3.606 20 0 FHADHM CCc1oc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CC[C@@H](C)C3)cc1C ZINC000821559116 607150863 /nfs/dbraw/zinc/15/08/63/607150863.db2.gz UKOMJNPEUWGSEF-SECBINFHSA-N -1 3 371.466 3.769 20 0 FHADHM CCc1oc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CC[C@@H](C)C3)cc1C ZINC000821559116 607150864 /nfs/dbraw/zinc/15/08/64/607150864.db2.gz UKOMJNPEUWGSEF-SECBINFHSA-N -1 3 371.466 3.769 20 0 FHADHM Cc1ccccc1-c1nc(CSc2ccc(-c3nnn[n-]3)cc2)no1 ZINC000822346003 607157950 /nfs/dbraw/zinc/15/79/50/607157950.db2.gz ZGVXQMDNCRBCRW-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM Cc1ccccc1-c1nc(CSc2ccc(-c3nn[n-]n3)cc2)no1 ZINC000822346003 607157952 /nfs/dbraw/zinc/15/79/52/607157952.db2.gz ZGVXQMDNCRBCRW-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM CC(C)c1ccc(NCc2nnc(-c3ccc(-c4nnn[n-]4)cc3)o2)cc1 ZINC000820192487 607166840 /nfs/dbraw/zinc/16/68/40/607166840.db2.gz QDMZGORMTVUGHY-UHFFFAOYSA-N -1 3 361.409 3.652 20 0 FHADHM CC(C)c1ccc(NCc2nnc(-c3ccc(-c4nn[n-]n4)cc3)o2)cc1 ZINC000820192487 607166842 /nfs/dbraw/zinc/16/68/42/607166842.db2.gz QDMZGORMTVUGHY-UHFFFAOYSA-N -1 3 361.409 3.652 20 0 FHADHM Cc1c2ccccc2sc1C(=O)COc1ccc(-c2nnn[n-]2)cc1F ZINC000822015075 607171476 /nfs/dbraw/zinc/17/14/76/607171476.db2.gz BVQFJVZLRHABMK-UHFFFAOYSA-N -1 3 368.393 3.791 20 0 FHADHM Cc1c2ccccc2sc1C(=O)COc1ccc(-c2nn[n-]n2)cc1F ZINC000822015075 607171477 /nfs/dbraw/zinc/17/14/77/607171477.db2.gz BVQFJVZLRHABMK-UHFFFAOYSA-N -1 3 368.393 3.791 20 0 FHADHM Cc1csc([C@@H](C)Nc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)n1 ZINC000822409694 607173172 /nfs/dbraw/zinc/17/31/72/607173172.db2.gz UPCGMLNOGXTMFC-MRVPVSSYSA-N -1 3 354.361 3.824 20 0 FHADHM Cc1csc([C@@H](C)Nc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)n1 ZINC000822409694 607173173 /nfs/dbraw/zinc/17/31/73/607173173.db2.gz UPCGMLNOGXTMFC-MRVPVSSYSA-N -1 3 354.361 3.824 20 0 FHADHM CC1(C)[C@H](Nc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)[C@@H]2CCCO[C@@H]21 ZINC000820586491 607173586 /nfs/dbraw/zinc/17/35/86/607173586.db2.gz WQVBBLVJSMOONR-GDLCADMTSA-N -1 3 367.375 3.501 20 0 FHADHM CC1(C)[C@H](Nc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)[C@@H]2CCCO[C@@H]21 ZINC000820586491 607173587 /nfs/dbraw/zinc/17/35/87/607173587.db2.gz WQVBBLVJSMOONR-GDLCADMTSA-N -1 3 367.375 3.501 20 0 FHADHM COC[C@@H](Nc1ccc(C(F)(F)F)cc1-c1nnn[n-]1)c1ccc(C)o1 ZINC000821684115 607173634 /nfs/dbraw/zinc/17/36/34/607173634.db2.gz SBYMIVXOHNNXMC-CYBMUJFWSA-N -1 3 367.331 3.587 20 0 FHADHM COC[C@@H](Nc1ccc(C(F)(F)F)cc1-c1nn[n-]n1)c1ccc(C)o1 ZINC000821684115 607173635 /nfs/dbraw/zinc/17/36/35/607173635.db2.gz SBYMIVXOHNNXMC-CYBMUJFWSA-N -1 3 367.331 3.587 20 0 FHADHM c1cc(N2CCC[C@H](c3nc4c(s3)CCCC4)C2)ccc1-c1nn[n-]n1 ZINC000823757059 607175293 /nfs/dbraw/zinc/17/52/93/607175293.db2.gz KLKQCUXQZPFHAW-AWEZNQCLSA-N -1 3 366.494 3.586 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nnn[n-]2)c1)c1ccc(F)c(Cl)c1 ZINC000823333125 607177967 /nfs/dbraw/zinc/17/79/67/607177967.db2.gz XWUYBUBLKFXDRN-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nn[n-]n2)c1)c1ccc(F)c(Cl)c1 ZINC000823333125 607177968 /nfs/dbraw/zinc/17/79/68/607177968.db2.gz XWUYBUBLKFXDRN-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM C[C@@H](CC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccc(F)cc1 ZINC000820226592 607189708 /nfs/dbraw/zinc/18/97/08/607189708.db2.gz VWTCTIMPGTYVTR-JTQLQIEISA-N -1 3 359.792 3.792 20 0 FHADHM C[C@@H](CC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccc(F)cc1 ZINC000820226592 607189709 /nfs/dbraw/zinc/18/97/09/607189709.db2.gz VWTCTIMPGTYVTR-JTQLQIEISA-N -1 3 359.792 3.792 20 0 FHADHM C[C@@H](CCOc1ccccc1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820249756 607189864 /nfs/dbraw/zinc/18/98/64/607189864.db2.gz ZIPINZOMEDLXBH-LBPRGKRZSA-N -1 3 371.828 3.564 20 0 FHADHM C[C@@H](CCOc1ccccc1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820249756 607189865 /nfs/dbraw/zinc/18/98/65/607189865.db2.gz ZIPINZOMEDLXBH-LBPRGKRZSA-N -1 3 371.828 3.564 20 0 FHADHM C[C@H](CCc1cccc(F)c1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820253519 607189942 /nfs/dbraw/zinc/18/99/42/607189942.db2.gz JKAOTLHBMLZAKG-LLVKDONJSA-N -1 3 373.819 3.867 20 0 FHADHM C[C@H](CCc1cccc(F)c1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820253519 607189943 /nfs/dbraw/zinc/18/99/43/607189943.db2.gz JKAOTLHBMLZAKG-LLVKDONJSA-N -1 3 373.819 3.867 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)[C@H]1CCCc2ccccc21 ZINC000823314889 607190524 /nfs/dbraw/zinc/19/05/24/607190524.db2.gz UDKAKQIHEWFAFB-AWEZNQCLSA-N -1 3 353.813 3.579 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)[C@H]1CCCc2ccccc21 ZINC000823314889 607190525 /nfs/dbraw/zinc/19/05/25/607190525.db2.gz UDKAKQIHEWFAFB-AWEZNQCLSA-N -1 3 353.813 3.579 20 0 FHADHM O=C(CC/C=C\c1ccccc1)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822954736 607190929 /nfs/dbraw/zinc/19/09/29/607190929.db2.gz AXNQOYGTPIEUDN-YWEYNIOJSA-N -1 3 353.813 3.952 20 0 FHADHM O=C(CC/C=C\c1ccccc1)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822954736 607190930 /nfs/dbraw/zinc/19/09/30/607190930.db2.gz AXNQOYGTPIEUDN-YWEYNIOJSA-N -1 3 353.813 3.952 20 0 FHADHM CC(C)(C)C1CCN(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)CC1 ZINC000819907690 607194585 /nfs/dbraw/zinc/19/45/85/607194585.db2.gz PSBQCVPMTUHMCE-UHFFFAOYSA-N -1 3 362.865 3.810 20 0 FHADHM CC(C)(C)C1CCN(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)CC1 ZINC000819907690 607194586 /nfs/dbraw/zinc/19/45/86/607194586.db2.gz PSBQCVPMTUHMCE-UHFFFAOYSA-N -1 3 362.865 3.810 20 0 FHADHM C[C@@H](c1ccccc1)N(C)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820563875 607195513 /nfs/dbraw/zinc/19/55/13/607195513.db2.gz WEANAFWUAMZEQD-NSHDSACASA-N -1 3 356.817 3.745 20 0 FHADHM C[C@@H](c1ccccc1)N(C)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820563875 607195514 /nfs/dbraw/zinc/19/55/14/607195514.db2.gz WEANAFWUAMZEQD-NSHDSACASA-N -1 3 356.817 3.745 20 0 FHADHM CN(C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)[C@H]1CCc2ccccc21 ZINC000821572129 607199196 /nfs/dbraw/zinc/19/91/96/607199196.db2.gz SHAMJXRNZGXWAP-INIZCTEOSA-N -1 3 368.828 3.671 20 0 FHADHM CN(C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)[C@H]1CCc2ccccc21 ZINC000821572129 607199197 /nfs/dbraw/zinc/19/91/97/607199197.db2.gz SHAMJXRNZGXWAP-INIZCTEOSA-N -1 3 368.828 3.671 20 0 FHADHM CC(C)Oc1ccc(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000820154939 607240345 /nfs/dbraw/zinc/24/03/45/607240345.db2.gz DMXFJAUYVVJUBY-UHFFFAOYSA-N -1 3 357.801 3.560 20 0 FHADHM CC(C)Oc1ccc(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000820154939 607240346 /nfs/dbraw/zinc/24/03/46/607240346.db2.gz DMXFJAUYVVJUBY-UHFFFAOYSA-N -1 3 357.801 3.560 20 0 FHADHM O=C(CCc1cccc(Cl)c1)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822983785 607242423 /nfs/dbraw/zinc/24/24/23/607242423.db2.gz UNPQNYZMHVYFNJ-UHFFFAOYSA-N -1 3 362.220 3.745 20 0 FHADHM O=C(CCc1cccc(Cl)c1)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822983785 607242424 /nfs/dbraw/zinc/24/24/24/607242424.db2.gz UNPQNYZMHVYFNJ-UHFFFAOYSA-N -1 3 362.220 3.745 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)c1cc(F)cc(Cl)c1 ZINC000823318658 607243242 /nfs/dbraw/zinc/24/32/42/607243242.db2.gz GNTHIXDUBWGIGY-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)c1cc(F)cc(Cl)c1 ZINC000823318658 607243243 /nfs/dbraw/zinc/24/32/43/607243243.db2.gz GNTHIXDUBWGIGY-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM COc1cccc(C(C)=CC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)c1 ZINC000821858300 607243540 /nfs/dbraw/zinc/24/35/40/607243540.db2.gz DTPWXGWKMOGXMC-DHZHZOJOSA-N -1 3 369.812 3.571 20 0 FHADHM COc1cccc(C(C)=CC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)c1 ZINC000821858300 607243541 /nfs/dbraw/zinc/24/35/41/607243541.db2.gz DTPWXGWKMOGXMC-DHZHZOJOSA-N -1 3 369.812 3.571 20 0 FHADHM O=C(Oc1ccc(-c2nnn[n-]2)cc1F)c1ccc(Cl)cc1Cl ZINC000823450360 607250231 /nfs/dbraw/zinc/25/02/31/607250231.db2.gz PJOKYLOPXGSVQB-UHFFFAOYSA-N -1 3 353.140 3.532 20 0 FHADHM O=C(Oc1ccc(-c2nn[n-]n2)cc1F)c1ccc(Cl)cc1Cl ZINC000823450360 607250232 /nfs/dbraw/zinc/25/02/32/607250232.db2.gz PJOKYLOPXGSVQB-UHFFFAOYSA-N -1 3 353.140 3.532 20 0 FHADHM C[C@H](C(=O)N(C)c1ccccc1-c1nnn[n-]1)c1ccc2ccccc2c1 ZINC000824041030 607787916 /nfs/dbraw/zinc/78/79/16/607787916.db2.gz XFXDJHBABVXJSD-AWEZNQCLSA-N -1 3 357.417 3.786 20 0 FHADHM C[C@H](C(=O)N(C)c1ccccc1-c1nn[n-]n1)c1ccc2ccccc2c1 ZINC000824041030 607787917 /nfs/dbraw/zinc/78/79/17/607787917.db2.gz XFXDJHBABVXJSD-AWEZNQCLSA-N -1 3 357.417 3.786 20 0 FHADHM CCN(C(=O)[C@@H](C)CCc1ccccc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000825362806 607796321 /nfs/dbraw/zinc/79/63/21/607796321.db2.gz RIRXPPPIMBUSAC-AWEZNQCLSA-N -1 3 367.428 3.628 20 0 FHADHM CCN(C(=O)[C@@H](C)CCc1ccccc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000825362806 607796322 /nfs/dbraw/zinc/79/63/22/607796322.db2.gz RIRXPPPIMBUSAC-AWEZNQCLSA-N -1 3 367.428 3.628 20 0 FHADHM Cc1cc(F)ccc1NC(=O)c1c(Cl)cc(-c2nnn[n-]2)cc1Cl ZINC000826269062 607833305 /nfs/dbraw/zinc/83/33/05/607833305.db2.gz ZADVMRDFGUCJJH-UHFFFAOYSA-N -1 3 366.183 3.873 20 0 FHADHM Cc1cc(F)ccc1NC(=O)c1c(Cl)cc(-c2nn[n-]n2)cc1Cl ZINC000826269062 607833306 /nfs/dbraw/zinc/83/33/06/607833306.db2.gz ZADVMRDFGUCJJH-UHFFFAOYSA-N -1 3 366.183 3.873 20 0 FHADHM FC(F)(F)c1ccc(N2CCC[C@H](C(F)(F)F)C2)cc1-c1nnn[n-]1 ZINC000826368535 607838920 /nfs/dbraw/zinc/83/89/20/607838920.db2.gz TUDUSEIHNNEEQQ-QMMMGPOBSA-N -1 3 365.281 3.664 20 0 FHADHM FC(F)(F)c1ccc(N2CCC[C@H](C(F)(F)F)C2)cc1-c1nn[n-]n1 ZINC000826368535 607838921 /nfs/dbraw/zinc/83/89/21/607838921.db2.gz TUDUSEIHNNEEQQ-QMMMGPOBSA-N -1 3 365.281 3.664 20 0 FHADHM O[C@H](COc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1)c1ccccc1 ZINC000826504625 607878628 /nfs/dbraw/zinc/87/86/28/607878628.db2.gz ABZBMFJIVLHJEE-HXUWFJFHSA-N -1 3 374.400 3.771 20 0 FHADHM O[C@H](COc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1)c1ccccc1 ZINC000826504625 607878629 /nfs/dbraw/zinc/87/86/29/607878629.db2.gz ABZBMFJIVLHJEE-HXUWFJFHSA-N -1 3 374.400 3.771 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NCc1coc(-c2ccccc2)n1 ZINC000825632025 607879736 /nfs/dbraw/zinc/87/97/36/607879736.db2.gz JQKMACHUKQTESU-UHFFFAOYSA-N -1 3 362.393 3.533 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000823943923 607881132 /nfs/dbraw/zinc/88/11/32/607881132.db2.gz VFAOMYIMLWIBSF-YLSINNKHSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000823943923 607881133 /nfs/dbraw/zinc/88/11/33/607881133.db2.gz VFAOMYIMLWIBSF-YLSINNKHSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000823944047 607881225 /nfs/dbraw/zinc/88/12/25/607881225.db2.gz XJGMCNKGHQOUFE-QBFSEMIESA-N -1 3 367.840 3.582 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000823944047 607881226 /nfs/dbraw/zinc/88/12/26/607881226.db2.gz XJGMCNKGHQOUFE-QBFSEMIESA-N -1 3 367.840 3.582 20 0 FHADHM Cc1c(NC(=O)[C@@H](C)Cc2cccc(Cl)c2)cccc1-c1nnn[n-]1 ZINC000826240611 607908858 /nfs/dbraw/zinc/90/88/58/607908858.db2.gz BIMTXHNLICTWNC-NSHDSACASA-N -1 3 355.829 3.646 20 0 FHADHM Cc1c(NC(=O)[C@@H](C)Cc2cccc(Cl)c2)cccc1-c1nn[n-]n1 ZINC000826240611 607908859 /nfs/dbraw/zinc/90/88/59/607908859.db2.gz BIMTXHNLICTWNC-NSHDSACASA-N -1 3 355.829 3.646 20 0 FHADHM O=C(NC1(c2cccc(-c3nnn[n-]3)c2)CC1)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 ZINC000826428325 607909363 /nfs/dbraw/zinc/90/93/63/607909363.db2.gz YKLZDHPWRFMANP-ZMSDIMECSA-N -1 3 365.481 3.579 20 0 FHADHM O=C(NC1(c2cccc(-c3nn[n-]n3)c2)CC1)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 ZINC000826428325 607909364 /nfs/dbraw/zinc/90/93/64/607909364.db2.gz YKLZDHPWRFMANP-ZMSDIMECSA-N -1 3 365.481 3.579 20 0 FHADHM C[C@@H](Cc1cccc(Cl)c1)C(=O)N(C)c1ccc(-c2nnn[n-]2)cc1F ZINC000824457408 607925878 /nfs/dbraw/zinc/92/58/78/607925878.db2.gz LKTIBDMGKBYOOK-NSHDSACASA-N -1 3 373.819 3.501 20 0 FHADHM C[C@@H](Cc1cccc(Cl)c1)C(=O)N(C)c1ccc(-c2nn[n-]n2)cc1F ZINC000824457408 607925879 /nfs/dbraw/zinc/92/58/79/607925879.db2.gz LKTIBDMGKBYOOK-NSHDSACASA-N -1 3 373.819 3.501 20 0 FHADHM CCN(C(=O)[C@@H](C)Cc1cccc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825363342 607927154 /nfs/dbraw/zinc/92/71/54/607927154.db2.gz YKUWJWLUXLRKSQ-ZDUSSCGKSA-N -1 3 369.856 3.752 20 0 FHADHM CCN(C(=O)[C@@H](C)Cc1cccc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825363342 607927155 /nfs/dbraw/zinc/92/71/55/607927155.db2.gz YKUWJWLUXLRKSQ-ZDUSSCGKSA-N -1 3 369.856 3.752 20 0 FHADHM CCNc1nc(SCc2ccccc2-c2nnn[n-]2)nc2ccccc21 ZINC000825480697 607928363 /nfs/dbraw/zinc/92/83/63/607928363.db2.gz GZCZWGYGVHMWSQ-UHFFFAOYSA-N -1 3 363.450 3.534 20 0 FHADHM CCNc1nc(SCc2ccccc2-c2nn[n-]n2)nc2ccccc21 ZINC000825480697 607928364 /nfs/dbraw/zinc/92/83/64/607928364.db2.gz GZCZWGYGVHMWSQ-UHFFFAOYSA-N -1 3 363.450 3.534 20 0 FHADHM Cc1c2ccccc2sc1C(=O)COc1ccc(-c2nn[n-]n2)cc1 ZINC000826234031 607963356 /nfs/dbraw/zinc/96/33/56/607963356.db2.gz FJIBWSBRSNVSME-UHFFFAOYSA-N -1 3 350.403 3.652 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000823943144 607969308 /nfs/dbraw/zinc/96/93/08/607969308.db2.gz ONCKMIIXHVSYIA-YLGBQOPLSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000823943144 607969309 /nfs/dbraw/zinc/96/93/09/607969309.db2.gz ONCKMIIXHVSYIA-YLGBQOPLSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000823944208 607969345 /nfs/dbraw/zinc/96/93/45/607969345.db2.gz ZXFFXCJOHKZTTJ-UKVQZPPCSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000823944208 607969346 /nfs/dbraw/zinc/96/93/46/607969346.db2.gz ZXFFXCJOHKZTTJ-UKVQZPPCSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000823944206 607969432 /nfs/dbraw/zinc/96/94/32/607969432.db2.gz ZXFFXCJOHKZTTJ-KXXVWKPMSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000823944206 607969433 /nfs/dbraw/zinc/96/94/33/607969433.db2.gz ZXFFXCJOHKZTTJ-KXXVWKPMSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1 ZINC000823942934 607970326 /nfs/dbraw/zinc/97/03/26/607970326.db2.gz LKBRMHGAGNNZOC-LCYFTJDESA-N -1 3 367.840 3.582 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1 ZINC000823942934 607970327 /nfs/dbraw/zinc/97/03/27/607970327.db2.gz LKBRMHGAGNNZOC-LCYFTJDESA-N -1 3 367.840 3.582 20 0 FHADHM CC(C)(C)C1=CCN(C(=O)Nc2cc(-c3nnn[n-]3)cn2C(C)(C)C)CC1 ZINC000824072170 607976260 /nfs/dbraw/zinc/97/62/60/607976260.db2.gz SEJYBVWENUJAQJ-UHFFFAOYSA-N -1 3 371.489 3.633 20 0 FHADHM CC(C)(C)C1=CCN(C(=O)Nc2cc(-c3nn[n-]n3)cn2C(C)(C)C)CC1 ZINC000824072170 607976261 /nfs/dbraw/zinc/97/62/61/607976261.db2.gz SEJYBVWENUJAQJ-UHFFFAOYSA-N -1 3 371.489 3.633 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000823942808 607986023 /nfs/dbraw/zinc/98/60/23/607986023.db2.gz JOIBKDNQUWCGMZ-KIWPFMIBSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000823942808 607986024 /nfs/dbraw/zinc/98/60/24/607986024.db2.gz JOIBKDNQUWCGMZ-KIWPFMIBSA-N -1 3 367.840 3.801 20 0 FHADHM CS[C@@H](C)CC(=O)OCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000826225301 608003397 /nfs/dbraw/zinc/00/33/97/608003397.db2.gz YLZGOAFZAOSDBQ-ZDUSSCGKSA-N -1 3 368.462 3.719 20 0 FHADHM CS[C@@H](C)CC(=O)OCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000826225301 608003398 /nfs/dbraw/zinc/00/33/98/608003398.db2.gz YLZGOAFZAOSDBQ-ZDUSSCGKSA-N -1 3 368.462 3.719 20 0 FHADHM Fc1ccc(NCc2cc(-c3nnn[n-]3)cs2)c(OCC(F)(F)F)c1 ZINC000826375238 608027350 /nfs/dbraw/zinc/02/73/50/608027350.db2.gz DZAVCHKYMKQEEU-UHFFFAOYSA-N -1 3 373.335 3.621 20 0 FHADHM Fc1ccc(NCc2cc(-c3nn[n-]n3)cs2)c(OCC(F)(F)F)c1 ZINC000826375238 608027351 /nfs/dbraw/zinc/02/73/51/608027351.db2.gz DZAVCHKYMKQEEU-UHFFFAOYSA-N -1 3 373.335 3.621 20 0 FHADHM CC(C)[C@@H]1CCc2ccccc2N1C(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000824222833 608029533 /nfs/dbraw/zinc/02/95/33/608029533.db2.gz CQTCVCPYXSUCJH-AWEZNQCLSA-N -1 3 353.451 3.546 20 0 FHADHM CC(C)[C@@H]1CCc2ccccc2N1C(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000824222833 608029534 /nfs/dbraw/zinc/02/95/34/608029534.db2.gz CQTCVCPYXSUCJH-AWEZNQCLSA-N -1 3 353.451 3.546 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CNCc1c(Cl)oc2ccccc21 ZINC000826373525 608055190 /nfs/dbraw/zinc/05/51/90/608055190.db2.gz PJQLVAZCSTVOFY-UHFFFAOYSA-N -1 3 357.776 3.695 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N[C@H]1c2ccccc2CC[C@@H]1C ZINC000826278122 608105835 /nfs/dbraw/zinc/10/58/35/608105835.db2.gz RMDJRQGRCCHYGR-SCLBCKFNSA-N -1 3 362.437 3.620 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N[C@H]1c2ccccc2CC[C@@H]1C ZINC000826278122 608105836 /nfs/dbraw/zinc/10/58/36/608105836.db2.gz RMDJRQGRCCHYGR-SCLBCKFNSA-N -1 3 362.437 3.620 20 0 FHADHM Cc1ccc2oc(CN[C@H](C)c3ccc(-c4nn[n-]n4)cc3F)cc2c1 ZINC000826295578 608136691 /nfs/dbraw/zinc/13/66/91/608136691.db2.gz NRLFIUPVOQCJGX-GFCCVEGCSA-N -1 3 351.385 3.911 20 0 FHADHM CC(C)c1ccc(/C=C\CC(=O)NCc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000495130203 608151076 /nfs/dbraw/zinc/15/10/76/608151076.db2.gz HHYGTZPRJCLMQJ-ARJAWSKDSA-N -1 3 361.449 3.710 20 0 FHADHM CC(C)c1ccc(/C=C\CC(=O)NCc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000495130203 608151077 /nfs/dbraw/zinc/15/10/77/608151077.db2.gz HHYGTZPRJCLMQJ-ARJAWSKDSA-N -1 3 361.449 3.710 20 0 FHADHM CC(C)c1ccc([C@@H]2CCCCN2C(=O)c2ccc(-c3nnn[n-]3)[nH]2)cc1 ZINC000824347976 608159208 /nfs/dbraw/zinc/15/92/08/608159208.db2.gz VHLKYISHMDJLFC-SFHVURJKSA-N -1 3 364.453 3.686 20 0 FHADHM CC(C)c1ccc([C@@H]2CCCCN2C(=O)c2ccc(-c3nn[n-]n3)[nH]2)cc1 ZINC000824347976 608159210 /nfs/dbraw/zinc/15/92/10/608159210.db2.gz VHLKYISHMDJLFC-SFHVURJKSA-N -1 3 364.453 3.686 20 0 FHADHM c1nc(CNC2(c3cccc(-c4nn[n-]n4)c3)CC2)sc1-c1ccccc1 ZINC000826519440 608161179 /nfs/dbraw/zinc/16/11/79/608161179.db2.gz YQDVRBJCCAGCQW-UHFFFAOYSA-N -1 3 374.473 3.769 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@H]1CC12CCCCC2 ZINC000825319065 608164458 /nfs/dbraw/zinc/16/44/58/608164458.db2.gz WNEWAMLUVRSGMZ-KRWDZBQOSA-N -1 3 368.485 3.511 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@H]1CC12CCCCC2 ZINC000825319065 608164460 /nfs/dbraw/zinc/16/44/60/608164460.db2.gz WNEWAMLUVRSGMZ-KRWDZBQOSA-N -1 3 368.485 3.511 20 0 FHADHM C[C@@H](OC(=O)c1ccccc1Br)c1cccc(-c2nnn[n-]2)c1 ZINC000824721928 608182021 /nfs/dbraw/zinc/18/20/21/608182021.db2.gz FOIFBRIKEGYGPE-SNVBAGLBSA-N -1 3 373.210 3.547 20 0 FHADHM C[C@@H](OC(=O)c1ccccc1Br)c1cccc(-c2nn[n-]n2)c1 ZINC000824721928 608182023 /nfs/dbraw/zinc/18/20/23/608182023.db2.gz FOIFBRIKEGYGPE-SNVBAGLBSA-N -1 3 373.210 3.547 20 0 FHADHM Cc1cccc(C2=CCN(c3ncc(-c4nnn[n-]4)cc3Cl)CC2)c1 ZINC000826297715 608194497 /nfs/dbraw/zinc/19/44/97/608194497.db2.gz PSLFBBUHSURTRQ-UHFFFAOYSA-N -1 3 352.829 3.517 20 0 FHADHM Cc1cccc(C2=CCN(c3ncc(-c4nn[n-]n4)cc3Cl)CC2)c1 ZINC000826297715 608194498 /nfs/dbraw/zinc/19/44/98/608194498.db2.gz PSLFBBUHSURTRQ-UHFFFAOYSA-N -1 3 352.829 3.517 20 0 FHADHM CCc1ccccc1NC(=O)CSc1cccc(Cl)c1-c1nnn[n-]1 ZINC000825721966 608205957 /nfs/dbraw/zinc/20/59/57/608205957.db2.gz CDSKHCJDEPLREY-UHFFFAOYSA-N -1 3 373.869 3.813 20 0 FHADHM CCc1ccccc1NC(=O)CSc1cccc(Cl)c1-c1nn[n-]n1 ZINC000825721966 608205958 /nfs/dbraw/zinc/20/59/58/608205958.db2.gz CDSKHCJDEPLREY-UHFFFAOYSA-N -1 3 373.869 3.813 20 0 FHADHM CC(C)OCc1ccccc1CNc1ccc2cc(-c3nnn[n-]3)ccc2n1 ZINC000824315715 608221091 /nfs/dbraw/zinc/22/10/91/608221091.db2.gz VWZRIVIYEIFMAS-UHFFFAOYSA-N -1 3 374.448 3.952 20 0 FHADHM CC(C)OCc1ccccc1CNc1ccc2cc(-c3nn[n-]n3)ccc2n1 ZINC000824315715 608221093 /nfs/dbraw/zinc/22/10/93/608221093.db2.gz VWZRIVIYEIFMAS-UHFFFAOYSA-N -1 3 374.448 3.952 20 0 FHADHM COc1ccc([C@H](C)N(C)c2ccc3cc(-c4nnn[n-]4)ccc3n2)cc1 ZINC000826188102 608221664 /nfs/dbraw/zinc/22/16/64/608221664.db2.gz NPKQQTPCVGRZPD-ZDUSSCGKSA-N -1 3 360.421 3.621 20 0 FHADHM COc1ccc([C@H](C)N(C)c2ccc3cc(-c4nn[n-]n4)ccc3n2)cc1 ZINC000826188102 608221666 /nfs/dbraw/zinc/22/16/66/608221666.db2.gz NPKQQTPCVGRZPD-ZDUSSCGKSA-N -1 3 360.421 3.621 20 0 FHADHM CCS[C@H]1CCCCN(c2ccc3cc(-c4nnn[n-]4)ccc3n2)C1 ZINC000825669089 608228478 /nfs/dbraw/zinc/22/84/78/608228478.db2.gz PUHRXZAPABHLHH-HNNXBMFYSA-N -1 3 354.483 3.527 20 0 FHADHM CCS[C@H]1CCCCN(c2ccc3cc(-c4nn[n-]n4)ccc3n2)C1 ZINC000825669089 608228480 /nfs/dbraw/zinc/22/84/80/608228480.db2.gz PUHRXZAPABHLHH-HNNXBMFYSA-N -1 3 354.483 3.527 20 0 FHADHM CC(C)[C@H](CNc1ccc2cc(-c3nnn[n-]3)ccc2n1)c1cccnc1 ZINC000824191451 608231387 /nfs/dbraw/zinc/23/13/87/608231387.db2.gz DZCHVVHMCZKIRP-KRWDZBQOSA-N -1 3 359.437 3.662 20 0 FHADHM CC(C)[C@H](CNc1ccc2cc(-c3nn[n-]n3)ccc2n1)c1cccnc1 ZINC000824191451 608231389 /nfs/dbraw/zinc/23/13/89/608231389.db2.gz DZCHVVHMCZKIRP-KRWDZBQOSA-N -1 3 359.437 3.662 20 0 FHADHM Clc1cc(NCCc2nc3c(s2)CCCC3)ccc1-c1nnn[n-]1 ZINC000826350760 608231479 /nfs/dbraw/zinc/23/14/79/608231479.db2.gz JZRWIPJKDMXRJP-UHFFFAOYSA-N -1 3 360.874 3.510 20 0 FHADHM Clc1cc(NCCc2nc3c(s2)CCCC3)ccc1-c1nn[n-]n1 ZINC000826350760 608231481 /nfs/dbraw/zinc/23/14/81/608231481.db2.gz JZRWIPJKDMXRJP-UHFFFAOYSA-N -1 3 360.874 3.510 20 0 FHADHM CC(C)OC1CCC(Nc2ccc3cc(-c4nnn[n-]4)ccc3n2)CC1 ZINC000824309667 608234316 /nfs/dbraw/zinc/23/43/16/608234316.db2.gz UOUVVLSWIHVLNL-UHFFFAOYSA-N -1 3 352.442 3.563 20 0 FHADHM CC(C)OC1CCC(Nc2ccc3cc(-c4nn[n-]n4)ccc3n2)CC1 ZINC000824309667 608234317 /nfs/dbraw/zinc/23/43/17/608234317.db2.gz UOUVVLSWIHVLNL-UHFFFAOYSA-N -1 3 352.442 3.563 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1ccc(Cl)c(F)c1 ZINC000824293283 608237710 /nfs/dbraw/zinc/23/77/10/608237710.db2.gz IYAHRFTWTFSPME-UHFFFAOYSA-N -1 3 373.819 3.710 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1ccc(Cl)c(F)c1 ZINC000824293283 608237711 /nfs/dbraw/zinc/23/77/11/608237711.db2.gz IYAHRFTWTFSPME-UHFFFAOYSA-N -1 3 373.819 3.710 20 0 FHADHM COc1ccc([C@@H](OC)[C@@H](C)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1 ZINC000826189930 608239328 /nfs/dbraw/zinc/23/93/28/608239328.db2.gz JPICCYYRBQHGMS-DIFFPNOSSA-N -1 3 373.844 3.717 20 0 FHADHM COc1ccc([C@@H](OC)[C@@H](C)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1 ZINC000826189930 608239330 /nfs/dbraw/zinc/23/93/30/608239330.db2.gz JPICCYYRBQHGMS-DIFFPNOSSA-N -1 3 373.844 3.717 20 0 FHADHM Cc1cccnc1COC(=O)c1ccccc1-c1ccccc1-c1nnn[n-]1 ZINC000826308253 608252248 /nfs/dbraw/zinc/25/22/48/608252248.db2.gz PXZNQURVUZZNCW-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM Cc1cccnc1COC(=O)c1ccccc1-c1ccccc1-c1nn[n-]n1 ZINC000826308253 608252250 /nfs/dbraw/zinc/25/22/50/608252250.db2.gz PXZNQURVUZZNCW-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM Cc1[nH]c2ccccc2c1C1CCN(c2nc(C)ccc2-c2nnn[n-]2)CC1 ZINC000826274244 608276506 /nfs/dbraw/zinc/27/65/06/608276506.db2.gz LBMNRNCRKXVXEF-UHFFFAOYSA-N -1 3 373.464 3.744 20 0 FHADHM Cc1[nH]c2ccccc2c1C1CCN(c2nc(C)ccc2-c2nn[n-]n2)CC1 ZINC000826274244 608276508 /nfs/dbraw/zinc/27/65/08/608276508.db2.gz LBMNRNCRKXVXEF-UHFFFAOYSA-N -1 3 373.464 3.744 20 0 FHADHM COc1ccc2oc([C@@H](C)Nc3nc(C)ccc3-c3nnn[n-]3)c(C)c2c1 ZINC000826214026 608284541 /nfs/dbraw/zinc/28/45/41/608284541.db2.gz XCGNWNLGEDGNKF-GFCCVEGCSA-N -1 3 364.409 3.806 20 0 FHADHM COc1ccc2oc([C@@H](C)Nc3nc(C)ccc3-c3nn[n-]n3)c(C)c2c1 ZINC000826214026 608284542 /nfs/dbraw/zinc/28/45/42/608284542.db2.gz XCGNWNLGEDGNKF-GFCCVEGCSA-N -1 3 364.409 3.806 20 0 FHADHM Cc1cc(C)n(-c2ccc([C@H](C)Nc3nc(C)ccc3-c3nnn[n-]3)cc2)n1 ZINC000826274963 608297113 /nfs/dbraw/zinc/29/71/13/608297113.db2.gz KFTVRIBTIUWJPA-HNNXBMFYSA-N -1 3 374.452 3.546 20 0 FHADHM Cc1cc(C)n(-c2ccc([C@H](C)Nc3nc(C)ccc3-c3nn[n-]n3)cc2)n1 ZINC000826274963 608297115 /nfs/dbraw/zinc/29/71/15/608297115.db2.gz KFTVRIBTIUWJPA-HNNXBMFYSA-N -1 3 374.452 3.546 20 0 FHADHM Cc1scc(C(=O)N(CC(C)C)c2ccc(-c3nnn[n-]3)cc2)c1C ZINC000826350439 608301697 /nfs/dbraw/zinc/30/16/97/608301697.db2.gz WIWJSUXGUNGBQS-UHFFFAOYSA-N -1 3 355.467 3.848 20 0 FHADHM Cc1scc(C(=O)N(CC(C)C)c2ccc(-c3nn[n-]n3)cc2)c1C ZINC000826350439 608301699 /nfs/dbraw/zinc/30/16/99/608301699.db2.gz WIWJSUXGUNGBQS-UHFFFAOYSA-N -1 3 355.467 3.848 20 0 FHADHM CCCc1nc(CSCc2ccc(-c3nnn[n-]3)cc2OC)cs1 ZINC000825353315 608322097 /nfs/dbraw/zinc/32/20/97/608322097.db2.gz UVKOMGIEGVYXHS-UHFFFAOYSA-N -1 3 361.496 3.718 20 0 FHADHM CCCc1nc(CSCc2ccc(-c3nn[n-]n3)cc2OC)cs1 ZINC000825353315 608322099 /nfs/dbraw/zinc/32/20/99/608322099.db2.gz UVKOMGIEGVYXHS-UHFFFAOYSA-N -1 3 361.496 3.718 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CSCc1csc(C2CC2)n1 ZINC000826173733 608323267 /nfs/dbraw/zinc/32/32/67/608323267.db2.gz RSQXPYOLLWJKIZ-UHFFFAOYSA-N -1 3 359.480 3.643 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CSCc1csc(C2CC2)n1 ZINC000826173733 608323269 /nfs/dbraw/zinc/32/32/69/608323269.db2.gz RSQXPYOLLWJKIZ-UHFFFAOYSA-N -1 3 359.480 3.643 20 0 FHADHM CC1(C(=O)NCc2ccc(-c3ccccc3-c3nnn[n-]3)cc2)CCCC1 ZINC000824784441 608327615 /nfs/dbraw/zinc/32/76/15/608327615.db2.gz TWESMEDIQKFCEY-UHFFFAOYSA-N -1 3 361.449 3.730 20 0 FHADHM CC1(C(=O)NCc2ccc(-c3ccccc3-c3nn[n-]n3)cc2)CCCC1 ZINC000824784441 608327617 /nfs/dbraw/zinc/32/76/17/608327617.db2.gz TWESMEDIQKFCEY-UHFFFAOYSA-N -1 3 361.449 3.730 20 0 FHADHM CC(C)(C)/C=C\C(=O)NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000824080645 608329425 /nfs/dbraw/zinc/32/94/25/608329425.db2.gz YVKDGRWDGPZGHZ-SEYXRHQNSA-N -1 3 361.449 3.752 20 0 FHADHM CC(C)(C)/C=C\C(=O)NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000824080645 608329427 /nfs/dbraw/zinc/32/94/27/608329427.db2.gz YVKDGRWDGPZGHZ-SEYXRHQNSA-N -1 3 361.449 3.752 20 0 FHADHM Cc1scc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCC3)c1C ZINC000826350504 608339629 /nfs/dbraw/zinc/33/96/29/608339629.db2.gz ZDILHLOTZQGANQ-UHFFFAOYSA-N -1 3 359.480 3.738 20 0 FHADHM Cc1scc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCC3)c1C ZINC000826350504 608339631 /nfs/dbraw/zinc/33/96/31/608339631.db2.gz ZDILHLOTZQGANQ-UHFFFAOYSA-N -1 3 359.480 3.738 20 0 FHADHM CCC(CC)NC(=O)NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000825106467 608342172 /nfs/dbraw/zinc/34/21/72/608342172.db2.gz CUBJXTYSDZTWPS-UHFFFAOYSA-N -1 3 364.453 3.522 20 0 FHADHM CCC(CC)NC(=O)NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000825106467 608342174 /nfs/dbraw/zinc/34/21/74/608342174.db2.gz CUBJXTYSDZTWPS-UHFFFAOYSA-N -1 3 364.453 3.522 20 0 FHADHM CCN(C(=O)c1csc(C2CC2)n1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825391474 608344393 /nfs/dbraw/zinc/34/43/93/608344393.db2.gz ZTULYGUDCLJHLD-UHFFFAOYSA-N -1 3 374.857 3.521 20 0 FHADHM CCN(C(=O)c1csc(C2CC2)n1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825391474 608344394 /nfs/dbraw/zinc/34/43/94/608344394.db2.gz ZTULYGUDCLJHLD-UHFFFAOYSA-N -1 3 374.857 3.521 20 0 FHADHM Oc1cccc2c1CC[C@H]2Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000826511269 608382294 /nfs/dbraw/zinc/38/22/94/608382294.db2.gz IWLCGTBCGQWJNU-CQSZACIVSA-N -1 3 361.327 3.691 20 0 FHADHM Oc1cccc2c1CC[C@H]2Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000826511269 608382296 /nfs/dbraw/zinc/38/22/96/608382296.db2.gz IWLCGTBCGQWJNU-CQSZACIVSA-N -1 3 361.327 3.691 20 0 FHADHM CCCCC[C@@H](C)NC(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000825267955 608391330 /nfs/dbraw/zinc/39/13/30/608391330.db2.gz OHTDJGNMEQBPIF-OAHLLOKOSA-N -1 3 368.485 3.634 20 0 FHADHM CCCCC[C@@H](C)NC(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000825267955 608391332 /nfs/dbraw/zinc/39/13/32/608391332.db2.gz OHTDJGNMEQBPIF-OAHLLOKOSA-N -1 3 368.485 3.634 20 0 FHADHM Fc1ccc([C@H]2CCCN2Cc2cccc(-c3nnn[n-]3)c2F)cc1F ZINC000826373851 608395012 /nfs/dbraw/zinc/39/50/12/608395012.db2.gz BUZYRXPMTWXLFN-MRXNPFEDSA-N -1 3 359.355 3.621 20 0 FHADHM Fc1ccc([C@H]2CCCN2Cc2cccc(-c3nn[n-]n3)c2F)cc1F ZINC000826373851 608395014 /nfs/dbraw/zinc/39/50/14/608395014.db2.gz BUZYRXPMTWXLFN-MRXNPFEDSA-N -1 3 359.355 3.621 20 0 FHADHM CCc1ccc(NC(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)cc1CC ZINC000825711895 608472375 /nfs/dbraw/zinc/47/23/75/608472375.db2.gz IJODNKRUZLDOHW-UHFFFAOYSA-N -1 3 357.364 3.522 20 0 FHADHM CCc1ccc(NC(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)cc1CC ZINC000825711895 608472376 /nfs/dbraw/zinc/47/23/76/608472376.db2.gz IJODNKRUZLDOHW-UHFFFAOYSA-N -1 3 357.364 3.522 20 0 FHADHM C[C@@H](CC(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1)c1ccccc1 ZINC000824385406 608477781 /nfs/dbraw/zinc/47/77/81/608477781.db2.gz SEYVUWBQOPJUGI-INIZCTEOSA-N -1 3 373.460 3.676 20 0 FHADHM C[C@@H](CC(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1)c1ccccc1 ZINC000824385406 608477782 /nfs/dbraw/zinc/47/77/82/608477782.db2.gz SEYVUWBQOPJUGI-INIZCTEOSA-N -1 3 373.460 3.676 20 0 FHADHM Cc1cccc([C@@H](C)C(=O)N2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)c1 ZINC000826296146 608482153 /nfs/dbraw/zinc/48/21/53/608482153.db2.gz KUQAWCFUQVUPON-MRXNPFEDSA-N -1 3 373.460 3.595 20 0 FHADHM Cc1cccc([C@@H](C)C(=O)N2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)c1 ZINC000826296146 608482154 /nfs/dbraw/zinc/48/21/54/608482154.db2.gz KUQAWCFUQVUPON-MRXNPFEDSA-N -1 3 373.460 3.595 20 0 FHADHM C[C@H](NCc1ncc(-c2ccc(F)cc2)o1)c1cccc(-c2nn[n-]n2)c1 ZINC000824633999 608482266 /nfs/dbraw/zinc/48/22/66/608482266.db2.gz SWBOFEITKDGLCY-LBPRGKRZSA-N -1 3 364.384 3.512 20 0 FHADHM CC(C)CC(C)(C)C(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000824230015 608488145 /nfs/dbraw/zinc/48/81/45/608488145.db2.gz XSHRYZZEIFNZPM-UHFFFAOYSA-N -1 3 353.470 3.555 20 0 FHADHM CC(C)CC(C)(C)C(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000824230015 608488146 /nfs/dbraw/zinc/48/81/46/608488146.db2.gz XSHRYZZEIFNZPM-UHFFFAOYSA-N -1 3 353.470 3.555 20 0 FHADHM CC(C)CCc1nc(CN[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cs1 ZINC000824248805 608490344 /nfs/dbraw/zinc/49/03/44/608490344.db2.gz CJCAWCBCTRUUFJ-ZDUSSCGKSA-N -1 3 356.499 3.763 20 0 FHADHM C[C@@H](OC(=O)c1ccc(F)c(Cl)c1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000824723688 608576118 /nfs/dbraw/zinc/57/61/18/608576118.db2.gz UICGJMYRSQKZBG-MRVPVSSYSA-N -1 3 364.739 3.716 20 0 FHADHM C[C@@H](OC(=O)c1ccc(F)c(Cl)c1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000824723688 608576119 /nfs/dbraw/zinc/57/61/19/608576119.db2.gz UICGJMYRSQKZBG-MRVPVSSYSA-N -1 3 364.739 3.716 20 0 FHADHM O=C(c1ccc(Cl)c(-c2nnn[n-]2)c1)N(Cc1ccco1)C1CCCC1 ZINC000826472443 608576463 /nfs/dbraw/zinc/57/64/63/608576463.db2.gz KPNKMHOTCGHVNH-UHFFFAOYSA-N -1 3 371.828 3.698 20 0 FHADHM O=C(c1ccc(Cl)c(-c2nn[n-]n2)c1)N(Cc1ccco1)C1CCCC1 ZINC000826472443 608576465 /nfs/dbraw/zinc/57/64/65/608576465.db2.gz KPNKMHOTCGHVNH-UHFFFAOYSA-N -1 3 371.828 3.698 20 0 FHADHM CC1(C)CC[C@H](NC(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)C1 ZINC000824803012 608600630 /nfs/dbraw/zinc/60/06/30/608600630.db2.gz REWBXEJHIROPEB-AWEZNQCLSA-N -1 3 361.449 3.842 20 0 FHADHM CC1(C)CC[C@H](NC(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)C1 ZINC000824803012 608600631 /nfs/dbraw/zinc/60/06/31/608600631.db2.gz REWBXEJHIROPEB-AWEZNQCLSA-N -1 3 361.449 3.842 20 0 FHADHM CCCOc1ccc(NC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000825339012 608607543 /nfs/dbraw/zinc/60/75/43/608607543.db2.gz LVTZRTKKQPYGQF-UHFFFAOYSA-N -1 3 372.816 3.953 20 0 FHADHM CCCOc1ccc(NC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000825339012 608607546 /nfs/dbraw/zinc/60/75/46/608607546.db2.gz LVTZRTKKQPYGQF-UHFFFAOYSA-N -1 3 372.816 3.953 20 0 FHADHM C[C@H]1SCCN(Cc2cccc(-c3nnn[n-]3)c2F)[C@H]1c1ccccc1 ZINC000825019574 608650708 /nfs/dbraw/zinc/65/07/08/608650708.db2.gz FLKAKBSYTKVZGG-FZKQIMNGSA-N -1 3 369.469 3.684 20 0 FHADHM CC(C)[C@H](OC(=O)Cc1cccc(-c2nnn[n-]2)c1)c1ccc(F)c(F)c1 ZINC000824207507 608671451 /nfs/dbraw/zinc/67/14/51/608671451.db2.gz YGQALDQBPGVSNM-SFHVURJKSA-N -1 3 372.375 3.628 20 0 FHADHM CC(C)[C@H](OC(=O)Cc1cccc(-c2nn[n-]n2)c1)c1ccc(F)c(F)c1 ZINC000824207507 608671453 /nfs/dbraw/zinc/67/14/53/608671453.db2.gz YGQALDQBPGVSNM-SFHVURJKSA-N -1 3 372.375 3.628 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1Oc1ccc(-c2ccccc2)nc1 ZINC000826350793 608796469 /nfs/dbraw/zinc/79/64/69/608796469.db2.gz LKGMSEMJNXQZTN-UHFFFAOYSA-N -1 3 350.769 3.769 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1Oc1ccc(-c2ccccc2)nc1 ZINC000826350793 608796472 /nfs/dbraw/zinc/79/64/72/608796472.db2.gz LKGMSEMJNXQZTN-UHFFFAOYSA-N -1 3 350.769 3.769 20 0 FHADHM CCCOc1c(Cl)cc(CNc2ccc(-c3nn[n-]n3)cc2)cc1OC ZINC000825339379 608868708 /nfs/dbraw/zinc/86/87/08/608868708.db2.gz YKATVABENROXQG-UHFFFAOYSA-N -1 3 373.844 3.930 20 0 FHADHM COc1ccc(CNc2ccc(-c3nn[n-]n3)cc2)cc1OCC(C)C ZINC000826203903 608868844 /nfs/dbraw/zinc/86/88/44/608868844.db2.gz LLRFCDALHADOTO-UHFFFAOYSA-N -1 3 353.426 3.522 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CCC[C@@H]1/C=C\c1ccccc1 ZINC000826278382 609157503 /nfs/dbraw/zinc/15/75/03/609157503.db2.gz ZHJZVQUJLXNHRT-SIKDUDHDSA-N -1 3 374.448 3.885 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CCC[C@@H]1/C=C\c1ccccc1 ZINC000826278382 609157504 /nfs/dbraw/zinc/15/75/04/609157504.db2.gz ZHJZVQUJLXNHRT-SIKDUDHDSA-N -1 3 374.448 3.885 20 0 FHADHM Cc1ccc(NC(=O)C2CC2)cc1N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000826290732 609158679 /nfs/dbraw/zinc/15/86/79/609158679.db2.gz XQPOUGIYBNOOBJ-CYBMUJFWSA-N -1 3 362.437 3.697 20 0 FHADHM Cc1ccc(NC(=O)C2CC2)cc1N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000826290732 609158681 /nfs/dbraw/zinc/15/86/81/609158681.db2.gz XQPOUGIYBNOOBJ-CYBMUJFWSA-N -1 3 362.437 3.697 20 0 FHADHM CC(C)C(=O)Nc1ccc(N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824184843 609161944 /nfs/dbraw/zinc/16/19/44/609161944.db2.gz MEDLMLCBLCHVAX-CYBMUJFWSA-N -1 3 350.426 3.634 20 0 FHADHM CC(C)C(=O)Nc1ccc(N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824184843 609161946 /nfs/dbraw/zinc/16/19/46/609161946.db2.gz MEDLMLCBLCHVAX-CYBMUJFWSA-N -1 3 350.426 3.634 20 0 FHADHM CCOc1ccc(N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1OCC ZINC000825643982 609162439 /nfs/dbraw/zinc/16/24/39/609162439.db2.gz ZBRIXFZAQVGVTI-CYBMUJFWSA-N -1 3 353.426 3.837 20 0 FHADHM CCOc1ccc(N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1OCC ZINC000825643982 609162440 /nfs/dbraw/zinc/16/24/40/609162440.db2.gz ZBRIXFZAQVGVTI-CYBMUJFWSA-N -1 3 353.426 3.837 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NCc1nc(C(C)(C)C)cs1 ZINC000825480520 609177432 /nfs/dbraw/zinc/17/74/32/609177432.db2.gz AYQXSANKBIKAMF-UHFFFAOYSA-N -1 3 357.487 3.665 20 0 FHADHM Cc1occc1S[C@H](C)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000826342668 609178965 /nfs/dbraw/zinc/17/89/65/609178965.db2.gz VKPMFYOYENBRBE-SECBINFHSA-N -1 3 363.830 3.541 20 0 FHADHM Cc1occc1S[C@H](C)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000826342668 609178967 /nfs/dbraw/zinc/17/89/67/609178967.db2.gz VKPMFYOYENBRBE-SECBINFHSA-N -1 3 363.830 3.541 20 0 FHADHM Cc1cc(NCc2ccccc2-c2nnn[n-]2)nn1-c1cccc(Cl)c1 ZINC000826271348 609180476 /nfs/dbraw/zinc/18/04/76/609180476.db2.gz NZHWETIRWURNIV-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM Cc1cc(NCc2ccccc2-c2nn[n-]n2)nn1-c1cccc(Cl)c1 ZINC000826271348 609180479 /nfs/dbraw/zinc/18/04/79/609180479.db2.gz NZHWETIRWURNIV-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM CC(C)(C)C[C@H](NC(=O)c1c[nH]c(-c2nnn[n-]2)c1)c1ccc(Cl)cc1 ZINC000824087512 609216688 /nfs/dbraw/zinc/21/66/88/609216688.db2.gz WEOZZMTXSNIASZ-HNNXBMFYSA-N -1 3 372.860 3.756 20 0 FHADHM CC(C)(C)C[C@H](NC(=O)c1c[nH]c(-c2nn[n-]n2)c1)c1ccc(Cl)cc1 ZINC000824087512 609216690 /nfs/dbraw/zinc/21/66/90/609216690.db2.gz WEOZZMTXSNIASZ-HNNXBMFYSA-N -1 3 372.860 3.756 20 0 FHADHM C[C@H](Nc1cccc(OC[C@H]2CCCO2)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824662831 609237267 /nfs/dbraw/zinc/23/72/67/609237267.db2.gz SBBMLQVGZZTTCM-IFXJQAMLSA-N -1 3 365.437 3.598 20 0 FHADHM C[C@H](Nc1cccc(OC[C@H]2CCCO2)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824662831 609237269 /nfs/dbraw/zinc/23/72/69/609237269.db2.gz SBBMLQVGZZTTCM-IFXJQAMLSA-N -1 3 365.437 3.598 20 0 FHADHM Cc1c(NC(=O)C2(c3ccc(F)cc3F)CCC2)cccc1-c1nnn[n-]1 ZINC000826241027 609237473 /nfs/dbraw/zinc/23/74/73/609237473.db2.gz OPGJSFPKHOFBAW-UHFFFAOYSA-N -1 3 369.375 3.514 20 0 FHADHM Cc1c(NC(=O)C2(c3ccc(F)cc3F)CCC2)cccc1-c1nn[n-]n1 ZINC000826241027 609237474 /nfs/dbraw/zinc/23/74/74/609237474.db2.gz OPGJSFPKHOFBAW-UHFFFAOYSA-N -1 3 369.375 3.514 20 0 FHADHM C[C@@H](Nc1cc2c(cc1Cl)OCCCO2)c1cccc(-c2nnn[n-]2)c1 ZINC000824650647 609253992 /nfs/dbraw/zinc/25/39/92/609253992.db2.gz UKDCEUUCGKCJFY-LLVKDONJSA-N -1 3 371.828 3.855 20 0 FHADHM C[C@@H](Nc1cc2c(cc1Cl)OCCCO2)c1cccc(-c2nn[n-]n2)c1 ZINC000824650647 609253993 /nfs/dbraw/zinc/25/39/93/609253993.db2.gz UKDCEUUCGKCJFY-LLVKDONJSA-N -1 3 371.828 3.855 20 0 FHADHM C[C@H](Nc1ccc(F)cc1OCC(F)F)c1cccc(-c2nnn[n-]2)c1 ZINC000824656236 609254014 /nfs/dbraw/zinc/25/40/14/609254014.db2.gz JMCPVJYDMGKKMT-JTQLQIEISA-N -1 3 363.343 3.823 20 0 FHADHM C[C@H](Nc1ccc(F)cc1OCC(F)F)c1cccc(-c2nn[n-]n2)c1 ZINC000824656236 609254015 /nfs/dbraw/zinc/25/40/15/609254015.db2.gz JMCPVJYDMGKKMT-JTQLQIEISA-N -1 3 363.343 3.823 20 0 FHADHM CCCCn1ncc(N[C@H]2CCCc3cc(-c4nnn[n-]4)ccc32)c1C ZINC000825301796 609254722 /nfs/dbraw/zinc/25/47/22/609254722.db2.gz OXJVMIXKAIZTHM-KRWDZBQOSA-N -1 3 351.458 3.661 20 0 FHADHM CCCCn1ncc(N[C@H]2CCCc3cc(-c4nn[n-]n4)ccc32)c1C ZINC000825301796 609254724 /nfs/dbraw/zinc/25/47/24/609254724.db2.gz OXJVMIXKAIZTHM-KRWDZBQOSA-N -1 3 351.458 3.661 20 0 FHADHM CCC(=O)Nc1ccc(N[C@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)cc1 ZINC000825034199 609269067 /nfs/dbraw/zinc/26/90/67/609269067.db2.gz GPMCUPRETBWWCU-LLVKDONJSA-N -1 3 354.389 3.527 20 0 FHADHM CCC(=O)Nc1ccc(N[C@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)cc1 ZINC000825034199 609269069 /nfs/dbraw/zinc/26/90/69/609269069.db2.gz GPMCUPRETBWWCU-LLVKDONJSA-N -1 3 354.389 3.527 20 0 FHADHM CCn1ncc2ccc(N[C@H](C)c3ccc(-c4nnn[n-]4)c(F)c3)cc21 ZINC000825806939 609276757 /nfs/dbraw/zinc/27/67/57/609276757.db2.gz KPFOQAHSLOAOFK-LLVKDONJSA-N -1 3 351.389 3.549 20 0 FHADHM CCn1ncc2ccc(N[C@H](C)c3ccc(-c4nn[n-]n4)c(F)c3)cc21 ZINC000825806939 609276758 /nfs/dbraw/zinc/27/67/58/609276758.db2.gz KPFOQAHSLOAOFK-LLVKDONJSA-N -1 3 351.389 3.549 20 0 FHADHM COc1ccc(N[C@H]2CCCc3cc(-c4nnn[n-]4)ccc32)c2cccnc12 ZINC000826210131 609276796 /nfs/dbraw/zinc/27/67/96/609276796.db2.gz FTSIDWSUTVCQFR-KRWDZBQOSA-N -1 3 372.432 3.913 20 0 FHADHM COc1ccc(N[C@H]2CCCc3cc(-c4nn[n-]n4)ccc32)c2cccnc12 ZINC000826210131 609276797 /nfs/dbraw/zinc/27/67/97/609276797.db2.gz FTSIDWSUTVCQFR-KRWDZBQOSA-N -1 3 372.432 3.913 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1nc(C2CC2)cs1 ZINC000824712948 609283037 /nfs/dbraw/zinc/28/30/37/609283037.db2.gz FQNRUGZWOJSOCX-ANYFNZRUSA-N -1 3 367.434 3.518 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1nc(C2CC2)cs1 ZINC000824712948 609283040 /nfs/dbraw/zinc/28/30/40/609283040.db2.gz FQNRUGZWOJSOCX-ANYFNZRUSA-N -1 3 367.434 3.518 20 0 FHADHM O=C(NC/C=C\c1ccccc1)c1c(Cl)cc(-c2nnn[n-]2)cc1Cl ZINC000826435647 609284020 /nfs/dbraw/zinc/28/40/20/609284020.db2.gz UDIVSZNHVKGWBV-DAXSKMNVSA-N -1 3 374.231 3.617 20 0 FHADHM O=C(NC/C=C\c1ccccc1)c1c(Cl)cc(-c2nn[n-]n2)cc1Cl ZINC000826435647 609284022 /nfs/dbraw/zinc/28/40/22/609284022.db2.gz UDIVSZNHVKGWBV-DAXSKMNVSA-N -1 3 374.231 3.617 20 0 FHADHM O=C(c1ccc(Cl)c(-c2nnn[n-]2)c1)N1CCC[C@H]1C1CCCCC1 ZINC000826472987 609289202 /nfs/dbraw/zinc/28/92/02/609289202.db2.gz FVFOMQANDXYVGJ-INIZCTEOSA-N -1 3 359.861 3.705 20 0 FHADHM O=C(c1ccc(Cl)c(-c2nn[n-]n2)c1)N1CCC[C@H]1C1CCCCC1 ZINC000826472987 609289203 /nfs/dbraw/zinc/28/92/03/609289203.db2.gz FVFOMQANDXYVGJ-INIZCTEOSA-N -1 3 359.861 3.705 20 0 FHADHM Cn1cc(C=Cc2nc3ccccc3o2)c(-c2ccc(-c3nnn[n-]3)cc2)n1 ZINC000826359692 609307849 /nfs/dbraw/zinc/30/78/49/609307849.db2.gz NZPDCRVQPAUQKR-KHPPLWFESA-N -1 3 369.388 3.579 20 0 FHADHM Cn1cc(C=Cc2nc3ccccc3o2)c(-c2ccc(-c3nn[n-]n3)cc2)n1 ZINC000826359692 609307851 /nfs/dbraw/zinc/30/78/51/609307851.db2.gz NZPDCRVQPAUQKR-KHPPLWFESA-N -1 3 369.388 3.579 20 0 FHADHM Oc1ccc(SCc2ccc(-c3nnn[n-]3)cc2Br)cc1 ZINC000826511558 609310203 /nfs/dbraw/zinc/31/02/03/609310203.db2.gz VHRFEEUSCDHPMS-UHFFFAOYSA-N -1 3 363.240 3.627 20 0 FHADHM Oc1ccc(SCc2ccc(-c3nn[n-]n3)cc2Br)cc1 ZINC000826511558 609310204 /nfs/dbraw/zinc/31/02/04/609310204.db2.gz VHRFEEUSCDHPMS-UHFFFAOYSA-N -1 3 363.240 3.627 20 0 FHADHM Cc1ncccc1NC(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000826330597 609326108 /nfs/dbraw/zinc/32/61/08/609326108.db2.gz AFYYKGSIUIMNEJ-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ncccc1NC(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000826330597 609326110 /nfs/dbraw/zinc/32/61/10/609326110.db2.gz AFYYKGSIUIMNEJ-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM CCOc1ccccc1[C@@H](C)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000825654113 609332784 /nfs/dbraw/zinc/33/27/84/609332784.db2.gz OPHNOGDXVAUSGB-CHWSQXEVSA-N -1 3 355.417 3.816 20 0 FHADHM COc1cccc(F)c1[C@@H](C)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1F ZINC000826217142 609337659 /nfs/dbraw/zinc/33/76/59/609337659.db2.gz ZOWZLFAXTZDXEY-WDEREUQCSA-N -1 3 359.380 3.565 20 0 FHADHM COc1cccc(F)c1[C@@H](C)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000826217142 609337660 /nfs/dbraw/zinc/33/76/60/609337660.db2.gz ZOWZLFAXTZDXEY-WDEREUQCSA-N -1 3 359.380 3.565 20 0 FHADHM Cn1cc(CNc2ccccc2Cl)c(-c2ccc(-c3nnn[n-]3)cc2)n1 ZINC000826362104 609343507 /nfs/dbraw/zinc/34/35/07/609343507.db2.gz DDKAGUMZTXYRDG-UHFFFAOYSA-N -1 3 365.828 3.533 20 0 FHADHM Cn1cc(CNc2ccccc2Cl)c(-c2ccc(-c3nn[n-]n3)cc2)n1 ZINC000826362104 609343509 /nfs/dbraw/zinc/34/35/09/609343509.db2.gz DDKAGUMZTXYRDG-UHFFFAOYSA-N -1 3 365.828 3.533 20 0 FHADHM CCOc1ccc(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2F)cc1OCC ZINC000825643300 609346121 /nfs/dbraw/zinc/34/61/21/609346121.db2.gz LFSVZPMVNDUFDP-GFCCVEGCSA-N -1 3 371.416 3.976 20 0 FHADHM CCOc1ccc(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2F)cc1OCC ZINC000825643300 609346122 /nfs/dbraw/zinc/34/61/22/609346122.db2.gz LFSVZPMVNDUFDP-GFCCVEGCSA-N -1 3 371.416 3.976 20 0 FHADHM C[C@H](Nc1ccc(-c2csnn2)cc1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824651452 609348205 /nfs/dbraw/zinc/34/82/05/609348205.db2.gz ZTOPUZVIFLKLLM-JTQLQIEISA-N -1 3 367.413 3.697 20 0 FHADHM C[C@H](Nc1ccc(-c2csnn2)cc1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824651452 609348206 /nfs/dbraw/zinc/34/82/06/609348206.db2.gz ZTOPUZVIFLKLLM-JTQLQIEISA-N -1 3 367.413 3.697 20 0 FHADHM Cc1nn(-c2ccccc2)cc1N[C@@H]1CCCc2cc(-c3nnn[n-]3)ccc21 ZINC000826332647 609351311 /nfs/dbraw/zinc/35/13/11/609351311.db2.gz BAFRALKCKHAMEC-LJQANCHMSA-N -1 3 371.448 3.850 20 0 FHADHM Cc1nn(-c2ccccc2)cc1N[C@@H]1CCCc2cc(-c3nn[n-]n3)ccc21 ZINC000826332647 609351314 /nfs/dbraw/zinc/35/13/14/609351314.db2.gz BAFRALKCKHAMEC-LJQANCHMSA-N -1 3 371.448 3.850 20 0 FHADHM Cc1nnc(-c2cccc(-c3nnn[n-]3)c2)n1CC1CCC(C)(C)CC1 ZINC000826334951 609379452 /nfs/dbraw/zinc/37/94/52/609379452.db2.gz QLVIYVCVOZVYBK-UHFFFAOYSA-N -1 3 351.458 3.650 20 0 FHADHM Cc1nnc(-c2cccc(-c3nn[n-]n3)c2)n1CC1CCC(C)(C)CC1 ZINC000826334951 609379455 /nfs/dbraw/zinc/37/94/55/609379455.db2.gz QLVIYVCVOZVYBK-UHFFFAOYSA-N -1 3 351.458 3.650 20 0 FHADHM Cc1ccc(-c2ccc(C(=O)N(C)c3ccc(-c4nnn[n-]4)cc3)s2)o1 ZINC000826273755 609390761 /nfs/dbraw/zinc/39/07/61/609390761.db2.gz SHHDMRWTMPJXKG-UHFFFAOYSA-N -1 3 365.418 3.773 20 0 FHADHM Cc1ccc(-c2ccc(C(=O)N(C)c3ccc(-c4nn[n-]n4)cc3)s2)o1 ZINC000826273755 609390764 /nfs/dbraw/zinc/39/07/64/609390764.db2.gz SHHDMRWTMPJXKG-UHFFFAOYSA-N -1 3 365.418 3.773 20 0 FHADHM C[C@@H](Oc1ccccc1NC(=O)c1c[nH]c(-c2nnn[n-]2)c1)c1ccccc1 ZINC000824753450 609462422 /nfs/dbraw/zinc/46/24/22/609462422.db2.gz DDOQYZWWVMBFAO-CYBMUJFWSA-N -1 3 374.404 3.587 20 0 FHADHM C[C@@H](Oc1ccccc1NC(=O)c1c[nH]c(-c2nn[n-]n2)c1)c1ccccc1 ZINC000824753450 609462424 /nfs/dbraw/zinc/46/24/24/609462424.db2.gz DDOQYZWWVMBFAO-CYBMUJFWSA-N -1 3 374.404 3.587 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NCc1cnc(C2CCC2)s1 ZINC000825632500 609477373 /nfs/dbraw/zinc/47/73/73/609477373.db2.gz VFCPLKHNZAFPSD-UHFFFAOYSA-N -1 3 356.455 3.602 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NCc1cnc(C2CCC2)s1 ZINC000825632500 609477374 /nfs/dbraw/zinc/47/73/74/609477374.db2.gz VFCPLKHNZAFPSD-UHFFFAOYSA-N -1 3 356.455 3.602 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NCc1csc(-c2cccs2)n1 ZINC000826186676 609483673 /nfs/dbraw/zinc/48/36/73/609483673.db2.gz GUXAKBNGRBELHB-UHFFFAOYSA-N -1 3 370.463 3.672 20 0 FHADHM Cc1ncccc1CNc1ccc(OCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000826330676 609484371 /nfs/dbraw/zinc/48/43/71/609484371.db2.gz CVSNXHLTKRFEBI-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM Cc1ncccc1CNc1ccc(OCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000826330676 609484374 /nfs/dbraw/zinc/48/43/74/609484374.db2.gz CVSNXHLTKRFEBI-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM Cc1c(NCc2cccc(OCc3ccccn3)c2)cccc1-c1nnn[n-]1 ZINC000826242657 609487043 /nfs/dbraw/zinc/48/70/43/609487043.db2.gz ZTRSCUFPRGTCGQ-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM Cc1c(NCc2cccc(OCc3ccccn3)c2)cccc1-c1nn[n-]n1 ZINC000826242657 609487046 /nfs/dbraw/zinc/48/70/46/609487046.db2.gz ZTRSCUFPRGTCGQ-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM CCOC(=O)Nc1ccc(NCc2ccccc2Cl)cc1-c1nnn[n-]1 ZINC000825553196 609490603 /nfs/dbraw/zinc/49/06/03/609490603.db2.gz MHGHGZHEDPXHOQ-UHFFFAOYSA-N -1 3 372.816 3.701 20 0 FHADHM CCOC(=O)Nc1ccc(NCc2ccccc2Cl)cc1-c1nn[n-]n1 ZINC000825553196 609490604 /nfs/dbraw/zinc/49/06/04/609490604.db2.gz MHGHGZHEDPXHOQ-UHFFFAOYSA-N -1 3 372.816 3.701 20 0 FHADHM Cc1cc(CNc2ccc(OC(C)C)c(-c3nnn[n-]3)c2)cnc1Cl ZINC000826266995 609491813 /nfs/dbraw/zinc/49/18/13/609491813.db2.gz KZYPSIFAPBUPSV-UHFFFAOYSA-N -1 3 358.833 3.623 20 0 FHADHM Cc1cc(CNc2ccc(OC(C)C)c(-c3nn[n-]n3)c2)cnc1Cl ZINC000826266995 609491814 /nfs/dbraw/zinc/49/18/14/609491814.db2.gz KZYPSIFAPBUPSV-UHFFFAOYSA-N -1 3 358.833 3.623 20 0 FHADHM CC(C)Oc1ccc(NCc2ccnc3ccccc23)cc1-c1nnn[n-]1 ZINC000824328905 609492237 /nfs/dbraw/zinc/49/22/37/609492237.db2.gz DLCYXQNZHLTOMY-UHFFFAOYSA-N -1 3 360.421 3.814 20 0 FHADHM CC(C)Oc1ccc(NCc2ccnc3ccccc23)cc1-c1nn[n-]n1 ZINC000824328905 609492238 /nfs/dbraw/zinc/49/22/38/609492238.db2.gz DLCYXQNZHLTOMY-UHFFFAOYSA-N -1 3 360.421 3.814 20 0 FHADHM CC(C)Oc1ccc(NCc2cncc3ccccc32)cc1-c1nnn[n-]1 ZINC000824329843 609492478 /nfs/dbraw/zinc/49/24/78/609492478.db2.gz XCCNUCWHVZAJTK-UHFFFAOYSA-N -1 3 360.421 3.814 20 0 FHADHM CC(C)Oc1ccc(NCc2cncc3ccccc32)cc1-c1nn[n-]n1 ZINC000824329843 609492479 /nfs/dbraw/zinc/49/24/79/609492479.db2.gz XCCNUCWHVZAJTK-UHFFFAOYSA-N -1 3 360.421 3.814 20 0 FHADHM CN(C(=O)c1ccc(-c2ccccc2)o1)c1ccc(-c2nnn[n-]2)cc1F ZINC000825826123 609499425 /nfs/dbraw/zinc/49/94/25/609499425.db2.gz XHCMECOYGSOJOY-UHFFFAOYSA-N -1 3 363.352 3.542 20 0 FHADHM CN(C(=O)c1ccc(-c2ccccc2)o1)c1ccc(-c2nn[n-]n2)cc1F ZINC000825826123 609499428 /nfs/dbraw/zinc/49/94/28/609499428.db2.gz XHCMECOYGSOJOY-UHFFFAOYSA-N -1 3 363.352 3.542 20 0 FHADHM C[C@@H](NC(=O)c1ccc(-c2ccccc2)o1)c1cccc(-c2nnn[n-]2)c1 ZINC000824513283 609503986 /nfs/dbraw/zinc/50/39/86/609503986.db2.gz AQJZFKAZUFCEBZ-CYBMUJFWSA-N -1 3 359.389 3.618 20 0 FHADHM C[C@@H](NC(=O)c1ccc(-c2ccccc2)o1)c1cccc(-c2nn[n-]n2)c1 ZINC000824513283 609503988 /nfs/dbraw/zinc/50/39/88/609503988.db2.gz AQJZFKAZUFCEBZ-CYBMUJFWSA-N -1 3 359.389 3.618 20 0 FHADHM CC[C@@H](C)[C@H](C)C(=O)Nc1nc(-c2ccc(-c3nnn[n-]3)cc2)cs1 ZINC000825049363 609506407 /nfs/dbraw/zinc/50/64/07/609506407.db2.gz BFVQXNCXFFVZJG-MNOVXSKESA-N -1 3 356.455 3.611 20 0 FHADHM CC[C@@H](C)[C@H](C)C(=O)Nc1nc(-c2ccc(-c3nn[n-]n3)cc2)cs1 ZINC000825049363 609506408 /nfs/dbraw/zinc/50/64/08/609506408.db2.gz BFVQXNCXFFVZJG-MNOVXSKESA-N -1 3 356.455 3.611 20 0 FHADHM CC[C@@H](C)[C@H](C)C(=O)N(Cc1ccco1)c1ccccc1-c1nnn[n-]1 ZINC000825051834 609525237 /nfs/dbraw/zinc/52/52/37/609525237.db2.gz SPYAVQOGUMMUSD-KGLIPLIRSA-N -1 3 353.426 3.675 20 0 FHADHM CC[C@@H](C)[C@H](C)C(=O)N(Cc1ccco1)c1ccccc1-c1nn[n-]n1 ZINC000825051834 609525239 /nfs/dbraw/zinc/52/52/39/609525239.db2.gz SPYAVQOGUMMUSD-KGLIPLIRSA-N -1 3 353.426 3.675 20 0 FHADHM Cc1ccnc(N[C@H](c2ccccc2)c2ccc(F)cc2)c1-c1nnn[n-]1 ZINC000826311476 609535328 /nfs/dbraw/zinc/53/53/28/609535328.db2.gz FXELQSBKCBVRMH-GOSISDBHSA-N -1 3 360.396 3.911 20 0 FHADHM Cc1ccnc(N[C@H](c2ccccc2)c2ccc(F)cc2)c1-c1nn[n-]n1 ZINC000826311476 609535330 /nfs/dbraw/zinc/53/53/30/609535330.db2.gz FXELQSBKCBVRMH-GOSISDBHSA-N -1 3 360.396 3.911 20 0 FHADHM CC[C@H](Nc1nccc(C)c1-c1nnn[n-]1)c1nc(C(F)(F)F)cs1 ZINC000825147567 609564673 /nfs/dbraw/zinc/56/46/73/609564673.db2.gz JLDQNXYMZBMNEA-QMMMGPOBSA-N -1 3 369.376 3.609 20 0 FHADHM CC[C@H](Nc1nccc(C)c1-c1nn[n-]n1)c1nc(C(F)(F)F)cs1 ZINC000825147567 609564678 /nfs/dbraw/zinc/56/46/78/609564678.db2.gz JLDQNXYMZBMNEA-QMMMGPOBSA-N -1 3 369.376 3.609 20 0 FHADHM Cc1ccnc(N[C@H](C)c2cccc(OC(F)(F)F)c2)c1-c1nnn[n-]1 ZINC000826311662 609574222 /nfs/dbraw/zinc/57/42/22/609574222.db2.gz KJPMSLXHBJMJAG-SNVBAGLBSA-N -1 3 364.331 3.642 20 0 FHADHM Cc1ccnc(N[C@H](C)c2cccc(OC(F)(F)F)c2)c1-c1nn[n-]n1 ZINC000826311662 609574224 /nfs/dbraw/zinc/57/42/24/609574224.db2.gz KJPMSLXHBJMJAG-SNVBAGLBSA-N -1 3 364.331 3.642 20 0 FHADHM C[C@@H]1CC[C@H](C(F)(F)F)CN1c1ccc2cc(-c3nnn[n-]3)ccc2n1 ZINC000824906694 609576578 /nfs/dbraw/zinc/57/65/78/609576578.db2.gz CWTRFAWZIFAQSN-MFKMUULPSA-N -1 3 362.359 3.582 20 0 FHADHM C[C@@H]1CC[C@H](C(F)(F)F)CN1c1ccc2cc(-c3nn[n-]n3)ccc2n1 ZINC000824906694 609576579 /nfs/dbraw/zinc/57/65/79/609576579.db2.gz CWTRFAWZIFAQSN-MFKMUULPSA-N -1 3 362.359 3.582 20 0 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FHADHM CC(C)c1ccc(S(=O)(=O)[N-]c2ccc(Cn3cccn3)cc2)cc1 ZINC000014230793 935016206 /nfs/dbraw/zinc/01/62/06/935016206.db2.gz AMMDSBXGFJAFBW-UHFFFAOYSA-N -1 3 355.463 3.856 20 0 FHADHM O=C(NCCc1cccc(OCC(F)(F)F)c1)c1cc([O-])ccc1Cl ZINC000511045269 935044663 /nfs/dbraw/zinc/04/46/63/935044663.db2.gz NAIKCAVQPPXOEY-UHFFFAOYSA-N -1 3 373.758 3.959 20 0 FHADHM O=C(Nc1nnc(C(F)(F)F)[n-]1)C1(CCCOCc2ccccc2)CC1 ZINC000892151316 935130981 /nfs/dbraw/zinc/13/09/81/935130981.db2.gz BSDKRBRKCYIWMG-UHFFFAOYSA-N -1 3 368.359 3.539 20 0 FHADHM O=C(Nc1nc(C(F)(F)F)n[n-]1)C1(CCCOCc2ccccc2)CC1 ZINC000892151316 935130982 /nfs/dbraw/zinc/13/09/82/935130982.db2.gz BSDKRBRKCYIWMG-UHFFFAOYSA-N -1 3 368.359 3.539 20 0 FHADHM Cc1sc2[n-]c([C@@H](C)OC(=O)c3cccc(CC#N)c3)nc(=O)c2c1C ZINC000051537549 935447924 /nfs/dbraw/zinc/44/79/24/935447924.db2.gz ININXQQXCAABBD-LLVKDONJSA-N -1 3 367.430 3.586 20 0 FHADHM Cc1ccccc1[C@H](CC(F)(F)F)NC(=O)c1cc(=O)[n-]c(C2CC2)n1 ZINC000582369148 935574752 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Cc1coc(-c2cc(NC(=O)c3cc(F)cc4n[n-]nc43)ccc2C)n1 ZINC000503693066 943335715 /nfs/dbraw/zinc/33/57/15/943335715.db2.gz YJCPLSPYKUYWKC-UHFFFAOYSA-N -1 3 351.341 3.621 20 0 FHADHM C[C@H](Cc1ccc(Cl)cc1Cl)NC(=O)c1cc(=O)[n-]c(C2CC2)n1 ZINC000584663867 943348269 /nfs/dbraw/zinc/34/82/69/943348269.db2.gz OIHYQDSMXABSRJ-SECBINFHSA-N -1 3 366.248 3.727 20 0 FHADHM COCC[C@@H]([N-]S(=O)(=O)c1cccc(Cl)c1Cl)c1ccco1 ZINC000503724046 943354618 /nfs/dbraw/zinc/35/46/18/943354618.db2.gz IFGLXNHKDOIFRT-LLVKDONJSA-N -1 3 364.250 3.643 20 0 FHADHM COc1cccc2c1CCN([C@@H](C(=O)[O-])c1c(F)cccc1Cl)CC2 ZINC000514945771 943396334 /nfs/dbraw/zinc/39/63/34/943396334.db2.gz XMTYALYZCBMVLT-GOSISDBHSA-N -1 3 363.816 3.714 20 0 FHADHM O=C(N[C@@H](c1ccccc1)c1ccc(F)cc1)c1cc(F)cc2n[n-]nc21 ZINC000503986350 943442728 /nfs/dbraw/zinc/44/27/28/943442728.db2.gz MIEMTRJLFPQNIU-SFHVURJKSA-N -1 3 364.355 3.756 20 0 FHADHM O=C(N[C@H](c1ccccc1)c1ccc(F)cc1)c1cc(F)cc2n[n-]nc21 ZINC000503986349 943442743 /nfs/dbraw/zinc/44/27/43/943442743.db2.gz MIEMTRJLFPQNIU-GOSISDBHSA-N -1 3 364.355 3.756 20 0 FHADHM O=C(Nc1cc(Cl)ccc1N1CCCCC1)c1cc(F)cc2n[n-]nc21 ZINC000503975500 943447486 /nfs/dbraw/zinc/44/74/86/943447486.db2.gz WZOKSBOFQFTRLR-UHFFFAOYSA-N -1 3 373.819 3.993 20 0 FHADHM O=S(=O)([N-][C@H](c1c(F)cccc1F)C(F)(F)F)c1ccc(F)cc1 ZINC000503978545 943449794 /nfs/dbraw/zinc/44/97/94/943449794.db2.gz QOFRCNHZPQKFBE-CYBMUJFWSA-N -1 3 369.286 3.686 20 0 FHADHM Cc1nc(C)c(CC(=O)N(C)[C@H](C)c2ccc(Cl)c(Cl)c2)c(=O)[n-]1 ZINC000515083748 943491676 /nfs/dbraw/zinc/49/16/76/943491676.db2.gz LVSWBXRZXIVABC-SNVBAGLBSA-N -1 3 368.264 3.868 20 0 FHADHM Cc1nc(C)c(CC(=O)N(C)[C@@H](C)c2ccc(Cl)c(Cl)c2)c(=O)[n-]1 ZINC000515083747 943491860 /nfs/dbraw/zinc/49/18/60/943491860.db2.gz LVSWBXRZXIVABC-JTQLQIEISA-N -1 3 368.264 3.868 20 0 FHADHM Cc1cc(S(=O)(=O)[N-]c2cc3c(cc2Br)CCC3)c(C)o1 ZINC000435715836 943576631 /nfs/dbraw/zinc/57/66/31/943576631.db2.gz CSODCXLCYRFAPL-UHFFFAOYSA-N -1 3 370.268 3.948 20 0 FHADHM COC(=O)c1ccc(C(=O)N(C)c2ccc(OCc3ccccc3)cc2)[n-]1 ZINC000504299402 943579512 /nfs/dbraw/zinc/57/95/12/943579512.db2.gz NXAPNQGSTZFKRL-UHFFFAOYSA-N -1 3 364.401 3.657 20 0 FHADHM COc1ccc([C@H](CC(=O)[O-])NCc2ccc3c(c2)CCCC3)cc1OC ZINC000417556714 943703349 /nfs/dbraw/zinc/70/33/49/943703349.db2.gz PRYRSSISHLMLKW-IBGZPJMESA-N -1 3 369.461 3.888 20 0 FHADHM COc1ccc([C@@H](CC(=O)[O-])NCc2ccc3c(c2)CCCC3)cc1OC ZINC000417556715 943703591 /nfs/dbraw/zinc/70/35/91/943703591.db2.gz PRYRSSISHLMLKW-LJQANCHMSA-N -1 3 369.461 3.888 20 0 FHADHM COC(=O)c1ccc(C(=O)Nc2ccccc2N2CCc3ccccc32)[n-]1 ZINC000431954818 943721133 /nfs/dbraw/zinc/72/11/33/943721133.db2.gz ZUQCBTIECSVNFV-UHFFFAOYSA-N -1 3 361.401 3.748 20 0 FHADHM CCOc1ccc([N-]S(=O)(=O)c2ccc(F)cc2C)cc1OCC ZINC000042667851 943721682 /nfs/dbraw/zinc/72/16/82/943721682.db2.gz CVQWOWCHWSKPTK-UHFFFAOYSA-N -1 3 353.415 3.732 20 0 FHADHM COc1cccc(C[C@H](NCc2cc(Cl)sc2Cl)C(=O)[O-])c1 ZINC000417582885 943728647 /nfs/dbraw/zinc/72/86/47/943728647.db2.gz 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ZINC000417631256 943769532 /nfs/dbraw/zinc/76/95/32/943769532.db2.gz RVURBSSXCQKQEO-ZFWWWQNUSA-N -1 3 351.324 3.830 20 0 FHADHM CC[C@@H](CSc1ccccc1)NC(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000504730327 943773375 /nfs/dbraw/zinc/77/33/75/943773375.db2.gz JTSXPVRKWOXXNE-AWEZNQCLSA-N -1 3 352.459 3.829 20 0 FHADHM O=C([O-])C[C@@H](CNCc1cnc(CCc2ccccc2)s1)C(F)(F)F ZINC000417636137 943774910 /nfs/dbraw/zinc/77/49/10/943774910.db2.gz XICSITGUOHCPOD-ZDUSSCGKSA-N -1 3 372.412 3.671 20 0 FHADHM CC(C)c1nn(-c2ccccc2)cc1CNC[C@H](CC(=O)[O-])C(F)(F)F ZINC000417624121 943775738 /nfs/dbraw/zinc/77/57/38/943775738.db2.gz KQBIJPDUMPKQFG-AWEZNQCLSA-N -1 3 369.387 3.739 20 0 FHADHM CO[C@@H](CNCc1ccc(-c2ccc(C(F)(F)F)cc2)o1)CC(=O)[O-] ZINC000417639768 943788711 /nfs/dbraw/zinc/78/87/11/943788711.db2.gz UCBVAQDZGPGWIU-CQSZACIVSA-N -1 3 357.328 3.545 20 0 FHADHM CO[C@@H](CNCc1ccc(-c2cccc(C(F)(F)F)c2)o1)CC(=O)[O-] ZINC000417640508 943789626 /nfs/dbraw/zinc/78/96/26/943789626.db2.gz YNSGKDPDEFYDNX-CQSZACIVSA-N -1 3 357.328 3.545 20 0 FHADHM COC(=O)CCSc1ncccc1[N-]C(=O)c1sccc1Cl ZINC000584861402 943800895 /nfs/dbraw/zinc/80/08/95/943800895.db2.gz RCWRUWCUKHNUBA-UHFFFAOYSA-N -1 3 356.856 3.704 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2F)c(Cl)c1 ZINC000584861273 943801873 /nfs/dbraw/zinc/80/18/73/943801873.db2.gz FARLLVFOJGAAOS-UHFFFAOYSA-N -1 3 350.198 3.942 20 0 FHADHM O=S(=O)(CCOCC1CC1)[N-]c1cc(Cl)c(Cl)cc1Cl ZINC000424214956 943802349 /nfs/dbraw/zinc/80/23/49/943802349.db2.gz YTZQPYGSNHZGII-UHFFFAOYSA-N -1 3 358.674 3.815 20 0 FHADHM O=C(COc1cc(F)cc(F)c1)Nc1nnc(-c2cc3ccccc3o2)[n-]1 ZINC000515334481 943803918 /nfs/dbraw/zinc/80/39/18/943803918.db2.gz DVFNKLYJRRTAKH-UHFFFAOYSA-N -1 3 370.315 3.514 20 0 FHADHM O=C(COc1cc(F)cc(F)c1)Nc1n[n-]c(-c2cc3ccccc3o2)n1 ZINC000515334481 943803921 /nfs/dbraw/zinc/80/39/21/943803921.db2.gz DVFNKLYJRRTAKH-UHFFFAOYSA-N -1 3 370.315 3.514 20 0 FHADHM CC(C)(C)Cc1nc2cc(-n3c([O-])c(CC(F)(F)F)[nH]c3=O)ccc2o1 ZINC000516906450 943804076 /nfs/dbraw/zinc/80/40/76/943804076.db2.gz ZJWVVQHTGZGYJL-NSHDSACASA-N -1 3 369.343 3.794 20 0 FHADHM CC[C@@H](NC(=O)CN1CCCC[C@H]1CCC(=O)[O-])c1ccc(Cl)cc1 ZINC000424255902 943808976 /nfs/dbraw/zinc/80/89/76/943808976.db2.gz IKIRHWGKJCQRJZ-DLBZAZTESA-N -1 3 366.889 3.627 20 0 FHADHM Cc1cc(CNCc2ccc(OCC(F)(F)F)cc2)ccc1C(=O)[O-] ZINC000417666615 943810465 /nfs/dbraw/zinc/81/04/65/943810465.db2.gz GOODLKCIDZVDNX-UHFFFAOYSA-N -1 3 353.340 3.924 20 0 FHADHM O=C([O-])CC[C@@H]1CCCCN1CCOc1ccccc1Br ZINC000424260585 943811091 /nfs/dbraw/zinc/81/10/91/943811091.db2.gz OHGKKIQGGQYUTO-ZDUSSCGKSA-N -1 3 356.260 3.547 20 0 FHADHM Cc1nn(Cc2ccccc2)c(C)c1CNCc1ccc(C(=O)[O-])c(C)c1 ZINC000417671774 943814327 /nfs/dbraw/zinc/81/43/27/943814327.db2.gz QWJMWSYRUCYABY-UHFFFAOYSA-N -1 3 363.461 3.845 20 0 FHADHM COC(=O)c1ccc(C(=O)Nc2cccc(COc3cccc(F)c3)c2)[n-]1 ZINC000431956813 943828777 /nfs/dbraw/zinc/82/87/77/943828777.db2.gz YPMVLNNQWHKQGF-UHFFFAOYSA-N -1 3 368.364 3.772 20 0 FHADHM O=S(=O)([N-]c1cccnc1Cl)c1ccc(CC(F)(F)F)cc1 ZINC000189226164 943855230 /nfs/dbraw/zinc/85/52/30/943855230.db2.gz QIOMRVGIGUXCNF-UHFFFAOYSA-N -1 3 350.749 3.641 20 0 FHADHM O=C(CCNC(=O)c1ccc2ccccc2c1)Nc1cc(Cl)ccc1[O-] ZINC000517089072 944006286 /nfs/dbraw/zinc/00/62/86/944006286.db2.gz CIFIRLPCJZWING-UHFFFAOYSA-N -1 3 368.820 3.957 20 0 FHADHM Cc1ccc(OCc2nc(CN[C@H](C)[C@H](C(=O)[O-])C(C)C)cs2)cc1 ZINC000424630723 944021254 /nfs/dbraw/zinc/02/12/54/944021254.db2.gz ZKOIVZWLYMSHRP-RDTXWAMCSA-N -1 3 362.495 3.865 20 0 FHADHM O=C(Nc1ncc(-c2ccc(F)cc2)s1)c1cc(F)cc2n[n-]nc21 ZINC000505096208 944036481 /nfs/dbraw/zinc/03/64/81/944036481.db2.gz IIJCBWZCXGBRDC-UHFFFAOYSA-N -1 3 357.345 3.612 20 0 FHADHM COc1cc(C)c(S(=O)(=O)[N-]c2ccc(OC(C)C)cc2)cc1OC ZINC000515629627 944062050 /nfs/dbraw/zinc/06/20/50/944062050.db2.gz HTQNMCWGEKBEDB-UHFFFAOYSA-N -1 3 365.451 3.600 20 0 FHADHM CCc1ccc([O-])c(C(=O)N2CCC(N3CCc4ccccc43)CC2)c1 ZINC000505140491 944070317 /nfs/dbraw/zinc/07/03/17/944070317.db2.gz 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0 FHADHM Cc1ccccc1-c1cc(=NC(=O)[C@@H]2C[C@H]2c2cc(F)ccc2F)[nH][n-]1 ZINC000439146897 944378944 /nfs/dbraw/zinc/37/89/44/944378944.db2.gz KNTISNMTPAAERX-GOEBONIOSA-N -1 3 353.372 3.827 20 0 FHADHM Cc1ccccc1-c1cc(=NC(=O)[C@@H]2C[C@H]2c2cccc(F)c2F)[nH][n-]1 ZINC000439148596 944379145 /nfs/dbraw/zinc/37/91/45/944379145.db2.gz ZHYDRVGYLHVWCX-LSDHHAIUSA-N -1 3 353.372 3.827 20 0 FHADHM CC[C@@H]1C[C@]1(NC(=O)c1cc(NC(C)=O)ccc1[O-])c1cccc(C)c1 ZINC000436509044 944379944 /nfs/dbraw/zinc/37/99/44/944379944.db2.gz FKVYJZDHTWSGIY-QVKFZJNVSA-N -1 3 352.434 3.714 20 0 FHADHM CC[C@@H]1C[C@@]1(NC(=O)c1cc(OC)c([O-])c(OC)c1)c1cccc(C)c1 ZINC000436514605 944385005 /nfs/dbraw/zinc/38/50/05/944385005.db2.gz SDOZTWWXRBJXKG-VFNWGFHPSA-N -1 3 355.434 3.773 20 0 FHADHM COc1ccc(Oc2cc(CNC(=O)c3ccc(C)cc3[O-])ccn2)cc1 ZINC000436520299 944389443 /nfs/dbraw/zinc/38/94/43/944389443.db2.gz FCNOXMDCUFMGPU-UHFFFAOYSA-N -1 3 364.401 3.827 20 0 FHADHM COc1ccc(C(=O)NCc2ccc(OC3CCCC3)c(OC)c2)c([O-])c1 ZINC000436524746 944392731 /nfs/dbraw/zinc/39/27/31/944392731.db2.gz KMHAZTXFMFNDBH-UHFFFAOYSA-N -1 3 371.433 3.661 20 0 FHADHM C[C@@H](NC(=O)c1cc(=O)c2ccccc2[n-]1)c1ccccc1OC(F)F ZINC000506186815 944403814 /nfs/dbraw/zinc/40/38/14/944403814.db2.gz BPHNNLBEOVCUTO-LLVKDONJSA-N -1 3 358.344 3.621 20 0 FHADHM COc1ccc(N(C)C(=O)c2cc(CCc3ccccc3)ccc2[O-])cn1 ZINC000436549997 944408661 /nfs/dbraw/zinc/40/86/61/944408661.db2.gz HJSHWFMQOACYKN-UHFFFAOYSA-N -1 3 362.429 3.858 20 0 FHADHM Cc1ccc(C(N)=O)cc1NC(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436539221 944417508 /nfs/dbraw/zinc/41/75/08/944417508.db2.gz LEFALLAASIMGFD-UHFFFAOYSA-N -1 3 374.440 3.837 20 0 FHADHM COc1ccc(CC2CCN(C(=O)c3ccc(OC)cc3[O-])CC2)cc1 ZINC000436543797 944421192 /nfs/dbraw/zinc/42/11/92/944421192.db2.gz MZHQKRJJTRLROX-UHFFFAOYSA-N -1 3 355.434 3.504 20 0 FHADHM CCOc1ccc([C@@H](C)NC(=O)c2ccc(C(C)=O)c([O-])c2)cc1OCC ZINC000436560975 944427147 /nfs/dbraw/zinc/42/71/47/944427147.db2.gz AEZWHLYMJBNEDD-CYBMUJFWSA-N -1 3 371.433 3.883 20 0 FHADHM CC(=O)c1ccc(C(=O)NCc2ccc(F)cc2C(F)(F)F)cc1[O-] ZINC000436563042 944429359 /nfs/dbraw/zinc/42/93/59/944429359.db2.gz CIQLRMDHBZHIKF-UHFFFAOYSA-N -1 3 355.287 3.683 20 0 FHADHM COc1ccc([O-])c(-c2nc(COc3ccc(Cl)c(F)c3)no2)c1 ZINC000436566673 944430886 /nfs/dbraw/zinc/43/08/86/944430886.db2.gz XJOYWKMCFJBBLS-UHFFFAOYSA-N -1 3 350.733 3.822 20 0 FHADHM Cc1nn(C)cc1[C@H](C)NC(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436568521 944433078 /nfs/dbraw/zinc/43/30/78/944433078.db2.gz XZZKJLMFZRZJDF-HNNXBMFYSA-N -1 3 363.461 3.710 20 0 FHADHM COc1cc(CC2CN(C(=O)c3ccc(C(C)C)cc3[O-])C2)cc(OC)c1 ZINC000436574498 944437079 /nfs/dbraw/zinc/43/70/79/944437079.db2.gz MDQSEIDNWYENDJ-UHFFFAOYSA-N -1 3 369.461 3.848 20 0 FHADHM C[C@H]1CN(C)c2ccccc2N(C(=O)c2ccc3c(c2[O-])OC(C)(C)C3)C1 ZINC000436592494 944439140 /nfs/dbraw/zinc/43/91/40/944439140.db2.gz VZJWFVQLYMNBFZ-AWEZNQCLSA-N -1 3 366.461 3.838 20 0 FHADHM CC(C)c1ccc(C(=O)N2CCOC[C@@H]2CC(=O)c2ccccc2)c([O-])c1 ZINC000436582206 944445907 /nfs/dbraw/zinc/44/59/07/944445907.db2.gz AOECAWARWUEPOP-SFHVURJKSA-N -1 3 367.445 3.630 20 0 FHADHM COc1ccc(C(=O)NCc2nc(C)c(-c3ccc(Cl)cc3)o2)c([O-])c1 ZINC000436584607 944446945 /nfs/dbraw/zinc/44/69/45/944446945.db2.gz JLGMHQIVQPPTMK-UHFFFAOYSA-N -1 3 372.808 3.948 20 0 FHADHM CCOC(=O)CC(C)(C)N(C)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436619872 944452298 /nfs/dbraw/zinc/45/22/98/944452298.db2.gz SZHSOVDTMPQJMB-UHFFFAOYSA-N -1 3 371.433 3.988 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]CCCC(F)(F)F)c(Cl)c1Cl ZINC000439235886 944466164 /nfs/dbraw/zinc/46/61/64/944466164.db2.gz LMNVCNKEUHXDRS-UHFFFAOYSA-N -1 3 366.188 3.623 20 0 FHADHM Cc1cccc(CN2CCN(C(=O)c3ccc(C(C)C)cc3[O-])CC2)c1 ZINC000436633946 944473789 /nfs/dbraw/zinc/47/37/89/944473789.db2.gz JDPQKJFBQDDBQI-UHFFFAOYSA-N -1 3 352.478 3.782 20 0 FHADHM CCc1ccc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2[O-])cc1CC ZINC000436621540 944478831 /nfs/dbraw/zinc/47/88/31/944478831.db2.gz AIDDLPBBHMHDFG-LJQANCHMSA-N -1 3 366.461 3.760 20 0 FHADHM CCCCOc1ccc(C(=O)N2CC[C@@H](n3cc(Cl)cn3)C2)c([O-])c1 ZINC000436621276 944479158 /nfs/dbraw/zinc/47/91/58/944479158.db2.gz VMEDEAJDIYPHET-CQSZACIVSA-N -1 3 363.845 3.508 20 0 FHADHM CC(C)(c1nnc(NC(=O)c2c([O-])cccc2O)s1)c1ccccc1 ZINC000436649454 944480990 /nfs/dbraw/zinc/48/09/90/944480990.db2.gz SNYUCXWOHUWHDM-UHFFFAOYSA-N -1 3 355.419 3.528 20 0 FHADHM COc1cc([C@@H](C)NC(=O)c2c([O-])cccc2O)ccc1OCC(C)C ZINC000436649369 944481010 /nfs/dbraw/zinc/48/10/10/944481010.db2.gz RIFJMJFGMQWPHW-CYBMUJFWSA-N -1 3 359.422 3.632 20 0 FHADHM CCC1(C)CN(C(=O)C[C@@H](NC(=O)c2ccc([O-])cc2)c2ccccc2)C1 ZINC000436652849 944483498 /nfs/dbraw/zinc/48/34/98/944483498.db2.gz AODGEGDIEXYELE-LJQANCHMSA-N -1 3 366.461 3.512 20 0 FHADHM O=C(NCCc1csc(-c2ccc(Cl)cc2)n1)c1c([O-])cccc1O ZINC000436648040 944495252 /nfs/dbraw/zinc/49/52/52/944495252.db2.gz PAHFWMBJVLEHRE-UHFFFAOYSA-N -1 3 374.849 3.847 20 0 FHADHM COc1ccc(F)cc1-c1csc(NC(=O)c2c([O-])cccc2O)n1 ZINC000436647874 944495345 /nfs/dbraw/zinc/49/53/45/944495345.db2.gz NHPVEICGJBPSJU-UHFFFAOYSA-N -1 3 360.366 3.621 20 0 FHADHM O=C(NCc1ccc(COCc2ccccc2)cc1)c1c([O-])cccc1O ZINC000436646142 944495423 /nfs/dbraw/zinc/49/54/23/944495423.db2.gz GIRMUEKGOCGFAR-UHFFFAOYSA-N -1 3 363.413 3.745 20 0 FHADHM CC[C@@H](c1nnc(NC(=O)c2c([O-])cccc2O)s1)c1ccccc1 ZINC000436646165 944495596 /nfs/dbraw/zinc/49/55/96/944495596.db2.gz FKDAIKJHLXVDEF-GFCCVEGCSA-N -1 3 355.419 3.744 20 0 FHADHM CC(=O)c1ccc(C(=O)Nc2cnn(-c3cc(C)ccc3C)c2C)cc1[O-] ZINC000436665240 944500373 /nfs/dbraw/zinc/50/03/73/944500373.db2.gz MQINYROEQFKCLJ-UHFFFAOYSA-N -1 3 363.417 3.958 20 0 FHADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CC[C@H](COC(F)F)C1 ZINC000436666144 944501527 /nfs/dbraw/zinc/50/15/27/944501527.db2.gz PLPUXBPZLGHNTM-INIZCTEOSA-N -1 3 361.388 3.684 20 0 FHADHM COc1ccc(C(=O)N[C@H](C)COc2ccccc2C(F)(F)F)c([O-])c1 ZINC000436677146 944515671 /nfs/dbraw/zinc/51/56/71/944515671.db2.gz BPBWKICPLHUFLZ-LLVKDONJSA-N -1 3 369.339 3.617 20 0 FHADHM Cc1nc(CNC(=O)c2ccc(O)cc2[O-])oc1-c1ccc(Cl)cc1 ZINC000436680683 944519385 /nfs/dbraw/zinc/51/93/85/944519385.db2.gz PFCXEPUXNZIZBS-UHFFFAOYSA-N -1 3 358.781 3.645 20 0 FHADHM COC[C@@H](c1ccc(Cl)cc1)N(C)C(=O)c1ccc(C(C)=O)c([O-])c1 ZINC000436682546 944522611 /nfs/dbraw/zinc/52/26/11/944522611.db2.gz QOLVSFXNGCRAFS-KRWDZBQOSA-N -1 3 361.825 3.708 20 0 FHADHM COc1cccc(C(=O)Nc2n[nH]c(-c3cccc4ccccc43)n2)c1[O-] ZINC000436684179 944524019 /nfs/dbraw/zinc/52/40/19/944524019.db2.gz YHYDOWJNUKMOIL-UHFFFAOYSA-N -1 3 360.373 3.591 20 0 FHADHM COc1cc(-c2nc(-c3cccc(CSC)c3)no2)cc(OC)c1[O-] ZINC000436692686 944531062 /nfs/dbraw/zinc/53/10/62/944531062.db2.gz ZHVQIBGZHFGMNI-UHFFFAOYSA-N -1 3 358.419 3.989 20 0 FHADHM CCCCOc1ccc(CN2CCN(C(=O)c3ccccc3[O-])CC2)cc1 ZINC000436697797 944536908 /nfs/dbraw/zinc/53/69/08/944536908.db2.gz NWEODMIQDFXMMZ-UHFFFAOYSA-N -1 3 368.477 3.529 20 0 FHADHM CCN(Cc1ccccc1Br)[C@@H](C)c1nc(C)cc(=O)[n-]1 ZINC000439327120 944540277 /nfs/dbraw/zinc/54/02/77/944540277.db2.gz USUACNWPVJQJGE-LBPRGKRZSA-N -1 3 350.260 3.836 20 0 FHADHM [O-]c1ccccc1-c1nc(CSc2nc3cc(F)c(F)cc3[nH]2)no1 ZINC000436704188 944544962 /nfs/dbraw/zinc/54/49/62/944544962.db2.gz JGQMCCANBLLOQX-UHFFFAOYSA-N -1 3 360.345 3.889 20 0 FHADHM Cc1ccc(C(=O)N[C@H](c2cncc(Br)c2)C2CC2)c([O-])c1 ZINC000436713326 944552454 /nfs/dbraw/zinc/55/24/54/944552454.db2.gz DVCBPLJKPBLZDI-INIZCTEOSA-N -1 3 361.239 3.739 20 0 FHADHM Cc1ccc(C(=O)N2CCN(c3cccc4cnccc43)C[C@H]2C)c([O-])c1 ZINC000436714060 944552773 /nfs/dbraw/zinc/55/27/73/944552773.db2.gz DWJCOJKLUQTHMK-MRXNPFEDSA-N -1 3 361.445 3.600 20 0 FHADHM COCC[C@H](NC(=O)c1ccc(O)cc1[O-])c1ccc(Cl)c(Cl)c1 ZINC000436712311 944553003 /nfs/dbraw/zinc/55/30/03/944553003.db2.gz NKEWPLROVIEKDL-HNNXBMFYSA-N -1 3 370.232 3.912 20 0 FHADHM CCCCOc1ccc(C(=O)N2CCOc3cc(OC)ccc3C2)c([O-])c1 ZINC000436716034 944554275 /nfs/dbraw/zinc/55/42/75/944554275.db2.gz NWLCSOOCZFWHAY-UHFFFAOYSA-N -1 3 371.433 3.615 20 0 FHADHM COc1ccc(NC(=O)c2cc(C)ccc2[O-])cc1OCc1cccnc1 ZINC000436719807 944558615 /nfs/dbraw/zinc/55/86/15/944558615.db2.gz BPCRQMNDIJYLHH-UHFFFAOYSA-N -1 3 364.401 3.936 20 0 FHADHM CN(Cc1ccco1)Cc1ccccc1CNC(=O)c1ccccc1[O-] ZINC000436720820 944560484 /nfs/dbraw/zinc/56/04/84/944560484.db2.gz VEJJGHNGEMEGET-UHFFFAOYSA-N -1 3 350.418 3.547 20 0 FHADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CCC[C@@]12CCOC2 ZINC000436738849 944567944 /nfs/dbraw/zinc/56/79/44/944567944.db2.gz UZUPNPVXLUCPSP-QFIPXVFZSA-N -1 3 351.446 3.573 20 0 FHADHM CCCCOc1ccc(CCNC(=O)c2cc(OC)c([O-])c(OC)c2)cc1 ZINC000436740465 944569672 /nfs/dbraw/zinc/56/96/72/944569672.db2.gz QSQUCWAETNTFJJ-UHFFFAOYSA-N -1 3 373.449 3.561 20 0 FHADHM O=C(N[C@H]1CCCc2[nH]c(=O)ccc21)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436757527 944580861 /nfs/dbraw/zinc/58/08/61/944580861.db2.gz IHLSGHBRGFGVOY-FQEVSTJZSA-N -1 3 374.440 3.891 20 0 FHADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1CCC(CCCO)CC1 ZINC000436752072 944591076 /nfs/dbraw/zinc/59/10/76/944591076.db2.gz WZHRCMKLKSMORD-UHFFFAOYSA-N -1 3 355.434 3.809 20 0 FHADHM CCN(Cc1ccccc1NC(=O)c1cc2c(cc1[O-])CCCC2)C(C)=O ZINC000436756599 944600621 /nfs/dbraw/zinc/60/06/21/944600621.db2.gz RYVQURPMEALAIE-UHFFFAOYSA-N -1 3 366.461 3.892 20 0 FHADHM Cc1nc2sc3c(c2c(NCc2cnc(C)[n-]c2=O)n1)CC[C@H](C)C3 ZINC000517778028 944601461 /nfs/dbraw/zinc/60/14/61/944601461.db2.gz QOUQRFVNRVOJSB-VIFPVBQESA-N -1 3 355.467 3.541 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc2c(c1)C(=O)[N-]C2=O)c1cc2ccccc2s1 ZINC000170962712 944632575 /nfs/dbraw/zinc/63/25/75/944632575.db2.gz QKIYAUFDZCJPEV-SNVBAGLBSA-N -1 3 365.414 3.668 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)NCCCc2ccc(C(C)C)cc2)c1 ZINC000436792768 944643405 /nfs/dbraw/zinc/64/34/05/944643405.db2.gz XNSTUQUYKPHOHD-UHFFFAOYSA-N -1 3 354.450 3.837 20 0 FHADHM COc1cccc(C(=O)Nc2ccc(-n3nc(C)cc3C)c(F)c2)c1[O-] ZINC000436797000 944648630 /nfs/dbraw/zinc/64/86/30/944648630.db2.gz LSZREJKFTSZQQW-UHFFFAOYSA-N -1 3 355.369 3.595 20 0 FHADHM CCc1ccc(C(=O)N[C@H](c2nccn2C)c2ccc(Cl)cc2)c([O-])c1 ZINC000436815720 944651552 /nfs/dbraw/zinc/65/15/52/944651552.db2.gz XIDWMJZSHBZKSC-SFHVURJKSA-N -1 3 369.852 3.861 20 0 FHADHM Cc1ccc(C(=O)Nc2cccc(-c3nnc4n3CCCCC4)c2)c([O-])c1 ZINC000436805559 944660222 /nfs/dbraw/zinc/66/02/22/944660222.db2.gz FLVZIEOOVTZYMO-UHFFFAOYSA-N -1 3 362.433 3.938 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@H]3CCCC[C@@H]3OC)c2)n1 ZINC000293065468 944666637 /nfs/dbraw/zinc/66/66/37/944666637.db2.gz LITVQDXTZGHSAF-IRXDYDNUSA-N -1 3 355.438 3.555 20 0 FHADHM COCCN(Cc1ccc(Br)s1)C(=O)c1ccccc1[O-] ZINC000436812748 944669562 /nfs/dbraw/zinc/66/95/62/944669562.db2.gz CBSBCDMYFBCVBC-UHFFFAOYSA-N -1 3 370.268 3.505 20 0 FHADHM Cc1cc(C)c(C(=O)CCCC(=O)N=c2cc([C@@H]3CCCO3)[n-][nH]2)c(C)c1 ZINC000473848714 944677949 /nfs/dbraw/zinc/67/79/49/944677949.db2.gz SUNPNEHFHXRJCH-SFHVURJKSA-N -1 3 369.465 3.600 20 0 FHADHM CCCCN(Cc1nc2c3ccccc3oc2c(=O)[n-]1)CC(F)(F)F ZINC000112340269 944685816 /nfs/dbraw/zinc/68/58/16/944685816.db2.gz PWQGGEDWSRQXEY-UHFFFAOYSA-N -1 3 353.344 3.834 20 0 FHADHM CCCc1c(NC(=O)c2cccc(OC)c2[O-])cnn1-c1cccc(F)c1 ZINC000436839539 944706091 /nfs/dbraw/zinc/70/60/91/944706091.db2.gz QCHUBKIJPQRAIH-UHFFFAOYSA-N -1 3 369.396 3.930 20 0 FHADHM CCc1ccc([C@@H]2CCN(C(=O)c3cc(OC)c([O-])c(OC)c3)C2)cc1 ZINC000436856452 944706099 /nfs/dbraw/zinc/70/60/99/944706099.db2.gz YDSMUDJDLCNIDW-MRXNPFEDSA-N -1 3 355.434 3.602 20 0 FHADHM C[C@@H](CN(C)C(=O)c1ccc(O)cc1[O-])Oc1ccc(Cl)c(Cl)c1 ZINC000436840510 944706120 /nfs/dbraw/zinc/70/61/20/944706120.db2.gz XACXUFVEYRCWPK-JTQLQIEISA-N -1 3 370.232 3.944 20 0 FHADHM C[C@H](C(=O)[O-])[C@@H](NCc1cnn(Cc2ccc(F)cc2)c1)c1ccccc1 ZINC000426714697 944714731 /nfs/dbraw/zinc/71/47/31/944714731.db2.gz DVUWVIGTAVFKTN-MGPUTAFESA-N -1 3 367.424 3.622 20 0 FHADHM CCO[C@H](C(=O)Nc1ccc(Br)cc1[O-])c1ccccc1 ZINC000516316294 944717206 /nfs/dbraw/zinc/71/72/06/944717206.db2.gz MUSXTGVPUJVDPP-HNNXBMFYSA-N -1 3 350.212 3.871 20 0 FHADHM O=C([O-])[C@@H](NCc1ccc(-n2ccnc2)cc1)c1ccc(Cl)c(F)c1 ZINC000426720113 944721179 /nfs/dbraw/zinc/72/11/79/944721179.db2.gz KQVINTYNGJRCIE-KRWDZBQOSA-N -1 3 359.788 3.580 20 0 FHADHM CSc1cc2c(cc1CN[C@H](c1ccccc1)[C@H](C)C(=O)[O-])OCCO2 ZINC000426722909 944723535 /nfs/dbraw/zinc/72/35/35/944723535.db2.gz JJDDLVQPWLXEID-DJJJIMSYSA-N -1 3 373.474 3.731 20 0 FHADHM COc1cc(CN[C@@H](C(=O)[O-])c2ccc(C)cc2)c(SC)cc1OC ZINC000426710053 944732424 /nfs/dbraw/zinc/73/24/24/944732424.db2.gz HFPYDDQUSFLHRD-GOSISDBHSA-N -1 3 361.463 3.650 20 0 FHADHM Cc1ccc([C@@H](NCc2ccc(F)c(Br)c2)C(=O)[O-])cc1 ZINC000426712968 944735587 /nfs/dbraw/zinc/73/55/87/944735587.db2.gz ZTWUKQSWFVNNPB-OAHLLOKOSA-N -1 3 352.203 3.812 20 0 FHADHM Cc1cc(C(=O)Nc2cc(Br)ccc2[O-])nn1[C@H](C)C1CC1 ZINC000436871725 944738710 /nfs/dbraw/zinc/73/87/10/944738710.db2.gz KQFICCJZDNOPDU-SNVBAGLBSA-N -1 3 364.243 3.883 20 0 FHADHM CO[N-]C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 ZINC000053720355 944742974 /nfs/dbraw/zinc/74/29/74/944742974.db2.gz ORXCBCJENGCROF-RAXLEYEMSA-N -1 3 369.402 3.813 20 0 FHADHM O=C([O-])[C@H](CSCCc1ccccc1)NCc1ccc(F)cc1Cl ZINC000426734454 944746474 /nfs/dbraw/zinc/74/64/74/944746474.db2.gz AKXCEHZDYSPTPJ-KRWDZBQOSA-N -1 3 367.873 3.998 20 0 FHADHM CCOc1ccc(NC(=O)c2c([O-])cccc2O)cc1Br ZINC000436858795 944746490 /nfs/dbraw/zinc/74/64/90/944746490.db2.gz HWEIDRZALQKLRS-UHFFFAOYSA-N -1 3 352.184 3.511 20 0 FHADHM COc1ccc(C(=O)NCc2ccnc(Oc3ccccc3)c2)c([O-])c1 ZINC000047166338 944760281 /nfs/dbraw/zinc/76/02/81/944760281.db2.gz UFKVJQAYFIBVOL-UHFFFAOYSA-N -1 3 350.374 3.518 20 0 FHADHM Cc1c([O-])ccc2c(CN3CCO[C@@H](c4ccccc4F)C3)cc(=O)oc12 ZINC000066846930 944762087 /nfs/dbraw/zinc/76/20/87/944762087.db2.gz IYJKGZGRTNQWEM-LJQANCHMSA-N -1 3 369.392 3.520 20 0 FHADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1C[C@H](CO)c2ccccc21 ZINC000436891718 944767271 /nfs/dbraw/zinc/76/72/71/944767271.db2.gz HALKMRQSXMFKQP-LJQANCHMSA-N -1 3 373.452 3.914 20 0 FHADHM C[C@@H](C(=O)[O-])[C@@H](NCc1cc(Cl)c2c(c1)OCCO2)c1ccccc1 ZINC000426751187 944770182 /nfs/dbraw/zinc/77/01/82/944770182.db2.gz 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CCC(=CC(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1)c1ccc(C)cc1 ZINC000736304928 944793691 /nfs/dbraw/zinc/79/36/91/944793691.db2.gz SCPXQMKQFHGYRB-LGMDPLHJSA-N -1 3 361.449 3.627 20 0 FHADHM CCC(=CC(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1)c1ccc(C)cc1 ZINC000736304928 944793705 /nfs/dbraw/zinc/79/37/05/944793705.db2.gz SCPXQMKQFHGYRB-LGMDPLHJSA-N -1 3 361.449 3.627 20 0 FHADHM CCCc1cccc(CN[C@H](CC(=O)[O-])c2ccc(OC)c(OC)c2)c1 ZINC000426781458 944798758 /nfs/dbraw/zinc/79/87/58/944798758.db2.gz CCQFRGWKXWEMNW-GOSISDBHSA-N -1 3 357.450 3.962 20 0 FHADHM COc1cccc([C@H](CC(=O)[O-])NCc2cccc(Br)c2)c1 ZINC000426788551 944812171 /nfs/dbraw/zinc/81/21/71/944812171.db2.gz NNGSXAPELVNFOC-INIZCTEOSA-N -1 3 364.239 3.763 20 0 FHADHM COc1cccc([C@@H](CC(=O)[O-])NCc2cc(C)c3ncccc3c2)c1 ZINC000426789701 944813232 /nfs/dbraw/zinc/81/32/32/944813232.db2.gz XAKRRGYPMFHRCS-LJQANCHMSA-N -1 3 350.418 3.857 20 0 FHADHM COc1cc(C)c(CN[C@H](CC(=O)[O-])c2cccc(Cl)c2)cc1OC ZINC000426797346 944819934 /nfs/dbraw/zinc/81/99/34/944819934.db2.gz 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374.231 3.891 20 0 FHADHM Cc1nn(-c2ccccc2)cc1C(=O)N=c1cc(-c2ccccc2C)[n-][nH]1 ZINC000523298717 947076115 /nfs/dbraw/zinc/07/61/15/947076115.db2.gz BERTUACUVYOIDU-UHFFFAOYSA-N -1 3 357.417 3.553 20 0 FHADHM Cc1sc(C(=O)[O-])cc1CN1CC[C@H](OCCCc2ccccc2)C1 ZINC000652436861 947119013 /nfs/dbraw/zinc/11/90/13/947119013.db2.gz GVWUQOWGRVCMEU-SFHVURJKSA-N -1 3 359.491 3.978 20 0 FHADHM CN(Cc1cc(F)cc(F)c1)Cc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000444699661 947124396 /nfs/dbraw/zinc/12/43/96/947124396.db2.gz DPSFPMDYXSSHHD-UHFFFAOYSA-N -1 3 355.344 3.992 20 0 FHADHM CCCCC[C@H](CC)C(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000825268643 947140770 /nfs/dbraw/zinc/14/07/70/947140770.db2.gz XDXLMBUAXOWMKR-INIZCTEOSA-N -1 3 355.486 3.964 20 0 FHADHM CCCCC[C@H](CC)C(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000825268643 947140776 /nfs/dbraw/zinc/14/07/76/947140776.db2.gz XDXLMBUAXOWMKR-INIZCTEOSA-N -1 3 355.486 3.964 20 0 FHADHM CCCc1c(NCc2ccc(-c3nnn[n-]3)cc2)cnn1-c1ccccc1 ZINC000825348641 947161393 /nfs/dbraw/zinc/16/13/93/947161393.db2.gz ULQYOSWFCOSTQS-UHFFFAOYSA-N -1 3 359.437 3.617 20 0 FHADHM CCCc1c(NCc2ccc(-c3nn[n-]n3)cc2)cnn1-c1ccccc1 ZINC000825348641 947161400 /nfs/dbraw/zinc/16/14/00/947161400.db2.gz ULQYOSWFCOSTQS-UHFFFAOYSA-N -1 3 359.437 3.617 20 0 FHADHM CCN(C(=O)c1cc2occc2s1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825379715 947168717 /nfs/dbraw/zinc/16/87/17/947168717.db2.gz KDDWKLVVHTYBSB-UHFFFAOYSA-N -1 3 373.825 3.995 20 0 FHADHM CCN(C(=O)c1cc2occc2s1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825379715 947168719 /nfs/dbraw/zinc/16/87/19/947168719.db2.gz KDDWKLVVHTYBSB-UHFFFAOYSA-N -1 3 373.825 3.995 20 0 FHADHM COc1ccc(SCCCC(=O)Nc2n[n-]c(-c3ccc(C)o3)n2)cc1 ZINC000444746013 947182758 /nfs/dbraw/zinc/18/27/58/947182758.db2.gz WPUBLLLOAVJTRW-UHFFFAOYSA-N -1 3 372.450 3.893 20 0 FHADHM CCCOc1ccc(OCCN2Cc3ccccc3[C@H](C(=O)[O-])C2)cc1 ZINC000652471273 947197376 /nfs/dbraw/zinc/19/73/76/947197376.db2.gz YVRXVAXDZWBGER-HXUWFJFHSA-N -1 3 355.434 3.538 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@H](C)Cc2ccsc2)cc1-c1nnn[n-]1 ZINC000825545766 947215615 /nfs/dbraw/zinc/21/56/15/947215615.db2.gz WKHGDNFASGIZDD-LLVKDONJSA-N -1 3 372.454 3.540 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@H](C)Cc2ccsc2)cc1-c1nn[n-]n1 ZINC000825545766 947215621 /nfs/dbraw/zinc/21/56/21/947215621.db2.gz WKHGDNFASGIZDD-LLVKDONJSA-N -1 3 372.454 3.540 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N(C)[C@H]3CCc4ccccc4C3)nc2)n1 ZINC000301252183 947252301 /nfs/dbraw/zinc/25/23/01/947252301.db2.gz DNKGZNXJYXJGGB-IBGZPJMESA-N -1 3 360.461 3.800 20 0 FHADHM O=c1cc(CN2CC[C@H]2c2ccc(Br)cc2)nc(C2CC2)[n-]1 ZINC000662094632 947255213 /nfs/dbraw/zinc/25/52/13/947255213.db2.gz CHNIMQODKVRBKK-HNNXBMFYSA-N -1 3 360.255 3.769 20 0 FHADHM CCOc1cc(Cl)ccc1C(=O)N(CC)c1ccc(-c2nnn[n-]2)cc1 ZINC000825615779 947259879 /nfs/dbraw/zinc/25/98/79/947259879.db2.gz KGNKQMJJNIFYAY-UHFFFAOYSA-N -1 3 371.828 3.586 20 0 FHADHM CCOc1cc(Cl)ccc1C(=O)N(CC)c1ccc(-c2nn[n-]n2)cc1 ZINC000825615779 947259890 /nfs/dbraw/zinc/25/98/90/947259890.db2.gz KGNKQMJJNIFYAY-UHFFFAOYSA-N -1 3 371.828 3.586 20 0 FHADHM CCS[C@@H]1CCCCN(c2ccc(-c3nc(CC)cc(=O)[n-]3)cn2)C1 ZINC000301268773 947260057 /nfs/dbraw/zinc/26/00/57/947260057.db2.gz XBLXEPWAXPLDEM-MRXNPFEDSA-N -1 3 358.511 3.919 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)c1ccc(C)c(C)c1Cl ZINC000825626553 947265236 /nfs/dbraw/zinc/26/52/36/947265236.db2.gz MNAQGRMPSQXWGJ-UHFFFAOYSA-N -1 3 371.828 3.788 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)c1ccc(C)c(C)c1Cl ZINC000825626553 947265239 /nfs/dbraw/zinc/26/52/39/947265239.db2.gz MNAQGRMPSQXWGJ-UHFFFAOYSA-N -1 3 371.828 3.788 20 0 FHADHM CSc1nc(-c2ccco2)nc(C)c1C(=O)[N-]c1nnc(C2CC2)s1 ZINC000248038948 947279459 /nfs/dbraw/zinc/27/94/59/947279459.db2.gz OHSJLAKXTKIPPV-UHFFFAOYSA-N -1 3 373.463 3.748 20 0 FHADHM C=C/C=C/CCNC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC001573316799 947283569 /nfs/dbraw/zinc/28/35/69/947283569.db2.gz ZKIDXLMUONJXCI-ONEGZZNKSA-N -1 3 361.405 3.521 20 0 FHADHM C=C/C=C/CCNC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC001573316799 947283578 /nfs/dbraw/zinc/28/35/78/947283578.db2.gz ZKIDXLMUONJXCI-ONEGZZNKSA-N -1 3 361.405 3.521 20 0 FHADHM CCc1noc([C@@H](C)Sc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)n1 ZINC000825771783 947323789 /nfs/dbraw/zinc/32/37/89/947323789.db2.gz RTTPRZZOVBATOR-SSDOTTSWSA-N -1 3 370.360 3.684 20 0 FHADHM CCc1noc([C@@H](C)Sc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)n1 ZINC000825771783 947323804 /nfs/dbraw/zinc/32/38/04/947323804.db2.gz RTTPRZZOVBATOR-SSDOTTSWSA-N -1 3 370.360 3.684 20 0 FHADHM O=S(=O)([N-]CC1(c2cccc(F)c2)CC1)c1cccc(Cl)c1F ZINC000523520840 947349421 /nfs/dbraw/zinc/34/94/21/947349421.db2.gz GEJSMJRRATVBKC-UHFFFAOYSA-N -1 3 357.809 3.628 20 0 FHADHM CCOC(=O)c1ccc(NC(=O)[C@H]2CCCC[C@H]2C(F)(F)F)c([O-])c1 ZINC000536337344 947534605 /nfs/dbraw/zinc/53/46/05/947534605.db2.gz XLIAWFYQCPNCOX-NWDGAFQWSA-N -1 3 359.344 3.876 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)Nc1csc2ccccc12 ZINC000826186372 947571528 /nfs/dbraw/zinc/57/15/28/947571528.db2.gz PRKMJTIWMFOFKC-UHFFFAOYSA-N -1 3 366.406 3.734 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)Nc1csc2ccccc12 ZINC000826186372 947571533 /nfs/dbraw/zinc/57/15/33/947571533.db2.gz PRKMJTIWMFOFKC-UHFFFAOYSA-N -1 3 366.406 3.734 20 0 FHADHM O=C([O-])CC[C@H](CNCc1cc(Br)ccc1F)C(F)(F)F ZINC000663262150 947583441 /nfs/dbraw/zinc/58/34/41/947583441.db2.gz PZODTFFNUNKQCH-SECBINFHSA-N -1 3 372.156 3.721 20 0 FHADHM O=C([O-])CC[C@@H](CNCc1cccc(Br)c1F)C(F)(F)F ZINC000663261551 947584851 /nfs/dbraw/zinc/58/48/51/947584851.db2.gz KWWFIOMDCPYBQW-VIFPVBQESA-N -1 3 372.156 3.721 20 0 FHADHM O=S(=O)([N-]CCC[C@@H]1CCCC[C@@H]1O)c1cccc(Cl)c1Cl ZINC000127880863 947591683 /nfs/dbraw/zinc/59/16/83/947591683.db2.gz IEEBUSOOHHDHGD-AAEUAGOBSA-N -1 3 366.310 3.603 20 0 FHADHM O=C([O-])[C@H]1C=C[C@@H](NCc2ccccc2OCc2ccc(F)cc2F)C1 ZINC000663264966 947598046 /nfs/dbraw/zinc/59/80/46/947598046.db2.gz ZSTAWWZGMNADPT-SUMWQHHRSA-N -1 3 359.372 3.663 20 0 FHADHM CSc1ccc(Cl)c(C(=O)[N-]NC(=O)c2ccc(Cl)cc2)c1 ZINC000027770626 947614112 /nfs/dbraw/zinc/61/41/12/947614112.db2.gz IAOQDQWXPIPQNL-UHFFFAOYSA-N -1 3 355.246 3.790 20 0 FHADHM COc1ccc(OC)c(CSc2cccc(Cl)c2-c2nnn[n-]2)c1 ZINC000826210801 947615114 /nfs/dbraw/zinc/61/51/14/947615114.db2.gz FTPXWYGKPWLCCH-UHFFFAOYSA-N -1 3 362.842 3.830 20 0 FHADHM COc1ccc(OC)c(CSc2cccc(Cl)c2-c2nn[n-]n2)c1 ZINC000826210801 947615119 /nfs/dbraw/zinc/61/51/19/947615119.db2.gz FTPXWYGKPWLCCH-UHFFFAOYSA-N -1 3 362.842 3.830 20 0 FHADHM COc1ccc([O-])c(C(=O)Nc2cccc3c2CN(c2nccs2)C3)c1 ZINC000536349698 947627421 /nfs/dbraw/zinc/62/74/21/947627421.db2.gz WQWQHZOONFFCQC-UHFFFAOYSA-N -1 3 367.430 3.630 20 0 FHADHM C=Cc1ccc(C(=O)N[C@@H](c2cccc(-c3nnn[n-]3)c2)C(F)(F)F)cc1 ZINC001573354762 947636012 /nfs/dbraw/zinc/63/60/12/947636012.db2.gz HKCVICPZYCBAKL-HNNXBMFYSA-N -1 3 373.338 3.543 20 0 FHADHM C=Cc1ccc(C(=O)N[C@@H](c2cccc(-c3nn[n-]n3)c2)C(F)(F)F)cc1 ZINC001573354762 947636015 /nfs/dbraw/zinc/63/60/15/947636015.db2.gz HKCVICPZYCBAKL-HNNXBMFYSA-N -1 3 373.338 3.543 20 0 FHADHM CC(=CC(=O)Nc1cc(-c2nnn[n-]2)ccc1C)c1cccc(Cl)c1 ZINC001573362077 947700622 /nfs/dbraw/zinc/70/06/22/947700622.db2.gz INYKTDNTOGNSAU-XYOKQWHBSA-N -1 3 353.813 3.871 20 0 FHADHM CC(=CC(=O)Nc1cc(-c2nn[n-]n2)ccc1C)c1cccc(Cl)c1 ZINC001573362077 947700632 /nfs/dbraw/zinc/70/06/32/947700632.db2.gz INYKTDNTOGNSAU-XYOKQWHBSA-N -1 3 353.813 3.871 20 0 FHADHM CC(=CC(=O)Nc1ccc(OC(C)C)c(-c2nnn[n-]2)c1)c1ccccc1 ZINC001573363971 947716657 /nfs/dbraw/zinc/71/66/57/947716657.db2.gz ORNGLZLZCMYPRJ-SDNWHVSQSA-N -1 3 363.421 3.696 20 0 FHADHM CC(=CC(=O)Nc1ccc(OC(C)C)c(-c2nn[n-]n2)c1)c1ccccc1 ZINC001573363971 947716664 /nfs/dbraw/zinc/71/66/64/947716664.db2.gz ORNGLZLZCMYPRJ-SDNWHVSQSA-N -1 3 363.421 3.696 20 0 FHADHM COc1cc(Cl)c(C)cc1NC(=O)Cc1noc(-c2ccccc2[O-])n1 ZINC000445315750 947718266 /nfs/dbraw/zinc/71/82/66/947718266.db2.gz FEXAZGXSLCHOGF-UHFFFAOYSA-N -1 3 373.796 3.594 20 0 FHADHM CC(=CC(=O)Nc1cccc(-c2nnn[n-]2)c1C)c1cccc(Cl)c1 ZINC001573364576 947723583 /nfs/dbraw/zinc/72/35/83/947723583.db2.gz QWPCJTVVWYTSRS-PKNBQFBNSA-N -1 3 353.813 3.871 20 0 FHADHM CC(=CC(=O)Nc1cccc(-c2nn[n-]n2)c1C)c1cccc(Cl)c1 ZINC001573364576 947723590 /nfs/dbraw/zinc/72/35/90/947723590.db2.gz QWPCJTVVWYTSRS-PKNBQFBNSA-N -1 3 353.813 3.871 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1cccc(Cl)c1OC(C)C ZINC000826250932 947726110 /nfs/dbraw/zinc/72/61/10/947726110.db2.gz ZQPMICJQLNRPSB-UHFFFAOYSA-N -1 3 371.828 3.868 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1cccc(Cl)c1OC(C)C ZINC000826250932 947726116 /nfs/dbraw/zinc/72/61/16/947726116.db2.gz ZQPMICJQLNRPSB-UHFFFAOYSA-N -1 3 371.828 3.868 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1ncc(C2CCCCC2)s1 ZINC000826251710 947728884 /nfs/dbraw/zinc/72/88/84/947728884.db2.gz YKJPCVOOYVMCEN-UHFFFAOYSA-N -1 3 368.466 3.932 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1ncc(C2CCCCC2)s1 ZINC000826251710 947728892 /nfs/dbraw/zinc/72/88/92/947728892.db2.gz YKJPCVOOYVMCEN-UHFFFAOYSA-N -1 3 368.466 3.932 20 0 FHADHM CC(=Cc1ccc(C)cc1)C(=O)Nc1c(-c2nnn[n-]2)c(C)c2ccccn21 ZINC001573365998 947736917 /nfs/dbraw/zinc/73/69/17/947736917.db2.gz OPXJDBJTYRJKRT-OWBHPGMISA-N -1 3 372.432 3.778 20 0 FHADHM CC(=Cc1ccc(C)cc1)C(=O)Nc1c(-c2nn[n-]n2)c(C)c2ccccn21 ZINC001573365998 947736925 /nfs/dbraw/zinc/73/69/25/947736925.db2.gz OPXJDBJTYRJKRT-OWBHPGMISA-N -1 3 372.432 3.778 20 0 FHADHM CCc1c(C(=O)N=c2cc(-c3cc(C)cc(C)c3)[n-][nH]2)[nH]c(C)c1C(C)=O ZINC000523945957 947751928 /nfs/dbraw/zinc/75/19/28/947751928.db2.gz NNIISMSGGVDUES-UHFFFAOYSA-N -1 3 364.449 3.769 20 0 FHADHM Cc1ccc(C[C@@H](C)C(=O)N(C)c2cc(Cl)ccc2-c2nnn[n-]2)cc1 ZINC000826286902 947829500 /nfs/dbraw/zinc/82/95/00/947829500.db2.gz VHELYFBZSZRNTC-CYBMUJFWSA-N -1 3 369.856 3.670 20 0 FHADHM Cc1ccc(C[C@@H](C)C(=O)N(C)c2cc(Cl)ccc2-c2nn[n-]n2)cc1 ZINC000826286902 947829504 /nfs/dbraw/zinc/82/95/04/947829504.db2.gz VHELYFBZSZRNTC-CYBMUJFWSA-N -1 3 369.856 3.670 20 0 FHADHM O=S(=O)([N-]c1ccsc1Cl)c1cc2c(cc1Cl)OCCO2 ZINC000189743824 947831295 /nfs/dbraw/zinc/83/12/95/947831295.db2.gz DRVYYYMIOQKIMU-UHFFFAOYSA-N -1 3 366.247 3.627 20 0 FHADHM CCc1cc(=O)[n-]c(CN2CCC(c3nc4cccc(C)c4o3)CC2)n1 ZINC000189803942 947839646 /nfs/dbraw/zinc/83/96/46/947839646.db2.gz YYOKTRMYRZZOJG-UHFFFAOYSA-N -1 3 352.438 3.574 20 0 FHADHM Cc1nc(Cl)cc(Sc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)n1 ZINC000826326633 947952033 /nfs/dbraw/zinc/95/20/33/947952033.db2.gz XXVIGAICZGFTQZ-UHFFFAOYSA-N -1 3 372.763 3.789 20 0 FHADHM Cc1nc(Cl)cc(Sc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)n1 ZINC000826326633 947952034 /nfs/dbraw/zinc/95/20/34/947952034.db2.gz XXVIGAICZGFTQZ-UHFFFAOYSA-N -1 3 372.763 3.789 20 0 FHADHM O=c1nc(CN2CC[C@H](C(F)F)C2)[n-]c2scc(-c3ccco3)c21 ZINC000663463442 948046471 /nfs/dbraw/zinc/04/64/71/948046471.db2.gz BTSYEGKVUYZSQX-VIFPVBQESA-N -1 3 351.378 3.744 20 0 FHADHM C[C@@H](C(=O)NC1(c2cccc(-c3nnn[n-]3)c2)CC1)c1cc2ccccc2o1 ZINC001573665026 948067010 /nfs/dbraw/zinc/06/70/10/948067010.db2.gz ZYWQOOOCSLEJPG-CYBMUJFWSA-N -1 3 373.416 3.522 20 0 FHADHM C[C@@H](C(=O)NC1(c2cccc(-c3nn[n-]n3)c2)CC1)c1cc2ccccc2o1 ZINC001573665026 948067020 /nfs/dbraw/zinc/06/70/20/948067020.db2.gz ZYWQOOOCSLEJPG-CYBMUJFWSA-N -1 3 373.416 3.522 20 0 FHADHM Clc1ccc(-c2nnc(CSc3ccc(-c4nnn[n-]4)cc3)o2)cc1 ZINC000826351253 948097669 /nfs/dbraw/zinc/09/76/69/948097669.db2.gz FNEIXGAWKJBIMU-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1ccc(-c2nnc(CSc3ccc(-c4nn[n-]n4)cc3)o2)cc1 ZINC000826351253 948097677 /nfs/dbraw/zinc/09/76/77/948097677.db2.gz FNEIXGAWKJBIMU-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM CCc1ccc([O-])c(C(=O)N2CCC[C@H](n3ccc(C(F)(F)F)n3)C2)c1 ZINC000180767497 948129430 /nfs/dbraw/zinc/12/94/30/948129430.db2.gz STLZOWAPCQGMSP-ZDUSSCGKSA-N -1 3 367.371 3.647 20 0 FHADHM Fc1cccc([C@H](NCc2cccc(-c3nnn[n-]3)c2)C(F)(F)F)c1F ZINC000826376553 948164809 /nfs/dbraw/zinc/16/48/09/948164809.db2.gz IXAYJZDALVHRCD-AWEZNQCLSA-N -1 3 369.297 3.538 20 0 FHADHM Fc1cccc([C@H](NCc2cccc(-c3nn[n-]n3)c2)C(F)(F)F)c1F ZINC000826376553 948164815 /nfs/dbraw/zinc/16/48/15/948164815.db2.gz IXAYJZDALVHRCD-AWEZNQCLSA-N -1 3 369.297 3.538 20 0 FHADHM Cc1ccccc1[C@H](NC(=O)Nc1ccc2c(c1)C(=O)[N-]C2=O)C(C)(C)C ZINC000432342246 948167491 /nfs/dbraw/zinc/16/74/91/948167491.db2.gz HVJYPVGLRLAMRT-KRWDZBQOSA-N -1 3 365.433 3.788 20 0 FHADHM Fc1cccc(Cc2cnc(NCc3cccc(-c4nnn[n-]4)c3)s2)c1 ZINC000826377398 948169748 /nfs/dbraw/zinc/16/97/48/948169748.db2.gz QAINPELNVIHSBR-UHFFFAOYSA-N -1 3 366.425 3.665 20 0 FHADHM Fc1cccc(Cc2cnc(NCc3cccc(-c4nn[n-]n4)c3)s2)c1 ZINC000826377398 948169753 /nfs/dbraw/zinc/16/97/53/948169753.db2.gz QAINPELNVIHSBR-UHFFFAOYSA-N -1 3 366.425 3.665 20 0 FHADHM O=C(CSc1cccc(Cl)c1-c1nnn[n-]1)c1ccc(F)cc1F ZINC000826420773 948264479 /nfs/dbraw/zinc/26/44/79/948264479.db2.gz BFXBCKPMUMDZFX-UHFFFAOYSA-N -1 3 366.780 3.773 20 0 FHADHM O=C(CSc1cccc(Cl)c1-c1nn[n-]n1)c1ccc(F)cc1F ZINC000826420773 948264486 /nfs/dbraw/zinc/26/44/86/948264486.db2.gz BFXBCKPMUMDZFX-UHFFFAOYSA-N -1 3 366.780 3.773 20 0 FHADHM O=C(CSc1cccc(Cl)c1-c1nnn[n-]1)c1ccc(F)c(F)c1 ZINC000826421128 948268037 /nfs/dbraw/zinc/26/80/37/948268037.db2.gz SSYMSOHORYFVAA-UHFFFAOYSA-N -1 3 366.780 3.773 20 0 FHADHM O=C(CSc1cccc(Cl)c1-c1nn[n-]n1)c1ccc(F)c(F)c1 ZINC000826421128 948268044 /nfs/dbraw/zinc/26/80/44/948268044.db2.gz SSYMSOHORYFVAA-UHFFFAOYSA-N -1 3 366.780 3.773 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@H]3CCC[C@H](OC)C3)c2)n1 ZINC000432407574 948346075 /nfs/dbraw/zinc/34/60/75/948346075.db2.gz NFQZAMNSFDUDKO-YOEHRIQHSA-N -1 3 355.438 3.555 20 0 FHADHM CCc1ccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2C)c([O-])c1 ZINC000190703565 948516094 /nfs/dbraw/zinc/51/60/94/948516094.db2.gz KOPOAZKZBSPBML-UHFFFAOYSA-N -1 3 352.434 3.751 20 0 FHADHM CC(C)(C)Cc1ccccc1C(=O)Nc1cc(-c2nnn[n-]2)ccc1F ZINC001535498257 948546730 /nfs/dbraw/zinc/54/67/30/948546730.db2.gz GCZKIWGISCZJRE-UHFFFAOYSA-N -1 3 353.401 3.847 20 0 FHADHM CC(C)(C)Cc1ccccc1C(=O)Nc1cc(-c2nn[n-]n2)ccc1F ZINC001535498257 948546739 /nfs/dbraw/zinc/54/67/39/948546739.db2.gz GCZKIWGISCZJRE-UHFFFAOYSA-N -1 3 353.401 3.847 20 0 FHADHM COc1ccccc1NC(=S)N[N-]C(=O)c1cccc(Cl)c1Cl ZINC000006571627 948570486 /nfs/dbraw/zinc/57/04/86/948570486.db2.gz XOTXBSIHHHVTAW-UHFFFAOYSA-N -1 3 370.261 3.633 20 0 FHADHM CCOC(=O)c1nc([C@@H](CC(C)C)NCc2sccc2Cl)n[n-]1 ZINC000895104001 948575122 /nfs/dbraw/zinc/57/51/22/948575122.db2.gz BUZCWQVXPVZXGJ-LLVKDONJSA-N -1 3 356.879 3.573 20 0 FHADHM CCOC(=O)c1nnc([C@@H](CC(C)C)NCc2sccc2Cl)[n-]1 ZINC000895104001 948575125 /nfs/dbraw/zinc/57/51/25/948575125.db2.gz BUZCWQVXPVZXGJ-LLVKDONJSA-N -1 3 356.879 3.573 20 0 FHADHM CCOC(=O)c1n[n-]c([C@@H](CC(C)C)NCc2sccc2Cl)n1 ZINC000895104001 948575128 /nfs/dbraw/zinc/57/51/28/948575128.db2.gz BUZCWQVXPVZXGJ-LLVKDONJSA-N -1 3 356.879 3.573 20 0 FHADHM CC(C)Cc1ccc(C(=O)CCC(=O)Nc2nnc(C(F)(F)F)[n-]2)cc1 ZINC000050603584 948630276 /nfs/dbraw/zinc/63/02/76/948630276.db2.gz QCIMHPFULNMWAX-UHFFFAOYSA-N -1 3 368.359 3.624 20 0 FHADHM CC(C)Cc1ccc(C(=O)CCC(=O)Nc2nc(C(F)(F)F)n[n-]2)cc1 ZINC000050603584 948630277 /nfs/dbraw/zinc/63/02/77/948630277.db2.gz QCIMHPFULNMWAX-UHFFFAOYSA-N -1 3 368.359 3.624 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCCCC2)C(C)(F)F ZINC001573754061 948724368 /nfs/dbraw/zinc/72/43/68/948724368.db2.gz BDSZJVMUXADEBK-SECBINFHSA-N -1 3 369.441 3.817 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCCCC2)C(C)(F)F ZINC001573754061 948724374 /nfs/dbraw/zinc/72/43/74/948724374.db2.gz BDSZJVMUXADEBK-SECBINFHSA-N -1 3 369.441 3.817 20 0 FHADHM CC(C)c1ccc(N(CCCO)Cc2cccc(-c3nnn[n-]3)c2F)cc1 ZINC001574418135 948771902 /nfs/dbraw/zinc/77/19/02/948771902.db2.gz SEVWPBXWTPLXCA-UHFFFAOYSA-N -1 3 369.444 3.518 20 0 FHADHM CC(C)c1ccc(N(CCCO)Cc2cccc(-c3nn[n-]n3)c2F)cc1 ZINC001574418135 948771914 /nfs/dbraw/zinc/77/19/14/948771914.db2.gz SEVWPBXWTPLXCA-UHFFFAOYSA-N -1 3 369.444 3.518 20 0 FHADHM O=C(Nc1cc(Cl)ccc1[O-])[C@@H](O)Cc1cccc(C(F)(F)F)c1 ZINC000187068792 948775622 /nfs/dbraw/zinc/77/56/22/948775622.db2.gz RKJYKBMTKDJNNH-AWEZNQCLSA-N -1 3 359.731 3.607 20 0 FHADHM CC(C)c1cccc(CNC(=O)c2ccc(Cl)c(-c3nnn[n-]3)c2)c1 ZINC001574419893 948788986 /nfs/dbraw/zinc/78/89/86/948788986.db2.gz LDSSOZZASXBELZ-UHFFFAOYSA-N -1 3 355.829 3.574 20 0 FHADHM CC(C)c1cccc(CNC(=O)c2ccc(Cl)c(-c3nn[n-]n3)c2)c1 ZINC001574419893 948789009 /nfs/dbraw/zinc/78/90/09/948789009.db2.gz LDSSOZZASXBELZ-UHFFFAOYSA-N -1 3 355.829 3.574 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)Nc3ccc4c(c3)CCO4)cc2)cc(=O)[n-]1 ZINC000520737576 948793319 /nfs/dbraw/zinc/79/33/19/948793319.db2.gz YLDXMRPPGAKOCM-UHFFFAOYSA-N -1 3 362.389 3.737 20 0 FHADHM Cc1ccc(C(=O)N2CCN(c3cccc(C(F)(F)F)c3)CC2)c([O-])c1 ZINC000025964879 132914580 /nfs/dbraw/zinc/91/45/80/132914580.db2.gz JNDVCXMBQMQDDL-UHFFFAOYSA-N -1 3 364.367 3.682 20 0 FHADHM Cc1ncc(C[N-]S(=O)(=O)c2cc(C(F)(F)F)ccc2Cl)s1 ZINC000098038989 222222995 /nfs/dbraw/zinc/22/29/95/222222995.db2.gz WCZLDOJJKXZWQO-UHFFFAOYSA-N -1 3 370.805 3.602 20 0 FHADHM CC(C)Cc1n[n-]c(=NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)s1 ZINC000503052428 514898310 /nfs/dbraw/zinc/89/83/10/514898310.db2.gz LATDEICEEIATAM-MRXNPFEDSA-N -1 3 373.526 3.523 20 0 FHADHM COc1ccc(Cn2ccc(=NC(=O)c3cc([O-])ccc3Cl)[nH]2)cc1 ZINC000501555096 516152205 /nfs/dbraw/zinc/15/22/05/516152205.db2.gz HLYHMUUVRHUZQB-UHFFFAOYSA-N -1 3 357.797 3.551 20 0 FHADHM COC(=O)Cc1occ(C)c1C(=O)N=c1cc(-c2cc(C)cc(C)c2)[n-][nH]1 ZINC000519237305 516933017 /nfs/dbraw/zinc/93/30/17/516933017.db2.gz CEUZJHQSONCVRT-UHFFFAOYSA-N -1 3 367.405 3.563 20 0 FHADHM Cc1cn(-c2ncccc2F)nc1NC(=O)c1ccc2c(c1[O-])CCCC2 ZINC000541721531 517187142 /nfs/dbraw/zinc/18/71/42/517187142.db2.gz TUPCXGCQIOACKV-UHFFFAOYSA-N -1 3 366.396 3.552 20 0 FHADHM O=C(N=c1cc([C@H]2CCCO2)[n-][nH]1)c1cnn(-c2ccccc2)c1C1CC1 ZINC000525968071 517263321 /nfs/dbraw/zinc/26/33/21/517263321.db2.gz SYPUPCWZPCTKAX-QGZVFWFLSA-N -1 3 363.421 3.577 20 0 FHADHM CCCC(=O)N1CCC[C@@H](C(=O)N=c2[nH][n-]c(C)c2-c2ccccc2F)C1 ZINC000530276799 517673795 /nfs/dbraw/zinc/67/37/95/517673795.db2.gz UTUKIALKNPUQEL-CQSZACIVSA-N -1 3 372.444 3.501 20 0 FHADHM CCSC1(CNC(=O)N=c2[n-]n(CC(F)(F)F)cc2Cl)CC1 ZINC000603041526 520042001 /nfs/dbraw/zinc/04/20/01/520042001.db2.gz GBFQHJOFPNHZBW-UHFFFAOYSA-N -1 3 356.801 3.506 20 0 FHADHM CCOC(=O)c1cnc([N-]c2ccn([C@@H](C)c3ccccc3)n2)nc1C ZINC000611493656 521186377 /nfs/dbraw/zinc/18/63/77/521186377.db2.gz AXXDCOLQQGHFRT-AWEZNQCLSA-N -1 3 351.410 3.511 20 0 FHADHM Cc1[n-][nH]c(=NC(=O)c2cn(-c3ccc(C)cc3)nn2)c1-c1ccccc1 ZINC000623490169 522063221 /nfs/dbraw/zinc/06/32/21/522063221.db2.gz VZDHYTJFXSKXLP-UHFFFAOYSA-N -1 3 358.405 3.527 20 0 FHADHM COc1cccc(-c2c(C)[n-][nH]c2=NC(=O)c2cc(C(C)C)n(C)n2)c1 ZINC000629694634 522399092 /nfs/dbraw/zinc/39/90/92/522399092.db2.gz ZPMHRFFOAGEGJO-UHFFFAOYSA-N -1 3 353.426 3.503 20 0 FHADHM Cc1csc(C(=O)Nc2ccc(C)cc2[O-])c1I ZINC000188519395 567851977 /nfs/dbraw/zinc/85/19/77/567851977.db2.gz CODSIINAZVSWPO-UHFFFAOYSA-N -1 3 373.215 3.927 20 0 FHADHM Cc1coc2ccc(NC(=O)[C@H]3CCCN3C(=O)c3ccccc3[O-])cc12 ZINC000185780022 567863391 /nfs/dbraw/zinc/86/33/91/567863391.db2.gz FQLAYDNWHGFDFD-QGZVFWFLSA-N -1 3 364.401 3.690 20 0 FHADHM Cc1cn(-c2ccccc2)nc1C(=O)Nc1cc(Br)ccc1[O-] ZINC000186260378 567895285 /nfs/dbraw/zinc/89/52/85/567895285.db2.gz RARKPJFTQKJKFF-UHFFFAOYSA-N -1 3 372.222 3.901 20 0 FHADHM CC[C@H](C)C(=O)N1CCC[C@@H](C(=O)N2CC[C@H](C)c3cccc([O-])c32)C1 ZINC000186269514 567895886 /nfs/dbraw/zinc/89/58/86/567895886.db2.gz YNJBZFAHSBPAFH-HRCADAONSA-N -1 3 358.482 3.517 20 0 FHADHM Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1cccc(-c2nc(C)cc(=O)[n-]2)c1 ZINC000161790609 567964869 /nfs/dbraw/zinc/96/48/69/567964869.db2.gz AMGAEMQNFPQEJB-HOTGVXAUSA-N -1 3 365.458 3.857 20 0 FHADHM COC(=O)c1cc(Cl)c(Cl)c([N-]C(=O)c2snnc2C2CC2)c1 ZINC000602419995 567978567 /nfs/dbraw/zinc/97/85/67/567978567.db2.gz CVBMRSUTJOBETB-UHFFFAOYSA-N -1 3 372.233 3.761 20 0 FHADHM Cc1cnccc1[N-]S(=O)(=O)c1ccc(OC(C)C)c2ccccc21 ZINC000602498144 567983623 /nfs/dbraw/zinc/98/36/23/567983623.db2.gz CLPZGXRKYBRUMX-UHFFFAOYSA-N -1 3 356.447 3.553 20 0 FHADHM C[C@H](NC(=O)c1cc(=O)[n-]c(C2CC2)n1)c1ccc(Cl)cc1Cl ZINC000518794709 567986289 /nfs/dbraw/zinc/98/62/89/567986289.db2.gz MWPXFJGDPACFAM-QMMMGPOBSA-N -1 3 352.221 3.857 20 0 FHADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)Cc3ccc4c(c3)CCCC4)cc2)n1 ZINC000064342901 568018993 /nfs/dbraw/zinc/01/89/93/568018993.db2.gz GZCWWYKFOMRISC-UHFFFAOYSA-N -1 3 373.456 3.805 20 0 FHADHM O=S(=O)([N-]C[C@H]1OCCc2ccccc21)c1cccc(Cl)c1Cl ZINC000603506883 568109870 /nfs/dbraw/zinc/10/98/70/568109870.db2.gz XJSSYVKEBODSIJ-CQSZACIVSA-N -1 3 372.273 3.586 20 0 FHADHM C[C@H](SCC(=O)N(C)C)c1nc(=O)c2c(-c3ccccc3)csc2[n-]1 ZINC000603773122 568156005 /nfs/dbraw/zinc/15/60/05/568156005.db2.gz RHMNTMWVALGHIC-NSHDSACASA-N -1 3 373.503 3.946 20 0 FHADHM C[C@H](c1ccccc1)[C@H](C)[N-]S(=O)(=O)c1cccnc1C(F)(F)F ZINC000672388627 568171565 /nfs/dbraw/zinc/17/15/65/568171565.db2.gz DFQRMHHQIVLPSQ-RYUDHWBXSA-N -1 3 358.385 3.571 20 0 FHADHM Cc1c2cccc(Cl)c2oc1C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000070730774 568181737 /nfs/dbraw/zinc/18/17/37/568181737.db2.gz SESUNKHHQHQJPT-UHFFFAOYSA-N -1 3 353.769 3.827 20 0 FHADHM Cc1c2cccc(Cl)c2oc1C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000070730774 568181738 /nfs/dbraw/zinc/18/17/38/568181738.db2.gz SESUNKHHQHQJPT-UHFFFAOYSA-N -1 3 353.769 3.827 20 0 FHADHM CC(C)c1cc(C[N-]S(=O)(=O)c2ccc3c(c2)Cc2ccccc2-3)on1 ZINC000603947421 568186572 /nfs/dbraw/zinc/18/65/72/568186572.db2.gz ARQDZHSXFQGTBU-UHFFFAOYSA-N -1 3 368.458 3.848 20 0 FHADHM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2ccc3c(c2)NC(=O)[C@@H](C)O3)cc1 ZINC000007729304 568252101 /nfs/dbraw/zinc/25/21/01/568252101.db2.gz COKFAGCCEROVSZ-QWHCGFSZSA-N -1 3 374.462 3.720 20 0 FHADHM C[C@H](Sc1nnc([N-]c2ccccc2F)s1)C(=O)NC1CCCC1 ZINC000003514788 568365589 /nfs/dbraw/zinc/36/55/89/568365589.db2.gz GWLVSUZFXLQFPC-JTQLQIEISA-N -1 3 366.487 3.960 20 0 FHADHM COc1ccccc1-c1cc(=NC(=O)[C@H]2C[C@H]2c2c(F)cccc2F)[nH][n-]1 ZINC000604789397 568367291 /nfs/dbraw/zinc/36/72/91/568367291.db2.gz ZAVPUQHUPZKBEF-OLZOCXBDSA-N -1 3 369.371 3.528 20 0 FHADHM C[C@@H](c1ccccc1)N1CCC(NC(=O)c2c([O-])cc(F)cc2F)CC1 ZINC000604790422 568367403 /nfs/dbraw/zinc/36/74/03/568367403.db2.gz QLJBARYIIUEMMV-ZDUSSCGKSA-N -1 3 360.404 3.626 20 0 FHADHM CC(=O)c1sc2[n-]c(CSc3nc4ccccc4o3)nc(=O)c2c1C ZINC000005628874 568391806 /nfs/dbraw/zinc/39/18/06/568391806.db2.gz LRKLWQHIYJVKBI-UHFFFAOYSA-N -1 3 371.443 3.929 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2ccc(OCC3CC3)cc2)c(C)c1C ZINC000604972003 568464651 /nfs/dbraw/zinc/46/46/51/568464651.db2.gz LYNFVTXJKHQHAY-UHFFFAOYSA-N -1 3 361.463 3.902 20 0 FHADHM COc1ccc(Cl)cc1-c1cc(=NC(=O)c2cccc3c2CCC3)[nH][n-]1 ZINC000605022181 568525515 /nfs/dbraw/zinc/52/55/15/568525515.db2.gz VDJZKHSWHNOVED-UHFFFAOYSA-N -1 3 367.836 3.902 20 0 FHADHM C[C@H]1CCN(C(=O)c2cc(=O)c3ccccc3[n-]2)[C@H]1c1cccc(F)c1 ZINC000365370414 568574898 /nfs/dbraw/zinc/57/48/98/568574898.db2.gz VIRZSSNCDNJWLE-RNODOKPDSA-N -1 3 350.393 3.891 20 0 FHADHM Cc1ccc(-c2nc(CCNC(=O)c3cc([O-])ccc3Cl)co2)cc1 ZINC000365457328 568734839 /nfs/dbraw/zinc/73/48/39/568734839.db2.gz CBLHYEBAZDEFPZ-UHFFFAOYSA-N -1 3 356.809 3.982 20 0 FHADHM CSCCCCC(=O)Oc1ccc(-c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000737181120 598828155 /nfs/dbraw/zinc/82/81/55/598828155.db2.gz FYMLRTKEPWZMEE-UHFFFAOYSA-N -1 3 368.462 3.972 20 0 FHADHM CSCCCCC(=O)Oc1ccc(-c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000737181120 598828157 /nfs/dbraw/zinc/82/81/57/598828157.db2.gz FYMLRTKEPWZMEE-UHFFFAOYSA-N -1 3 368.462 3.972 20 0 FHADHM Cc1cccc([C@@H](C)C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCC3)c1 ZINC000737385019 598829764 /nfs/dbraw/zinc/82/97/64/598829764.db2.gz QOXRJAPZPAJATI-GFCCVEGCSA-N -1 3 367.478 3.858 20 0 FHADHM Cc1cccc([C@@H](C)C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCC3)c1 ZINC000737385019 598829766 /nfs/dbraw/zinc/82/97/66/598829766.db2.gz QOXRJAPZPAJATI-GFCCVEGCSA-N -1 3 367.478 3.858 20 0 FHADHM c1c2ccccc2oc1CCNc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000738441614 598855087 /nfs/dbraw/zinc/85/50/87/598855087.db2.gz LOHSTGCAWNACFN-UHFFFAOYSA-N -1 3 356.389 3.816 20 0 FHADHM c1c2ccccc2oc1CCNc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000738441614 598855089 /nfs/dbraw/zinc/85/50/89/598855089.db2.gz LOHSTGCAWNACFN-UHFFFAOYSA-N -1 3 356.389 3.816 20 0 FHADHM Clc1ccccc1-c1noc(C=Cc2ccccc2-c2nnn[n-]2)n1 ZINC000737585030 598859937 /nfs/dbraw/zinc/85/99/37/598859937.db2.gz WVSXFALAKVGORJ-MDZDMXLPSA-N -1 3 350.769 3.741 20 0 FHADHM Clc1ccccc1-c1noc(C=Cc2ccccc2-c2nn[n-]n2)n1 ZINC000737585030 598859938 /nfs/dbraw/zinc/85/99/38/598859938.db2.gz WVSXFALAKVGORJ-MDZDMXLPSA-N -1 3 350.769 3.741 20 0 FHADHM CCc1ccc(-c2noc([C@@H](C)Oc3ccccc3-c3nnn[n-]3)n2)cc1 ZINC000736677842 598860125 /nfs/dbraw/zinc/86/01/25/598860125.db2.gz PDDMARNVXIEVQD-GFCCVEGCSA-N -1 3 362.393 3.619 20 0 FHADHM CCc1ccc(-c2noc([C@@H](C)Oc3ccccc3-c3nn[n-]n3)n2)cc1 ZINC000736677842 598860127 /nfs/dbraw/zinc/86/01/27/598860127.db2.gz PDDMARNVXIEVQD-GFCCVEGCSA-N -1 3 362.393 3.619 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)NC1C[C@H](C)C[C@@H](C)C1 ZINC000736481759 598890830 /nfs/dbraw/zinc/89/08/30/598890830.db2.gz UQDLHCVTNJMCPQ-HUUCEWRRSA-N -1 3 370.501 3.613 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)NC1C[C@H](C)C[C@@H](C)C1 ZINC000736481759 598890833 /nfs/dbraw/zinc/89/08/33/598890833.db2.gz UQDLHCVTNJMCPQ-HUUCEWRRSA-N -1 3 370.501 3.613 20 0 FHADHM CCCCN(C)C(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000736453931 598891089 /nfs/dbraw/zinc/89/10/89/598891089.db2.gz UCPDNOKGJCPJPQ-UHFFFAOYSA-N -1 3 370.482 3.537 20 0 FHADHM CC(C)[C@H](Cc1ccccc1)C(=O)OCc1ccc(-c2nnn[n-]2)cc1F ZINC000735714199 598901524 /nfs/dbraw/zinc/90/15/24/598901524.db2.gz ZZIRACDBMLNBSA-KRWDZBQOSA-N -1 3 368.412 3.564 20 0 FHADHM CC(C)[C@H](Cc1ccccc1)C(=O)OCc1ccc(-c2nn[n-]n2)cc1F ZINC000735714199 598901525 /nfs/dbraw/zinc/90/15/25/598901525.db2.gz ZZIRACDBMLNBSA-KRWDZBQOSA-N -1 3 368.412 3.564 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)Nc1cc(-c2ccccc2)ns1 ZINC000737796924 598913083 /nfs/dbraw/zinc/91/30/83/598913083.db2.gz CFVLJFVYBHJULB-KHPPLWFESA-N -1 3 374.429 3.642 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)Nc1cc(-c2ccccc2)ns1 ZINC000737796924 598913085 /nfs/dbraw/zinc/91/30/85/598913085.db2.gz CFVLJFVYBHJULB-KHPPLWFESA-N -1 3 374.429 3.642 20 0 FHADHM Cc1ccc2cccc(NC(=O)N[C@@H](C)c3ccc(-c4nnn[n-]4)cc3)c2n1 ZINC000737374062 598923308 /nfs/dbraw/zinc/92/33/08/598923308.db2.gz JPMAAKHIVWGNLE-ZDUSSCGKSA-N -1 3 373.420 3.606 20 0 FHADHM Cc1ccc2cccc(NC(=O)N[C@@H](C)c3ccc(-c4nn[n-]n4)cc3)c2n1 ZINC000737374062 598923309 /nfs/dbraw/zinc/92/33/09/598923309.db2.gz JPMAAKHIVWGNLE-ZDUSSCGKSA-N -1 3 373.420 3.606 20 0 FHADHM CCCCN(C(=O)c1ccc(-c2nnn[n-]2)cn1)[C@@H](CC)c1ccccc1 ZINC000736451859 598927787 /nfs/dbraw/zinc/92/77/87/598927787.db2.gz QCIHECLMNADNKU-SFHVURJKSA-N -1 3 364.453 3.655 20 0 FHADHM CCCCN(C(=O)c1ccc(-c2nn[n-]n2)cn1)[C@@H](CC)c1ccccc1 ZINC000736451859 598927788 /nfs/dbraw/zinc/92/77/88/598927788.db2.gz QCIHECLMNADNKU-SFHVURJKSA-N -1 3 364.453 3.655 20 0 FHADHM C[C@H]1C[C@H]1c1ccc(CN(c2ncc(-c3nnn[n-]3)cc2Cl)C2CC2)o1 ZINC000736242004 598936874 /nfs/dbraw/zinc/93/68/74/598936874.db2.gz YKSSWDYGXSWPBW-IINYFYTJSA-N -1 3 370.844 3.801 20 0 FHADHM C[C@H]1C[C@H]1c1ccc(CN(c2ncc(-c3nn[n-]n3)cc2Cl)C2CC2)o1 ZINC000736242004 598936876 /nfs/dbraw/zinc/93/68/76/598936876.db2.gz YKSSWDYGXSWPBW-IINYFYTJSA-N -1 3 370.844 3.801 20 0 FHADHM CC[C@H]1CCC[C@@H](NC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)C1 ZINC000736395065 598942246 /nfs/dbraw/zinc/94/22/46/598942246.db2.gz GTXKJYHEJYYADE-DOTOQJQBSA-N -1 3 371.485 3.501 20 0 FHADHM CC[C@H]1CCC[C@@H](NC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)C1 ZINC000736395065 598942248 /nfs/dbraw/zinc/94/22/48/598942248.db2.gz GTXKJYHEJYYADE-DOTOQJQBSA-N -1 3 371.485 3.501 20 0 FHADHM Cc1ccc(CN(C(=O)C=Cc2ccccc2-c2nnn[n-]2)C2CC2)cc1C ZINC000737336349 598943073 /nfs/dbraw/zinc/94/30/73/598943073.db2.gz AFKCIQZBIQTDFG-FMIVXFBMSA-N -1 3 373.460 3.688 20 0 FHADHM Cc1ccc(CN(C(=O)C=Cc2ccccc2-c2nn[n-]n2)C2CC2)cc1C ZINC000737336349 598943075 /nfs/dbraw/zinc/94/30/75/598943075.db2.gz AFKCIQZBIQTDFG-FMIVXFBMSA-N -1 3 373.460 3.688 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CCC[C@@H](C(C)C)CC1 ZINC000736633727 598966284 /nfs/dbraw/zinc/96/62/84/598966284.db2.gz DSBIWRLJRNSEIE-CQSZACIVSA-N -1 3 372.473 3.555 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CCC[C@@H](C(C)C)CC1 ZINC000736633727 598966286 /nfs/dbraw/zinc/96/62/86/598966286.db2.gz DSBIWRLJRNSEIE-CQSZACIVSA-N -1 3 372.473 3.555 20 0 FHADHM Cc1cc(C)c(-c2nnn[n-]2)c(N[C@H]2C[C@@H]2c2c(F)cccc2Cl)n1 ZINC000737243780 598972086 /nfs/dbraw/zinc/97/20/86/598972086.db2.gz BGZQNZVIVGKUGH-GWCFXTLKSA-N -1 3 358.808 3.639 20 0 FHADHM Cc1cc(C)c(-c2nn[n-]n2)c(N[C@H]2C[C@@H]2c2c(F)cccc2Cl)n1 ZINC000737243780 598972087 /nfs/dbraw/zinc/97/20/87/598972087.db2.gz BGZQNZVIVGKUGH-GWCFXTLKSA-N -1 3 358.808 3.639 20 0 FHADHM Fc1ccccc1[C@@H](Cc1ccccc1)Nc1ncccc1-c1nnn[n-]1 ZINC000737665602 598975940 /nfs/dbraw/zinc/97/59/40/598975940.db2.gz SOJVPWPFCOHTOO-GOSISDBHSA-N -1 3 360.396 3.797 20 0 FHADHM Fc1ccccc1[C@@H](Cc1ccccc1)Nc1ncccc1-c1nn[n-]n1 ZINC000737665602 598975942 /nfs/dbraw/zinc/97/59/42/598975942.db2.gz SOJVPWPFCOHTOO-GOSISDBHSA-N -1 3 360.396 3.797 20 0 FHADHM Fc1cccc(Cl)c1[C@@H]1C[C@@H]1Nc1nc2c(cc1-c1nnn[n-]1)CCC2 ZINC000737659370 598972452 /nfs/dbraw/zinc/97/24/52/598972452.db2.gz CPVXMBOCNFIQMU-BMIGLBTASA-N -1 3 370.819 3.511 20 0 FHADHM Fc1cccc(Cl)c1[C@@H]1C[C@@H]1Nc1nc2c(cc1-c1nn[n-]n1)CCC2 ZINC000737659370 598972453 /nfs/dbraw/zinc/97/24/53/598972453.db2.gz CPVXMBOCNFIQMU-BMIGLBTASA-N -1 3 370.819 3.511 20 0 FHADHM CCc1c(C)sc(NC(=O)C2(c3cccc(F)c3)CC2)c1-c1nnn[n-]1 ZINC000736669812 599001318 /nfs/dbraw/zinc/00/13/18/599001318.db2.gz LWXDXSFDXZXYRW-UHFFFAOYSA-N -1 3 371.441 3.608 20 0 FHADHM CCc1c(C)sc(NC(=O)C2(c3cccc(F)c3)CC2)c1-c1nn[n-]n1 ZINC000736669812 599001320 /nfs/dbraw/zinc/00/13/20/599001320.db2.gz LWXDXSFDXZXYRW-UHFFFAOYSA-N -1 3 371.441 3.608 20 0 FHADHM CC(C)[C@H](NC(=O)c1sccc1-c1nnn[n-]1)c1ccccc1Cl ZINC000735733271 599006984 /nfs/dbraw/zinc/00/69/84/599006984.db2.gz GXOMZUMSFGYHGV-ZDUSSCGKSA-N -1 3 361.858 3.709 20 0 FHADHM CC(C)[C@H](NC(=O)c1sccc1-c1nn[n-]n1)c1ccccc1Cl ZINC000735733271 599006986 /nfs/dbraw/zinc/00/69/86/599006986.db2.gz GXOMZUMSFGYHGV-ZDUSSCGKSA-N -1 3 361.858 3.709 20 0 FHADHM C[C@@H](CCC1CCCCC1)NC(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000735985367 599008203 /nfs/dbraw/zinc/00/82/03/599008203.db2.gz KGFZLKGBDBPRLO-AWEZNQCLSA-N -1 3 373.526 3.824 20 0 FHADHM C[C@@H](CCC1CCCCC1)NC(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000735985367 599008205 /nfs/dbraw/zinc/00/82/05/599008205.db2.gz KGFZLKGBDBPRLO-AWEZNQCLSA-N -1 3 373.526 3.824 20 0 FHADHM C[C@H](C(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)nc1)C(C)(C)C ZINC000735561110 599015046 /nfs/dbraw/zinc/01/50/46/599015046.db2.gz VSZVVEZBKBIWDZ-GFCCVEGCSA-N -1 3 366.425 3.675 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H]1CCC[C@H](CC)C1 ZINC000736482147 599013952 /nfs/dbraw/zinc/01/39/52/599013952.db2.gz VHXVEKHCNLTTGS-MAUKXSAKSA-N -1 3 370.501 3.757 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H]1CCC[C@H](CC)C1 ZINC000736482147 599013954 /nfs/dbraw/zinc/01/39/54/599013954.db2.gz VHXVEKHCNLTTGS-MAUKXSAKSA-N -1 3 370.501 3.757 20 0 FHADHM O=C(C[C@H]1CCc2ccccc21)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000737818650 599016412 /nfs/dbraw/zinc/01/64/12/599016412.db2.gz JNJZLXGKUBODOJ-GFCCVEGCSA-N -1 3 353.813 3.579 20 0 FHADHM O=C(C[C@H]1CCc2ccccc21)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000737818650 599016414 /nfs/dbraw/zinc/01/64/14/599016414.db2.gz JNJZLXGKUBODOJ-GFCCVEGCSA-N -1 3 353.813 3.579 20 0 FHADHM CC(C)C[C@@H]1CCCCCN1C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000735795519 599018736 /nfs/dbraw/zinc/01/87/36/599018736.db2.gz NODSXMGVLNCLBK-YJBOKZPZSA-N -1 3 370.501 3.928 20 0 FHADHM CC(C)C[C@@H]1CCCCCN1C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000735795519 599018738 /nfs/dbraw/zinc/01/87/38/599018738.db2.gz NODSXMGVLNCLBK-YJBOKZPZSA-N -1 3 370.501 3.928 20 0 FHADHM CC(C)C[C@@H]1CCCCCN1C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000735795518 599018976 /nfs/dbraw/zinc/01/89/76/599018976.db2.gz NODSXMGVLNCLBK-QAPCUYQASA-N -1 3 370.501 3.928 20 0 FHADHM CC(C)C[C@@H]1CCCCCN1C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000735795518 599018978 /nfs/dbraw/zinc/01/89/78/599018978.db2.gz NODSXMGVLNCLBK-QAPCUYQASA-N -1 3 370.501 3.928 20 0 FHADHM CC(C)C[C@H](C(=O)OCc1ccccc1-c1nnn[n-]1)c1ccccc1 ZINC000735755077 599019059 /nfs/dbraw/zinc/01/90/59/599019059.db2.gz BHNKLKISSJGPRF-SFHVURJKSA-N -1 3 350.422 3.740 20 0 FHADHM CC(C)C[C@H](C(=O)OCc1ccccc1-c1nn[n-]n1)c1ccccc1 ZINC000735755077 599019062 /nfs/dbraw/zinc/01/90/62/599019062.db2.gz BHNKLKISSJGPRF-SFHVURJKSA-N -1 3 350.422 3.740 20 0 FHADHM CC(C)C[C@@H]1CCCCCN1C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000735795503 599021739 /nfs/dbraw/zinc/02/17/39/599021739.db2.gz NIBROQNUIGGAJH-AWEZNQCLSA-N -1 3 360.437 3.828 20 0 FHADHM CC(C)C[C@@H]1CCCCCN1C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000735795503 599021741 /nfs/dbraw/zinc/02/17/41/599021741.db2.gz NIBROQNUIGGAJH-AWEZNQCLSA-N -1 3 360.437 3.828 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N2CCC[C@@H]2c2cccs2)n1 ZINC000737631035 599040218 /nfs/dbraw/zinc/04/02/18/599040218.db2.gz BTTFEDHCBMWFPV-SNVBAGLBSA-N -1 3 366.372 3.684 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N2CCC[C@@H]2c2cccs2)n1 ZINC000737631035 599040221 /nfs/dbraw/zinc/04/02/21/599040221.db2.gz BTTFEDHCBMWFPV-SNVBAGLBSA-N -1 3 366.372 3.684 20 0 FHADHM C[C@@H](CNc1nc(C(F)(F)F)ccc1-c1nnn[n-]1)Cc1cccs1 ZINC000820280478 599041722 /nfs/dbraw/zinc/04/17/22/599041722.db2.gz HHPGKMKLTTVJQX-SECBINFHSA-N -1 3 368.388 3.633 20 0 FHADHM C[C@@H](CNc1nc(C(F)(F)F)ccc1-c1nn[n-]n1)Cc1cccs1 ZINC000820280478 599041725 /nfs/dbraw/zinc/04/17/25/599041725.db2.gz HHPGKMKLTTVJQX-SECBINFHSA-N -1 3 368.388 3.633 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N2CCC[C@H]2c2ccccc2)n1 ZINC000737633228 599042005 /nfs/dbraw/zinc/04/20/05/599042005.db2.gz PGKKDXZARCTFSB-ZDUSSCGKSA-N -1 3 360.343 3.622 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N2CCC[C@H]2c2ccccc2)n1 ZINC000737633228 599042008 /nfs/dbraw/zinc/04/20/08/599042008.db2.gz PGKKDXZARCTFSB-ZDUSSCGKSA-N -1 3 360.343 3.622 20 0 FHADHM CC1(C)[C@H](Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)[C@H]2CCCO[C@H]21 ZINC000820582912 599043067 /nfs/dbraw/zinc/04/30/67/599043067.db2.gz AOWCEPQABJTLTO-MRVWCRGKSA-N -1 3 367.375 3.501 20 0 FHADHM CC1(C)[C@H](Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)[C@H]2CCCO[C@H]21 ZINC000820582912 599043070 /nfs/dbraw/zinc/04/30/70/599043070.db2.gz AOWCEPQABJTLTO-MRVWCRGKSA-N -1 3 367.375 3.501 20 0 FHADHM CCc1ccc(CNc2nc(C(F)(F)F)ccc2-c2nnn[n-]2)s1 ZINC000736690088 599043691 /nfs/dbraw/zinc/04/36/91/599043691.db2.gz LBLQMZLJFPKHMG-UHFFFAOYSA-N -1 3 354.361 3.517 20 0 FHADHM CCc1ccc(CNc2nc(C(F)(F)F)ccc2-c2nn[n-]n2)s1 ZINC000736690088 599043694 /nfs/dbraw/zinc/04/36/94/599043694.db2.gz LBLQMZLJFPKHMG-UHFFFAOYSA-N -1 3 354.361 3.517 20 0 FHADHM CCC(CC)c1cc(CNc2cc(-c3nnn[n-]3)c3ccccc3n2)on1 ZINC000820897843 599045699 /nfs/dbraw/zinc/04/56/99/599045699.db2.gz PACTYQSNXUMFLK-UHFFFAOYSA-N -1 3 363.425 3.919 20 0 FHADHM CCC(CC)c1cc(CNc2cc(-c3nn[n-]n3)c3ccccc3n2)on1 ZINC000820897843 599045702 /nfs/dbraw/zinc/04/57/02/599045702.db2.gz PACTYQSNXUMFLK-UHFFFAOYSA-N -1 3 363.425 3.919 20 0 FHADHM Cc1ccc([C@H](C)Nc2nc(C(F)(F)F)ccc2-c2nnn[n-]2)s1 ZINC000737318321 599047224 /nfs/dbraw/zinc/04/72/24/599047224.db2.gz AAGMXVMPGKTUSM-QMMMGPOBSA-N -1 3 354.361 3.824 20 0 FHADHM Cc1ccc([C@H](C)Nc2nc(C(F)(F)F)ccc2-c2nn[n-]n2)s1 ZINC000737318321 599047225 /nfs/dbraw/zinc/04/72/25/599047225.db2.gz AAGMXVMPGKTUSM-QMMMGPOBSA-N -1 3 354.361 3.824 20 0 FHADHM C[C@@H]1Cc2ccccc2[C@@H]1Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000736296469 599056272 /nfs/dbraw/zinc/05/62/72/599056272.db2.gz HKXLJSHEBBHODD-YMTOWFKASA-N -1 3 360.343 3.626 20 0 FHADHM C[C@@H]1Cc2ccccc2[C@@H]1Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000736296469 599056275 /nfs/dbraw/zinc/05/62/75/599056275.db2.gz HKXLJSHEBBHODD-YMTOWFKASA-N -1 3 360.343 3.626 20 0 FHADHM C[C@@H]1C[C@H](c2cccc(F)c2)N(c2ncc(-c3nnn[n-]3)cc2Cl)C1 ZINC000820667622 599060131 /nfs/dbraw/zinc/06/01/31/599060131.db2.gz NCPCMANPEFDECM-MEBBXXQBSA-N -1 3 358.808 3.642 20 0 FHADHM C[C@@H]1C[C@H](c2cccc(F)c2)N(c2ncc(-c3nn[n-]n3)cc2Cl)C1 ZINC000820667622 599060133 /nfs/dbraw/zinc/06/01/33/599060133.db2.gz NCPCMANPEFDECM-MEBBXXQBSA-N -1 3 358.808 3.642 20 0 FHADHM CC(C)(C)Oc1ccccc1NCCCOc1ccc(-c2nn[n-]n2)cc1 ZINC000735643569 599064062 /nfs/dbraw/zinc/06/40/62/599064062.db2.gz PKIVJUYLJKMEJV-UHFFFAOYSA-N -1 3 367.453 3.925 20 0 FHADHM O=C([C@@H]1C[C@H]1C1CCCCC1)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000737781420 599069363 /nfs/dbraw/zinc/06/93/63/599069363.db2.gz APEFNLJRHJDYCV-RBUKOAKNSA-N -1 3 365.481 3.574 20 0 FHADHM O=C([C@@H]1C[C@H]1C1CCCCC1)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000737781420 599069367 /nfs/dbraw/zinc/06/93/67/599069367.db2.gz APEFNLJRHJDYCV-RBUKOAKNSA-N -1 3 365.481 3.574 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@H]1CCC[C@H](C)C1 ZINC000735829623 599069597 /nfs/dbraw/zinc/06/95/97/599069597.db2.gz MLFPSFRQRBRAQX-YJBOKZPZSA-N -1 3 355.486 3.678 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@H]1CCC[C@H](C)C1 ZINC000735829623 599069599 /nfs/dbraw/zinc/06/95/99/599069599.db2.gz MLFPSFRQRBRAQX-YJBOKZPZSA-N -1 3 355.486 3.678 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NC(=O)C1CCCCCCC1 ZINC000735902910 599070393 /nfs/dbraw/zinc/07/03/93/599070393.db2.gz AAYLGIHJALHHEN-UHFFFAOYSA-N -1 3 357.458 3.953 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NC(=O)C1CCCCCCC1 ZINC000735902910 599070396 /nfs/dbraw/zinc/07/03/96/599070396.db2.gz AAYLGIHJALHHEN-UHFFFAOYSA-N -1 3 357.458 3.953 20 0 FHADHM CCc1ccc(CC(=O)N(CC)[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000736682184 599071601 /nfs/dbraw/zinc/07/16/01/599071601.db2.gz ICWKADXRNAAPJP-HNNXBMFYSA-N -1 3 363.465 3.581 20 0 FHADHM CCc1ccc(CC(=O)N(CC)[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000736682184 599071604 /nfs/dbraw/zinc/07/16/04/599071604.db2.gz ICWKADXRNAAPJP-HNNXBMFYSA-N -1 3 363.465 3.581 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCCCC2)c1ccco1 ZINC000735568728 599069819 /nfs/dbraw/zinc/06/98/19/599069819.db2.gz AHVJIGQWLXTYCH-NSHDSACASA-N -1 3 371.466 3.922 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCCCC2)c1ccco1 ZINC000735568728 599069822 /nfs/dbraw/zinc/06/98/22/599069822.db2.gz AHVJIGQWLXTYCH-NSHDSACASA-N -1 3 371.466 3.922 20 0 FHADHM CC(C)(C)c1nc2ccc(Nc3ccc(-c4nnn[n-]4)cn3)cc2s1 ZINC000819965660 599076391 /nfs/dbraw/zinc/07/63/91/599076391.db2.gz MBESEIIAZMJVHM-UHFFFAOYSA-N -1 3 351.439 3.913 20 0 FHADHM CC(C)(C)c1nc2ccc(Nc3ccc(-c4nn[n-]n4)cn3)cc2s1 ZINC000819965660 599076393 /nfs/dbraw/zinc/07/63/93/599076393.db2.gz MBESEIIAZMJVHM-UHFFFAOYSA-N -1 3 351.439 3.913 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1N[C@@H]1COc2c1ccc(Cl)c2Cl ZINC000822743884 599076539 /nfs/dbraw/zinc/07/65/39/599076539.db2.gz HVPFXDSDFPEKDT-GFCCVEGCSA-N -1 3 366.183 3.858 20 0 FHADHM CN(CCc1cccs1)c1c(-c2nnn[n-]2)cnc2ccc(Cl)cc21 ZINC000821607340 599087699 /nfs/dbraw/zinc/08/76/99/599087699.db2.gz KRQCCKAALWVISI-UHFFFAOYSA-N -1 3 370.869 3.809 20 0 FHADHM CN(CCc1cccs1)c1c(-c2nn[n-]n2)cnc2ccc(Cl)cc21 ZINC000821607340 599087702 /nfs/dbraw/zinc/08/77/02/599087702.db2.gz KRQCCKAALWVISI-UHFFFAOYSA-N -1 3 370.869 3.809 20 0 FHADHM CCO[C@@H]1C[C@H](Nc2cc(-c3nnn[n-]3)c3ccccc3n2)C12CCCC2 ZINC000821359192 599101154 /nfs/dbraw/zinc/10/11/54/599101154.db2.gz MNCLRXGWULCFNY-DLBZAZTESA-N -1 3 364.453 3.565 20 0 FHADHM CCO[C@@H]1C[C@H](Nc2cc(-c3nn[n-]n3)c3ccccc3n2)C12CCCC2 ZINC000821359192 599101156 /nfs/dbraw/zinc/10/11/56/599101156.db2.gz MNCLRXGWULCFNY-DLBZAZTESA-N -1 3 364.453 3.565 20 0 FHADHM Cc1ccc([C@@H]2OCCC[C@H]2CNc2cccc(F)c2-c2nnn[n-]2)cc1 ZINC000822233573 599108646 /nfs/dbraw/zinc/10/86/46/599108646.db2.gz RLDFUAFUISKGGN-KXBFYZLASA-N -1 3 367.428 3.894 20 0 FHADHM Cc1ccc([C@@H]2OCCC[C@H]2CNc2cccc(F)c2-c2nn[n-]n2)cc1 ZINC000822233573 599108647 /nfs/dbraw/zinc/10/86/47/599108647.db2.gz RLDFUAFUISKGGN-KXBFYZLASA-N -1 3 367.428 3.894 20 0 FHADHM Clc1ccc(-c2noc(CSc3ccccc3-c3nnn[n-]3)n2)cc1 ZINC000737570926 599110876 /nfs/dbraw/zinc/11/08/76/599110876.db2.gz LWKIAXIWUPINHY-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1ccc(-c2noc(CSc3ccccc3-c3nn[n-]n3)n2)cc1 ZINC000737570926 599110879 /nfs/dbraw/zinc/11/08/79/599110879.db2.gz LWKIAXIWUPINHY-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM C[C@H](C(=O)Oc1ccc(-c2ccc(-c3nnn[n-]3)cc2)cc1)C(F)(F)F ZINC000819882971 599134660 /nfs/dbraw/zinc/13/46/60/599134660.db2.gz DGSHYGHOWKHRJY-SNVBAGLBSA-N -1 3 362.311 3.638 20 0 FHADHM C[C@H](C(=O)Oc1ccc(-c2ccc(-c3nn[n-]n3)cc2)cc1)C(F)(F)F ZINC000819882971 599134663 /nfs/dbraw/zinc/13/46/63/599134663.db2.gz DGSHYGHOWKHRJY-SNVBAGLBSA-N -1 3 362.311 3.638 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1cccc(F)c1Cl ZINC000820120578 599146231 /nfs/dbraw/zinc/14/62/31/599146231.db2.gz FEQRHXJQPRASEK-UHFFFAOYSA-N -1 3 373.819 3.710 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1cccc(F)c1Cl ZINC000820120578 599146234 /nfs/dbraw/zinc/14/62/34/599146234.db2.gz FEQRHXJQPRASEK-UHFFFAOYSA-N -1 3 373.819 3.710 20 0 FHADHM Cc1cncc(C(=O)Nc2ccc(Oc3ccc(-c4nn[n-]n4)cc3)cc2)c1 ZINC000822399545 599147501 /nfs/dbraw/zinc/14/75/01/599147501.db2.gz JAGASKDYOWMXEV-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)ccc1OC(=O)C[C@H](C)c1ccccc1C ZINC000736627820 599160490 /nfs/dbraw/zinc/16/04/90/599160490.db2.gz OFGIKAYKQJYXII-AWEZNQCLSA-N -1 3 366.421 3.673 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)ccc1OC(=O)C[C@H](C)c1ccccc1C ZINC000736627820 599160493 /nfs/dbraw/zinc/16/04/93/599160493.db2.gz OFGIKAYKQJYXII-AWEZNQCLSA-N -1 3 366.421 3.673 20 0 FHADHM Cc1nc(C)c(CSc2nc3c(cc2-c2nnn[n-]2)CCCC3)s1 ZINC000737473520 599162162 /nfs/dbraw/zinc/16/21/62/599162162.db2.gz JMFKIDMCRWPZGT-UHFFFAOYSA-N -1 3 358.496 3.506 20 0 FHADHM Cc1nc(C)c(CSc2nc3c(cc2-c2nn[n-]n2)CCCC3)s1 ZINC000737473520 599162164 /nfs/dbraw/zinc/16/21/64/599162164.db2.gz JMFKIDMCRWPZGT-UHFFFAOYSA-N -1 3 358.496 3.506 20 0 FHADHM Cc1ccc([C@H]2CCC[C@@H]2N(C)C(=O)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000822232970 599162232 /nfs/dbraw/zinc/16/22/32/599162232.db2.gz FPPUSWJBCZKRGB-MOPGFXCFSA-N -1 3 361.449 3.583 20 0 FHADHM Cc1ccc([C@H]2CCC[C@@H]2N(C)C(=O)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000822232970 599162234 /nfs/dbraw/zinc/16/22/34/599162234.db2.gz FPPUSWJBCZKRGB-MOPGFXCFSA-N -1 3 361.449 3.583 20 0 FHADHM CCC[C@H](CC1CCCC1)C(=O)NCc1cc(-c2nnn[n-]2)ccc1F ZINC000821015364 599163535 /nfs/dbraw/zinc/16/35/35/599163535.db2.gz PKJPPECHFHLKIO-OAHLLOKOSA-N -1 3 359.449 3.619 20 0 FHADHM CCC[C@H](CC1CCCC1)C(=O)NCc1cc(-c2nn[n-]n2)ccc1F ZINC000821015364 599163536 /nfs/dbraw/zinc/16/35/36/599163536.db2.gz PKJPPECHFHLKIO-OAHLLOKOSA-N -1 3 359.449 3.619 20 0 FHADHM CC(C)[C@@H](CC1CCCCC1)C(=O)NCc1cc(-c2nnn[n-]2)ccc1F ZINC000820021485 599178061 /nfs/dbraw/zinc/17/80/61/599178061.db2.gz VCKQSSDKOAUODX-QGZVFWFLSA-N -1 3 373.476 3.865 20 0 FHADHM CC(C)[C@@H](CC1CCCCC1)C(=O)NCc1cc(-c2nn[n-]n2)ccc1F ZINC000820021485 599178064 /nfs/dbraw/zinc/17/80/64/599178064.db2.gz VCKQSSDKOAUODX-QGZVFWFLSA-N -1 3 373.476 3.865 20 0 FHADHM CCCc1sc(C(=O)NCc2cc(-c3nnn[n-]3)ccc2F)cc1CC ZINC000821143360 599179060 /nfs/dbraw/zinc/17/90/60/599179060.db2.gz SOJSWNJEYVKKLH-UHFFFAOYSA-N -1 3 373.457 3.512 20 0 FHADHM CCCc1sc(C(=O)NCc2cc(-c3nn[n-]n3)ccc2F)cc1CC ZINC000821143360 599179062 /nfs/dbraw/zinc/17/90/62/599179062.db2.gz SOJSWNJEYVKKLH-UHFFFAOYSA-N -1 3 373.457 3.512 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)ccc1OC(=O)[C@H](C)c1cccc(Cl)c1 ZINC000736629156 599179526 /nfs/dbraw/zinc/17/95/26/599179526.db2.gz UWQJPBUYBVZSCM-LLVKDONJSA-N -1 3 372.812 3.628 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)ccc1OC(=O)[C@H](C)c1cccc(Cl)c1 ZINC000736629156 599179527 /nfs/dbraw/zinc/17/95/27/599179527.db2.gz UWQJPBUYBVZSCM-LLVKDONJSA-N -1 3 372.812 3.628 20 0 FHADHM CC[C@@H](Cc1ccc(Cl)cc1)NC(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000736351799 599181182 /nfs/dbraw/zinc/18/11/82/599181182.db2.gz HGZANXIZQHAQPV-HNNXBMFYSA-N -1 3 370.844 3.663 20 0 FHADHM CC[C@@H](Cc1ccc(Cl)cc1)NC(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000736351799 599181183 /nfs/dbraw/zinc/18/11/83/599181183.db2.gz HGZANXIZQHAQPV-HNNXBMFYSA-N -1 3 370.844 3.663 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nnn[n-]2)c1)[C@H]1CCSc2ccccc21 ZINC000738163290 599181414 /nfs/dbraw/zinc/18/14/14/599181414.db2.gz LCCVCMYJPMJTST-LBPRGKRZSA-N -1 3 371.853 3.738 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nn[n-]n2)c1)[C@H]1CCSc2ccccc21 ZINC000738163290 599181416 /nfs/dbraw/zinc/18/14/16/599181416.db2.gz LCCVCMYJPMJTST-LBPRGKRZSA-N -1 3 371.853 3.738 20 0 FHADHM C[C@H](OC(=O)[C@@H]1C[C@H]1c1c(F)cccc1F)c1cccc(-c2nnn[n-]2)c1 ZINC000736147961 599190578 /nfs/dbraw/zinc/19/05/78/599190578.db2.gz BINYDZLKTZYJDT-ZLKJLUDKSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@@H]1C[C@H]1c1c(F)cccc1F)c1cccc(-c2nn[n-]n2)c1 ZINC000736147961 599190580 /nfs/dbraw/zinc/19/05/80/599190580.db2.gz BINYDZLKTZYJDT-ZLKJLUDKSA-N -1 3 370.359 3.553 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)N1CCCC2(C1)CCCCCC2 ZINC000822928276 599202364 /nfs/dbraw/zinc/20/23/64/599202364.db2.gz GDJTWIVSHFWHQL-KHPPLWFESA-N -1 3 365.481 3.843 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)N1CCCC2(C1)CCCCCC2 ZINC000822928276 599202366 /nfs/dbraw/zinc/20/23/66/599202366.db2.gz GDJTWIVSHFWHQL-KHPPLWFESA-N -1 3 365.481 3.843 20 0 FHADHM CCc1ccc([C@H]2C[C@@H](C)CCN2C(=O)c2sccc2-c2nnn[n-]2)o1 ZINC000821480825 599221099 /nfs/dbraw/zinc/22/10/99/599221099.db2.gz FIWQVMBYGDGAMO-SMDDNHRTSA-N -1 3 371.466 3.697 20 0 FHADHM CCc1ccc([C@H]2C[C@@H](C)CCN2C(=O)c2sccc2-c2nn[n-]n2)o1 ZINC000821480825 599221101 /nfs/dbraw/zinc/22/11/01/599221101.db2.gz FIWQVMBYGDGAMO-SMDDNHRTSA-N -1 3 371.466 3.697 20 0 FHADHM CC(C)Oc1ccc(OCCCOc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000735913463 599232457 /nfs/dbraw/zinc/23/24/57/599232457.db2.gz ORZDARHHZYRMBT-UHFFFAOYSA-N -1 3 354.410 3.502 20 0 FHADHM Cc1cccc([C@H](C)SCC(=O)Nc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000822289459 599226558 /nfs/dbraw/zinc/22/65/58/599226558.db2.gz XXJMKXMYEGNLTB-ZDUSSCGKSA-N -1 3 353.451 3.608 20 0 FHADHM Cc1cccc([C@H](C)SCC(=O)Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000822289459 599226560 /nfs/dbraw/zinc/22/65/60/599226560.db2.gz XXJMKXMYEGNLTB-ZDUSSCGKSA-N -1 3 353.451 3.608 20 0 FHADHM C[C@@H]1C[C@@H]1[C@@H](NC(=O)c1ccc(-c2nnn[n-]2)cc1)c1ccc(Cl)cc1 ZINC000736237203 599226764 /nfs/dbraw/zinc/22/67/64/599226764.db2.gz VCGVRRNTTKJAPJ-NVGVWMPQSA-N -1 3 367.840 3.647 20 0 FHADHM C[C@@H]1C[C@@H]1[C@@H](NC(=O)c1ccc(-c2nn[n-]n2)cc1)c1ccc(Cl)cc1 ZINC000736237203 599226765 /nfs/dbraw/zinc/22/67/65/599226765.db2.gz VCGVRRNTTKJAPJ-NVGVWMPQSA-N -1 3 367.840 3.647 20 0 FHADHM COc1cccc(CCCSCc2cc(-c3nnn[n-]3)ccc2F)c1 ZINC000821868113 599227013 /nfs/dbraw/zinc/22/70/13/599227013.db2.gz OICCQYXYFLXJAJ-UHFFFAOYSA-N -1 3 358.442 3.880 20 0 FHADHM COc1cccc(CCCSCc2cc(-c3nn[n-]n3)ccc2F)c1 ZINC000821868113 599227016 /nfs/dbraw/zinc/22/70/16/599227016.db2.gz OICCQYXYFLXJAJ-UHFFFAOYSA-N -1 3 358.442 3.880 20 0 FHADHM Cc1c(NC(=O)[C@H]2C[C@@H]2c2cccc(Cl)c2)cccc1-c1nnn[n-]1 ZINC000822061514 607266991 /nfs/dbraw/zinc/26/69/91/607266991.db2.gz OSQBQYYURPYYRH-CABCVRRESA-N -1 3 353.813 3.571 20 0 FHADHM Cc1c(NC(=O)[C@H]2C[C@@H]2c2cccc(Cl)c2)cccc1-c1nn[n-]n1 ZINC000822061514 607266992 /nfs/dbraw/zinc/26/69/92/607266992.db2.gz OSQBQYYURPYYRH-CABCVRRESA-N -1 3 353.813 3.571 20 0 FHADHM Cc1c(NC(=O)c2cc3cc(F)ccc3s2)cccc1-c1nnn[n-]1 ZINC000822108331 607267249 /nfs/dbraw/zinc/26/72/49/607267249.db2.gz HSTZTAREQUWDBS-UHFFFAOYSA-N -1 3 353.382 3.781 20 0 FHADHM Cc1c(NC(=O)c2cc3cc(F)ccc3s2)cccc1-c1nn[n-]n1 ZINC000822108331 607267250 /nfs/dbraw/zinc/26/72/50/607267250.db2.gz HSTZTAREQUWDBS-UHFFFAOYSA-N -1 3 353.382 3.781 20 0 FHADHM Cc1c(NC(=O)CCCOc2ccccc2Cl)cccc1-c1nnn[n-]1 ZINC000822068008 607267419 /nfs/dbraw/zinc/26/74/19/607267419.db2.gz NFZMHRDLHGDCPC-UHFFFAOYSA-N -1 3 371.828 3.626 20 0 FHADHM Cc1c(NC(=O)CCCOc2ccccc2Cl)cccc1-c1nn[n-]n1 ZINC000822068008 607267420 /nfs/dbraw/zinc/26/74/20/607267420.db2.gz NFZMHRDLHGDCPC-UHFFFAOYSA-N -1 3 371.828 3.626 20 0 FHADHM Cc1ccc(C(C)C)c(OCC(=O)Nc2cccc(-c3nnn[n-]3)c2C)c1 ZINC000822228666 607267735 /nfs/dbraw/zinc/26/77/35/607267735.db2.gz BWBFPCRTYFBQIW-UHFFFAOYSA-N -1 3 365.437 3.624 20 0 FHADHM Cc1ccc(C(C)C)c(OCC(=O)Nc2cccc(-c3nn[n-]n3)c2C)c1 ZINC000822228666 607267736 /nfs/dbraw/zinc/26/77/36/607267736.db2.gz BWBFPCRTYFBQIW-UHFFFAOYSA-N -1 3 365.437 3.624 20 0 FHADHM Cc1cccc(C)c1NC(=S)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000822293600 599239710 /nfs/dbraw/zinc/23/97/10/599239710.db2.gz DHWDDZRWXJDLIY-ZDUSSCGKSA-N -1 3 352.467 3.531 20 0 FHADHM Cc1cccc(C)c1NC(=S)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000822293600 599239711 /nfs/dbraw/zinc/23/97/11/599239711.db2.gz DHWDDZRWXJDLIY-ZDUSSCGKSA-N -1 3 352.467 3.531 20 0 FHADHM Cc1cccc([C@H]2CCCN2C(=O)Nc2ccc(-c3nnn[n-]3)cc2)c1C ZINC000822299768 599241971 /nfs/dbraw/zinc/24/19/71/599241971.db2.gz UTVAXTADVZSULB-GOSISDBHSA-N -1 3 362.437 3.853 20 0 FHADHM Cc1cccc([C@H]2CCCN2C(=O)Nc2ccc(-c3nn[n-]n3)cc2)c1C ZINC000822299768 599241973 /nfs/dbraw/zinc/24/19/73/599241973.db2.gz UTVAXTADVZSULB-GOSISDBHSA-N -1 3 362.437 3.853 20 0 FHADHM Cc1c(NC(=O)c2ccc(Oc3cccnc3)cc2)cccc1-c1nnn[n-]1 ZINC000822108172 607269155 /nfs/dbraw/zinc/26/91/55/607269155.db2.gz FTILKBLDDUQPCV-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1c(NC(=O)c2ccc(Oc3cccnc3)cc2)cccc1-c1nn[n-]n1 ZINC000822108172 607269156 /nfs/dbraw/zinc/26/91/56/607269156.db2.gz FTILKBLDDUQPCV-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccc([C@@H]2CCCCN2C(=O)Nc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000822233170 599243898 /nfs/dbraw/zinc/24/38/98/599243898.db2.gz IYTIVGNZUHHBBD-SFHVURJKSA-N -1 3 362.437 3.934 20 0 FHADHM Cc1ccc([C@@H]2CCCCN2C(=O)Nc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000822233170 599243900 /nfs/dbraw/zinc/24/39/00/599243900.db2.gz IYTIVGNZUHHBBD-SFHVURJKSA-N -1 3 362.437 3.934 20 0 FHADHM C[C@@H]1C[C@H](c2cccc(F)c2)N(C(=O)Nc2cccc(-c3nnn[n-]3)c2)C1 ZINC000820668586 599246947 /nfs/dbraw/zinc/24/69/47/599246947.db2.gz VBIUGGQLZMXCDS-SJKOYZFVSA-N -1 3 366.400 3.621 20 0 FHADHM C[C@@H]1C[C@H](c2cccc(F)c2)N(C(=O)Nc2cccc(-c3nn[n-]n3)c2)C1 ZINC000820668586 599246950 /nfs/dbraw/zinc/24/69/50/599246950.db2.gz VBIUGGQLZMXCDS-SJKOYZFVSA-N -1 3 366.400 3.621 20 0 FHADHM Cc1cc(C)c(NC(=O)NCc2cc(-c3nnn[n-]3)ccc2F)c(Cl)c1 ZINC000822194388 599247997 /nfs/dbraw/zinc/24/79/97/599247997.db2.gz VLZZLRRHGVAXIV-UHFFFAOYSA-N -1 3 374.807 3.598 20 0 FHADHM Cc1cc(C)c(NC(=O)NCc2cc(-c3nn[n-]n3)ccc2F)c(Cl)c1 ZINC000822194388 599247998 /nfs/dbraw/zinc/24/79/98/599247998.db2.gz VLZZLRRHGVAXIV-UHFFFAOYSA-N -1 3 374.807 3.598 20 0 FHADHM CCCOc1ccccc1NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821139449 599249628 /nfs/dbraw/zinc/24/96/28/599249628.db2.gz ZQRRWUCHRKUAMS-CYBMUJFWSA-N -1 3 366.425 3.538 20 0 FHADHM CCCOc1ccccc1NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821139449 599249630 /nfs/dbraw/zinc/24/96/30/599249630.db2.gz ZQRRWUCHRKUAMS-CYBMUJFWSA-N -1 3 366.425 3.538 20 0 FHADHM O=C([O-])CCCNCc1csc(-c2cccc(Br)c2)n1 ZINC000262460007 597264873 /nfs/dbraw/zinc/26/48/73/597264873.db2.gz QMNZQTUIRWPIKW-UHFFFAOYSA-N -1 3 355.257 3.527 20 0 FHADHM Cc1c(NC(=O)N(Cc2cccs2)C(C)C)cccc1-c1nnn[n-]1 ZINC000822083575 607281278 /nfs/dbraw/zinc/28/12/78/607281278.db2.gz CNNDFLSSMGXTSY-UHFFFAOYSA-N -1 3 356.455 3.679 20 0 FHADHM Cc1c(NC(=O)N(Cc2cccs2)C(C)C)cccc1-c1nn[n-]n1 ZINC000822083575 607281279 /nfs/dbraw/zinc/28/12/79/607281279.db2.gz CNNDFLSSMGXTSY-UHFFFAOYSA-N -1 3 356.455 3.679 20 0 FHADHM Cc1cccc([C@@H]2CCCN2C(=O)Nc2cccc(-c3nnn[n-]3)c2C)c1 ZINC000822299261 607287800 /nfs/dbraw/zinc/28/78/00/607287800.db2.gz CRASQOIOTUVTPT-SFHVURJKSA-N -1 3 362.437 3.853 20 0 FHADHM Cc1cccc([C@@H]2CCCN2C(=O)Nc2cccc(-c3nn[n-]n3)c2C)c1 ZINC000822299261 607287801 /nfs/dbraw/zinc/28/78/01/607287801.db2.gz CRASQOIOTUVTPT-SFHVURJKSA-N -1 3 362.437 3.853 20 0 FHADHM Cc1cccc2c1ncc(-c1nnn[n-]1)c2N1CCC[C@@H](C(F)(F)F)C1 ZINC000737410122 599256171 /nfs/dbraw/zinc/25/61/71/599256171.db2.gz PJSXUSTYLPTMNS-LLVKDONJSA-N -1 3 362.359 3.502 20 0 FHADHM Cc1cccc2c1ncc(-c1nn[n-]n1)c2N1CCC[C@@H](C(F)(F)F)C1 ZINC000737410122 599256172 /nfs/dbraw/zinc/25/61/72/599256172.db2.gz PJSXUSTYLPTMNS-LLVKDONJSA-N -1 3 362.359 3.502 20 0 FHADHM Cc1c(NC(=O)N([C@@H](C)c2ccco2)C2CC2)cccc1-c1nnn[n-]1 ZINC000822075267 607285541 /nfs/dbraw/zinc/28/55/41/607285541.db2.gz ANVUFOUARRPKSC-LBPRGKRZSA-N -1 3 352.398 3.526 20 0 FHADHM Cc1c(NC(=O)N([C@@H](C)c2ccco2)C2CC2)cccc1-c1nn[n-]n1 ZINC000822075267 607285542 /nfs/dbraw/zinc/28/55/42/607285542.db2.gz ANVUFOUARRPKSC-LBPRGKRZSA-N -1 3 352.398 3.526 20 0 FHADHM Cc1c(NC(=O)N(C)Cc2cc3ccccc3o2)cccc1-c1nnn[n-]1 ZINC000822075847 607289745 /nfs/dbraw/zinc/28/97/45/607289745.db2.gz JPMSNUBCCQMRNP-UHFFFAOYSA-N -1 3 362.393 3.585 20 0 FHADHM Cc1c(NC(=O)N(C)Cc2cc3ccccc3o2)cccc1-c1nn[n-]n1 ZINC000822075847 607289746 /nfs/dbraw/zinc/28/97/46/607289746.db2.gz JPMSNUBCCQMRNP-UHFFFAOYSA-N -1 3 362.393 3.585 20 0 FHADHM Cc1cccc([C@H]2CCCCCN2C(=O)c2sccc2-c2nnn[n-]2)c1 ZINC000737388613 599262505 /nfs/dbraw/zinc/26/25/05/599262505.db2.gz GIBNBOCYAVLYPL-MRXNPFEDSA-N -1 3 367.478 3.994 20 0 FHADHM Cc1cccc([C@H]2CCCCCN2C(=O)c2sccc2-c2nn[n-]n2)c1 ZINC000737388613 599262509 /nfs/dbraw/zinc/26/25/09/599262509.db2.gz GIBNBOCYAVLYPL-MRXNPFEDSA-N -1 3 367.478 3.994 20 0 FHADHM O=C(Nc1ccc(F)cc1OC1CCCC1)c1cccc(-c2nnn[n-]2)c1 ZINC000823346698 607294704 /nfs/dbraw/zinc/29/47/04/607294704.db2.gz PGAOMWSDDTVILC-UHFFFAOYSA-N -1 3 367.384 3.580 20 0 FHADHM O=C(Nc1ccc(F)cc1OC1CCCC1)c1cccc(-c2nn[n-]n2)c1 ZINC000823346698 607294705 /nfs/dbraw/zinc/29/47/05/607294705.db2.gz PGAOMWSDDTVILC-UHFFFAOYSA-N -1 3 367.384 3.580 20 0 FHADHM CCC[C@]1(C)CCCN(C(=O)N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)C1 ZINC000821027692 599259915 /nfs/dbraw/zinc/25/99/15/599259915.db2.gz QQJVAMSRUSRBTR-IFXJQAMLSA-N -1 3 356.474 3.540 20 0 FHADHM CCC[C@]1(C)CCCN(C(=O)N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)C1 ZINC000821027692 599259917 /nfs/dbraw/zinc/25/99/17/599259917.db2.gz QQJVAMSRUSRBTR-IFXJQAMLSA-N -1 3 356.474 3.540 20 0 FHADHM CCC[C@]1(C)CCCN(C(=O)N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)C1 ZINC000821027691 599260086 /nfs/dbraw/zinc/26/00/86/599260086.db2.gz QQJVAMSRUSRBTR-AUUYWEPGSA-N -1 3 356.474 3.540 20 0 FHADHM CCC[C@]1(C)CCCN(C(=O)N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)C1 ZINC000821027691 599260087 /nfs/dbraw/zinc/26/00/87/599260087.db2.gz QQJVAMSRUSRBTR-AUUYWEPGSA-N -1 3 356.474 3.540 20 0 FHADHM CCN(C(=O)CCCC[C@H](C)C(C)=O)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821154789 607299755 /nfs/dbraw/zinc/29/97/55/607299755.db2.gz RNRHRFSUUPGLAY-LSDHHAIUSA-N -1 3 371.485 3.562 20 0 FHADHM CCN(C(=O)CCCC[C@H](C)C(C)=O)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821154789 607299756 /nfs/dbraw/zinc/29/97/56/607299756.db2.gz RNRHRFSUUPGLAY-LSDHHAIUSA-N -1 3 371.485 3.562 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NC(=O)N1C[C@@H](C)CCC[C@H]1C ZINC000820690218 599262899 /nfs/dbraw/zinc/26/28/99/599262899.db2.gz HSHSDUFBONGCDC-UONOGXRCSA-N -1 3 372.473 3.696 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NC(=O)N1C[C@@H](C)CCC[C@H]1C ZINC000820690218 599262900 /nfs/dbraw/zinc/26/29/00/599262900.db2.gz HSHSDUFBONGCDC-UONOGXRCSA-N -1 3 372.473 3.696 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NC(=O)N1C[C@H](C)CCC[C@H]1C ZINC000820690219 599263140 /nfs/dbraw/zinc/26/31/40/599263140.db2.gz HSHSDUFBONGCDC-ZIAGYGMSSA-N -1 3 372.473 3.696 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NC(=O)N1C[C@H](C)CCC[C@H]1C ZINC000820690219 599263143 /nfs/dbraw/zinc/26/31/43/599263143.db2.gz HSHSDUFBONGCDC-ZIAGYGMSSA-N -1 3 372.473 3.696 20 0 FHADHM c1nc(COc2ccccc2NCc2cc(-c3nnn[n-]3)cs2)cs1 ZINC000823792485 607316400 /nfs/dbraw/zinc/31/64/00/607316400.db2.gz VBZMHVKYQKOCDJ-UHFFFAOYSA-N -1 3 370.463 3.576 20 0 FHADHM c1nc(COc2ccccc2NCc2cc(-c3nn[n-]n3)cs2)cs1 ZINC000823792485 607316401 /nfs/dbraw/zinc/31/64/01/607316401.db2.gz VBZMHVKYQKOCDJ-UHFFFAOYSA-N -1 3 370.463 3.576 20 0 FHADHM Cc1nc(-c2ccc(NCc3ccc(-c4nnn[n-]4)s3)cc2)oc1C ZINC000822419658 607314764 /nfs/dbraw/zinc/31/47/64/607314764.db2.gz RYUAUCJUXQESIE-UHFFFAOYSA-N -1 3 352.423 3.812 20 0 FHADHM Clc1cc(NCc2ccc(-c3nnn[n-]3)cc2)ccc1N1CCCC1 ZINC000822568692 607315220 /nfs/dbraw/zinc/31/52/20/607315220.db2.gz WKABFBQYALHIAB-UHFFFAOYSA-N -1 3 354.845 3.732 20 0 FHADHM Clc1cc(NCc2ccc(-c3nn[n-]n3)cc2)ccc1N1CCCC1 ZINC000822568692 607315221 /nfs/dbraw/zinc/31/52/21/607315221.db2.gz WKABFBQYALHIAB-UHFFFAOYSA-N -1 3 354.845 3.732 20 0 FHADHM COc1ccc(CNc2cccc(SC(F)F)c2)cc1-c1nnn[n-]1 ZINC000821824117 607316266 /nfs/dbraw/zinc/31/62/66/607316266.db2.gz HDUWKJHZNZHIGP-UHFFFAOYSA-N -1 3 363.393 3.802 20 0 FHADHM COc1ccc(CNc2cccc(SC(F)F)c2)cc1-c1nn[n-]n1 ZINC000821824117 607316267 /nfs/dbraw/zinc/31/62/67/607316267.db2.gz HDUWKJHZNZHIGP-UHFFFAOYSA-N -1 3 363.393 3.802 20 0 FHADHM CC(C)(C)[S@@](=O)Cc1cccc(NCc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000819951322 607316906 /nfs/dbraw/zinc/31/69/06/607316906.db2.gz SECWQLLBEBIKOR-SANMLTNESA-N -1 3 369.494 3.526 20 0 FHADHM CC(C)(C)[S@@](=O)Cc1cccc(NCc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000819951322 607316907 /nfs/dbraw/zinc/31/69/07/607316907.db2.gz SECWQLLBEBIKOR-SANMLTNESA-N -1 3 369.494 3.526 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CCC(C2CCCC2)CC1 ZINC000822217436 599269831 /nfs/dbraw/zinc/26/98/31/599269831.db2.gz DTHPLKIJVHKCAZ-UHFFFAOYSA-N -1 3 354.458 3.609 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CCC(C2CCCC2)CC1 ZINC000822217436 599269833 /nfs/dbraw/zinc/26/98/33/599269833.db2.gz DTHPLKIJVHKCAZ-UHFFFAOYSA-N -1 3 354.458 3.609 20 0 FHADHM CC1CCN(c2cccc(NCc3ccc(-c4nnn[n-]4)s3)c2)CC1 ZINC000820728071 607317456 /nfs/dbraw/zinc/31/74/56/607317456.db2.gz SBZIAVUPXUXNAE-UHFFFAOYSA-N -1 3 354.483 3.777 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)CCCc1cccs1 ZINC000736489382 599275138 /nfs/dbraw/zinc/27/51/38/599275138.db2.gz ZEAGQZUSUZAJAA-UHFFFAOYSA-N -1 3 370.482 3.712 20 0 FHADHM CSCc1ccc(NC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000821970815 599277615 /nfs/dbraw/zinc/27/76/15/599277615.db2.gz SOLZRIXDUJNNCQ-GFCCVEGCSA-N -1 3 368.466 3.612 20 0 FHADHM CSCc1ccc(NC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000821970815 599277617 /nfs/dbraw/zinc/27/76/17/599277617.db2.gz SOLZRIXDUJNNCQ-GFCCVEGCSA-N -1 3 368.466 3.612 20 0 FHADHM CCc1ccc([C@H]2CCCN2C(=O)Nc2cc(-c3nnn[n-]3)ccc2C)o1 ZINC000736684444 599279993 /nfs/dbraw/zinc/27/99/93/599279993.db2.gz HFOOXAJCUXVNIG-MRXNPFEDSA-N -1 3 366.425 3.700 20 0 FHADHM CCc1ccc([C@H]2CCCN2C(=O)Nc2cc(-c3nn[n-]n3)ccc2C)o1 ZINC000736684444 599279995 /nfs/dbraw/zinc/27/99/95/599279995.db2.gz HFOOXAJCUXVNIG-MRXNPFEDSA-N -1 3 366.425 3.700 20 0 FHADHM Cc1cc(-c2nn[n-]n2)cc(C)c1OCc1coc(-c2cccs2)n1 ZINC000737222316 599283868 /nfs/dbraw/zinc/28/38/68/599283868.db2.gz XKWFWXRMYIPXKX-UHFFFAOYSA-N -1 3 353.407 3.779 20 0 FHADHM CC[C@H]1CCCCN1C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000820981641 599292026 /nfs/dbraw/zinc/29/20/26/599292026.db2.gz USFUCLJBXRLVRB-NSHDSACASA-N -1 3 368.363 3.682 20 0 FHADHM CC[C@H]1CCCCN1C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000820981641 599292027 /nfs/dbraw/zinc/29/20/27/599292027.db2.gz USFUCLJBXRLVRB-NSHDSACASA-N -1 3 368.363 3.682 20 0 FHADHM O=C([O-])c1cccc(CNCc2ccc(N3CCc4ccccc4C3)nc2)c1 ZINC000821552784 598202993 /nfs/dbraw/zinc/20/29/93/598202993.db2.gz RWFIXYZLAPNBNG-UHFFFAOYSA-N -1 3 373.456 3.632 20 0 FHADHM Fc1cccc(Nc2cccc(OCC(F)(F)F)c2)c1-c1nnn[n-]1 ZINC000737662682 598239000 /nfs/dbraw/zinc/23/90/00/598239000.db2.gz CUTYLIGSNZWCOS-UHFFFAOYSA-N -1 3 353.279 3.691 20 0 FHADHM Fc1cccc(Nc2cccc(OCC(F)(F)F)c2)c1-c1nn[n-]n1 ZINC000737662682 598239001 /nfs/dbraw/zinc/23/90/01/598239001.db2.gz CUTYLIGSNZWCOS-UHFFFAOYSA-N -1 3 353.279 3.691 20 0 FHADHM CCCOc1ccc([C@H](C)Nc2ccc(-c3nn[n-]n3)cc2F)cc1OC ZINC000736490421 598239372 /nfs/dbraw/zinc/23/93/72/598239372.db2.gz LKQGUGSYTUMWQB-LBPRGKRZSA-N -1 3 371.416 3.976 20 0 FHADHM CC(C)(C)OC(=O)NC1(CNc2ccc(-c3nn[n-]n3)cc2)CCCCC1 ZINC000735632692 598245364 /nfs/dbraw/zinc/24/53/64/598245364.db2.gz FQZPQLRMYMIOGA-UHFFFAOYSA-N -1 3 372.473 3.506 20 0 FHADHM CCCN(C)C(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736471122 598267022 /nfs/dbraw/zinc/26/70/22/598267022.db2.gz HOFXKXCFVDLRHD-UHFFFAOYSA-N -1 3 352.398 3.533 20 0 FHADHM CCCN(C)C(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736471122 598267024 /nfs/dbraw/zinc/26/70/24/598267024.db2.gz HOFXKXCFVDLRHD-UHFFFAOYSA-N -1 3 352.398 3.533 20 0 FHADHM CCC(CC)NC(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736345789 598267232 /nfs/dbraw/zinc/26/72/32/598267232.db2.gz LJCBBICVVZYRIA-UHFFFAOYSA-N -1 3 366.425 3.969 20 0 FHADHM CCC(CC)NC(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736345789 598267234 /nfs/dbraw/zinc/26/72/34/598267234.db2.gz LJCBBICVVZYRIA-UHFFFAOYSA-N -1 3 366.425 3.969 20 0 FHADHM CCN(C(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)C1CC1 ZINC000736504593 598267256 /nfs/dbraw/zinc/26/72/56/598267256.db2.gz BUGSUVIBTYZYHE-UHFFFAOYSA-N -1 3 364.409 3.675 20 0 FHADHM CCN(C(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)C1CC1 ZINC000736504593 598267259 /nfs/dbraw/zinc/26/72/59/598267259.db2.gz BUGSUVIBTYZYHE-UHFFFAOYSA-N -1 3 364.409 3.675 20 0 FHADHM C[C@@H](CCc1ccco1)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000735992714 598274691 /nfs/dbraw/zinc/27/46/91/598274691.db2.gz LTKHLDIOHRZCRX-JTQLQIEISA-N -1 3 351.332 3.912 20 0 FHADHM C[C@@H](CCc1ccco1)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000735992714 598274693 /nfs/dbraw/zinc/27/46/93/598274693.db2.gz LTKHLDIOHRZCRX-JTQLQIEISA-N -1 3 351.332 3.912 20 0 FHADHM Cc1ccccc1[C@@H](C)NC(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000737420152 598275495 /nfs/dbraw/zinc/27/54/95/598275495.db2.gz HAIDIDLANDYNLL-CYBMUJFWSA-N -1 3 367.457 3.614 20 0 FHADHM Cc1ccccc1[C@@H](C)NC(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000737420152 598275496 /nfs/dbraw/zinc/27/54/96/598275496.db2.gz HAIDIDLANDYNLL-CYBMUJFWSA-N -1 3 367.457 3.614 20 0 FHADHM CCCCC1CCC(C(=O)N(C)c2ccc(-c3nnn[n-]3)cc2F)CC1 ZINC000736437364 598281574 /nfs/dbraw/zinc/28/15/74/598281574.db2.gz IPDNAWBYAQQBJQ-UHFFFAOYSA-N -1 3 359.449 3.965 20 0 FHADHM CCCCC1CCC(C(=O)N(C)c2ccc(-c3nn[n-]n3)cc2F)CC1 ZINC000736437364 598281576 /nfs/dbraw/zinc/28/15/76/598281576.db2.gz IPDNAWBYAQQBJQ-UHFFFAOYSA-N -1 3 359.449 3.965 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N(Cc1cccs1)C(C)C ZINC000737291491 598293249 /nfs/dbraw/zinc/29/32/49/598293249.db2.gz MYBYMUHHYAIPBY-UHFFFAOYSA-N -1 3 356.455 3.679 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N(Cc1cccs1)C(C)C ZINC000737291491 598293251 /nfs/dbraw/zinc/29/32/51/598293251.db2.gz MYBYMUHHYAIPBY-UHFFFAOYSA-N -1 3 356.455 3.679 20 0 FHADHM Cc1nc(-c2ccsc2)ccc1C(=O)Nc1sccc1-c1nnn[n-]1 ZINC000737464603 598296034 /nfs/dbraw/zinc/29/60/34/598296034.db2.gz QDFNWERMGLCWTL-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM Cc1nc(-c2ccsc2)ccc1C(=O)Nc1sccc1-c1nn[n-]n1 ZINC000737464603 598296036 /nfs/dbraw/zinc/29/60/36/598296036.db2.gz QDFNWERMGLCWTL-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM CC[C@@H](C)Oc1ccccc1C=CC(=O)Nc1sccc1-c1nnn[n-]1 ZINC000736328076 598297015 /nfs/dbraw/zinc/29/70/15/598297015.db2.gz NRYGZQDPUOAHOQ-IDVQTMNDSA-N -1 3 369.450 3.757 20 0 FHADHM CC[C@@H](C)Oc1ccccc1C=CC(=O)Nc1sccc1-c1nn[n-]n1 ZINC000736328076 598297018 /nfs/dbraw/zinc/29/70/18/598297018.db2.gz NRYGZQDPUOAHOQ-IDVQTMNDSA-N -1 3 369.450 3.757 20 0 FHADHM Cc1cc(F)ccc1C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCC2 ZINC000822205866 607349416 /nfs/dbraw/zinc/34/94/16/607349416.db2.gz LEBVEWBLNSTMEQ-UHFFFAOYSA-N -1 3 357.414 3.507 20 0 FHADHM Cc1cc(F)ccc1C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCC2 ZINC000822205866 607349418 /nfs/dbraw/zinc/34/94/18/607349418.db2.gz LEBVEWBLNSTMEQ-UHFFFAOYSA-N -1 3 357.414 3.507 20 0 FHADHM C[C@@H](OC(=O)CCc1ccc(-c2nnn[n-]2)cc1)c1cnc2ccccc2c1 ZINC000736152327 598306506 /nfs/dbraw/zinc/30/65/06/598306506.db2.gz SSMSPAVNOPJHDI-CQSZACIVSA-N -1 3 373.416 3.652 20 0 FHADHM C[C@@H](OC(=O)CCc1ccc(-c2nn[n-]n2)cc1)c1cnc2ccccc2c1 ZINC000736152327 598306507 /nfs/dbraw/zinc/30/65/07/598306507.db2.gz SSMSPAVNOPJHDI-CQSZACIVSA-N -1 3 373.416 3.652 20 0 FHADHM CN(C(=O)c1cc2c(cccc2F)s1)c1ccc(-c2nnn[n-]2)cc1F ZINC000736746994 598311694 /nfs/dbraw/zinc/31/16/94/598311694.db2.gz DDOSGNGIWINOCN-UHFFFAOYSA-N -1 3 371.372 3.636 20 0 FHADHM CN(C(=O)c1cc2c(cccc2F)s1)c1ccc(-c2nn[n-]n2)cc1F ZINC000736746994 598311696 /nfs/dbraw/zinc/31/16/96/598311696.db2.gz DDOSGNGIWINOCN-UHFFFAOYSA-N -1 3 371.372 3.636 20 0 FHADHM Cc1csc(-c2cccc(OC(=O)c3cccc(-c4nnn[n-]4)c3)c2)n1 ZINC000737448877 598311742 /nfs/dbraw/zinc/31/17/42/598311742.db2.gz RSAJYKUSOILQJS-UHFFFAOYSA-N -1 3 363.402 3.518 20 0 FHADHM Cc1csc(-c2cccc(OC(=O)c3cccc(-c4nn[n-]n4)c3)c2)n1 ZINC000737448877 598311745 /nfs/dbraw/zinc/31/17/45/598311745.db2.gz RSAJYKUSOILQJS-UHFFFAOYSA-N -1 3 363.402 3.518 20 0 FHADHM C[C@@H]1CCCC[C@@H]1CNC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736269943 598321902 /nfs/dbraw/zinc/32/19/02/598321902.db2.gz HQGQMUICTWDBMH-GHMZBOCLSA-N -1 3 364.906 3.633 20 0 FHADHM C[C@@H]1CCCC[C@@H]1CNC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736269943 598321903 /nfs/dbraw/zinc/32/19/03/598321903.db2.gz HQGQMUICTWDBMH-GHMZBOCLSA-N -1 3 364.906 3.633 20 0 FHADHM CC(C)C[C@@H]1CCCN1C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000735796034 598323193 /nfs/dbraw/zinc/32/31/93/598323193.db2.gz QWHVUVULBUNRKA-LBPRGKRZSA-N -1 3 364.906 3.727 20 0 FHADHM CC(C)C[C@@H]1CCCN1C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000735796034 598323195 /nfs/dbraw/zinc/32/31/95/598323195.db2.gz QWHVUVULBUNRKA-LBPRGKRZSA-N -1 3 364.906 3.727 20 0 FHADHM CC(C)N(C(=S)N[C@@H](C)c1cccs1)c1cccc(-c2nnn[n-]2)c1 ZINC000736128527 598324129 /nfs/dbraw/zinc/32/41/29/598324129.db2.gz XWZREFAEXPPKCV-LBPRGKRZSA-N -1 3 372.523 3.779 20 0 FHADHM CC(C)N(C(=S)N[C@@H](C)c1cccs1)c1cccc(-c2nn[n-]n2)c1 ZINC000736128527 598324131 /nfs/dbraw/zinc/32/41/31/598324131.db2.gz XWZREFAEXPPKCV-LBPRGKRZSA-N -1 3 372.523 3.779 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)[C@@H]1CCCc2sccc21 ZINC000819971224 607350289 /nfs/dbraw/zinc/35/02/89/607350289.db2.gz FOWYIBXKKGHORC-CYBMUJFWSA-N -1 3 370.482 3.543 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)[C@@H]1CCCc2sccc21 ZINC000819971224 607350291 /nfs/dbraw/zinc/35/02/91/607350291.db2.gz FOWYIBXKKGHORC-CYBMUJFWSA-N -1 3 370.482 3.543 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)c1ccccc1C(C)(C)C ZINC000821412973 607350977 /nfs/dbraw/zinc/35/09/77/607350977.db2.gz VHIMMFMBLLQXIC-UHFFFAOYSA-N -1 3 365.437 3.815 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)c1ccccc1C(C)(C)C ZINC000821412973 607350979 /nfs/dbraw/zinc/35/09/79/607350979.db2.gz VHIMMFMBLLQXIC-UHFFFAOYSA-N -1 3 365.437 3.815 20 0 FHADHM Cc1sc(NC(=O)C[C@H](C)c2ccccc2F)c(-c2nnn[n-]2)c1C ZINC000737562408 598365599 /nfs/dbraw/zinc/36/55/99/598365599.db2.gz MXDYSNGJLXXRIZ-VIFPVBQESA-N -1 3 359.430 3.816 20 0 FHADHM Cc1sc(NC(=O)C[C@H](C)c2ccccc2F)c(-c2nn[n-]n2)c1C ZINC000737562408 598365601 /nfs/dbraw/zinc/36/56/01/598365601.db2.gz MXDYSNGJLXXRIZ-VIFPVBQESA-N -1 3 359.430 3.816 20 0 FHADHM Cc1ccccc1C1CCN(c2ncc(-c3nnn[n-]3)cc2Cl)CC1 ZINC000737419691 598386640 /nfs/dbraw/zinc/38/66/40/598386640.db2.gz AMSKOLVJJRRGDL-UHFFFAOYSA-N -1 3 354.845 3.608 20 0 FHADHM Cc1ccccc1C1CCN(c2ncc(-c3nn[n-]n3)cc2Cl)CC1 ZINC000737419691 598386641 /nfs/dbraw/zinc/38/66/41/598386641.db2.gz AMSKOLVJJRRGDL-UHFFFAOYSA-N -1 3 354.845 3.608 20 0 FHADHM Fc1ccc(SCCCNc2ncc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000737657550 598387142 /nfs/dbraw/zinc/38/71/42/598387142.db2.gz WVWUYIOCABGMSX-UHFFFAOYSA-N -1 3 364.837 3.649 20 0 FHADHM Fc1ccc(SCCCNc2ncc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000737657550 598387144 /nfs/dbraw/zinc/38/71/44/598387144.db2.gz WVWUYIOCABGMSX-UHFFFAOYSA-N -1 3 364.837 3.649 20 0 FHADHM CC(C)c1ccc(-c2noc(CNc3ccc(-c4nn[n-]n4)cc3)n2)cc1 ZINC000735923942 598415298 /nfs/dbraw/zinc/41/52/98/598415298.db2.gz ZMHLPCCQUSFKQC-UHFFFAOYSA-N -1 3 361.409 3.652 20 0 FHADHM O=C(C[C@H]1C=CCC1)Nc1ccccc1NCc1ccccc1-c1nnn[n-]1 ZINC000737813140 598418278 /nfs/dbraw/zinc/41/82/78/598418278.db2.gz HRNQEUJPJWFQLX-HNNXBMFYSA-N -1 3 374.448 3.774 20 0 FHADHM O=C(C[C@H]1C=CCC1)Nc1ccccc1NCc1ccccc1-c1nn[n-]n1 ZINC000737813140 598418279 /nfs/dbraw/zinc/41/82/79/598418279.db2.gz HRNQEUJPJWFQLX-HNNXBMFYSA-N -1 3 374.448 3.774 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl ZINC000500684808 598419132 /nfs/dbraw/zinc/41/91/32/598419132.db2.gz OUYSVDVPUUSTFN-ZIAGYGMSSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl ZINC000500684808 598419134 /nfs/dbraw/zinc/41/91/34/598419134.db2.gz OUYSVDVPUUSTFN-ZIAGYGMSSA-N -1 3 374.231 3.916 20 0 FHADHM CC(C)Oc1ccc(F)cc1NC(=S)Nc1ccccc1-c1nnn[n-]1 ZINC000735914698 598439605 /nfs/dbraw/zinc/43/96/05/598439605.db2.gz ILBLJYDESWCIJA-UHFFFAOYSA-N -1 3 372.429 3.602 20 0 FHADHM CC(C)Oc1ccc(F)cc1NC(=S)Nc1ccccc1-c1nn[n-]n1 ZINC000735914698 598439607 /nfs/dbraw/zinc/43/96/07/598439607.db2.gz ILBLJYDESWCIJA-UHFFFAOYSA-N -1 3 372.429 3.602 20 0 FHADHM CC(=CC(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccccc1Cl ZINC000735448851 598442131 /nfs/dbraw/zinc/44/21/31/598442131.db2.gz LOGPGALMLKHAJG-YLGBQOPLSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=CC(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccccc1Cl ZINC000735448851 598442132 /nfs/dbraw/zinc/44/21/32/598442132.db2.gz LOGPGALMLKHAJG-YLGBQOPLSA-N -1 3 367.840 3.801 20 0 FHADHM C[C@H]1C[C@H](CC(=O)N(C)Cc2ccc(-c3nnn[n-]3)cc2)CC(C)(C)C1 ZINC000736227965 598442442 /nfs/dbraw/zinc/44/24/42/598442442.db2.gz MOLCXWHZMLAVOO-GOEBONIOSA-N -1 3 355.486 3.678 20 0 FHADHM C[C@H]1C[C@H](CC(=O)N(C)Cc2ccc(-c3nn[n-]n3)cc2)CC(C)(C)C1 ZINC000736227965 598442444 /nfs/dbraw/zinc/44/24/44/598442444.db2.gz MOLCXWHZMLAVOO-GOEBONIOSA-N -1 3 355.486 3.678 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)C=C(C)c2ccccc2OC)s1 ZINC000736679715 598443899 /nfs/dbraw/zinc/44/38/99/598443899.db2.gz ZVGITGURGIKMMS-PKNBQFBNSA-N -1 3 369.450 3.541 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)C=C(C)c2ccccc2OC)s1 ZINC000736679715 598443900 /nfs/dbraw/zinc/44/39/00/598443900.db2.gz ZVGITGURGIKMMS-PKNBQFBNSA-N -1 3 369.450 3.541 20 0 FHADHM CCC(CC)N(C(=O)c1ccc(-c2nnn[n-]2)cn1)c1ccc(C)c(C)c1 ZINC000736345213 598449430 /nfs/dbraw/zinc/44/94/30/598449430.db2.gz GHTYCIKRNNGMNV-UHFFFAOYSA-N -1 3 364.453 3.714 20 0 FHADHM CCC(CC)N(C(=O)c1ccc(-c2nn[n-]n2)cn1)c1ccc(C)c(C)c1 ZINC000736345213 598449432 /nfs/dbraw/zinc/44/94/32/598449432.db2.gz GHTYCIKRNNGMNV-UHFFFAOYSA-N -1 3 364.453 3.714 20 0 FHADHM C[C@@H](c1ccccc1)c1ccc(OC(=O)c2ccc(-c3nnn[n-]3)cn2)cc1 ZINC000736201759 598453855 /nfs/dbraw/zinc/45/38/55/598453855.db2.gz HQEZSEPHZCQXAJ-AWEZNQCLSA-N -1 3 371.400 3.633 20 0 FHADHM C[C@@H](c1ccccc1)c1ccc(OC(=O)c2ccc(-c3nn[n-]n3)cn2)cc1 ZINC000736201759 598453857 /nfs/dbraw/zinc/45/38/57/598453857.db2.gz HQEZSEPHZCQXAJ-AWEZNQCLSA-N -1 3 371.400 3.633 20 0 FHADHM Cc1cccc(NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)c1C ZINC000737400605 598475004 /nfs/dbraw/zinc/47/50/04/598475004.db2.gz WUDZSXNEYVQBFW-UHFFFAOYSA-N -1 3 362.437 3.680 20 0 FHADHM Cc1cccc(NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)c1C ZINC000737400605 598475005 /nfs/dbraw/zinc/47/50/05/598475005.db2.gz WUDZSXNEYVQBFW-UHFFFAOYSA-N -1 3 362.437 3.680 20 0 FHADHM O=C(OCc1ccc(-c2nnn[n-]2)cc1)[C@@H]1C[C@@H]1c1cccc2ccccc21 ZINC000738236219 598475739 /nfs/dbraw/zinc/47/57/39/598475739.db2.gz FIRVEZKPXVUDHQ-WOJBJXKFSA-N -1 3 370.412 3.867 20 0 FHADHM O=C(OCc1ccc(-c2nn[n-]n2)cc1)[C@@H]1C[C@@H]1c1cccc2ccccc21 ZINC000738236219 598475741 /nfs/dbraw/zinc/47/57/41/598475741.db2.gz FIRVEZKPXVUDHQ-WOJBJXKFSA-N -1 3 370.412 3.867 20 0 FHADHM O=C(OCc1ccccc1-c1nnn[n-]1)[C@H]1C[C@H]1c1cccc2ccccc21 ZINC000738235308 598475973 /nfs/dbraw/zinc/47/59/73/598475973.db2.gz QOGXVIJJEPQFPG-PMACEKPBSA-N -1 3 370.412 3.867 20 0 FHADHM O=C(OCc1ccccc1-c1nn[n-]n1)[C@H]1C[C@H]1c1cccc2ccccc21 ZINC000738235308 598475975 /nfs/dbraw/zinc/47/59/75/598475975.db2.gz QOGXVIJJEPQFPG-PMACEKPBSA-N -1 3 370.412 3.867 20 0 FHADHM CC[C@@H]1CCCC[C@H]1NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000736401417 598478087 /nfs/dbraw/zinc/47/80/87/598478087.db2.gz WLKGYDQKDVEZRL-CRAIPNDOSA-N -1 3 368.485 3.510 20 0 FHADHM CC[C@@H]1CCCC[C@H]1NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000736401417 598478089 /nfs/dbraw/zinc/47/80/89/598478089.db2.gz WLKGYDQKDVEZRL-CRAIPNDOSA-N -1 3 368.485 3.510 20 0 FHADHM COc1ccccc1C(C)=CC(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000737143288 598481845 /nfs/dbraw/zinc/48/18/45/598481845.db2.gz TYUDPUUTNVPUTL-FZDNWWAKSA-N -1 3 364.405 3.583 20 0 FHADHM COc1ccccc1C(C)=CC(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000737143288 598481847 /nfs/dbraw/zinc/48/18/47/598481847.db2.gz TYUDPUUTNVPUTL-FZDNWWAKSA-N -1 3 364.405 3.583 20 0 FHADHM C[C@@H](OC(=O)c1[nH]c2ccccc2c1Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000736157900 598483951 /nfs/dbraw/zinc/48/39/51/598483951.db2.gz DYYKKQZLXOSLRK-SNVBAGLBSA-N -1 3 367.796 3.919 20 0 FHADHM C[C@@H](OC(=O)c1[nH]c2ccccc2c1Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000736157900 598483952 /nfs/dbraw/zinc/48/39/52/598483952.db2.gz DYYKKQZLXOSLRK-SNVBAGLBSA-N -1 3 367.796 3.919 20 0 FHADHM C[C@H](OC(=O)[C@H]1CCC[C@H](C(F)(F)F)C1)c1cccc(-c2nnn[n-]2)c1 ZINC000736151161 598483981 /nfs/dbraw/zinc/48/39/81/598483981.db2.gz LDAFMERHAMLEHD-BPNCWPANSA-N -1 3 368.359 3.840 20 0 FHADHM C[C@H](OC(=O)[C@H]1CCC[C@H](C(F)(F)F)C1)c1cccc(-c2nn[n-]n2)c1 ZINC000736151161 598483982 /nfs/dbraw/zinc/48/39/82/598483982.db2.gz LDAFMERHAMLEHD-BPNCWPANSA-N -1 3 368.359 3.840 20 0 FHADHM C[C@H](OC(=O)CCOc1cccc(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000736147109 598485770 /nfs/dbraw/zinc/48/57/70/598485770.db2.gz AVSPHPWWBBXLGL-LBPRGKRZSA-N -1 3 372.812 3.593 20 0 FHADHM C[C@H](OC(=O)CCOc1cccc(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000736147109 598485772 /nfs/dbraw/zinc/48/57/72/598485772.db2.gz AVSPHPWWBBXLGL-LBPRGKRZSA-N -1 3 372.812 3.593 20 0 FHADHM C[C@@H](OC(=O)CCSc1ccccc1)c1cccc(-c2nnn[n-]2)c1 ZINC000736152353 598486101 /nfs/dbraw/zinc/48/61/01/598486101.db2.gz TVMNCVWBEORMKC-CYBMUJFWSA-N -1 3 354.435 3.653 20 0 FHADHM C[C@@H](OC(=O)CCSc1ccccc1)c1cccc(-c2nn[n-]n2)c1 ZINC000736152353 598486103 /nfs/dbraw/zinc/48/61/03/598486103.db2.gz TVMNCVWBEORMKC-CYBMUJFWSA-N -1 3 354.435 3.653 20 0 FHADHM C[C@H](OC(=O)Cc1c(F)cccc1Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000736155408 598490877 /nfs/dbraw/zinc/49/08/77/598490877.db2.gz MRQMDTSYFXZVTA-JTQLQIEISA-N -1 3 360.776 3.506 20 0 FHADHM C[C@H](OC(=O)Cc1c(F)cccc1Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000736155408 598490878 /nfs/dbraw/zinc/49/08/78/598490878.db2.gz MRQMDTSYFXZVTA-JTQLQIEISA-N -1 3 360.776 3.506 20 0 FHADHM Cc1ccc(C(C)(C)C)cc1[S@@](=O)Cc1cccc(-c2nnn[n-]2)c1 ZINC000737316467 598491405 /nfs/dbraw/zinc/49/14/05/598491405.db2.gz CLLIXBWJRGVYPI-VWLOTQADSA-N -1 3 354.479 3.780 20 0 FHADHM Cc1ccc(C(C)(C)C)cc1[S@@](=O)Cc1cccc(-c2nn[n-]n2)c1 ZINC000737316467 598491407 /nfs/dbraw/zinc/49/14/07/598491407.db2.gz CLLIXBWJRGVYPI-VWLOTQADSA-N -1 3 354.479 3.780 20 0 FHADHM c1ccc2cc(OCCCSc3cc(-c4nnn[n-]4)ccn3)ccc2c1 ZINC000738440722 598495186 /nfs/dbraw/zinc/49/51/86/598495186.db2.gz IIUJKJJHUCKYFM-UHFFFAOYSA-N -1 3 363.446 3.976 20 0 FHADHM c1ccc2cc(OCCCSc3cc(-c4nn[n-]n4)ccn3)ccc2c1 ZINC000738440722 598495187 /nfs/dbraw/zinc/49/51/87/598495187.db2.gz IIUJKJJHUCKYFM-UHFFFAOYSA-N -1 3 363.446 3.976 20 0 FHADHM O=C(c1cccc(-c2nnn[n-]2)c1)N1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000738265771 598497247 /nfs/dbraw/zinc/49/72/47/598497247.db2.gz CWJKCNSLXFJYJC-LJQANCHMSA-N -1 3 372.432 3.715 20 0 FHADHM O=C(c1cccc(-c2nn[n-]n2)c1)N1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000738265771 598497248 /nfs/dbraw/zinc/49/72/48/598497248.db2.gz CWJKCNSLXFJYJC-LJQANCHMSA-N -1 3 372.432 3.715 20 0 FHADHM CCc1ccc([C@H](C)C(=O)Nc2ccc(Cl)c(-c3nnn[n-]3)c2)cc1 ZINC000736688664 598498352 /nfs/dbraw/zinc/49/83/52/598498352.db2.gz QGZCHPZJHSTUNP-NSHDSACASA-N -1 3 355.829 3.825 20 0 FHADHM CCc1ccc([C@H](C)C(=O)Nc2ccc(Cl)c(-c3nn[n-]n3)c2)cc1 ZINC000736688664 598498353 /nfs/dbraw/zinc/49/83/53/598498353.db2.gz QGZCHPZJHSTUNP-NSHDSACASA-N -1 3 355.829 3.825 20 0 FHADHM CCCOc1ccc(CNc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1OC ZINC000736491688 598507633 /nfs/dbraw/zinc/50/76/33/598507633.db2.gz WZMFWZKQQYTLIX-UHFFFAOYSA-N -1 3 373.844 3.930 20 0 FHADHM CCCOc1ccc(CNc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1OC ZINC000736491688 598507635 /nfs/dbraw/zinc/50/76/35/598507635.db2.gz WZMFWZKQQYTLIX-UHFFFAOYSA-N -1 3 373.844 3.930 20 0 FHADHM Clc1cc(NCCc2cccc3cccnc32)ccc1-c1nnn[n-]1 ZINC000737563039 598508383 /nfs/dbraw/zinc/50/83/83/598508383.db2.gz CXGZACSRKXTDLM-UHFFFAOYSA-N -1 3 350.813 3.723 20 0 FHADHM Clc1cc(NCCc2cccc3cccnc32)ccc1-c1nn[n-]n1 ZINC000737563039 598508385 /nfs/dbraw/zinc/50/83/85/598508385.db2.gz CXGZACSRKXTDLM-UHFFFAOYSA-N -1 3 350.813 3.723 20 0 FHADHM CCC[C@@H](Cc1ccccc1)NC(=S)Nc1ccccc1-c1nnn[n-]1 ZINC000736425136 598513554 /nfs/dbraw/zinc/51/35/54/598513554.db2.gz BRUNSSQNUHDTCI-HNNXBMFYSA-N -1 3 366.494 3.565 20 0 FHADHM CCC[C@@H](Cc1ccccc1)NC(=S)Nc1ccccc1-c1nn[n-]n1 ZINC000736425136 598513555 /nfs/dbraw/zinc/51/35/55/598513555.db2.gz BRUNSSQNUHDTCI-HNNXBMFYSA-N -1 3 366.494 3.565 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H](CC)c2c(C)noc2C)c1-c1nnn[n-]1 ZINC000736669331 598515343 /nfs/dbraw/zinc/51/53/43/598515343.db2.gz FCUPKFUCDOXLBX-GFCCVEGCSA-N -1 3 374.470 3.536 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H](CC)c2c(C)noc2C)c1-c1nn[n-]n1 ZINC000736669331 598515344 /nfs/dbraw/zinc/51/53/44/598515344.db2.gz FCUPKFUCDOXLBX-GFCCVEGCSA-N -1 3 374.470 3.536 20 0 FHADHM O=C(Oc1ccc(-c2nnn[n-]2)cc1)[C@@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000738250177 598533648 /nfs/dbraw/zinc/53/36/48/598533648.db2.gz DNJRJQYIDFXUSM-RBUKOAKNSA-N -1 3 356.385 3.729 20 0 FHADHM O=C(Oc1ccc(-c2nn[n-]n2)cc1)[C@@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000738250177 598533649 /nfs/dbraw/zinc/53/36/49/598533649.db2.gz DNJRJQYIDFXUSM-RBUKOAKNSA-N -1 3 356.385 3.729 20 0 FHADHM C[C@@H](NC(=O)N(CC1CC1)C1CCCCC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736110624 598534107 /nfs/dbraw/zinc/53/41/07/598534107.db2.gz ILCZULRTSBKLND-CQSZACIVSA-N -1 3 368.485 3.682 20 0 FHADHM C[C@@H](NC(=O)N(CC1CC1)C1CCCCC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736110624 598534109 /nfs/dbraw/zinc/53/41/09/598534109.db2.gz ILCZULRTSBKLND-CQSZACIVSA-N -1 3 368.485 3.682 20 0 FHADHM FC(F)c1nc2ccccc2c(Sc2ccc(-c3nnn[n-]3)cc2)n1 ZINC000737639340 598536592 /nfs/dbraw/zinc/53/65/92/598536592.db2.gz PCEXYTBDNCAYRU-UHFFFAOYSA-N -1 3 356.361 3.899 20 0 FHADHM FC(F)c1nc2ccccc2c(Sc2ccc(-c3nn[n-]n3)cc2)n1 ZINC000737639340 598536594 /nfs/dbraw/zinc/53/65/94/598536594.db2.gz PCEXYTBDNCAYRU-UHFFFAOYSA-N -1 3 356.361 3.899 20 0 FHADHM O=C(Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)cc1)C1CCCC1 ZINC000738174347 598544703 /nfs/dbraw/zinc/54/47/03/598544703.db2.gz XZEUZCHGTDVGOA-UHFFFAOYSA-N -1 3 363.421 3.574 20 0 FHADHM O=C(Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)cc1)C1CCCC1 ZINC000738174347 598544704 /nfs/dbraw/zinc/54/47/04/598544704.db2.gz XZEUZCHGTDVGOA-UHFFFAOYSA-N -1 3 363.421 3.574 20 0 FHADHM Fc1cc(OCc2csc(-c3ccsc3)n2)ccc1-c1nnn[n-]1 ZINC000737654025 598548313 /nfs/dbraw/zinc/54/83/13/598548313.db2.gz WDJLIYOGTYRICV-UHFFFAOYSA-N -1 3 359.411 3.770 20 0 FHADHM Fc1cc(OCc2csc(-c3ccsc3)n2)ccc1-c1nn[n-]n1 ZINC000737654025 598548314 /nfs/dbraw/zinc/54/83/14/598548314.db2.gz WDJLIYOGTYRICV-UHFFFAOYSA-N -1 3 359.411 3.770 20 0 FHADHM CC[C@@H](C)NC(=S)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736325475 598551371 /nfs/dbraw/zinc/55/13/71/598551371.db2.gz KBGCVLLMHIDMCK-GFCCVEGCSA-N -1 3 368.466 3.744 20 0 FHADHM CC[C@@H](C)NC(=S)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736325475 598551373 /nfs/dbraw/zinc/55/13/73/598551373.db2.gz KBGCVLLMHIDMCK-GFCCVEGCSA-N -1 3 368.466 3.744 20 0 FHADHM CC[C@@H](C)c1ccc(C(=O)COc2ccc(-c3nnn[n-]3)c(F)c2)cc1 ZINC000736325116 598551613 /nfs/dbraw/zinc/55/16/13/598551613.db2.gz FGPPOWGYZDSUMP-GFCCVEGCSA-N -1 3 354.385 3.781 20 0 FHADHM CC[C@@H](C)c1ccc(C(=O)COc2ccc(-c3nn[n-]n3)c(F)c2)cc1 ZINC000736325116 598551614 /nfs/dbraw/zinc/55/16/14/598551614.db2.gz FGPPOWGYZDSUMP-GFCCVEGCSA-N -1 3 354.385 3.781 20 0 FHADHM Cc1cc(CNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)ccc1F ZINC000737263106 598571529 /nfs/dbraw/zinc/57/15/29/598571529.db2.gz BYBAAHOQZHEWGC-UHFFFAOYSA-N -1 3 351.307 3.945 20 0 FHADHM Cc1cc(CNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)ccc1F ZINC000737263106 598571530 /nfs/dbraw/zinc/57/15/30/598571530.db2.gz BYBAAHOQZHEWGC-UHFFFAOYSA-N -1 3 351.307 3.945 20 0 FHADHM Cc1ccc(C)c(OCCCCC(=O)Nc2ccccc2-c2nnn[n-]2)c1 ZINC000737326214 598571606 /nfs/dbraw/zinc/57/16/06/598571606.db2.gz NHJLKNLMTCJGJM-UHFFFAOYSA-N -1 3 365.437 3.671 20 0 FHADHM Cc1ccc(C)c(OCCCCC(=O)Nc2ccccc2-c2nn[n-]n2)c1 ZINC000737326214 598571611 /nfs/dbraw/zinc/57/16/11/598571611.db2.gz NHJLKNLMTCJGJM-UHFFFAOYSA-N -1 3 365.437 3.671 20 0 FHADHM Cc1nc(-c2ccsc2)ccc1C(=O)Nc1ccccc1-c1nnn[n-]1 ZINC000737464069 598572058 /nfs/dbraw/zinc/57/20/58/598572058.db2.gz DAUZNZSAFTYUQB-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1nc(-c2ccsc2)ccc1C(=O)Nc1ccccc1-c1nn[n-]n1 ZINC000737464069 598572060 /nfs/dbraw/zinc/57/20/60/598572060.db2.gz DAUZNZSAFTYUQB-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Fc1ccc(CNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)cc1F ZINC000737648077 598578123 /nfs/dbraw/zinc/57/81/23/598578123.db2.gz FOAJUZFOOMIKED-UHFFFAOYSA-N -1 3 355.270 3.776 20 0 FHADHM Fc1ccc(CNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)cc1F ZINC000737648077 598578124 /nfs/dbraw/zinc/57/81/24/598578124.db2.gz FOAJUZFOOMIKED-UHFFFAOYSA-N -1 3 355.270 3.776 20 0 FHADHM CCCO[C@@H]1CCCN(c2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)CC1 ZINC000736489626 598580171 /nfs/dbraw/zinc/58/01/71/598580171.db2.gz XYRRABWRNOFZHU-CYBMUJFWSA-N -1 3 369.391 3.671 20 0 FHADHM CCCO[C@@H]1CCCN(c2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)CC1 ZINC000736489626 598580172 /nfs/dbraw/zinc/58/01/72/598580172.db2.gz XYRRABWRNOFZHU-CYBMUJFWSA-N -1 3 369.391 3.671 20 0 FHADHM CC(C)c1ccc(NC(=S)Nc2ccc(F)c(-c3nnn[n-]3)c2)cc1 ZINC000735928937 598580505 /nfs/dbraw/zinc/58/05/05/598580505.db2.gz SCPDDAJEXIXAMR-UHFFFAOYSA-N -1 3 356.430 3.938 20 0 FHADHM CC(C)c1ccc(NC(=S)Nc2ccc(F)c(-c3nn[n-]n3)c2)cc1 ZINC000735928937 598580507 /nfs/dbraw/zinc/58/05/07/598580507.db2.gz SCPDDAJEXIXAMR-UHFFFAOYSA-N -1 3 356.430 3.938 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccc2c(c1)-c1ccccc1C2 ZINC000738168239 598588628 /nfs/dbraw/zinc/58/86/28/598588628.db2.gz WRUWEKQFPQOFMC-UHFFFAOYSA-N -1 3 371.375 3.829 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccc2c(c1)-c1ccccc1C2 ZINC000738168239 598588630 /nfs/dbraw/zinc/58/86/30/598588630.db2.gz WRUWEKQFPQOFMC-UHFFFAOYSA-N -1 3 371.375 3.829 20 0 FHADHM CC[C@@H](C)C(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)c(F)c1 ZINC000736320969 598591964 /nfs/dbraw/zinc/59/19/64/598591964.db2.gz ZYCSGQPHBIURIY-GFCCVEGCSA-N -1 3 369.400 3.569 20 0 FHADHM CC[C@@H](C)C(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)c(F)c1 ZINC000736320969 598591966 /nfs/dbraw/zinc/59/19/66/598591966.db2.gz ZYCSGQPHBIURIY-GFCCVEGCSA-N -1 3 369.400 3.569 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)c1cc(Cl)cc(Cl)c1 ZINC000738166464 598592886 /nfs/dbraw/zinc/59/28/86/598592886.db2.gz JRARSFKMMPMOCL-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)c1cc(Cl)cc(Cl)c1 ZINC000738166464 598592887 /nfs/dbraw/zinc/59/28/87/598592887.db2.gz JRARSFKMMPMOCL-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM CSCc1cccc(NC(=O)N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737187763 598601194 /nfs/dbraw/zinc/60/11/94/598601194.db2.gz UEWWQKCJUUKGMF-GFCCVEGCSA-N -1 3 368.466 3.612 20 0 FHADHM CSCc1cccc(NC(=O)N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737187763 598601196 /nfs/dbraw/zinc/60/11/96/598601196.db2.gz UEWWQKCJUUKGMF-GFCCVEGCSA-N -1 3 368.466 3.612 20 0 FHADHM Cc1cc([C@@H](C)NC(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)c(C)s1 ZINC000737244715 598625059 /nfs/dbraw/zinc/62/50/59/598625059.db2.gz KIBNELVDSNIJBQ-SECBINFHSA-N -1 3 360.418 3.567 20 0 FHADHM Cc1cc([C@@H](C)NC(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)c(C)s1 ZINC000737244715 598625061 /nfs/dbraw/zinc/62/50/61/598625061.db2.gz KIBNELVDSNIJBQ-SECBINFHSA-N -1 3 360.418 3.567 20 0 FHADHM CC(C)(CCc1ccccc1)NC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000735667360 598625772 /nfs/dbraw/zinc/62/57/72/598625772.db2.gz ZZQZYIZBAPPOEG-UHFFFAOYSA-N -1 3 368.416 3.539 20 0 FHADHM CC(C)(CCc1ccccc1)NC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000735667360 598625773 /nfs/dbraw/zinc/62/57/73/598625773.db2.gz ZZQZYIZBAPPOEG-UHFFFAOYSA-N -1 3 368.416 3.539 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)N1CCC[C@H]1C1CCCCC1 ZINC000738164046 598630177 /nfs/dbraw/zinc/63/01/77/598630177.db2.gz WUBAERUKHGWARK-INIZCTEOSA-N -1 3 358.421 3.582 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)N1CCC[C@H]1C1CCCCC1 ZINC000738164046 598630179 /nfs/dbraw/zinc/63/01/79/598630179.db2.gz WUBAERUKHGWARK-INIZCTEOSA-N -1 3 358.421 3.582 20 0 FHADHM O=C(CCCCOc1cccc(-c2nnn[n-]2)c1)NC1CCCCCCC1 ZINC000737831605 598645791 /nfs/dbraw/zinc/64/57/91/598645791.db2.gz BKZVWBSPXCFJOY-UHFFFAOYSA-N -1 3 371.485 3.645 20 0 FHADHM O=C(CCCCOc1cccc(-c2nn[n-]n2)c1)NC1CCCCCCC1 ZINC000737831605 598645792 /nfs/dbraw/zinc/64/57/92/598645792.db2.gz BKZVWBSPXCFJOY-UHFFFAOYSA-N -1 3 371.485 3.645 20 0 FHADHM CC(C)c1ccccc1NC(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000735933387 598647183 /nfs/dbraw/zinc/64/71/83/598647183.db2.gz VRJBXLHKLKJZHF-UHFFFAOYSA-N -1 3 353.451 3.721 20 0 FHADHM CC(C)c1ccccc1NC(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000735933387 598647185 /nfs/dbraw/zinc/64/71/85/598647185.db2.gz VRJBXLHKLKJZHF-UHFFFAOYSA-N -1 3 353.451 3.721 20 0 FHADHM CCN(C(=O)CSc1ccc(-c2nnn[n-]2)cc1)c1cc(C)ccc1C ZINC000736505866 598652057 /nfs/dbraw/zinc/65/20/57/598652057.db2.gz TXZUYWXZOXKJGV-UHFFFAOYSA-N -1 3 367.478 3.629 20 0 FHADHM CCN(C(=O)CSc1ccc(-c2nn[n-]n2)cc1)c1cc(C)ccc1C ZINC000736505866 598652058 /nfs/dbraw/zinc/65/20/58/598652058.db2.gz TXZUYWXZOXKJGV-UHFFFAOYSA-N -1 3 367.478 3.629 20 0 FHADHM CCN(C(=O)CSc1ccc(-c2nnn[n-]2)cc1)c1cccc(Cl)c1 ZINC000736506173 598652098 /nfs/dbraw/zinc/65/20/98/598652098.db2.gz WWMAXXUVPVFFNQ-UHFFFAOYSA-N -1 3 373.869 3.665 20 0 FHADHM CCN(C(=O)CSc1ccc(-c2nn[n-]n2)cc1)c1cccc(Cl)c1 ZINC000736506173 598652100 /nfs/dbraw/zinc/65/21/00/598652100.db2.gz WWMAXXUVPVFFNQ-UHFFFAOYSA-N -1 3 373.869 3.665 20 0 FHADHM CC[C@@H]1CCCC[C@@H]1NC(=O)CCCCOc1cccc(-c2nnn[n-]2)c1 ZINC000736400207 598652975 /nfs/dbraw/zinc/65/29/75/598652975.db2.gz MZVUHOGOJRDNAE-QAPCUYQASA-N -1 3 371.485 3.501 20 0 FHADHM CC[C@@H]1CCCC[C@@H]1NC(=O)CCCCOc1cccc(-c2nn[n-]n2)c1 ZINC000736400207 598652977 /nfs/dbraw/zinc/65/29/77/598652977.db2.gz MZVUHOGOJRDNAE-QAPCUYQASA-N -1 3 371.485 3.501 20 0 FHADHM CC(C)CCCNC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000735796959 598653167 /nfs/dbraw/zinc/65/31/67/598653167.db2.gz KTAMMWRSBSGEPR-UHFFFAOYSA-N -1 3 365.437 3.825 20 0 FHADHM CC(C)CCCNC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735796959 598653169 /nfs/dbraw/zinc/65/31/69/598653169.db2.gz KTAMMWRSBSGEPR-UHFFFAOYSA-N -1 3 365.437 3.825 20 0 FHADHM Fc1ccc(OCCCSCc2ccc(F)cc2-c2nnn[n-]2)cc1 ZINC000737657728 598695573 /nfs/dbraw/zinc/69/55/73/598695573.db2.gz ZIMSUDANUAYXFA-UHFFFAOYSA-N -1 3 362.405 3.847 20 0 FHADHM Fc1ccc(OCCCSCc2ccc(F)cc2-c2nn[n-]n2)cc1 ZINC000737657728 598695574 /nfs/dbraw/zinc/69/55/74/598695574.db2.gz ZIMSUDANUAYXFA-UHFFFAOYSA-N -1 3 362.405 3.847 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nnn[n-]1)c1cc(Cl)sc1Cl ZINC000738232136 598705614 /nfs/dbraw/zinc/70/56/14/598705614.db2.gz POGJHJQMHCZSET-UHFFFAOYSA-N -1 3 373.196 3.731 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nn[n-]n1)c1cc(Cl)sc1Cl ZINC000738232136 598705615 /nfs/dbraw/zinc/70/56/15/598705615.db2.gz POGJHJQMHCZSET-UHFFFAOYSA-N -1 3 373.196 3.731 20 0 FHADHM C[C@H](CCc1ccccc1)OC(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000735993997 598713550 /nfs/dbraw/zinc/71/35/50/598713550.db2.gz XFMKSUNZJXDADT-CQSZACIVSA-N -1 3 368.462 3.523 20 0 FHADHM C[C@H](CCc1ccccc1)OC(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000735993997 598713552 /nfs/dbraw/zinc/71/35/52/598713552.db2.gz XFMKSUNZJXDADT-CQSZACIVSA-N -1 3 368.462 3.523 20 0 FHADHM CCCCCCOC(=O)c1ccc(Oc2ccc(-c3nnn[n-]3)cn2)cc1 ZINC000736446516 598725998 /nfs/dbraw/zinc/72/59/98/598725998.db2.gz IRLGNUODSMNUQX-UHFFFAOYSA-N -1 3 367.409 3.791 20 0 FHADHM CCCCCCOC(=O)c1ccc(Oc2ccc(-c3nn[n-]n3)cn2)cc1 ZINC000736446516 598725999 /nfs/dbraw/zinc/72/59/99/598725999.db2.gz IRLGNUODSMNUQX-UHFFFAOYSA-N -1 3 367.409 3.791 20 0 FHADHM COc1ccccc1[C@H](C)CC(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000737143747 598727595 /nfs/dbraw/zinc/72/75/95/598727595.db2.gz YZSIJHCKWUBSOI-ZIAGYGMSSA-N -1 3 366.421 3.673 20 0 FHADHM COc1ccccc1[C@H](C)CC(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000737143747 598727597 /nfs/dbraw/zinc/72/75/97/598727597.db2.gz YZSIJHCKWUBSOI-ZIAGYGMSSA-N -1 3 366.421 3.673 20 0 FHADHM O=C(OCC1CC1)c1ccccc1SCc1ccc(-c2nnn[n-]2)cc1 ZINC000738221620 598727919 /nfs/dbraw/zinc/72/79/19/598727919.db2.gz YESOZYUXGZRZEN-UHFFFAOYSA-N -1 3 366.446 3.726 20 0 FHADHM O=C(OCC1CC1)c1ccccc1SCc1ccc(-c2nn[n-]n2)cc1 ZINC000738221620 598727920 /nfs/dbraw/zinc/72/79/20/598727920.db2.gz YESOZYUXGZRZEN-UHFFFAOYSA-N -1 3 366.446 3.726 20 0 FHADHM CC(C)Sc1ccc([C@H](C)NC(=O)c2sccc2-c2nnn[n-]2)cc1 ZINC000735921320 598743858 /nfs/dbraw/zinc/74/38/58/598743858.db2.gz OYJMBMQBFNYRSB-NSHDSACASA-N -1 3 373.507 3.920 20 0 FHADHM CC(C)Sc1ccc([C@H](C)NC(=O)c2sccc2-c2nn[n-]n2)cc1 ZINC000735921320 598743859 /nfs/dbraw/zinc/74/38/59/598743859.db2.gz OYJMBMQBFNYRSB-NSHDSACASA-N -1 3 373.507 3.920 20 0 FHADHM Cc1ccccc1[C@@H](NC(=O)Nc1cccc(-c2nnn[n-]2)c1)C(C)C ZINC000737418483 598757567 /nfs/dbraw/zinc/75/75/67/598757567.db2.gz BGBUCOKRUWMKRW-KRWDZBQOSA-N -1 3 350.426 3.694 20 0 FHADHM Cc1ccccc1[C@@H](NC(=O)Nc1cccc(-c2nn[n-]n2)c1)C(C)C ZINC000737418483 598757568 /nfs/dbraw/zinc/75/75/68/598757568.db2.gz BGBUCOKRUWMKRW-KRWDZBQOSA-N -1 3 350.426 3.694 20 0 FHADHM C[C@@H](CCc1ccco1)Nc1c(-c2nnn[n-]2)cnc2c(F)cc(F)cc21 ZINC000735993453 598770235 /nfs/dbraw/zinc/77/02/35/598770235.db2.gz SGZNHLVGCNHZIS-JTQLQIEISA-N -1 3 370.363 3.719 20 0 FHADHM C[C@@H](CCc1ccco1)Nc1c(-c2nn[n-]n2)cnc2c(F)cc(F)cc21 ZINC000735993453 598770236 /nfs/dbraw/zinc/77/02/36/598770236.db2.gz SGZNHLVGCNHZIS-JTQLQIEISA-N -1 3 370.363 3.719 20 0 FHADHM Cc1ccc(CN(C)c2c(-c3nnn[n-]3)cnc3c(F)cc(F)cc32)s1 ZINC000737343132 598771891 /nfs/dbraw/zinc/77/18/91/598771891.db2.gz VOXLUZCFVMSHIU-UHFFFAOYSA-N -1 3 372.404 3.699 20 0 FHADHM Cc1ccc(CN(C)c2c(-c3nn[n-]n3)cnc3c(F)cc(F)cc32)s1 ZINC000737343132 598771892 /nfs/dbraw/zinc/77/18/92/598771892.db2.gz VOXLUZCFVMSHIU-UHFFFAOYSA-N -1 3 372.404 3.699 20 0 FHADHM CCC(=CC(=O)OCc1ccc(-c2nnn[n-]2)cc1F)c1ccccc1 ZINC000736304873 598780363 /nfs/dbraw/zinc/78/03/63/598780363.db2.gz RRGBLJQIWVRBCK-ACCUITESSA-N -1 3 352.369 3.543 20 0 FHADHM CCC(=CC(=O)OCc1ccc(-c2nn[n-]n2)cc1F)c1ccccc1 ZINC000736304873 598780365 /nfs/dbraw/zinc/78/03/65/598780365.db2.gz RRGBLJQIWVRBCK-ACCUITESSA-N -1 3 352.369 3.543 20 0 FHADHM S=C(NC/C=C\c1ccccc1)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000738402167 598790968 /nfs/dbraw/zinc/79/09/68/598790968.db2.gz YTEAYVVZQHBBHA-DAXSKMNVSA-N -1 3 370.869 3.520 20 0 FHADHM S=C(NC/C=C\c1ccccc1)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000738402167 598790969 /nfs/dbraw/zinc/79/09/69/598790969.db2.gz YTEAYVVZQHBBHA-DAXSKMNVSA-N -1 3 370.869 3.520 20 0 FHADHM O=C(c1cccc(C(F)F)c1)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000738268872 598791135 /nfs/dbraw/zinc/79/11/35/598791135.db2.gz OYFUKMGOXWTRFW-UHFFFAOYSA-N -1 3 369.375 3.609 20 0 FHADHM O=C(c1cccc(C(F)F)c1)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000738268872 598791136 /nfs/dbraw/zinc/79/11/36/598791136.db2.gz OYFUKMGOXWTRFW-UHFFFAOYSA-N -1 3 369.375 3.609 20 0 FHADHM CN(Cc1nc2ccccc2s1)c1ccc(Cl)cc1-c1nnn[n-]1 ZINC000736831725 598791814 /nfs/dbraw/zinc/79/18/14/598791814.db2.gz RXBXLAJCJAWIHJ-UHFFFAOYSA-N -1 3 356.842 3.766 20 0 FHADHM CN(Cc1nc2ccccc2s1)c1ccc(Cl)cc1-c1nn[n-]n1 ZINC000736831725 598791816 /nfs/dbraw/zinc/79/18/16/598791816.db2.gz RXBXLAJCJAWIHJ-UHFFFAOYSA-N -1 3 356.842 3.766 20 0 FHADHM c1cc2c(ncnc2Nc2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)[nH]1 ZINC000738419900 598796891 /nfs/dbraw/zinc/79/68/91/598796891.db2.gz SMMNZIJZOMVLER-UHFFFAOYSA-N -1 3 370.376 3.674 20 0 FHADHM Cc1cc(C)c(-c2nnn[n-]2)c(N2CCC(c3ccc(F)c(F)c3)CC2)n1 ZINC000737245828 598797515 /nfs/dbraw/zinc/79/75/15/598797515.db2.gz QDDGCBAGOOZUIX-UHFFFAOYSA-N -1 3 370.407 3.541 20 0 FHADHM Cc1cc(C)c(-c2nn[n-]n2)c(N2CCC(c3ccc(F)c(F)c3)CC2)n1 ZINC000737245828 598797516 /nfs/dbraw/zinc/79/75/16/598797516.db2.gz QDDGCBAGOOZUIX-UHFFFAOYSA-N -1 3 370.407 3.541 20 0 FHADHM CC(C)Oc1ccc(NC(=S)N[C@@H]2CCCC[C@H]2C)cc1-c1nnn[n-]1 ZINC000820173557 607367104 /nfs/dbraw/zinc/36/71/04/607367104.db2.gz HTLVHDMYSWNFCH-IUODEOHRSA-N -1 3 374.514 3.519 20 0 FHADHM CC(C)Oc1ccc(NC(=S)N[C@@H]2CCCC[C@H]2C)cc1-c1nn[n-]n1 ZINC000820173557 607367106 /nfs/dbraw/zinc/36/71/06/607367106.db2.gz HTLVHDMYSWNFCH-IUODEOHRSA-N -1 3 374.514 3.519 20 0 FHADHM CC(C)[C@@H](C)C(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)cc1 ZINC000735700421 598803646 /nfs/dbraw/zinc/80/36/46/598803646.db2.gz GLPSNSKLUWIBBM-CYBMUJFWSA-N -1 3 351.410 3.890 20 0 FHADHM CC(C)[C@@H](C)C(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)cc1 ZINC000735700421 598803647 /nfs/dbraw/zinc/80/36/47/598803647.db2.gz GLPSNSKLUWIBBM-CYBMUJFWSA-N -1 3 351.410 3.890 20 0 FHADHM CCN(c1ncccc1-c1nnn[n-]1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000736564936 598816706 /nfs/dbraw/zinc/81/67/06/598816706.db2.gz PHOFYOXDLSHMTK-LLVKDONJSA-N -1 3 362.359 3.868 20 0 FHADHM CCN(c1ncccc1-c1nn[n-]n1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000736564936 598816708 /nfs/dbraw/zinc/81/67/08/598816708.db2.gz PHOFYOXDLSHMTK-LLVKDONJSA-N -1 3 362.359 3.868 20 0 FHADHM CCC[C@H](CC)NC(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000821015557 599294014 /nfs/dbraw/zinc/29/40/14/599294014.db2.gz QMOMIIMWUIXBIN-VIFPVBQESA-N -1 3 356.352 3.586 20 0 FHADHM CCC[C@H](CC)NC(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000821015557 599294016 /nfs/dbraw/zinc/29/40/16/599294016.db2.gz QMOMIIMWUIXBIN-VIFPVBQESA-N -1 3 356.352 3.586 20 0 FHADHM CCN(C(=O)c1cc(Cl)cc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736506417 599309659 /nfs/dbraw/zinc/30/96/59/599309659.db2.gz XXAIDJKANAZTSJ-UHFFFAOYSA-N -1 3 362.220 3.840 20 0 FHADHM CCN(C(=O)c1cc(Cl)cc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736506417 599309662 /nfs/dbraw/zinc/30/96/62/599309662.db2.gz XXAIDJKANAZTSJ-UHFFFAOYSA-N -1 3 362.220 3.840 20 0 FHADHM CCN(C(=O)CCc1ccc(Cl)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736504496 599312231 /nfs/dbraw/zinc/31/22/31/599312231.db2.gz FHBKPVJJRZCNQP-UHFFFAOYSA-N -1 3 355.829 3.506 20 0 FHADHM CCN(C(=O)CCc1ccc(Cl)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736504496 599312234 /nfs/dbraw/zinc/31/22/34/599312234.db2.gz FHBKPVJJRZCNQP-UHFFFAOYSA-N -1 3 355.829 3.506 20 0 FHADHM CCN(C(=O)c1ccc(C(F)(F)F)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736506455 599312261 /nfs/dbraw/zinc/31/22/61/599312261.db2.gz YTQQABUJTBVHAK-UHFFFAOYSA-N -1 3 361.327 3.552 20 0 FHADHM CCN(C(=O)c1ccc(C(F)(F)F)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736506455 599312263 /nfs/dbraw/zinc/31/22/63/599312263.db2.gz YTQQABUJTBVHAK-UHFFFAOYSA-N -1 3 361.327 3.552 20 0 FHADHM CCN(C(=O)c1cccc(Cl)c1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000736509328 599312786 /nfs/dbraw/zinc/31/27/86/599312786.db2.gz VBBAZQFAOJHDLN-UHFFFAOYSA-N -1 3 362.220 3.840 20 0 FHADHM CCN(C(=O)c1cccc(Cl)c1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000736509328 599312789 /nfs/dbraw/zinc/31/27/89/599312789.db2.gz VBBAZQFAOJHDLN-UHFFFAOYSA-N -1 3 362.220 3.840 20 0 FHADHM CC(=O)Nc1c(C)ccc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1C ZINC000735482953 599323333 /nfs/dbraw/zinc/32/33/33/599323333.db2.gz XLYFCYWFORIPLS-ZDUSSCGKSA-N -1 3 350.426 3.615 20 0 FHADHM CC(=O)Nc1c(C)ccc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1C ZINC000735482953 599323335 /nfs/dbraw/zinc/32/33/35/599323335.db2.gz XLYFCYWFORIPLS-ZDUSSCGKSA-N -1 3 350.426 3.615 20 0 FHADHM Cc1ccccc1NC(=O)CS[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000737436300 599329202 /nfs/dbraw/zinc/32/92/02/599329202.db2.gz RAJKTCLKBNXPFF-ZDUSSCGKSA-N -1 3 353.451 3.608 20 0 FHADHM Cc1ccccc1NC(=O)CS[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000737436300 599329204 /nfs/dbraw/zinc/32/92/04/599329204.db2.gz RAJKTCLKBNXPFF-ZDUSSCGKSA-N -1 3 353.451 3.608 20 0 FHADHM Fc1ccc(CNc2ccc(F)c(-c3nnn[n-]3)c2)cc1Br ZINC000737647369 599331673 /nfs/dbraw/zinc/33/16/73/599331673.db2.gz CTFRPXFSUFEASQ-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1ccc(CNc2ccc(F)c(-c3nn[n-]n3)c2)cc1Br ZINC000737647369 599331674 /nfs/dbraw/zinc/33/16/74/599331674.db2.gz CTFRPXFSUFEASQ-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Cc1ccc(NC(=O)CS[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1F ZINC000737356940 599334257 /nfs/dbraw/zinc/33/42/57/599334257.db2.gz KGEFJSOREYFWSR-LBPRGKRZSA-N -1 3 371.441 3.747 20 0 FHADHM Cc1ccc(NC(=O)CS[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1F ZINC000737356940 599334260 /nfs/dbraw/zinc/33/42/60/599334260.db2.gz KGEFJSOREYFWSR-LBPRGKRZSA-N -1 3 371.441 3.747 20 0 FHADHM CSc1ccc(NC(=O)[C@H](C)Sc2ccccc2-c2nnn[n-]2)cc1 ZINC000821984359 599342744 /nfs/dbraw/zinc/34/27/44/599342744.db2.gz OGZLWWMIENWOGO-NSHDSACASA-N -1 3 371.491 3.708 20 0 FHADHM CSc1ccc(NC(=O)[C@H](C)Sc2ccccc2-c2nn[n-]n2)cc1 ZINC000821984359 599342746 /nfs/dbraw/zinc/34/27/46/599342746.db2.gz OGZLWWMIENWOGO-NSHDSACASA-N -1 3 371.491 3.708 20 0 FHADHM CSc1ccccc1NC(=O)[C@H](C)Sc1ccccc1-c1nnn[n-]1 ZINC000821983093 599351158 /nfs/dbraw/zinc/35/11/58/599351158.db2.gz DGPBPRSTXGCSGA-NSHDSACASA-N -1 3 371.491 3.708 20 0 FHADHM CSc1ccccc1NC(=O)[C@H](C)Sc1ccccc1-c1nn[n-]n1 ZINC000821983093 599351159 /nfs/dbraw/zinc/35/11/59/599351159.db2.gz DGPBPRSTXGCSGA-NSHDSACASA-N -1 3 371.491 3.708 20 0 FHADHM COC(=O)c1cc2cc(CSc3ccccc3-c3nnn[n-]3)ccc2o1 ZINC000821669019 599352509 /nfs/dbraw/zinc/35/25/09/599352509.db2.gz USKSPDSTERCHEZ-UHFFFAOYSA-N -1 3 366.402 3.692 20 0 FHADHM COC(=O)c1cc2cc(CSc3ccccc3-c3nn[n-]n3)ccc2o1 ZINC000821669019 599352511 /nfs/dbraw/zinc/35/25/11/599352511.db2.gz USKSPDSTERCHEZ-UHFFFAOYSA-N -1 3 366.402 3.692 20 0 FHADHM C[C@H](Nc1cccc(OC[C@H]2CCCO2)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820461722 599365279 /nfs/dbraw/zinc/36/52/79/599365279.db2.gz QOBLHERRXNJLMZ-IFXJQAMLSA-N -1 3 365.437 3.598 20 0 FHADHM C[C@H](Nc1cccc(OC[C@H]2CCCO2)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820461722 599365283 /nfs/dbraw/zinc/36/52/83/599365283.db2.gz QOBLHERRXNJLMZ-IFXJQAMLSA-N -1 3 365.437 3.598 20 0 FHADHM Cc1ccc(NC(=O)C(C)C)cc1N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000822242292 599368124 /nfs/dbraw/zinc/36/81/24/599368124.db2.gz HDPSAAGLNFTWRE-AWEZNQCLSA-N -1 3 364.453 3.943 20 0 FHADHM Cc1ccc(NC(=O)C(C)C)cc1N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000822242292 599368127 /nfs/dbraw/zinc/36/81/27/599368127.db2.gz HDPSAAGLNFTWRE-AWEZNQCLSA-N -1 3 364.453 3.943 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1cc2occc2s1 ZINC000735874045 599372015 /nfs/dbraw/zinc/37/20/15/599372015.db2.gz LPTIOLUHNIXZJC-UHFFFAOYSA-N -1 3 367.434 3.725 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1cc2occc2s1 ZINC000735874045 599372018 /nfs/dbraw/zinc/37/20/18/599372018.db2.gz LPTIOLUHNIXZJC-UHFFFAOYSA-N -1 3 367.434 3.725 20 0 FHADHM Cc1ccc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1OCC(F)F ZINC000822254173 599374811 /nfs/dbraw/zinc/37/48/11/599374811.db2.gz BPXUBMUZALWPRA-LBPRGKRZSA-N -1 3 359.380 3.992 20 0 FHADHM Cc1ccc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1OCC(F)F ZINC000822254173 599374812 /nfs/dbraw/zinc/37/48/12/599374812.db2.gz BPXUBMUZALWPRA-LBPRGKRZSA-N -1 3 359.380 3.992 20 0 FHADHM C[C@@H](NC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1ccc(F)cc1Cl ZINC000736099086 599377937 /nfs/dbraw/zinc/37/79/37/599377937.db2.gz GKXJVADMCXYNAQ-OALRPVAKSA-N -1 3 371.803 3.550 20 0 FHADHM C[C@@H](NC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1ccc(F)cc1Cl ZINC000736099086 599377940 /nfs/dbraw/zinc/37/79/40/599377940.db2.gz GKXJVADMCXYNAQ-OALRPVAKSA-N -1 3 371.803 3.550 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(Nc2ccc(N3CCCCC3)nc2)c1 ZINC000737570620 599401580 /nfs/dbraw/zinc/40/15/80/599401580.db2.gz IPKPSLCNZZKSDY-UHFFFAOYSA-N -1 3 355.833 3.649 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(Nc2ccc(N3CCCCC3)nc2)c1 ZINC000737570620 599401583 /nfs/dbraw/zinc/40/15/83/599401583.db2.gz IPKPSLCNZZKSDY-UHFFFAOYSA-N -1 3 355.833 3.649 20 0 FHADHM COc1ccc(F)cc1[C@H](C)Nc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000737099974 599411484 /nfs/dbraw/zinc/41/14/84/599411484.db2.gz RTCJPLJMFYGQDF-NSHDSACASA-N -1 3 364.384 3.736 20 0 FHADHM COc1ccc(F)cc1[C@H](C)Nc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000737099974 599411486 /nfs/dbraw/zinc/41/14/86/599411486.db2.gz RTCJPLJMFYGQDF-NSHDSACASA-N -1 3 364.384 3.736 20 0 FHADHM CCCOCc1ccccc1CNc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000736487028 599411862 /nfs/dbraw/zinc/41/18/62/599411862.db2.gz CSMXVSSUGYKXPO-UHFFFAOYSA-N -1 3 374.448 3.954 20 0 FHADHM CCCOCc1ccccc1CNc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000736487028 599411866 /nfs/dbraw/zinc/41/18/66/599411866.db2.gz CSMXVSSUGYKXPO-UHFFFAOYSA-N -1 3 374.448 3.954 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(NCCCOCCc2ccccc2)c1 ZINC000737570678 599415079 /nfs/dbraw/zinc/41/50/79/599415079.db2.gz KHNVXHPRSDVTHW-UHFFFAOYSA-N -1 3 357.845 3.581 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(NCCCOCCc2ccccc2)c1 ZINC000737570678 599415080 /nfs/dbraw/zinc/41/50/80/599415080.db2.gz KHNVXHPRSDVTHW-UHFFFAOYSA-N -1 3 357.845 3.581 20 0 FHADHM CCC[C@@H]1CCCC[C@@H]1NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821039812 599433876 /nfs/dbraw/zinc/43/38/76/599433876.db2.gz HHRAHRCMYPRPPC-VBQJREDUSA-N -1 3 356.474 3.586 20 0 FHADHM CCC[C@@H]1CCCC[C@@H]1NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821039812 599433880 /nfs/dbraw/zinc/43/38/80/599433880.db2.gz HHRAHRCMYPRPPC-VBQJREDUSA-N -1 3 356.474 3.586 20 0 FHADHM Cc1cc(C)cc([C@@H](C)NC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000822196553 599440224 /nfs/dbraw/zinc/44/02/24/599440224.db2.gz NFNJXBBKMPLPDO-HUUCEWRRSA-N -1 3 364.453 3.605 20 0 FHADHM Cc1cc(C)cc([C@@H](C)NC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000822196553 599440227 /nfs/dbraw/zinc/44/02/27/599440227.db2.gz NFNJXBBKMPLPDO-HUUCEWRRSA-N -1 3 364.453 3.605 20 0 FHADHM Fc1ccccc1C1CCN(c2cc(-c3nnn[n-]3)c3ccccc3n2)CC1 ZINC000737666283 599441438 /nfs/dbraw/zinc/44/14/38/599441438.db2.gz WHLJUIHFHVBQER-UHFFFAOYSA-N -1 3 374.423 3.938 20 0 FHADHM Fc1ccccc1C1CCN(c2cc(-c3nn[n-]n3)c3ccccc3n2)CC1 ZINC000737666283 599441441 /nfs/dbraw/zinc/44/14/41/599441441.db2.gz WHLJUIHFHVBQER-UHFFFAOYSA-N -1 3 374.423 3.938 20 0 FHADHM c1ccc(OC2CCC2)c(CNc2cc(-c3nnn[n-]3)c3ccccc3n2)c1 ZINC000738434305 599442576 /nfs/dbraw/zinc/44/25/76/599442576.db2.gz CRGYPGOHEZJCNP-UHFFFAOYSA-N -1 3 372.432 3.958 20 0 FHADHM c1ccc(OC2CCC2)c(CNc2cc(-c3nn[n-]n3)c3ccccc3n2)c1 ZINC000738434305 599442579 /nfs/dbraw/zinc/44/25/79/599442579.db2.gz CRGYPGOHEZJCNP-UHFFFAOYSA-N -1 3 372.432 3.958 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1CSc1nc2cc(C)ccc2o1 ZINC000821752189 607379153 /nfs/dbraw/zinc/37/91/53/607379153.db2.gz IPPZVAHVMMSIFN-UHFFFAOYSA-N -1 3 353.407 3.617 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CSc1nc2cc(C)ccc2o1 ZINC000821752189 607379155 /nfs/dbraw/zinc/37/91/55/607379155.db2.gz IPPZVAHVMMSIFN-UHFFFAOYSA-N -1 3 353.407 3.617 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc(-c2nnn[n-]2)cc1)c1ccc(F)cc1Cl ZINC000736115785 599451294 /nfs/dbraw/zinc/45/12/94/599451294.db2.gz JOIVOCHZQJCUOY-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc(-c2nn[n-]n2)cc1)c1ccc(F)cc1Cl ZINC000736115785 599451297 /nfs/dbraw/zinc/45/12/97/599451297.db2.gz JOIVOCHZQJCUOY-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM c1ccc2nc(CSCCOc3cccc(-c4nnn[n-]4)c3)ccc2c1 ZINC000738417811 599453288 /nfs/dbraw/zinc/45/32/88/599453288.db2.gz DFVATDUYKDAKJY-UHFFFAOYSA-N -1 3 363.446 3.727 20 0 FHADHM c1ccc2nc(CSCCOc3cccc(-c4nn[n-]n4)c3)ccc2c1 ZINC000738417811 599453289 /nfs/dbraw/zinc/45/32/89/599453289.db2.gz DFVATDUYKDAKJY-UHFFFAOYSA-N -1 3 363.446 3.727 20 0 FHADHM S=C(Nc1ccccc1-c1nnn[n-]1)N1CCCCC[C@@H]1c1ccco1 ZINC000738407115 599464781 /nfs/dbraw/zinc/46/47/81/599464781.db2.gz FXKGBUVXXSJWRN-OAHLLOKOSA-N -1 3 368.466 3.774 20 0 FHADHM S=C(Nc1ccccc1-c1nn[n-]n1)N1CCCCC[C@@H]1c1ccco1 ZINC000738407115 599464784 /nfs/dbraw/zinc/46/47/84/599464784.db2.gz FXKGBUVXXSJWRN-OAHLLOKOSA-N -1 3 368.466 3.774 20 0 FHADHM C[C@@H](C[C@@H](O)c1ccc(F)cc1)Nc1c(Cl)cccc1-c1nnn[n-]1 ZINC000820231581 607381216 /nfs/dbraw/zinc/38/12/16/607381216.db2.gz BSIIOYXXDNBXMM-ZUZCIYMTSA-N -1 3 361.808 3.583 20 0 FHADHM C[C@@H](C[C@@H](O)c1ccc(F)cc1)Nc1c(Cl)cccc1-c1nn[n-]n1 ZINC000820231581 607381218 /nfs/dbraw/zinc/38/12/18/607381218.db2.gz BSIIOYXXDNBXMM-ZUZCIYMTSA-N -1 3 361.808 3.583 20 0 FHADHM CCC[C@H](NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)C1CCCCC1 ZINC000821020954 599484204 /nfs/dbraw/zinc/48/42/04/599484204.db2.gz KENNKKZRDWLKDF-KDOFPFPSSA-N -1 3 370.501 3.976 20 0 FHADHM CCC[C@H](NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)C1CCCCC1 ZINC000821020954 599484205 /nfs/dbraw/zinc/48/42/05/599484205.db2.gz KENNKKZRDWLKDF-KDOFPFPSSA-N -1 3 370.501 3.976 20 0 FHADHM C[C@@H](NC(=O)c1occc1-c1ccccc1)c1cccc(-c2nnn[n-]2)c1 ZINC000820403958 599499597 /nfs/dbraw/zinc/49/95/97/599499597.db2.gz NTCFWKXTVOGRBC-CYBMUJFWSA-N -1 3 359.389 3.618 20 0 FHADHM C[C@@H](NC(=O)c1occc1-c1ccccc1)c1cccc(-c2nn[n-]n2)c1 ZINC000820403958 599499600 /nfs/dbraw/zinc/49/96/00/599499600.db2.gz NTCFWKXTVOGRBC-CYBMUJFWSA-N -1 3 359.389 3.618 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CCCCC[C@@H]1c1ccco1 ZINC000737292955 599502387 /nfs/dbraw/zinc/50/23/87/599502387.db2.gz XTJDNSMNHLYBFY-MRXNPFEDSA-N -1 3 366.425 3.917 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CCCCC[C@@H]1c1ccco1 ZINC000737292955 599502390 /nfs/dbraw/zinc/50/23/90/599502390.db2.gz XTJDNSMNHLYBFY-MRXNPFEDSA-N -1 3 366.425 3.917 20 0 FHADHM C[C@H](NC(=O)Cc1csc2ccccc12)c1cccc(-c2nnn[n-]2)c1 ZINC000820335467 599506891 /nfs/dbraw/zinc/50/68/91/599506891.db2.gz YRQACYUNMSNWHP-LBPRGKRZSA-N -1 3 363.446 3.501 20 0 FHADHM C[C@H](NC(=O)Cc1csc2ccccc12)c1cccc(-c2nn[n-]n2)c1 ZINC000820335467 599506892 /nfs/dbraw/zinc/50/68/92/599506892.db2.gz YRQACYUNMSNWHP-LBPRGKRZSA-N -1 3 363.446 3.501 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1NCCCCOCc1ccccc1 ZINC000822582902 599507685 /nfs/dbraw/zinc/50/76/85/599507685.db2.gz ZZCGQEFWEDBCKF-UHFFFAOYSA-N -1 3 357.845 3.929 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1NCCCCOCc1ccccc1 ZINC000822582902 599507686 /nfs/dbraw/zinc/50/76/86/599507686.db2.gz ZZCGQEFWEDBCKF-UHFFFAOYSA-N -1 3 357.845 3.929 20 0 FHADHM COc1cc2ccccc2cc1C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821728378 599508220 /nfs/dbraw/zinc/50/82/20/599508220.db2.gz VLXQHEUZTHPVIE-ZDUSSCGKSA-N -1 3 373.416 3.520 20 0 FHADHM COc1cc2ccccc2cc1C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821728378 599508223 /nfs/dbraw/zinc/50/82/23/599508223.db2.gz VLXQHEUZTHPVIE-ZDUSSCGKSA-N -1 3 373.416 3.520 20 0 FHADHM C[C@H](NC(=O)[C@@H](C)c1cccc(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820315227 599511678 /nfs/dbraw/zinc/51/16/78/599511678.db2.gz MHORDSRGJXUZGE-RYUDHWBXSA-N -1 3 355.829 3.501 20 0 FHADHM C[C@H](NC(=O)[C@@H](C)c1cccc(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820315227 599511679 /nfs/dbraw/zinc/51/16/79/599511679.db2.gz MHORDSRGJXUZGE-RYUDHWBXSA-N -1 3 355.829 3.501 20 0 FHADHM Cc1c(Cl)cccc1OCC(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000737215536 599516871 /nfs/dbraw/zinc/51/68/71/599516871.db2.gz LCORUVFLOCJTGB-LBPRGKRZSA-N -1 3 372.812 3.512 20 0 FHADHM Cc1c(Cl)cccc1OCC(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000737215536 599516874 /nfs/dbraw/zinc/51/68/74/599516874.db2.gz LCORUVFLOCJTGB-LBPRGKRZSA-N -1 3 372.812 3.512 20 0 FHADHM Cc1ccc(-c2nc(CCNc3ccc(F)cc3-c3nnn[n-]3)co2)cc1 ZINC000822214146 599517331 /nfs/dbraw/zinc/51/73/31/599517331.db2.gz RBOMIDVNSGFJOQ-UHFFFAOYSA-N -1 3 364.384 3.624 20 0 FHADHM Cc1ccc(-c2nc(CCNc3ccc(F)cc3-c3nn[n-]n3)co2)cc1 ZINC000822214146 599517332 /nfs/dbraw/zinc/51/73/32/599517332.db2.gz RBOMIDVNSGFJOQ-UHFFFAOYSA-N -1 3 364.384 3.624 20 0 FHADHM Fc1ccc(N[C@@H](c2nccs2)c2ccccc2)c(-c2nnn[n-]2)c1 ZINC000822778178 599526729 /nfs/dbraw/zinc/52/67/29/599526729.db2.gz FFVSSHTZJKEDDM-OAHLLOKOSA-N -1 3 352.398 3.664 20 0 FHADHM Fc1ccc(N[C@@H](c2nccs2)c2ccccc2)c(-c2nn[n-]n2)c1 ZINC000822778178 599526733 /nfs/dbraw/zinc/52/67/33/599526733.db2.gz FFVSSHTZJKEDDM-OAHLLOKOSA-N -1 3 352.398 3.664 20 0 FHADHM Cc1ccc(C[C@H](C)Nc2nc(C(F)(F)F)ccc2-c2nnn[n-]2)s1 ZINC000737335114 599529268 /nfs/dbraw/zinc/52/92/68/599529268.db2.gz QCYCYGMHBFLGFE-QMMMGPOBSA-N -1 3 368.388 3.694 20 0 FHADHM Cc1ccc(C[C@H](C)Nc2nc(C(F)(F)F)ccc2-c2nn[n-]n2)s1 ZINC000737335114 599529270 /nfs/dbraw/zinc/52/92/70/599529270.db2.gz QCYCYGMHBFLGFE-QMMMGPOBSA-N -1 3 368.388 3.694 20 0 FHADHM C[C@@H](NC(=O)C(C)(C)c1ccccc1Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000820316322 599533249 /nfs/dbraw/zinc/53/32/49/599533249.db2.gz SVDJJRYUUXYIEN-GFCCVEGCSA-N -1 3 369.856 3.675 20 0 FHADHM C[C@@H](NC(=O)C(C)(C)c1ccccc1Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000820316322 599533252 /nfs/dbraw/zinc/53/32/52/599533252.db2.gz SVDJJRYUUXYIEN-GFCCVEGCSA-N -1 3 369.856 3.675 20 0 FHADHM CC[C@H](NC(=S)Nc1ccccc1-c1nnn[n-]1)c1ccc(F)cc1F ZINC000736370708 599536126 /nfs/dbraw/zinc/53/61/26/599536126.db2.gz OBOOJCRXYVSBHP-AWEZNQCLSA-N -1 3 374.420 3.583 20 0 FHADHM CC[C@H](NC(=S)Nc1ccccc1-c1nn[n-]n1)c1ccc(F)cc1F ZINC000736370708 599536129 /nfs/dbraw/zinc/53/61/29/599536129.db2.gz OBOOJCRXYVSBHP-AWEZNQCLSA-N -1 3 374.420 3.583 20 0 FHADHM CC[C@H](CC(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccc(C)cc1 ZINC000736331299 599542361 /nfs/dbraw/zinc/54/23/61/599542361.db2.gz IWAUMVCHTQJMCO-HZPDHXFCSA-N -1 3 363.465 3.936 20 0 FHADHM CC[C@H](CC(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccc(C)cc1 ZINC000736331299 599542363 /nfs/dbraw/zinc/54/23/63/599542363.db2.gz IWAUMVCHTQJMCO-HZPDHXFCSA-N -1 3 363.465 3.936 20 0 FHADHM Cc1ccc(NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)s1 ZINC000822249001 599551574 /nfs/dbraw/zinc/55/15/74/599551574.db2.gz XSJUJDOLGXNABC-UHFFFAOYSA-N -1 3 356.455 3.679 20 0 FHADHM Cc1ccc(NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)s1 ZINC000822249001 599551575 /nfs/dbraw/zinc/55/15/75/599551575.db2.gz XSJUJDOLGXNABC-UHFFFAOYSA-N -1 3 356.455 3.679 20 0 FHADHM O=C(Nc1cccc(Oc2ccccn2)c1)Nc1cccc(-c2nnn[n-]2)c1 ZINC000823368043 599556315 /nfs/dbraw/zinc/55/63/15/599556315.db2.gz SJDYFXJQVDDZET-UHFFFAOYSA-N -1 3 373.376 3.698 20 0 FHADHM O=C(Nc1cccc(Oc2ccccn2)c1)Nc1cccc(-c2nn[n-]n2)c1 ZINC000823368043 599556316 /nfs/dbraw/zinc/55/63/16/599556316.db2.gz SJDYFXJQVDDZET-UHFFFAOYSA-N -1 3 373.376 3.698 20 0 FHADHM C[C@@H](CCc1cccc(F)c1)C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000820253992 599556348 /nfs/dbraw/zinc/55/63/48/599556348.db2.gz LNHHOXIGQYVSGT-NSHDSACASA-N -1 3 373.819 3.867 20 0 FHADHM C[C@@H](CCc1cccc(F)c1)C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000820253992 599556350 /nfs/dbraw/zinc/55/63/50/599556350.db2.gz LNHHOXIGQYVSGT-NSHDSACASA-N -1 3 373.819 3.867 20 0 FHADHM Fc1ccc(F)c2c1ncc(-c1nnn[n-]1)c2N1CCC[C@H]1c1ccco1 ZINC000822773964 599560814 /nfs/dbraw/zinc/56/08/14/599560814.db2.gz CNYLTHRBMMHAIC-ZDUSSCGKSA-N -1 3 368.347 3.628 20 0 FHADHM Fc1ccc(F)c2c1ncc(-c1nn[n-]n1)c2N1CCC[C@H]1c1ccco1 ZINC000822773964 599560815 /nfs/dbraw/zinc/56/08/15/599560815.db2.gz CNYLTHRBMMHAIC-ZDUSSCGKSA-N -1 3 368.347 3.628 20 0 FHADHM CC[C@@H]1CCCN1C(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736403110 599567002 /nfs/dbraw/zinc/56/70/02/599567002.db2.gz SINKQOPAFDZWIQ-GOSISDBHSA-N -1 3 362.437 3.625 20 0 FHADHM Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)Nc2cccc(-c3nnn[n-]3)c2)C1 ZINC000737421465 599599649 /nfs/dbraw/zinc/59/96/49/599599649.db2.gz NIQLTMFQXXYAAV-GDBMZVCRSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)Nc2cccc(-c3nn[n-]n3)c2)C1 ZINC000737421465 599599650 /nfs/dbraw/zinc/59/96/50/599599650.db2.gz NIQLTMFQXXYAAV-GDBMZVCRSA-N -1 3 362.437 3.585 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CCCC[C@@H]1[C@H](C)CC ZINC000736633871 599610530 /nfs/dbraw/zinc/61/05/30/599610530.db2.gz FVGGJSCRDZALDF-CZUORRHYSA-N -1 3 372.473 3.698 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CCCC[C@@H]1[C@H](C)CC ZINC000736633871 599610531 /nfs/dbraw/zinc/61/05/31/599610531.db2.gz FVGGJSCRDZALDF-CZUORRHYSA-N -1 3 372.473 3.698 20 0 FHADHM CCC(CC)(C(=O)OCc1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000820882223 599623048 /nfs/dbraw/zinc/62/30/48/599623048.db2.gz MPUISCUOAYUQAL-UHFFFAOYSA-N -1 3 350.422 3.668 20 0 FHADHM CCC(CC)(C(=O)OCc1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000820882223 599623049 /nfs/dbraw/zinc/62/30/49/599623049.db2.gz MPUISCUOAYUQAL-UHFFFAOYSA-N -1 3 350.422 3.668 20 0 FHADHM O=C(OCc1ccc(-c2nnn[n-]2)cc1)C1CCC(c2ccccc2)CC1 ZINC000823417724 599623512 /nfs/dbraw/zinc/62/35/12/599623512.db2.gz GKJYJWBALARMPD-UHFFFAOYSA-N -1 3 362.433 3.884 20 0 FHADHM O=C(OCc1ccc(-c2nn[n-]n2)cc1)C1CCC(c2ccccc2)CC1 ZINC000823417724 599623513 /nfs/dbraw/zinc/62/35/13/599623513.db2.gz GKJYJWBALARMPD-UHFFFAOYSA-N -1 3 362.433 3.884 20 0 FHADHM O=C(C=Cc1cccs1)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000822935240 599632967 /nfs/dbraw/zinc/63/29/67/599632967.db2.gz IJNJGKQQFOZXNG-GQCTYLIASA-N -1 3 365.340 3.599 20 0 FHADHM O=C(C=Cc1cccs1)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000822935240 599632968 /nfs/dbraw/zinc/63/29/68/599632968.db2.gz IJNJGKQQFOZXNG-GQCTYLIASA-N -1 3 365.340 3.599 20 0 FHADHM C[C@@H]1CC[C@H](C)CN1C(=O)c1ccccc1-c1ccccc1-c1nnn[n-]1 ZINC000820686733 599635375 /nfs/dbraw/zinc/63/53/75/599635375.db2.gz ZRAFHLPVFZHRSF-LSDHHAIUSA-N -1 3 361.449 3.794 20 0 FHADHM C[C@@H]1CC[C@H](C)CN1C(=O)c1ccccc1-c1ccccc1-c1nn[n-]n1 ZINC000820686733 599635376 /nfs/dbraw/zinc/63/53/76/599635376.db2.gz ZRAFHLPVFZHRSF-LSDHHAIUSA-N -1 3 361.449 3.794 20 0 FHADHM CC[C@@H](NCc1ccc(-c2nn[n-]n2)cc1)c1nc(C(F)(F)F)cs1 ZINC000820925578 599647292 /nfs/dbraw/zinc/64/72/92/599647292.db2.gz JTMQDKGFCJLIPP-LLVKDONJSA-N -1 3 368.388 3.583 20 0 FHADHM C[C@@H](Nc1c(F)cc(-c2nnn[n-]2)cc1F)c1cccc(-n2cccn2)c1 ZINC000820450996 599686698 /nfs/dbraw/zinc/68/66/98/599686698.db2.gz QQAOQCCCIUQQJQ-LLVKDONJSA-N -1 3 367.363 3.504 20 0 FHADHM C[C@@H](Nc1c(F)cc(-c2nn[n-]n2)cc1F)c1cccc(-n2cccn2)c1 ZINC000820450996 599686699 /nfs/dbraw/zinc/68/66/99/599686699.db2.gz QQAOQCCCIUQQJQ-LLVKDONJSA-N -1 3 367.363 3.504 20 0 FHADHM CC[C@H](Nc1ccc(-c2nn[n-]n2)cc1)c1nc(C(F)(F)F)cs1 ZINC000820925966 599688355 /nfs/dbraw/zinc/68/83/55/599688355.db2.gz NTEWXIFWRXDMCO-JTQLQIEISA-N -1 3 354.361 3.905 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1NCc1cc(Cl)ccc1OC(F)F ZINC000822748189 599689447 /nfs/dbraw/zinc/68/94/47/599689447.db2.gz MJYCGQABXSQDCN-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM COc1cccc(CN(Cc2cc(C(=O)[O-])c(C)o2)C2CCC(O)CC2)c1 ZINC000738096230 599771761 /nfs/dbraw/zinc/77/17/61/599771761.db2.gz BUCNKVJQSRJLGO-UHFFFAOYSA-N -1 3 373.449 3.601 20 0 FHADHM O=C([O-])[C@H](NCc1ccc(F)c(F)c1)c1ccc(Br)cc1 ZINC000426826378 599788500 /nfs/dbraw/zinc/78/85/00/599788500.db2.gz SXQQFTUGBWIAJR-CQSZACIVSA-N -1 3 356.166 3.643 20 0 FHADHM CC(C)c1ccc(C(C)(C)NCC(=O)NC2(C(=O)[O-])CCCCC2)cc1 ZINC000736513066 599802892 /nfs/dbraw/zinc/80/28/92/599802892.db2.gz OZCNOXNBTCNSEQ-UHFFFAOYSA-N -1 3 360.498 3.538 20 0 FHADHM CC(C)Oc1ccc(NC(=O)[C@@H](C)c2ccccc2F)cc1-c1nnn[n-]1 ZINC000820160598 607396898 /nfs/dbraw/zinc/39/68/98/607396898.db2.gz MNSLHUXOSGWXTM-LBPRGKRZSA-N -1 3 369.400 3.535 20 0 FHADHM CC(C)Oc1ccc(NC(=O)[C@@H](C)c2ccccc2F)cc1-c1nn[n-]n1 ZINC000820160598 607396900 /nfs/dbraw/zinc/39/69/00/607396900.db2.gz MNSLHUXOSGWXTM-LBPRGKRZSA-N -1 3 369.400 3.535 20 0 FHADHM CCc1cccc2c1OCC[C@H]2NCc1cc(C)c(OCC(=O)[O-])c(C)c1 ZINC000737273038 599859402 /nfs/dbraw/zinc/85/94/02/599859402.db2.gz VIHJRNOITMKRJZ-LJQANCHMSA-N -1 3 369.461 3.943 20 0 FHADHM C[C@H](C(=O)[O-])N1CCN([C@H](c2ccccc2)c2ccccc2Cl)CC1 ZINC000237465937 599951960 /nfs/dbraw/zinc/95/19/60/599951960.db2.gz QRKFLISBANSTPF-DNVCBOLYSA-N -1 3 358.869 3.520 20 0 FHADHM COC[C@H](C)NCc1nc2ccccc2c(-c2ccccc2)c1C(=O)[O-] ZINC000737749161 600011800 /nfs/dbraw/zinc/01/18/00/600011800.db2.gz XDYKNDDDJAFVRL-AWEZNQCLSA-N -1 3 350.418 3.725 20 0 FHADHM C[C@](NCc1cccc(F)c1)(C(=O)[O-])c1cccc(Br)c1 ZINC000041768213 600079458 /nfs/dbraw/zinc/07/94/58/600079458.db2.gz XEJYBSHYPPFRRA-MRXNPFEDSA-N -1 3 352.203 3.678 20 0 FHADHM O=C([O-])[C@@H]1CCCN([C@@H](C(=O)c2c[nH]c3ccccc23)c2ccccc2)C1 ZINC000263573524 600100566 /nfs/dbraw/zinc/10/05/66/600100566.db2.gz MLVHHGBPDCQWEI-OXQOHEQNSA-N -1 3 362.429 3.889 20 0 FHADHM O=C(NC1(c2cccc(-c3nnn[n-]3)c2)CC1)c1cc(Cl)ccc1Cl ZINC000826427806 607420288 /nfs/dbraw/zinc/42/02/88/607420288.db2.gz BKNJPLFFNFSXKF-UHFFFAOYSA-N -1 3 374.231 3.593 20 0 FHADHM O=C(NC1(c2cccc(-c3nn[n-]n3)c2)CC1)c1cc(Cl)ccc1Cl ZINC000826427806 607420289 /nfs/dbraw/zinc/42/02/89/607420289.db2.gz BKNJPLFFNFSXKF-UHFFFAOYSA-N -1 3 374.231 3.593 20 0 FHADHM O=C(NC1(c2cccc(-c3nnn[n-]3)c2)CC1)c1cccc(Cl)c1Cl ZINC000826428183 607424890 /nfs/dbraw/zinc/42/48/90/607424890.db2.gz RMASSPUUHYDHGX-UHFFFAOYSA-N -1 3 374.231 3.593 20 0 FHADHM O=C(NC1(c2cccc(-c3nn[n-]n3)c2)CC1)c1cccc(Cl)c1Cl ZINC000826428183 607424892 /nfs/dbraw/zinc/42/48/92/607424892.db2.gz RMASSPUUHYDHGX-UHFFFAOYSA-N -1 3 374.231 3.593 20 0 FHADHM CCC[C@@](C)(NCc1coc(-c2ccc(Br)cc2)n1)C(=O)[O-] ZINC000736962298 600153819 /nfs/dbraw/zinc/15/38/19/600153819.db2.gz HGERQLJVQWSMPY-MRXNPFEDSA-N -1 3 367.243 3.837 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@H]1C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000826316119 607430899 /nfs/dbraw/zinc/43/08/99/607430899.db2.gz DGOYQIMEVIFXGL-CHWSQXEVSA-N -1 3 370.482 3.535 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@H]1C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000826316119 607430901 /nfs/dbraw/zinc/43/09/01/607430901.db2.gz DGOYQIMEVIFXGL-CHWSQXEVSA-N -1 3 370.482 3.535 20 0 FHADHM CC(C)(C)CCN1CCN(C(=O)Nc2cc(Cl)cc(C(=O)[O-])c2)CC1 ZINC000736249515 600283497 /nfs/dbraw/zinc/28/34/97/600283497.db2.gz XPQWRGJOOGVRNV-UHFFFAOYSA-N -1 3 367.877 3.624 20 0 FHADHM C[C@H]1CCCC[C@]1(CNC(=O)OC(C)(C)C)NCc1cc(C(=O)[O-])co1 ZINC000387863352 600315639 /nfs/dbraw/zinc/31/56/39/600315639.db2.gz OVHMTQQBZFQSMD-ORAYPTAESA-N -1 3 366.458 3.541 20 0 FHADHM Cc1cc(CN2CCC(CN3CCc4ccccc43)CC2)oc1C(=O)[O-] ZINC000738383530 600334586 /nfs/dbraw/zinc/33/45/86/600334586.db2.gz WUWCGGQGBMWTDA-UHFFFAOYSA-N -1 3 354.450 3.561 20 0 FHADHM Cc1oc(CN2CCC(CN3CCc4ccccc43)CC2)cc1C(=O)[O-] ZINC000738977287 600335141 /nfs/dbraw/zinc/33/51/41/600335141.db2.gz CCJCFGPGHOOUAF-UHFFFAOYSA-N -1 3 354.450 3.561 20 0 FHADHM CC[C@@]1(C)CCCN(C(=O)Nc2ccc(OC(C)C)c(-c3nnn[n-]3)c2)C1 ZINC000820950758 607433324 /nfs/dbraw/zinc/43/33/24/607433324.db2.gz SAPCHAFQAJXQNQ-IBGZPJMESA-N -1 3 372.473 3.698 20 0 FHADHM CC[C@@]1(C)CCCN(C(=O)Nc2ccc(OC(C)C)c(-c3nn[n-]n3)c2)C1 ZINC000820950758 607433326 /nfs/dbraw/zinc/43/33/26/607433326.db2.gz SAPCHAFQAJXQNQ-IBGZPJMESA-N -1 3 372.473 3.698 20 0 FHADHM CN(C(=O)c1cc(C2CC2)nc2ccccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000825825642 607433687 /nfs/dbraw/zinc/43/36/87/607433687.db2.gz GMGVYOFMYWJLBR-UHFFFAOYSA-N -1 3 370.416 3.569 20 0 FHADHM CN(C(=O)c1cc(C2CC2)nc2ccccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000825825642 607433688 /nfs/dbraw/zinc/43/36/88/607433688.db2.gz GMGVYOFMYWJLBR-UHFFFAOYSA-N -1 3 370.416 3.569 20 0 FHADHM CCc1ccc([C@@H](CNC(=O)Nc2ccc(F)c(C(=O)[O-])c2)N(C)C)cc1 ZINC000737259856 600384176 /nfs/dbraw/zinc/38/41/76/600384176.db2.gz ZGNQTRDDRUVENT-GOSISDBHSA-N -1 3 373.428 3.511 20 0 FHADHM CCOc1cc(CN[C@H](C(=O)[O-])c2ccc(F)cc2)ccc1OC(F)F ZINC000426818310 600425199 /nfs/dbraw/zinc/42/51/99/600425199.db2.gz RMHWVERQRWGTCD-INIZCTEOSA-N -1 3 369.339 3.741 20 0 FHADHM O=C([O-])[C@H](NCc1ccc(N2CCCCC2=O)cc1)c1cccc(Cl)c1 ZINC000739501850 600428531 /nfs/dbraw/zinc/42/85/31/600428531.db2.gz ZYOUCXFFBALGIL-LJQANCHMSA-N -1 3 372.852 3.772 20 0 FHADHM O=C([O-])[C@@H](NCc1ccc(Br)c(F)c1)c1ccc(F)cc1 ZINC000426777118 600430481 /nfs/dbraw/zinc/43/04/81/600430481.db2.gz KPZVCRKEKVLVPU-AWEZNQCLSA-N -1 3 356.166 3.643 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1c2ccccc2S[C@H](C)[C@@H]1C ZINC000826246047 607443988 /nfs/dbraw/zinc/44/39/88/607443988.db2.gz PRSBJTMODNUFOO-QWHCGFSZSA-N -1 3 365.462 3.705 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1c2ccccc2S[C@H](C)[C@@H]1C ZINC000826246047 607443990 /nfs/dbraw/zinc/44/39/90/607443990.db2.gz PRSBJTMODNUFOO-QWHCGFSZSA-N -1 3 365.462 3.705 20 0 FHADHM Cc1ccsc1[C@H]1C[C@@H]1C(=O)N(C)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000826316544 607444361 /nfs/dbraw/zinc/44/43/61/607444361.db2.gz RMMCKQWOBHSMIR-STQMWFEESA-N -1 3 373.869 3.657 20 0 FHADHM Cc1ccsc1[C@H]1C[C@@H]1C(=O)N(C)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000826316544 607444362 /nfs/dbraw/zinc/44/43/62/607444362.db2.gz RMMCKQWOBHSMIR-STQMWFEESA-N -1 3 373.869 3.657 20 0 FHADHM CC(C)C[C@@H]1CCCCCN1Cc1nc2cc(C(=O)[O-])ccc2c(=O)[nH]1 ZINC000736425456 600718432 /nfs/dbraw/zinc/71/84/32/600718432.db2.gz KCZLRONIZUKIMS-HNNXBMFYSA-N -1 3 357.454 3.824 20 0 FHADHM O=C([O-])[C@@H](NC[C@H]1Cc2ccccc2O1)c1ccc(Cl)cc1Cl ZINC000833165321 600737483 /nfs/dbraw/zinc/73/74/83/600737483.db2.gz BIEUDKJNNBFQPK-WBMJQRKESA-N -1 3 352.217 3.712 20 0 FHADHM C[C@H](COCC(F)(F)F)N[C@H](C(=O)[O-])c1ccc(Cl)cc1Cl ZINC000827517511 600743740 /nfs/dbraw/zinc/74/37/40/600743740.db2.gz OVFVBFGANSNSAS-HQJQHLMTSA-N -1 3 360.159 3.676 20 0 FHADHM O=C([O-])[C@@H](c1ccc(Cl)cc1Cl)N1CCC(c2ncc[nH]2)CC1 ZINC000833171077 600821721 /nfs/dbraw/zinc/82/17/21/600821721.db2.gz LYTWFBIIRYYLKV-CQSZACIVSA-N -1 3 354.237 3.722 20 0 FHADHM O=C([O-])N1CCC[C@@H](NCc2cc(Cl)ccc2OC2CCCC2)C1 ZINC000833279111 600896499 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606260174 /nfs/dbraw/zinc/26/01/74/606260174.db2.gz VOWUCKNRJJZFEY-YPDDLIOESA-N -1 3 364.405 3.583 20 0 FHADHM COc1cccc(C(C)=CC(=O)O[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000821859995 606260176 /nfs/dbraw/zinc/26/01/76/606260176.db2.gz VOWUCKNRJJZFEY-YPDDLIOESA-N -1 3 364.405 3.583 20 0 FHADHM COc1cccc(C(C)=CC(=O)O[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000821859992 606260450 /nfs/dbraw/zinc/26/04/50/606260450.db2.gz VOWUCKNRJJZFEY-CMPYXILNSA-N -1 3 364.405 3.583 20 0 FHADHM COc1cccc(C(C)=CC(=O)O[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000821859992 606260451 /nfs/dbraw/zinc/26/04/51/606260451.db2.gz VOWUCKNRJJZFEY-CMPYXILNSA-N -1 3 364.405 3.583 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cc2occc2s1 ZINC000821123343 606279970 /nfs/dbraw/zinc/27/99/70/606279970.db2.gz PHENUZYATGELBR-UHFFFAOYSA-N -1 3 368.422 3.749 20 0 FHADHM COc1cc2nc(C=Cc3cc(-c4nnn[n-]4)cs3)sc2cc1OC ZINC000821728028 606305888 /nfs/dbraw/zinc/30/58/88/606305888.db2.gz QYYHOXICXSWXHA-ARJAWSKDSA-N -1 3 371.447 3.726 20 0 FHADHM COc1cc2nc(C=Cc3cc(-c4nn[n-]n4)cs3)sc2cc1OC ZINC000821728028 606305890 /nfs/dbraw/zinc/30/58/90/606305890.db2.gz QYYHOXICXSWXHA-ARJAWSKDSA-N -1 3 371.447 3.726 20 0 FHADHM Cc1ccc2c(CSc3cccc(-c4nnn[n-]4)c3)cc(=O)oc2c1C ZINC000822274809 606324248 /nfs/dbraw/zinc/32/42/48/606324248.db2.gz JVDHXWQEMILWDH-UHFFFAOYSA-N -1 3 364.430 3.882 20 0 FHADHM Cc1ccc2c(CSc3cccc(-c4nn[n-]n4)c3)cc(=O)oc2c1C ZINC000822274809 606324250 /nfs/dbraw/zinc/32/42/50/606324250.db2.gz JVDHXWQEMILWDH-UHFFFAOYSA-N -1 3 364.430 3.882 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)Nc1ccc(OC2CCC2)c(F)c1 ZINC000823309390 606335001 /nfs/dbraw/zinc/33/50/01/606335001.db2.gz YAPSWJGWHTXXLF-UHFFFAOYSA-N -1 3 368.372 3.581 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)Nc1ccc(OC2CCC2)c(F)c1 ZINC000823309390 606335003 /nfs/dbraw/zinc/33/50/03/606335003.db2.gz YAPSWJGWHTXXLF-UHFFFAOYSA-N -1 3 368.372 3.581 20 0 FHADHM Cc1ccccc1C(C)(C)C(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000822345722 606341479 /nfs/dbraw/zinc/34/14/79/606341479.db2.gz PXUKOEUQBXSBCX-CQSZACIVSA-N -1 3 350.422 3.757 20 0 FHADHM Cc1ccccc1C(C)(C)C(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000822345722 606341481 /nfs/dbraw/zinc/34/14/81/606341481.db2.gz PXUKOEUQBXSBCX-CQSZACIVSA-N -1 3 350.422 3.757 20 0 FHADHM C[C@@H](OC(=O)CSCc1ccc(F)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820496704 606343920 /nfs/dbraw/zinc/34/39/20/606343920.db2.gz OMXWAXLVJHIYSC-GFCCVEGCSA-N -1 3 372.425 3.543 20 0 FHADHM C[C@@H](OC(=O)CSCc1ccc(F)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820496704 606343923 /nfs/dbraw/zinc/34/39/23/606343923.db2.gz OMXWAXLVJHIYSC-GFCCVEGCSA-N -1 3 372.425 3.543 20 0 FHADHM Cc1ccc([C@H](C)N(C)C(=O)Nc2ccc(F)cc2-c2nnn[n-]2)c(C)c1 ZINC000822228927 606347740 /nfs/dbraw/zinc/34/77/40/606347740.db2.gz IWNZZMMLBJSVFM-ZDUSSCGKSA-N -1 3 368.416 3.848 20 0 FHADHM Cc1ccc([C@H](C)N(C)C(=O)Nc2ccc(F)cc2-c2nn[n-]n2)c(C)c1 ZINC000822228927 606347742 /nfs/dbraw/zinc/34/77/42/606347742.db2.gz IWNZZMMLBJSVFM-ZDUSSCGKSA-N -1 3 368.416 3.848 20 0 FHADHM Cc1cccc2[nH]cc(CC(=O)O[C@@H](C)c3ccc(-c4nnn[n-]4)cc3)c21 ZINC000822331990 606348235 /nfs/dbraw/zinc/34/82/35/606348235.db2.gz KEGKHZADKKZGNJ-ZDUSSCGKSA-N -1 3 361.405 3.503 20 0 FHADHM Cc1cccc2[nH]cc(CC(=O)O[C@@H](C)c3ccc(-c4nn[n-]n4)cc3)c21 ZINC000822331990 606348237 /nfs/dbraw/zinc/34/82/37/606348237.db2.gz KEGKHZADKKZGNJ-ZDUSSCGKSA-N -1 3 361.405 3.503 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)N1CCC[C@H]1c1cccc(F)c1 ZINC000823344350 606348313 /nfs/dbraw/zinc/34/83/13/606348313.db2.gz WCYXXADRJIYOSK-INIZCTEOSA-N -1 3 370.363 3.514 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)N1CCC[C@H]1c1cccc(F)c1 ZINC000823344350 606348314 /nfs/dbraw/zinc/34/83/14/606348314.db2.gz WCYXXADRJIYOSK-INIZCTEOSA-N -1 3 370.363 3.514 20 0 FHADHM C[C@@H](OC(=O)[C@H](C)SCc1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820549903 606349779 /nfs/dbraw/zinc/34/97/79/606349779.db2.gz SYNPLMUZLQKFKZ-KGLIPLIRSA-N -1 3 368.462 3.793 20 0 FHADHM C[C@@H](OC(=O)[C@H](C)SCc1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820549903 606349781 /nfs/dbraw/zinc/34/97/81/606349781.db2.gz SYNPLMUZLQKFKZ-KGLIPLIRSA-N -1 3 368.462 3.793 20 0 FHADHM CSCc1ccc(C(=O)O[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000821971056 606350130 /nfs/dbraw/zinc/35/01/30/606350130.db2.gz WPVKETLBHGPHPR-LBPRGKRZSA-N -1 3 354.435 3.648 20 0 FHADHM CSCc1ccc(C(=O)O[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000821971056 606350132 /nfs/dbraw/zinc/35/01/32/606350132.db2.gz WPVKETLBHGPHPR-LBPRGKRZSA-N -1 3 354.435 3.648 20 0 FHADHM Cc1cccc([C@@H](C)NC(=O)Nc2ccc(F)cc2-c2nnn[n-]2)c1C ZINC000822288608 606351505 /nfs/dbraw/zinc/35/15/05/606351505.db2.gz CWYATFIQRXHCJF-GFCCVEGCSA-N -1 3 354.389 3.505 20 0 FHADHM Cc1cccc([C@@H](C)NC(=O)Nc2ccc(F)cc2-c2nn[n-]n2)c1C ZINC000822288608 606351506 /nfs/dbraw/zinc/35/15/06/606351506.db2.gz CWYATFIQRXHCJF-GFCCVEGCSA-N -1 3 354.389 3.505 20 0 FHADHM C[C@@H](OC(=O)CCOc1cccc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820498196 606356051 /nfs/dbraw/zinc/35/60/51/606356051.db2.gz ZJJQFEQIGYEAAE-GFCCVEGCSA-N -1 3 372.812 3.593 20 0 FHADHM C[C@@H](OC(=O)CCOc1cccc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820498196 606356052 /nfs/dbraw/zinc/35/60/52/606356052.db2.gz ZJJQFEQIGYEAAE-GFCCVEGCSA-N -1 3 372.812 3.593 20 0 FHADHM C[C@H](OC(=O)[C@@H]1C[C@H]1c1cc(F)ccc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000820487751 606359624 /nfs/dbraw/zinc/35/96/24/606359624.db2.gz IKXLYOMIUFIWRP-JMPLFQLZSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@@H]1C[C@H]1c1cc(F)ccc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000820487751 606359626 /nfs/dbraw/zinc/35/96/26/606359626.db2.gz IKXLYOMIUFIWRP-JMPLFQLZSA-N -1 3 370.359 3.553 20 0 FHADHM CN(C(=O)c1ccc(Cl)s1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821573527 606412590 /nfs/dbraw/zinc/41/25/90/606412590.db2.gz UHTJUPFSEXQNNZ-UHFFFAOYSA-N -1 3 354.222 3.512 20 0 FHADHM CN(C(=O)c1ccc(Cl)s1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821573527 606412591 /nfs/dbraw/zinc/41/25/91/606412591.db2.gz UHTJUPFSEXQNNZ-UHFFFAOYSA-N -1 3 354.222 3.512 20 0 FHADHM C[C@@H]1c2c(Cl)cc(Cl)cc2CCN1c1ccc(-c2nnn[n-]2)cn1 ZINC000820819336 606429719 /nfs/dbraw/zinc/42/97/19/606429719.db2.gz HPTSHNMQVJYRIY-SECBINFHSA-N -1 3 361.236 3.692 20 0 FHADHM C[C@@H]1c2c(Cl)cc(Cl)cc2CCN1c1ccc(-c2nn[n-]n2)cn1 ZINC000820819336 606429722 /nfs/dbraw/zinc/42/97/22/606429722.db2.gz HPTSHNMQVJYRIY-SECBINFHSA-N -1 3 361.236 3.692 20 0 FHADHM Clc1cc(Nc2ncccc2-c2nnn[n-]2)ccc1N1CCCCC1 ZINC000822567773 606433100 /nfs/dbraw/zinc/43/31/00/606433100.db2.gz HIDSFQDYIAYDNN-UHFFFAOYSA-N -1 3 355.833 3.649 20 0 FHADHM Clc1cc(Nc2ncccc2-c2nn[n-]n2)ccc1N1CCCCC1 ZINC000822567773 606433101 /nfs/dbraw/zinc/43/31/01/606433101.db2.gz HIDSFQDYIAYDNN-UHFFFAOYSA-N -1 3 355.833 3.649 20 0 FHADHM C[C@@H]1[C@@H](C)CCN1C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000820715686 606445903 /nfs/dbraw/zinc/44/59/03/606445903.db2.gz CIKDUAXHHYALIB-UONOGXRCSA-N -1 3 363.421 3.530 20 0 FHADHM C[C@@H]1[C@@H](C)CCN1C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000820715686 606445904 /nfs/dbraw/zinc/44/59/04/606445904.db2.gz CIKDUAXHHYALIB-UONOGXRCSA-N -1 3 363.421 3.530 20 0 FHADHM FC(F)(F)[C@H]1CCC[C@H](Nc2cc(-c3nnn[n-]3)c3ccccc3n2)C1 ZINC000822714377 606447367 /nfs/dbraw/zinc/44/73/67/606447367.db2.gz MRNWOJVKTLDJMP-QWRGUYRKSA-N -1 3 362.359 3.948 20 0 FHADHM FC(F)(F)[C@H]1CCC[C@H](Nc2cc(-c3nn[n-]n3)c3ccccc3n2)C1 ZINC000822714377 606447369 /nfs/dbraw/zinc/44/73/69/606447369.db2.gz MRNWOJVKTLDJMP-QWRGUYRKSA-N -1 3 362.359 3.948 20 0 FHADHM O=C(Nc1ccccc1NCc1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000823373329 606447906 /nfs/dbraw/zinc/44/79/06/606447906.db2.gz XCKCVLFOKNCGBN-UHFFFAOYSA-N -1 3 370.416 3.731 20 0 FHADHM O=C(Nc1ccccc1NCc1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000823373329 606447908 /nfs/dbraw/zinc/44/79/08/606447908.db2.gz XCKCVLFOKNCGBN-UHFFFAOYSA-N -1 3 370.416 3.731 20 0 FHADHM FC(F)(F)c1cc(-c2nn[n-]n2)ccc1N1CCC[C@H]1c1ccccn1 ZINC000822718335 606459312 /nfs/dbraw/zinc/45/93/12/606459312.db2.gz IGYSMXBTWSCBQP-HNNXBMFYSA-N -1 3 360.343 3.622 20 0 FHADHM CCc1ccc(CC)c(NC(=O)CSc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000821480664 606459556 /nfs/dbraw/zinc/45/95/56/606459556.db2.gz CQIPLSOIIQVBOV-UHFFFAOYSA-N -1 3 367.478 3.722 20 0 FHADHM CCc1ccc(CC)c(NC(=O)CSc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000821480664 606459559 /nfs/dbraw/zinc/45/95/59/606459559.db2.gz CQIPLSOIIQVBOV-UHFFFAOYSA-N -1 3 367.478 3.722 20 0 FHADHM C[C@H](OC(=O)c1cc(-c2nnn[n-]2)cs1)c1ccc(F)c(Cl)c1 ZINC000820508511 606462966 /nfs/dbraw/zinc/46/29/66/606462966.db2.gz QOBAWQYAEJGWTP-ZETCQYMHSA-N -1 3 352.778 3.639 20 0 FHADHM C[C@H](OC(=O)c1cc(-c2nn[n-]n2)cs1)c1ccc(F)c(Cl)c1 ZINC000820508511 606462967 /nfs/dbraw/zinc/46/29/67/606462967.db2.gz QOBAWQYAEJGWTP-ZETCQYMHSA-N -1 3 352.778 3.639 20 0 FHADHM O=C(Cc1cccc(-c2nnn[n-]2)c1)Nc1ccc(-c2ccccc2)cc1 ZINC000823103451 606488041 /nfs/dbraw/zinc/48/80/41/606488041.db2.gz GXCMGQKUAZBBBX-UHFFFAOYSA-N -1 3 355.401 3.715 20 0 FHADHM O=C(Cc1cccc(-c2nn[n-]n2)c1)Nc1ccc(-c2ccccc2)cc1 ZINC000823103451 606488042 /nfs/dbraw/zinc/48/80/42/606488042.db2.gz GXCMGQKUAZBBBX-UHFFFAOYSA-N -1 3 355.401 3.715 20 0 FHADHM O=C(Nc1cccc(OC2CCCC2)c1)c1cc(-c2nnn[n-]2)cs1 ZINC000823366990 606489610 /nfs/dbraw/zinc/48/96/10/606489610.db2.gz BXQZMMDJKGXCQK-UHFFFAOYSA-N -1 3 355.423 3.502 20 0 FHADHM O=C(Nc1cccc(OC2CCCC2)c1)c1cc(-c2nn[n-]n2)cs1 ZINC000823366990 606489611 /nfs/dbraw/zinc/48/96/11/606489611.db2.gz BXQZMMDJKGXCQK-UHFFFAOYSA-N -1 3 355.423 3.502 20 0 FHADHM O=C(Cc1cccc(-c2nnn[n-]2)c1)Nc1ccccc1-c1ccccc1 ZINC000823107649 606489688 /nfs/dbraw/zinc/48/96/88/606489688.db2.gz DHBZFFISTVHLTP-UHFFFAOYSA-N -1 3 355.401 3.715 20 0 FHADHM O=C(Cc1cccc(-c2nn[n-]n2)c1)Nc1ccccc1-c1ccccc1 ZINC000823107649 606489689 /nfs/dbraw/zinc/48/96/89/606489689.db2.gz DHBZFFISTVHLTP-UHFFFAOYSA-N -1 3 355.401 3.715 20 0 FHADHM O=C(Cc1cccc(-c2nnn[n-]2)c1)Nc1ccccc1Cc1ccccc1 ZINC000823107648 606489979 /nfs/dbraw/zinc/48/99/79/606489979.db2.gz DGTNATYRKNTILB-UHFFFAOYSA-N -1 3 369.428 3.639 20 0 FHADHM O=C(Cc1cccc(-c2nn[n-]n2)c1)Nc1ccccc1Cc1ccccc1 ZINC000823107648 606489980 /nfs/dbraw/zinc/48/99/80/606489980.db2.gz DGTNATYRKNTILB-UHFFFAOYSA-N -1 3 369.428 3.639 20 0 FHADHM CC(C)Cn1ccc2cc(NC(=O)c3cc(-c4nnn[n-]4)cs3)ccc21 ZINC000820107962 606498673 /nfs/dbraw/zinc/49/86/73/606498673.db2.gz DWWGPUYWXONHOJ-UHFFFAOYSA-N -1 3 366.450 3.791 20 0 FHADHM CC(C)Cn1ccc2cc(NC(=O)c3cc(-c4nn[n-]n4)cs3)ccc21 ZINC000820107962 606498675 /nfs/dbraw/zinc/49/86/75/606498675.db2.gz DWWGPUYWXONHOJ-UHFFFAOYSA-N -1 3 366.450 3.791 20 0 FHADHM O=C(Cc1cccc(-c2nnn[n-]2)c1)Nc1ccccc1-c1cccs1 ZINC000823108735 606499291 /nfs/dbraw/zinc/49/92/91/606499291.db2.gz QRJGIUMGRYSRIC-UHFFFAOYSA-N -1 3 361.430 3.776 20 0 FHADHM O=C(Cc1cccc(-c2nn[n-]n2)c1)Nc1ccccc1-c1cccs1 ZINC000823108735 606499292 /nfs/dbraw/zinc/49/92/92/606499292.db2.gz QRJGIUMGRYSRIC-UHFFFAOYSA-N -1 3 361.430 3.776 20 0 FHADHM C[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)cc2OC(F)F)[C@H]1c1ccccc1 ZINC000820758781 606502313 /nfs/dbraw/zinc/50/23/13/606502313.db2.gz CVFLMFDBAKRMEE-SJKOYZFVSA-N -1 3 371.391 3.661 20 0 FHADHM CC(C)[C@H](C(=O)NCc1cccc(-c2nnn[n-]2)c1)c1cccc(Cl)c1 ZINC000820015139 606502692 /nfs/dbraw/zinc/50/26/92/606502692.db2.gz AKLBDYYTHULWRM-KRWDZBQOSA-N -1 3 369.856 3.576 20 0 FHADHM CC(C)[C@H](C(=O)NCc1cccc(-c2nn[n-]n2)c1)c1cccc(Cl)c1 ZINC000820015139 606502694 /nfs/dbraw/zinc/50/26/94/606502694.db2.gz AKLBDYYTHULWRM-KRWDZBQOSA-N -1 3 369.856 3.576 20 0 FHADHM CC(C)[C@@H](C(=O)NCc1cccc(-c2nnn[n-]2)c1)c1cccc(Cl)c1 ZINC000820015140 606502951 /nfs/dbraw/zinc/50/29/51/606502951.db2.gz AKLBDYYTHULWRM-QGZVFWFLSA-N -1 3 369.856 3.576 20 0 FHADHM CC(C)[C@@H](C(=O)NCc1cccc(-c2nn[n-]n2)c1)c1cccc(Cl)c1 ZINC000820015140 606502952 /nfs/dbraw/zinc/50/29/52/606502952.db2.gz AKLBDYYTHULWRM-QGZVFWFLSA-N -1 3 369.856 3.576 20 0 FHADHM O=C(Cc1cccc(-c2nnn[n-]2)c1)Nc1ccc2c(c1)oc1ccccc12 ZINC000823107654 606510502 /nfs/dbraw/zinc/51/05/02/606510502.db2.gz DMQHABVWUPVIRQ-UHFFFAOYSA-N -1 3 369.384 3.947 20 0 FHADHM O=C(Cc1cccc(-c2nn[n-]n2)c1)Nc1ccc2c(c1)oc1ccccc12 ZINC000823107654 606510504 /nfs/dbraw/zinc/51/05/04/606510504.db2.gz DMQHABVWUPVIRQ-UHFFFAOYSA-N -1 3 369.384 3.947 20 0 FHADHM O=C(CCC1CCC1)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)nc1 ZINC000822950541 606510569 /nfs/dbraw/zinc/51/05/69/606510569.db2.gz SABSDHPLBYMMTI-UHFFFAOYSA-N -1 3 364.409 3.573 20 0 FHADHM O=C(CCC1CCC1)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)nc1 ZINC000822950541 606510571 /nfs/dbraw/zinc/51/05/71/606510571.db2.gz SABSDHPLBYMMTI-UHFFFAOYSA-N -1 3 364.409 3.573 20 0 FHADHM C[C@@H](NC(=O)c1cc(-c2nnn[n-]2)cs1)c1cccc(Cl)c1Cl ZINC000820392673 606513589 /nfs/dbraw/zinc/51/35/89/606513589.db2.gz YLBBPMRLAJLXES-SSDOTTSWSA-N -1 3 368.249 3.726 20 0 FHADHM C[C@@H](NC(=O)c1cc(-c2nn[n-]n2)cs1)c1cccc(Cl)c1Cl ZINC000820392673 606513590 /nfs/dbraw/zinc/51/35/90/606513590.db2.gz YLBBPMRLAJLXES-SSDOTTSWSA-N -1 3 368.249 3.726 20 0 FHADHM CC[C@@H](Cc1ccc(C)cc1)N(CC)C(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000820913330 606519241 /nfs/dbraw/zinc/51/92/41/606519241.db2.gz FSOYNNKHBAEQQY-INIZCTEOSA-N -1 3 369.494 3.720 20 0 FHADHM CC[C@@H](Cc1ccc(C)cc1)N(CC)C(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000820913330 606519243 /nfs/dbraw/zinc/51/92/43/606519243.db2.gz FSOYNNKHBAEQQY-INIZCTEOSA-N -1 3 369.494 3.720 20 0 FHADHM CCC(CC)[C@@H](NC(=O)Cc1cccc(-c2nnn[n-]2)c1)c1cccs1 ZINC000820893326 606530543 /nfs/dbraw/zinc/53/05/43/606530543.db2.gz NLZCRFMVGVJCLW-GOSISDBHSA-N -1 3 369.494 3.764 20 0 FHADHM CCC(CC)[C@@H](NC(=O)Cc1cccc(-c2nn[n-]n2)c1)c1cccs1 ZINC000820893326 606530544 /nfs/dbraw/zinc/53/05/44/606530544.db2.gz NLZCRFMVGVJCLW-GOSISDBHSA-N -1 3 369.494 3.764 20 0 FHADHM CCSc1ccc(Cl)cc1NC(=O)Cc1cccc(-c2nnn[n-]2)c1 ZINC000821461147 606551945 /nfs/dbraw/zinc/55/19/45/606551945.db2.gz KOIQRAFNWKTTRX-UHFFFAOYSA-N -1 3 373.869 3.813 20 0 FHADHM CCSc1ccc(Cl)cc1NC(=O)Cc1cccc(-c2nn[n-]n2)c1 ZINC000821461147 606551947 /nfs/dbraw/zinc/55/19/47/606551947.db2.gz KOIQRAFNWKTTRX-UHFFFAOYSA-N -1 3 373.869 3.813 20 0 FHADHM CC1CC(NC(=O)Nc2ccc(Oc3cccc(-c4nnn[n-]4)c3)cc2)C1 ZINC000820658044 606577560 /nfs/dbraw/zinc/57/75/60/606577560.db2.gz OXLVNYQKZMKBCO-UHFFFAOYSA-N -1 3 364.409 3.579 20 0 FHADHM CC1CC(NC(=O)Nc2ccc(Oc3cccc(-c4nn[n-]n4)c3)cc2)C1 ZINC000820658044 606577562 /nfs/dbraw/zinc/57/75/62/606577562.db2.gz OXLVNYQKZMKBCO-UHFFFAOYSA-N -1 3 364.409 3.579 20 0 FHADHM Cc1csc(SCc2ccc(-c3nnn[n-]3)cc2OC(F)F)n1 ZINC000822414561 606589227 /nfs/dbraw/zinc/58/92/27/606589227.db2.gz KKRMOIUCCOZXRQ-UHFFFAOYSA-N -1 3 355.395 3.525 20 0 FHADHM Cc1csc(SCc2ccc(-c3nn[n-]n3)cc2OC(F)F)n1 ZINC000822414561 606589228 /nfs/dbraw/zinc/58/92/28/606589228.db2.gz KKRMOIUCCOZXRQ-UHFFFAOYSA-N -1 3 355.395 3.525 20 0 FHADHM C[C@H](Nc1cc(-c2nnn[n-]2)c2ccccc2n1)c1ccc(F)cc1F ZINC000736140305 606592101 /nfs/dbraw/zinc/59/21/01/606592101.db2.gz TWUXRAMDIGHSFV-JTQLQIEISA-N -1 3 352.348 3.866 20 0 FHADHM C[C@H](Nc1cc(-c2nn[n-]n2)c2ccccc2n1)c1ccc(F)cc1F ZINC000736140305 606592103 /nfs/dbraw/zinc/59/21/03/606592103.db2.gz TWUXRAMDIGHSFV-JTQLQIEISA-N -1 3 352.348 3.866 20 0 FHADHM FC(F)(F)[C@@H]1CCC[C@@H](CNc2nc3c(cc2-c2nnn[n-]2)CCC3)C1 ZINC000822714957 606595178 /nfs/dbraw/zinc/59/51/78/606595178.db2.gz XOZKOSRAQWBJPG-ZYHUDNBSSA-N -1 3 366.391 3.531 20 0 FHADHM FC(F)(F)[C@@H]1CCC[C@@H](CNc2nc3c(cc2-c2nn[n-]n2)CCC3)C1 ZINC000822714957 606595179 /nfs/dbraw/zinc/59/51/79/606595179.db2.gz XOZKOSRAQWBJPG-ZYHUDNBSSA-N -1 3 366.391 3.531 20 0 FHADHM Cc1ncc(CSCc2ccc(-c3nnn[n-]3)cc2OC(F)F)s1 ZINC000822472377 606599079 /nfs/dbraw/zinc/59/90/79/606599079.db2.gz QPKNSULNYXRRDH-UHFFFAOYSA-N -1 3 369.422 3.666 20 0 FHADHM Cc1ncc(CSCc2ccc(-c3nn[n-]n3)cc2OC(F)F)s1 ZINC000822472377 606599080 /nfs/dbraw/zinc/59/90/80/606599080.db2.gz QPKNSULNYXRRDH-UHFFFAOYSA-N -1 3 369.422 3.666 20 0 FHADHM Cc1cc(CCCC(=O)N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c(C)s1 ZINC000822199846 606602703 /nfs/dbraw/zinc/60/27/03/606602703.db2.gz JTLXIOXZKSIFRG-CYBMUJFWSA-N -1 3 369.494 3.745 20 0 FHADHM CN(Cc1cccc(-c2nnn[n-]2)c1)C(=O)c1cc2cccc(Cl)c2o1 ZINC000821613242 606602667 /nfs/dbraw/zinc/60/26/67/606602667.db2.gz DOWXSLIHHZZVQP-UHFFFAOYSA-N -1 3 367.796 3.539 20 0 FHADHM CN(Cc1cccc(-c2nn[n-]n2)c1)C(=O)c1cc2cccc(Cl)c2o1 ZINC000821613242 606602669 /nfs/dbraw/zinc/60/26/69/606602669.db2.gz DOWXSLIHHZZVQP-UHFFFAOYSA-N -1 3 367.796 3.539 20 0 FHADHM Cc1cc(CCCC(=O)N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c(C)s1 ZINC000822199846 606602702 /nfs/dbraw/zinc/60/27/02/606602702.db2.gz JTLXIOXZKSIFRG-CYBMUJFWSA-N -1 3 369.494 3.745 20 0 FHADHM CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1cc2cccc(Cl)c2o1 ZINC000821609564 606602782 /nfs/dbraw/zinc/60/27/82/606602782.db2.gz CIOVIWYOPDSXGY-UHFFFAOYSA-N -1 3 367.796 3.539 20 0 FHADHM CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1cc2cccc(Cl)c2o1 ZINC000821609564 606602783 /nfs/dbraw/zinc/60/27/83/606602783.db2.gz CIOVIWYOPDSXGY-UHFFFAOYSA-N -1 3 367.796 3.539 20 0 FHADHM COc1cccc([C@@H](C)CC(=O)Nc2ccc(Cl)c(-c3nnn[n-]3)c2)c1 ZINC000821858857 606602898 /nfs/dbraw/zinc/60/28/98/606602898.db2.gz HLSMYMQQZQLECX-NSHDSACASA-N -1 3 371.828 3.661 20 0 FHADHM COc1cccc([C@@H](C)CC(=O)Nc2ccc(Cl)c(-c3nn[n-]n3)c2)c1 ZINC000821858857 606602899 /nfs/dbraw/zinc/60/28/99/606602899.db2.gz HLSMYMQQZQLECX-NSHDSACASA-N -1 3 371.828 3.661 20 0 FHADHM COc1cccc([C@H](C)CC(=O)O[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000821860030 606604390 /nfs/dbraw/zinc/60/43/90/606604390.db2.gz WLAHILMVHOEPAD-KGLIPLIRSA-N -1 3 366.421 3.673 20 0 FHADHM COc1cccc([C@H](C)CC(=O)O[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000821860030 606604392 /nfs/dbraw/zinc/60/43/92/606604392.db2.gz WLAHILMVHOEPAD-KGLIPLIRSA-N -1 3 366.421 3.673 20 0 FHADHM O=C(Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1)C1CC(F)(F)C1 ZINC000823350713 606619469 /nfs/dbraw/zinc/61/94/69/606619469.db2.gz YGBPAYOOZJESDN-UHFFFAOYSA-N -1 3 371.347 3.643 20 0 FHADHM O=C(Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1)C1CC(F)(F)C1 ZINC000823350713 606619470 /nfs/dbraw/zinc/61/94/70/606619470.db2.gz YGBPAYOOZJESDN-UHFFFAOYSA-N -1 3 371.347 3.643 20 0 FHADHM O=C(c1cccc(-c2nnn[n-]2)c1)N1CCCCC[C@H]1/C=C\c1ccccc1 ZINC000823487739 606626827 /nfs/dbraw/zinc/62/68/27/606626827.db2.gz GYHSNWBFAOBXOB-ODLZTCLXSA-N -1 3 373.460 3.965 20 0 FHADHM O=C(c1cccc(-c2nn[n-]n2)c1)N1CCCCC[C@H]1/C=C\c1ccccc1 ZINC000823487739 606626829 /nfs/dbraw/zinc/62/68/29/606626829.db2.gz GYHSNWBFAOBXOB-ODLZTCLXSA-N -1 3 373.460 3.965 20 0 FHADHM Cc1cccnc1C(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000822369889 606632097 /nfs/dbraw/zinc/63/20/97/606632097.db2.gz OFOAFHMVIRNISQ-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM CC(C)(C)c1ccc(NC(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)cc1 ZINC000819957953 606660823 /nfs/dbraw/zinc/66/08/23/606660823.db2.gz FIKGUNZWFQSMAO-UHFFFAOYSA-N -1 3 357.364 3.695 20 0 FHADHM CC(C)(C)c1ccc(NC(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)cc1 ZINC000819957953 606660824 /nfs/dbraw/zinc/66/08/24/606660824.db2.gz FIKGUNZWFQSMAO-UHFFFAOYSA-N -1 3 357.364 3.695 20 0 FHADHM COCC[C@H](C)Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1C ZINC000821685750 606661304 /nfs/dbraw/zinc/66/13/04/606661304.db2.gz OOASXUMGFHJZBF-AWEZNQCLSA-N -1 3 353.426 3.804 20 0 FHADHM COCC[C@H](C)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1C ZINC000821685750 606661305 /nfs/dbraw/zinc/66/13/05/606661305.db2.gz OOASXUMGFHJZBF-AWEZNQCLSA-N -1 3 353.426 3.804 20 0 FHADHM CC(C)c1ccc([C@@H](C)NC(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)cc1 ZINC000820192729 606661751 /nfs/dbraw/zinc/66/17/51/606661751.db2.gz WWBZSTKSEJHHGU-LLVKDONJSA-N -1 3 371.391 3.759 20 0 FHADHM CC(C)c1ccc([C@@H](C)NC(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)cc1 ZINC000820192729 606661752 /nfs/dbraw/zinc/66/17/52/606661752.db2.gz WWBZSTKSEJHHGU-LLVKDONJSA-N -1 3 371.391 3.759 20 0 FHADHM O=C(Oc1cc(Cl)cc(Cl)c1)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000823444226 606663185 /nfs/dbraw/zinc/66/31/85/606663185.db2.gz KISXMGYBOQOQAO-UHFFFAOYSA-N -1 3 371.130 3.671 20 0 FHADHM O=C(Oc1cc(Cl)cc(Cl)c1)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000823444226 606663186 /nfs/dbraw/zinc/66/31/86/606663186.db2.gz KISXMGYBOQOQAO-UHFFFAOYSA-N -1 3 371.130 3.671 20 0 FHADHM CCc1cccc(CC)c1NC(=O)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000821492512 606663620 /nfs/dbraw/zinc/66/36/20/606663620.db2.gz OYBQAONDBVZMSW-UHFFFAOYSA-N -1 3 357.364 3.522 20 0 FHADHM CCc1cccc(CC)c1NC(=O)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000821492512 606663621 /nfs/dbraw/zinc/66/36/21/606663621.db2.gz OYBQAONDBVZMSW-UHFFFAOYSA-N -1 3 357.364 3.522 20 0 FHADHM CC[C@@H](c1ccccc1)N(CC)C(=O)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000820938458 606670059 /nfs/dbraw/zinc/67/00/59/606670059.db2.gz JCYASWHLPJJVIC-INIZCTEOSA-N -1 3 371.391 3.758 20 0 FHADHM CC[C@@H](c1ccccc1)N(CC)C(=O)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000820938458 606670060 /nfs/dbraw/zinc/67/00/60/606670060.db2.gz JCYASWHLPJJVIC-INIZCTEOSA-N -1 3 371.391 3.758 20 0 FHADHM C[C@H](CCC1CCCCC1)NC(=O)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000820242721 606679589 /nfs/dbraw/zinc/67/95/89/606679589.db2.gz QAJNXDNBOMXAEG-LLVKDONJSA-N -1 3 363.412 3.624 20 0 FHADHM C[C@H](CCC1CCCCC1)NC(=O)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000820242721 606679590 /nfs/dbraw/zinc/67/95/90/606679590.db2.gz QAJNXDNBOMXAEG-LLVKDONJSA-N -1 3 363.412 3.624 20 0 FHADHM Cc1ccc(COC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)s1 ZINC000822238395 606686835 /nfs/dbraw/zinc/68/68/35/606686835.db2.gz GIMWTZHUJIMOHP-UHFFFAOYSA-N -1 3 372.450 3.529 20 0 FHADHM Cc1ccc(COC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)s1 ZINC000822238395 606686836 /nfs/dbraw/zinc/68/68/36/606686836.db2.gz GIMWTZHUJIMOHP-UHFFFAOYSA-N -1 3 372.450 3.529 20 0 FHADHM C[C@H](Nc1ccc(-c2nn[n-]n2)cc1F)c1cccc(N2CCCC2)c1 ZINC000820455719 606732708 /nfs/dbraw/zinc/73/27/08/606732708.db2.gz MNMTVOJOMQTHDL-ZDUSSCGKSA-N -1 3 352.417 3.779 20 0 FHADHM C[C@H](OC1CCCCCC1)C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820518676 606735286 /nfs/dbraw/zinc/73/52/86/606735286.db2.gz IWYYBXZFFTWULE-KBPBESRZSA-N -1 3 358.442 3.599 20 0 FHADHM C[C@H](OC1CCCCCC1)C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820518676 606735288 /nfs/dbraw/zinc/73/52/88/606735288.db2.gz IWYYBXZFFTWULE-KBPBESRZSA-N -1 3 358.442 3.599 20 0 FHADHM O=C(Nc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1)C1=CCCC1 ZINC000823356857 606735298 /nfs/dbraw/zinc/73/52/98/606735298.db2.gz PHKCJXYWBVTMTH-UHFFFAOYSA-N -1 3 365.368 3.847 20 0 FHADHM O=C(Nc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1)C1=CCCC1 ZINC000823356857 606735300 /nfs/dbraw/zinc/73/53/00/606735300.db2.gz PHKCJXYWBVTMTH-UHFFFAOYSA-N -1 3 365.368 3.847 20 0 FHADHM CCCCCOc1cc(C)ccc1CNCc1ccc(-c2nnn[n-]2)o1 ZINC000821056384 606771792 /nfs/dbraw/zinc/77/17/92/606771792.db2.gz OZJYDCRVZBYTIB-UHFFFAOYSA-N -1 3 355.442 3.627 20 0 FHADHM CCCCCOc1cc(C)ccc1CNCc1ccc(-c2nn[n-]n2)o1 ZINC000821056384 606771793 /nfs/dbraw/zinc/77/17/93/606771793.db2.gz OZJYDCRVZBYTIB-UHFFFAOYSA-N -1 3 355.442 3.627 20 0 FHADHM CCC1(CNC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)CCCC1 ZINC000820961789 606775097 /nfs/dbraw/zinc/77/50/97/606775097.db2.gz BUOPASLPIIFYOZ-UHFFFAOYSA-N -1 3 368.485 3.511 20 0 FHADHM CCC1(CNC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)CCCC1 ZINC000820961789 606775098 /nfs/dbraw/zinc/77/50/98/606775098.db2.gz BUOPASLPIIFYOZ-UHFFFAOYSA-N -1 3 368.485 3.511 20 0 FHADHM CC(C)c1ccccc1NC(=O)COc1cc(Cl)ccc1-c1nnn[n-]1 ZINC000820198412 606778486 /nfs/dbraw/zinc/77/84/86/606778486.db2.gz VBUXITXOZPBQDF-UHFFFAOYSA-N -1 3 371.828 3.661 20 0 FHADHM CC(C)c1ccccc1NC(=O)COc1cc(Cl)ccc1-c1nn[n-]n1 ZINC000820198412 606778487 /nfs/dbraw/zinc/77/84/87/606778487.db2.gz VBUXITXOZPBQDF-UHFFFAOYSA-N -1 3 371.828 3.661 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(OCc2ncc(-c3cccs3)o2)c1 ZINC000822574498 606781469 /nfs/dbraw/zinc/78/14/69/606781469.db2.gz VYTAHJRKFJEVCL-UHFFFAOYSA-N -1 3 359.798 3.816 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(OCc2ncc(-c3cccs3)o2)c1 ZINC000822574498 606781471 /nfs/dbraw/zinc/78/14/71/606781471.db2.gz VYTAHJRKFJEVCL-UHFFFAOYSA-N -1 3 359.798 3.816 20 0 FHADHM Cc1ccc(C)c([C@@H]2CCCN2c2ncc(-c3nnn[n-]3)cc2Cl)c1 ZINC000822232104 606788884 /nfs/dbraw/zinc/78/88/84/606788884.db2.gz TUSRRGXJYZDYOP-INIZCTEOSA-N -1 3 354.845 3.873 20 0 FHADHM Cc1ccc(C)c([C@@H]2CCCN2c2ncc(-c3nn[n-]n3)cc2Cl)c1 ZINC000822232104 606788886 /nfs/dbraw/zinc/78/88/86/606788886.db2.gz TUSRRGXJYZDYOP-INIZCTEOSA-N -1 3 354.845 3.873 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1Oc1ccc(C(=O)N2CCC[C@H]2C)cc1 ZINC000822137739 606796587 /nfs/dbraw/zinc/79/65/87/606796587.db2.gz WPGBYFLVCDGHTI-CQSZACIVSA-N -1 3 363.421 3.592 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1Oc1ccc(C(=O)N2CCC[C@H]2C)cc1 ZINC000822137739 606796589 /nfs/dbraw/zinc/79/65/89/606796589.db2.gz WPGBYFLVCDGHTI-CQSZACIVSA-N -1 3 363.421 3.592 20 0 FHADHM Cc1ccc(C)c([C@H]2CCCN2C(=O)c2cc(-c3nnn[n-]3)cs2)c1 ZINC000822230749 606807690 /nfs/dbraw/zinc/80/76/90/606807690.db2.gz PDLJHTVXSIZMLP-OAHLLOKOSA-N -1 3 353.451 3.522 20 0 FHADHM Cc1ccc(C)c([C@H]2CCCN2C(=O)c2cc(-c3nn[n-]n3)cs2)c1 ZINC000822230749 606807691 /nfs/dbraw/zinc/80/76/91/606807691.db2.gz PDLJHTVXSIZMLP-OAHLLOKOSA-N -1 3 353.451 3.522 20 0 FHADHM CCCC[C@H](NC(=O)CSCc1ccc(-c2nnn[n-]2)cc1)C1CCC1 ZINC000821042991 606816879 /nfs/dbraw/zinc/81/68/79/606816879.db2.gz KEBGKGUZEZCHKE-KRWDZBQOSA-N -1 3 373.526 3.575 20 0 FHADHM CCCC[C@H](NC(=O)CSCc1ccc(-c2nn[n-]n2)cc1)C1CCC1 ZINC000821042991 606816881 /nfs/dbraw/zinc/81/68/81/606816881.db2.gz KEBGKGUZEZCHKE-KRWDZBQOSA-N -1 3 373.526 3.575 20 0 FHADHM Clc1cc(Br)ccc1NCc1cccc(-c2nnn[n-]2)c1 ZINC000822567514 606840907 /nfs/dbraw/zinc/84/09/07/606840907.db2.gz CPGYPQBWJAMXEO-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM Clc1cc(Br)ccc1NCc1cccc(-c2nn[n-]n2)c1 ZINC000822567514 606840908 /nfs/dbraw/zinc/84/09/08/606840908.db2.gz CPGYPQBWJAMXEO-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM C[C@H](NC(=O)c1ccc(C(C)(C)C)s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820397708 606864791 /nfs/dbraw/zinc/86/47/91/606864791.db2.gz RGSJPMPIYZVKJU-NSHDSACASA-N -1 3 355.467 3.717 20 0 FHADHM C[C@H](NC(=O)c1ccc(C(C)(C)C)s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820397708 606864792 /nfs/dbraw/zinc/86/47/92/606864792.db2.gz RGSJPMPIYZVKJU-NSHDSACASA-N -1 3 355.467 3.717 20 0 FHADHM Cc1cc(Cl)cc(C(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(C)C)c1 ZINC000822202100 606871976 /nfs/dbraw/zinc/87/19/76/606871976.db2.gz KXJLGPKXXMXQNB-UHFFFAOYSA-N -1 3 371.828 3.868 20 0 FHADHM Cc1cc(Cl)cc(C(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(C)C)c1 ZINC000822202100 606871978 /nfs/dbraw/zinc/87/19/78/606871978.db2.gz KXJLGPKXXMXQNB-UHFFFAOYSA-N -1 3 371.828 3.868 20 0 FHADHM Cc1cc(N[C@@H]2CCC(F)(F)C2)n2c3ccccc3nc2c1-c1nnn[n-]1 ZINC000822209530 606881448 /nfs/dbraw/zinc/88/14/48/606881448.db2.gz MQZXMVWCDAUFAQ-LLVKDONJSA-N -1 3 369.379 3.576 20 0 FHADHM Cc1cc(N[C@@H]2CCC(F)(F)C2)n2c3ccccc3nc2c1-c1nn[n-]n1 ZINC000822209530 606881449 /nfs/dbraw/zinc/88/14/49/606881449.db2.gz MQZXMVWCDAUFAQ-LLVKDONJSA-N -1 3 369.379 3.576 20 0 FHADHM Cc1cc(C(F)(F)F)c(-c2nnn[n-]2)c(S[C@H](C)C(F)(F)F)n1 ZINC000822191926 606902529 /nfs/dbraw/zinc/90/25/29/606902529.db2.gz UVTIREWWZTVVTJ-RXMQYKEDSA-N -1 3 357.283 3.632 20 0 FHADHM FC(F)(F)c1ccc(NCc2cc3ccccc3[nH]2)c(-c2nnn[n-]2)c1 ZINC000822728944 606911991 /nfs/dbraw/zinc/91/19/91/606911991.db2.gz NPJABHADOZCYBR-UHFFFAOYSA-N -1 3 358.327 3.979 20 0 FHADHM FC(F)(F)c1ccc(NCc2cc3ccccc3[nH]2)c(-c2nn[n-]n2)c1 ZINC000822728944 606911993 /nfs/dbraw/zinc/91/19/93/606911993.db2.gz NPJABHADOZCYBR-UHFFFAOYSA-N -1 3 358.327 3.979 20 0 FHADHM CCc1nc(CN(C)c2ccc(C(F)(F)F)cc2-c2nnn[n-]2)cs1 ZINC000821509496 606923897 /nfs/dbraw/zinc/92/38/97/606923897.db2.gz IQUIUEXQQRAERC-UHFFFAOYSA-N -1 3 368.388 3.541 20 0 FHADHM CCc1nc(CN(C)c2ccc(C(F)(F)F)cc2-c2nn[n-]n2)cs1 ZINC000821509496 606923898 /nfs/dbraw/zinc/92/38/98/606923898.db2.gz IQUIUEXQQRAERC-UHFFFAOYSA-N -1 3 368.388 3.541 20 0 FHADHM Fc1ccc(CNc2cccc(OCC(F)(F)F)c2)cc1-c1nnn[n-]1 ZINC000822772042 606928209 /nfs/dbraw/zinc/92/82/09/606928209.db2.gz PPTZCOXQKXLSNC-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM Fc1ccc(CNc2cccc(OCC(F)(F)F)c2)cc1-c1nn[n-]n1 ZINC000822772042 606928210 /nfs/dbraw/zinc/92/82/10/606928210.db2.gz PPTZCOXQKXLSNC-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM Fc1ccc(CNc2ccc(CC(F)(F)F)cc2)cc1-c1nnn[n-]1 ZINC000822771647 606929955 /nfs/dbraw/zinc/92/99/55/606929955.db2.gz IYRFODJELZMBDZ-UHFFFAOYSA-N -1 3 351.307 3.723 20 0 FHADHM Fc1ccc(CNc2ccc(CC(F)(F)F)cc2)cc1-c1nn[n-]n1 ZINC000822771647 606929957 /nfs/dbraw/zinc/92/99/57/606929957.db2.gz IYRFODJELZMBDZ-UHFFFAOYSA-N -1 3 351.307 3.723 20 0 FHADHM Fc1ccc(CNc2ccc(Oc3ccccn3)cc2)cc1-c1nnn[n-]1 ZINC000822772187 606929972 /nfs/dbraw/zinc/92/99/72/606929972.db2.gz SLYWPPDSLUIMLA-UHFFFAOYSA-N -1 3 362.368 3.805 20 0 FHADHM Fc1ccc(CNc2ccc(Oc3ccccn3)cc2)cc1-c1nn[n-]n1 ZINC000822772187 606929973 /nfs/dbraw/zinc/92/99/73/606929973.db2.gz SLYWPPDSLUIMLA-UHFFFAOYSA-N -1 3 362.368 3.805 20 0 FHADHM CCc1nnc(S[C@@H](C)c2ccccc2OC)c(-c2nnn[n-]2)c1CC ZINC000821548705 606938820 /nfs/dbraw/zinc/93/88/20/606938820.db2.gz UQPUFSFIEUARHX-NSHDSACASA-N -1 3 370.482 3.643 20 0 FHADHM CCc1nnc(S[C@@H](C)c2ccccc2OC)c(-c2nn[n-]n2)c1CC ZINC000821548705 606938822 /nfs/dbraw/zinc/93/88/22/606938822.db2.gz UQPUFSFIEUARHX-NSHDSACASA-N -1 3 370.482 3.643 20 0 FHADHM C[C@@H](NC(=O)Nc1cc(F)cc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820372864 606954547 /nfs/dbraw/zinc/95/45/47/606954547.db2.gz COEKAIOMZBKPMJ-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM C[C@@H](NC(=O)Nc1cc(F)cc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820372864 606954548 /nfs/dbraw/zinc/95/45/48/606954548.db2.gz COEKAIOMZBKPMJ-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM CC[C@@]1(C)CCN(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)C1 ZINC000820951022 606955100 /nfs/dbraw/zinc/95/51/00/606955100.db2.gz VCYXDASYWPKNRT-HNNXBMFYSA-N -1 3 368.363 3.539 20 0 FHADHM C[C@@H](NC(=O)Nc1cc(F)cc(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820375146 606955118 /nfs/dbraw/zinc/95/51/18/606955118.db2.gz YSQJDIJCLVGCFI-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM C[C@@H](NC(=O)Nc1cc(F)cc(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820375146 606955120 /nfs/dbraw/zinc/95/51/20/606955120.db2.gz YSQJDIJCLVGCFI-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM CC[C@@]1(C)CCN(C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)C1 ZINC000820951022 606955102 /nfs/dbraw/zinc/95/51/02/606955102.db2.gz VCYXDASYWPKNRT-HNNXBMFYSA-N -1 3 368.363 3.539 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cccc(Cl)c2F)c1-c1nnn[n-]1 ZINC000821465474 606957445 /nfs/dbraw/zinc/95/74/45/606957445.db2.gz IOTWSZGWNFDZIJ-UHFFFAOYSA-N -1 3 365.821 3.844 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cccc(Cl)c2F)c1-c1nn[n-]n1 ZINC000821465474 606957446 /nfs/dbraw/zinc/95/74/46/606957446.db2.gz IOTWSZGWNFDZIJ-UHFFFAOYSA-N -1 3 365.821 3.844 20 0 FHADHM C[C@H](CC(=O)N(C)c1cc(Cl)ccc1-c1nnn[n-]1)c1cccc(F)c1 ZINC000820219457 606960335 /nfs/dbraw/zinc/96/03/35/606960335.db2.gz GVTHCSGHLATZRQ-LLVKDONJSA-N -1 3 373.819 3.816 20 0 FHADHM C[C@H](CC(=O)N(C)c1cc(Cl)ccc1-c1nn[n-]n1)c1cccc(F)c1 ZINC000820219457 606960337 /nfs/dbraw/zinc/96/03/37/606960337.db2.gz GVTHCSGHLATZRQ-LLVKDONJSA-N -1 3 373.819 3.816 20 0 FHADHM C[C@H](Cc1cccc(F)c1)C(=O)N(C)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000820299683 606960409 /nfs/dbraw/zinc/96/04/09/606960409.db2.gz JCTOVMWGMLJOPK-LLVKDONJSA-N -1 3 373.819 3.501 20 0 FHADHM C[C@H](Cc1cccc(F)c1)C(=O)N(C)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000820299683 606960410 /nfs/dbraw/zinc/96/04/10/606960410.db2.gz JCTOVMWGMLJOPK-LLVKDONJSA-N -1 3 373.819 3.501 20 0 FHADHM CN(C(=O)C[C@@H]1CCc2ccccc21)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821569720 606961062 /nfs/dbraw/zinc/96/10/62/606961062.db2.gz SWNKQPRVUPSGSR-ZDUSSCGKSA-N -1 3 367.840 3.603 20 0 FHADHM CN(C(=O)C[C@@H]1CCc2ccccc21)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821569720 606961066 /nfs/dbraw/zinc/96/10/66/606961066.db2.gz SWNKQPRVUPSGSR-ZDUSSCGKSA-N -1 3 367.840 3.603 20 0 FHADHM CN(C(=O)c1ccc(-c2ccccc2F)o1)c1ccccc1-c1nnn[n-]1 ZINC000821573483 606971650 /nfs/dbraw/zinc/97/16/50/606971650.db2.gz RMSOITPLPQJVNH-UHFFFAOYSA-N -1 3 363.352 3.542 20 0 FHADHM CN(C(=O)c1ccc(-c2ccccc2F)o1)c1ccccc1-c1nn[n-]n1 ZINC000821573483 606971652 /nfs/dbraw/zinc/97/16/52/606971652.db2.gz RMSOITPLPQJVNH-UHFFFAOYSA-N -1 3 363.352 3.542 20 0 FHADHM Cc1ccc(SCCC(=O)OCc2ccc(F)c(-c3nnn[n-]3)c2)cc1 ZINC000822266502 606989226 /nfs/dbraw/zinc/98/92/26/606989226.db2.gz BMRJPNUBYKYZBO-UHFFFAOYSA-N -1 3 372.425 3.540 20 0 FHADHM Cc1ccc(SCCC(=O)OCc2ccc(F)c(-c3nn[n-]n3)c2)cc1 ZINC000822266502 606989228 /nfs/dbraw/zinc/98/92/28/606989228.db2.gz BMRJPNUBYKYZBO-UHFFFAOYSA-N -1 3 372.425 3.540 20 0 FHADHM C[C@H](NC(=O)c1ccc(-c2ccco2)s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820391996 606991842 /nfs/dbraw/zinc/99/18/42/606991842.db2.gz SHPAZCSKSVBIOI-NSHDSACASA-N -1 3 365.418 3.679 20 0 FHADHM C[C@H](NC(=O)c1ccc(-c2ccco2)s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820391996 606991843 /nfs/dbraw/zinc/99/18/43/606991843.db2.gz SHPAZCSKSVBIOI-NSHDSACASA-N -1 3 365.418 3.679 20 0 FHADHM CCC(=O)c1cc(Cl)ccc1OCc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000820837593 607006956 /nfs/dbraw/zinc/00/69/56/607006956.db2.gz JUKIWIZOOUREOE-UHFFFAOYSA-N -1 3 360.776 3.831 20 0 FHADHM CCC(=O)c1cc(Cl)ccc1OCc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000820837593 607006959 /nfs/dbraw/zinc/00/69/59/607006959.db2.gz JUKIWIZOOUREOE-UHFFFAOYSA-N -1 3 360.776 3.831 20 0 FHADHM Fc1ccccc1-c1cnc(CSc2cccc(-c3nnn[n-]3)c2)o1 ZINC000822791887 607011207 /nfs/dbraw/zinc/01/12/07/607011207.db2.gz MGCVTONCJSENRM-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM Fc1ccccc1-c1cnc(CSc2cccc(-c3nn[n-]n3)c2)o1 ZINC000822791887 607011208 /nfs/dbraw/zinc/01/12/08/607011208.db2.gz MGCVTONCJSENRM-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM Clc1ccc(-c2nnc(CSc3cccc(-c4nnn[n-]4)c3)o2)cc1 ZINC000822567748 607015659 /nfs/dbraw/zinc/01/56/59/607015659.db2.gz GKULBFFSLSWTSR-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1ccc(-c2nnc(CSc3cccc(-c4nn[n-]n4)c3)o2)cc1 ZINC000822567748 607015660 /nfs/dbraw/zinc/01/56/60/607015660.db2.gz GKULBFFSLSWTSR-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM C[C@@H](NC(=O)Cc1ccc(C(C)(C)C)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000820333779 607024236 /nfs/dbraw/zinc/02/42/36/607024236.db2.gz GCBFIUZEMQQEOI-CQSZACIVSA-N -1 3 363.465 3.584 20 0 FHADHM C[C@@H](NC(=O)Cc1ccc(C(C)(C)C)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000820333779 607024239 /nfs/dbraw/zinc/02/42/39/607024239.db2.gz GCBFIUZEMQQEOI-CQSZACIVSA-N -1 3 363.465 3.584 20 0 FHADHM Cc1oc(-c2ccsc2)nc1COc1cc(-c2nnn[n-]2)ccc1C ZINC000822221571 607031430 /nfs/dbraw/zinc/03/14/30/607031430.db2.gz VFTRGNOISPKIMA-UHFFFAOYSA-N -1 3 353.407 3.779 20 0 FHADHM Cc1oc(-c2ccsc2)nc1COc1cc(-c2nn[n-]n2)ccc1C ZINC000822221571 607031432 /nfs/dbraw/zinc/03/14/32/607031432.db2.gz VFTRGNOISPKIMA-UHFFFAOYSA-N -1 3 353.407 3.779 20 0 FHADHM O=c1[nH]c2ccccc2cc1CSCc1cc(F)ccc1-c1nnn[n-]1 ZINC000823656462 607035744 /nfs/dbraw/zinc/03/57/44/607035744.db2.gz DRXLUFDGLBPYPT-UHFFFAOYSA-N -1 3 367.409 3.693 20 0 FHADHM O=c1[nH]c2ccccc2cc1CSCc1cc(F)ccc1-c1nn[n-]n1 ZINC000823656462 607035747 /nfs/dbraw/zinc/03/57/47/607035747.db2.gz DRXLUFDGLBPYPT-UHFFFAOYSA-N -1 3 367.409 3.693 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cc2cc(C)ccc2o1 ZINC000821305123 607102579 /nfs/dbraw/zinc/10/25/79/607102579.db2.gz XWXLZXLOXPFHMY-UHFFFAOYSA-N -1 3 362.393 3.605 20 0 FHADHM C[C@H]1CN(c2cc(Cl)ccc2-c2nnn[n-]2)C[C@@H](c2ccsc2)O1 ZINC000820768323 607115738 /nfs/dbraw/zinc/11/57/38/607115738.db2.gz MNNVRRSDJJKCGM-BONVTDFDSA-N -1 3 361.858 3.548 20 0 FHADHM C[C@H]1CN(c2cc(Cl)ccc2-c2nn[n-]n2)C[C@@H](c2ccsc2)O1 ZINC000820768323 607115739 /nfs/dbraw/zinc/11/57/39/607115739.db2.gz MNNVRRSDJJKCGM-BONVTDFDSA-N -1 3 361.858 3.548 20 0 FHADHM C[C@H]1CN(c2ccc(Cl)cc2-c2nnn[n-]2)C[C@@H](c2ccsc2)O1 ZINC000820776443 607116447 /nfs/dbraw/zinc/11/64/47/607116447.db2.gz MASZWLIGYYBMBN-BONVTDFDSA-N -1 3 361.858 3.548 20 0 FHADHM C[C@H]1CN(c2ccc(Cl)cc2-c2nn[n-]n2)C[C@@H](c2ccsc2)O1 ZINC000820776443 607116448 /nfs/dbraw/zinc/11/64/48/607116448.db2.gz MASZWLIGYYBMBN-BONVTDFDSA-N -1 3 361.858 3.548 20 0 FHADHM Fc1ccccc1-c1cnc(CNc2ccc(-c3nn[n-]n3)cc2Cl)o1 ZINC000822792201 607125296 /nfs/dbraw/zinc/12/52/96/607125296.db2.gz QTLNTWRNCACGGN-UHFFFAOYSA-N -1 3 370.775 3.926 20 0 FHADHM Cc1coc(-c2ccc(C)c(NCc3ccc(F)c(-c4nnn[n-]4)c3)c2)n1 ZINC000822403644 607125530 /nfs/dbraw/zinc/12/55/30/607125530.db2.gz RKCUQYLYVSERKP-UHFFFAOYSA-N -1 3 364.384 3.890 20 0 FHADHM Cc1coc(-c2ccc(C)c(NCc3ccc(F)c(-c4nn[n-]n4)c3)c2)n1 ZINC000822403644 607125532 /nfs/dbraw/zinc/12/55/32/607125532.db2.gz RKCUQYLYVSERKP-UHFFFAOYSA-N -1 3 364.384 3.890 20 0 FHADHM Clc1cccc(Cl)c1C1(NCc2cccc(-c3nn[n-]n3)c2)CC1 ZINC000822585612 607130377 /nfs/dbraw/zinc/13/03/77/607130377.db2.gz HEDSRRPMQIFQSU-UHFFFAOYSA-N -1 3 360.248 3.952 20 0 FHADHM c1ccc2nc(N[C@H]3CCOC4(CCCCC4)C3)c(-c3nnn[n-]3)cc2c1 ZINC000823802399 607131641 /nfs/dbraw/zinc/13/16/41/607131641.db2.gz LZVPXVRRVGBJDK-HNNXBMFYSA-N -1 3 364.453 3.709 20 0 FHADHM c1ccc2nc(N[C@H]3CCOC4(CCCCC4)C3)c(-c3nn[n-]n3)cc2c1 ZINC000823802399 607131642 /nfs/dbraw/zinc/13/16/42/607131642.db2.gz LZVPXVRRVGBJDK-HNNXBMFYSA-N -1 3 364.453 3.709 20 0 FHADHM c1ccc2c(c1)nc(N[C@@H]1CCOC3(CCCCC3)C1)cc2-c1nnn[n-]1 ZINC000823791561 607132023 /nfs/dbraw/zinc/13/20/23/607132023.db2.gz FBJYTOOQXLYAIM-CQSZACIVSA-N -1 3 364.453 3.709 20 0 FHADHM c1ccc2c(c1)nc(N[C@@H]1CCOC3(CCCCC3)C1)cc2-c1nn[n-]n1 ZINC000823791561 607132025 /nfs/dbraw/zinc/13/20/25/607132025.db2.gz FBJYTOOQXLYAIM-CQSZACIVSA-N -1 3 364.453 3.709 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1OCc1ncc(-c2ccc(Cl)cc2)o1 ZINC000822748422 607136759 /nfs/dbraw/zinc/13/67/59/607136759.db2.gz YECPWBGGNMSRHS-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1OCc1ncc(-c2ccc(Cl)cc2)o1 ZINC000822748422 607136762 /nfs/dbraw/zinc/13/67/62/607136762.db2.gz YECPWBGGNMSRHS-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM Fc1cccc(CN(C/C=C/Cl)Cc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000822786320 607146748 /nfs/dbraw/zinc/14/67/48/607146748.db2.gz JRSJQOQMJNZBHU-XNWCZRBMSA-N -1 3 357.820 3.761 20 0 FHADHM Fc1cccc(CN(C/C=C/Cl)Cc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000822786320 607146749 /nfs/dbraw/zinc/14/67/49/607146749.db2.gz JRSJQOQMJNZBHU-XNWCZRBMSA-N -1 3 357.820 3.761 20 0 FHADHM CCCCC[C@H]1CCCN1C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821050918 607153207 /nfs/dbraw/zinc/15/32/07/607153207.db2.gz VNJYKXMJHNGGGT-YOEHRIQHSA-N -1 3 356.474 3.682 20 0 FHADHM CCCCC[C@H]1CCCN1C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821050918 607153208 /nfs/dbraw/zinc/15/32/08/607153208.db2.gz VNJYKXMJHNGGGT-YOEHRIQHSA-N -1 3 356.474 3.682 20 0 FHADHM Cc1cccc(C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)CC(C)C)c1F ZINC000822284549 607154554 /nfs/dbraw/zinc/15/45/54/607154554.db2.gz UQJMTNYSBNYTHN-UHFFFAOYSA-N -1 3 367.428 3.613 20 0 FHADHM Cc1cccc(C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)CC(C)C)c1F ZINC000822284549 607154555 /nfs/dbraw/zinc/15/45/55/607154555.db2.gz UQJMTNYSBNYTHN-UHFFFAOYSA-N -1 3 367.428 3.613 20 0 FHADHM CCOC(=O)c1ccc(-c2nnn[n-]2)c(S[C@H](C)c2ccccc2C)n1 ZINC000821343159 607160804 /nfs/dbraw/zinc/16/08/04/607160804.db2.gz LBCFAUHOBSDVGL-GFCCVEGCSA-N -1 3 369.450 3.600 20 0 FHADHM CCOC(=O)c1ccc(-c2nn[n-]n2)c(S[C@H](C)c2ccccc2C)n1 ZINC000821343159 607160805 /nfs/dbraw/zinc/16/08/05/607160805.db2.gz LBCFAUHOBSDVGL-GFCCVEGCSA-N -1 3 369.450 3.600 20 0 FHADHM O=C(CCc1ccc(-c2nnn[n-]2)cc1)N1CCC[C@@H]1CCC1CCCC1 ZINC000822978173 607163195 /nfs/dbraw/zinc/16/31/95/607163195.db2.gz DSLGHUMSZNEOFM-LJQANCHMSA-N -1 3 367.497 3.761 20 0 FHADHM O=C(CCc1ccc(-c2nn[n-]n2)cc1)N1CCC[C@@H]1CCC1CCCC1 ZINC000822978173 607163197 /nfs/dbraw/zinc/16/31/97/607163197.db2.gz DSLGHUMSZNEOFM-LJQANCHMSA-N -1 3 367.497 3.761 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccc2c(c1)CCCC2 ZINC000823319058 607189387 /nfs/dbraw/zinc/18/93/87/607189387.db2.gz PWROATXUZLXFNF-UHFFFAOYSA-N -1 3 353.813 3.651 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccc2c(c1)CCCC2 ZINC000823319058 607189388 /nfs/dbraw/zinc/18/93/88/607189388.db2.gz PWROATXUZLXFNF-UHFFFAOYSA-N -1 3 353.813 3.651 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)[C@@H]1CCCc2ccccc21 ZINC000823314892 607190265 /nfs/dbraw/zinc/19/02/65/607190265.db2.gz UDKAKQIHEWFAFB-CQSZACIVSA-N -1 3 353.813 3.579 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)[C@@H]1CCCc2ccccc21 ZINC000823314892 607190266 /nfs/dbraw/zinc/19/02/66/607190266.db2.gz UDKAKQIHEWFAFB-CQSZACIVSA-N -1 3 353.813 3.579 20 0 FHADHM CC1(C)CCC(C(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(F)F)CC1 ZINC000820589357 607192426 /nfs/dbraw/zinc/19/24/26/607192426.db2.gz CKFXJQHASULISO-UHFFFAOYSA-N -1 3 365.384 3.623 20 0 FHADHM CC1(C)CCC(C(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(F)F)CC1 ZINC000820589357 607192427 /nfs/dbraw/zinc/19/24/27/607192427.db2.gz CKFXJQHASULISO-UHFFFAOYSA-N -1 3 365.384 3.623 20 0 FHADHM CCC[C@@H](NC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccccn1 ZINC000821022251 607194689 /nfs/dbraw/zinc/19/46/89/607194689.db2.gz QOJHEAUECXFCGU-OAHLLOKOSA-N -1 3 371.832 3.578 20 0 FHADHM CCC[C@@H](NC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccccn1 ZINC000821022251 607194690 /nfs/dbraw/zinc/19/46/90/607194690.db2.gz QOJHEAUECXFCGU-OAHLLOKOSA-N -1 3 371.832 3.578 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N[C@@H]1CC[C@H]2CCC[C@@H]2C1 ZINC000823319392 607196889 /nfs/dbraw/zinc/19/68/89/607196889.db2.gz TXORGEXYJPLEMP-NQBHXWOUSA-N -1 3 360.849 3.610 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N[C@@H]1CC[C@H]2CCC[C@@H]2C1 ZINC000823319392 607196890 /nfs/dbraw/zinc/19/68/90/607196890.db2.gz TXORGEXYJPLEMP-NQBHXWOUSA-N -1 3 360.849 3.610 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1F ZINC000822229180 607197613 /nfs/dbraw/zinc/19/76/13/607197613.db2.gz OKQMEDIOFVBPQB-JTQLQIEISA-N -1 3 374.807 3.850 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1F ZINC000822229180 607197614 /nfs/dbraw/zinc/19/76/14/607197614.db2.gz OKQMEDIOFVBPQB-JTQLQIEISA-N -1 3 374.807 3.850 20 0 FHADHM CCCCN(CCCC)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000821065166 607198290 /nfs/dbraw/zinc/19/82/90/607198290.db2.gz FZEDQMFOWSYYOR-UHFFFAOYSA-N -1 3 350.854 3.954 20 0 FHADHM CCCCN(CCCC)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000821065166 607198291 /nfs/dbraw/zinc/19/82/91/607198291.db2.gz FZEDQMFOWSYYOR-UHFFFAOYSA-N -1 3 350.854 3.954 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N1CCC[C@@H]1c1ccsc1 ZINC000823314520 607198561 /nfs/dbraw/zinc/19/85/61/607198561.db2.gz OYXOZDNGSGJYMG-CQSZACIVSA-N -1 3 374.857 3.951 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N1CCC[C@@H]1c1ccsc1 ZINC000823314520 607198562 /nfs/dbraw/zinc/19/85/62/607198562.db2.gz OYXOZDNGSGJYMG-CQSZACIVSA-N -1 3 374.857 3.951 20 0 FHADHM C[C@H]1c2ccsc2CCN1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820826092 607200124 /nfs/dbraw/zinc/20/01/24/607200124.db2.gz IZLBWBXWLBMCHM-VIFPVBQESA-N -1 3 374.857 3.733 20 0 FHADHM C[C@H]1c2ccsc2CCN1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820826092 607200125 /nfs/dbraw/zinc/20/01/25/607200125.db2.gz IZLBWBXWLBMCHM-VIFPVBQESA-N -1 3 374.857 3.733 20 0 FHADHM CC(C)CC1CCN(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)CC1 ZINC000820069195 607201448 /nfs/dbraw/zinc/20/14/48/607201448.db2.gz XKXDQLIPBQPBDZ-UHFFFAOYSA-N -1 3 362.865 3.810 20 0 FHADHM CC(C)CC1CCN(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)CC1 ZINC000820069195 607201449 /nfs/dbraw/zinc/20/14/49/607201449.db2.gz XKXDQLIPBQPBDZ-UHFFFAOYSA-N -1 3 362.865 3.810 20 0 FHADHM O=C(c1sccc1-c1nnn[n-]1)N1CCC[C@@H]1CCCc1ccccc1 ZINC000823498003 607225630 /nfs/dbraw/zinc/22/56/30/607225630.db2.gz DNHSSACOOFTPIE-HNNXBMFYSA-N -1 3 367.478 3.556 20 0 FHADHM O=C(c1sccc1-c1nn[n-]n1)N1CCC[C@@H]1CCCc1ccccc1 ZINC000823498003 607225631 /nfs/dbraw/zinc/22/56/31/607225631.db2.gz DNHSSACOOFTPIE-HNNXBMFYSA-N -1 3 367.478 3.556 20 0 FHADHM Cc1cc(Cl)ccc1C(=O)N(C)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000822202169 607239086 /nfs/dbraw/zinc/23/90/86/607239086.db2.gz NUKLRZWBHJEKOP-UHFFFAOYSA-N -1 3 362.220 3.759 20 0 FHADHM Cc1cc(Cl)ccc1C(=O)N(C)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000822202169 607239087 /nfs/dbraw/zinc/23/90/87/607239087.db2.gz NUKLRZWBHJEKOP-UHFFFAOYSA-N -1 3 362.220 3.759 20 0 FHADHM O=C(C[C@@H]1CCc2ccccc21)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822945514 607241814 /nfs/dbraw/zinc/24/18/14/607241814.db2.gz IJAATGQYWROXMT-LBPRGKRZSA-N -1 3 353.813 3.579 20 0 FHADHM O=C(C[C@@H]1CCc2ccccc21)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822945514 607241815 /nfs/dbraw/zinc/24/18/15/607241815.db2.gz IJAATGQYWROXMT-LBPRGKRZSA-N -1 3 353.813 3.579 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)C1(c2cccc(Cl)c2)CC1 ZINC000823315574 607242577 /nfs/dbraw/zinc/24/25/77/607242577.db2.gz ZPOZEMNQBWUMKV-UHFFFAOYSA-N -1 3 374.231 3.844 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)C1(c2cccc(Cl)c2)CC1 ZINC000823315574 607242578 /nfs/dbraw/zinc/24/25/78/607242578.db2.gz ZPOZEMNQBWUMKV-UHFFFAOYSA-N -1 3 374.231 3.844 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)C1(c2ccc(F)cc2)CCC1 ZINC000823313681 607244191 /nfs/dbraw/zinc/24/41/91/607244191.db2.gz HQCKAHHYUGZCGL-UHFFFAOYSA-N -1 3 371.803 3.720 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)C1(c2ccc(F)cc2)CCC1 ZINC000823313681 607244192 /nfs/dbraw/zinc/24/41/92/607244192.db2.gz HQCKAHHYUGZCGL-UHFFFAOYSA-N -1 3 371.803 3.720 20 0 FHADHM O=C(Oc1ccc(-c2nnn[n-]2)cc1F)C(c1ccccc1)c1ccccc1 ZINC000823449712 607247316 /nfs/dbraw/zinc/24/73/16/607247316.db2.gz AIDPYBQISYHSAP-UHFFFAOYSA-N -1 3 374.375 3.743 20 0 FHADHM O=C(Oc1ccc(-c2nn[n-]n2)cc1F)C(c1ccccc1)c1ccccc1 ZINC000823449712 607247317 /nfs/dbraw/zinc/24/73/17/607247317.db2.gz AIDPYBQISYHSAP-UHFFFAOYSA-N -1 3 374.375 3.743 20 0 FHADHM C[C@H]1CC[C@H](NC(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)c2ccccc21 ZINC000824914971 607775228 /nfs/dbraw/zinc/77/52/28/607775228.db2.gz AUMYLQITTQICRB-QFYYESIMSA-N -1 3 369.375 3.513 20 0 FHADHM C[C@H]1CC[C@H](NC(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)c2ccccc21 ZINC000824914971 607775229 /nfs/dbraw/zinc/77/52/29/607775229.db2.gz AUMYLQITTQICRB-QFYYESIMSA-N -1 3 369.375 3.513 20 0 FHADHM CCSc1ccc(CC(=O)O[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000825674070 607777367 /nfs/dbraw/zinc/77/73/67/607777367.db2.gz HMYDAKNGDHVDAV-CYBMUJFWSA-N -1 3 368.462 3.826 20 0 FHADHM CCSc1ccc(CC(=O)O[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000825674070 607777368 /nfs/dbraw/zinc/77/73/68/607777368.db2.gz HMYDAKNGDHVDAV-CYBMUJFWSA-N -1 3 368.462 3.826 20 0 FHADHM Cc1ccc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCCCC3)nc1 ZINC000826282512 607794209 /nfs/dbraw/zinc/79/42/09/607794209.db2.gz RQBHQWFSPAMZQE-UHFFFAOYSA-N -1 3 368.466 3.543 20 0 FHADHM Cc1ccc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCCCC3)nc1 ZINC000826282512 607794210 /nfs/dbraw/zinc/79/42/10/607794210.db2.gz RQBHQWFSPAMZQE-UHFFFAOYSA-N -1 3 368.466 3.543 20 0 FHADHM CCC(C)(C)c1ccc(C(=O)N(C)c2ccc(-c3nnn[n-]3)cc2F)cc1 ZINC000825044894 607794675 /nfs/dbraw/zinc/79/46/75/607794675.db2.gz VHOCFFNQNXQZFT-UHFFFAOYSA-N -1 3 367.428 3.970 20 0 FHADHM CCC(C)(C)c1ccc(C(=O)N(C)c2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000825044894 607794676 /nfs/dbraw/zinc/79/46/76/607794676.db2.gz VHOCFFNQNXQZFT-UHFFFAOYSA-N -1 3 367.428 3.970 20 0 FHADHM O=C(NCCC1=CCCC1)c1ccccc1-c1ccccc1-c1nnn[n-]1 ZINC000826436230 607795402 /nfs/dbraw/zinc/79/54/02/607795402.db2.gz MPOAJVSMUPMOTD-UHFFFAOYSA-N -1 3 359.433 3.764 20 0 FHADHM O=C(NCCC1=CCCC1)c1ccccc1-c1ccccc1-c1nn[n-]n1 ZINC000826436230 607795403 /nfs/dbraw/zinc/79/54/03/607795403.db2.gz MPOAJVSMUPMOTD-UHFFFAOYSA-N -1 3 359.433 3.764 20 0 FHADHM CCN(C(=O)c1cc2c(cccc2F)s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825381091 607796811 /nfs/dbraw/zinc/79/68/11/607796811.db2.gz ZLAWQESOOQTQOD-UHFFFAOYSA-N -1 3 367.409 3.887 20 0 FHADHM CCN(C(=O)c1cc2c(cccc2F)s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825381091 607796812 /nfs/dbraw/zinc/79/68/12/607796812.db2.gz ZLAWQESOOQTQOD-UHFFFAOYSA-N -1 3 367.409 3.887 20 0 FHADHM CCN(C(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825367320 607798986 /nfs/dbraw/zinc/79/89/86/607798986.db2.gz NGWHJFCKQTVDEB-DLBZAZTESA-N -1 3 367.840 3.677 20 0 FHADHM CCN(C(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825367320 607798987 /nfs/dbraw/zinc/79/89/87/607798987.db2.gz NGWHJFCKQTVDEB-DLBZAZTESA-N -1 3 367.840 3.677 20 0 FHADHM C[C@@H](OC(=O)c1cc(-c2nnn[n-]2)cs1)c1ccc(C(F)(F)F)cc1 ZINC000820508598 607801148 /nfs/dbraw/zinc/80/11/48/607801148.db2.gz SNRHRQZTTGRBJV-MRVPVSSYSA-N -1 3 368.340 3.865 20 0 FHADHM C[C@@H](OC(=O)c1cc(-c2nn[n-]n2)cs1)c1ccc(C(F)(F)F)cc1 ZINC000820508598 607801149 /nfs/dbraw/zinc/80/11/49/607801149.db2.gz SNRHRQZTTGRBJV-MRVPVSSYSA-N -1 3 368.340 3.865 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1CNCc1cc(Cl)ccc1Cl ZINC000826371519 607813180 /nfs/dbraw/zinc/81/31/80/607813180.db2.gz JAFXPXVJYDYORV-UHFFFAOYSA-N -1 3 352.200 3.602 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CNCc1cc(Cl)ccc1Cl ZINC000826371519 607813181 /nfs/dbraw/zinc/81/31/81/607813181.db2.gz JAFXPXVJYDYORV-UHFFFAOYSA-N -1 3 352.200 3.602 20 0 FHADHM Cc1nc(NC(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)cs1 ZINC000826327086 607813550 /nfs/dbraw/zinc/81/35/50/607813550.db2.gz RNBDFQZPNFNVCH-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1nc(NC(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)cs1 ZINC000826327086 607813551 /nfs/dbraw/zinc/81/35/51/607813551.db2.gz RNBDFQZPNFNVCH-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM C[C@H](NC(=O)CCC(C)(C)c1ccccc1)c1cccc(-c2nnn[n-]2)c1 ZINC000824478489 607819208 /nfs/dbraw/zinc/81/92/08/607819208.db2.gz HJLIYUWZBPGMKY-HNNXBMFYSA-N -1 3 363.465 3.802 20 0 FHADHM C[C@H](NC(=O)CCC(C)(C)c1ccccc1)c1cccc(-c2nn[n-]n2)c1 ZINC000824478489 607819209 /nfs/dbraw/zinc/81/92/09/607819209.db2.gz HJLIYUWZBPGMKY-HNNXBMFYSA-N -1 3 363.465 3.802 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1C[C@H](C)CSc2ccccc21 ZINC000826244520 607832047 /nfs/dbraw/zinc/83/20/47/607832047.db2.gz VQARLWDPVLASGE-LBPRGKRZSA-N -1 3 365.462 3.564 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1C[C@H](C)CSc2ccccc21 ZINC000826244520 607832048 /nfs/dbraw/zinc/83/20/48/607832048.db2.gz VQARLWDPVLASGE-LBPRGKRZSA-N -1 3 365.462 3.564 20 0 FHADHM O=C(Nc1ccc2[nH]ccc2c1)c1c(Cl)cc(-c2nnn[n-]2)cc1Cl ZINC000826455166 607833585 /nfs/dbraw/zinc/83/35/85/607833585.db2.gz BRNVJPBJDYLLMC-UHFFFAOYSA-N -1 3 373.203 3.907 20 0 FHADHM O=C(Nc1ccc2[nH]ccc2c1)c1c(Cl)cc(-c2nn[n-]n2)cc1Cl ZINC000826455166 607833586 /nfs/dbraw/zinc/83/35/86/607833586.db2.gz BRNVJPBJDYLLMC-UHFFFAOYSA-N -1 3 373.203 3.907 20 0 FHADHM Cc1c(C(=O)Nc2sccc2-c2nnn[n-]2)cccc1-c1ccccn1 ZINC000826234676 607861604 /nfs/dbraw/zinc/86/16/04/607861604.db2.gz IWDDFOBNHGHBCS-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1c(C(=O)Nc2sccc2-c2nn[n-]n2)cccc1-c1ccccn1 ZINC000826234676 607861605 /nfs/dbraw/zinc/86/16/05/607861605.db2.gz IWDDFOBNHGHBCS-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM O[C@@H](COc1cccc(Oc2ccccc2)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000826505255 607870103 /nfs/dbraw/zinc/87/01/03/607870103.db2.gz QPBHRJAEDADWKJ-FQEVSTJZSA-N -1 3 374.400 3.771 20 0 FHADHM O[C@@H](COc1cccc(Oc2ccccc2)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000826505255 607870104 /nfs/dbraw/zinc/87/01/04/607870104.db2.gz QPBHRJAEDADWKJ-FQEVSTJZSA-N -1 3 374.400 3.771 20 0 FHADHM O[C@H](COc1ccccc1Cc1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000826505508 607870585 /nfs/dbraw/zinc/87/05/85/607870585.db2.gz WYYCDCSWIADGIA-HXUWFJFHSA-N -1 3 372.428 3.570 20 0 FHADHM O[C@H](COc1ccccc1Cc1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000826505508 607870586 /nfs/dbraw/zinc/87/05/86/607870586.db2.gz WYYCDCSWIADGIA-HXUWFJFHSA-N -1 3 372.428 3.570 20 0 FHADHM CC(C)[C@H](C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccc(F)cc1 ZINC000824473017 607881255 /nfs/dbraw/zinc/88/12/55/607881255.db2.gz YPETWAAJZOPYAM-ACJLOTCBSA-N -1 3 367.428 3.623 20 0 FHADHM CC(C)[C@H](C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccc(F)cc1 ZINC000824473017 607881256 /nfs/dbraw/zinc/88/12/56/607881256.db2.gz YPETWAAJZOPYAM-ACJLOTCBSA-N -1 3 367.428 3.623 20 0 FHADHM CN(C(=O)[C@@H]1CC[C@@H]2CCCC[C@H]2C1)c1ccc(-c2nnn[n-]2)cc1F ZINC000825812916 607926145 /nfs/dbraw/zinc/92/61/45/607926145.db2.gz XNQFFIURZAAYRE-KCQAQPDRSA-N -1 3 357.433 3.575 20 0 FHADHM CN(C(=O)[C@@H]1CC[C@@H]2CCCC[C@H]2C1)c1ccc(-c2nn[n-]n2)cc1F ZINC000825812916 607926146 /nfs/dbraw/zinc/92/61/46/607926146.db2.gz XNQFFIURZAAYRE-KCQAQPDRSA-N -1 3 357.433 3.575 20 0 FHADHM CCn1c2ccc(-c3nnn[n-]3)cc2nc1-c1ccc(OC(F)F)cc1 ZINC000825782352 607975132 /nfs/dbraw/zinc/97/51/32/607975132.db2.gz DUEAPQOQDFMGJA-UHFFFAOYSA-N -1 3 356.336 3.505 20 0 FHADHM CCn1c2ccc(-c3nn[n-]n3)cc2nc1-c1ccc(OC(F)F)cc1 ZINC000825782352 607975133 /nfs/dbraw/zinc/97/51/33/607975133.db2.gz DUEAPQOQDFMGJA-UHFFFAOYSA-N -1 3 356.336 3.505 20 0 FHADHM CCn1c2ccc(-c3nnn[n-]3)cc2nc1-c1ccc(OCC(F)F)cc1 ZINC000825782801 607975174 /nfs/dbraw/zinc/97/51/74/607975174.db2.gz QBGDIFHIMHMOOJ-UHFFFAOYSA-N -1 3 370.363 3.547 20 0 FHADHM CCn1c2ccc(-c3nn[n-]n3)cc2nc1-c1ccc(OCC(F)F)cc1 ZINC000825782801 607975175 /nfs/dbraw/zinc/97/51/75/607975175.db2.gz QBGDIFHIMHMOOJ-UHFFFAOYSA-N -1 3 370.363 3.547 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1OC[C@@H](O)c1ccc(Cl)cc1Cl ZINC000826254891 607982027 /nfs/dbraw/zinc/98/20/27/607982027.db2.gz DUIOCUQRYBXEHM-CQSZACIVSA-N -1 3 365.220 3.594 20 0 FHADHM Fc1ccc(NCc2ccc(-c3nnn[n-]3)s2)c(OCC(F)(F)F)c1 ZINC000826375271 608027266 /nfs/dbraw/zinc/02/72/66/608027266.db2.gz GOLYOTKWBSSGEU-UHFFFAOYSA-N -1 3 373.335 3.621 20 0 FHADHM Cn1c2ccc(NCc3ccc(-c4nnn[n-]4)s3)cc2nc1C(C)(C)C ZINC000826355419 608028391 /nfs/dbraw/zinc/02/83/91/608028391.db2.gz YPSGJCNLDGUKCA-UHFFFAOYSA-N -1 3 367.482 3.725 20 0 FHADHM Cn1c2ccc(NCc3ccc(-c4nn[n-]n4)s3)cc2nc1C(C)(C)C ZINC000826355419 608028392 /nfs/dbraw/zinc/02/83/92/608028392.db2.gz YPSGJCNLDGUKCA-UHFFFAOYSA-N -1 3 367.482 3.725 20 0 FHADHM O=C(c1cc(-c2nnn[n-]2)cs1)N1CCCC[C@H]1CCc1ccccc1 ZINC000826470343 608032185 /nfs/dbraw/zinc/03/21/85/608032185.db2.gz MRCFQVSHKDPGBU-INIZCTEOSA-N -1 3 367.478 3.556 20 0 FHADHM O=C(c1cc(-c2nn[n-]n2)cs1)N1CCCC[C@H]1CCc1ccccc1 ZINC000826470343 608032186 /nfs/dbraw/zinc/03/21/86/608032186.db2.gz MRCFQVSHKDPGBU-INIZCTEOSA-N -1 3 367.478 3.556 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1Oc1cc(C(C)C)nc(C(C)C)n1 ZINC000826176222 608047280 /nfs/dbraw/zinc/04/72/80/608047280.db2.gz GXFPVPMVDCHDCN-UHFFFAOYSA-N -1 3 354.414 3.704 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1Oc1cc(C(C)C)nc(C(C)C)n1 ZINC000826176222 608047281 /nfs/dbraw/zinc/04/72/81/608047281.db2.gz GXFPVPMVDCHDCN-UHFFFAOYSA-N -1 3 354.414 3.704 20 0 FHADHM Cc1ccsc1CNc1ccc(-c2nn[n-]n2)cc1Br ZINC000826316015 608048870 /nfs/dbraw/zinc/04/88/70/608048870.db2.gz AXAFBOLZNQNIGC-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM c1ccc(C[C@H]2c3ccccc3CCN2c2ccc(-c3nnn[n-]3)cn2)cc1 ZINC000826520887 608053737 /nfs/dbraw/zinc/05/37/37/608053737.db2.gz ULXZFSHROWWIME-FQEVSTJZSA-N -1 3 368.444 3.608 20 0 FHADHM c1ccc(C[C@H]2c3ccccc3CCN2c2ccc(-c3nn[n-]n3)cn2)cc1 ZINC000826520887 608053738 /nfs/dbraw/zinc/05/37/38/608053738.db2.gz ULXZFSHROWWIME-FQEVSTJZSA-N -1 3 368.444 3.608 20 0 FHADHM Cc1c(NC(=O)N(C)Cc2ccc(Cl)c(F)c2)cccc1-c1nnn[n-]1 ZINC000826241448 608106751 /nfs/dbraw/zinc/10/67/51/608106751.db2.gz DKPYZRVUGWZTEN-UHFFFAOYSA-N -1 3 374.807 3.632 20 0 FHADHM Cc1c(NC(=O)N(C)Cc2ccc(Cl)c(F)c2)cccc1-c1nn[n-]n1 ZINC000826241448 608106752 /nfs/dbraw/zinc/10/67/52/608106752.db2.gz DKPYZRVUGWZTEN-UHFFFAOYSA-N -1 3 374.807 3.632 20 0 FHADHM Cc1cc(C(=O)N(CC(C)C)c2ccc(-c3nnn[n-]3)cc2)cc(C)c1F ZINC000826258004 608119867 /nfs/dbraw/zinc/11/98/67/608119867.db2.gz WOBBWTQFQXCLIE-UHFFFAOYSA-N -1 3 367.428 3.925 20 0 FHADHM Cc1cc(C(=O)N(CC(C)C)c2ccc(-c3nn[n-]n3)cc2)cc(C)c1F ZINC000826258004 608119868 /nfs/dbraw/zinc/11/98/68/608119868.db2.gz WOBBWTQFQXCLIE-UHFFFAOYSA-N -1 3 367.428 3.925 20 0 FHADHM Fc1cccc(F)c1-c1csc(COc2ccccc2-c2nnn[n-]2)n1 ZINC000826377332 608144274 /nfs/dbraw/zinc/14/42/74/608144274.db2.gz NENAMOBBHULQTO-UHFFFAOYSA-N -1 3 371.372 3.847 20 0 FHADHM Fc1cccc(F)c1-c1csc(COc2ccccc2-c2nn[n-]n2)n1 ZINC000826377332 608144275 /nfs/dbraw/zinc/14/42/75/608144275.db2.gz NENAMOBBHULQTO-UHFFFAOYSA-N -1 3 371.372 3.847 20 0 FHADHM C[C@H](OC(=O)c1cc(F)c(Cl)cc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000824723536 608158971 /nfs/dbraw/zinc/15/89/71/608158971.db2.gz RWGKDULXWIOHOI-QMMMGPOBSA-N -1 3 364.739 3.716 20 0 FHADHM C[C@H](OC(=O)c1cc(F)c(Cl)cc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000824723536 608158973 /nfs/dbraw/zinc/15/89/73/608158973.db2.gz RWGKDULXWIOHOI-QMMMGPOBSA-N -1 3 364.739 3.716 20 0 FHADHM CCCCNc1ccccc1C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000825291395 608169032 /nfs/dbraw/zinc/16/90/32/608169032.db2.gz QPZRBESZXAZNIJ-AWEZNQCLSA-N -1 3 364.453 3.570 20 0 FHADHM CCCCNc1ccccc1C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000825291395 608169033 /nfs/dbraw/zinc/16/90/33/608169033.db2.gz QPZRBESZXAZNIJ-AWEZNQCLSA-N -1 3 364.453 3.570 20 0 FHADHM C[C@H](OC(=O)[C@H]1CCCc2sccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000824714962 608181892 /nfs/dbraw/zinc/18/18/92/608181892.db2.gz PSJMOYGMWMCPDV-NHYWBVRUSA-N -1 3 354.435 3.653 20 0 FHADHM C[C@H](OC(=O)[C@H]1CCCc2sccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000824714962 608181894 /nfs/dbraw/zinc/18/18/94/608181894.db2.gz PSJMOYGMWMCPDV-NHYWBVRUSA-N -1 3 354.435 3.653 20 0 FHADHM C[C@H](OC(=O)c1cc(F)c(Cl)cc1F)c1cccc(-c2nnn[n-]2)c1 ZINC000824723621 608183499 /nfs/dbraw/zinc/18/34/99/608183499.db2.gz SSKRQHAKEYOQEM-QMMMGPOBSA-N -1 3 364.739 3.716 20 0 FHADHM C[C@H](OC(=O)c1cc(F)c(Cl)cc1F)c1cccc(-c2nn[n-]n2)c1 ZINC000824723621 608183503 /nfs/dbraw/zinc/18/35/03/608183503.db2.gz SSKRQHAKEYOQEM-QMMMGPOBSA-N -1 3 364.739 3.716 20 0 FHADHM C[C@@H](OC(=O)c1cc(F)c(F)cc1Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000824722460 608185264 /nfs/dbraw/zinc/18/52/64/608185264.db2.gz IXTIDBNKTLPJKL-MRVPVSSYSA-N -1 3 364.739 3.716 20 0 FHADHM C[C@@H](OC(=O)c1cc(F)c(F)cc1Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000824722460 608185265 /nfs/dbraw/zinc/18/52/65/608185265.db2.gz IXTIDBNKTLPJKL-MRVPVSSYSA-N -1 3 364.739 3.716 20 0 FHADHM CS[C@H](C(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000826224676 608186042 /nfs/dbraw/zinc/18/60/42/608186042.db2.gz JYBGDJANOSJVNZ-WBMJQRKESA-N -1 3 354.435 3.575 20 0 FHADHM CS[C@H](C(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000826224676 608186043 /nfs/dbraw/zinc/18/60/43/608186043.db2.gz JYBGDJANOSJVNZ-WBMJQRKESA-N -1 3 354.435 3.575 20 0 FHADHM C[C@@H]1CCN(C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)CC12CCC2 ZINC000824945812 608203987 /nfs/dbraw/zinc/20/39/87/608203987.db2.gz GGLMMGSCLUSDCW-LLVKDONJSA-N -1 3 360.849 3.564 20 0 FHADHM C[C@@H]1CCN(C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)CC12CCC2 ZINC000824945812 608203988 /nfs/dbraw/zinc/20/39/88/608203988.db2.gz GGLMMGSCLUSDCW-LLVKDONJSA-N -1 3 360.849 3.564 20 0 FHADHM COc1cccc(C(=O)CSc2cccc(Cl)c2-c2nnn[n-]2)c1 ZINC000826213624 608206413 /nfs/dbraw/zinc/20/64/13/608206413.db2.gz DXBMTNNTRJXCAO-UHFFFAOYSA-N -1 3 360.826 3.504 20 0 FHADHM COc1cccc(C(=O)CSc2cccc(Cl)c2-c2nn[n-]n2)c1 ZINC000826213624 608206414 /nfs/dbraw/zinc/20/64/14/608206414.db2.gz DXBMTNNTRJXCAO-UHFFFAOYSA-N -1 3 360.826 3.504 20 0 FHADHM c1ccc([C@H](Nc2ccc3cc(-c4nnn[n-]4)ccc3n2)[C@H]2CCCO2)cc1 ZINC000826521056 608226242 /nfs/dbraw/zinc/22/62/42/608226242.db2.gz YGTCFVDESOJLHJ-QUCCMNQESA-N -1 3 372.432 3.747 20 0 FHADHM c1ccc([C@H](Nc2ccc3cc(-c4nn[n-]n4)ccc3n2)[C@H]2CCCO2)cc1 ZINC000826521056 608226243 /nfs/dbraw/zinc/22/62/43/608226243.db2.gz YGTCFVDESOJLHJ-QUCCMNQESA-N -1 3 372.432 3.747 20 0 FHADHM COc1cc(Cl)ccc1CNc1ccc2cc(-c3nnn[n-]3)ccc2n1 ZINC000826179930 608226472 /nfs/dbraw/zinc/22/64/72/608226472.db2.gz LHFNUNRCUVEXFE-UHFFFAOYSA-N -1 3 366.812 3.689 20 0 FHADHM COc1cc(Cl)ccc1CNc1ccc2cc(-c3nn[n-]n3)ccc2n1 ZINC000826179930 608226474 /nfs/dbraw/zinc/22/64/74/608226474.db2.gz LHFNUNRCUVEXFE-UHFFFAOYSA-N -1 3 366.812 3.689 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1CNc1ccc(F)cc1OC(C)(C)C ZINC000826183912 608227495 /nfs/dbraw/zinc/22/74/95/608227495.db2.gz FGKDDBMWVSJTJO-UHFFFAOYSA-N -1 3 371.416 3.804 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CNc1ccc(F)cc1OC(C)(C)C ZINC000826183912 608227496 /nfs/dbraw/zinc/22/74/96/608227496.db2.gz FGKDDBMWVSJTJO-UHFFFAOYSA-N -1 3 371.416 3.804 20 0 FHADHM COc1ccc([C@H](OC)[C@@H](C)Nc2ccc(Cl)cc2-c2nnn[n-]2)cc1 ZINC000826190086 608239964 /nfs/dbraw/zinc/23/99/64/608239964.db2.gz PIJHJWBPXCQINY-PIGZYNQJSA-N -1 3 373.844 3.717 20 0 FHADHM COc1ccc([C@H](OC)[C@@H](C)Nc2ccc(Cl)cc2-c2nn[n-]n2)cc1 ZINC000826190086 608239965 /nfs/dbraw/zinc/23/99/65/608239965.db2.gz PIJHJWBPXCQINY-PIGZYNQJSA-N -1 3 373.844 3.717 20 0 FHADHM CC[C@H]1CC[C@H](C)N1C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000825195357 608263901 /nfs/dbraw/zinc/26/39/01/608263901.db2.gz WHCSSSDKBSMTAX-ONGXEEELSA-N -1 3 368.363 3.680 20 0 FHADHM CC[C@H]1CC[C@H](C)N1C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000825195357 608263903 /nfs/dbraw/zinc/26/39/03/608263903.db2.gz WHCSSSDKBSMTAX-ONGXEEELSA-N -1 3 368.363 3.680 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CSc1nc2cc(C)ccc2o1 ZINC000826173450 608264451 /nfs/dbraw/zinc/26/44/51/608264451.db2.gz DXPJZOSCSGEBGP-UHFFFAOYSA-N -1 3 353.407 3.617 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CSc1nc2cc(C)ccc2o1 ZINC000826173450 608264452 /nfs/dbraw/zinc/26/44/52/608264452.db2.gz DXPJZOSCSGEBGP-UHFFFAOYSA-N -1 3 353.407 3.617 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)c(N[C@H](C)c2cccc(Br)c2)n1 ZINC000826275236 608273122 /nfs/dbraw/zinc/27/31/22/608273122.db2.gz SZGLTISROYRFQG-SNVBAGLBSA-N -1 3 359.231 3.506 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)c(N[C@H](C)c2cccc(Br)c2)n1 ZINC000826275236 608273124 /nfs/dbraw/zinc/27/31/24/608273124.db2.gz SZGLTISROYRFQG-SNVBAGLBSA-N -1 3 359.231 3.506 20 0 FHADHM Cc1cnc([C@H](C)NCc2ccc(-c3ccccc3-c3nnn[n-]3)cc2)o1 ZINC000826317688 608291864 /nfs/dbraw/zinc/29/18/64/608291864.db2.gz KZWDCKHJQRZKRQ-AWEZNQCLSA-N -1 3 360.421 3.681 20 0 FHADHM Cc1cnc([C@H](C)NCc2ccc(-c3ccccc3-c3nn[n-]n3)cc2)o1 ZINC000826317688 608291865 /nfs/dbraw/zinc/29/18/65/608291865.db2.gz KZWDCKHJQRZKRQ-AWEZNQCLSA-N -1 3 360.421 3.681 20 0 FHADHM C[C@@H](Nc1nc2c(cc1-c1nnn[n-]1)CCCC2)c1ccc(F)cc1F ZINC000826231829 608295201 /nfs/dbraw/zinc/29/52/01/608295201.db2.gz DBEVKDYNOURLOJ-SNVBAGLBSA-N -1 3 356.380 3.592 20 0 FHADHM C[C@@H](Nc1nc2c(cc1-c1nn[n-]n1)CCCC2)c1ccc(F)cc1F ZINC000826231829 608295202 /nfs/dbraw/zinc/29/52/02/608295202.db2.gz DBEVKDYNOURLOJ-SNVBAGLBSA-N -1 3 356.380 3.592 20 0 FHADHM C[C@@H]1CCN(C(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)C[C@H]1C ZINC000824955458 608313047 /nfs/dbraw/zinc/31/30/47/608313047.db2.gz OVVAZJHOLQCZEP-HUUCEWRRSA-N -1 3 361.449 3.652 20 0 FHADHM C[C@@H]1CCN(C(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)C[C@H]1C ZINC000824955458 608313049 /nfs/dbraw/zinc/31/30/49/608313049.db2.gz OVVAZJHOLQCZEP-HUUCEWRRSA-N -1 3 361.449 3.652 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CNc1ccc(Br)c(C)c1 ZINC000826170837 608319296 /nfs/dbraw/zinc/31/92/96/608319296.db2.gz QYQZVVNGGDIUTK-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CNc1ccc(Br)c(C)c1 ZINC000826170837 608319297 /nfs/dbraw/zinc/31/92/97/608319297.db2.gz QYQZVVNGGDIUTK-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM Cc1scc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CC[C@@H](C)C3)c1C ZINC000826350205 608339826 /nfs/dbraw/zinc/33/98/26/608339826.db2.gz MESHXUZMBNKEQH-MRVPVSSYSA-N -1 3 373.507 3.984 20 0 FHADHM Cc1scc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CC[C@@H](C)C3)c1C ZINC000826350205 608339828 /nfs/dbraw/zinc/33/98/28/608339828.db2.gz MESHXUZMBNKEQH-MRVPVSSYSA-N -1 3 373.507 3.984 20 0 FHADHM CCN(C(=O)CCCC(F)(F)F)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825371964 608344949 /nfs/dbraw/zinc/34/49/49/608344949.db2.gz OUGQXXLWGXOYGG-UHFFFAOYSA-N -1 3 361.755 3.606 20 0 FHADHM CCN(C(=O)CCCC(F)(F)F)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825371964 608344951 /nfs/dbraw/zinc/34/49/51/608344951.db2.gz OUGQXXLWGXOYGG-UHFFFAOYSA-N -1 3 361.755 3.606 20 0 FHADHM CCN(C(=O)c1cc(C)ccc1C)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825379524 608345270 /nfs/dbraw/zinc/34/52/70/608345270.db2.gz HBRYTRWKWHBCSP-UHFFFAOYSA-N -1 3 355.829 3.804 20 0 FHADHM CCN(C(=O)c1cc(C)ccc1C)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825379524 608345271 /nfs/dbraw/zinc/34/52/71/608345271.db2.gz HBRYTRWKWHBCSP-UHFFFAOYSA-N -1 3 355.829 3.804 20 0 FHADHM CC(C)(C)c1cc(NC(=O)c2scnc2Cl)c(-c2nnn[n-]2)s1 ZINC000824135244 608348632 /nfs/dbraw/zinc/34/86/32/608348632.db2.gz CMSYMNGASNYUFP-UHFFFAOYSA-N -1 3 368.875 3.588 20 0 FHADHM O[C@H](CSc1ccc(-c2nnn[n-]2)cc1Cl)c1ccc(Cl)cc1 ZINC000826510749 608393542 /nfs/dbraw/zinc/39/35/42/608393542.db2.gz ISMOSCHSRKCMQZ-CYBMUJFWSA-N -1 3 367.261 3.999 20 0 FHADHM O[C@H](CSc1ccc(-c2nn[n-]n2)cc1Cl)c1ccc(Cl)cc1 ZINC000826510749 608393543 /nfs/dbraw/zinc/39/35/43/608393543.db2.gz ISMOSCHSRKCMQZ-CYBMUJFWSA-N -1 3 367.261 3.999 20 0 FHADHM Fc1c(COc2ccc(Cl)c3cccnc23)cccc1-c1nnn[n-]1 ZINC000826370649 608394908 /nfs/dbraw/zinc/39/49/08/608394908.db2.gz CCNVHOFMUQKVNH-UHFFFAOYSA-N -1 3 355.760 3.786 20 0 FHADHM Fc1c(COc2ccc(Cl)c3cccnc23)cccc1-c1nn[n-]n1 ZINC000826370649 608394909 /nfs/dbraw/zinc/39/49/09/608394909.db2.gz CCNVHOFMUQKVNH-UHFFFAOYSA-N -1 3 355.760 3.786 20 0 FHADHM O=C(OCc1cccc(-c2nnn[n-]2)c1F)[C@H]1C[C@H]1c1cccc(Cl)c1 ZINC000826465990 608444999 /nfs/dbraw/zinc/44/49/99/608444999.db2.gz LAEWQHWAPOZMNX-GJZGRUSLSA-N -1 3 372.787 3.506 20 0 FHADHM O=C(OCc1cccc(-c2nn[n-]n2)c1F)[C@H]1C[C@H]1c1cccc(Cl)c1 ZINC000826465990 608445000 /nfs/dbraw/zinc/44/50/00/608445000.db2.gz LAEWQHWAPOZMNX-GJZGRUSLSA-N -1 3 372.787 3.506 20 0 FHADHM CCc1ccc(NC(=O)N2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)cc1 ZINC000825711540 608468748 /nfs/dbraw/zinc/46/87/48/608468748.db2.gz FENSJDNCKDBBPN-UHFFFAOYSA-N -1 3 374.448 3.750 20 0 FHADHM CCc1ccc(NC(=O)N2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)cc1 ZINC000825711540 608468749 /nfs/dbraw/zinc/46/87/49/608468749.db2.gz FENSJDNCKDBBPN-UHFFFAOYSA-N -1 3 374.448 3.750 20 0 FHADHM CC1(C)CCC[C@H](C(=O)N2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)C1 ZINC000824801465 608484274 /nfs/dbraw/zinc/48/42/74/608484274.db2.gz FTSAPAUCVRXHJZ-SFHVURJKSA-N -1 3 365.481 3.699 20 0 FHADHM CC1(C)CCC[C@H](C(=O)N2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)C1 ZINC000824801465 608484276 /nfs/dbraw/zinc/48/42/76/608484276.db2.gz FTSAPAUCVRXHJZ-SFHVURJKSA-N -1 3 365.481 3.699 20 0 FHADHM C[C@@H](NCc1ncc(-c2ccccc2F)o1)c1cccc(-c2nn[n-]n2)c1 ZINC000824633384 608484560 /nfs/dbraw/zinc/48/45/60/608484560.db2.gz MBQYBMUKSBFXGT-GFCCVEGCSA-N -1 3 364.384 3.512 20 0 FHADHM O=C(CCCC1CCCC1)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000826406161 608487167 /nfs/dbraw/zinc/48/71/67/608487167.db2.gz KVIDIZIWSVSDBP-UHFFFAOYSA-N -1 3 365.481 3.843 20 0 FHADHM O=C(CCCC1CCCC1)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000826406161 608487168 /nfs/dbraw/zinc/48/71/68/608487168.db2.gz KVIDIZIWSVSDBP-UHFFFAOYSA-N -1 3 365.481 3.843 20 0 FHADHM Cc1oc(-c2cccs2)nc1CN[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000826340574 608493065 /nfs/dbraw/zinc/49/30/65/608493065.db2.gz CYOOEOGCDUTQOP-NSHDSACASA-N -1 3 366.450 3.742 20 0 FHADHM O=C(Nc1sccc1-c1nnn[n-]1)c1ccc(C(F)(F)F)cc1Cl ZINC000826461002 608540646 /nfs/dbraw/zinc/54/06/46/608540646.db2.gz AZTFQHZQFIOUPC-UHFFFAOYSA-N -1 3 373.747 3.853 20 0 FHADHM O=C(Nc1sccc1-c1nn[n-]n1)c1ccc(C(F)(F)F)cc1Cl ZINC000826461002 608540647 /nfs/dbraw/zinc/54/06/47/608540647.db2.gz AZTFQHZQFIOUPC-UHFFFAOYSA-N -1 3 373.747 3.853 20 0 FHADHM CC[C@@H](Nc1cccc(F)c1-c1nnn[n-]1)c1nc(-c2ccccc2)c[nH]1 ZINC000825146980 608540677 /nfs/dbraw/zinc/54/06/77/608540677.db2.gz GCGICHJYBJYXRD-CQSZACIVSA-N -1 3 363.400 3.959 20 0 FHADHM CC[C@@H](Nc1cccc(F)c1-c1nn[n-]n1)c1nc(-c2ccccc2)c[nH]1 ZINC000825146980 608540678 /nfs/dbraw/zinc/54/06/78/608540678.db2.gz GCGICHJYBJYXRD-CQSZACIVSA-N -1 3 363.400 3.959 20 0 FHADHM O=C(Nc1ccc(Cl)cc1F)c1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000826453675 608573966 /nfs/dbraw/zinc/57/39/66/608573966.db2.gz VCEMRSSKBOFZQT-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(Cl)cc1F)c1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000826453675 608573967 /nfs/dbraw/zinc/57/39/67/608573967.db2.gz VCEMRSSKBOFZQT-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM CSc1ccc(C)c(NC(=O)C=Cc2ccccc2-c2nnn[n-]2)c1 ZINC000826230537 608591580 /nfs/dbraw/zinc/59/15/80/608591580.db2.gz XXWYAEPRFPQIEH-CSKARUKUSA-N -1 3 351.435 3.549 20 0 FHADHM CSc1ccc(C)c(NC(=O)C=Cc2ccccc2-c2nn[n-]n2)c1 ZINC000826230537 608591581 /nfs/dbraw/zinc/59/15/81/608591581.db2.gz XXWYAEPRFPQIEH-CSKARUKUSA-N -1 3 351.435 3.549 20 0 FHADHM CSc1ccc(C)c(NC(=O)C=Cc2ccccc2-c2nnn[n-]2)c1 ZINC000826230538 608591984 /nfs/dbraw/zinc/59/19/84/608591984.db2.gz XXWYAEPRFPQIEH-NTMALXAHSA-N -1 3 351.435 3.549 20 0 FHADHM CSc1ccc(C)c(NC(=O)C=Cc2ccccc2-c2nn[n-]n2)c1 ZINC000826230538 608591986 /nfs/dbraw/zinc/59/19/86/608591986.db2.gz XXWYAEPRFPQIEH-NTMALXAHSA-N -1 3 351.435 3.549 20 0 FHADHM C[C@@H]1CCCN(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)[C@@H]1C ZINC000824937799 608604714 /nfs/dbraw/zinc/60/47/14/608604714.db2.gz RJTSHONGOCBHAQ-NXEZZACHSA-N -1 3 368.363 3.538 20 0 FHADHM C[C@@H]1CCCN(C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)[C@@H]1C ZINC000824937799 608604715 /nfs/dbraw/zinc/60/47/15/608604715.db2.gz RJTSHONGOCBHAQ-NXEZZACHSA-N -1 3 368.363 3.538 20 0 FHADHM CC(C)[C@@H](OC(=O)Cc1cccc(-c2nnn[n-]2)c1)c1ccc(F)c(F)c1 ZINC000824207506 608671339 /nfs/dbraw/zinc/67/13/39/608671339.db2.gz YGQALDQBPGVSNM-GOSISDBHSA-N -1 3 372.375 3.628 20 0 FHADHM CC(C)[C@@H](OC(=O)Cc1cccc(-c2nn[n-]n2)c1)c1ccc(F)c(F)c1 ZINC000824207506 608671341 /nfs/dbraw/zinc/67/13/41/608671341.db2.gz YGQALDQBPGVSNM-GOSISDBHSA-N -1 3 372.375 3.628 20 0 FHADHM COc1ccc(F)cc1[C@H](C)N[C@@H](C)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000826209051 609134241 /nfs/dbraw/zinc/13/42/41/609134241.db2.gz KOUSQSBUVYIAEY-QWRGUYRKSA-N -1 3 359.380 3.565 20 0 FHADHM CCC(CC)c1cc(CN[C@@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)on1 ZINC000825114084 609146866 /nfs/dbraw/zinc/14/68/66/609146866.db2.gz JMNKAGMWAFZDCM-NSHDSACASA-N -1 3 358.421 3.748 20 0 FHADHM CCC(CC)c1cc(CN[C@@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)on1 ZINC000825114084 609146869 /nfs/dbraw/zinc/14/68/69/609146869.db2.gz JMNKAGMWAFZDCM-NSHDSACASA-N -1 3 358.421 3.748 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@@H]2/C=C\c2ccccc2)cccc1-c1nnn[n-]1 ZINC000826241353 609159662 /nfs/dbraw/zinc/15/96/62/609159662.db2.gz ANGCVWHULUTBCV-MUSGIIIZSA-N -1 3 374.448 3.885 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@@H]2/C=C\c2ccccc2)cccc1-c1nn[n-]n1 ZINC000826241353 609159663 /nfs/dbraw/zinc/15/96/63/609159663.db2.gz ANGCVWHULUTBCV-MUSGIIIZSA-N -1 3 374.448 3.885 20 0 FHADHM FC(F)Oc1cccc(N[C@@H]2CCCc3cc(-c4nnn[n-]4)ccc32)c1 ZINC000826370092 609165353 /nfs/dbraw/zinc/16/53/53/609165353.db2.gz DFJCBJDUGPVUOM-MRXNPFEDSA-N -1 3 357.364 3.958 20 0 FHADHM FC(F)Oc1cccc(N[C@@H]2CCCc3cc(-c4nn[n-]n4)ccc32)c1 ZINC000826370092 609165354 /nfs/dbraw/zinc/16/53/54/609165354.db2.gz DFJCBJDUGPVUOM-MRXNPFEDSA-N -1 3 357.364 3.958 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NCc1ccc(C(F)(F)F)cc1 ZINC000825481004 609179222 /nfs/dbraw/zinc/17/92/22/609179222.db2.gz QKRZHIKLDGFZMH-UHFFFAOYSA-N -1 3 362.359 3.929 20 0 FHADHM COCCOc1ccc(N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1Cl ZINC000826162477 609180739 /nfs/dbraw/zinc/18/07/39/609180739.db2.gz DFSGJTCJIUQLGW-GFCCVEGCSA-N -1 3 373.844 3.718 20 0 FHADHM COCCOc1ccc(N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1Cl ZINC000826162477 609180741 /nfs/dbraw/zinc/18/07/41/609180741.db2.gz DFSGJTCJIUQLGW-GFCCVEGCSA-N -1 3 373.844 3.718 20 0 FHADHM Cc1cc(NCc2cccc(-c3nnn[n-]3)c2)nn1-c1cccc(Cl)c1 ZINC000826271114 609180983 /nfs/dbraw/zinc/18/09/83/609180983.db2.gz CSSHYKMHUQKLNV-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM Cc1cc(NCc2cccc(-c3nn[n-]n3)c2)nn1-c1cccc(Cl)c1 ZINC000826271114 609180984 /nfs/dbraw/zinc/18/09/84/609180984.db2.gz CSSHYKMHUQKLNV-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM CCc1c(C)sc(NC(=O)Cc2ccccc2SC)c1-c1nnn[n-]1 ZINC000825688131 609183319 /nfs/dbraw/zinc/18/33/19/609183319.db2.gz QUQZLHODKKNFIE-UHFFFAOYSA-N -1 3 373.507 3.702 20 0 FHADHM CCc1c(C)sc(NC(=O)Cc2ccccc2SC)c1-c1nn[n-]n1 ZINC000825688131 609183320 /nfs/dbraw/zinc/18/33/20/609183320.db2.gz QUQZLHODKKNFIE-UHFFFAOYSA-N -1 3 373.507 3.702 20 0 FHADHM CCCN(C(=O)c1c[nH]c(-c2nnn[n-]2)c1)[C@H](C)c1cc2ccccc2o1 ZINC000825301619 609201148 /nfs/dbraw/zinc/20/11/48/609201148.db2.gz NUAYTBGPPBFGJA-GFCCVEGCSA-N -1 3 364.409 3.554 20 0 FHADHM CCCN(C(=O)c1c[nH]c(-c2nn[n-]n2)c1)[C@H](C)c1cc2ccccc2o1 ZINC000825301619 609201149 /nfs/dbraw/zinc/20/11/49/609201149.db2.gz NUAYTBGPPBFGJA-GFCCVEGCSA-N -1 3 364.409 3.554 20 0 FHADHM CCOc1ccc(N[C@H]2CCCc3cc(-c4nnn[n-]4)ccc32)cc1OC ZINC000825642780 609270957 /nfs/dbraw/zinc/27/09/57/609270957.db2.gz BMJHUWBWKNREIQ-KRWDZBQOSA-N -1 3 365.437 3.764 20 0 FHADHM CCOc1ccc(N[C@H]2CCCc3cc(-c4nn[n-]n4)ccc32)cc1OC ZINC000825642780 609270958 /nfs/dbraw/zinc/27/09/58/609270958.db2.gz BMJHUWBWKNREIQ-KRWDZBQOSA-N -1 3 365.437 3.764 20 0 FHADHM CCOc1ccc(OCC)c(N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000825643438 609272047 /nfs/dbraw/zinc/27/20/47/609272047.db2.gz NXCLVDZBNJQVAX-ZDUSSCGKSA-N -1 3 353.426 3.837 20 0 FHADHM CCOc1ccc(OCC)c(N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000825643438 609272048 /nfs/dbraw/zinc/27/20/48/609272048.db2.gz NXCLVDZBNJQVAX-ZDUSSCGKSA-N -1 3 353.426 3.837 20 0 FHADHM C[C@@H](Nc1cccc(C(=O)NC(C)(C)C)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824662472 609273309 /nfs/dbraw/zinc/27/33/09/609273309.db2.gz LDSMPVIBLQPQNJ-CYBMUJFWSA-N -1 3 364.453 3.568 20 0 FHADHM C[C@@H](Nc1cccc(C(=O)NC(C)(C)C)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824662472 609273310 /nfs/dbraw/zinc/27/33/10/609273310.db2.gz LDSMPVIBLQPQNJ-CYBMUJFWSA-N -1 3 364.453 3.568 20 0 FHADHM Cc1cc(C)n(-c2cccc(N[C@@H](C)c3cccc(-c4nnn[n-]4)c3)c2)n1 ZINC000826265375 609276739 /nfs/dbraw/zinc/27/67/39/609276739.db2.gz WUTUXYQMWRRDCC-HNNXBMFYSA-N -1 3 359.437 3.842 20 0 FHADHM Cc1cc(C)n(-c2cccc(N[C@@H](C)c3cccc(-c4nn[n-]n4)c3)c2)n1 ZINC000826265375 609276740 /nfs/dbraw/zinc/27/67/40/609276740.db2.gz WUTUXYQMWRRDCC-HNNXBMFYSA-N -1 3 359.437 3.842 20 0 FHADHM Cc1cc(C)n(-c2cccc(N[C@H](C)c3cccc(-c4nnn[n-]4)c3)c2)n1 ZINC000826265376 609277000 /nfs/dbraw/zinc/27/70/00/609277000.db2.gz WUTUXYQMWRRDCC-OAHLLOKOSA-N -1 3 359.437 3.842 20 0 FHADHM Cc1cc(C)n(-c2cccc(N[C@H](C)c3cccc(-c4nn[n-]n4)c3)c2)n1 ZINC000826265376 609277002 /nfs/dbraw/zinc/27/70/02/609277002.db2.gz WUTUXYQMWRRDCC-OAHLLOKOSA-N -1 3 359.437 3.842 20 0 FHADHM Cc1ccc(NC(=O)c2ccc(Cl)c(-c3nnn[n-]3)c2)c2cccnc12 ZINC000826291041 609296984 /nfs/dbraw/zinc/29/69/84/609296984.db2.gz MPVFVJFPLXZMNB-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1ccc(NC(=O)c2ccc(Cl)c(-c3nn[n-]n3)c2)c2cccnc12 ZINC000826291041 609296986 /nfs/dbraw/zinc/29/69/86/609296986.db2.gz MPVFVJFPLXZMNB-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM CC(C)[C@H](c1ccccc1)N(C)C(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000824214937 609299334 /nfs/dbraw/zinc/29/93/34/609299334.db2.gz ILILQNFVXOBEOK-QGZVFWFLSA-N -1 3 369.856 3.989 20 0 FHADHM CC(C)[C@H](c1ccccc1)N(C)C(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000824214937 609299335 /nfs/dbraw/zinc/29/93/35/609299335.db2.gz ILILQNFVXOBEOK-QGZVFWFLSA-N -1 3 369.856 3.989 20 0 FHADHM CCN(CC(C)C)C(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000825398926 609312517 /nfs/dbraw/zinc/31/25/17/609312517.db2.gz BIWIKMMLYYENRU-UHFFFAOYSA-N -1 3 365.437 3.777 20 0 FHADHM CCN(CC(C)C)C(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000825398926 609312519 /nfs/dbraw/zinc/31/25/19/609312519.db2.gz BIWIKMMLYYENRU-UHFFFAOYSA-N -1 3 365.437 3.777 20 0 FHADHM CCCN(CC)C(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000825307748 609312883 /nfs/dbraw/zinc/31/28/83/609312883.db2.gz OMMJRHHMXDXSQG-UHFFFAOYSA-N -1 3 351.410 3.531 20 0 FHADHM CCCN(CC)C(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000825307748 609312885 /nfs/dbraw/zinc/31/28/85/609312885.db2.gz OMMJRHHMXDXSQG-UHFFFAOYSA-N -1 3 351.410 3.531 20 0 FHADHM CCC(CC)[C@H]1C[C@H](Nc2nc3ccccc3cc2-c2nnn[n-]2)CCO1 ZINC000825108333 609322055 /nfs/dbraw/zinc/32/20/55/609322055.db2.gz VVWBCRVJWLJTBF-CRAIPNDOSA-N -1 3 366.469 3.811 20 0 FHADHM CCC(CC)[C@H]1C[C@H](Nc2nc3ccccc3cc2-c2nn[n-]n2)CCO1 ZINC000825108333 609322056 /nfs/dbraw/zinc/32/20/56/609322056.db2.gz VVWBCRVJWLJTBF-CRAIPNDOSA-N -1 3 366.469 3.811 20 0 FHADHM C[C@H](CSCCC(=O)Nc1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000824449880 609330313 /nfs/dbraw/zinc/33/03/13/609330313.db2.gz PWBCXPMVSUTPEF-CQSZACIVSA-N -1 3 367.478 3.732 20 0 FHADHM C[C@H](CSCCC(=O)Nc1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000824449880 609330315 /nfs/dbraw/zinc/33/03/15/609330315.db2.gz 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371.380 3.636 20 0 FHADHM CCOc1ccc(Nc2ncccc2C(=O)Nc2ncccc2[O-])cc1 ZINC000683139171 927426010 /nfs/dbraw/zinc/42/60/10/927426010.db2.gz ICJWYSFOLQEXMF-UHFFFAOYSA-N -1 3 350.378 3.577 20 0 FHADHM COc1ccc([C@@H](CC(=O)[O-])NCc2cccc(OC(F)(F)F)c2)cc1 ZINC000683171824 927740954 /nfs/dbraw/zinc/74/09/54/927740954.db2.gz QEBUGZCUKDBPOA-MRXNPFEDSA-N -1 3 369.339 3.899 20 0 FHADHM COc1ccc([C@H](CC(=O)[O-])NCc2ccc(SC)c(OC)c2)cc1 ZINC000683172058 927744333 /nfs/dbraw/zinc/74/43/33/927744333.db2.gz VABPRYAPFZECMO-INIZCTEOSA-N -1 3 361.463 3.731 20 0 FHADHM CC[C@@H](C)Oc1cc(CN[C@H](C(=O)[O-])c2ccc(F)cc2)ccc1OC ZINC000683172249 927754185 /nfs/dbraw/zinc/75/41/85/927754185.db2.gz BDVHCFKIEXDZBR-YJYMSZOUSA-N -1 3 361.413 3.927 20 0 FHADHM O=C([O-])[C@@H](CNCc1csc(-c2cccs2)n1)Cc1ccccc1 ZINC000683172495 927755703 /nfs/dbraw/zinc/75/57/03/927755703.db2.gz WQEHAKCIBGNQSO-CQSZACIVSA-N -1 3 358.488 3.905 20 0 FHADHM O=C([O-])[C@H](CNCc1csc(-c2cccs2)n1)Cc1ccccc1 ZINC000683172492 927755786 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CCN(C(=O)[C@H](C)SCc1cc(=O)[n-]c(C2CC2)n1)c1ccccc1 ZINC000419588963 942323380 /nfs/dbraw/zinc/32/33/80/942323380.db2.gz PRIGWSNPNQUIAC-ZDUSSCGKSA-N -1 3 357.479 3.734 20 0 FHADHM CCc1ccc([C@H](C)NC(=O)CSCc2cc(=O)[n-]c(C3CC3)n2)cc1 ZINC000419600228 942327936 /nfs/dbraw/zinc/32/79/36/942327936.db2.gz HHWZTGOBBZVKNT-ZDUSSCGKSA-N -1 3 371.506 3.733 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)c3cc(C(C)=O)cs3)c2)n1 ZINC000106622360 942360255 /nfs/dbraw/zinc/36/02/55/942360255.db2.gz DMWNVOQBVKIUMO-UHFFFAOYSA-N -1 3 367.430 3.516 20 0 FHADHM CC[C@H](CS(=O)(=O)[N-]c1ccc(Oc2nc(C)cs2)c(F)c1)OC ZINC000421162793 942379065 /nfs/dbraw/zinc/37/90/65/942379065.db2.gz GJJXCTKNWAVGNP-GFCCVEGCSA-N -1 3 374.459 3.550 20 0 FHADHM CO[C@@H](CC(C)C)CS(=O)(=O)[N-]c1cccc(Oc2ccccn2)c1 ZINC000421161815 942379084 /nfs/dbraw/zinc/37/90/84/942379084.db2.gz XYYJYHHHQPMKPX-KRWDZBQOSA-N -1 3 364.467 3.677 20 0 FHADHM COc1ccc(C(=O)N2CCC[C@@H](c3nc4ccc(F)cc4o3)C2)c([O-])c1 ZINC000378230258 942437835 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COc1cc(C(=O)N[C@@H]2CCCC[C@H]2Cc2ccccc2)cc(OC)c1[O-] ZINC000513960482 942625989 /nfs/dbraw/zinc/62/59/89/942625989.db2.gz IWTSQAFHKANSJC-FUHWJXTLSA-N -1 3 369.461 3.941 20 0 FHADHM CCc1ccc([C@@H](COC)[N-]S(=O)(=O)Cc2ccc3ccccc3c2)o1 ZINC000501703042 942628959 /nfs/dbraw/zinc/62/89/59/942628959.db2.gz WHWJVTHBRVAJLR-LJQANCHMSA-N -1 3 373.474 3.802 20 0 FHADHM Cc1sc2[n-]c([C@@H](C)OC(=O)CCc3cccs3)nc(=O)c2c1C ZINC000006977305 942639105 /nfs/dbraw/zinc/63/91/05/942639105.db2.gz JPXOZTIGUYOGKG-SNVBAGLBSA-N -1 3 362.476 3.900 20 0 FHADHM O=C(NCCc1ccc(C(F)(F)F)cc1)c1c[n-]c2ccccc2c1=O ZINC000042017342 942705067 /nfs/dbraw/zinc/70/50/67/942705067.db2.gz HENMPTMGJFRLOA-UHFFFAOYSA-N -1 3 360.335 3.519 20 0 FHADHM O=C1CCc2cc(-c3csc([N-]c4ncnc5ncccc45)n3)ccc2N1 ZINC000502745512 942711439 /nfs/dbraw/zinc/71/14/39/942711439.db2.gz YVCUFYXREVGSHZ-UHFFFAOYSA-N -1 3 374.429 3.777 20 0 FHADHM C[C@@H](CNCc1c(F)ccc([O-])c1F)Oc1ccccc1Br ZINC000511555667 942848220 /nfs/dbraw/zinc/84/82/20/942848220.db2.gz PMHGFGYGQHLNIN-JTQLQIEISA-N -1 3 372.209 3.990 20 0 FHADHM COc1ccc(Cl)cc1-c1cc(=NC(=O)[C@@H]2CCC[C@@H](F)C2)[nH][n-]1 ZINC000425161706 942911814 /nfs/dbraw/zinc/91/18/14/942911814.db2.gz YJSNLYVEMWLZEF-ZYHUDNBSSA-N -1 3 351.809 3.627 20 0 FHADHM COc1ccc(C(=O)Nc2ccc(-c3nc(C)cc(=O)[n-]3)cc2)cc1Cl ZINC000366595698 942915518 /nfs/dbraw/zinc/91/55/18/942915518.db2.gz HQCOZKKJNJZIHQ-UHFFFAOYSA-N -1 3 369.808 3.660 20 0 FHADHM C[C@@H](Oc1cccc(C(C)(C)C)c1)C(=O)N=c1cc(-c2ccncc2)[n-][nH]1 ZINC000503013685 942923070 /nfs/dbraw/zinc/92/30/70/942923070.db2.gz YLUZTCCUJABIFW-CQSZACIVSA-N -1 3 364.449 3.597 20 0 FHADHM Cc1ccc(Cl)c(S(=O)(=O)[N-][C@@H](C)c2nccs2)c1Cl ZINC000416575568 942978794 /nfs/dbraw/zinc/97/87/94/942978794.db2.gz CGLMVSOCQQDFSW-QMMMGPOBSA-N -1 3 351.280 3.798 20 0 FHADHM O=C(Cc1ccc(F)c(Br)c1)[N-]OCc1ccc(F)cc1 ZINC000184191876 942981400 /nfs/dbraw/zinc/98/14/00/942981400.db2.gz FFWKDAJHQLAOOF-UHFFFAOYSA-N -1 3 356.166 3.518 20 0 FHADHM CC[C@H](C[N-]S(=O)(=O)c1cc(Cl)ccc1OC)CC(F)(F)F ZINC000416586869 942991236 /nfs/dbraw/zinc/99/12/36/942991236.db2.gz DAKNIEQEFHYKDV-VIFPVBQESA-N -1 3 359.797 3.606 20 0 FHADHM CCc1ncc(Cl)c(C(=O)[N-]c2c3nsnc3ccc2Cl)n1 ZINC001126431015 943066833 /nfs/dbraw/zinc/06/68/33/943066833.db2.gz UZQCQGSAUKMHFJ-UHFFFAOYSA-N -1 3 354.222 3.603 20 0 FHADHM CCOc1ccc(N(CC2CC2)C(=O)CCc2c(C)nc(C)[n-]c2=O)cc1 ZINC000637726765 943174045 /nfs/dbraw/zinc/17/40/45/943174045.db2.gz YZVYCESAAGHECG-UHFFFAOYSA-N -1 3 369.465 3.574 20 0 FHADHM O=C(N[C@H]1CCc2c1ccc(Cl)c2Cl)c1cc(F)cc2n[n-]nc21 ZINC000503589258 943277303 /nfs/dbraw/zinc/27/73/03/943277303.db2.gz RXRZNBMFPZUFOM-LBPRGKRZSA-N -1 3 365.195 3.821 20 0 FHADHM O=C(c1ccc(Cl)cc1NCc1cc(=O)[n-]c(C2CC2)n1)N1CCCC1 ZINC000417004729 943285985 /nfs/dbraw/zinc/28/59/85/943285985.db2.gz HVSSZSJNSNYVNL-UHFFFAOYSA-N -1 3 372.856 3.561 20 0 FHADHM CC(C)n1cnc(S(=O)(=O)[N-][C@H](C)c2ccccc2C(F)(F)F)c1 ZINC000513794013 943291893 /nfs/dbraw/zinc/29/18/93/943291893.db2.gz ISEKEZXLDQNCPO-LLVKDONJSA-N -1 3 361.389 3.522 20 0 FHADHM CC(C)n1cnc(S(=O)(=O)[N-][C@@H](C)c2ccccc2C(F)(F)F)c1 ZINC000513794014 943291916 /nfs/dbraw/zinc/29/19/16/943291916.db2.gz ISEKEZXLDQNCPO-NSHDSACASA-N -1 3 361.389 3.522 20 0 FHADHM COC[C@@H](C)Oc1ccc(Cl)cc1NCc1cc(=O)[n-]c(C2CC2)n1 ZINC000417022306 943298391 /nfs/dbraw/zinc/29/83/91/943298391.db2.gz HNECSVDVXXZTME-LLVKDONJSA-N -1 3 363.845 3.739 20 0 FHADHM O=C(C[C@H]1C=CCC1)Nc1ccccc1NCc1cc(=O)[n-]c(C2CC2)n1 ZINC000417023819 943300073 /nfs/dbraw/zinc/30/00/73/943300073.db2.gz LTUQYWMCNJCZNV-AWEZNQCLSA-N -1 3 364.449 3.967 20 0 FHADHM O=C(c1cc(=O)[n-]c(C2CC2)n1)N(CCc1ccccc1F)C1CCCC1 ZINC000514869699 943349956 /nfs/dbraw/zinc/34/99/56/943349956.db2.gz ADFWENYRNNMIKT-UHFFFAOYSA-N -1 3 369.440 3.826 20 0 FHADHM O=C([O-])c1ccccc1C1CCN(Cc2cnn(-c3ccccc3)c2)CC1 ZINC000364036064 943376320 /nfs/dbraw/zinc/37/63/20/943376320.db2.gz JQRWYANVNZNRSR-UHFFFAOYSA-N -1 3 361.445 3.950 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)N3CCCc4occc4C3)cc2)cc(=O)[n-]1 ZINC000584677638 943379301 /nfs/dbraw/zinc/37/93/01/943379301.db2.gz JJWTYJLJMVTMEB-UHFFFAOYSA-N -1 3 364.405 3.731 20 0 FHADHM CCc1noc(C)c1C[N-]S(=O)(=O)c1c(Cl)ccc(C)c1Cl ZINC000549464917 943385681 /nfs/dbraw/zinc/38/56/81/943385681.db2.gz GUUYUJOUBSDDRN-UHFFFAOYSA-N -1 3 363.266 3.639 20 0 FHADHM COc1cccc2c1CCN([C@H](C(=O)[O-])c1c(F)cccc1Cl)CC2 ZINC000514945775 943396147 /nfs/dbraw/zinc/39/61/47/943396147.db2.gz XMTYALYZCBMVLT-SFHVURJKSA-N -1 3 363.816 3.714 20 0 FHADHM COC1(CC[N-]S(=O)(=O)c2ccc(Cl)cc2C(F)(F)F)CCC1 ZINC000549465732 943446087 /nfs/dbraw/zinc/44/60/87/943446087.db2.gz XYMXRKQZTQYNEL-UHFFFAOYSA-N -1 3 371.808 3.596 20 0 FHADHM O=S(=O)([N-][C@H]1C[C@H](c2cccc(F)c2)C1)c1cc(F)ccc1Cl ZINC000435587332 943505541 /nfs/dbraw/zinc/50/55/41/943505541.db2.gz GNMVCRNDLVWDGU-YEORSEQZSA-N -1 3 357.809 3.843 20 0 FHADHM O=C([N-]c1nc(-c2cccc(O)c2)cs1)c1cc(-c2ccccn2)no1 ZINC000431944297 943566632 /nfs/dbraw/zinc/56/66/32/943566632.db2.gz BIJJPTVGJWAQKH-UHFFFAOYSA-N -1 3 364.386 3.818 20 0 FHADHM COc1cc(-c2nc3cc(Br)c(F)cc3c(=O)[n-]2)ccc1C ZINC000504507270 943648031 /nfs/dbraw/zinc/64/80/31/943648031.db2.gz GWEHCKJQWDNMDU-UHFFFAOYSA-N -1 3 363.186 3.809 20 0 FHADHM Cc1nc(CCNCc2csc(Cl)c2Cl)sc1C(=O)[O-] ZINC000417542347 943681690 /nfs/dbraw/zinc/68/16/90/943681690.db2.gz DQLLZHDNHRVIDK-UHFFFAOYSA-N -1 3 351.280 3.850 20 0 FHADHM O=c1cc(CS[C@H]2C[C@H]3CCCC[C@H]3NC2=O)nc(-c2ccccc2)[n-]1 ZINC000584829830 943709655 /nfs/dbraw/zinc/70/96/55/943709655.db2.gz NJHDWHAMHHFIDB-OIISXLGYSA-N -1 3 369.490 3.530 20 0 FHADHM CC(C)[C@@H]1CC(NCc2ccc([S@@](C)=O)cc2)(C(=O)[O-])c2ccccc21 ZINC000417575963 943733896 /nfs/dbraw/zinc/73/38/96/943733896.db2.gz GWLCEYMLESRUGF-CNDUHNDJSA-N -1 3 371.502 3.637 20 0 FHADHM O=C([O-])[C@@H]1C[C@@H](NCc2ccc(Br)s2)c2ccccc21 ZINC000417619502 943755035 /nfs/dbraw/zinc/75/50/35/943755035.db2.gz KUSDKVIZHUGDJB-CHWSQXEVSA-N -1 3 352.253 3.913 20 0 FHADHM CCCOc1ccc(CN[C@@H]2C[C@H](C(=O)[O-])c3ccccc32)cc1OC ZINC000417620374 943756189 /nfs/dbraw/zinc/75/61/89/943756189.db2.gz LOUSYBCQUGFBNW-ZWKOTPCHSA-N -1 3 355.434 3.887 20 0 FHADHM O=C([O-])C[C@H](CNCc1cc(Br)ccc1Cl)C(F)(F)F ZINC000417624030 943758779 /nfs/dbraw/zinc/75/87/79/943758779.db2.gz KEZNZTDAOYJOND-MRVPVSSYSA-N -1 3 374.584 3.845 20 0 FHADHM COc1cc(CN[C@H]2C[C@@H](C(=O)[O-])c3ccccc32)ccc1OC(F)F ZINC000417612502 943761913 /nfs/dbraw/zinc/76/19/13/943761913.db2.gz BUZCXMZIUXLALQ-CABCVRRESA-N -1 3 363.360 3.699 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)NC[C@@H]3CCC[C@H]4C[C@H]43)cc2)cc(=O)[n-]1 ZINC000664378627 943763536 /nfs/dbraw/zinc/76/35/36/943763536.db2.gz NHQKLJLMDYWRPT-YQQAZPJKSA-N -1 3 352.438 3.715 20 0 FHADHM CC(C)=CCSC[C@H](NCc1cc(Cl)cc2c1OCC2)C(=O)[O-] ZINC000417631527 943768701 /nfs/dbraw/zinc/76/87/01/943768701.db2.gz VVECNVPOGQNNBE-HNNXBMFYSA-N -1 3 355.887 3.517 20 0 FHADHM O=C([O-])C[C@H](CNCc1cc(Br)ccc1Cl)C(F)F ZINC000417624975 943774867 /nfs/dbraw/zinc/77/48/67/943774867.db2.gz PAIRHHQZNGXJDR-MRVPVSSYSA-N -1 3 356.594 3.548 20 0 FHADHM CCc1nc(CN[C@@H](Cc2ccc(Cl)c(Cl)c2)C(=O)[O-])cs1 ZINC000417625975 943775564 /nfs/dbraw/zinc/77/55/64/943775564.db2.gz SCJTWALIDRPBGZ-ZDUSSCGKSA-N -1 3 359.278 3.798 20 0 FHADHM CC(C)(C)c1nn(-c2ccccc2Cl)cc1CN[C@@H]1C=C[C@@H](C(=O)[O-])C1 ZINC000417626546 943776589 /nfs/dbraw/zinc/77/65/89/943776589.db2.gz TWOVUTPOXWLUNS-UKRRQHHQSA-N -1 3 373.884 3.942 20 0 FHADHM Cc1ccc(-n2cc(CN[C@H]3C=C[C@@H](C(=O)[O-])C3)c(C(C)(C)C)n2)cc1 ZINC000417628775 943778567 /nfs/dbraw/zinc/77/85/67/943778567.db2.gz WQMFXAVAIHBCBB-WBVHZDCISA-N -1 3 353.466 3.597 20 0 FHADHM Cc1ncccc1CN[C@@H](c1ccc(Br)cc1)[C@H](C)C(=O)[O-] ZINC000417639139 943788924 /nfs/dbraw/zinc/78/89/24/943788924.db2.gz LHUKWADTDSZXAP-MEDUHNTESA-N -1 3 363.255 3.704 20 0 FHADHM CO[C@H](CNCc1ccc(-c2cccc(C(F)(F)F)c2)o1)CC(=O)[O-] ZINC000417640507 943790012 /nfs/dbraw/zinc/79/00/12/943790012.db2.gz YNSGKDPDEFYDNX-AWEZNQCLSA-N -1 3 357.328 3.545 20 0 FHADHM Cc1ncsc1CN[C@@H](c1ccc(Br)cc1)[C@@H](C)C(=O)[O-] ZINC000417641177 943791099 /nfs/dbraw/zinc/79/10/99/943791099.db2.gz OSMORISDVJJECQ-YMTOWFKASA-N -1 3 369.284 3.766 20 0 FHADHM CC(C)Cc1ccc([C@H](C)NC(=O)CN2CCCC[C@H]2CCC(=O)[O-])cc1 ZINC000424257523 943809356 /nfs/dbraw/zinc/80/93/56/943809356.db2.gz KNFOAQYMMNRCQM-PXNSSMCTSA-N -1 3 374.525 3.782 20 0 FHADHM COc1ccc([O-])c(-c2nc(C3(c4ccccc4)CCOCC3)no2)c1 ZINC000515359893 943824373 /nfs/dbraw/zinc/82/43/73/943824373.db2.gz LTUHVAXVLGVFRA-UHFFFAOYSA-N -1 3 352.390 3.547 20 0 FHADHM CSc1cc(Br)ccc1CN1CCC[C@@H](C)[C@@H]1C(=O)[O-] ZINC000424423650 943899645 /nfs/dbraw/zinc/89/96/45/943899645.db2.gz VFJIWFIGSUUONE-QMTHXVAHSA-N -1 3 358.301 3.856 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)N3CCC[C@H](CCF)C3)cc2)cc(=O)[n-]1 ZINC000664387476 943917190 /nfs/dbraw/zinc/91/71/90/943917190.db2.gz VTVIXVXHVIANPS-CQSZACIVSA-N -1 3 358.417 3.761 20 0 FHADHM COC[C@@H](C)Nc1ccccc1NC(=O)CCCc1ccc([O-])c(F)c1 ZINC000437599785 943941060 /nfs/dbraw/zinc/94/10/60/943941060.db2.gz IITPNZBXOOFRKR-CQSZACIVSA-N -1 3 360.429 3.940 20 0 FHADHM C[C@H]1CCC[C@H]1[N-]S(=O)(=O)c1cc(Br)ccc1Cl ZINC000517084329 943979036 /nfs/dbraw/zinc/97/90/36/943979036.db2.gz LPRLTVSMVCJXML-GZMMTYOYSA-N -1 3 352.681 3.569 20 0 FHADHM Cc1cc(F)c(CNC[C@H](Cc2cc(F)c(F)c(F)c2)C(=O)[O-])c(F)c1 ZINC000424631086 944020945 /nfs/dbraw/zinc/02/09/45/944020945.db2.gz ZRYLACRJEXWYJF-NSHDSACASA-N -1 3 373.321 3.724 20 0 FHADHM CN(CCc1cccc2ccccc21)C(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000505118667 944048277 /nfs/dbraw/zinc/04/82/77/944048277.db2.gz WSGCUDIWAHWJCO-UHFFFAOYSA-N -1 3 356.425 3.996 20 0 FHADHM Cc1cc(NC(=O)c2cc(F)cc3n[n-]nc32)ccc1Oc1ccncc1 ZINC000505131323 944062044 /nfs/dbraw/zinc/06/20/44/944062044.db2.gz VQTPDDVXROUQMZ-UHFFFAOYSA-N -1 3 363.352 3.845 20 0 FHADHM Cc1cc(F)c(Br)cc1NC(=O)c1cc(F)cc2n[n-]nc21 ZINC000505133923 944062750 /nfs/dbraw/zinc/06/27/50/944062750.db2.gz LCFRVKHBGNPXSB-UHFFFAOYSA-N -1 3 367.153 3.559 20 0 FHADHM CC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccc(OC3COC3)cc2)cc1 ZINC000436159125 944063922 /nfs/dbraw/zinc/06/39/22/944063922.db2.gz YGHOLLJGNZKBQJ-UHFFFAOYSA-N -1 3 361.463 3.563 20 0 FHADHM CCCCOc1ccc(C(=O)N2CCC(n3ccc(C)n3)CC2)c([O-])c1 ZINC000364225149 944103763 /nfs/dbraw/zinc/10/37/63/944103763.db2.gz WLMRENHXMQUAOG-UHFFFAOYSA-N -1 3 357.454 3.553 20 0 FHADHM C[C@@]1(NC(=O)c2cc(F)c([O-])c(Cl)c2)CCN(Cc2ccccc2)C1 ZINC000515663469 944107093 /nfs/dbraw/zinc/10/70/93/944107093.db2.gz DALSTDLUTUAORZ-LJQANCHMSA-N -1 3 362.832 3.579 20 0 FHADHM O=C(Nc1cc(Br)ccc1[O-])c1cncc(C(F)(F)F)c1 ZINC000517227874 944124606 /nfs/dbraw/zinc/12/46/06/944124606.db2.gz BHUMKYJJUUWOOH-UHFFFAOYSA-N -1 3 361.117 3.821 20 0 FHADHM COC1(C(F)(F)F)CCN(Cc2cccc([O-])c2Br)CC1 ZINC000418105390 944161176 /nfs/dbraw/zinc/16/11/76/944161176.db2.gz ZMPKSDKCKMBVDR-UHFFFAOYSA-N -1 3 368.193 3.698 20 0 FHADHM O=S(=O)([N-]c1ccc(N2CCCC2)cc1)c1ccc(F)c(Cl)c1 ZINC000007051695 944162927 /nfs/dbraw/zinc/16/29/27/944162927.db2.gz MZJPDZFUZIKCFB-UHFFFAOYSA-N -1 3 354.834 3.880 20 0 FHADHM CCC1([N-]S(=O)(=O)c2cc(C)c(Br)s2)CCCC1 ZINC000382585134 944296150 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Cc1ccc(C(=O)N[C@H](C)c2nc(-c3ccc(F)c(C)c3)no2)c([O-])c1 ZINC000436580248 944445533 /nfs/dbraw/zinc/44/55/33/944445533.db2.gz BLSCSCGIYJZQKS-GFCCVEGCSA-N -1 3 355.369 3.689 20 0 FHADHM COC(=O)CN(C(=O)c1cc(Oc2ccccc2)ccc1[O-])C1CCCC1 ZINC000436581968 944446021 /nfs/dbraw/zinc/44/60/21/944446021.db2.gz KIZKXZRTQITNCN-UHFFFAOYSA-N -1 3 369.417 3.742 20 0 FHADHM CC(C)(O)COc1ccc(NC(=O)c2ccc3c(c2[O-])OC(C)(C)C3)cc1 ZINC000436583658 944446908 /nfs/dbraw/zinc/44/69/08/944446908.db2.gz HXYRLWOMCOMYPI-UHFFFAOYSA-N -1 3 371.433 3.508 20 0 FHADHM CCOCCOCc1cccc(NC(=O)c2cc(OC)ccc2[O-])c1C ZINC000436585018 944446937 /nfs/dbraw/zinc/44/69/37/944446937.db2.gz KYKNEUALIBLKAZ-UHFFFAOYSA-N -1 3 359.422 3.515 20 0 FHADHM COc1cc(-c2nc(-c3ccc(N4CCCC4)cc3)no2)cc(OC)c1[O-] ZINC000436585960 944448126 /nfs/dbraw/zinc/44/81/26/944448126.db2.gz UJNFEGXTAXCIRI-UHFFFAOYSA-N -1 3 367.405 3.727 20 0 FHADHM CC(C)c1ccc(C(=O)N(CCc2ccccc2)[C@@H]2CCOC2)c([O-])c1 ZINC000436586678 944448781 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FHADHM CC(C)c1ccc(C(=O)N2CC[C@H](C(=O)N(C)c3ccccc3)C2)c([O-])c1 ZINC000436624726 944465953 /nfs/dbraw/zinc/46/59/53/944465953.db2.gz CBDIPTKFZJVXJR-KRWDZBQOSA-N -1 3 366.461 3.641 20 0 FHADHM O=c1[n-]c(CN[C@H]2CCCc3c(O)cccc32)nc2c3ccccc3oc21 ZINC000436628925 944469554 /nfs/dbraw/zinc/46/95/54/944469554.db2.gz SPUHNOAVRVUOOU-HNNXBMFYSA-N -1 3 361.401 3.954 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(NC(=O)CC(F)(F)F)cc2)c([O-])c1 ZINC000436630899 944470968 /nfs/dbraw/zinc/47/09/68/944470968.db2.gz POQRFWUYEHSOKD-UHFFFAOYSA-N -1 3 352.312 3.844 20 0 FHADHM CCOC(=O)c1ccc(NC(=O)c2cc(C(C)C)c(O)cc2C)c([O-])c1 ZINC000436632344 944473144 /nfs/dbraw/zinc/47/31/44/944473144.db2.gz WOGNIMBBCSEDDF-UHFFFAOYSA-N -1 3 357.406 3.959 20 0 FHADHM CC(C)(C)[C@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)c2ccccc2[O-])CC1 ZINC000436623574 944479768 /nfs/dbraw/zinc/47/97/68/944479768.db2.gz HAUPFBVHFUYPSE-WMZOPIPTSA-N -1 3 372.509 3.672 20 0 FHADHM CC(C)c1ccc(C(=O)N2CCC[C@@](CO)(c3ccccc3)C2)c([O-])c1 ZINC000436654061 944483686 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O=C(NCc1cnc(-c2ccc(Cl)cc2)s1)c1c([O-])cccc1O ZINC000436663096 944513276 /nfs/dbraw/zinc/51/32/76/944513276.db2.gz KNSDQGKVBCKDFD-UHFFFAOYSA-N -1 3 360.822 3.805 20 0 FHADHM CCc1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2ccccc2[O-])cc1Cl ZINC000436676646 944514287 /nfs/dbraw/zinc/51/42/87/944514287.db2.gz RKHCHMFFUXSQJR-KRWDZBQOSA-N -1 3 372.852 3.851 20 0 FHADHM COc1cccc(C(=O)Nc2ccc(OCc3ccncc3)cc2)c1[O-] ZINC000436676546 944515003 /nfs/dbraw/zinc/51/50/03/944515003.db2.gz QSPXQBRPVDZHEW-UHFFFAOYSA-N -1 3 350.374 3.627 20 0 FHADHM CC1(C)Cc2ccc(C(=O)Nc3nnc(-c4ccsc4)s3)c([O-])c2O1 ZINC000436682901 944521505 /nfs/dbraw/zinc/52/15/05/944521505.db2.gz RQCPRVMUOUVOOW-UHFFFAOYSA-N -1 3 373.459 3.938 20 0 FHADHM COC(=O)c1cccc2[n-]c(NC(=O)C3(c4cccc(F)c4)CCC3)nc21 ZINC000438344626 944524843 /nfs/dbraw/zinc/52/48/43/944524843.db2.gz IZNQYOQXDIHBJR-UHFFFAOYSA-N -1 3 367.380 3.549 20 0 FHADHM COc1cc(-c2nc(-c3cccc(C(F)(F)F)n3)no2)cc(OC)c1[O-] ZINC000436691902 944530169 /nfs/dbraw/zinc/53/01/69/944530169.db2.gz 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ZINC000436734492 944564819 /nfs/dbraw/zinc/56/48/19/944564819.db2.gz AVVXDSPTWHKNFY-UHFFFAOYSA-N -1 3 366.211 3.733 20 0 FHADHM CN(C)Cc1cc(CNC(=O)c2cc3ccccc3cc2[O-])ccc1F ZINC000436742505 944571471 /nfs/dbraw/zinc/57/14/71/944571471.db2.gz FGLFPMCNBRDFHB-UHFFFAOYSA-N -1 3 352.409 3.676 20 0 FHADHM O=C(c1ccc(O)cc1[O-])N(Cc1ccc2c(c1)OCO2)C1CCCCC1 ZINC000436730566 944576915 /nfs/dbraw/zinc/57/69/15/944576915.db2.gz XHRRVPMHEKWAHN-UHFFFAOYSA-N -1 3 369.417 3.802 20 0 FHADHM O=C(NC[C@@H](c1ccco1)N1CCCC1)c1ccc2ccccc2c1[O-] ZINC000436757982 944580222 /nfs/dbraw/zinc/58/02/22/944580222.db2.gz WYIGQFOIWLMYKS-SFHVURJKSA-N -1 3 350.418 3.705 20 0 FHADHM COc1ccc(NC(=O)c2cccc(C)c2[O-])cc1OCC(F)(F)F ZINC000436759439 944582263 /nfs/dbraw/zinc/58/22/63/944582263.db2.gz BIJMIZAAMDCBHU-UHFFFAOYSA-N -1 3 355.312 3.903 20 0 FHADHM CC(C)c1ccc(C(=O)N[C@H](c2nccn2C)c2ccccc2F)c([O-])c1 ZINC000436752334 944593094 /nfs/dbraw/zinc/59/30/94/944593094.db2.gz AUYMWWHDAIBVIN-IBGZPJMESA-N -1 3 367.424 3.908 20 0 FHADHM CCN(C(=O)c1cc(OC)ccc1[O-])c1cccc(Br)c1 ZINC000436752674 944594313 /nfs/dbraw/zinc/59/43/13/944594313.db2.gz AGDVTYRIGZSZBK-UHFFFAOYSA-N -1 3 350.212 3.830 20 0 FHADHM CCc1ccc([O-])c(C(=O)N2CCN(c3nccc4sccc43)CC2)c1 ZINC000517788912 944613118 /nfs/dbraw/zinc/61/31/18/944613118.db2.gz CBQJMGHKUHVVIK-UHFFFAOYSA-N -1 3 367.474 3.527 20 0 FHADHM COc1ccc(Cl)c(S(=O)(=O)[N-]c2ccc(F)cc2Cl)c1 ZINC000112266077 944617616 /nfs/dbraw/zinc/61/76/16/944617616.db2.gz OWHXRIGANCQXQJ-UHFFFAOYSA-N -1 3 350.198 3.942 20 0 FHADHM CCN(CCNC(=O)c1ccc2ccccc2c1[O-])CCC(F)(F)F ZINC000436799884 944623688 /nfs/dbraw/zinc/62/36/88/944623688.db2.gz QZWXUOAEMMTJDN-UHFFFAOYSA-N -1 3 354.372 3.550 20 0 FHADHM Cc1ccc(C(=O)N2CCC[C@H]2c2ccc(Br)cn2)c([O-])c1 ZINC000436783108 944626109 /nfs/dbraw/zinc/62/61/09/944626109.db2.gz QLMCUGAVCQZGOH-HNNXBMFYSA-N -1 3 361.239 3.835 20 0 FHADHM CCc1oc2ccccc2c1CN(C)C(=O)c1cc(NC(C)=O)ccc1[O-] ZINC000436781735 944626089 /nfs/dbraw/zinc/62/60/89/944626089.db2.gz FREQZSSGVIRDNL-UHFFFAOYSA-N -1 3 366.417 3.931 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(-c2nnn[n-]2)cc1)c1c(Cl)cccc1Cl ZINC000591175364 944636336 /nfs/dbraw/zinc/63/63/36/944636336.db2.gz TVMVJACSCDDEDP-SECBINFHSA-N -1 3 362.220 3.916 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(-c2nn[n-]n2)cc1)c1c(Cl)cccc1Cl ZINC000591175364 944636343 /nfs/dbraw/zinc/63/63/43/944636343.db2.gz TVMVJACSCDDEDP-SECBINFHSA-N -1 3 362.220 3.916 20 0 FHADHM CC1(C)CC[C@@H]1NC(=O)C[C@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436793502 944645947 /nfs/dbraw/zinc/64/59/47/944645947.db2.gz RWXGWNDSUVOTQG-OALUTQOASA-N -1 3 366.461 3.558 20 0 FHADHM O=C(NC[C@H](c1cccs1)N1CCCC1)c1ccc(Cl)cc1[O-] ZINC000436818207 944653875 /nfs/dbraw/zinc/65/38/75/944653875.db2.gz JNOWAKDRDFKQRE-CQSZACIVSA-N -1 3 350.871 3.674 20 0 FHADHM COc1ccc(-c2csc(NC(=O)c3cccc(OC)c3[O-])n2)cc1 ZINC000436808862 944665202 /nfs/dbraw/zinc/66/52/02/944665202.db2.gz MFEPLQZIRBMYAT-UHFFFAOYSA-N -1 3 356.403 3.785 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@H]3CCCC[C@H]3OC)c2)n1 ZINC000293065455 944666045 /nfs/dbraw/zinc/66/60/45/944666045.db2.gz LITVQDXTZGHSAF-DLBZAZTESA-N -1 3 355.438 3.555 20 0 FHADHM CC(C)c1ccc(C(=O)N[C@@H](c2ccn(C)n2)c2ccc(F)cc2)c([O-])c1 ZINC000436811830 944668681 /nfs/dbraw/zinc/66/86/81/944668681.db2.gz KNODLDMWVFONJK-HXUWFJFHSA-N -1 3 367.424 3.908 20 0 FHADHM CCC1(CC)CCCN(C(=O)[C@@H]2CCCN2C(=O)c2ccccc2[O-])CC1 ZINC000436830287 944676144 /nfs/dbraw/zinc/67/61/44/944676144.db2.gz UYYHJAVIJHLUCL-SFHVURJKSA-N -1 3 372.509 3.816 20 0 FHADHM O=C([O-])C[C@@H](NCc1ccc(OC[C@@H]2CCCO2)cc1)c1ccsc1 ZINC000426682854 944679616 /nfs/dbraw/zinc/67/96/16/944679616.db2.gz MHZWKNXRTLQGLC-ZWKOTPCHSA-N -1 3 361.463 3.612 20 0 FHADHM CC[C@@H](C(=O)N=c1cc([C@H]2CCCO2)[n-][nH]1)c1cccc(C(F)(F)F)c1 ZINC000473848728 944680913 /nfs/dbraw/zinc/68/09/13/944680913.db2.gz SXBPAOQDPCBRNE-UKRRQHHQSA-N -1 3 367.371 3.834 20 0 FHADHM O=C(N=c1cc([C@H]2CCCO2)[n-][nH]1)c1occc1CSc1ccccc1 ZINC000473848842 944682222 /nfs/dbraw/zinc/68/22/22/944682222.db2.gz JHLGRLUTFVRYQF-MRXNPFEDSA-N -1 3 369.446 3.821 20 0 FHADHM O=C([O-])[C@H](CCCNCc1ccn(-c2ccccc2)n1)Cc1ccccc1 ZINC000426675830 944688872 /nfs/dbraw/zinc/68/88/72/944688872.db2.gz WLXFTSWONBHXTK-LJQANCHMSA-N -1 3 363.461 3.686 20 0 FHADHM O=C([O-])COc1ccc(CCNCc2nc(-c3ccccc3)cs2)cc1 ZINC000426679893 944693662 /nfs/dbraw/zinc/69/36/62/944693662.db2.gz JYIIXVQUDLYJQF-UHFFFAOYSA-N -1 3 368.458 3.606 20 0 FHADHM Cc1ccc(C(=O)N2CCO[C@H](c3ccc(OC(F)F)cc3)C2)c([O-])c1 ZINC000436839842 944704971 /nfs/dbraw/zinc/70/49/71/944704971.db2.gz QMPNWDRMAICQON-KRWDZBQOSA-N -1 3 363.360 3.516 20 0 FHADHM [O-]c1cc2ccccc2cc1-c1nc(-c2cn(Cc3ccccc3)nn2)no1 ZINC000436838535 944705294 /nfs/dbraw/zinc/70/52/94/944705294.db2.gz JGRHLCQRCITBIC-UHFFFAOYSA-N -1 3 369.384 3.902 20 0 FHADHM COc1ccc(CN[C@H](C)CCC[C@H](C)C(=O)[O-])c(Br)c1O ZINC000426703745 944705669 /nfs/dbraw/zinc/70/56/69/944705669.db2.gz NIEASUGWKSLIMZ-WDEREUQCSA-N -1 3 374.275 3.532 20 0 FHADHM COCCOc1c(Cl)cc(NC(=O)c2c([O-])cccc2O)cc1Cl ZINC000436841139 944706157 /nfs/dbraw/zinc/70/61/57/944706157.db2.gz VAKQFGPBANPDOP-UHFFFAOYSA-N -1 3 372.204 3.682 20 0 FHADHM CO[C@@H]1CN(C(=O)c2cc(CCc3ccccc3)ccc2[O-])CC[C@@H]1C ZINC000436842466 944710021 /nfs/dbraw/zinc/71/00/21/944710021.db2.gz WPKOMOGRJBYNCM-HRAATJIYSA-N -1 3 353.462 3.674 20 0 FHADHM COc1ccc(Br)c(CN(C)C(=O)c2ccc(C)cc2[O-])c1 ZINC000436843492 944710182 /nfs/dbraw/zinc/71/01/82/944710182.db2.gz HUGJTCGFKOAILM-UHFFFAOYSA-N -1 3 364.239 3.744 20 0 FHADHM O=C([O-])Cc1ccccc1CNCc1ccc(OC(F)F)c(Cl)c1 ZINC000426691639 944710945 /nfs/dbraw/zinc/71/09/45/944710945.db2.gz JTJXMHWWJRJUOR-UHFFFAOYSA-N -1 3 355.768 3.858 20 0 FHADHM Cn1nccc1C1=CCN(C(=O)c2cc(Cc3ccccc3)ccc2[O-])CC1 ZINC000436847137 944713468 /nfs/dbraw/zinc/71/34/68/944713468.db2.gz ZIKRNTMSJRRCIO-UHFFFAOYSA-N -1 3 373.456 3.646 20 0 FHADHM C[C@@H](C(=O)[O-])[C@H](NCc1cnn(Cc2ccc(F)cc2)c1)c1ccccc1 ZINC000426714698 944714945 /nfs/dbraw/zinc/71/49/45/944714945.db2.gz DVUWVIGTAVFKTN-QRWLVFNGSA-N -1 3 367.424 3.622 20 0 FHADHM Cc1ccc(C(=O)NC[C@H](NCc2ccccc2)c2ccco2)c([O-])c1 ZINC000436853201 944721922 /nfs/dbraw/zinc/72/19/22/944721922.db2.gz BZYWYIVTIRIDQR-SFHVURJKSA-N -1 3 350.418 3.555 20 0 FHADHM COc1cc2c(c(CN[C@H](c3ccccc3)[C@H](C)C(=O)[O-])c1)O[C@@H](C)C2 ZINC000426724784 944726519 /nfs/dbraw/zinc/72/65/19/944726519.db2.gz VQKDOTICTFTBBO-NJSLBKSFSA-N -1 3 355.434 3.570 20 0 FHADHM COc1cc(CN[C@H](C(=O)[O-])c2ccc(C)cc2)c(SC)cc1OC ZINC000426710054 944732360 /nfs/dbraw/zinc/73/23/60/944732360.db2.gz HFPYDDQUSFLHRD-SFHVURJKSA-N -1 3 361.463 3.650 20 0 FHADHM O=C([O-])[C@H](NCc1cccc(OC(F)F)c1)c1ccc(Cl)c(F)c1 ZINC000426729448 944738192 /nfs/dbraw/zinc/73/81/92/944738192.db2.gz CWVZWKCBRVTKOD-CQSZACIVSA-N -1 3 359.731 3.996 20 0 FHADHM C[C@@H](CN(C)C(=O)c1c([O-])cccc1O)Oc1ccc(Cl)c(Cl)c1 ZINC000436857816 944745446 /nfs/dbraw/zinc/74/54/46/944745446.db2.gz YHLVREIDXUEXHQ-JTQLQIEISA-N -1 3 370.232 3.944 20 0 FHADHM C[C@H](CC(=O)N=c1cc([C@H]2CCCO2)[n-][nH]1)c1ccccc1C(F)(F)F ZINC000473849973 944749986 /nfs/dbraw/zinc/74/99/86/944749986.db2.gz MFHDXMUVTIMCSL-IAQYHMDHSA-N -1 3 367.371 3.834 20 0 FHADHM Cc1ccc(OCc2nc(CN[C@@H]3CCC[C@@]3(C)C(=O)[O-])cs2)cc1 ZINC000426744441 944758484 /nfs/dbraw/zinc/75/84/84/944758484.db2.gz QXMGGYHTCDUEQS-VQIMIIECSA-N -1 3 360.479 3.764 20 0 FHADHM Cc1cccc([C@H](NCc2cnn(-c3ccc(F)cc3)c2)C(=O)[O-])c1C ZINC000426745794 944759771 /nfs/dbraw/zinc/75/97/71/944759771.db2.gz WAQZFHFGJDBUHY-IBGZPJMESA-N -1 3 353.397 3.544 20 0 FHADHM Cc1c([O-])ccc2c(CN3CCO[C@H](c4ccccc4F)C3)cc(=O)oc12 ZINC000066846929 944762124 /nfs/dbraw/zinc/76/21/24/944762124.db2.gz IYJKGZGRTNQWEM-IBGZPJMESA-N -1 3 369.392 3.520 20 0 FHADHM COc1cccc([C@H](CC(=O)[O-])NCc2cccc3cccnc32)c1OC ZINC000426766141 944764964 /nfs/dbraw/zinc/76/49/64/944764964.db2.gz XELIHYJUNNFXMI-KRWDZBQOSA-N -1 3 366.417 3.558 20 0 FHADHM COC(=O)c1cccc(OCc2noc(-c3ccc(C(C)C)cc3[O-])n2)c1 ZINC000436889672 944765096 /nfs/dbraw/zinc/76/50/96/944765096.db2.gz WYAUKEZESDMFLT-UHFFFAOYSA-N -1 3 368.389 3.931 20 0 FHADHM CC[C@@H](CSc1ccccc1)NC(=O)c1cc(OC)c([O-])c(OC)c1 ZINC000436893061 944768681 /nfs/dbraw/zinc/76/86/81/944768681.db2.gz MGUZVNGOVNIYAP-AWEZNQCLSA-N -1 3 361.463 3.710 20 0 FHADHM CC1(C)[C@H](NC(=O)c2cc(Cc3ccccc3)ccc2[O-])[C@@H]2CCO[C@H]21 ZINC000436903877 944771063 /nfs/dbraw/zinc/77/10/63/944771063.db2.gz XKQJMPURFPXLPK-PWIZWCRZSA-N -1 3 351.446 3.526 20 0 FHADHM COc1ccc([C@@H](CCC(=O)[O-])NCc2cc3ccccc3[nH]c2=O)cc1 ZINC000426753586 944773876 /nfs/dbraw/zinc/77/38/76/944773876.db2.gz JKCGCEVISVTINY-GOSISDBHSA-N -1 3 366.417 3.645 20 0 FHADHM COc1ccccc1N1CC[C@@H](CNC(=O)c2ccc(C(C)C)cc2[O-])C1 ZINC000436904571 944774210 /nfs/dbraw/zinc/77/42/10/944774210.db2.gz LWKXMOAREZCBKM-INIZCTEOSA-N -1 3 368.477 3.781 20 0 FHADHM C[C@@H]1CCC[C@@H](C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCCC3)C1 ZINC000736243911 944776435 /nfs/dbraw/zinc/77/64/35/944776435.db2.gz AUUFNCNMMZLMOR-VXGBXAGGSA-N -1 3 359.499 3.962 20 0 FHADHM C[C@@H]1CCC[C@@H](C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCCC3)C1 ZINC000736243911 944776442 /nfs/dbraw/zinc/77/64/42/944776442.db2.gz AUUFNCNMMZLMOR-VXGBXAGGSA-N -1 3 359.499 3.962 20 0 FHADHM O=C([O-])C[C@@H](NC/C=C\c1ccc(F)cc1)c1cnn(-c2ccccc2)c1 ZINC000426758479 944780645 /nfs/dbraw/zinc/78/06/45/944780645.db2.gz IGFPXBBGLHSHLA-BBIZLLLXSA-N -1 3 365.408 3.830 20 0 FHADHM COc1ccc([C@@H](CC(=O)[O-])NCc2cc3c(cccc3F)[nH]2)cc1OC ZINC000426773045 944789648 /nfs/dbraw/zinc/78/96/48/944789648.db2.gz HXUXMSSKUCMOMK-QGZVFWFLSA-N -1 3 372.396 3.630 20 0 FHADHM CC1(C)[C@H](NC(=O)c2cc(CCc3ccccc3)ccc2[O-])[C@H]2CCO[C@H]21 ZINC000436902123 944791808 /nfs/dbraw/zinc/79/18/08/944791808.db2.gz SQAJQAZRMRNIHM-DUXKGJEZSA-N -1 3 365.473 3.721 20 0 FHADHM COc1ccc(Oc2ccc(NC(=O)c3cccc(OC)c3[O-])cn2)cc1 ZINC000436929501 944792341 /nfs/dbraw/zinc/79/23/41/944792341.db2.gz FDFQFCHTZRJSOK-UHFFFAOYSA-N -1 3 366.373 3.849 20 0 FHADHM O=C([O-])[C@@H](Cc1ccccc1)NCc1csc(-c2ccc(F)cc2)n1 ZINC000426767380 944805213 /nfs/dbraw/zinc/80/52/13/944805213.db2.gz MJZOJXAYYFKGCS-QGZVFWFLSA-N -1 3 356.422 3.735 20 0 FHADHM COc1ccc(Cc2noc(-c3ccc(C)cc3[O-])n2)cc1OC(F)F ZINC000436920413 944805740 /nfs/dbraw/zinc/80/57/40/944805740.db2.gz PCWJZFPWZUNUFL-UHFFFAOYSA-N -1 3 362.332 3.951 20 0 FHADHM COc1ccc([C@H](NCc2cccc(Br)c2)C(=O)[O-])cc1F ZINC000426803732 944825717 /nfs/dbraw/zinc/82/57/17/944825717.db2.gz OXYIEYBTCBCSOV-HNNXBMFYSA-N -1 3 368.202 3.512 20 0 FHADHM O=C(Nc1ccc(NC(=O)c2ccc3c(c2[O-])CCCC3)cc1)NC1CC1 ZINC000436950824 944832236 /nfs/dbraw/zinc/83/22/36/944832236.db2.gz WBSCQCXMHBBVRO-UHFFFAOYSA-N -1 3 365.433 3.807 20 0 FHADHM O=C(c1c[n-]c2c(F)cc(F)cc2c1=O)N(CCC(F)(F)F)CC1CC1 ZINC000500415322 944833053 /nfs/dbraw/zinc/83/30/53/944833053.db2.gz PPTYZVMBOVVRSM-UHFFFAOYSA-N -1 3 374.309 3.611 20 0 FHADHM Cc1nnc([C@@H](C)NC(=O)c2cc(CCc3ccccc3)ccc2[O-])s1 ZINC000436962151 944838160 /nfs/dbraw/zinc/83/81/60/944838160.db2.gz WLAHKTAMPFTOBO-CYBMUJFWSA-N -1 3 367.474 3.828 20 0 FHADHM Cc1cccc(CN(CCN(C)C)C(=O)c2cc(F)c([O-])c(Cl)c2)c1 ZINC000436966022 944842654 /nfs/dbraw/zinc/84/26/54/944842654.db2.gz UDBITSNPPSTSCX-UHFFFAOYSA-N -1 3 364.848 3.697 20 0 FHADHM Cc1ccc(CN(C(=O)CCNC(=O)c2ccc(C)cc2[O-])C(C)C)s1 ZINC000436952004 944846942 /nfs/dbraw/zinc/84/69/42/944846942.db2.gz UGDLVXJTMMQZCN-UHFFFAOYSA-N -1 3 374.506 3.628 20 0 FHADHM COc1cccc(-c2nc(-c3cnc(Oc4ccccc4)cn3)no2)c1[O-] ZINC000436954139 944849429 /nfs/dbraw/zinc/84/94/29/944849429.db2.gz UMPHKROXFWEIQJ-UHFFFAOYSA-N -1 3 362.345 3.700 20 0 FHADHM Cc1oncc1C(=O)Nc1ccc([O-])c(C(=O)N2CCC[C@@H]2CC(C)C)c1 ZINC000436958141 944852824 /nfs/dbraw/zinc/85/28/24/944852824.db2.gz ZQHQLPPRAFOUHQ-OAHLLOKOSA-N -1 3 371.437 3.592 20 0 FHADHM CCNC(=O)c1ccc(C)c(NC(=O)c2ccc3c(c2[O-])CCCC3)c1 ZINC000436956631 944852945 /nfs/dbraw/zinc/85/29/45/944852945.db2.gz OCDXMGCEDFPTIO-UHFFFAOYSA-N -1 3 352.434 3.581 20 0 FHADHM CCc1ccc([C@H](NCc2cc3c(cc2SC)OCCO3)C(=O)[O-])cc1 ZINC000426835126 944872017 /nfs/dbraw/zinc/87/20/17/944872017.db2.gz PZIOYJWRURPOEB-IBGZPJMESA-N -1 3 373.474 3.658 20 0 FHADHM O=S(=O)([N-][C@H]1CCc2ccccc21)c1csc(-c2ccccc2)n1 ZINC000500425779 944874377 /nfs/dbraw/zinc/87/43/77/944874377.db2.gz FHJPGUCJAQHJNI-INIZCTEOSA-N -1 3 356.472 3.776 20 0 FHADHM CCCc1c(NC(=O)c2cccc(C)c2[O-])cnn1-c1cc(C)ccn1 ZINC000436987151 944878478 /nfs/dbraw/zinc/87/84/78/944878478.db2.gz SSIFQPZZMVYYCB-UHFFFAOYSA-N -1 3 350.422 3.795 20 0 FHADHM CCCCOc1ccc(C(=O)N2CCCN(c3ccccc3)CC2)c([O-])c1 ZINC000436987903 944881135 /nfs/dbraw/zinc/88/11/35/944881135.db2.gz KOWOGNKDVAQIKT-UHFFFAOYSA-N -1 3 368.477 3.924 20 0 FHADHM Cc1cnc(Br)c([N-]S(=O)(=O)c2ccc(Cl)cc2)c1 ZINC000311444231 944882672 /nfs/dbraw/zinc/88/26/72/944882672.db2.gz HJYBIVAPSOHNGZ-UHFFFAOYSA-N -1 3 361.648 3.607 20 0 FHADHM Cc1ccc(-c2nc3cc(F)c(F)cc3c(=O)[n-]2)cc1Br ZINC000507037258 944884324 /nfs/dbraw/zinc/88/43/24/944884324.db2.gz RFNKCPIRIINXIX-UHFFFAOYSA-N -1 3 351.150 3.939 20 0 FHADHM CC(C)=CCCNC(=O)C[C@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436996192 944891439 /nfs/dbraw/zinc/89/14/39/944891439.db2.gz SSKUZRGYOLVTQD-FQEVSTJZSA-N -1 3 366.461 3.726 20 0 FHADHM COC(=O)c1cc2cc(CSc3ccc(-c4nnn[n-]4)cc3)ccc2o1 ZINC000736951900 944916851 /nfs/dbraw/zinc/91/68/51/944916851.db2.gz VHYYKBXZGLFUMY-UHFFFAOYSA-N -1 3 366.402 3.692 20 0 FHADHM COC(=O)c1cc2cc(CSc3ccc(-c4nn[n-]n4)cc3)ccc2o1 ZINC000736951900 944916857 /nfs/dbraw/zinc/91/68/57/944916857.db2.gz VHYYKBXZGLFUMY-UHFFFAOYSA-N -1 3 366.402 3.692 20 0 FHADHM CCCOc1ccc(-c2noc(-c3cc(OC)ccc3[O-])n2)cc1OC ZINC000437001976 944921377 /nfs/dbraw/zinc/92/13/77/944921377.db2.gz RSXIUCLMHPHYSB-UHFFFAOYSA-N -1 3 356.378 3.915 20 0 FHADHM COC(=O)C1(c2ccccc2)CCN(Cc2cccc([O-])c2Cl)CC1 ZINC000507088186 944946340 /nfs/dbraw/zinc/94/63/40/944946340.db2.gz QXAPKXIJXUPJCM-UHFFFAOYSA-N -1 3 359.853 3.752 20 0 FHADHM C[C@@H]1CCCN1C(=O)c1ccc(-c2nc3cc(Cl)ccc3c(=O)[n-]2)cc1 ZINC000426124757 944971608 /nfs/dbraw/zinc/97/16/08/944971608.db2.gz VQBVADQWBXCSDY-GFCCVEGCSA-N -1 3 367.836 3.868 20 0 FHADHM CC[C@@H](C)[C@H](NC(=O)c1cc(=O)c2ccccc2[n-]1)c1nc2ccccc2[nH]1 ZINC000507131624 944975331 /nfs/dbraw/zinc/97/53/31/944975331.db2.gz CVSFIHCKSQSARV-XCLFUZPHSA-N -1 3 374.444 3.922 20 0 FHADHM O=C(Nc1cc(F)ccc1[O-])c1ccc(Br)c2c1OCCC2 ZINC000426994161 944984089 /nfs/dbraw/zinc/98/40/89/944984089.db2.gz YSBZXNXBVHVLPX-UHFFFAOYSA-N -1 3 366.186 3.871 20 0 FHADHM CC(C)C(=O)c1ccc(S(=O)(=O)[N-]c2cc(F)c(F)cc2F)cc1 ZINC000438768519 945009818 /nfs/dbraw/zinc/00/98/18/945009818.db2.gz CSNWIGUIRSAUBG-UHFFFAOYSA-N -1 3 357.353 3.743 20 0 FHADHM Cc1cc(F)ccc1[N-]S(=O)(=O)c1ccc(F)c(Br)c1 ZINC000438789664 945017856 /nfs/dbraw/zinc/01/78/56/945017856.db2.gz IXBZUBLFYXCQHL-UHFFFAOYSA-N -1 3 362.195 3.837 20 0 FHADHM O=C(Nc1cc(Cl)ccc1[O-])c1cnn(-c2ccncc2)c1C(F)F ZINC000427038538 945035725 /nfs/dbraw/zinc/03/57/25/945035725.db2.gz NXAZXZHPRUOLIT-UHFFFAOYSA-N -1 3 364.739 3.816 20 0 FHADHM CCc1nc(C)c(C(=O)[N-]c2nnc(Cc3ccc(Cl)cc3)s2)o1 ZINC000294376301 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373.865 3.786 20 0 FHADHM O=C(NCc1ncccc1[O-])c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000473641639 945683877 /nfs/dbraw/zinc/68/38/77/945683877.db2.gz VPOKHEFCYIBHGB-UHFFFAOYSA-N -1 3 364.245 3.755 20 0 FHADHM CS[C@H]1CCC[C@H](NC(=O)Nc2ccc(-c3cc(=O)[n-]c(C)n3)cc2)C1 ZINC000522716270 945710975 /nfs/dbraw/zinc/71/09/75/945710975.db2.gz YDFHRBUAYSMASC-HOTGVXAUSA-N -1 3 372.494 3.953 20 0 FHADHM CC(C)c1ccc(C(=O)Nc2cccc(CN3CCOCC3)c2)c([O-])c1 ZINC000110568299 945713527 /nfs/dbraw/zinc/71/35/27/945713527.db2.gz VMYQJVLPYAEAQN-UHFFFAOYSA-N -1 3 354.450 3.600 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)c1ccc(Cl)cc1C(F)(F)F ZINC000473651964 945729743 /nfs/dbraw/zinc/72/97/43/945729743.db2.gz YFYGJPYWVNDZJD-UHFFFAOYSA-N -1 3 367.718 3.791 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)c1ccc(Cl)cc1C(F)(F)F ZINC000473651964 945729751 /nfs/dbraw/zinc/72/97/51/945729751.db2.gz YFYGJPYWVNDZJD-UHFFFAOYSA-N -1 3 367.718 3.791 20 0 FHADHM Cc1ccccc1C[C@@H](C)[N-]S(=O)(=O)c1ccc(Br)s1 ZINC000048440304 945732490 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FHADHM Cc1nc(-c2ccc(NC(=O)N(C)Cc3cccc(O)c3)cc2)cc(=O)[n-]1 ZINC000519946796 945917220 /nfs/dbraw/zinc/91/72/20/945917220.db2.gz ZWPVWSAGSVDZTA-UHFFFAOYSA-N -1 3 364.405 3.527 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)c3cc(C)c(C)s3)c2)n1 ZINC000049304554 945938796 /nfs/dbraw/zinc/93/87/96/945938796.db2.gz PJBXYNOHZDQXNT-UHFFFAOYSA-N -1 3 353.447 3.930 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NCCc3cc4ccccc4[nH]3)nc2)n1 ZINC000301742041 945943241 /nfs/dbraw/zinc/94/32/41/945943241.db2.gz LOSGHBPALHCZQF-UHFFFAOYSA-N -1 3 359.433 3.943 20 0 FHADHM CC(C)(C)C[C@H](NC(=O)Nc1ccc2c(c1)C(=O)[N-]C2=O)c1ccccc1 ZINC000519959566 945947497 /nfs/dbraw/zinc/94/74/97/945947497.db2.gz NERSZPLDUJHANL-KRWDZBQOSA-N -1 3 365.433 3.869 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)N3CCS[C@H](C)[C@H]3C)cc2)cc(=O)[n-]1 ZINC000522840653 945971935 /nfs/dbraw/zinc/97/19/35/945971935.db2.gz XTSFWBAIQOMJPZ-VXGBXAGGSA-N -1 3 358.467 3.515 20 0 FHADHM CCc1cc(=O)[n-]c(CSCCC(=O)Nc2ccc(Cl)cc2)n1 ZINC000125608103 945980513 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C[C@H]1CCc2ccccc2N1C(=O)COC(=O)c1cc(Cl)c(Cl)[n-]1 ZINC000011810878 946039598 /nfs/dbraw/zinc/03/95/98/946039598.db2.gz BZJIRWJOQLGRQT-JTQLQIEISA-N -1 3 367.232 3.846 20 0 FHADHM O=S(=O)([N-]c1cccc(F)c1F)c1ccc(OC(F)(F)F)cc1 ZINC000520037795 946059160 /nfs/dbraw/zinc/05/91/60/946059160.db2.gz AZINHMZQERDBFY-UHFFFAOYSA-N -1 3 353.268 3.664 20 0 FHADHM Cc1ccccc1[C@H](O)COc1ccc(-c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000822351573 946064085 /nfs/dbraw/zinc/06/40/85/946064085.db2.gz OLAQRCKDICWDAL-OAQYLSRUSA-N -1 3 372.428 3.955 20 0 FHADHM Cc1ccccc1[C@H](O)COc1ccc(-c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000822351573 946064102 /nfs/dbraw/zinc/06/41/02/946064102.db2.gz OLAQRCKDICWDAL-OAQYLSRUSA-N -1 3 372.428 3.955 20 0 FHADHM Cc1nc(NC(=O)c2cc(-c3nnn[n-]3)cs2)sc1-c1ccccc1 ZINC000822449639 946091055 /nfs/dbraw/zinc/09/10/55/946091055.db2.gz IFRFRTNTQKDZTD-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM Cc1nc(NC(=O)c2cc(-c3nn[n-]n3)cs2)sc1-c1ccccc1 ZINC000822449639 946091071 /nfs/dbraw/zinc/09/10/71/946091071.db2.gz 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362.195 3.837 20 0 FHADHM NC(=O)c1oc2ccccc2c1[N-]C(=O)c1nc(-c2ccccc2)cs1 ZINC000192515839 946343331 /nfs/dbraw/zinc/34/33/31/946343331.db2.gz FSUKUBHATDLVTM-UHFFFAOYSA-N -1 3 363.398 3.908 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nnn[n-]2)c1)c1cccc(F)c1Cl ZINC000823332855 946410580 /nfs/dbraw/zinc/41/05/80/946410580.db2.gz SNLACIXSVVMPPH-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nn[n-]n2)c1)c1cccc(F)c1Cl ZINC000823332855 946410584 /nfs/dbraw/zinc/41/05/84/946410584.db2.gz SNLACIXSVVMPPH-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM Oc1ccc(C2=CCN(c3c(Cl)cccc3-c3nnn[n-]3)CC2)cc1 ZINC000823727061 946471176 /nfs/dbraw/zinc/47/11/76/946471176.db2.gz MBJYTYZDFSMVTM-UHFFFAOYSA-N -1 3 353.813 3.519 20 0 FHADHM Oc1ccc(C2=CCN(c3c(Cl)cccc3-c3nn[n-]n3)CC2)cc1 ZINC000823727061 946471185 /nfs/dbraw/zinc/47/11/85/946471185.db2.gz MBJYTYZDFSMVTM-UHFFFAOYSA-N -1 3 353.813 3.519 20 0 FHADHM Brc1ccc(N2CCC[C@H]2c2ccco2)c(-c2nnn[n-]2)c1 ZINC000823826505 946486400 /nfs/dbraw/zinc/48/64/00/946486400.db2.gz KDXPGUYVZIALOP-ZDUSSCGKSA-N -1 3 360.215 3.564 20 0 FHADHM Brc1ccc(N2CCC[C@H]2c2ccco2)c(-c2nn[n-]n2)c1 ZINC000823826505 946486407 /nfs/dbraw/zinc/48/64/07/946486407.db2.gz KDXPGUYVZIALOP-ZDUSSCGKSA-N -1 3 360.215 3.564 20 0 FHADHM COc1cccc(C(=O)Nc2ccc(OCc3ccccc3)nc2)c1[O-] ZINC000614751396 946530084 /nfs/dbraw/zinc/53/00/84/946530084.db2.gz WNDNIKDXMVPUKA-UHFFFAOYSA-N -1 3 350.374 3.627 20 0 FHADHM CC1(C)CO[C@H](c2cccc(F)c2)CN1Cc1cc(=O)[n-]c(C2CC2)n1 ZINC000661735466 946541711 /nfs/dbraw/zinc/54/17/11/946541711.db2.gz GOJCVSCCLDCECH-KRWDZBQOSA-N -1 3 357.429 3.551 20 0 FHADHM Cc1cc(S(=O)(=O)[N-]Cc2cccc(OC(F)F)c2)sc1Cl ZINC000473901136 946562490 /nfs/dbraw/zinc/56/24/90/946562490.db2.gz JVYAVGATHCGTBR-UHFFFAOYSA-N -1 3 367.826 3.790 20 0 FHADHM CCOC(=O)c1ccc(NC(=O)c2ccc(OC)c(C3CC3)c2)c([O-])c1 ZINC000444327276 946569854 /nfs/dbraw/zinc/56/98/54/946569854.db2.gz FHHCAHVHBLNBHU-UHFFFAOYSA-N -1 3 355.390 3.707 20 0 FHADHM O=C(CC1CCCC1)NC1CCN(Cc2cccc([O-])c2Cl)CC1 ZINC000508489580 946583977 /nfs/dbraw/zinc/58/39/77/946583977.db2.gz NKWJAWWWIJUJOT-UHFFFAOYSA-N -1 3 350.890 3.707 20 0 FHADHM CC(C)[C@H]1CCN1C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000824223735 946626750 /nfs/dbraw/zinc/62/67/50/946626750.db2.gz LDYORXLYLFAZJA-GOSISDBHSA-N -1 3 363.421 3.530 20 0 FHADHM CC(C)[C@H]1CCN1C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000824223735 946626759 /nfs/dbraw/zinc/62/67/59/946626759.db2.gz LDYORXLYLFAZJA-GOSISDBHSA-N -1 3 363.421 3.530 20 0 FHADHM CC(C)COC[C@H](N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccco1 ZINC000824266461 946639071 /nfs/dbraw/zinc/63/90/71/946639071.db2.gz MBZIJYIGUODYOG-YOEHRIQHSA-N -1 3 355.442 3.524 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N2CCC[C@@H]2c2cccc(C)c2C)c1 ZINC000122755446 946642771 /nfs/dbraw/zinc/64/27/71/946642771.db2.gz JVSSEJFOZMUIRL-LJQANCHMSA-N -1 3 352.434 3.945 20 0 FHADHM COc1cc(Cl)c(S(=O)(=O)[N-]c2ccc(C)cc2F)cc1OC ZINC000192773853 946648969 /nfs/dbraw/zinc/64/89/69/946648969.db2.gz WKSRDJHLMZDIKR-UHFFFAOYSA-N -1 3 359.806 3.606 20 0 FHADHM O=C(N[C@@H](CN1CCCC1)c1ccccc1)c1cc(F)c([O-])c(Cl)c1 ZINC000184234836 946671464 /nfs/dbraw/zinc/67/14/64/946671464.db2.gz VTWMMIXQFSGZQI-KRWDZBQOSA-N -1 3 362.832 3.752 20 0 FHADHM O=S(=O)([N-]c1cn[nH]c1-c1ccccc1)c1cnc(Cl)c(Cl)c1 ZINC000179096553 946719680 /nfs/dbraw/zinc/71/96/80/946719680.db2.gz LTGJDBPHNCMROC-UHFFFAOYSA-N -1 3 369.233 3.579 20 0 FHADHM C[C@H](NC(=O)C1=CCCC1)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824472028 946725426 /nfs/dbraw/zinc/72/54/26/946725426.db2.gz UPLSPTREYDQRPU-AWEZNQCLSA-N -1 3 359.433 3.821 20 0 FHADHM C[C@H](NC(=O)C1=CCCC1)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824472028 946725437 /nfs/dbraw/zinc/72/54/37/946725437.db2.gz UPLSPTREYDQRPU-AWEZNQCLSA-N -1 3 359.433 3.821 20 0 FHADHM C[C@@H](NC(=O)N1CC=CCC1)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824492458 946741472 /nfs/dbraw/zinc/74/14/72/946741472.db2.gz ZFLYOBOSPQWZCD-OAHLLOKOSA-N -1 3 374.448 3.566 20 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946840041 /nfs/dbraw/zinc/84/00/41/946840041.db2.gz XHEFCPGFDQWCSP-LLVKDONJSA-N -1 3 374.220 3.739 20 0 FHADHM Cc1cc(S(=O)(=O)[N-][C@H]2CCO[C@H](CC(C)C)C2)sc1Cl ZINC000473948830 946871722 /nfs/dbraw/zinc/87/17/22/946871722.db2.gz IFPOZTILLCALKG-NWDGAFQWSA-N -1 3 351.921 3.582 20 0 FHADHM CC(C)(C)OC(=O)c1ccc(C(=O)[N-]c2c(F)cc(F)cc2F)nc1 ZINC001126616370 946876443 /nfs/dbraw/zinc/87/64/43/946876443.db2.gz OJPAIEMEAWHCQC-UHFFFAOYSA-N -1 3 352.312 3.707 20 0 FHADHM CC(=O)c1cc(-c2nnn[n-]2)ccc1NC(=O)c1csc2ccccc12 ZINC001573552695 946878124 /nfs/dbraw/zinc/87/81/24/946878124.db2.gz AMLSDHBIEULBEH-UHFFFAOYSA-N -1 3 363.402 3.536 20 0 FHADHM CC(=O)c1cc(-c2nn[n-]n2)ccc1NC(=O)c1csc2ccccc12 ZINC001573552695 946878130 /nfs/dbraw/zinc/87/81/30/946878130.db2.gz AMLSDHBIEULBEH-UHFFFAOYSA-N -1 3 363.402 3.536 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NCC3(c4ccccc4)CCC3)nc2)n1 ZINC000111106406 946879364 /nfs/dbraw/zinc/87/93/64/946879364.db2.gz AAKFQCXPQYZWQE-UHFFFAOYSA-N -1 3 360.461 3.928 20 0 FHADHM CC(=O)c1cc(-c2nnn[n-]2)ccc1NC(=O)c1cccc(-c2ccoc2)c1 ZINC001573554543 946900191 /nfs/dbraw/zinc/90/01/91/946900191.db2.gz WSCYVSGBVKXECM-UHFFFAOYSA-N -1 3 373.372 3.582 20 0 FHADHM CC(=O)c1cc(-c2nn[n-]n2)ccc1NC(=O)c1cccc(-c2ccoc2)c1 ZINC001573554543 946900201 /nfs/dbraw/zinc/90/02/01/946900201.db2.gz WSCYVSGBVKXECM-UHFFFAOYSA-N -1 3 373.372 3.582 20 0 FHADHM [O-]c1cccnc1CNCc1cc(Cl)ccc1OCc1cccnc1 ZINC000475343141 946913564 /nfs/dbraw/zinc/91/35/64/946913564.db2.gz OLMLRDWSCWCMLG-UHFFFAOYSA-N -1 3 355.825 3.704 20 0 FHADHM CC[C@@H](C)[C@H]([N-]S(=O)(=O)c1cc(Cl)c(OC)cc1C)C(F)(F)F ZINC001211677539 946933376 /nfs/dbraw/zinc/93/33/76/946933376.db2.gz JNARTPSFDVBGJX-OQPBUACISA-N -1 3 373.824 3.912 20 0 FHADHM CN(Cc1ccccc1)c1ccc(NC(=O)c2cccc3n[n-]nc32)cc1 ZINC000783569294 946961568 /nfs/dbraw/zinc/96/15/68/946961568.db2.gz JMWGECHKKMRVFC-UHFFFAOYSA-N -1 3 357.417 3.847 20 0 FHADHM CC(C)c1ccc(C(=O)NC[C@@]2(O)CCC[C@H](C(F)(F)F)C2)c([O-])c1 ZINC000444499670 946963048 /nfs/dbraw/zinc/96/30/48/946963048.db2.gz GWOWDBMWIFSMBI-SUMWQHHRSA-N -1 3 359.388 3.729 20 0 FHADHM CCC[C@]1(CO)CCCN1C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000444552666 946991125 /nfs/dbraw/zinc/99/11/25/946991125.db2.gz USWBXAWAYWOCSW-JOCHJYFZSA-N -1 3 353.462 3.750 20 0 FHADHM CCOc1ccc([C@@H]2C[C@H]2[N-]S(=O)(=O)c2cc(F)c(C)cc2F)cc1 ZINC001211678979 946992213 /nfs/dbraw/zinc/99/22/13/946992213.db2.gz CLWPIZLNBLWDTN-WMLDXEAASA-N -1 3 367.417 3.506 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CC[C@@H](C)C2)c1ccccc1 ZINC000824966630 947008841 /nfs/dbraw/zinc/00/88/41/947008841.db2.gz CTKBUPGFEIVXIO-NEPJUHHUSA-N -1 3 367.478 3.795 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CC[C@@H](C)C2)c1ccccc1 ZINC000824966630 947008853 /nfs/dbraw/zinc/00/88/53/947008853.db2.gz CTKBUPGFEIVXIO-NEPJUHHUSA-N -1 3 367.478 3.795 20 0 FHADHM CCC(CC)N(CCOC)Cc1c(Br)cccc1C(=O)[O-] ZINC000652394691 947020658 /nfs/dbraw/zinc/02/06/58/947020658.db2.gz ACEMJEROADUXTR-UHFFFAOYSA-N -1 3 358.276 3.784 20 0 FHADHM C[C@H]1c2ccccc2CN1c1ccc(Br)cc1-c1nnn[n-]1 ZINC000825029230 947052256 /nfs/dbraw/zinc/05/22/56/947052256.db2.gz PJDVVUNCTJWRCI-JTQLQIEISA-N -1 3 356.227 3.710 20 0 FHADHM C[C@H]1c2ccccc2CN1c1ccc(Br)cc1-c1nn[n-]n1 ZINC000825029230 947052263 /nfs/dbraw/zinc/05/22/63/947052263.db2.gz PJDVVUNCTJWRCI-JTQLQIEISA-N -1 3 356.227 3.710 20 0 FHADHM CC[C@@H](C(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccc(OC)cc1 ZINC000825039252 947056938 /nfs/dbraw/zinc/05/69/38/947056938.db2.gz OULDCMPLYJKPRY-FZKQIMNGSA-N -1 3 366.421 3.673 20 0 FHADHM CC[C@@H](C(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccc(OC)cc1 ZINC000825039252 947056946 /nfs/dbraw/zinc/05/69/46/947056946.db2.gz OULDCMPLYJKPRY-FZKQIMNGSA-N -1 3 366.421 3.673 20 0 FHADHM Cc1ccc([C@H](CNC(=O)c2cc(F)c([O-])c(Cl)c2)N(C)C)cc1 ZINC000184330829 947057903 /nfs/dbraw/zinc/05/79/03/947057903.db2.gz FUYYCPLISOIPJH-INIZCTEOSA-N -1 3 350.821 3.526 20 0 FHADHM CCN(CC)[C@H](CNC(=O)C1(C(=O)[O-])CCCCCC1)c1ccsc1 ZINC000663113110 947066286 /nfs/dbraw/zinc/06/62/86/947066286.db2.gz FYRTXPKXEYFABH-MRXNPFEDSA-N -1 3 366.527 3.672 20 0 FHADHM CC[C@H](C)NC(=O)[C@H](Sc1cccc(Cl)c1-c1nnn[n-]1)C(C)C ZINC000825069262 947068741 /nfs/dbraw/zinc/06/87/41/947068741.db2.gz ZJQCLHKKPVPBEM-IINYFYTJSA-N -1 3 367.906 3.552 20 0 FHADHM CC[C@H](C)NC(=O)[C@H](Sc1cccc(Cl)c1-c1nn[n-]n1)C(C)C ZINC000825069262 947068750 /nfs/dbraw/zinc/06/87/50/947068750.db2.gz ZJQCLHKKPVPBEM-IINYFYTJSA-N -1 3 367.906 3.552 20 0 FHADHM CCC(CC)n1nc(C)cc1C(=O)Nc1sc(C)c(C)c1-c1nnn[n-]1 ZINC000825113770 947078793 /nfs/dbraw/zinc/07/87/93/947078793.db2.gz GAJABFGWRFDHKZ-UHFFFAOYSA-N -1 3 373.486 3.663 20 0 FHADHM CCC(CC)n1nc(C)cc1C(=O)Nc1sc(C)c(C)c1-c1nn[n-]n1 ZINC000825113770 947078806 /nfs/dbraw/zinc/07/88/06/947078806.db2.gz GAJABFGWRFDHKZ-UHFFFAOYSA-N -1 3 373.486 3.663 20 0 FHADHM CCC(CC)n1nc(C(=O)O[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1C ZINC000825113668 947079263 /nfs/dbraw/zinc/07/92/63/947079263.db2.gz DQDYEQDXHXUPFV-ZDUSSCGKSA-N -1 3 368.441 3.651 20 0 FHADHM CCC(CC)n1nc(C(=O)O[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1C ZINC000825113668 947079275 /nfs/dbraw/zinc/07/92/75/947079275.db2.gz DQDYEQDXHXUPFV-ZDUSSCGKSA-N -1 3 368.441 3.651 20 0 FHADHM CCc1ccc([O-])c(C(=O)N2CCN(C(=O)CCC3CCCCC3)CC2)c1 ZINC000523318115 947109083 /nfs/dbraw/zinc/10/90/83/947109083.db2.gz ZVOJJQCNSGMIQU-UHFFFAOYSA-N -1 3 372.509 3.600 20 0 FHADHM O=S(=O)([N-]CC[C@@H](c1ccccc1)C(F)(F)F)c1ccccc1F ZINC000432288871 947125450 /nfs/dbraw/zinc/12/54/50/947125450.db2.gz IXWACRVRYJSEKD-ZDUSSCGKSA-N -1 3 361.360 3.840 20 0 FHADHM CCCNc1ccc(Cl)cc1NC(=O)c1ccc(-c2nnn[n-]2)cc1C ZINC000825333231 947157364 /nfs/dbraw/zinc/15/73/64/947157364.db2.gz SMIJLURWLXUXTP-UHFFFAOYSA-N -1 3 370.844 3.903 20 0 FHADHM CCCNc1ccc(Cl)cc1NC(=O)c1ccc(-c2nn[n-]n2)cc1C ZINC000825333231 947157367 /nfs/dbraw/zinc/15/73/67/947157367.db2.gz SMIJLURWLXUXTP-UHFFFAOYSA-N -1 3 370.844 3.903 20 0 FHADHM CCN(C(=O)c1cnc(C2CC2)s1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825385424 947168977 /nfs/dbraw/zinc/16/89/77/947168977.db2.gz FLHYWPRYHUXLQM-UHFFFAOYSA-N -1 3 374.857 3.521 20 0 FHADHM CCN(C(=O)c1cnc(C2CC2)s1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825385424 947168981 /nfs/dbraw/zinc/16/89/81/947168981.db2.gz FLHYWPRYHUXLQM-UHFFFAOYSA-N -1 3 374.857 3.521 20 0 FHADHM CC[C@@H]1[C@@H](C)CCN1C(=O)c1c[n-]c2ccc(Br)cc2c1=O ZINC000444363265 947229812 /nfs/dbraw/zinc/22/98/12/947229812.db2.gz IVKVWRDGIUBMKS-ZUZCIYMTSA-N -1 3 363.255 3.551 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N2CC[C@H](c3cc(C)cc(C)c3)C2)c1 ZINC000330821609 947280287 /nfs/dbraw/zinc/28/02/87/947280287.db2.gz NMKGBPDQKZJOPJ-INIZCTEOSA-N -1 3 352.434 3.597 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)c2cc(C)n(C(CC)CC)n2)s1 ZINC000825693785 947289818 /nfs/dbraw/zinc/28/98/18/947289818.db2.gz FOFBXIYSFJAYDC-UHFFFAOYSA-N -1 3 373.486 3.609 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)c2cc(C)n(C(CC)CC)n2)s1 ZINC000825693785 947289830 /nfs/dbraw/zinc/28/98/30/947289830.db2.gz FOFBXIYSFJAYDC-UHFFFAOYSA-N -1 3 373.486 3.609 20 0 FHADHM CCc1ccc(NC(=O)CSc2cccc(Cl)c2-c2nnn[n-]2)cc1 ZINC000825712980 947299155 /nfs/dbraw/zinc/29/91/55/947299155.db2.gz YKMGCWKAKJXZDB-UHFFFAOYSA-N -1 3 373.869 3.813 20 0 FHADHM CCc1ccc(NC(=O)CSc2cccc(Cl)c2-c2nn[n-]n2)cc1 ZINC000825712980 947299167 /nfs/dbraw/zinc/29/91/67/947299167.db2.gz YKMGCWKAKJXZDB-UHFFFAOYSA-N -1 3 373.869 3.813 20 0 FHADHM O=C(NCCc1cccc(-c2ccccc2)c1)c1cc(=O)[n-]c(C2CC2)n1 ZINC001167787465 947303332 /nfs/dbraw/zinc/30/33/32/947303332.db2.gz KNWDPWHLIJEGRM-UHFFFAOYSA-N -1 3 359.429 3.699 20 0 FHADHM Cc1cc(=O)[n-]c([C@H](C)N2CCO[C@@H](c3ccc(C(F)(F)F)cc3)C2)n1 ZINC000248712247 947309468 /nfs/dbraw/zinc/30/94/68/947309468.db2.gz CYSJBWGTELPMTD-SWLSCSKDSA-N -1 3 367.371 3.644 20 0 FHADHM CCO[C@@H](C[N-]S(=O)(=O)c1cc(C)c(Cl)s1)c1ccccc1 ZINC000444973131 947381486 /nfs/dbraw/zinc/38/14/86/947381486.db2.gz HTYDFFXMDBRDLD-ZDUSSCGKSA-N -1 3 359.900 3.766 20 0 FHADHM COCCOc1ccc(-c2nnn[n-]2)cc1N[C@H](C)c1ccc(Cl)cc1 ZINC000826162087 947509125 /nfs/dbraw/zinc/50/91/25/947509125.db2.gz MPCSCMKGBJEQDX-GFCCVEGCSA-N -1 3 373.844 3.718 20 0 FHADHM COCCOc1ccc(-c2nn[n-]n2)cc1N[C@H](C)c1ccc(Cl)cc1 ZINC000826162087 947509134 /nfs/dbraw/zinc/50/91/34/947509134.db2.gz MPCSCMKGBJEQDX-GFCCVEGCSA-N -1 3 373.844 3.718 20 0 FHADHM COCCOc1ccc(-c2nnn[n-]2)cc1N[C@@H](C)c1ccc(Cl)cc1 ZINC000826162088 947509368 /nfs/dbraw/zinc/50/93/68/947509368.db2.gz MPCSCMKGBJEQDX-LBPRGKRZSA-N -1 3 373.844 3.718 20 0 FHADHM COCCOc1ccc(-c2nn[n-]n2)cc1N[C@@H](C)c1ccc(Cl)cc1 ZINC000826162088 947509376 /nfs/dbraw/zinc/50/93/76/947509376.db2.gz MPCSCMKGBJEQDX-LBPRGKRZSA-N -1 3 373.844 3.718 20 0 FHADHM Cc1nn(C(C)C)c(C)c1S(=O)(=O)[N-]c1ccccc1Br ZINC000523728384 947569203 /nfs/dbraw/zinc/56/92/03/947569203.db2.gz SOFITRWPRZVXLN-UHFFFAOYSA-N -1 3 372.288 3.644 20 0 FHADHM Cc1cc(Br)c(CNC[C@@H](CCC(=O)[O-])C(F)(F)F)s1 ZINC000663262133 947583342 /nfs/dbraw/zinc/58/33/42/947583342.db2.gz PSFHILURXMFVMF-MRVPVSSYSA-N -1 3 374.222 3.952 20 0 FHADHM Cc1cc(Br)cc(NC(=O)c2c[n-]c3ccccc3c2=O)c1 ZINC000188461845 947623982 /nfs/dbraw/zinc/62/39/82/947623982.db2.gz VBWBSCWURCCYIJ-UHFFFAOYSA-N -1 3 357.207 3.851 20 0 FHADHM CC(=CC(=O)N(C)c1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccc(F)cc1 ZINC001573357910 947654662 /nfs/dbraw/zinc/65/46/62/947654662.db2.gz BUWCGTPMJDXTMU-LUAWRHEFSA-N -1 3 371.803 3.726 20 0 FHADHM CC(=CC(=O)N(C)c1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccc(F)cc1 ZINC001573357910 947654669 /nfs/dbraw/zinc/65/46/69/947654669.db2.gz BUWCGTPMJDXTMU-LUAWRHEFSA-N -1 3 371.803 3.726 20 0 FHADHM Cc1ccccc1-c1cc(=NC(=O)[C@H]2C[C@@H]2c2c(F)cccc2F)[nH][n-]1 ZINC000523871180 947682715 /nfs/dbraw/zinc/68/27/15/947682715.db2.gz YPCOWYVAJLLTLS-KBPBESRZSA-N -1 3 353.372 3.827 20 0 FHADHM CC(=CC(=O)Nc1sc2c(c1-c1nnn[n-]1)C(C)(C)CC2)c1ccco1 ZINC001573362000 947699088 /nfs/dbraw/zinc/69/90/88/947699088.db2.gz GYTXCTQNYTUSHK-KTKRTIGZSA-N -1 3 369.450 3.787 20 0 FHADHM CC(=CC(=O)Nc1sc2c(c1-c1nn[n-]n1)C(C)(C)CC2)c1ccco1 ZINC001573362000 947699095 /nfs/dbraw/zinc/69/90/95/947699095.db2.gz GYTXCTQNYTUSHK-KTKRTIGZSA-N -1 3 369.450 3.787 20 0 FHADHM Cc1c(Cl)cnc(NCc2nc(C(C)(C)C)cs2)c1-c1nnn[n-]1 ZINC000826240370 947710936 /nfs/dbraw/zinc/71/09/36/947710936.db2.gz PECIFQQHIPTNCU-UHFFFAOYSA-N -1 3 363.878 3.590 20 0 FHADHM Cc1c(Cl)cnc(NCc2nc(C(C)(C)C)cs2)c1-c1nn[n-]n1 ZINC000826240370 947710950 /nfs/dbraw/zinc/71/09/50/947710950.db2.gz PECIFQQHIPTNCU-UHFFFAOYSA-N -1 3 363.878 3.590 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)N(C)c1ccc(-c2nnn[n-]2)cc1 ZINC001573364704 947724828 /nfs/dbraw/zinc/72/48/28/947724828.db2.gz IXFMYAXIIIZKCL-BENRWUELSA-N -1 3 353.813 3.586 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)N(C)c1ccc(-c2nn[n-]n2)cc1 ZINC001573364704 947724836 /nfs/dbraw/zinc/72/48/36/947724836.db2.gz IXFMYAXIIIZKCL-BENRWUELSA-N -1 3 353.813 3.586 20 0 FHADHM CC(=CC(=O)Oc1ccc(-c2nnn[n-]2)cc1)c1ccc(C(F)(F)F)cc1 ZINC001573366904 947749393 /nfs/dbraw/zinc/74/93/93/947749393.db2.gz UYWQKJPXWHTZMH-KHPPLWFESA-N -1 3 374.322 3.894 20 0 FHADHM CC(=CC(=O)Oc1ccc(-c2nn[n-]n2)cc1)c1ccc(C(F)(F)F)cc1 ZINC001573366904 947749400 /nfs/dbraw/zinc/74/94/00/947749400.db2.gz UYWQKJPXWHTZMH-KHPPLWFESA-N -1 3 374.322 3.894 20 0 FHADHM COc1ccc([O-])c(C(=O)Nc2nnc(-c3ccc(C)cc3C)s2)c1 ZINC000520472275 947780048 /nfs/dbraw/zinc/78/00/48/947780048.db2.gz GECMEXANTVPSON-UHFFFAOYSA-N -1 3 355.419 3.788 20 0 FHADHM Cc1cc(N[C@@H](C)c2ccc(-c3cccc(-c4nnn[n-]4)c3)cc2)ncn1 ZINC000826270800 947785030 /nfs/dbraw/zinc/78/50/30/947785030.db2.gz PJLMWCAEBNAMLB-AWEZNQCLSA-N -1 3 357.421 3.805 20 0 FHADHM Cc1cc(N[C@@H](C)c2ccc(-c3cccc(-c4nn[n-]n4)c3)cc2)ncn1 ZINC000826270800 947785038 /nfs/dbraw/zinc/78/50/38/947785038.db2.gz PJLMWCAEBNAMLB-AWEZNQCLSA-N -1 3 357.421 3.805 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)n1 ZINC000826274535 947794092 /nfs/dbraw/zinc/79/40/92/947794092.db2.gz USAAJBFEVJDHAY-CYBMUJFWSA-N -1 3 374.370 3.583 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)n1 ZINC000826274535 947794103 /nfs/dbraw/zinc/79/41/03/947794103.db2.gz USAAJBFEVJDHAY-CYBMUJFWSA-N -1 3 374.370 3.583 20 0 FHADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(NC(=O)C3CC4(CC4)C3)cc2)cc1 ZINC000665056809 947808118 /nfs/dbraw/zinc/80/81/18/947808118.db2.gz WSJILIIPQGHUMA-UHFFFAOYSA-N -1 3 370.474 3.925 20 0 FHADHM Cc1ccc(NC(=O)C[C@H](C)Nc2cccc(-c3nnn[n-]3)c2)c(Cl)c1 ZINC000826290175 947845108 /nfs/dbraw/zinc/84/51/08/947845108.db2.gz DJFHEWMJARHJSG-LBPRGKRZSA-N -1 3 370.844 3.658 20 0 FHADHM Cc1ccc(NC(=O)C[C@H](C)Nc2cccc(-c3nn[n-]n3)c2)c(Cl)c1 ZINC000826290175 947845120 /nfs/dbraw/zinc/84/51/20/947845120.db2.gz DJFHEWMJARHJSG-LBPRGKRZSA-N -1 3 370.844 3.658 20 0 FHADHM CCCCCC[C@](C)(NC(=O)c1cccc(CN2CCCC2)c1)C(=O)[O-] ZINC000909432253 947966816 /nfs/dbraw/zinc/96/68/16/947966816.db2.gz NYIFTBRRXLJBPD-NRFANRHFSA-N -1 3 360.498 3.826 20 0 FHADHM CCOC(=O)C(=Cc1ccc(F)cc1)c1nc(=O)c2c(C)c(C)sc2[n-]1 ZINC000006210602 948044281 /nfs/dbraw/zinc/04/42/81/948044281.db2.gz SFCSIZXUNLGMBD-ZROIWOOFSA-N -1 3 372.421 3.844 20 0 FHADHM CC(C)(C)OC(=O)c1ccc([N-]C(=O)c2ncc(F)cc2F)c(F)c1 ZINC000190534520 948050166 /nfs/dbraw/zinc/05/01/66/948050166.db2.gz IPCXBHRSYUHBBL-UHFFFAOYSA-N -1 3 352.312 3.707 20 0 FHADHM O=c1nc(CN2CC3(C2)CC(F)(F)C3)[n-]c2scc(-c3ccco3)c21 ZINC000663464517 948053331 /nfs/dbraw/zinc/05/33/31/948053331.db2.gz KIFLPMIGQMPJTC-UHFFFAOYSA-N -1 3 363.389 3.888 20 0 FHADHM C[C@H](C(=O)NC1(c2cccc(-c3nnn[n-]3)c2)CC1)c1cc2ccccc2o1 ZINC001573665027 948066757 /nfs/dbraw/zinc/06/67/57/948066757.db2.gz ZYWQOOOCSLEJPG-ZDUSSCGKSA-N -1 3 373.416 3.522 20 0 FHADHM C[C@H](C(=O)NC1(c2cccc(-c3nn[n-]n3)c2)CC1)c1cc2ccccc2o1 ZINC001573665027 948066762 /nfs/dbraw/zinc/06/67/62/948066762.db2.gz ZYWQOOOCSLEJPG-ZDUSSCGKSA-N -1 3 373.416 3.522 20 0 FHADHM Clc1cccc(SCc2cccc3nsnc32)c1-c1nnn[n-]1 ZINC000826353548 948103525 /nfs/dbraw/zinc/10/35/25/948103525.db2.gz UQEQTTVNGAWNSR-UHFFFAOYSA-N -1 3 360.855 3.817 20 0 FHADHM Clc1cccc(SCc2cccc3nsnc32)c1-c1nn[n-]n1 ZINC000826353548 948103534 /nfs/dbraw/zinc/10/35/34/948103534.db2.gz UQEQTTVNGAWNSR-UHFFFAOYSA-N -1 3 360.855 3.817 20 0 FHADHM FC(F)(F)[C@H](NCc1cccc(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000826367191 948145528 /nfs/dbraw/zinc/14/55/28/948145528.db2.gz OXOTXEWZUKYYSE-CQSZACIVSA-N -1 3 367.762 3.913 20 0 FHADHM FC(F)(F)[C@H](NCc1cccc(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000826367191 948145534 /nfs/dbraw/zinc/14/55/34/948145534.db2.gz OXOTXEWZUKYYSE-CQSZACIVSA-N -1 3 367.762 3.913 20 0 FHADHM Cc1nc([C@@H]2CCCCN2Cc2nc3c4ccccc4oc3c(=O)[n-]2)no1 ZINC000613937480 948248080 /nfs/dbraw/zinc/24/80/80/948248080.db2.gz QLBGISFUJOZBHY-ZDUSSCGKSA-N -1 3 365.393 3.500 20 0 FHADHM C[C@@H]1CC[C@@](CNCc2c(F)cccc2Br)(CC(=O)[O-])C1 ZINC000417571951 948265221 /nfs/dbraw/zinc/26/52/21/948265221.db2.gz UJLLBWNMXXBLAP-BZNIZROVSA-N -1 3 358.251 3.959 20 0 FHADHM COc1ccccc1CC(C)(C)[N-]S(=O)(=O)c1cccc(Cl)c1F ZINC000520556544 948277036 /nfs/dbraw/zinc/27/70/36/948277036.db2.gz FDQPTMPVZYCPJS-UHFFFAOYSA-N -1 3 371.861 3.787 20 0 FHADHM CC(C)(C)n1cc(CN[C@]2(C(=O)[O-])CCC(C)(C)c3ccccc32)cn1 ZINC000417576392 948279432 /nfs/dbraw/zinc/27/94/32/948279432.db2.gz HSTSRPLGVISQMB-OAQYLSRUSA-N -1 3 355.482 3.779 20 0 FHADHM O=S(=O)(Cc1cc(-c2ccccc2)no1)[N-]Cc1cc2ccccc2o1 ZINC000585780660 948284332 /nfs/dbraw/zinc/28/43/32/948284332.db2.gz UWVBHJQNTNFBKT-UHFFFAOYSA-N -1 3 368.414 3.707 20 0 FHADHM O=C(NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1)C12CCC(CC1)C2 ZINC000826440744 948299658 /nfs/dbraw/zinc/29/96/58/948299658.db2.gz YVXBXCWLCBCWSK-UHFFFAOYSA-N -1 3 373.460 3.730 20 0 FHADHM O=C(NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1)C12CCC(CC1)C2 ZINC000826440744 948299668 /nfs/dbraw/zinc/29/96/68/948299668.db2.gz YVXBXCWLCBCWSK-UHFFFAOYSA-N -1 3 373.460 3.730 20 0 FHADHM CC[C@@H](C)[N-]S(=O)(=O)c1ccc(Br)cc1C(F)(F)F ZINC000614598310 948327033 /nfs/dbraw/zinc/32/70/33/948327033.db2.gz ATNXYSIQLLUOGG-SSDOTTSWSA-N -1 3 360.195 3.545 20 0 FHADHM Cc1ccc([N-]S(=O)(=O)c2ccc(NC(=O)C(F)(F)F)cc2)cc1C ZINC000006270267 948369430 /nfs/dbraw/zinc/36/94/30/948369430.db2.gz VAJSCJLZNRMTKY-UHFFFAOYSA-N -1 3 372.368 3.605 20 0 FHADHM c1csc(CNc2ccc(OCc3cccc(-c4nnn[n-]4)c3)cc2)n1 ZINC000826516665 948443466 /nfs/dbraw/zinc/44/34/66/948443466.db2.gz VJWDNTFSYNQNDY-UHFFFAOYSA-N -1 3 364.434 3.514 20 0 FHADHM c1csc(CNc2ccc(OCc3cccc(-c4nn[n-]n4)c3)cc2)n1 ZINC000826516665 948443470 /nfs/dbraw/zinc/44/34/70/948443470.db2.gz VJWDNTFSYNQNDY-UHFFFAOYSA-N -1 3 364.434 3.514 20 0 FHADHM O=C(CCCc1nnc(-c2ccccc2)o1)N=c1cc(-c2ccccc2)[n-][nH]1 ZINC000520631878 948464071 /nfs/dbraw/zinc/46/40/71/948464071.db2.gz ISWGUYXYSSEVMO-UHFFFAOYSA-N -1 3 373.416 3.510 20 0 FHADHM O=C(Nc1cc(-c2nnn[n-]2)ccc1F)c1ccccc1-c1ccccc1 ZINC001129728937 948471706 /nfs/dbraw/zinc/47/17/06/948471706.db2.gz PEFKZLRAAQNZAI-UHFFFAOYSA-N -1 3 359.364 3.925 20 0 FHADHM O=C(Nc1cc(-c2nn[n-]n2)ccc1F)c1ccccc1-c1ccccc1 ZINC001129728937 948471710 /nfs/dbraw/zinc/47/17/10/948471710.db2.gz PEFKZLRAAQNZAI-UHFFFAOYSA-N -1 3 359.364 3.925 20 0 FHADHM CC(C)(C)OC(=O)c1ccc(CNc2cc(F)cc(-c3nnn[n-]3)c2)cc1 ZINC001162841255 948486624 /nfs/dbraw/zinc/48/66/24/948486624.db2.gz GBIUINZURGHIOC-UHFFFAOYSA-N -1 3 369.400 3.573 20 0 FHADHM CC(C)(C)OC(=O)c1ccc(CNc2cc(F)cc(-c3nn[n-]n3)c2)cc1 ZINC001162841255 948486635 /nfs/dbraw/zinc/48/66/35/948486635.db2.gz GBIUINZURGHIOC-UHFFFAOYSA-N -1 3 369.400 3.573 20 0 FHADHM COc1cc(OC)cc(-c2noc([N-][C@H](c3cnn(C)c3)C(C)(C)C)n2)c1 ZINC000663706278 948724727 /nfs/dbraw/zinc/72/47/27/948724727.db2.gz ONRIPZKAYLQXAY-MRXNPFEDSA-N -1 3 371.441 3.687 20 0 FHADHM CC(C)[C@H](F)C(=O)Nc1ccc(Sc2ccccc2-c2nnn[n-]2)cc1 ZINC001574078595 948757750 /nfs/dbraw/zinc/75/77/50/948757750.db2.gz FEHONPPOPGFLBD-INIZCTEOSA-N -1 3 371.441 3.951 20 0 FHADHM CC(C)[C@H](F)C(=O)Nc1ccc(Sc2ccccc2-c2nn[n-]n2)cc1 ZINC001574078595 948757763 /nfs/dbraw/zinc/75/77/63/948757763.db2.gz FEHONPPOPGFLBD-INIZCTEOSA-N -1 3 371.441 3.951 20 0 FHADHM CC(C)c1cccc(C(=O)NC(C)(C)Cc2ccc(-c3nnn[n-]3)cc2)c1 ZINC001574416769 948760851 /nfs/dbraw/zinc/76/08/51/948760851.db2.gz HGMSGQUZBQSHKK-UHFFFAOYSA-N -1 3 363.465 3.741 20 0 FHADHM CC(C)c1cccc(C(=O)NC(C)(C)Cc2ccc(-c3nn[n-]n3)cc2)c1 ZINC001574416769 948760861 /nfs/dbraw/zinc/76/08/61/948760861.db2.gz HGMSGQUZBQSHKK-UHFFFAOYSA-N -1 3 363.465 3.741 20 0 FHADHM Cc1c(C(=O)Nc2ccc(-c3nc(C)cc(=O)[n-]3)cc2)ccn1C(C)C ZINC000549639804 948769366 /nfs/dbraw/zinc/76/93/66/948769366.db2.gz AYFJYVRFOMSSFC-UHFFFAOYSA-N -1 3 350.422 3.688 20 0 FHADHM CC(C)c1ccc(OCCC(=O)Nc2ccc(-c3nnn[n-]3)c(F)c2)cc1 ZINC001574418473 948777999 /nfs/dbraw/zinc/77/79/99/948777999.db2.gz WPHMXTOPQBRCLQ-UHFFFAOYSA-N -1 3 369.400 3.537 20 0 FHADHM CC(C)c1ccc(OCCC(=O)Nc2ccc(-c3nn[n-]n3)c(F)c2)cc1 ZINC001574418473 948778008 /nfs/dbraw/zinc/77/80/08/948778008.db2.gz WPHMXTOPQBRCLQ-UHFFFAOYSA-N -1 3 369.400 3.537 20 0 FHADHM CC(C)(C)[C@@H]1OCCC[C@H]1C[N-]S(=O)(=O)c1cc(F)ccc1Cl ZINC000524020451 948787454 /nfs/dbraw/zinc/78/74/54/948787454.db2.gz SWROAWUQRFSTOC-XHDPSFHLSA-N -1 3 363.882 3.599 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2ccc(-c3ccncc3)c(C)c2)cc1 ZINC000427636781 948802376 /nfs/dbraw/zinc/80/23/76/948802376.db2.gz MHXWGISAAWRVCG-UHFFFAOYSA-N -1 3 354.431 3.866 20 0 FHADHM CC(C)[C@H](NC(=O)c1ccc(-c2nnn[n-]2)cc1F)c1ccc(Cl)cc1 ZINC001574081239 948822090 /nfs/dbraw/zinc/82/20/90/948822090.db2.gz ZBJDVBVRLCYYAD-INIZCTEOSA-N -1 3 373.819 3.786 20 0 FHADHM CC(C)[C@H](NC(=O)c1ccc(-c2nn[n-]n2)cc1F)c1ccc(Cl)cc1 ZINC001574081239 948822106 /nfs/dbraw/zinc/82/21/06/948822106.db2.gz ZBJDVBVRLCYYAD-INIZCTEOSA-N -1 3 373.819 3.786 20 0 FHADHM C[C@H](Sc1nncn1C)c1nc(=O)c2c(-c3ccccc3)csc2[n-]1 ZINC000023552518 211391130 /nfs/dbraw/zinc/39/11/30/211391130.db2.gz CUTILPSLTBBMAQ-JTQLQIEISA-N -1 3 369.475 3.633 20 0 FHADHM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2ccc3c(c2)CCN3C(C)=O)cc1 ZINC000022274507 211346372 /nfs/dbraw/zinc/34/63/72/211346372.db2.gz GOSOOMYRQNLJIV-CQSZACIVSA-N -1 3 372.490 3.910 20 0 FHADHM Cc1ccc([N-]S(=O)(=O)c2ccc(Cl)nc2)c(Br)c1 ZINC000016147294 211155586 /nfs/dbraw/zinc/15/55/86/211155586.db2.gz ZCECDFFKIBHVBG-UHFFFAOYSA-N -1 3 361.648 3.607 20 0 FHADHM CCCc1n[n-]c(=NC(=O)NC[C@H](C2CC2)N(C)Cc2ccccc2)s1 ZINC000479967595 514792511 /nfs/dbraw/zinc/79/25/11/514792511.db2.gz QAXMQUXRHGCCOT-MRXNPFEDSA-N -1 3 373.526 3.523 20 0 FHADHM C[C@H](C(=O)N=c1cc(OC(F)F)n(C)[n-]1)c1ccc(Br)cc1 ZINC000490977990 515347783 /nfs/dbraw/zinc/34/77/83/515347783.db2.gz VHVZWPAUUOBQND-QMMMGPOBSA-N -1 3 374.185 3.526 20 0 FHADHM CC[C@H](CC(=O)N=c1cc(OC(F)F)n(C)[n-]1)c1ccc(OC)cc1 ZINC000491035588 515363471 /nfs/dbraw/zinc/36/34/71/515363471.db2.gz MOZNMJVFPBQJBT-LLVKDONJSA-N -1 3 353.369 3.553 20 0 FHADHM CCCCCc1n[n-]c(=NC(=O)N[C@@H](C)CN2CCC[C@@H](C)C2)s1 ZINC000510384186 515524268 /nfs/dbraw/zinc/52/42/68/515524268.db2.gz ZTVASGGVJWNDJK-KGLIPLIRSA-N -1 3 353.536 3.513 20 0 FHADHM CCN=c1[n-]c(C(=O)N2CC[C@@H](Oc3ccccc3Cl)C2)cs1 ZINC000506198295 515812151 /nfs/dbraw/zinc/81/21/51/515812151.db2.gz BHZVJKBUXYLGJM-LLVKDONJSA-N -1 3 351.859 3.522 20 0 FHADHM CC(C)(C)c1noc2ncc(C(=O)N=c3cc(-c4ccncc4)[n-][nH]3)cc21 ZINC000512283036 516222894 /nfs/dbraw/zinc/22/28/94/516222894.db2.gz WBFMYXCVAOBFKN-UHFFFAOYSA-N -1 3 362.393 3.558 20 0 FHADHM COC(=O)[C@@H](C)CC(=O)N=c1cc(-c2cc(Cl)cc(Cl)c2)[n-][nH]1 ZINC000474924395 516237878 /nfs/dbraw/zinc/23/78/78/516237878.db2.gz LECAYNNLKRDYRG-QMMMGPOBSA-N -1 3 356.209 3.521 20 0 FHADHM CCCc1ccc(-c2cc(=NC(=O)c3ccc4nnn(C)c4c3)[nH][n-]2)cc1 ZINC000544612607 516835900 /nfs/dbraw/zinc/83/59/00/516835900.db2.gz JCVPFFFUOVJQAA-UHFFFAOYSA-N -1 3 360.421 3.563 20 0 FHADHM Cc1cc(=NC(=O)NCc2cn3ccsc3n2)[n-]n1-c1ccc(C)cc1 ZINC000537220851 517094779 /nfs/dbraw/zinc/09/47/79/517094779.db2.gz VFKSGJIMLTWWRT-UHFFFAOYSA-N -1 3 366.450 3.520 20 0 FHADHM O=C(N=c1cc([C@@H]2CCCO2)[n-][nH]1)[C@H]1CCCN1Cc1ccc(Cl)cc1 ZINC000529522806 517197301 /nfs/dbraw/zinc/19/73/01/517197301.db2.gz VZGRYPYJNCFIBR-SJORKVTESA-N -1 3 374.872 3.518 20 0 FHADHM CCC[C@H](OCC)C(=O)N=c1[nH][n-]c(CC)c1-c1ccc2c(c1)OCO2 ZINC000530263308 517667271 /nfs/dbraw/zinc/66/72/71/517667271.db2.gz OYZBZNDALRGYLB-HNNXBMFYSA-N -1 3 359.426 3.512 20 0 FHADHM CCN1CCC(NC(=O)N=c2[n-]nc(-c3cc4ccccc4o3)s2)CC1 ZINC000530343850 517716325 /nfs/dbraw/zinc/71/63/25/517716325.db2.gz TZMCFDYHWLRXOE-UHFFFAOYSA-N -1 3 371.466 3.557 20 0 FHADHM CCc1[n-][nH]c(=NC(=O)c2cc(C)[nH]c2C)c1-c1ccc2c(c1)OCO2 ZINC000608482532 519999124 /nfs/dbraw/zinc/99/91/24/519999124.db2.gz ILEIUGQXZJPKCG-UHFFFAOYSA-N -1 3 352.394 3.565 20 0 FHADHM O=C(Cc1nc(-c2ccccc2)cs1)N=c1cc([C@H]2CCCO2)[n-][nH]1 ZINC000616824722 520165346 /nfs/dbraw/zinc/16/53/46/520165346.db2.gz MSMCOWCFEJQZCY-OAHLLOKOSA-N -1 3 354.435 3.566 20 0 FHADHM COc1cccc(-c2c(C)[n-][nH]c2=NC(=O)c2noc3c2CCCC3)c1 ZINC000629694485 522397784 /nfs/dbraw/zinc/39/77/84/522397784.db2.gz VQFWOOOESFRGMR-UHFFFAOYSA-N -1 3 352.394 3.513 20 0 FHADHM CCCc1ncc[n-]c1=NC(=O)c1cc2c(C(F)F)nn(C)c2s1 ZINC000622966616 523587537 /nfs/dbraw/zinc/58/75/37/523587537.db2.gz CMQWQSXIRZMICW-UHFFFAOYSA-N -1 3 351.382 3.567 20 0 FHADHM O=C(Nc1cccc(Oc2ccncc2)c1)c1c[n-]c2ccccc2c1=O ZINC000601735297 567821273 /nfs/dbraw/zinc/82/12/73/567821273.db2.gz QJARHDODYAXQQB-UHFFFAOYSA-N -1 3 357.369 3.968 20 0 FHADHM O=C(Nc1cccc(Oc2ccncc2)c1)c1cnc2ccccc2c1[O-] ZINC000601735297 567821274 /nfs/dbraw/zinc/82/12/74/567821274.db2.gz QJARHDODYAXQQB-UHFFFAOYSA-N -1 3 357.369 3.968 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@H]1C(=O)Nc1cccc(-c2nc(C)cc(=O)[n-]2)c1 ZINC000161790732 567964865 /nfs/dbraw/zinc/96/48/65/567964865.db2.gz AMGAEMQNFPQEJB-HZPDHXFCSA-N -1 3 365.458 3.857 20 0 FHADHM Cc1cc([N-]C(=O)[C@@H](C)Nc2cc(C)n(-c3cccc(Cl)c3)n2)on1 ZINC000188614198 567993864 /nfs/dbraw/zinc/99/38/64/567993864.db2.gz MGCQJHOWXOINCT-GFCCVEGCSA-N -1 3 359.817 3.570 20 0 FHADHM CN(CCc1ccccc1C(=O)[O-])Cc1ccc(Br)s1 ZINC000228512967 568109830 /nfs/dbraw/zinc/10/98/30/568109830.db2.gz GDPFKRKHOSYFSR-UHFFFAOYSA-N -1 3 354.269 3.883 20 0 FHADHM COC(=O)c1cc(NC(=O)c2cc(-c3ccc(C)o3)[n-]n2)ccc1Cl ZINC000603685580 568135474 /nfs/dbraw/zinc/13/54/74/568135474.db2.gz GDTLMMMSJLLIGA-UHFFFAOYSA-N -1 3 359.769 3.670 20 0 FHADHM COC(=O)c1cc(NC(=O)c2cc(-c3ccc(C)o3)n[n-]2)ccc1Cl ZINC000603685580 568135475 /nfs/dbraw/zinc/13/54/75/568135475.db2.gz GDTLMMMSJLLIGA-UHFFFAOYSA-N -1 3 359.769 3.670 20 0 FHADHM C[C@H]([N-]S(=O)(=O)c1cccnc1C(F)(F)F)[C@@H](C)c1ccccc1 ZINC000672388625 568171430 /nfs/dbraw/zinc/17/14/30/568171430.db2.gz DFQRMHHQIVLPSQ-NEPJUHHUSA-N -1 3 358.385 3.571 20 0 FHADHM O=c1cc(CN[C@@H](c2c[nH]c3ccccc32)C(F)(F)F)nc(C2CC2)[n-]1 ZINC000563105904 568191665 /nfs/dbraw/zinc/19/16/65/568191665.db2.gz MPGLEZAQKJOVIC-INIZCTEOSA-N -1 3 362.355 3.934 20 0 FHADHM CCN(Cc1nc(=O)c2cc(-c3ccccc3)sc2[n-]1)C[C@@H]1CCOC1 ZINC000604052250 568206703 /nfs/dbraw/zinc/20/67/03/568206703.db2.gz IBPGNCNFNSCCIX-AWEZNQCLSA-N -1 3 369.490 3.922 20 0 FHADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CCC(C2(O)CC2)CC1 ZINC000652662377 568328383 /nfs/dbraw/zinc/32/83/83/568328383.db2.gz QGEYNEOQPGMVBF-UHFFFAOYSA-N -1 3 365.473 3.555 20 0 FHADHM CC(C)[C@H](CC1CCCC1)C(=O)Nc1ccc(F)c([N-]S(C)(=O)=O)c1 ZINC000604739341 568359242 /nfs/dbraw/zinc/35/92/42/568359242.db2.gz LIWXNEISCDJIIB-HNNXBMFYSA-N -1 3 370.490 3.988 20 0 FHADHM Cc1cc(S(=O)(=O)[N-]c2cccc(-n3ccnc3)c2)ccc1OC(C)C ZINC000604839466 568375489 /nfs/dbraw/zinc/37/54/89/568375489.db2.gz GTEKAMVNAZJPBP-UHFFFAOYSA-N -1 3 371.462 3.769 20 0 FHADHM CCc1ccc(CC)c(C(=O)CSc2n[n-]c(-c3ccccn3)n2)c1 ZINC000604933187 568395397 /nfs/dbraw/zinc/39/53/97/568395397.db2.gz JJFTVZABBMVFKB-UHFFFAOYSA-N -1 3 352.463 3.967 20 0 FHADHM O=C(N[C@@H](c1ccccc1)c1ccc2c(c1)CCCO2)c1csc(=O)[n-]1 ZINC000365299850 568450116 /nfs/dbraw/zinc/45/01/16/568450116.db2.gz QNVNEHDTRHSNLO-SFHVURJKSA-N -1 3 366.442 3.693 20 0 FHADHM CO[C@@H](CC(C)C)CS(=O)(=O)[N-]c1ccc(COC(C)(C)C)cc1 ZINC000643269552 568450352 /nfs/dbraw/zinc/45/03/52/568450352.db2.gz XYRHKIYOXXLNPS-KRWDZBQOSA-N -1 3 357.516 3.805 20 0 FHADHM CN(C(=O)c1csc(=O)[n-]1)[C@@H](c1ccc(Cl)cc1)c1cccnc1 ZINC000365311063 568479774 /nfs/dbraw/zinc/47/97/74/568479774.db2.gz WCOQHJQZMHFCIT-HNNXBMFYSA-N -1 3 359.838 3.759 20 0 FHADHM O=S(=O)([N-][C@@H]1CSc2ccccc21)c1ccccc1C(F)(F)F ZINC000605164070 568592677 /nfs/dbraw/zinc/59/26/77/568592677.db2.gz HXXYSURCNMRVQQ-GFCCVEGCSA-N -1 3 359.394 3.831 20 0 FHADHM O=S(=O)(Cc1cc(-c2ccccc2)no1)[N-][C@@H]1CSc2ccccc21 ZINC000605164366 568592816 /nfs/dbraw/zinc/59/28/16/568592816.db2.gz ZFAWWNCANHMPKH-QGZVFWFLSA-N -1 3 372.471 3.608 20 0 FHADHM Cc1ccc([N-]S(C)(=O)=O)c(NC(=O)C[C@]23CCCC[C@H]2C3(F)F)c1 ZINC000669204096 568645586 /nfs/dbraw/zinc/64/55/86/568645586.db2.gz FRALZZDQLMSTMH-GDBMZVCRSA-N -1 3 372.437 3.521 20 0 FHADHM Cc1ccc([N-]S(C)(=O)=O)c(NC(=O)[C@@H]2C[C@H]2c2ccc(C)c(C)c2)c1 ZINC000669204671 568652434 /nfs/dbraw/zinc/65/24/34/568652434.db2.gz KHTKVLXLKYFOCM-DLBZAZTESA-N -1 3 372.490 3.726 20 0 FHADHM O=C(NCC1(c2cccs2)CCCCC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000738043183 598836629 /nfs/dbraw/zinc/83/66/29/598836629.db2.gz AHXRKCMFVQUTIV-UHFFFAOYSA-N -1 3 367.478 3.560 20 0 FHADHM O=C(NCC1(c2cccs2)CCCCC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000738043183 598836631 /nfs/dbraw/zinc/83/66/31/598836631.db2.gz AHXRKCMFVQUTIV-UHFFFAOYSA-N -1 3 367.478 3.560 20 0 FHADHM Clc1cccc(C2(CNc3ncc(-c4nnn[n-]4)cc3Cl)CC2)c1 ZINC000737573218 598856095 /nfs/dbraw/zinc/85/60/95/598856095.db2.gz CBBCEDXNNOXDJW-UHFFFAOYSA-N -1 3 361.236 3.712 20 0 FHADHM Clc1cccc(C2(CNc3ncc(-c4nn[n-]n4)cc3Cl)CC2)c1 ZINC000737573218 598856096 /nfs/dbraw/zinc/85/60/96/598856096.db2.gz CBBCEDXNNOXDJW-UHFFFAOYSA-N -1 3 361.236 3.712 20 0 FHADHM C[C@H](Sc1ccc(-c2nnn[n-]2)cc1)c1nc(Cc2ccccc2)no1 ZINC000736189871 598858229 /nfs/dbraw/zinc/85/82/29/598858229.db2.gz CSIKRGYLCPSZGI-LBPRGKRZSA-N -1 3 364.434 3.694 20 0 FHADHM C[C@H](Sc1ccc(-c2nn[n-]n2)cc1)c1nc(Cc2ccccc2)no1 ZINC000736189871 598858231 /nfs/dbraw/zinc/85/82/31/598858231.db2.gz CSIKRGYLCPSZGI-LBPRGKRZSA-N -1 3 364.434 3.694 20 0 FHADHM CCSc1cccc(NC(=S)Nc2ccccc2-c2nnn[n-]2)c1 ZINC000736667942 598861332 /nfs/dbraw/zinc/86/13/32/598861332.db2.gz SGISQSOXHVDWFC-UHFFFAOYSA-N -1 3 356.480 3.788 20 0 FHADHM CCSc1cccc(NC(=S)Nc2ccccc2-c2nn[n-]n2)c1 ZINC000736667942 598861334 /nfs/dbraw/zinc/86/13/34/598861334.db2.gz SGISQSOXHVDWFC-UHFFFAOYSA-N -1 3 356.480 3.788 20 0 FHADHM Fc1cc2ncc(Oc3ccc(-c4nnn[n-]4)cc3Cl)nc2cc1F ZINC000737650094 598896506 /nfs/dbraw/zinc/89/65/06/598896506.db2.gz FZNGKHPWBOWKAU-UHFFFAOYSA-N -1 3 360.711 3.534 20 0 FHADHM Fc1cc2ncc(Oc3ccc(-c4nn[n-]n4)cc3Cl)nc2cc1F ZINC000737650094 598896508 /nfs/dbraw/zinc/89/65/08/598896508.db2.gz FZNGKHPWBOWKAU-UHFFFAOYSA-N -1 3 360.711 3.534 20 0 FHADHM CCCCOCCSc1nc(-c2ccccc2)ccc1-c1nnn[n-]1 ZINC000736463388 598901556 /nfs/dbraw/zinc/90/15/56/598901556.db2.gz MJNJLCHNWYGRJW-UHFFFAOYSA-N -1 3 355.467 3.838 20 0 FHADHM CCCCOCCSc1nc(-c2ccccc2)ccc1-c1nn[n-]n1 ZINC000736463388 598901558 /nfs/dbraw/zinc/90/15/58/598901558.db2.gz MJNJLCHNWYGRJW-UHFFFAOYSA-N -1 3 355.467 3.838 20 0 FHADHM CCN(C(=O)[C@@H](C)CC1CCCC1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736502892 598903282 /nfs/dbraw/zinc/90/32/82/598903282.db2.gz QLKGLUZKXYOZAY-GJZGRUSLSA-N -1 3 355.486 3.993 20 0 FHADHM CCN(C(=O)[C@@H](C)CC1CCCC1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736502892 598903283 /nfs/dbraw/zinc/90/32/83/598903283.db2.gz QLKGLUZKXYOZAY-GJZGRUSLSA-N -1 3 355.486 3.993 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)C=C1CCC(C)CC1 ZINC000736478560 598926418 /nfs/dbraw/zinc/92/64/18/598926418.db2.gz DKBSVXOMZCVXAE-UHFFFAOYSA-N -1 3 353.470 3.742 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)C=C1CCC(C)CC1 ZINC000736478560 598926420 /nfs/dbraw/zinc/92/64/20/598926420.db2.gz DKBSVXOMZCVXAE-UHFFFAOYSA-N -1 3 353.470 3.742 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1OCCSc1ccccc1Cl ZINC000737032795 598938230 /nfs/dbraw/zinc/93/82/30/598938230.db2.gz OSZRRELJYBCNKF-UHFFFAOYSA-N -1 3 362.842 3.700 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1OCCSc1ccccc1Cl ZINC000737032795 598938232 /nfs/dbraw/zinc/93/82/32/598938232.db2.gz OSZRRELJYBCNKF-UHFFFAOYSA-N -1 3 362.842 3.700 20 0 FHADHM CC(C)C[C@@H]1CCCCCN1C(=O)C=Cc1ccccc1-c1nnn[n-]1 ZINC000735796170 598943348 /nfs/dbraw/zinc/94/33/48/598943348.db2.gz VVQVNZANZMHXHF-FLVLSHQESA-N -1 3 353.470 3.697 20 0 FHADHM CC(C)C[C@@H]1CCCCCN1C(=O)C=Cc1ccccc1-c1nn[n-]n1 ZINC000735796170 598943350 /nfs/dbraw/zinc/94/33/50/598943350.db2.gz VVQVNZANZMHXHF-FLVLSHQESA-N -1 3 353.470 3.697 20 0 FHADHM Fc1ccccc1[C@H](Cc1ccccc1)Nc1ccc(-c2nnn[n-]2)cn1 ZINC000737665617 598976071 /nfs/dbraw/zinc/97/60/71/598976071.db2.gz SSURQFLPPLNPGX-SFHVURJKSA-N -1 3 360.396 3.797 20 0 FHADHM Fc1ccccc1[C@H](Cc1ccccc1)Nc1ccc(-c2nn[n-]n2)cn1 ZINC000737665617 598976072 /nfs/dbraw/zinc/97/60/72/598976072.db2.gz SSURQFLPPLNPGX-SFHVURJKSA-N -1 3 360.396 3.797 20 0 FHADHM Cc1ccc(C(=O)Nc2ccccc2-c2nnn[n-]2)cc1Oc1ccncc1 ZINC000737316498 598980691 /nfs/dbraw/zinc/98/06/91/598980691.db2.gz XJRMFFBRVNJVNN-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccc(C(=O)Nc2ccccc2-c2nn[n-]n2)cc1Oc1ccncc1 ZINC000737316498 598980693 /nfs/dbraw/zinc/98/06/93/598980693.db2.gz XJRMFFBRVNJVNN-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1cc(F)ccc1N(Cc1ccon1)Cc1cccc(-c2nnn[n-]2)c1 ZINC000737270573 598986520 /nfs/dbraw/zinc/98/65/20/598986520.db2.gz MSEIXZJMVINYIF-UHFFFAOYSA-N -1 3 364.384 3.509 20 0 FHADHM Cc1cc(F)ccc1N(Cc1ccon1)Cc1cccc(-c2nn[n-]n2)c1 ZINC000737270573 598986521 /nfs/dbraw/zinc/98/65/21/598986521.db2.gz MSEIXZJMVINYIF-UHFFFAOYSA-N -1 3 364.384 3.509 20 0 FHADHM Cc1c(NCc2ccc(Br)s2)cccc1-c1nnn[n-]1 ZINC000822121242 607256595 /nfs/dbraw/zinc/25/65/95/607256595.db2.gz BVTJUILXDUMNND-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM Cc1c(NCc2ccc(Br)s2)cccc1-c1nn[n-]n1 ZINC000822121242 607256596 /nfs/dbraw/zinc/25/65/96/607256596.db2.gz BVTJUILXDUMNND-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM CC[C@H](NC(=S)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1cccs1 ZINC000736370142 599013849 /nfs/dbraw/zinc/01/38/49/599013849.db2.gz MJBBVNFFJKYZPS-LBPRGKRZSA-N -1 3 362.459 3.505 20 0 FHADHM CC[C@H](NC(=S)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1cccs1 ZINC000736370142 599013851 /nfs/dbraw/zinc/01/38/51/599013851.db2.gz MJBBVNFFJKYZPS-LBPRGKRZSA-N -1 3 362.459 3.505 20 0 FHADHM COC(=O)[C@H](C)CSCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000736895579 599014370 /nfs/dbraw/zinc/01/43/70/599014370.db2.gz YNPUEHMXIUZHOU-CYBMUJFWSA-N -1 3 368.462 3.576 20 0 FHADHM COC(=O)[C@H](C)CSCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000736895579 599014372 /nfs/dbraw/zinc/01/43/72/599014372.db2.gz YNPUEHMXIUZHOU-CYBMUJFWSA-N -1 3 368.462 3.576 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@H]2C(=O)OCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000735922225 599016762 /nfs/dbraw/zinc/01/67/62/599016762.db2.gz CVOVCMRKFBNBCD-RBUKOAKNSA-N -1 3 362.433 3.837 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@H]2C(=O)OCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000735922225 599016764 /nfs/dbraw/zinc/01/67/64/599016764.db2.gz CVOVCMRKFBNBCD-RBUKOAKNSA-N -1 3 362.433 3.837 20 0 FHADHM CC(C)C[C@@H](C(=O)OCc1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000735756456 599019097 /nfs/dbraw/zinc/01/90/97/599019097.db2.gz ONQXUUCNPKOYOM-GOSISDBHSA-N -1 3 350.422 3.740 20 0 FHADHM CC(C)C[C@@H](C(=O)OCc1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000735756456 599019099 /nfs/dbraw/zinc/01/90/99/599019099.db2.gz ONQXUUCNPKOYOM-GOSISDBHSA-N -1 3 350.422 3.740 20 0 FHADHM CC[C@@H]1CCC[C@@H](NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)C1 ZINC000736398238 599023827 /nfs/dbraw/zinc/02/38/27/599023827.db2.gz ZUCVPAJQXFDHMA-RHSMWYFYSA-N -1 3 368.485 3.510 20 0 FHADHM CC[C@@H]1CCC[C@@H](NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)C1 ZINC000736398238 599023829 /nfs/dbraw/zinc/02/38/29/599023829.db2.gz ZUCVPAJQXFDHMA-RHSMWYFYSA-N -1 3 368.485 3.510 20 0 FHADHM CC[C@H]1CCC[C@H](NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)C1 ZINC000736398240 599023595 /nfs/dbraw/zinc/02/35/95/599023595.db2.gz ZUCVPAJQXFDHMA-YOEHRIQHSA-N -1 3 368.485 3.510 20 0 FHADHM CC[C@H]1CCC[C@H](NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)C1 ZINC000736398240 599023597 /nfs/dbraw/zinc/02/35/97/599023597.db2.gz ZUCVPAJQXFDHMA-YOEHRIQHSA-N -1 3 368.485 3.510 20 0 FHADHM CC(C)Oc1ccc(CCCOC(=O)c2sccc2-c2nnn[n-]2)cc1 ZINC000735915601 599026164 /nfs/dbraw/zinc/02/61/64/599026164.db2.gz QQVZOHJDCNKSRU-UHFFFAOYSA-N -1 3 372.450 3.505 20 0 FHADHM CC1(C)CCCN(c2c(-c3nnn[n-]3)cnc3c(F)ccc(F)c32)CC1 ZINC000820594893 599038059 /nfs/dbraw/zinc/03/80/59/599038059.db2.gz FDNLUNQJQAQXTB-UHFFFAOYSA-N -1 3 358.396 3.710 20 0 FHADHM CC1(C)CCCN(c2c(-c3nn[n-]n3)cnc3c(F)ccc(F)c32)CC1 ZINC000820594893 599038061 /nfs/dbraw/zinc/03/80/61/599038061.db2.gz FDNLUNQJQAQXTB-UHFFFAOYSA-N -1 3 358.396 3.710 20 0 FHADHM CC[C@@H](CNc1nc(C(F)(F)F)ccc1-c1nnn[n-]1)c1ccccc1 ZINC000736351499 599039086 /nfs/dbraw/zinc/03/90/86/599039086.db2.gz QJIAATIWPWENAE-NSHDSACASA-N -1 3 362.359 3.886 20 0 FHADHM CC[C@@H](CNc1nc(C(F)(F)F)ccc1-c1nn[n-]n1)c1ccccc1 ZINC000736351499 599039088 /nfs/dbraw/zinc/03/90/88/599039088.db2.gz QJIAATIWPWENAE-NSHDSACASA-N -1 3 362.359 3.886 20 0 FHADHM CN(Cc1ccc(Cl)cc1)c1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000736816228 599039521 /nfs/dbraw/zinc/03/95/21/599039521.db2.gz AUJCJEBMCZVMDA-UHFFFAOYSA-N -1 3 368.750 3.570 20 0 FHADHM CN(Cc1ccc(Cl)cc1)c1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000736816228 599039524 /nfs/dbraw/zinc/03/95/24/599039524.db2.gz AUJCJEBMCZVMDA-UHFFFAOYSA-N -1 3 368.750 3.570 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(NCc2cc3ccccc3o2)n1 ZINC000737635008 599044669 /nfs/dbraw/zinc/04/46/69/599044669.db2.gz CRNULWUDBBPPNC-UHFFFAOYSA-N -1 3 360.299 3.639 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(NCc2cc3ccccc3o2)n1 ZINC000737635008 599044673 /nfs/dbraw/zinc/04/46/73/599044673.db2.gz CRNULWUDBBPPNC-UHFFFAOYSA-N -1 3 360.299 3.639 20 0 FHADHM Cc1cccc([C@@H](C)CNc2nc(C(F)(F)F)ccc2-c2nnn[n-]2)c1 ZINC000737386054 599046542 /nfs/dbraw/zinc/04/65/42/599046542.db2.gz AHKBFQZGIWZKGL-NSHDSACASA-N -1 3 362.359 3.805 20 0 FHADHM Cc1cccc([C@@H](C)CNc2nc(C(F)(F)F)ccc2-c2nn[n-]n2)c1 ZINC000737386054 599046545 /nfs/dbraw/zinc/04/65/45/599046545.db2.gz AHKBFQZGIWZKGL-NSHDSACASA-N -1 3 362.359 3.805 20 0 FHADHM CC(C)(C)C[C@H]1CCCN1c1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000735604042 599047462 /nfs/dbraw/zinc/04/74/62/599047462.db2.gz QZBZKSOGOGHVGK-SNVBAGLBSA-N -1 3 354.380 3.686 20 0 FHADHM CC(C)(C)C[C@H]1CCCN1c1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000735604042 599047467 /nfs/dbraw/zinc/04/74/67/599047467.db2.gz QZBZKSOGOGHVGK-SNVBAGLBSA-N -1 3 354.380 3.686 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(NCCc2ccccc2Cl)n1 ZINC000737634907 599050229 /nfs/dbraw/zinc/05/02/29/599050229.db2.gz BFQZFKFINVSVDI-UHFFFAOYSA-N -1 3 368.750 3.589 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(NCCc2ccccc2Cl)n1 ZINC000737634907 599050232 /nfs/dbraw/zinc/05/02/32/599050232.db2.gz BFQZFKFINVSVDI-UHFFFAOYSA-N -1 3 368.750 3.589 20 0 FHADHM CC(C)(CNc1nc(C(F)(F)F)ccc1-c1nnn[n-]1)c1cccs1 ZINC000735671052 599055427 /nfs/dbraw/zinc/05/54/27/599055427.db2.gz KOHBGARFNPLMAT-UHFFFAOYSA-N -1 3 368.388 3.732 20 0 FHADHM CC(C)(CNc1nc(C(F)(F)F)ccc1-c1nn[n-]n1)c1cccs1 ZINC000735671052 599055430 /nfs/dbraw/zinc/05/54/30/599055430.db2.gz KOHBGARFNPLMAT-UHFFFAOYSA-N -1 3 368.388 3.732 20 0 FHADHM CC[C@H]1c2ccccc2CCN1c1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000736411464 599056903 /nfs/dbraw/zinc/05/69/03/599056903.db2.gz OFFMFSPUQLUKEB-AWEZNQCLSA-N -1 3 374.370 3.794 20 0 FHADHM CC[C@H]1c2ccccc2CCN1c1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000736411464 599056906 /nfs/dbraw/zinc/05/69/06/599056906.db2.gz OFFMFSPUQLUKEB-AWEZNQCLSA-N -1 3 374.370 3.794 20 0 FHADHM Cc1cccc([C@H](C)CNC(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c1 ZINC000737391305 599058903 /nfs/dbraw/zinc/05/89/03/599058903.db2.gz ZPLJSDSXAGPHAM-GFCCVEGCSA-N -1 3 370.844 3.754 20 0 FHADHM Cc1cccc([C@H](C)CNC(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c1 ZINC000737391305 599058907 /nfs/dbraw/zinc/05/89/07/599058907.db2.gz ZPLJSDSXAGPHAM-GFCCVEGCSA-N -1 3 370.844 3.754 20 0 FHADHM Cc1nnc(N[C@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)c(-c2nnn[n-]2)c1C ZINC000822510115 599055455 /nfs/dbraw/zinc/05/54/55/599055455.db2.gz JMSCHOIDRFFRSH-FVLGBLRTSA-N -1 3 369.860 3.736 20 0 FHADHM Cc1nnc(N[C@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)c(-c2nn[n-]n2)c1C ZINC000822510115 599055457 /nfs/dbraw/zinc/05/54/57/599055457.db2.gz JMSCHOIDRFFRSH-FVLGBLRTSA-N -1 3 369.860 3.736 20 0 FHADHM Cc1ccc(N2CCC[C@@H](Nc3c(F)cc(-c4nnn[n-]4)cc3F)C2)cc1 ZINC000822242814 599066085 /nfs/dbraw/zinc/06/60/85/599066085.db2.gz YOWJZAIILUAGFZ-CQSZACIVSA-N -1 3 370.407 3.534 20 0 FHADHM Cc1ccc(N2CCC[C@@H](Nc3c(F)cc(-c4nn[n-]n4)cc3F)C2)cc1 ZINC000822242814 599066088 /nfs/dbraw/zinc/06/60/88/599066088.db2.gz YOWJZAIILUAGFZ-CQSZACIVSA-N -1 3 370.407 3.534 20 0 FHADHM CCN(C(=O)[C@@H]1C[C@@H]1C1CCCCC1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736503455 599070583 /nfs/dbraw/zinc/07/05/83/599070583.db2.gz XCASBCPPFYAFEG-GDIGMMSISA-N -1 3 367.497 3.993 20 0 FHADHM CCN(C(=O)[C@@H]1C[C@@H]1C1CCCCC1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736503455 599070586 /nfs/dbraw/zinc/07/05/86/599070586.db2.gz XCASBCPPFYAFEG-GDIGMMSISA-N -1 3 367.497 3.993 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1N1CC[C@H](CSc2ccccc2)C1 ZINC000822743710 599088435 /nfs/dbraw/zinc/08/84/35/599088435.db2.gz DZFORBICFQHDQJ-ZDUSSCGKSA-N -1 3 355.442 3.624 20 0 FHADHM Cc1cccc([C@@H]2CCCN2C(=O)c2sccc2-c2nnn[n-]2)c1C ZINC000737389070 599103223 /nfs/dbraw/zinc/10/32/23/599103223.db2.gz IFLNCTHDBDQMPY-HNNXBMFYSA-N -1 3 353.451 3.522 20 0 FHADHM Cc1cccc([C@@H]2CCCN2C(=O)c2sccc2-c2nn[n-]n2)c1C ZINC000737389070 599103225 /nfs/dbraw/zinc/10/32/25/599103225.db2.gz IFLNCTHDBDQMPY-HNNXBMFYSA-N -1 3 353.451 3.522 20 0 FHADHM C[C@@H](CCC1CCCCC1)NC(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000735986969 599103290 /nfs/dbraw/zinc/10/32/90/599103290.db2.gz UZAJUALQMALWTD-GJZGRUSLSA-N -1 3 370.501 3.976 20 0 FHADHM C[C@@H](CCC1CCCCC1)NC(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000735986969 599103291 /nfs/dbraw/zinc/10/32/91/599103291.db2.gz UZAJUALQMALWTD-GJZGRUSLSA-N -1 3 370.501 3.976 20 0 FHADHM Clc1cc(CSc2ccccc2-c2nnn[n-]2)cc2c1OCCCO2 ZINC000737566523 599111486 /nfs/dbraw/zinc/11/14/86/599111486.db2.gz UNIQFUVAWNLDNO-UHFFFAOYSA-N -1 3 374.853 3.974 20 0 FHADHM Clc1cc(CSc2ccccc2-c2nn[n-]n2)cc2c1OCCCO2 ZINC000737566523 599111489 /nfs/dbraw/zinc/11/14/89/599111489.db2.gz UNIQFUVAWNLDNO-UHFFFAOYSA-N -1 3 374.853 3.974 20 0 FHADHM CCO[C@@H]1C[C@@H](Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)C12CCC2 ZINC000736611643 599120100 /nfs/dbraw/zinc/12/01/00/599120100.db2.gz JYIDDQCTGFPLHD-ZIAGYGMSSA-N -1 3 367.375 3.645 20 0 FHADHM CCO[C@@H]1C[C@@H](Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)C12CCC2 ZINC000736611643 599120101 /nfs/dbraw/zinc/12/01/01/599120101.db2.gz JYIDDQCTGFPLHD-ZIAGYGMSSA-N -1 3 367.375 3.645 20 0 FHADHM CC(C)[C@@H](C)SCCC(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2 ZINC000820020072 599129330 /nfs/dbraw/zinc/12/93/30/599129330.db2.gz APQDTEVRKFRRTI-SNVBAGLBSA-N -1 3 365.528 3.523 20 0 FHADHM CC(C)[C@@H](C)SCCC(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2 ZINC000820020072 599129333 /nfs/dbraw/zinc/12/93/33/599129333.db2.gz APQDTEVRKFRRTI-SNVBAGLBSA-N -1 3 365.528 3.523 20 0 FHADHM CCc1nc(C)c([C@H](C)N(C)Cc2cc(-c3nn[n-]n3)ccc2F)s1 ZINC000736700536 599135121 /nfs/dbraw/zinc/13/51/21/599135121.db2.gz VBVWIIHETCSTEM-NSHDSACASA-N -1 3 360.462 3.526 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)C=Cc1cnc(C(C)(C)C)s1 ZINC000822216653 599149343 /nfs/dbraw/zinc/14/93/43/599149343.db2.gz VWVFDJTXJQVLLQ-FPLPWBNLSA-N -1 3 368.466 3.581 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)C=Cc1cnc(C(C)(C)C)s1 ZINC000822216653 599149345 /nfs/dbraw/zinc/14/93/45/599149345.db2.gz VWVFDJTXJQVLLQ-FPLPWBNLSA-N -1 3 368.466 3.581 20 0 FHADHM CCn1c2ccc(Cl)cc2nc1-c1ccc(OC)c(-c2nnn[n-]2)c1 ZINC000821563840 599156404 /nfs/dbraw/zinc/15/64/04/599156404.db2.gz IGCRTVCHTRPTCQ-UHFFFAOYSA-N -1 3 354.801 3.565 20 0 FHADHM CCn1c2ccc(Cl)cc2nc1-c1ccc(OC)c(-c2nn[n-]n2)c1 ZINC000821563840 599156407 /nfs/dbraw/zinc/15/64/07/599156407.db2.gz IGCRTVCHTRPTCQ-UHFFFAOYSA-N -1 3 354.801 3.565 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)C[C@H](C)c1ccccc1C ZINC000736633884 599160671 /nfs/dbraw/zinc/16/06/71/599160671.db2.gz FXUYYDQVPYILDV-AWEZNQCLSA-N -1 3 365.437 3.706 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)C[C@H](C)c1ccccc1C ZINC000736633884 599160673 /nfs/dbraw/zinc/16/06/73/599160673.db2.gz FXUYYDQVPYILDV-AWEZNQCLSA-N -1 3 365.437 3.706 20 0 FHADHM Cc1ccccc1[C@H](C)CC(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000737424692 599161591 /nfs/dbraw/zinc/16/15/91/599161591.db2.gz WSDXZJOKYRWFPS-CQSZACIVSA-N -1 3 366.469 3.864 20 0 FHADHM Cc1ccccc1[C@H](C)CC(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000737424692 599161594 /nfs/dbraw/zinc/16/15/94/599161594.db2.gz WSDXZJOKYRWFPS-CQSZACIVSA-N -1 3 366.469 3.864 20 0 FHADHM Fc1ccccc1-c1cnc(COc2ccc(-c3nnn[n-]3)cc2Cl)o1 ZINC000737663626 599162874 /nfs/dbraw/zinc/16/28/74/599162874.db2.gz JGJIUMDCEFGBSG-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM Fc1ccccc1-c1cnc(COc2ccc(-c3nn[n-]n3)cc2Cl)o1 ZINC000737663626 599162876 /nfs/dbraw/zinc/16/28/76/599162876.db2.gz JGJIUMDCEFGBSG-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM CCc1ccccc1NC(=O)[C@@H](C)Sc1ccc(-c2nnn[n-]2)cc1F ZINC000736702923 599169283 /nfs/dbraw/zinc/16/92/83/599169283.db2.gz ZJJUYHNOBSVFGL-LLVKDONJSA-N -1 3 371.441 3.688 20 0 FHADHM CCc1ccccc1NC(=O)[C@@H](C)Sc1ccc(-c2nn[n-]n2)cc1F ZINC000736702923 599169284 /nfs/dbraw/zinc/16/92/84/599169284.db2.gz ZJJUYHNOBSVFGL-LLVKDONJSA-N -1 3 371.441 3.688 20 0 FHADHM Fc1cc(F)c2ncc(-c3nnn[n-]3)c(N3CCC[C@H]3c3ccco3)c2c1 ZINC000737645308 599170021 /nfs/dbraw/zinc/17/00/21/599170021.db2.gz WZKMBJZCXWFFOF-AWEZNQCLSA-N -1 3 368.347 3.628 20 0 FHADHM Fc1cc(F)c2ncc(-c3nn[n-]n3)c(N3CCC[C@H]3c3ccco3)c2c1 ZINC000737645308 599170023 /nfs/dbraw/zinc/17/00/23/599170023.db2.gz WZKMBJZCXWFFOF-AWEZNQCLSA-N -1 3 368.347 3.628 20 0 FHADHM CC[C@@H](CC(=O)NCc1cc(-c2nnn[n-]2)ccc1F)c1ccc(C)cc1 ZINC000820882045 599170707 /nfs/dbraw/zinc/17/07/07/599170707.db2.gz ILBHXHDYXAQRMS-AWEZNQCLSA-N -1 3 367.428 3.514 20 0 FHADHM CC[C@@H](CC(=O)NCc1cc(-c2nn[n-]n2)ccc1F)c1ccc(C)cc1 ZINC000820882045 599170709 /nfs/dbraw/zinc/17/07/09/599170709.db2.gz ILBHXHDYXAQRMS-AWEZNQCLSA-N -1 3 367.428 3.514 20 0 FHADHM CC(C)(C)C1CCN(c2nc(C(F)(F)F)ccc2-c2nnn[n-]2)CC1 ZINC000735597993 599171022 /nfs/dbraw/zinc/17/10/22/599171022.db2.gz VUFJTDNAUJYXSJ-UHFFFAOYSA-N -1 3 354.380 3.543 20 0 FHADHM CC(C)(C)C1CCN(c2nc(C(F)(F)F)ccc2-c2nn[n-]n2)CC1 ZINC000735597993 599171024 /nfs/dbraw/zinc/17/10/24/599171024.db2.gz VUFJTDNAUJYXSJ-UHFFFAOYSA-N -1 3 354.380 3.543 20 0 FHADHM CC[C@H](CC(=O)NCc1cc(-c2nnn[n-]2)ccc1F)c1ccc(C)cc1 ZINC000820882046 599171269 /nfs/dbraw/zinc/17/12/69/599171269.db2.gz ILBHXHDYXAQRMS-CQSZACIVSA-N -1 3 367.428 3.514 20 0 FHADHM CC[C@H](CC(=O)NCc1cc(-c2nn[n-]n2)ccc1F)c1ccc(C)cc1 ZINC000820882046 599171270 /nfs/dbraw/zinc/17/12/70/599171270.db2.gz ILBHXHDYXAQRMS-CQSZACIVSA-N -1 3 367.428 3.514 20 0 FHADHM S=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)N1C2CCCC1CCC2 ZINC000738400977 599176099 /nfs/dbraw/zinc/17/60/99/599176099.db2.gz MOXZQSUTGZOFGA-UHFFFAOYSA-N -1 3 362.890 3.624 20 0 FHADHM S=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)N1C2CCCC1CCC2 ZINC000738400977 599176100 /nfs/dbraw/zinc/17/61/00/599176100.db2.gz MOXZQSUTGZOFGA-UHFFFAOYSA-N -1 3 362.890 3.624 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCC2)c1cccc(F)c1 ZINC000735570299 599177543 /nfs/dbraw/zinc/17/75/43/599177543.db2.gz NDSRULCLDXEDNT-SNVBAGLBSA-N -1 3 371.441 3.688 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCC2)c1cccc(F)c1 ZINC000735570299 599177545 /nfs/dbraw/zinc/17/75/45/599177545.db2.gz NDSRULCLDXEDNT-SNVBAGLBSA-N -1 3 371.441 3.688 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1cccc(Cl)c1 ZINC000735550722 599179613 /nfs/dbraw/zinc/17/96/13/599179613.db2.gz KSGCBEZRCOHIRX-SECBINFHSA-N -1 3 362.220 3.916 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1cccc(Cl)c1 ZINC000735550722 599179616 /nfs/dbraw/zinc/17/96/16/599179616.db2.gz KSGCBEZRCOHIRX-SECBINFHSA-N -1 3 362.220 3.916 20 0 FHADHM CCN(C(=O)[C@H](C)c1cccc(F)c1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736503354 599182865 /nfs/dbraw/zinc/18/28/65/599182865.db2.gz VPOSXCUOUZCBGA-KGLIPLIRSA-N -1 3 367.428 3.719 20 0 FHADHM CCN(C(=O)[C@H](C)c1cccc(F)c1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736503354 599182867 /nfs/dbraw/zinc/18/28/67/599182867.db2.gz VPOSXCUOUZCBGA-KGLIPLIRSA-N -1 3 367.428 3.719 20 0 FHADHM CN(C(=O)Cc1ccc(-c2nnn[n-]2)cc1)c1ccc(-c2ccccc2)cc1 ZINC000821571019 599193068 /nfs/dbraw/zinc/19/30/68/599193068.db2.gz WBAHVCOMGBIPSF-UHFFFAOYSA-N -1 3 369.428 3.739 20 0 FHADHM CN(C(=O)Cc1ccc(-c2nn[n-]n2)cc1)c1ccc(-c2ccccc2)cc1 ZINC000821571019 599193070 /nfs/dbraw/zinc/19/30/70/599193070.db2.gz WBAHVCOMGBIPSF-UHFFFAOYSA-N -1 3 369.428 3.739 20 0 FHADHM CC(C)CNC(=O)c1cccc(Oc2cccc(Cl)c2-c2nnn[n-]2)c1 ZINC000735837953 599193576 /nfs/dbraw/zinc/19/35/76/599193576.db2.gz ADGRKSIFOCHRCO-UHFFFAOYSA-N -1 3 371.828 3.698 20 0 FHADHM CN(C(=O)c1cccc(Oc2cccc(Cl)c2-c2nnn[n-]2)c1)C1CC1 ZINC000736740826 599194336 /nfs/dbraw/zinc/19/43/36/599194336.db2.gz GJYFHHRUUGIMST-UHFFFAOYSA-N -1 3 369.812 3.547 20 0 FHADHM COCCN(C(=O)CCCC1CCCCC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736988282 599203617 /nfs/dbraw/zinc/20/36/17/599203617.db2.gz JLUMFLSOVLVULB-UHFFFAOYSA-N -1 3 371.485 3.597 20 0 FHADHM COCCN(C(=O)CCCC1CCCCC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736988282 599203619 /nfs/dbraw/zinc/20/36/19/599203619.db2.gz JLUMFLSOVLVULB-UHFFFAOYSA-N -1 3 371.485 3.597 20 0 FHADHM CCc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)c2cccc(-c3nnn[n-]3)c2)o1 ZINC000821482515 599220780 /nfs/dbraw/zinc/22/07/80/599220780.db2.gz SEKAQZAYGKTODU-GUYCJALGSA-N -1 3 365.437 3.636 20 0 FHADHM CCc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)c2cccc(-c3nn[n-]n3)c2)o1 ZINC000821482515 599220783 /nfs/dbraw/zinc/22/07/83/599220783.db2.gz SEKAQZAYGKTODU-GUYCJALGSA-N -1 3 365.437 3.636 20 0 FHADHM CCc1ccc([C@@H]2C[C@H](C)CCN2C(=O)c2sccc2-c2nnn[n-]2)o1 ZINC000821480824 599220864 /nfs/dbraw/zinc/22/08/64/599220864.db2.gz FIWQVMBYGDGAMO-RISCZKNCSA-N -1 3 371.466 3.697 20 0 FHADHM CCc1ccc([C@@H]2C[C@H](C)CCN2C(=O)c2sccc2-c2nn[n-]n2)o1 ZINC000821480824 599220867 /nfs/dbraw/zinc/22/08/67/599220867.db2.gz FIWQVMBYGDGAMO-RISCZKNCSA-N -1 3 371.466 3.697 20 0 FHADHM C[C@@H](SCC(=O)N(C1CC1)C1CCCC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820548469 599222494 /nfs/dbraw/zinc/22/24/94/599222494.db2.gz ALCRKMWQPYLNDA-CYBMUJFWSA-N -1 3 371.510 3.595 20 0 FHADHM C[C@@H](SCC(=O)N(C1CC1)C1CCCC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820548469 599222496 /nfs/dbraw/zinc/22/24/96/599222496.db2.gz ALCRKMWQPYLNDA-CYBMUJFWSA-N -1 3 371.510 3.595 20 0 FHADHM O=C(CCSCc1ccccc1Cl)Nc1cccc(-c2nnn[n-]2)c1 ZINC000822974386 599223847 /nfs/dbraw/zinc/22/38/47/599223847.db2.gz JWYZSJQWSLMQGK-UHFFFAOYSA-N -1 3 373.869 3.782 20 0 FHADHM O=C(CCSCc1ccccc1Cl)Nc1cccc(-c2nn[n-]n2)c1 ZINC000822974386 599223849 /nfs/dbraw/zinc/22/38/49/599223849.db2.gz JWYZSJQWSLMQGK-UHFFFAOYSA-N -1 3 373.869 3.782 20 0 FHADHM C[C@H](CCSc1ccccc1)OC(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000820249159 607260952 /nfs/dbraw/zinc/26/09/52/607260952.db2.gz SPZRSVOTOXPHFY-CYBMUJFWSA-N -1 3 354.435 3.594 20 0 FHADHM C[C@H](CCSc1ccccc1)OC(=O)c1cccc(-c2nn[n-]n2)c1 ZINC000820249159 607260953 /nfs/dbraw/zinc/26/09/53/607260953.db2.gz SPZRSVOTOXPHFY-CYBMUJFWSA-N -1 3 354.435 3.594 20 0 FHADHM CS[C@@H]1CCC[C@H](Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)C1 ZINC000737180447 599233448 /nfs/dbraw/zinc/23/34/48/599233448.db2.gz QSSUPUQRIOGQJH-GXSJLCMTSA-N -1 3 357.405 3.972 20 0 FHADHM CS[C@@H]1CCC[C@H](Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)C1 ZINC000737180447 599233450 /nfs/dbraw/zinc/23/34/50/599233450.db2.gz QSSUPUQRIOGQJH-GXSJLCMTSA-N -1 3 357.405 3.972 20 0 FHADHM CS[C@H]1CCC[C@H](Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)C1 ZINC000737180450 599233651 /nfs/dbraw/zinc/23/36/51/599233651.db2.gz QSSUPUQRIOGQJH-ONGXEEELSA-N -1 3 357.405 3.972 20 0 FHADHM CS[C@H]1CCC[C@H](Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)C1 ZINC000737180450 599233652 /nfs/dbraw/zinc/23/36/52/599233652.db2.gz QSSUPUQRIOGQJH-ONGXEEELSA-N -1 3 357.405 3.972 20 0 FHADHM C[C@@H]1C[C@H]1[C@@H](NC(=O)c1ccc(-c2nnn[n-]2)cc1)c1ccc(Cl)cc1 ZINC000736237202 599226613 /nfs/dbraw/zinc/22/66/13/599226613.db2.gz VCGVRRNTTKJAPJ-LQAWEQHXSA-N -1 3 367.840 3.647 20 0 FHADHM C[C@@H]1C[C@H]1[C@@H](NC(=O)c1ccc(-c2nn[n-]n2)cc1)c1ccc(Cl)cc1 ZINC000736237202 599226616 /nfs/dbraw/zinc/22/66/16/599226616.db2.gz VCGVRRNTTKJAPJ-LQAWEQHXSA-N -1 3 367.840 3.647 20 0 FHADHM Cc1c(NC(=O)c2ccc(SC(F)F)cc2)cccc1-c1nnn[n-]1 ZINC000822107648 607267348 /nfs/dbraw/zinc/26/73/48/607267348.db2.gz AVDKUVXYZQNDKB-UHFFFAOYSA-N -1 3 361.377 3.742 20 0 FHADHM Cc1c(NC(=O)c2ccc(SC(F)F)cc2)cccc1-c1nn[n-]n1 ZINC000822107648 607267349 /nfs/dbraw/zinc/26/73/49/607267349.db2.gz AVDKUVXYZQNDKB-UHFFFAOYSA-N -1 3 361.377 3.742 20 0 FHADHM Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccc(-c3nnn[n-]3)cc2)c1C ZINC000822299769 599242031 /nfs/dbraw/zinc/24/20/31/599242031.db2.gz UTVAXTADVZSULB-SFHVURJKSA-N -1 3 362.437 3.853 20 0 FHADHM Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccc(-c3nn[n-]n3)cc2)c1C ZINC000822299769 599242035 /nfs/dbraw/zinc/24/20/35/599242035.db2.gz UTVAXTADVZSULB-SFHVURJKSA-N -1 3 362.437 3.853 20 0 FHADHM CC(C)c1ccccc1NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820198416 599242466 /nfs/dbraw/zinc/24/24/66/599242466.db2.gz VEPXPJKZNTWPDH-ZDUSSCGKSA-N -1 3 350.426 3.873 20 0 FHADHM CC(C)c1ccccc1NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820198416 599242469 /nfs/dbraw/zinc/24/24/69/599242469.db2.gz VEPXPJKZNTWPDH-ZDUSSCGKSA-N -1 3 350.426 3.873 20 0 FHADHM Cc1c(NC(=O)c2ccc(Oc3ccccc3)nc2)cccc1-c1nnn[n-]1 ZINC000822108418 607268969 /nfs/dbraw/zinc/26/89/69/607268969.db2.gz JAOYCIOEUHMFPG-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1c(NC(=O)c2ccc(Oc3ccccc3)nc2)cccc1-c1nn[n-]n1 ZINC000822108418 607268970 /nfs/dbraw/zinc/26/89/70/607268970.db2.gz JAOYCIOEUHMFPG-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)N[C@@H]1CC[C@H]2CCC[C@H]2C1 ZINC000823308464 599251680 /nfs/dbraw/zinc/25/16/80/599251680.db2.gz BDYKAQNHOWRFAW-GRYCIOLGSA-N -1 3 360.849 3.610 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)N[C@@H]1CC[C@H]2CCC[C@H]2C1 ZINC000823308464 599251682 /nfs/dbraw/zinc/25/16/82/599251682.db2.gz BDYKAQNHOWRFAW-GRYCIOLGSA-N -1 3 360.849 3.610 20 0 FHADHM Cc1c(NC(=O)N[C@@H](C)c2ccc(F)c(Cl)c2)cccc1-c1nnn[n-]1 ZINC000822090664 607281588 /nfs/dbraw/zinc/28/15/88/607281588.db2.gz LPFHIIXIEFZUEZ-JTQLQIEISA-N -1 3 374.807 3.850 20 0 FHADHM Cc1c(NC(=O)N[C@@H](C)c2ccc(F)c(Cl)c2)cccc1-c1nn[n-]n1 ZINC000822090664 607281589 /nfs/dbraw/zinc/28/15/89/607281589.db2.gz LPFHIIXIEFZUEZ-JTQLQIEISA-N -1 3 374.807 3.850 20 0 FHADHM CC[C@@H](NC(=O)Nc1cccc(-c2nnn[n-]2)c1C)c1ccc(F)cc1F ZINC000820920326 607288010 /nfs/dbraw/zinc/28/80/10/607288010.db2.gz OZWIWXSVLOOPOW-OAHLLOKOSA-N -1 3 372.379 3.726 20 0 FHADHM CC[C@@H](NC(=O)Nc1cccc(-c2nn[n-]n2)c1C)c1ccc(F)cc1F ZINC000820920326 607288011 /nfs/dbraw/zinc/28/80/11/607288011.db2.gz OZWIWXSVLOOPOW-OAHLLOKOSA-N -1 3 372.379 3.726 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@@H]2c2ccc(F)cc2)cccc1-c1nnn[n-]1 ZINC000822084327 607285323 /nfs/dbraw/zinc/28/53/23/607285323.db2.gz IYTVEQUVHCMNFR-QGZVFWFLSA-N -1 3 366.400 3.683 20 0 FHADHM Cc1c(NC(=O)N2CCC[C@@H]2c2ccc(F)cc2)cccc1-c1nn[n-]n1 ZINC000822084327 607285324 /nfs/dbraw/zinc/28/53/24/607285324.db2.gz IYTVEQUVHCMNFR-QGZVFWFLSA-N -1 3 366.400 3.683 20 0 FHADHM Cc1c(NC(=O)N[C@H](c2cccs2)C2CC2)cccc1-c1nnn[n-]1 ZINC000822089962 607285743 /nfs/dbraw/zinc/28/57/43/607285743.db2.gz HZGJVWMSCZCFIC-HNNXBMFYSA-N -1 3 354.439 3.509 20 0 FHADHM Cc1c(NC(=O)N[C@H](c2cccs2)C2CC2)cccc1-c1nn[n-]n1 ZINC000822089962 607285744 /nfs/dbraw/zinc/28/57/44/607285744.db2.gz HZGJVWMSCZCFIC-HNNXBMFYSA-N -1 3 354.439 3.509 20 0 FHADHM CCC[C@H](NC(=O)Nc1cccc(-c2nnn[n-]2)c1C)c1ccccc1 ZINC000821020570 607287006 /nfs/dbraw/zinc/28/70/06/607287006.db2.gz FFWHMLBZFRQDGA-KRWDZBQOSA-N -1 3 350.426 3.838 20 0 FHADHM CCC[C@H](NC(=O)Nc1cccc(-c2nn[n-]n2)c1C)c1ccccc1 ZINC000821020570 607287007 /nfs/dbraw/zinc/28/70/07/607287007.db2.gz FFWHMLBZFRQDGA-KRWDZBQOSA-N -1 3 350.426 3.838 20 0 FHADHM Cc1c(NC(=O)N2CCCCC[C@@H]2c2ccco2)cccc1-c1nnn[n-]1 ZINC000822084488 607289922 /nfs/dbraw/zinc/28/99/22/607289922.db2.gz LBHOSHNZELYQSD-MRXNPFEDSA-N -1 3 366.425 3.917 20 0 FHADHM Cc1c(NC(=O)N2CCCCC[C@@H]2c2ccco2)cccc1-c1nn[n-]n1 ZINC000822084488 607289923 /nfs/dbraw/zinc/28/99/23/607289923.db2.gz LBHOSHNZELYQSD-MRXNPFEDSA-N -1 3 366.425 3.917 20 0 FHADHM Cc1c(NC(=O)N2CCC(C3CCCC3)CC2)cccc1-c1nnn[n-]1 ZINC000822084856 607293273 /nfs/dbraw/zinc/29/32/73/607293273.db2.gz QLRWKCURKREOGL-UHFFFAOYSA-N -1 3 354.458 3.609 20 0 FHADHM Cc1c(NC(=O)N2CCC(C3CCCC3)CC2)cccc1-c1nn[n-]n1 ZINC000822084856 607293274 /nfs/dbraw/zinc/29/32/74/607293274.db2.gz QLRWKCURKREOGL-UHFFFAOYSA-N -1 3 354.458 3.609 20 0 FHADHM C[C@@H](NC(=O)N1CCC(C2CCCC2)CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820342919 599259140 /nfs/dbraw/zinc/25/91/40/599259140.db2.gz YQVNEWPNXCZADZ-CQSZACIVSA-N -1 3 368.485 3.540 20 0 FHADHM C[C@@H](NC(=O)N1CCC(C2CCCC2)CC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820342919 599259142 /nfs/dbraw/zinc/25/91/42/599259142.db2.gz YQVNEWPNXCZADZ-CQSZACIVSA-N -1 3 368.485 3.540 20 0 FHADHM Cc1ccc(Cl)c(O[C@H](C)C(=O)Nc2cccc(-c3nnn[n-]3)c2C)c1 ZINC000822240142 607294418 /nfs/dbraw/zinc/29/44/18/607294418.db2.gz UIUIJKBOKBXAFM-GFCCVEGCSA-N -1 3 371.828 3.543 20 0 FHADHM Cc1ccc(Cl)c(O[C@H](C)C(=O)Nc2cccc(-c3nn[n-]n3)c2C)c1 ZINC000822240142 607294419 /nfs/dbraw/zinc/29/44/19/607294419.db2.gz UIUIJKBOKBXAFM-GFCCVEGCSA-N -1 3 371.828 3.543 20 0 FHADHM Cc1c(NC(=O)[C@H](C)Sc2ccc(Cl)cc2)cccc1-c1nnn[n-]1 ZINC000822060201 607295772 /nfs/dbraw/zinc/29/57/72/607295772.db2.gz GBVLFRTZOQIYEY-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM Cc1c(NC(=O)[C@H](C)Sc2ccc(Cl)cc2)cccc1-c1nn[n-]n1 ZINC000822060201 607295773 /nfs/dbraw/zinc/29/57/73/607295773.db2.gz GBVLFRTZOQIYEY-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM CC(C)(C)c1nc2cc(NCc3ccc(-c4nnn[n-]4)s3)ccc2o1 ZINC000819965368 607309599 /nfs/dbraw/zinc/30/95/99/607309599.db2.gz DARVVDDTEFZKRS-UHFFFAOYSA-N -1 3 354.439 3.979 20 0 FHADHM COc1ccc(CNc2cccc(-c3nccs3)c2)cc1-c1nnn[n-]1 ZINC000821821585 607313429 /nfs/dbraw/zinc/31/34/29/607313429.db2.gz MEUUVYJXEDMDAP-UHFFFAOYSA-N -1 3 364.434 3.611 20 0 FHADHM COc1ccc(CNc2cccc(-c3nccs3)c2)cc1-c1nn[n-]n1 ZINC000821821585 607313430 /nfs/dbraw/zinc/31/34/30/607313430.db2.gz MEUUVYJXEDMDAP-UHFFFAOYSA-N -1 3 364.434 3.611 20 0 FHADHM c1c(-c2ccc(NCc3cccc(-c4nnn[n-]4)c3)cc2)nc2n1CCCC2 ZINC000823751920 607314760 /nfs/dbraw/zinc/31/47/60/607314760.db2.gz RPEFTLSDKCCDDY-UHFFFAOYSA-N -1 3 371.448 3.679 20 0 FHADHM c1c(-c2ccc(NCc3cccc(-c4nn[n-]n4)c3)cc2)nc2n1CCCC2 ZINC000823751920 607314761 /nfs/dbraw/zinc/31/47/61/607314761.db2.gz RPEFTLSDKCCDDY-UHFFFAOYSA-N -1 3 371.448 3.679 20 0 FHADHM c1ccc(C2CCN(c3c(-c4nnn[n-]4)cnc4ccccc43)CC2)cc1 ZINC000738429099 599266222 /nfs/dbraw/zinc/26/62/22/599266222.db2.gz TYMWJABFJMQSEX-UHFFFAOYSA-N -1 3 356.433 3.799 20 0 FHADHM c1ccc(C2CCN(c3c(-c4nn[n-]n4)cnc4ccccc43)CC2)cc1 ZINC000738429099 599266225 /nfs/dbraw/zinc/26/62/25/599266225.db2.gz TYMWJABFJMQSEX-UHFFFAOYSA-N -1 3 356.433 3.799 20 0 FHADHM c1nc(COc2ccccc2NCc2cccc(-c3nnn[n-]3)c2)cs1 ZINC000823751299 607316546 /nfs/dbraw/zinc/31/65/46/607316546.db2.gz FARQZHZQAUFLOZ-UHFFFAOYSA-N -1 3 364.434 3.514 20 0 FHADHM c1nc(COc2ccccc2NCc2cccc(-c3nn[n-]n3)c2)cs1 ZINC000823751299 607316547 /nfs/dbraw/zinc/31/65/47/607316547.db2.gz FARQZHZQAUFLOZ-UHFFFAOYSA-N -1 3 364.434 3.514 20 0 FHADHM c1nc(COc2cccc(NCc3ccc(-c4nnn[n-]4)cc3)c2)cs1 ZINC000823757381 607316597 /nfs/dbraw/zinc/31/65/97/607316597.db2.gz QBOVZRUSSSBVKQ-UHFFFAOYSA-N -1 3 364.434 3.514 20 0 FHADHM c1nc(COc2cccc(NCc3ccc(-c4nn[n-]n4)cc3)c2)cs1 ZINC000823757381 607316598 /nfs/dbraw/zinc/31/65/98/607316598.db2.gz QBOVZRUSSSBVKQ-UHFFFAOYSA-N -1 3 364.434 3.514 20 0 FHADHM CC[C@H](Cc1ccccc1)N(C)C(=O)Nc1cc(-c2nnn[n-]2)ccc1C ZINC000820914926 599268730 /nfs/dbraw/zinc/26/87/30/599268730.db2.gz SBNAMFLDWHUBAQ-QGZVFWFLSA-N -1 3 364.453 3.660 20 0 FHADHM CC[C@H](Cc1ccccc1)N(C)C(=O)Nc1cc(-c2nn[n-]n2)ccc1C ZINC000820914926 599268732 /nfs/dbraw/zinc/26/87/32/599268732.db2.gz SBNAMFLDWHUBAQ-QGZVFWFLSA-N -1 3 364.453 3.660 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1ccc(C)c(C)c1 ZINC000736487075 599276772 /nfs/dbraw/zinc/27/67/72/599276772.db2.gz BTXKZCBCEVMBOH-UHFFFAOYSA-N -1 3 350.426 3.558 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)N[C@@H](CC1CC1)c1ccccc1 ZINC000823333173 599280690 /nfs/dbraw/zinc/28/06/90/599280690.db2.gz ZJWWJRCQEYTOTJ-KRWDZBQOSA-N -1 3 366.400 3.669 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)N[C@@H](CC1CC1)c1ccccc1 ZINC000823333173 599280692 /nfs/dbraw/zinc/28/06/92/599280692.db2.gz ZJWWJRCQEYTOTJ-KRWDZBQOSA-N -1 3 366.400 3.669 20 0 FHADHM C[C@H](Sc1nnc(-c2ccccc2)n1C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736190327 599286836 /nfs/dbraw/zinc/28/68/36/599286836.db2.gz CYZDBXBSNXRCJM-LBPRGKRZSA-N -1 3 363.450 3.516 20 0 FHADHM C[C@H](Sc1nnc(-c2ccccc2)n1C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736190327 599286837 /nfs/dbraw/zinc/28/68/37/599286837.db2.gz CYZDBXBSNXRCJM-LBPRGKRZSA-N -1 3 363.450 3.516 20 0 FHADHM Cc1c(NC(=O)c2cc(Cl)nc3ccccc32)cccc1-c1nnn[n-]1 ZINC000822107726 607321037 /nfs/dbraw/zinc/32/10/37/607321037.db2.gz CIQFFCIWTYQAEJ-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1c(NC(=O)c2cc(Cl)nc3ccccc32)cccc1-c1nn[n-]n1 ZINC000822107726 607321038 /nfs/dbraw/zinc/32/10/38/607321038.db2.gz CIQFFCIWTYQAEJ-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM CC(C)[C@@H](Sc1ccc(-c2nn[n-]n2)cc1Cl)C(=O)NC(C)(C)C ZINC000824206926 607844157 /nfs/dbraw/zinc/84/41/57/607844157.db2.gz LZRJJAKTYXEJNB-CYBMUJFWSA-N -1 3 367.906 3.552 20 0 FHADHM COc1cccc(Oc2ccc(CNCc3cccc(C(=O)[O-])c3)cn2)c1 ZINC000820870990 598202925 /nfs/dbraw/zinc/20/29/25/598202925.db2.gz KKLMLHVAMJVBIH-UHFFFAOYSA-N -1 3 364.401 3.871 20 0 FHADHM CC(C)c1ccc(C(C)(C)NC(=O)c2sccc2-c2nnn[n-]2)cc1 ZINC000735921995 598239083 /nfs/dbraw/zinc/23/90/83/598239083.db2.gz DIBIUGOEDUYYLU-UHFFFAOYSA-N -1 3 355.467 3.717 20 0 FHADHM CC(C)c1ccc(C(C)(C)NC(=O)c2sccc2-c2nn[n-]n2)cc1 ZINC000735921995 598239084 /nfs/dbraw/zinc/23/90/84/598239084.db2.gz DIBIUGOEDUYYLU-UHFFFAOYSA-N -1 3 355.467 3.717 20 0 FHADHM Fc1cccc(N2CCC[C@@H](c3cc4ccccc4[nH]3)C2)c1-c1nnn[n-]1 ZINC000737659453 598239975 /nfs/dbraw/zinc/23/99/75/598239975.db2.gz DGQUNXZJKSIMJZ-CQSZACIVSA-N -1 3 362.412 3.871 20 0 FHADHM Fc1cccc(N2CCC[C@@H](c3cc4ccccc4[nH]3)C2)c1-c1nn[n-]n1 ZINC000737659453 598239976 /nfs/dbraw/zinc/23/99/76/598239976.db2.gz DGQUNXZJKSIMJZ-CQSZACIVSA-N -1 3 362.412 3.871 20 0 FHADHM FC(F)(F)c1cc(-c2nn[n-]n2)ccc1N1CCC[C@H](C(F)(F)F)C1 ZINC000737625470 598274441 /nfs/dbraw/zinc/27/44/41/598274441.db2.gz AJRGQOSFACBTKP-VIFPVBQESA-N -1 3 365.281 3.664 20 0 FHADHM CC[C@@H](NC(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C)c1ccccc1 ZINC000736366175 598281202 /nfs/dbraw/zinc/28/12/02/598281202.db2.gz ZUCWNNWNLHSTKC-OAHLLOKOSA-N -1 3 367.457 3.696 20 0 FHADHM CC[C@@H](NC(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C)c1ccccc1 ZINC000736366175 598281203 /nfs/dbraw/zinc/28/12/03/598281203.db2.gz ZUCWNNWNLHSTKC-OAHLLOKOSA-N -1 3 367.457 3.696 20 0 FHADHM C[C@@H](NC(=O)N(C)CCC1CCCCC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736110246 598283287 /nfs/dbraw/zinc/28/32/87/598283287.db2.gz GRZNZMZVRLSHNK-CQSZACIVSA-N -1 3 356.474 3.540 20 0 FHADHM C[C@@H](NC(=O)N(C)CCC1CCCCC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736110246 598283289 /nfs/dbraw/zinc/28/32/89/598283289.db2.gz GRZNZMZVRLSHNK-CQSZACIVSA-N -1 3 356.474 3.540 20 0 FHADHM CC(C)N(C(=O)c1ccc(-c2nnn[n-]2)cc1)c1ccc(F)cc1Cl ZINC000735857218 598310518 /nfs/dbraw/zinc/31/05/18/598310518.db2.gz PCLOVFUXYJFUIJ-UHFFFAOYSA-N -1 3 359.792 3.714 20 0 FHADHM CC(C)N(C(=O)c1ccc(-c2nn[n-]n2)cc1)c1ccc(F)cc1Cl ZINC000735857218 598310520 /nfs/dbraw/zinc/31/05/20/598310520.db2.gz PCLOVFUXYJFUIJ-UHFFFAOYSA-N -1 3 359.792 3.714 20 0 FHADHM C[C@H](SCc1cccc(-c2nnn[n-]2)c1)c1nc(-c2cccs2)no1 ZINC000736189101 598313267 /nfs/dbraw/zinc/31/32/67/598313267.db2.gz ANTJBDMWGDQOOR-JTQLQIEISA-N -1 3 370.463 3.973 20 0 FHADHM C[C@H](SCc1cccc(-c2nn[n-]n2)c1)c1nc(-c2cccs2)no1 ZINC000736189101 598313268 /nfs/dbraw/zinc/31/32/68/598313268.db2.gz ANTJBDMWGDQOOR-JTQLQIEISA-N -1 3 370.463 3.973 20 0 FHADHM O=C(CS[C@@H]1CCCc2ccccc21)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000737932135 598316189 /nfs/dbraw/zinc/31/61/89/598316189.db2.gz JWAUCIWZVGODJJ-QGZVFWFLSA-N -1 3 365.462 3.616 20 0 FHADHM O=C(CS[C@@H]1CCCc2ccccc21)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000737932135 598316192 /nfs/dbraw/zinc/31/61/92/598316192.db2.gz JWAUCIWZVGODJJ-QGZVFWFLSA-N -1 3 365.462 3.616 20 0 FHADHM O=C(c1ccc(C(F)F)cc1)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000738258984 598326180 /nfs/dbraw/zinc/32/61/80/598326180.db2.gz TZBIJNSIBWUFSG-UHFFFAOYSA-N -1 3 369.375 3.609 20 0 FHADHM O=C(c1ccc(C(F)F)cc1)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000738258984 598326181 /nfs/dbraw/zinc/32/61/81/598326181.db2.gz TZBIJNSIBWUFSG-UHFFFAOYSA-N -1 3 369.375 3.609 20 0 FHADHM CCN(C(=O)c1nccc2ccccc21)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736507212 598330477 /nfs/dbraw/zinc/33/04/77/598330477.db2.gz BRSNGHURXULVOX-CQSZACIVSA-N -1 3 372.432 3.638 20 0 FHADHM CCN(C(=O)c1nccc2ccccc21)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736507212 598330478 /nfs/dbraw/zinc/33/04/78/598330478.db2.gz BRSNGHURXULVOX-CQSZACIVSA-N -1 3 372.432 3.638 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H]2CCCc3sccc32)c1-c1nnn[n-]1 ZINC000821465046 607350779 /nfs/dbraw/zinc/35/07/79/607350779.db2.gz AIEAJFNSNWXLQQ-GFCCVEGCSA-N -1 3 373.507 3.919 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H]2CCCc3sccc32)c1-c1nn[n-]n1 ZINC000821465046 607350781 /nfs/dbraw/zinc/35/07/81/607350781.db2.gz AIEAJFNSNWXLQQ-GFCCVEGCSA-N -1 3 373.507 3.919 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)cc1CSc1nnc(-c2ccccc2)s1 ZINC000737653051 598359671 /nfs/dbraw/zinc/35/96/71/598359671.db2.gz YKHQNHCKJFBIQP-UHFFFAOYSA-N -1 3 370.438 3.817 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CSc1nnc(-c2ccccc2)s1 ZINC000737653051 598359672 /nfs/dbraw/zinc/35/96/72/598359672.db2.gz YKHQNHCKJFBIQP-UHFFFAOYSA-N -1 3 370.438 3.817 20 0 FHADHM CCCCN(Cc1ccccc1Cl)C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000736455653 598366470 /nfs/dbraw/zinc/36/64/70/598366470.db2.gz BVKJYAQAAOPCJX-UHFFFAOYSA-N -1 3 369.856 3.963 20 0 FHADHM CCCCN(Cc1ccccc1Cl)C(=O)c1cccc(-c2nn[n-]n2)c1 ZINC000736455653 598366472 /nfs/dbraw/zinc/36/64/72/598366472.db2.gz BVKJYAQAAOPCJX-UHFFFAOYSA-N -1 3 369.856 3.963 20 0 FHADHM O=C(OCc1cccc(-c2nnn[n-]2)c1)c1cc2cc(Cl)ccc2o1 ZINC000738233234 598367375 /nfs/dbraw/zinc/36/73/75/598367375.db2.gz RTOHXACLOCUAEP-UHFFFAOYSA-N -1 3 354.753 3.623 20 0 FHADHM O=C(OCc1cccc(-c2nn[n-]n2)c1)c1cc2cc(Cl)ccc2o1 ZINC000738233234 598367377 /nfs/dbraw/zinc/36/73/77/598367377.db2.gz RTOHXACLOCUAEP-UHFFFAOYSA-N -1 3 354.753 3.623 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)[C@@H](OC1CCCC1)c1ccccc1 ZINC000726933455 598379244 /nfs/dbraw/zinc/37/92/44/598379244.db2.gz MJWLIQJOBYTXQI-SFHVURJKSA-N -1 3 363.421 3.506 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)[C@@H](OC1CCCC1)c1ccccc1 ZINC000726933455 598379247 /nfs/dbraw/zinc/37/92/47/598379247.db2.gz MJWLIQJOBYTXQI-SFHVURJKSA-N -1 3 363.421 3.506 20 0 FHADHM Clc1ccc(CNc2ncc(-c3nnn[n-]3)cc2Cl)c(Cl)c1 ZINC000737576257 598386783 /nfs/dbraw/zinc/38/67/83/598386783.db2.gz OJEZUOXMWYVKHY-UHFFFAOYSA-N -1 3 355.616 3.834 20 0 FHADHM Clc1ccc(CNc2ncc(-c3nn[n-]n3)cc2Cl)c(Cl)c1 ZINC000737576257 598386785 /nfs/dbraw/zinc/38/67/85/598386785.db2.gz OJEZUOXMWYVKHY-UHFFFAOYSA-N -1 3 355.616 3.834 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1NCCc1cccc2ccccc21 ZINC000737559462 598390309 /nfs/dbraw/zinc/39/03/09/598390309.db2.gz YNWNCVSXRFFOBN-UHFFFAOYSA-N -1 3 350.813 3.723 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1NCCc1cccc2ccccc21 ZINC000737559462 598390311 /nfs/dbraw/zinc/39/03/11/598390311.db2.gz YNWNCVSXRFFOBN-UHFFFAOYSA-N -1 3 350.813 3.723 20 0 FHADHM Cc1ccc(C)c(CSCCC(=O)Nc2ccccc2-c2nnn[n-]2)c1 ZINC000737322778 598392869 /nfs/dbraw/zinc/39/28/69/598392869.db2.gz NLGFXEZTWROVPY-UHFFFAOYSA-N -1 3 367.478 3.746 20 0 FHADHM Cc1ccc(C)c(CSCCC(=O)Nc2ccccc2-c2nn[n-]n2)c1 ZINC000737322778 598392870 /nfs/dbraw/zinc/39/28/70/598392870.db2.gz NLGFXEZTWROVPY-UHFFFAOYSA-N -1 3 367.478 3.746 20 0 FHADHM Clc1ccc(-c2cnc(CNc3ccc(-c4nn[n-]n4)cc3)o2)cc1 ZINC000737562987 598416338 /nfs/dbraw/zinc/41/63/38/598416338.db2.gz BUPJMBJQPKLCIE-UHFFFAOYSA-N -1 3 352.785 3.787 20 0 FHADHM CSc1ccsc1C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000737193159 598419356 /nfs/dbraw/zinc/41/93/56/598419356.db2.gz YCWUMORMGWQRBH-UHFFFAOYSA-N -1 3 351.844 3.556 20 0 FHADHM CSc1ccsc1C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000737193159 598419357 /nfs/dbraw/zinc/41/93/57/598419357.db2.gz YCWUMORMGWQRBH-UHFFFAOYSA-N -1 3 351.844 3.556 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)Nc1cccc(F)c1F ZINC000735873158 598425321 /nfs/dbraw/zinc/42/53/21/598425321.db2.gz AGWOGJKBLQBAIY-UHFFFAOYSA-N -1 3 372.379 3.587 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)Nc1cccc(F)c1F ZINC000735873158 598425323 /nfs/dbraw/zinc/42/53/23/598425323.db2.gz AGWOGJKBLQBAIY-UHFFFAOYSA-N -1 3 372.379 3.587 20 0 FHADHM CC(C)[C@@H](Sc1ccccc1)C(=O)OCc1cccc(-c2nnn[n-]2)c1 ZINC000735733583 598425779 /nfs/dbraw/zinc/42/57/79/598425779.db2.gz BNWWIJUIWNEREE-QGZVFWFLSA-N -1 3 368.462 3.727 20 0 FHADHM CC(C)[C@@H](Sc1ccccc1)C(=O)OCc1cccc(-c2nn[n-]n2)c1 ZINC000735733583 598425781 /nfs/dbraw/zinc/42/57/81/598425781.db2.gz BNWWIJUIWNEREE-QGZVFWFLSA-N -1 3 368.462 3.727 20 0 FHADHM Cc1ccccc1NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C(C)C ZINC000737436326 598426520 /nfs/dbraw/zinc/42/65/20/598426520.db2.gz RSSUDVLMNBMPPK-UHFFFAOYSA-N -1 3 350.426 3.618 20 0 FHADHM Cc1ccccc1NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C(C)C ZINC000737436326 598426522 /nfs/dbraw/zinc/42/65/22/598426522.db2.gz RSSUDVLMNBMPPK-UHFFFAOYSA-N -1 3 350.426 3.618 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)NC1CCCCCC1 ZINC000735873587 598427466 /nfs/dbraw/zinc/42/74/66/598427466.db2.gz CPMKDTRKMAHYEM-UHFFFAOYSA-N -1 3 356.474 3.510 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)NC1CCCCCC1 ZINC000735873587 598427467 /nfs/dbraw/zinc/42/74/67/598427467.db2.gz CPMKDTRKMAHYEM-UHFFFAOYSA-N -1 3 356.474 3.510 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@H](C)c1cccs1 ZINC000736113168 598428009 /nfs/dbraw/zinc/42/80/09/598428009.db2.gz XSZSUBOVEXSLME-CYBMUJFWSA-N -1 3 370.482 3.609 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@H](C)c1cccs1 ZINC000736113168 598428011 /nfs/dbraw/zinc/42/80/11/598428011.db2.gz XSZSUBOVEXSLME-CYBMUJFWSA-N -1 3 370.482 3.609 20 0 FHADHM CCC1CCC(N(C)C(=O)N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000736397731 598429524 /nfs/dbraw/zinc/42/95/24/598429524.db2.gz XACPEPRYIJQYBD-CBCUQQMYSA-N -1 3 356.474 3.538 20 0 FHADHM CCC1CCC(N(C)C(=O)N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000736397731 598429525 /nfs/dbraw/zinc/42/95/25/598429525.db2.gz XACPEPRYIJQYBD-CBCUQQMYSA-N -1 3 356.474 3.538 20 0 FHADHM CCC1CCC(NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)CC1 ZINC000736394735 598429598 /nfs/dbraw/zinc/42/95/98/598429598.db2.gz FEOIFHSSIXHJHE-UHFFFAOYSA-N -1 3 370.501 3.756 20 0 FHADHM CCC1CCC(NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)CC1 ZINC000736394735 598429600 /nfs/dbraw/zinc/42/96/00/598429600.db2.gz FEOIFHSSIXHJHE-UHFFFAOYSA-N -1 3 370.501 3.756 20 0 FHADHM CC(C)c1noc(OCc2ccc(-c3ccccc3-c3nnn[n-]3)cc2)n1 ZINC000735953382 598434398 /nfs/dbraw/zinc/43/43/98/598434398.db2.gz JICPPFONXLHVKR-UHFFFAOYSA-N -1 3 362.393 3.619 20 0 FHADHM CC(C)c1noc(OCc2ccc(-c3ccccc3-c3nn[n-]n3)cc2)n1 ZINC000735953382 598434401 /nfs/dbraw/zinc/43/44/01/598434401.db2.gz JICPPFONXLHVKR-UHFFFAOYSA-N -1 3 362.393 3.619 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)[C@@H]1C[C@H]1c1cccc2ccccc21 ZINC000107583952 598435434 /nfs/dbraw/zinc/43/54/34/598435434.db2.gz JRIDAOCVIGCARV-RBUKOAKNSA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)[C@@H]1C[C@H]1c1cccc2ccccc21 ZINC000107583952 598435435 /nfs/dbraw/zinc/43/54/35/598435435.db2.gz JRIDAOCVIGCARV-RBUKOAKNSA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1sccc1-c1nnn[n-]1)[C@H]1C[C@H]1c1cccc2ccccc21 ZINC000738208298 598437374 /nfs/dbraw/zinc/43/73/74/598437374.db2.gz LIMMSVFEQWVMMS-HOTGVXAUSA-N -1 3 361.430 3.824 20 0 FHADHM O=C(Nc1sccc1-c1nn[n-]n1)[C@H]1C[C@H]1c1cccc2ccccc21 ZINC000738208298 598437376 /nfs/dbraw/zinc/43/73/76/598437376.db2.gz LIMMSVFEQWVMMS-HOTGVXAUSA-N -1 3 361.430 3.824 20 0 FHADHM CCn1c(CSc2ccc(-c3nnn[n-]3)cc2)nc2cc(F)ccc21 ZINC000736714090 598439507 /nfs/dbraw/zinc/43/95/07/598439507.db2.gz NONOAYNPMSLXRS-UHFFFAOYSA-N -1 3 354.414 3.668 20 0 FHADHM CCn1c(CSc2ccc(-c3nn[n-]n3)cc2)nc2cc(F)ccc21 ZINC000736714090 598439508 /nfs/dbraw/zinc/43/95/08/598439508.db2.gz NONOAYNPMSLXRS-UHFFFAOYSA-N -1 3 354.414 3.668 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1OC(=O)C=C(C)c1ccccc1Cl ZINC000737023113 598441246 /nfs/dbraw/zinc/44/12/46/598441246.db2.gz BEGHBPQFAHKQDV-LUAWRHEFSA-N -1 3 370.796 3.538 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1OC(=O)C=C(C)c1ccccc1Cl ZINC000737023113 598441248 /nfs/dbraw/zinc/44/12/48/598441248.db2.gz BEGHBPQFAHKQDV-LUAWRHEFSA-N -1 3 370.796 3.538 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)C[C@H]1C[C@H](C)CC(C)(C)C1 ZINC000737057803 598444017 /nfs/dbraw/zinc/44/40/17/598444017.db2.gz JQFJRVGOBACTNV-QWHCGFSZSA-N -1 3 357.458 3.666 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)C[C@H]1C[C@H](C)CC(C)(C)C1 ZINC000737057803 598444020 /nfs/dbraw/zinc/44/40/20/598444020.db2.gz JQFJRVGOBACTNV-QWHCGFSZSA-N -1 3 357.458 3.666 20 0 FHADHM CCN(C(=O)CSCc1ccc(-c2nnn[n-]2)cc1)[C@H]1CCCC[C@H]1C ZINC000736506194 598445094 /nfs/dbraw/zinc/44/50/94/598445094.db2.gz XQACSMNLKSZXBD-PBHICJAKSA-N -1 3 373.526 3.527 20 0 FHADHM CCN(C(=O)CSCc1ccc(-c2nn[n-]n2)cc1)[C@H]1CCCC[C@H]1C ZINC000736506194 598445095 /nfs/dbraw/zinc/44/50/95/598445095.db2.gz XQACSMNLKSZXBD-PBHICJAKSA-N -1 3 373.526 3.527 20 0 FHADHM Cc1ccc(F)c(NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)c1 ZINC000737345939 598475087 /nfs/dbraw/zinc/47/50/87/598475087.db2.gz XTVWOESOJXFAFN-UHFFFAOYSA-N -1 3 366.400 3.511 20 0 FHADHM Cc1ccc(F)c(NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)c1 ZINC000737345939 598475088 /nfs/dbraw/zinc/47/50/88/598475088.db2.gz XTVWOESOJXFAFN-UHFFFAOYSA-N -1 3 366.400 3.511 20 0 FHADHM O=C(OCc1ccccc1-c1nnn[n-]1)[C@@H]1C[C@@H]1c1cccc2ccccc21 ZINC000738235319 598475709 /nfs/dbraw/zinc/47/57/09/598475709.db2.gz QOGXVIJJEPQFPG-WOJBJXKFSA-N -1 3 370.412 3.867 20 0 FHADHM O=C(OCc1ccccc1-c1nn[n-]n1)[C@@H]1C[C@@H]1c1cccc2ccccc21 ZINC000738235319 598475711 /nfs/dbraw/zinc/47/57/11/598475711.db2.gz QOGXVIJJEPQFPG-WOJBJXKFSA-N -1 3 370.412 3.867 20 0 FHADHM CSCc1ccc(NC(=O)N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000737183319 598476815 /nfs/dbraw/zinc/47/68/15/598476815.db2.gz YDDAYLRVSCMUDP-LBPRGKRZSA-N -1 3 368.466 3.612 20 0 FHADHM CSCc1ccc(NC(=O)N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000737183319 598476816 /nfs/dbraw/zinc/47/68/16/598476816.db2.gz YDDAYLRVSCMUDP-LBPRGKRZSA-N -1 3 368.466 3.612 20 0 FHADHM C[C@@H](CC(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(F)cc1 ZINC000735977456 598482489 /nfs/dbraw/zinc/48/24/89/598482489.db2.gz OPYBIAVHPMZQDV-STQMWFEESA-N -1 3 354.385 3.804 20 0 FHADHM C[C@@H](CC(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(F)cc1 ZINC000735977456 598482491 /nfs/dbraw/zinc/48/24/91/598482491.db2.gz OPYBIAVHPMZQDV-STQMWFEESA-N -1 3 354.385 3.804 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)C=Cc1ccccc1Cl ZINC000735655456 598487661 /nfs/dbraw/zinc/48/76/61/598487661.db2.gz POSDIYAEQIEVDZ-HJWRWDBZSA-N -1 3 370.844 3.729 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)C=Cc1ccccc1Cl ZINC000735655456 598487662 /nfs/dbraw/zinc/48/76/62/598487662.db2.gz POSDIYAEQIEVDZ-HJWRWDBZSA-N -1 3 370.844 3.729 20 0 FHADHM C[C@@H](OC(=O)Cc1csc2ccccc12)c1cccc(-c2nnn[n-]2)c1 ZINC000736162022 598487833 /nfs/dbraw/zinc/48/78/33/598487833.db2.gz ZGOGRHOUDYVZFJ-GFCCVEGCSA-N -1 3 364.430 3.928 20 0 FHADHM C[C@@H](OC(=O)Cc1csc2ccccc12)c1cccc(-c2nn[n-]n2)c1 ZINC000736162022 598487835 /nfs/dbraw/zinc/48/78/35/598487835.db2.gz ZGOGRHOUDYVZFJ-GFCCVEGCSA-N -1 3 364.430 3.928 20 0 FHADHM COc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)C[C@H](C)CC(C)C ZINC000737025794 598494709 /nfs/dbraw/zinc/49/47/09/598494709.db2.gz NELZAGRVYOSQSM-SNVBAGLBSA-N -1 3 352.822 3.506 20 0 FHADHM COc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)C[C@H](C)CC(C)C ZINC000737025794 598494710 /nfs/dbraw/zinc/49/47/10/598494710.db2.gz NELZAGRVYOSQSM-SNVBAGLBSA-N -1 3 352.822 3.506 20 0 FHADHM Cc1ccc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CC[C@H](C)C3)cc1F ZINC000737316561 598495045 /nfs/dbraw/zinc/49/50/45/598495045.db2.gz YTGHRPFEADXGHN-VIFPVBQESA-N -1 3 371.441 3.753 20 0 FHADHM Cc1ccc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CC[C@H](C)C3)cc1F ZINC000737316561 598495047 /nfs/dbraw/zinc/49/50/47/598495047.db2.gz YTGHRPFEADXGHN-VIFPVBQESA-N -1 3 371.441 3.753 20 0 FHADHM O=C(c1cccc(-c2nnn[n-]2)c1)N1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000738265769 598496702 /nfs/dbraw/zinc/49/67/02/598496702.db2.gz CWJKCNSLXFJYJC-IBGZPJMESA-N -1 3 372.432 3.715 20 0 FHADHM O=C(c1cccc(-c2nn[n-]n2)c1)N1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000738265769 598496703 /nfs/dbraw/zinc/49/67/03/598496703.db2.gz CWJKCNSLXFJYJC-IBGZPJMESA-N -1 3 372.432 3.715 20 0 FHADHM c1c(CSc2ccnc3ccccc32)c(-c2nnn[n-]2)c2ccccn12 ZINC000738437678 598504587 /nfs/dbraw/zinc/50/45/87/598504587.db2.gz SLJIHRPNRXEEAL-UHFFFAOYSA-N -1 3 358.430 3.960 20 0 FHADHM c1c(CSc2ccnc3ccccc32)c(-c2nn[n-]n2)c2ccccn12 ZINC000738437678 598504589 /nfs/dbraw/zinc/50/45/89/598504589.db2.gz SLJIHRPNRXEEAL-UHFFFAOYSA-N -1 3 358.430 3.960 20 0 FHADHM COc1ccc(CCCNc2ccc(Cl)cc2-c2nnn[n-]2)cc1OC ZINC000737089342 598507660 /nfs/dbraw/zinc/50/76/60/598507660.db2.gz SITPNVOCKKIOGD-UHFFFAOYSA-N -1 3 373.844 3.582 20 0 FHADHM COc1ccc(CCCNc2ccc(Cl)cc2-c2nn[n-]n2)cc1OC ZINC000737089342 598507663 /nfs/dbraw/zinc/50/76/63/598507663.db2.gz SITPNVOCKKIOGD-UHFFFAOYSA-N -1 3 373.844 3.582 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)[C@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000521464920 598513408 /nfs/dbraw/zinc/51/34/08/598513408.db2.gz FSNVWUVHHIBMLG-OLZOCXBDSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)[C@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000521464920 598513410 /nfs/dbraw/zinc/51/34/10/598513410.db2.gz FSNVWUVHHIBMLG-OLZOCXBDSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)[C@@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000108769630 598532373 /nfs/dbraw/zinc/53/23/73/598532373.db2.gz PIKBQMYOZGOYDN-RBUKOAKNSA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)[C@@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000108769630 598532375 /nfs/dbraw/zinc/53/23/75/598532375.db2.gz PIKBQMYOZGOYDN-RBUKOAKNSA-N -1 3 355.401 3.762 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)O[C@@H]1CCc2ccc(Cl)cc21 ZINC000737799034 598538070 /nfs/dbraw/zinc/53/80/70/598538070.db2.gz ITKMTIMNVRRBRK-CGQZWFTASA-N -1 3 366.808 3.764 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)O[C@@H]1CCc2ccc(Cl)cc21 ZINC000737799034 598538072 /nfs/dbraw/zinc/53/80/72/598538072.db2.gz ITKMTIMNVRRBRK-CGQZWFTASA-N -1 3 366.808 3.764 20 0 FHADHM O=C(OC1CCCCC1)c1ccc(COc2ccc(-c3nn[n-]n3)cc2)o1 ZINC000738213033 598538354 /nfs/dbraw/zinc/53/83/54/598538354.db2.gz DNQAGLCWEKYFAY-UHFFFAOYSA-N -1 3 368.393 3.528 20 0 FHADHM Cc1ccc(C)c(CC(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCC3)c1 ZINC000737323235 598539732 /nfs/dbraw/zinc/53/97/32/598539732.db2.gz QVEAHBXNKUEBGR-UHFFFAOYSA-N -1 3 367.478 3.605 20 0 FHADHM Cc1ccc(C)c(CC(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCC3)c1 ZINC000737323235 598539734 /nfs/dbraw/zinc/53/97/34/598539734.db2.gz QVEAHBXNKUEBGR-UHFFFAOYSA-N -1 3 367.478 3.605 20 0 FHADHM CC(=CC(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(F)F)c1ccccc1 ZINC000735449451 598544744 /nfs/dbraw/zinc/54/47/44/598544744.db2.gz YOKMJNIBZDTAJF-LUAWRHEFSA-N -1 3 371.347 3.510 20 0 FHADHM CC(=CC(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(F)F)c1ccccc1 ZINC000735449451 598544745 /nfs/dbraw/zinc/54/47/45/598544745.db2.gz YOKMJNIBZDTAJF-LUAWRHEFSA-N -1 3 371.347 3.510 20 0 FHADHM Fc1ccc(-c2nc(COc3ccc(-c4nnn[n-]4)c(F)c3)cs2)cc1 ZINC000737650218 598552169 /nfs/dbraw/zinc/55/21/69/598552169.db2.gz GQRHFLUFRCDWSG-UHFFFAOYSA-N -1 3 371.372 3.847 20 0 FHADHM Fc1ccc(-c2nc(COc3ccc(-c4nn[n-]n4)c(F)c3)cs2)cc1 ZINC000737650218 598552170 /nfs/dbraw/zinc/55/21/70/598552170.db2.gz GQRHFLUFRCDWSG-UHFFFAOYSA-N -1 3 371.372 3.847 20 0 FHADHM CSC[C@H](C)C(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)cc1 ZINC000737179124 598553635 /nfs/dbraw/zinc/55/36/35/598553635.db2.gz HSNCNTLNNUQWBX-LBPRGKRZSA-N -1 3 369.450 3.597 20 0 FHADHM CSC[C@H](C)C(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)cc1 ZINC000737179124 598553637 /nfs/dbraw/zinc/55/36/37/598553637.db2.gz HSNCNTLNNUQWBX-LBPRGKRZSA-N -1 3 369.450 3.597 20 0 FHADHM CSC[C@H](C)C(=O)OCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000737181527 598564128 /nfs/dbraw/zinc/56/41/28/598564128.db2.gz WDJVRTNVHZOBDZ-ZDUSSCGKSA-N -1 3 368.462 3.576 20 0 FHADHM CSC[C@H](C)C(=O)OCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000737181527 598564129 /nfs/dbraw/zinc/56/41/29/598564129.db2.gz WDJVRTNVHZOBDZ-ZDUSSCGKSA-N -1 3 368.462 3.576 20 0 FHADHM O=C(CCc1ccc(Cl)c(Cl)c1)Nc1ccccc1-c1nnn[n-]1 ZINC000737854121 598572525 /nfs/dbraw/zinc/57/25/25/598572525.db2.gz RHWSCTRRUREEKP-UHFFFAOYSA-N -1 3 362.220 3.745 20 0 FHADHM O=C(CCc1ccc(Cl)c(Cl)c1)Nc1ccccc1-c1nn[n-]n1 ZINC000737854121 598572526 /nfs/dbraw/zinc/57/25/26/598572526.db2.gz RHWSCTRRUREEKP-UHFFFAOYSA-N -1 3 362.220 3.745 20 0 FHADHM FC(F)(F)c1cc(N2CC[C@H](c3ccccc3)C2)ccc1-c1nnn[n-]1 ZINC000737632197 598578041 /nfs/dbraw/zinc/57/80/41/598578041.db2.gz KZZBFROMLABLQG-ZDUSSCGKSA-N -1 3 359.355 3.879 20 0 FHADHM FC(F)(F)c1cc(N2CC[C@H](c3ccccc3)C2)ccc1-c1nn[n-]n1 ZINC000737632197 598578042 /nfs/dbraw/zinc/57/80/42/598578042.db2.gz KZZBFROMLABLQG-ZDUSSCGKSA-N -1 3 359.355 3.879 20 0 FHADHM Cc1nc([C@H](C)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)cs1 ZINC000737469879 598580322 /nfs/dbraw/zinc/58/03/22/598580322.db2.gz DGEFFDKRHRFJIA-ZETCQYMHSA-N -1 3 354.361 3.824 20 0 FHADHM Cc1nc([C@H](C)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)cs1 ZINC000737469879 598580324 /nfs/dbraw/zinc/58/03/24/598580324.db2.gz DGEFFDKRHRFJIA-ZETCQYMHSA-N -1 3 354.361 3.824 20 0 FHADHM Cc1c(Cl)cccc1NC(=S)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000737215855 598581187 /nfs/dbraw/zinc/58/11/87/598581187.db2.gz LYQDCLWGSFCTHJ-UHFFFAOYSA-N -1 3 362.821 3.777 20 0 FHADHM Cc1c(Cl)cccc1NC(=S)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000737215855 598581189 /nfs/dbraw/zinc/58/11/89/598581189.db2.gz LYQDCLWGSFCTHJ-UHFFFAOYSA-N -1 3 362.821 3.777 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccc(-c2ccc(F)cc2)o1 ZINC000738165956 598589699 /nfs/dbraw/zinc/58/96/99/598589699.db2.gz IPUAECUOCPISKE-UHFFFAOYSA-N -1 3 367.315 3.657 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccc(-c2ccc(F)cc2)o1 ZINC000738165956 598589701 /nfs/dbraw/zinc/58/97/01/598589701.db2.gz IPUAECUOCPISKE-UHFFFAOYSA-N -1 3 367.315 3.657 20 0 FHADHM c1ccc(SC2(CNc3ccc(-c4nnn[n-]4)cn3)CCCC2)cc1 ZINC000738432009 598594636 /nfs/dbraw/zinc/59/46/36/598594636.db2.gz BRJYBJZZDVZGNY-UHFFFAOYSA-N -1 3 352.467 3.779 20 0 FHADHM c1ccc(SC2(CNc3ccc(-c4nn[n-]n4)cn3)CCCC2)cc1 ZINC000738432009 598594638 /nfs/dbraw/zinc/59/46/38/598594638.db2.gz BRJYBJZZDVZGNY-UHFFFAOYSA-N -1 3 352.467 3.779 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)c1cc2cc(F)ccc2s1 ZINC000738168285 598600517 /nfs/dbraw/zinc/60/05/17/598600517.db2.gz YGDDDPMWRQAMHQ-UHFFFAOYSA-N -1 3 357.345 3.612 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)c1cc2cc(F)ccc2s1 ZINC000738168285 598600518 /nfs/dbraw/zinc/60/05/18/598600518.db2.gz YGDDDPMWRQAMHQ-UHFFFAOYSA-N -1 3 357.345 3.612 20 0 FHADHM CCC[C@@H](NC(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)C1CCCCC1 ZINC000736431991 598607640 /nfs/dbraw/zinc/60/76/40/598607640.db2.gz ZVBKHKIPQNCPDD-KBXCAEBGSA-N -1 3 370.501 3.976 20 0 FHADHM CCC[C@@H](NC(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)C1CCCCC1 ZINC000736431991 598607644 /nfs/dbraw/zinc/60/76/44/598607644.db2.gz ZVBKHKIPQNCPDD-KBXCAEBGSA-N -1 3 370.501 3.976 20 0 FHADHM Cc1cc(-c2noc([C@H](C)Oc3ccccc3-c3nnn[n-]3)n2)ccc1F ZINC000737226628 598611054 /nfs/dbraw/zinc/61/10/54/598611054.db2.gz XDOLVYVJWXJCFI-NSHDSACASA-N -1 3 366.356 3.504 20 0 FHADHM Cc1cc(-c2noc([C@H](C)Oc3ccccc3-c3nn[n-]n3)n2)ccc1F ZINC000737226628 598611056 /nfs/dbraw/zinc/61/10/56/598611056.db2.gz XDOLVYVJWXJCFI-NSHDSACASA-N -1 3 366.356 3.504 20 0 FHADHM Clc1ccc(Cc2noc(C=Cc3ccccc3-c3nnn[n-]3)n2)cc1 ZINC000737574458 598613023 /nfs/dbraw/zinc/61/30/23/598613023.db2.gz FSSLUSFOPWMGBN-YFHOEESVSA-N -1 3 364.796 3.664 20 0 FHADHM Clc1ccc(Cc2noc(C=Cc3ccccc3-c3nn[n-]n3)n2)cc1 ZINC000737574458 598613025 /nfs/dbraw/zinc/61/30/25/598613025.db2.gz FSSLUSFOPWMGBN-YFHOEESVSA-N -1 3 364.796 3.664 20 0 FHADHM Cc1cc(C(F)(F)F)c(-c2nnn[n-]2)c(S[C@@H](C)c2ccncc2)n1 ZINC000737245226 598613983 /nfs/dbraw/zinc/61/39/83/598613983.db2.gz LPCSFJBLBJBHRV-VIFPVBQESA-N -1 3 366.372 3.837 20 0 FHADHM C[C@@H](OC(=O)c1cccc(-c2nnn[n-]2)c1)c1ccc(C(F)(F)F)cc1 ZINC000736161052 598618440 /nfs/dbraw/zinc/61/84/40/598618440.db2.gz BNWXBRBJKYSOFQ-SNVBAGLBSA-N -1 3 362.311 3.804 20 0 FHADHM C[C@@H](OC(=O)c1cccc(-c2nn[n-]n2)c1)c1ccc(C(F)(F)F)cc1 ZINC000736161052 598618441 /nfs/dbraw/zinc/61/84/41/598618441.db2.gz BNWXBRBJKYSOFQ-SNVBAGLBSA-N -1 3 362.311 3.804 20 0 FHADHM Cc1ccccc1[C@@H](C)N(C)C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000737420622 598626109 /nfs/dbraw/zinc/62/61/09/598626109.db2.gz IIDPRJWHHDKRCH-GFCCVEGCSA-N -1 3 354.389 3.539 20 0 FHADHM Cc1ccccc1[C@@H](C)N(C)C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000737420622 598626110 /nfs/dbraw/zinc/62/61/10/598626110.db2.gz IIDPRJWHHDKRCH-GFCCVEGCSA-N -1 3 354.389 3.539 20 0 FHADHM FC(F)Oc1ccccc1CNc1c(Cl)cccc1-c1nnn[n-]1 ZINC000737638022 598632530 /nfs/dbraw/zinc/63/25/30/598632530.db2.gz AGZWEWSLICIYLH-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM FC(F)Oc1ccccc1CNc1c(Cl)cccc1-c1nn[n-]n1 ZINC000737638022 598632531 /nfs/dbraw/zinc/63/25/31/598632531.db2.gz AGZWEWSLICIYLH-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM Cc1cccc(NC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)c1C ZINC000737400049 598643990 /nfs/dbraw/zinc/64/39/90/598643990.db2.gz PPKGHXJZFHJCQK-UHFFFAOYSA-N -1 3 365.437 3.671 20 0 FHADHM Cc1cccc(NC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)c1C ZINC000737400049 598643991 /nfs/dbraw/zinc/64/39/91/598643991.db2.gz PPKGHXJZFHJCQK-UHFFFAOYSA-N -1 3 365.437 3.671 20 0 FHADHM Cc1ccc(NC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)c(F)c1 ZINC000737355626 598644755 /nfs/dbraw/zinc/64/47/55/598644755.db2.gz KEBYVGSCKMBYHH-UHFFFAOYSA-N -1 3 369.400 3.502 20 0 FHADHM Cc1ccc(NC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)c(F)c1 ZINC000737355626 598644757 /nfs/dbraw/zinc/64/47/57/598644757.db2.gz KEBYVGSCKMBYHH-UHFFFAOYSA-N -1 3 369.400 3.502 20 0 FHADHM C[C@H](OC(=O)CCCCOc1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000736148290 598646426 /nfs/dbraw/zinc/64/64/26/598646426.db2.gz GTOUPZAJMHEWOX-HNNXBMFYSA-N -1 3 366.421 3.720 20 0 FHADHM C[C@H](OC(=O)CCCCOc1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000736148290 598646427 /nfs/dbraw/zinc/64/64/27/598646427.db2.gz GTOUPZAJMHEWOX-HNNXBMFYSA-N -1 3 366.421 3.720 20 0 FHADHM Cc1cccc(C)c1NC(=O)CCCCOc1cccc(-c2nnn[n-]2)c1 ZINC000737390856 598646764 /nfs/dbraw/zinc/64/67/64/598646764.db2.gz SFSOYWLHTUHIDA-UHFFFAOYSA-N -1 3 365.437 3.671 20 0 FHADHM Cc1cccc(C)c1NC(=O)CCCCOc1cccc(-c2nn[n-]n2)c1 ZINC000737390856 598646766 /nfs/dbraw/zinc/64/67/66/598646766.db2.gz SFSOYWLHTUHIDA-UHFFFAOYSA-N -1 3 365.437 3.671 20 0 FHADHM Cc1cc(OC(=O)CSc2ccc(-c3nnn[n-]3)cc2)ccc1Cl ZINC000737279789 598647404 /nfs/dbraw/zinc/64/74/04/598647404.db2.gz QTHTUTMVGCRLFT-UHFFFAOYSA-N -1 3 360.826 3.526 20 0 FHADHM Cc1cc(OC(=O)CSc2ccc(-c3nn[n-]n3)cc2)ccc1Cl ZINC000737279789 598647406 /nfs/dbraw/zinc/64/74/06/598647406.db2.gz QTHTUTMVGCRLFT-UHFFFAOYSA-N -1 3 360.826 3.526 20 0 FHADHM CC(C)[C@@H](CC(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000735706998 598651564 /nfs/dbraw/zinc/65/15/64/598651564.db2.gz FKHUAPJOLNOENO-LJQANCHMSA-N -1 3 363.465 3.655 20 0 FHADHM CC(C)[C@@H](CC(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000735706998 598651566 /nfs/dbraw/zinc/65/15/66/598651566.db2.gz FKHUAPJOLNOENO-LJQANCHMSA-N -1 3 363.465 3.655 20 0 FHADHM CC(C)[C@H](C)N(C)C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000735699570 598651631 /nfs/dbraw/zinc/65/16/31/598651631.db2.gz ACMQSMCOMVZXFE-AWEZNQCLSA-N -1 3 365.437 3.776 20 0 FHADHM CC(C)[C@H](C)N(C)C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735699570 598651632 /nfs/dbraw/zinc/65/16/32/598651632.db2.gz ACMQSMCOMVZXFE-AWEZNQCLSA-N -1 3 365.437 3.776 20 0 FHADHM Clc1cc(NCC2(c3ccccc3)CCOCC2)ccc1-c1nnn[n-]1 ZINC000737566520 598651923 /nfs/dbraw/zinc/65/19/23/598651923.db2.gz UGIUVCHCZZZKSI-UHFFFAOYSA-N -1 3 369.856 3.680 20 0 FHADHM Clc1cc(NCC2(c3ccccc3)CCOCC2)ccc1-c1nn[n-]n1 ZINC000737566520 598651924 /nfs/dbraw/zinc/65/19/24/598651924.db2.gz UGIUVCHCZZZKSI-UHFFFAOYSA-N -1 3 369.856 3.680 20 0 FHADHM CCCC(=O)Nc1ccc(CNc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1 ZINC000736414920 598652453 /nfs/dbraw/zinc/65/24/53/598652453.db2.gz AUXJDIAOVBBZQS-UHFFFAOYSA-N -1 3 370.844 3.871 20 0 FHADHM CCCC(=O)Nc1ccc(CNc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1 ZINC000736414920 598652455 /nfs/dbraw/zinc/65/24/55/598652455.db2.gz AUXJDIAOVBBZQS-UHFFFAOYSA-N -1 3 370.844 3.871 20 0 FHADHM CC[C@H](C)N(C)C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736321294 598653397 /nfs/dbraw/zinc/65/33/97/598653397.db2.gz APVHUGWMENLOER-ZDUSSCGKSA-N -1 3 351.410 3.530 20 0 FHADHM CC[C@H](C)N(C)C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736321294 598653399 /nfs/dbraw/zinc/65/33/99/598653399.db2.gz APVHUGWMENLOER-ZDUSSCGKSA-N -1 3 351.410 3.530 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@@H](C)CSc1ccccc1 ZINC000737290435 598656323 /nfs/dbraw/zinc/65/63/23/598656323.db2.gz VTXUIPXMGQZUDD-ZDUSSCGKSA-N -1 3 353.451 3.542 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@@H](C)CSc1ccccc1 ZINC000737290435 598656324 /nfs/dbraw/zinc/65/63/24/598656324.db2.gz VTXUIPXMGQZUDD-ZDUSSCGKSA-N -1 3 353.451 3.542 20 0 FHADHM CC[C@H](Sc1ccccc1)C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000736393453 598657483 /nfs/dbraw/zinc/65/74/83/598657483.db2.gz YXBXRYRUVBIFJU-HNNXBMFYSA-N -1 3 357.414 3.515 20 0 FHADHM CC[C@H](Sc1ccccc1)C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000736393453 598657485 /nfs/dbraw/zinc/65/74/85/598657485.db2.gz YXBXRYRUVBIFJU-HNNXBMFYSA-N -1 3 357.414 3.515 20 0 FHADHM Fc1ccc2c(CCNc3ccc(-c4nnn[n-]4)c(Cl)c3)c[nH]c2c1 ZINC000737667372 598668660 /nfs/dbraw/zinc/66/86/60/598668660.db2.gz PRIOZGJUGYLTSX-UHFFFAOYSA-N -1 3 356.792 3.795 20 0 FHADHM Fc1ccc2c(CCNc3ccc(-c4nn[n-]n4)c(Cl)c3)c[nH]c2c1 ZINC000737667372 598668662 /nfs/dbraw/zinc/66/86/62/598668662.db2.gz PRIOZGJUGYLTSX-UHFFFAOYSA-N -1 3 356.792 3.795 20 0 FHADHM Cc1ccc(CCC(=O)OCc2ccc(F)cc2-c2nnn[n-]2)cc1Cl ZINC000737338208 598706285 /nfs/dbraw/zinc/70/62/85/598706285.db2.gz PJOMGQMAGQYBSA-UHFFFAOYSA-N -1 3 374.803 3.644 20 0 FHADHM Cc1ccc(CCC(=O)OCc2ccc(F)cc2-c2nn[n-]n2)cc1Cl ZINC000737338208 598706286 /nfs/dbraw/zinc/70/62/86/598706286.db2.gz PJOMGQMAGQYBSA-UHFFFAOYSA-N -1 3 374.803 3.644 20 0 FHADHM Cc1c2cc(F)ccc2oc1C(=O)OCc1ccc(F)cc1-c1nnn[n-]1 ZINC000737209598 598706321 /nfs/dbraw/zinc/70/63/21/598706321.db2.gz SIKWAVUJMKJYBP-UHFFFAOYSA-N -1 3 370.315 3.557 20 0 FHADHM Cc1c2cc(F)ccc2oc1C(=O)OCc1ccc(F)cc1-c1nn[n-]n1 ZINC000737209598 598706322 /nfs/dbraw/zinc/70/63/22/598706322.db2.gz SIKWAVUJMKJYBP-UHFFFAOYSA-N -1 3 370.315 3.557 20 0 FHADHM O=C(CCCc1ccc(Cl)cc1)OCc1ccc(F)cc1-c1nnn[n-]1 ZINC000737835158 598707701 /nfs/dbraw/zinc/70/77/01/598707701.db2.gz DSLJFQYNYQQKRS-UHFFFAOYSA-N -1 3 374.803 3.725 20 0 FHADHM O=C(CCCc1ccc(Cl)cc1)OCc1ccc(F)cc1-c1nn[n-]n1 ZINC000737835158 598707703 /nfs/dbraw/zinc/70/77/03/598707703.db2.gz DSLJFQYNYQQKRS-UHFFFAOYSA-N -1 3 374.803 3.725 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nnn[n-]1)[C@H]1C[C@H]1c1cccc(Cl)c1 ZINC000738232098 598711624 /nfs/dbraw/zinc/71/16/24/598711624.db2.gz PBZALBGHACRAPD-HOCLYGCPSA-N -1 3 372.787 3.506 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nn[n-]n1)[C@H]1C[C@H]1c1cccc(Cl)c1 ZINC000738232098 598711626 /nfs/dbraw/zinc/71/16/26/598711626.db2.gz PBZALBGHACRAPD-HOCLYGCPSA-N -1 3 372.787 3.506 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)N1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000738178902 598716510 /nfs/dbraw/zinc/71/65/10/598716510.db2.gz MYQMHVCYUNLJPB-AWEZNQCLSA-N -1 3 368.828 3.542 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)N1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000738178902 598716511 /nfs/dbraw/zinc/71/65/11/598716511.db2.gz MYQMHVCYUNLJPB-AWEZNQCLSA-N -1 3 368.828 3.542 20 0 FHADHM Clc1ccccc1-c1nnc(SCc2ccc(-c3nnn[n-]3)cc2)o1 ZINC000737573941 598718686 /nfs/dbraw/zinc/71/86/86/598718686.db2.gz HQPOJZPJIDCWCM-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1ccccc1-c1nnc(SCc2ccc(-c3nn[n-]n3)cc2)o1 ZINC000737573941 598718688 /nfs/dbraw/zinc/71/86/88/598718688.db2.gz HQPOJZPJIDCWCM-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Cc1cc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCC3)ccc1F ZINC000737238046 598735003 /nfs/dbraw/zinc/73/50/03/598735003.db2.gz HSDQOUXWNAPRRP-UHFFFAOYSA-N -1 3 357.414 3.507 20 0 FHADHM Cc1cc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCC3)ccc1F ZINC000737238046 598735004 /nfs/dbraw/zinc/73/50/04/598735004.db2.gz HSDQOUXWNAPRRP-UHFFFAOYSA-N -1 3 357.414 3.507 20 0 FHADHM CC/C=C/CCOC(=O)c1ccc(Oc2ccc(-c3nnn[n-]3)cn2)cc1 ZINC000736408671 598735462 /nfs/dbraw/zinc/73/54/62/598735462.db2.gz GGUDMSQFTHVDEH-ONEGZZNKSA-N -1 3 365.393 3.567 20 0 FHADHM CC/C=C/CCOC(=O)c1ccc(Oc2ccc(-c3nn[n-]n3)cn2)cc1 ZINC000736408671 598735463 /nfs/dbraw/zinc/73/54/63/598735463.db2.gz GGUDMSQFTHVDEH-ONEGZZNKSA-N -1 3 365.393 3.567 20 0 FHADHM Cc1cc(C(=O)N(CC(C)C)c2ccc(-c3nnn[n-]3)cc2)ccc1F ZINC000737226911 598736898 /nfs/dbraw/zinc/73/68/98/598736898.db2.gz FVYPXJYRIHRALA-UHFFFAOYSA-N -1 3 353.401 3.617 20 0 FHADHM Cc1cc(C(=O)N(CC(C)C)c2ccc(-c3nn[n-]n3)cc2)ccc1F ZINC000737226911 598736899 /nfs/dbraw/zinc/73/68/99/598736899.db2.gz FVYPXJYRIHRALA-UHFFFAOYSA-N -1 3 353.401 3.617 20 0 FHADHM Cc1ccc(C)n1C1CCN(c2ccc(Cl)cc2-c2nnn[n-]2)CC1 ZINC000737332425 598747275 /nfs/dbraw/zinc/74/72/75/598747275.db2.gz VYMQNRBOIJHLPQ-UHFFFAOYSA-N -1 3 356.861 3.780 20 0 FHADHM Cc1ccc(C)n1C1CCN(c2ccc(Cl)cc2-c2nn[n-]n2)CC1 ZINC000737332425 598747277 /nfs/dbraw/zinc/74/72/77/598747277.db2.gz VYMQNRBOIJHLPQ-UHFFFAOYSA-N -1 3 356.861 3.780 20 0 FHADHM Cc1ccccc1[C@H](NC(=O)C=Cc1ccccc1-c1nnn[n-]1)C(C)C ZINC000737419168 598755073 /nfs/dbraw/zinc/75/50/73/598755073.db2.gz DDWFTCGCLBCFBV-DRUFCSCSSA-N -1 3 361.449 3.702 20 0 FHADHM Cc1ccccc1[C@H](NC(=O)C=Cc1ccccc1-c1nn[n-]n1)C(C)C ZINC000737419168 598755075 /nfs/dbraw/zinc/75/50/75/598755075.db2.gz DDWFTCGCLBCFBV-DRUFCSCSSA-N -1 3 361.449 3.702 20 0 FHADHM C[C@@H](Sc1ccccc1Cl)C(=O)Nc1sccc1-c1nnn[n-]1 ZINC000736190337 598756869 /nfs/dbraw/zinc/75/68/69/598756869.db2.gz DBNIVPUBPJTYOS-MRVPVSSYSA-N -1 3 365.871 3.701 20 0 FHADHM C[C@@H](Sc1ccccc1Cl)C(=O)Nc1sccc1-c1nn[n-]n1 ZINC000736190337 598756870 /nfs/dbraw/zinc/75/68/70/598756870.db2.gz DBNIVPUBPJTYOS-MRVPVSSYSA-N -1 3 365.871 3.701 20 0 FHADHM Cc1ccccc1[C@@H](CC(C)C)NC(=O)c1sccc1-c1nnn[n-]1 ZINC000737422697 598764593 /nfs/dbraw/zinc/76/45/93/598764593.db2.gz OKOVARLIFYMRSD-OAHLLOKOSA-N -1 3 355.467 3.754 20 0 FHADHM Cc1ccccc1[C@@H](CC(C)C)NC(=O)c1sccc1-c1nn[n-]n1 ZINC000737422697 598764594 /nfs/dbraw/zinc/76/45/94/598764594.db2.gz OKOVARLIFYMRSD-OAHLLOKOSA-N -1 3 355.467 3.754 20 0 FHADHM CCSc1ccc([C@@H](C)NC(=O)Nc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736668453 598769408 /nfs/dbraw/zinc/76/94/08/598769408.db2.gz ZSENUSLGYNADEI-GFCCVEGCSA-N -1 3 368.466 3.861 20 0 FHADHM CCSc1ccc([C@@H](C)NC(=O)Nc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736668453 598769410 /nfs/dbraw/zinc/76/94/10/598769410.db2.gz ZSENUSLGYNADEI-GFCCVEGCSA-N -1 3 368.466 3.861 20 0 FHADHM CC(C)CC(CC(C)C)NC(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000735762300 598776864 /nfs/dbraw/zinc/77/68/64/598776864.db2.gz XBKFIPJDJWGEGN-CQSZACIVSA-N -1 3 358.490 3.688 20 0 FHADHM CC(C)CC(CC(C)C)NC(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000735762300 598776866 /nfs/dbraw/zinc/77/68/66/598776866.db2.gz XBKFIPJDJWGEGN-CQSZACIVSA-N -1 3 358.490 3.688 20 0 FHADHM CC[C@H](CC(=O)OCc1ccc(-c2nnn[n-]2)cc1F)c1ccccc1 ZINC000736334054 598780840 /nfs/dbraw/zinc/78/08/40/598780840.db2.gz DXTPATCSNAVWKF-CYBMUJFWSA-N -1 3 354.385 3.633 20 0 FHADHM CC[C@H](CC(=O)OCc1ccc(-c2nn[n-]n2)cc1F)c1ccccc1 ZINC000736334054 598780841 /nfs/dbraw/zinc/78/08/41/598780841.db2.gz DXTPATCSNAVWKF-CYBMUJFWSA-N -1 3 354.385 3.633 20 0 FHADHM CCN(C)C(=O)Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)c(Cl)c1 ZINC000736510170 598788199 /nfs/dbraw/zinc/78/81/99/598788199.db2.gz QZYXXJUQEXXSBS-UHFFFAOYSA-N -1 3 372.816 3.796 20 0 FHADHM CCN(C)C(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)c(Cl)c1 ZINC000736510170 598788200 /nfs/dbraw/zinc/78/82/00/598788200.db2.gz QZYXXJUQEXXSBS-UHFFFAOYSA-N -1 3 372.816 3.796 20 0 FHADHM S=C(Nc1ccccc1-c1nnn[n-]1)N[C@@H](c1ccccc1)C1CCC1 ZINC000738409586 598789622 /nfs/dbraw/zinc/78/96/22/598789622.db2.gz SRHFMLSERPLUSZ-KRWDZBQOSA-N -1 3 364.478 3.695 20 0 FHADHM S=C(Nc1ccccc1-c1nn[n-]n1)N[C@@H](c1ccccc1)C1CCC1 ZINC000738409586 598789624 /nfs/dbraw/zinc/78/96/24/598789624.db2.gz SRHFMLSERPLUSZ-KRWDZBQOSA-N -1 3 364.478 3.695 20 0 FHADHM Clc1ccc(NCc2cc(Br)cs2)c(-c2nnn[n-]2)c1 ZINC000737575479 598793591 /nfs/dbraw/zinc/79/35/91/598793591.db2.gz VUWASOUPTBFOPL-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM Clc1ccc(NCc2cc(Br)cs2)c(-c2nn[n-]n2)c1 ZINC000737575479 598793592 /nfs/dbraw/zinc/79/35/92/598793592.db2.gz VUWASOUPTBFOPL-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM CC(C)[C@@H](C)C(=O)Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000735699913 598803703 /nfs/dbraw/zinc/80/37/03/598803703.db2.gz DKWIBAJPINPELV-CYBMUJFWSA-N -1 3 351.410 3.890 20 0 FHADHM CC(C)[C@@H](C)C(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000735699913 598803704 /nfs/dbraw/zinc/80/37/04/598803704.db2.gz DKWIBAJPINPELV-CYBMUJFWSA-N -1 3 351.410 3.890 20 0 FHADHM CC(C)[C@@H](C)C(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000735702675 598804704 /nfs/dbraw/zinc/80/47/04/598804704.db2.gz QKOHLFIBSUMXGU-CQSZACIVSA-N -1 3 365.437 3.676 20 0 FHADHM CC(C)[C@@H](C)C(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000735702675 598804706 /nfs/dbraw/zinc/80/47/06/598804706.db2.gz QKOHLFIBSUMXGU-CQSZACIVSA-N -1 3 365.437 3.676 20 0 FHADHM CC(C)[C@@H](C)C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000735703785 598804757 /nfs/dbraw/zinc/80/47/57/598804757.db2.gz WBPZBMVHZWFRKH-CYBMUJFWSA-N -1 3 351.410 3.890 20 0 FHADHM CC(C)[C@@H](C)C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000735703785 598804758 /nfs/dbraw/zinc/80/47/58/598804758.db2.gz WBPZBMVHZWFRKH-CYBMUJFWSA-N -1 3 351.410 3.890 20 0 FHADHM CCc1cc(Nc2cccc(OCc3cccc(-c4nnn[n-]4)c3)c2)ncn1 ZINC000736676143 598815276 /nfs/dbraw/zinc/81/52/76/598815276.db2.gz AQIRVYYJWYNTSB-UHFFFAOYSA-N -1 3 373.420 3.542 20 0 FHADHM CCc1cc(Nc2cccc(OCc3cccc(-c4nn[n-]n4)c3)c2)ncn1 ZINC000736676143 598815278 /nfs/dbraw/zinc/81/52/78/598815278.db2.gz AQIRVYYJWYNTSB-UHFFFAOYSA-N -1 3 373.420 3.542 20 0 FHADHM CCCN(CC(C)C)C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000821094594 599294867 /nfs/dbraw/zinc/29/48/67/599294867.db2.gz MWSFUYBQZGKTHK-UHFFFAOYSA-N -1 3 370.379 3.785 20 0 FHADHM CCCN(CC(C)C)C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000821094594 599294869 /nfs/dbraw/zinc/29/48/69/599294869.db2.gz MWSFUYBQZGKTHK-UHFFFAOYSA-N -1 3 370.379 3.785 20 0 FHADHM C[C@@H](N[C@@H](c1nccs1)c1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736131158 599310821 /nfs/dbraw/zinc/31/08/21/599310821.db2.gz JNMOOIPNWRTCEE-CXAGYDPISA-N -1 3 362.462 3.763 20 0 FHADHM C[C@@H](N[C@@H](c1nccs1)c1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736131158 599310823 /nfs/dbraw/zinc/31/08/23/599310823.db2.gz JNMOOIPNWRTCEE-CXAGYDPISA-N -1 3 362.462 3.763 20 0 FHADHM O=C([O-])CCN(CCC(F)(F)F)Cc1cccc(Br)c1 ZINC000582671408 601221039 /nfs/dbraw/zinc/22/10/39/601221039.db2.gz AHKYOLUCCFKFFY-UHFFFAOYSA-N -1 3 354.166 3.678 20 0 FHADHM CCN(C(=O)c1cc2c(s1)CC[C@H](C)C2)c1ccc(-c2nnn[n-]2)cc1 ZINC000736505482 599313724 /nfs/dbraw/zinc/31/37/24/599313724.db2.gz JYLNUUNFJZGMKK-LBPRGKRZSA-N -1 3 367.478 3.720 20 0 FHADHM CCN(C(=O)c1cc2c(s1)CC[C@H](C)C2)c1ccc(-c2nn[n-]n2)cc1 ZINC000736505482 599313727 /nfs/dbraw/zinc/31/37/27/599313727.db2.gz JYLNUUNFJZGMKK-LBPRGKRZSA-N -1 3 367.478 3.720 20 0 FHADHM Cc1cccc(NC(=S)Nc2ccc(OC(C)C)c(-c3nnn[n-]3)c2)c1 ZINC000822324157 607368285 /nfs/dbraw/zinc/36/82/85/607368285.db2.gz WZHVTGNVJGDCDC-UHFFFAOYSA-N -1 3 368.466 3.771 20 0 FHADHM Cc1cccc(NC(=S)Nc2ccc(OC(C)C)c(-c3nn[n-]n3)c2)c1 ZINC000822324157 607368286 /nfs/dbraw/zinc/36/82/86/607368286.db2.gz WZHVTGNVJGDCDC-UHFFFAOYSA-N -1 3 368.466 3.771 20 0 FHADHM CC(C)Oc1ccc(NCCOc2cccc(-c3nnn[n-]3)c2)cc1Cl ZINC000735912946 599325422 /nfs/dbraw/zinc/32/54/22/599325422.db2.gz KFSWNUWBRUPAHA-UHFFFAOYSA-N -1 3 373.844 3.798 20 0 FHADHM CC(C)Oc1ccc(NCCOc2cccc(-c3nn[n-]n3)c2)cc1Cl ZINC000735912946 599325425 /nfs/dbraw/zinc/32/54/25/599325425.db2.gz KFSWNUWBRUPAHA-UHFFFAOYSA-N -1 3 373.844 3.798 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1CNc1ccc(Cl)c(Cl)c1 ZINC000821736103 607369399 /nfs/dbraw/zinc/36/93/99/607369399.db2.gz BFRUGPMQIFWVES-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CNc1ccc(Cl)c(Cl)c1 ZINC000821736103 607369401 /nfs/dbraw/zinc/36/94/01/607369401.db2.gz BFRUGPMQIFWVES-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM Cc1ccc(C)c(NC(=O)CS[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737325333 599332000 /nfs/dbraw/zinc/33/20/00/599332000.db2.gz DBXSEEZHZDJUER-AWEZNQCLSA-N -1 3 367.478 3.916 20 0 FHADHM Cc1ccc(C)c(NC(=O)CS[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737325333 599332003 /nfs/dbraw/zinc/33/20/03/599332003.db2.gz DBXSEEZHZDJUER-AWEZNQCLSA-N -1 3 367.478 3.916 20 0 FHADHM C[C@@H](Sc1ccccc1-c1nnn[n-]1)c1nc(Cc2ccccc2)no1 ZINC000820555756 599344752 /nfs/dbraw/zinc/34/47/52/599344752.db2.gz PHLFMRQHYWACQE-GFCCVEGCSA-N -1 3 364.434 3.694 20 0 FHADHM C[C@@H](Sc1ccccc1-c1nn[n-]n1)c1nc(Cc2ccccc2)no1 ZINC000820555756 599344756 /nfs/dbraw/zinc/34/47/56/599344756.db2.gz PHLFMRQHYWACQE-GFCCVEGCSA-N -1 3 364.434 3.694 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1CNc1ccccc1OC1CCCC1 ZINC000821736163 607370976 /nfs/dbraw/zinc/37/09/76/607370976.db2.gz DOSWUGLETMTAJF-UHFFFAOYSA-N -1 3 365.437 3.809 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CNc1ccccc1OC1CCCC1 ZINC000821736163 607370978 /nfs/dbraw/zinc/37/09/78/607370978.db2.gz DOSWUGLETMTAJF-UHFFFAOYSA-N -1 3 365.437 3.809 20 0 FHADHM C[C@H](Nc1cccc(OC[C@@H]2CCCO2)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820461724 599364988 /nfs/dbraw/zinc/36/49/88/599364988.db2.gz QOBLHERRXNJLMZ-LIRRHRJNSA-N -1 3 365.437 3.598 20 0 FHADHM C[C@H](Nc1cccc(OC[C@@H]2CCCO2)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820461724 599364991 /nfs/dbraw/zinc/36/49/91/599364991.db2.gz QOBLHERRXNJLMZ-LIRRHRJNSA-N -1 3 365.437 3.598 20 0 FHADHM C[C@@H](Nc1ccc(OC[C@@H]2CCCO2)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820455163 599369111 /nfs/dbraw/zinc/36/91/11/599369111.db2.gz FRLHXUSEWMJICC-KUHUBIRLSA-N -1 3 365.437 3.598 20 0 FHADHM C[C@@H](Nc1ccc(OC[C@@H]2CCCO2)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820455163 599369114 /nfs/dbraw/zinc/36/91/14/599369114.db2.gz FRLHXUSEWMJICC-KUHUBIRLSA-N -1 3 365.437 3.598 20 0 FHADHM C[C@@H](Sc1ncccc1Br)c1ccc(-c2nnn[n-]2)cc1 ZINC000736189810 599369293 /nfs/dbraw/zinc/36/92/93/599369293.db2.gz CDRKPGDUORMHBO-SECBINFHSA-N -1 3 362.256 3.878 20 0 FHADHM C[C@@H](Sc1ncccc1Br)c1ccc(-c2nn[n-]n2)cc1 ZINC000736189810 599369294 /nfs/dbraw/zinc/36/92/94/599369294.db2.gz CDRKPGDUORMHBO-SECBINFHSA-N -1 3 362.256 3.878 20 0 FHADHM CCN(C(=O)c1cc2occc2s1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736505737 599372030 /nfs/dbraw/zinc/37/20/30/599372030.db2.gz LUTRRELCQVMACS-NSHDSACASA-N -1 3 367.434 3.898 20 0 FHADHM CCN(C(=O)c1cc2occc2s1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736505737 599372033 /nfs/dbraw/zinc/37/20/33/599372033.db2.gz LUTRRELCQVMACS-NSHDSACASA-N -1 3 367.434 3.898 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CNc1cccc(Oc2ccccn2)c1 ZINC000821736806 607371872 /nfs/dbraw/zinc/37/18/72/607371872.db2.gz OQEHBBSCNYLRCU-UHFFFAOYSA-N -1 3 374.404 3.675 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1OCc1ccc(OCC(F)(F)F)cc1 ZINC000822136520 599385024 /nfs/dbraw/zinc/38/50/24/599385024.db2.gz MAXZFTMTKBEAFU-UHFFFAOYSA-N -1 3 364.327 3.695 20 0 FHADHM CC(C)Oc1ccc(NCc2csc(C(C)C)n2)cc1-c1nnn[n-]1 ZINC000820173828 607372518 /nfs/dbraw/zinc/37/25/18/607372518.db2.gz KYJDUIZHCKKNBK-UHFFFAOYSA-N -1 3 358.471 3.846 20 0 FHADHM CC(C)Oc1ccc(NCc2csc(C(C)C)n2)cc1-c1nn[n-]n1 ZINC000820173828 607372520 /nfs/dbraw/zinc/37/25/20/607372520.db2.gz KYJDUIZHCKKNBK-UHFFFAOYSA-N -1 3 358.471 3.846 20 0 FHADHM CC(C)Oc1ccc(NCc2ncc(C(C)(C)C)o2)cc1-c1nnn[n-]1 ZINC000820173918 607372564 /nfs/dbraw/zinc/37/25/64/607372564.db2.gz NJSAAESAGWKZBL-UHFFFAOYSA-N -1 3 356.430 3.552 20 0 FHADHM CC(C)Oc1ccc(NCc2ncc(C(C)(C)C)o2)cc1-c1nn[n-]n1 ZINC000820173918 607372565 /nfs/dbraw/zinc/37/25/65/607372565.db2.gz NJSAAESAGWKZBL-UHFFFAOYSA-N -1 3 356.430 3.552 20 0 FHADHM c1c(CNc2cc(-c3nnn[n-]3)c3ccccc3n2)sc2c1CCCC2 ZINC000738433961 599414117 /nfs/dbraw/zinc/41/41/17/599414117.db2.gz XHJIAXLPPPKXQG-UHFFFAOYSA-N -1 3 362.462 3.967 20 0 FHADHM c1c(CNc2cc(-c3nn[n-]n3)c3ccccc3n2)sc2c1CCCC2 ZINC000738433961 599414118 /nfs/dbraw/zinc/41/41/18/599414118.db2.gz XHJIAXLPPPKXQG-UHFFFAOYSA-N -1 3 362.462 3.967 20 0 FHADHM C[C@@H](NC(=O)NCCCC1CCCCC1)c1cccc(-c2nnn[n-]2)c1 ZINC000820366908 599416311 /nfs/dbraw/zinc/41/63/11/599416311.db2.gz PMHLYKYRMKFZOT-CQSZACIVSA-N -1 3 356.474 3.587 20 0 FHADHM C[C@@H](NC(=O)NCCCC1CCCCC1)c1cccc(-c2nn[n-]n2)c1 ZINC000820366908 599416313 /nfs/dbraw/zinc/41/63/13/599416313.db2.gz PMHLYKYRMKFZOT-CQSZACIVSA-N -1 3 356.474 3.587 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(NCc2ccccc2Br)c1 ZINC000737571212 599420590 /nfs/dbraw/zinc/42/05/90/599420590.db2.gz WTKZKEIHYCSYHJ-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(NCc2ccccc2Br)c1 ZINC000737571212 599420593 /nfs/dbraw/zinc/42/05/93/599420593.db2.gz WTKZKEIHYCSYHJ-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM Clc1cccc([C@H](NCc2ccc(-c3nnn[n-]3)o2)c2ccccc2)c1 ZINC000822585650 599421121 /nfs/dbraw/zinc/42/11/21/599421121.db2.gz IUBQPWYXBLCAGI-GOSISDBHSA-N -1 3 365.824 3.992 20 0 FHADHM Clc1cccc([C@H](NCc2ccc(-c3nn[n-]n3)o2)c2ccccc2)c1 ZINC000822585650 599421124 /nfs/dbraw/zinc/42/11/24/599421124.db2.gz IUBQPWYXBLCAGI-GOSISDBHSA-N -1 3 365.824 3.992 20 0 FHADHM CC(C)(C)[C@H]1OCCC[C@H]1CNc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000735595236 599440677 /nfs/dbraw/zinc/44/06/77/599440677.db2.gz FFBCGKKONZIELH-UGSOOPFHSA-N -1 3 366.469 3.668 20 0 FHADHM CC(C)(C)[C@H]1OCCC[C@H]1CNc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000735595236 599440681 /nfs/dbraw/zinc/44/06/81/599440681.db2.gz FFBCGKKONZIELH-UGSOOPFHSA-N -1 3 366.469 3.668 20 0 FHADHM CCc1noc([C@H](C)Oc2ccc(-c3ccc(-c4nnn[n-]4)cc3)cc2)n1 ZINC000736713831 599444714 /nfs/dbraw/zinc/44/47/14/599444714.db2.gz SQXCIHIVWITEJM-LBPRGKRZSA-N -1 3 362.393 3.619 20 0 FHADHM CCc1noc([C@H](C)Oc2ccc(-c3ccc(-c4nn[n-]n4)cc3)cc2)n1 ZINC000736713831 599444716 /nfs/dbraw/zinc/44/47/16/599444716.db2.gz SQXCIHIVWITEJM-LBPRGKRZSA-N -1 3 362.393 3.619 20 0 FHADHM Cc1ccc(CSc2nc(-c3ccccc3)ccc2-c2nnn[n-]2)nc1 ZINC000822239858 607379843 /nfs/dbraw/zinc/37/98/43/607379843.db2.gz HZFRSSVOGGLWEX-UHFFFAOYSA-N -1 3 360.446 3.924 20 0 FHADHM Cc1ccc(CSc2nc(-c3ccccc3)ccc2-c2nn[n-]n2)nc1 ZINC000822239858 607379844 /nfs/dbraw/zinc/37/98/44/607379844.db2.gz HZFRSSVOGGLWEX-UHFFFAOYSA-N -1 3 360.446 3.924 20 0 FHADHM CC(C)(C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1cccc(Cl)c1 ZINC000735581082 599464688 /nfs/dbraw/zinc/46/46/88/599464688.db2.gz NPBKRVFAWGUVNK-UHFFFAOYSA-N -1 3 359.792 3.576 20 0 FHADHM CC(C)(C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1cccc(Cl)c1 ZINC000735581082 599464690 /nfs/dbraw/zinc/46/46/90/599464690.db2.gz NPBKRVFAWGUVNK-UHFFFAOYSA-N -1 3 359.792 3.576 20 0 FHADHM Cc1nc2ccccc2n1CCCNc1c(Cl)cccc1-c1nnn[n-]1 ZINC000822462327 599465670 /nfs/dbraw/zinc/46/56/70/599465670.db2.gz GTDBPYILXXWPTG-UHFFFAOYSA-N -1 3 367.844 3.680 20 0 FHADHM Cc1nc2ccccc2n1CCCNc1c(Cl)cccc1-c1nn[n-]n1 ZINC000822462327 599465672 /nfs/dbraw/zinc/46/56/72/599465672.db2.gz GTDBPYILXXWPTG-UHFFFAOYSA-N -1 3 367.844 3.680 20 0 FHADHM COc1ccc(CCCNc2c(Cl)cccc2-c2nnn[n-]2)cc1OC ZINC000821790040 599496320 /nfs/dbraw/zinc/49/63/20/599496320.db2.gz FRLZHCKGSVGRTM-UHFFFAOYSA-N -1 3 373.844 3.582 20 0 FHADHM COc1ccc(CCCNc2c(Cl)cccc2-c2nn[n-]n2)cc1OC ZINC000821790040 599496323 /nfs/dbraw/zinc/49/63/23/599496323.db2.gz FRLZHCKGSVGRTM-UHFFFAOYSA-N -1 3 373.844 3.582 20 0 FHADHM C[C@H](CCC(C)(C)C)NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000735984027 599505199 /nfs/dbraw/zinc/50/51/99/599505199.db2.gz AWVBTTXEWPENGB-CQSZACIVSA-N -1 3 370.501 3.756 20 0 FHADHM C[C@H](CCC(C)(C)C)NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000735984027 599505202 /nfs/dbraw/zinc/50/52/02/599505202.db2.gz AWVBTTXEWPENGB-CQSZACIVSA-N -1 3 370.501 3.756 20 0 FHADHM CC(C)[C@H](CC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000820323791 599508797 /nfs/dbraw/zinc/50/87/97/599508797.db2.gz ZBOZAYGOBYUCTH-KXBFYZLASA-N -1 3 363.465 3.874 20 0 FHADHM CC(C)[C@H](CC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000820323791 599508799 /nfs/dbraw/zinc/50/87/99/599508799.db2.gz ZBOZAYGOBYUCTH-KXBFYZLASA-N -1 3 363.465 3.874 20 0 FHADHM Cc1csc([C@H]2CCCN(c3c(Cl)cccc3-c3nnn[n-]3)C2)n1 ZINC000822409122 599509228 /nfs/dbraw/zinc/50/92/28/599509228.db2.gz MLZVQQJSRAVOIO-NSHDSACASA-N -1 3 360.874 3.669 20 0 FHADHM Cc1csc([C@H]2CCCN(c3c(Cl)cccc3-c3nn[n-]n3)C2)n1 ZINC000822409122 599509230 /nfs/dbraw/zinc/50/92/30/599509230.db2.gz MLZVQQJSRAVOIO-NSHDSACASA-N -1 3 360.874 3.669 20 0 FHADHM C[C@@H](NC(=O)C[C@H]1CCCc2ccccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000820321585 599515999 /nfs/dbraw/zinc/51/59/99/599515999.db2.gz IXFSRHVOWWJODC-RHSMWYFYSA-N -1 3 361.449 3.554 20 0 FHADHM C[C@@H](NC(=O)C[C@H]1CCCc2ccccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000820321585 599516001 /nfs/dbraw/zinc/51/60/01/599516001.db2.gz IXFSRHVOWWJODC-RHSMWYFYSA-N -1 3 361.449 3.554 20 0 FHADHM C[C@H](Nc1ccc(-c2nn[n-]n2)cc1C(F)(F)F)c1nc2ccccc2[nH]1 ZINC000736136950 599521532 /nfs/dbraw/zinc/52/15/32/599521532.db2.gz IAIQDWPLPSTHMI-VIFPVBQESA-N -1 3 373.342 3.935 20 0 FHADHM COc1ccc(COCCCNc2c(Cl)cccc2-c2nnn[n-]2)cc1 ZINC000821824843 599522002 /nfs/dbraw/zinc/52/20/02/599522002.db2.gz ORCANPSHXMEFQU-UHFFFAOYSA-N -1 3 373.844 3.548 20 0 FHADHM COc1ccc(COCCCNc2c(Cl)cccc2-c2nn[n-]n2)cc1 ZINC000821824843 599522004 /nfs/dbraw/zinc/52/20/04/599522004.db2.gz ORCANPSHXMEFQU-UHFFFAOYSA-N -1 3 373.844 3.548 20 0 FHADHM Cc1ccc(CN(C)c2c(-c3nnn[n-]3)cnc3c(C)cccc32)s1 ZINC000822237327 599524184 /nfs/dbraw/zinc/52/41/84/599524184.db2.gz PFAOIBTUSRVOME-UHFFFAOYSA-N -1 3 350.451 3.730 20 0 FHADHM Cc1ccc(CN(C)c2c(-c3nn[n-]n3)cnc3c(C)cccc32)s1 ZINC000822237327 599524187 /nfs/dbraw/zinc/52/41/87/599524187.db2.gz PFAOIBTUSRVOME-UHFFFAOYSA-N -1 3 350.451 3.730 20 0 FHADHM CC(C)c1ccc(CCC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000820192402 599527499 /nfs/dbraw/zinc/52/74/99/599527499.db2.gz MKMPIHTVQRQGRM-OAHLLOKOSA-N -1 3 363.465 3.800 20 0 FHADHM CC(C)c1ccc(CCC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000820192402 599527501 /nfs/dbraw/zinc/52/75/01/599527501.db2.gz MKMPIHTVQRQGRM-OAHLLOKOSA-N -1 3 363.465 3.800 20 0 FHADHM CC(C)(C)c1csc(CCNc2c(Cl)cccc2-c2nnn[n-]2)n1 ZINC000819965458 599527719 /nfs/dbraw/zinc/52/77/19/599527719.db2.gz HOMBZVRQACNJHE-UHFFFAOYSA-N -1 3 362.890 3.929 20 0 FHADHM CC(C)(C)c1csc(CCNc2c(Cl)cccc2-c2nn[n-]n2)n1 ZINC000819965458 599527722 /nfs/dbraw/zinc/52/77/22/599527722.db2.gz HOMBZVRQACNJHE-UHFFFAOYSA-N -1 3 362.890 3.929 20 0 FHADHM COc1ccccc1[C@@H]1CCN(c2ccc(Cl)cc2-c2nnn[n-]2)C1 ZINC000737147123 599537600 /nfs/dbraw/zinc/53/76/00/599537600.db2.gz KIADXZHGYFZNKM-GFCCVEGCSA-N -1 3 355.829 3.523 20 0 FHADHM COc1ccccc1[C@@H]1CCN(c2ccc(Cl)cc2-c2nn[n-]n2)C1 ZINC000737147123 599537602 /nfs/dbraw/zinc/53/76/02/599537602.db2.gz KIADXZHGYFZNKM-GFCCVEGCSA-N -1 3 355.829 3.523 20 0 FHADHM CC[C@@H](CC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccc(C)cc1 ZINC000736330317 599543906 /nfs/dbraw/zinc/54/39/06/599543906.db2.gz CFKIHBNAWJIUSW-ZDUSSCGKSA-N -1 3 353.401 3.837 20 0 FHADHM CC[C@@H](CC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccc(C)cc1 ZINC000736330317 599543908 /nfs/dbraw/zinc/54/39/08/599543908.db2.gz CFKIHBNAWJIUSW-ZDUSSCGKSA-N -1 3 353.401 3.837 20 0 FHADHM C[C@H](NC(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C)C1CCCCC1 ZINC000820374648 599549754 /nfs/dbraw/zinc/54/97/54/599549754.db2.gz POQPRYOXGXQENQ-LBPRGKRZSA-N -1 3 359.478 3.514 20 0 FHADHM C[C@H](NC(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C)C1CCCCC1 ZINC000820374648 599549756 /nfs/dbraw/zinc/54/97/56/599549756.db2.gz POQPRYOXGXQENQ-LBPRGKRZSA-N -1 3 359.478 3.514 20 0 FHADHM CCN(C(=O)Nc1ccc(C)s1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821153398 599550661 /nfs/dbraw/zinc/55/06/61/599550661.db2.gz APFCMMSWXVZOBV-LBPRGKRZSA-N -1 3 356.455 3.852 20 0 FHADHM CCN(C(=O)Nc1ccc(C)s1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821153398 599550663 /nfs/dbraw/zinc/55/06/63/599550663.db2.gz APFCMMSWXVZOBV-LBPRGKRZSA-N -1 3 356.455 3.852 20 0 FHADHM Cc1ccc([C@H]2C[C@H](C)CCN2C(=O)Nc2cccc(-c3nnn[n-]3)c2)o1 ZINC000822233705 599555871 /nfs/dbraw/zinc/55/58/71/599555871.db2.gz TWHBFVZWFDPCIG-MLGOLLRUSA-N -1 3 366.425 3.773 20 0 FHADHM Cc1ccc([C@H]2C[C@H](C)CCN2C(=O)Nc2cccc(-c3nn[n-]n3)c2)o1 ZINC000822233705 599555873 /nfs/dbraw/zinc/55/58/73/599555873.db2.gz TWHBFVZWFDPCIG-MLGOLLRUSA-N -1 3 366.425 3.773 20 0 FHADHM Cc1cc(NC(=O)C=Cc2ccccc2-c2nnn[n-]2)ccc1C(F)(F)F ZINC000822207005 599558755 /nfs/dbraw/zinc/55/87/55/599558755.db2.gz HTWNPUUHJBURLN-TWGQIWQCSA-N -1 3 373.338 3.846 20 0 FHADHM Cc1cc(NC(=O)C=Cc2ccccc2-c2nn[n-]n2)ccc1C(F)(F)F ZINC000822207005 599558756 /nfs/dbraw/zinc/55/87/56/599558756.db2.gz HTWNPUUHJBURLN-TWGQIWQCSA-N -1 3 373.338 3.846 20 0 FHADHM CN(C(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1)c1ccccc1 ZINC000736741082 599561770 /nfs/dbraw/zinc/56/17/70/599561770.db2.gz MVRFMFMWAPXWDT-UHFFFAOYSA-N -1 3 370.416 3.887 20 0 FHADHM FC(F)(F)Cc1ccc(Nc2ncc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000822718287 599579733 /nfs/dbraw/zinc/57/97/33/599579733.db2.gz GSZWEKXDYBSHFN-UHFFFAOYSA-N -1 3 354.723 3.764 20 0 FHADHM FC(F)(F)Cc1ccc(Nc2ncc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000822718287 599579735 /nfs/dbraw/zinc/57/97/35/599579735.db2.gz GSZWEKXDYBSHFN-UHFFFAOYSA-N -1 3 354.723 3.764 20 0 FHADHM O=C(CC/C=C\c1ccccc1)OCc1cc(-c2nnn[n-]2)ccc1F ZINC000737824240 599606284 /nfs/dbraw/zinc/60/62/84/599606284.db2.gz GBSCALSKDWASCW-YWEYNIOJSA-N -1 3 352.369 3.543 20 0 FHADHM O=C(CC/C=C\c1ccccc1)OCc1cc(-c2nn[n-]n2)ccc1F ZINC000737824240 599606285 /nfs/dbraw/zinc/60/62/85/599606285.db2.gz GBSCALSKDWASCW-YWEYNIOJSA-N -1 3 352.369 3.543 20 0 FHADHM CCC(CC)(C(=O)OCc1ccccc1-c1nnn[n-]1)c1ccccc1 ZINC000820881982 599621715 /nfs/dbraw/zinc/62/17/15/599621715.db2.gz GWBXISWCKNYUIC-UHFFFAOYSA-N -1 3 350.422 3.668 20 0 FHADHM CCC(CC)(C(=O)OCc1ccccc1-c1nn[n-]n1)c1ccccc1 ZINC000820881982 599621716 /nfs/dbraw/zinc/62/17/16/599621716.db2.gz GWBXISWCKNYUIC-UHFFFAOYSA-N -1 3 350.422 3.668 20 0 FHADHM C[C@H](OC(=O)[C@H]1C[C@H]1c1cc(F)ccc1F)c1cccc(-c2nnn[n-]2)c1 ZINC000820488768 599622355 /nfs/dbraw/zinc/62/23/55/599622355.db2.gz UBEZPHWBCIVJJG-FSBGKCOPSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@H]1C[C@H]1c1cc(F)ccc1F)c1cccc(-c2nn[n-]n2)c1 ZINC000820488768 599622356 /nfs/dbraw/zinc/62/23/56/599622356.db2.gz UBEZPHWBCIVJJG-FSBGKCOPSA-N -1 3 370.359 3.553 20 0 FHADHM CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)C=CC3CC3)c2-c2nn[n-]n2)C1 ZINC000819908204 599629429 /nfs/dbraw/zinc/62/94/29/599629429.db2.gz XUOXVASGUNLFEU-UVMWJGKXSA-N -1 3 371.510 3.984 20 0 FHADHM CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)/C=C/C3CC3)c2-c2nn[n-]n2)C1 ZINC000819908204 599629430 /nfs/dbraw/zinc/62/94/30/599629430.db2.gz XUOXVASGUNLFEU-UVMWJGKXSA-N -1 3 371.510 3.984 20 0 FHADHM C[C@@H](CCc1cccc(F)c1)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820253203 599629450 /nfs/dbraw/zinc/62/94/50/599629450.db2.gz GUITZRIJKAKKHD-NSHDSACASA-N -1 3 373.819 3.867 20 0 FHADHM C[C@@H](CCc1cccc(F)c1)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820253203 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C[C@H]1CCCC[C@@]1(CNC(=O)OC(C)(C)C)NCc1cc(C(=O)[O-])co1 ZINC000387863351 600315785 /nfs/dbraw/zinc/31/57/85/600315785.db2.gz OVHMTQQBZFQSMD-DJJJIMSYSA-N -1 3 366.458 3.541 20 0 FHADHM O=C([O-])CCN(Cc1ccc(-n2cccn2)cc1)Cc1ccc(F)c(F)c1 ZINC000739725174 600327766 /nfs/dbraw/zinc/32/77/66/600327766.db2.gz UPPSEXJVNFVNJF-UHFFFAOYSA-N -1 3 371.387 3.627 20 0 FHADHM CN(C)Cc1c2ccccc2oc1C(=O)Nc1cc(C(=O)[O-])ccc1F ZINC000737368798 600405188 /nfs/dbraw/zinc/40/51/88/600405188.db2.gz UWMCDJAAQALLJV-UHFFFAOYSA-N -1 3 356.353 3.584 20 0 FHADHM COCc1ccc(CN[C@@H](C(=O)[O-])c2ccc(Br)cc2)cc1 ZINC000737834286 600422673 /nfs/dbraw/zinc/42/26/73/600422673.db2.gz OMWKQQXFLYINPZ-MRXNPFEDSA-N -1 3 364.239 3.511 20 0 FHADHM O=C([O-])[C@@H](NCc1ccc(N2CCCCCC2)nc1)c1ccc(F)cc1 ZINC000739501354 600425446 /nfs/dbraw/zinc/42/54/46/600425446.db2.gz XBBASRGJESZFBJ-IBGZPJMESA-N -1 3 357.429 3.517 20 0 FHADHM O=C([O-])[C@@H](NCc1ccc(OC2CCCC2)nc1)c1cccc(Cl)c1 ZINC000739499979 600426006 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O=C([O-])c1ccc(NC(=O)c2cccc(CN3CCCC3)c2)cc1Cl ZINC000739464498 600485941 /nfs/dbraw/zinc/48/59/41/600485941.db2.gz BKPUZNOGTZQZLU-UHFFFAOYSA-N -1 3 358.825 3.886 20 0 FHADHM CC(C)(C)CCN1CCN(C(=O)Nc2ccc(C(=O)[O-])c(Cl)c2)CC1 ZINC000736248464 600510687 /nfs/dbraw/zinc/51/06/87/600510687.db2.gz JQPXAPSBFKAJMI-UHFFFAOYSA-N -1 3 367.877 3.624 20 0 FHADHM Cc1[nH]c(C(=O)[C@H](C)N2C[C@H](c3ccccc3)C[C@H]2C)c(C)c1C(=O)[O-] ZINC000738228850 600630525 /nfs/dbraw/zinc/63/05/25/600630525.db2.gz CTAODOCTELGCBW-ISTRZQFTSA-N -1 3 354.450 3.779 20 0 FHADHM Cc1[nH]c(C(=O)CN2CCC[C@H]2Cc2ccc(C)cc2)c(C)c1C(=O)[O-] ZINC000738590017 600643488 /nfs/dbraw/zinc/64/34/88/600643488.db2.gz YPSRDLQDSAPSCP-KRWDZBQOSA-N -1 3 354.450 3.528 20 0 FHADHM C[C@@H](NCc1cccc(OCC(=O)[O-])c1)c1ccc(Br)cc1 ZINC000827741973 600749896 /nfs/dbraw/zinc/74/98/96/600749896.db2.gz YPAYCIPLMSTNRD-GFCCVEGCSA-N -1 3 364.239 3.763 20 0 FHADHM COc1cc(CN(C)[C@H](C(=O)[O-])c2ccccc2)c(SC)cc1OC ZINC000737881445 600795663 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CC(C)(C)c1ccccc1NC(=O)CN1CCC[C@H](C(C)(C)C(=O)[O-])C1 ZINC000833449973 604941440 /nfs/dbraw/zinc/94/14/40/604941440.db2.gz SLSDHACWRXKSLL-HNNXBMFYSA-N -1 3 360.498 3.745 20 0 FHADHM CCc1nc2c(s1)[C@H](NCc1ccc(CCNC(=O)[O-])cc1)CCC2 ZINC000827636892 604942788 /nfs/dbraw/zinc/94/27/88/604942788.db2.gz PAVIZPWEVFKZOW-OAHLLOKOSA-N -1 3 359.495 3.683 20 0 FHADHM CC(C)C[C@@H](NC(=O)CN1CCC[C@@H](C(C)(C)C(=O)[O-])C1)c1ccccc1 ZINC000833478873 604953590 /nfs/dbraw/zinc/95/35/90/604953590.db2.gz VUUISUDNWPNZNU-RTBURBONSA-N -1 3 374.525 3.713 20 0 FHADHM C[C@@H](N[C@@H](C(=O)[O-])c1cccnc1)c1cccc(OCc2ccccn2)c1 ZINC000827716814 604994507 /nfs/dbraw/zinc/99/45/07/604994507.db2.gz BCXJAXGURPPVMA-FOIQADDNSA-N -1 3 363.417 3.532 20 0 FHADHM O=C([O-])[C@@H](NCc1ccc(-c2ccc3c(c2)CCCO3)cc1)c1cccnc1 ZINC000833166542 604999986 /nfs/dbraw/zinc/99/99/86/604999986.db2.gz QFKYVOOOTJKYEJ-QFIPXVFZSA-N -1 3 374.440 3.989 20 0 FHADHM COc1ccccc1Oc1ccc(CN[C@H](C(=O)[O-])c2cccnc2)cc1 ZINC000832633757 605001118 /nfs/dbraw/zinc/00/11/18/605001118.db2.gz XEUCQMINBDQLNQ-FQEVSTJZSA-N -1 3 364.401 3.798 20 0 FHADHM COc1ccc([C@@H]2CCCN2Cc2ccccc2CC(=O)[O-])c(OC)c1 ZINC000833732993 605063397 /nfs/dbraw/zinc/06/33/97/605063397.db2.gz YWIYDOFKOSYTCX-IBGZPJMESA-N -1 3 355.434 3.668 20 0 FHADHM C[C@]1(NCc2coc(-c3ccc(F)c(F)c3)n2)CCCC[C@@H]1C(=O)[O-] ZINC000833570945 605070003 /nfs/dbraw/zinc/07/00/03/605070003.db2.gz WXUFWCAXYITTSE-ACJLOTCBSA-N -1 3 350.365 3.743 20 0 FHADHM CC(C)COC1CCN([C@H](C(=O)[O-])c2cccc(Br)c2)CC1 ZINC000579133088 605201745 /nfs/dbraw/zinc/20/17/45/605201745.db2.gz VFSCTGJSHMANPD-INIZCTEOSA-N -1 3 370.287 3.712 20 0 FHADHM CC[C@@H](CC(=O)Nc1cccc(-c2nnn[n-]2)c1C)c1ccc(OC)cc1 ZINC000825083065 607755195 /nfs/dbraw/zinc/75/51/95/607755195.db2.gz WZYXUYSARRBTRM-AWEZNQCLSA-N -1 3 365.437 3.706 20 0 FHADHM CC[C@@H](CC(=O)Nc1cccc(-c2nn[n-]n2)c1C)c1ccc(OC)cc1 ZINC000825083065 607755196 /nfs/dbraw/zinc/75/51/96/607755196.db2.gz WZYXUYSARRBTRM-AWEZNQCLSA-N -1 3 365.437 3.706 20 0 FHADHM Cc1oc(-c2cccs2)nc1CN1C[C@@H]2CCC[C@@H](NC(=O)[O-])[C@@H]2C1 ZINC000833934425 605438594 /nfs/dbraw/zinc/43/85/94/605438594.db2.gz JWIOFUJVYUXQTP-BFHYXJOUSA-N -1 3 361.467 3.580 20 0 FHADHM CC1([C@@H]2CCCN([C@H](C(=O)[O-])c3cccc(Cl)c3Cl)C2)OCCO1 ZINC000833564726 605444009 /nfs/dbraw/zinc/44/40/09/605444009.db2.gz PGFLWOXNXNPWBB-ABAIWWIYSA-N -1 3 374.264 3.594 20 0 FHADHM O=C([O-])Nc1ccc(CN2CCC[C@H](c3nc4ccccc4o3)C2)cn1 ZINC000834259672 605479330 /nfs/dbraw/zinc/47/93/30/605479330.db2.gz DNPBIWAMKFNXDT-AWEZNQCLSA-N -1 3 352.394 3.692 20 0 FHADHM O=C([O-])Nc1ccc2c(c1)CC[C@@H]2NCc1cnn(Cc2ccccc2)c1 ZINC000834263341 605578823 /nfs/dbraw/zinc/57/88/23/605578823.db2.gz STFXIAKPAPSQDB-FQEVSTJZSA-N -1 3 362.433 3.798 20 0 FHADHM C[C@@H](NC(=O)[O-])[C@@H]1CCCN(Cc2ccccc2OCc2cccnc2)C1 ZINC000833813539 605601154 /nfs/dbraw/zinc/60/11/54/605601154.db2.gz PSUCHVWFKNSSPO-SJLPKXTDSA-N -1 3 369.465 3.529 20 0 FHADHM Cc1cc(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)ccc1NC(=O)[O-] ZINC000829940017 605637451 /nfs/dbraw/zinc/63/74/51/605637451.db2.gz JESGIQOTXDUQGR-MAUKXSAKSA-N -1 3 367.449 3.650 20 0 FHADHM O=C([O-])N1CC[C@@]2(C1)C[C@H](N[C@@H]1CCCc3[nH]ccc31)c1ccccc1O2 ZINC000834082903 605639615 /nfs/dbraw/zinc/63/96/15/605639615.db2.gz FWJPRGDKQPSIHH-LQWHRVPQSA-N -1 3 367.449 3.628 20 0 FHADHM O=C([O-])N1CCC[C@H](CN[C@@H](c2cc3ccccc3o2)c2cccnc2)C1 ZINC000834099999 605672906 /nfs/dbraw/zinc/67/29/06/605672906.db2.gz RAZNFQDCOKLTOC-FOIQADDNSA-N -1 3 365.433 3.897 20 0 FHADHM O=C([O-])N1CCC[C@@H](CN[C@@H](c2cc3ccccc3o2)c2cccnc2)C1 ZINC000834100002 605673004 /nfs/dbraw/zinc/67/30/04/605673004.db2.gz RAZNFQDCOKLTOC-MGPUTAFESA-N -1 3 365.433 3.897 20 0 FHADHM O=C([O-])N1CCC(CN[C@H](c2cc3ccccc3o2)c2cccnc2)CC1 ZINC000834078077 605673143 /nfs/dbraw/zinc/67/31/43/605673143.db2.gz IUHBSPLWDVAPEH-FQEVSTJZSA-N -1 3 365.433 3.897 20 0 FHADHM O=C([O-])N1CCC(N[C@@H](c2cc3ccccc3o2)c2cccnc2)CC1 ZINC000834081723 605685622 /nfs/dbraw/zinc/68/56/22/605685622.db2.gz FAVDUVCCWILCJH-LJQANCHMSA-N -1 3 351.406 3.649 20 0 FHADHM O=C([O-])N1CC(CNCc2csc(-c3ccc(C(F)(F)F)cc3)n2)C1 ZINC000834068340 605736926 /nfs/dbraw/zinc/73/69/26/605736926.db2.gz BSVSHFORIUWQFS-UHFFFAOYSA-N -1 3 371.384 3.528 20 0 FHADHM O=C([O-])NC1C[C@H]2CCC[C@@H](C1)N2Cc1cnc(-c2ccccc2)s1 ZINC000832240365 605942574 /nfs/dbraw/zinc/94/25/74/605942574.db2.gz VYJXAFWEQCAPRJ-MQVJKMGUSA-N -1 3 357.479 3.963 20 0 FHADHM CC(C)OCc1ccccc1CNc1nc2ccccc2cc1-c1nnn[n-]1 ZINC000820146952 606035834 /nfs/dbraw/zinc/03/58/34/606035834.db2.gz VNHMQUOFRRETNW-UHFFFAOYSA-N -1 3 374.448 3.952 20 0 FHADHM CC(C)OCc1ccccc1CNc1nc2ccccc2cc1-c1nn[n-]n1 ZINC000820146952 606035840 /nfs/dbraw/zinc/03/58/40/606035840.db2.gz VNHMQUOFRRETNW-UHFFFAOYSA-N -1 3 374.448 3.952 20 0 FHADHM C[C@H](CCNc1ncccc1-c1nnn[n-]1)c1cccc(C(F)(F)F)c1 ZINC000820241181 606038928 /nfs/dbraw/zinc/03/89/28/606038928.db2.gz GLHAZKHIHOEWQE-LLVKDONJSA-N -1 3 362.359 3.886 20 0 FHADHM C[C@H](CCNc1ncccc1-c1nn[n-]n1)c1cccc(C(F)(F)F)c1 ZINC000820241181 606038929 /nfs/dbraw/zinc/03/89/29/606038929.db2.gz GLHAZKHIHOEWQE-LLVKDONJSA-N -1 3 362.359 3.886 20 0 FHADHM CC[C@@H](Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)C1CCOCC1 ZINC000820924928 606041864 /nfs/dbraw/zinc/04/18/64/606041864.db2.gz CIFHZWFGDUCRFK-CQSZACIVSA-N -1 3 355.364 3.503 20 0 FHADHM CC[C@@H](Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)C1CCOCC1 ZINC000820924928 606041867 /nfs/dbraw/zinc/04/18/67/606041867.db2.gz CIFHZWFGDUCRFK-CQSZACIVSA-N -1 3 355.364 3.503 20 0 FHADHM CCOc1ccccc1[C@@H](CC(C)C)Nc1ccc(-c2nnn[n-]2)cn1 ZINC000821431387 606043011 /nfs/dbraw/zinc/04/30/11/606043011.db2.gz SLTIZHDKMALXOL-MRXNPFEDSA-N -1 3 352.442 3.860 20 0 FHADHM CCOc1ccccc1[C@@H](CC(C)C)Nc1ccc(-c2nn[n-]n2)cn1 ZINC000821431387 606043016 /nfs/dbraw/zinc/04/30/16/606043016.db2.gz SLTIZHDKMALXOL-MRXNPFEDSA-N -1 3 352.442 3.860 20 0 FHADHM Cc1cccc(CN(Cc2ccc(-c3nn[n-]n3)cc2)Cc2ccccn2)c1 ZINC000822304112 606076307 /nfs/dbraw/zinc/07/63/07/606076307.db2.gz PZTVIANPDSXPOU-UHFFFAOYSA-N -1 3 370.460 3.773 20 0 FHADHM COC1CCC(CNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)CC1 ZINC000821679848 606103385 /nfs/dbraw/zinc/10/33/85/606103385.db2.gz ONXKDULLMSHPRD-UHFFFAOYSA-N -1 3 355.364 3.503 20 0 FHADHM COC1CCC(CNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)CC1 ZINC000821679848 606103387 /nfs/dbraw/zinc/10/33/87/606103387.db2.gz ONXKDULLMSHPRD-UHFFFAOYSA-N -1 3 355.364 3.503 20 0 FHADHM Cc1ccc2nc(C3CC3)cc(C(=O)Nc3cccc(-c4nnn[n-]4)c3)c2c1 ZINC000473661999 606119643 /nfs/dbraw/zinc/11/96/43/606119643.db2.gz VHGUGXQMDJNNLZ-UHFFFAOYSA-N -1 3 370.416 3.853 20 0 FHADHM Cc1ccc2nc(C3CC3)cc(C(=O)Nc3cccc(-c4nn[n-]n4)c3)c2c1 ZINC000473661999 606119644 /nfs/dbraw/zinc/11/96/44/606119644.db2.gz VHGUGXQMDJNNLZ-UHFFFAOYSA-N -1 3 370.416 3.853 20 0 FHADHM COc1ccc([C@H](C)CC(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1 ZINC000821777945 606123347 /nfs/dbraw/zinc/12/33/47/606123347.db2.gz PIBRQVIHSMLRAW-LLVKDONJSA-N -1 3 371.828 3.661 20 0 FHADHM COc1ccc([C@H](C)CC(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1 ZINC000821777945 606123348 /nfs/dbraw/zinc/12/33/48/606123348.db2.gz PIBRQVIHSMLRAW-LLVKDONJSA-N -1 3 371.828 3.661 20 0 FHADHM CN(C)c1cccc([C@H]2CCCN2c2c(F)cc(-c3nnn[n-]3)cc2F)c1 ZINC000821590854 606124719 /nfs/dbraw/zinc/12/47/19/606124719.db2.gz JJVFRHFTHCDRSK-QGZVFWFLSA-N -1 3 370.407 3.552 20 0 FHADHM CN(C)c1cccc([C@H]2CCCN2c2c(F)cc(-c3nn[n-]n3)cc2F)c1 ZINC000821590854 606124720 /nfs/dbraw/zinc/12/47/20/606124720.db2.gz JJVFRHFTHCDRSK-QGZVFWFLSA-N -1 3 370.407 3.552 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)C(C)=Cc2ccc(F)cc2)s1 ZINC000821466239 606126428 /nfs/dbraw/zinc/12/64/28/606126428.db2.gz VGPIRUBDPJWECW-NTMALXAHSA-N -1 3 357.414 3.672 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)C(C)=Cc2ccc(F)cc2)s1 ZINC000821466239 606126429 /nfs/dbraw/zinc/12/64/29/606126429.db2.gz VGPIRUBDPJWECW-NTMALXAHSA-N -1 3 357.414 3.672 20 0 FHADHM C[C@H](OC(=O)C/C=C\c1cccc(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488793 606127315 /nfs/dbraw/zinc/12/73/15/606127315.db2.gz UJLOWUGEEFCKGP-DXTPNHAXSA-N -1 3 352.369 3.714 20 0 FHADHM C[C@H](OC(=O)C/C=C\c1cccc(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488793 606127316 /nfs/dbraw/zinc/12/73/16/606127316.db2.gz UJLOWUGEEFCKGP-DXTPNHAXSA-N -1 3 352.369 3.714 20 0 FHADHM C[C@@H](OC(=O)Cc1cccc(-c2nnn[n-]2)c1)c1ccc(F)c(Cl)c1 ZINC000820502800 606142139 /nfs/dbraw/zinc/14/21/39/606142139.db2.gz WACKJPSLNQYJOX-SNVBAGLBSA-N -1 3 360.776 3.506 20 0 FHADHM C[C@@H](OC(=O)Cc1cccc(-c2nn[n-]n2)c1)c1ccc(F)c(Cl)c1 ZINC000820502800 606142140 /nfs/dbraw/zinc/14/21/40/606142140.db2.gz WACKJPSLNQYJOX-SNVBAGLBSA-N -1 3 360.776 3.506 20 0 FHADHM Cc1c(COC(C)(C)C)cccc1NC(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000822027123 606150833 /nfs/dbraw/zinc/15/08/33/606150833.db2.gz DCWZWEBTPGTSFT-UHFFFAOYSA-N -1 3 365.437 3.743 20 0 FHADHM Cc1c(COC(C)(C)C)cccc1NC(=O)c1cccc(-c2nn[n-]n2)c1 ZINC000822027123 606150834 /nfs/dbraw/zinc/15/08/34/606150834.db2.gz DCWZWEBTPGTSFT-UHFFFAOYSA-N -1 3 365.437 3.743 20 0 FHADHM Cc1ccc(C(C)(C)C)cc1[S@](=O)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000822227475 606156426 /nfs/dbraw/zinc/15/64/26/606156426.db2.gz KHUSPEPCWRIRKP-RUZDIDTESA-N -1 3 354.479 3.780 20 0 FHADHM Cc1ccc(C(C)(C)C)cc1[S@](=O)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000822227475 606156428 /nfs/dbraw/zinc/15/64/28/606156428.db2.gz KHUSPEPCWRIRKP-RUZDIDTESA-N -1 3 354.479 3.780 20 0 FHADHM CSc1ccc(NC(=O)NCc2ccc(-c3nnn[n-]3)cc2)cc1Cl ZINC000821984093 606162122 /nfs/dbraw/zinc/16/21/22/606162122.db2.gz MEJHFYMUSRLKTI-UHFFFAOYSA-N -1 3 374.857 3.564 20 0 FHADHM CSc1ccc(NC(=O)NCc2ccc(-c3nn[n-]n3)cc2)cc1Cl ZINC000821984093 606162124 /nfs/dbraw/zinc/16/21/24/606162124.db2.gz MEJHFYMUSRLKTI-UHFFFAOYSA-N -1 3 374.857 3.564 20 0 FHADHM C[C@H]1c2ccccc2CN1C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820825650 606165560 /nfs/dbraw/zinc/16/55/60/606165560.db2.gz AGUXYLZUAIKDNQ-JTQLQIEISA-N -1 3 370.869 3.794 20 0 FHADHM C[C@H]1c2ccccc2CN1C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820825650 606165562 /nfs/dbraw/zinc/16/55/62/606165562.db2.gz AGUXYLZUAIKDNQ-JTQLQIEISA-N -1 3 370.869 3.794 20 0 FHADHM Cc1sc(NC(=O)C/C=C/c2ccc(F)cc2)c(-c2nnn[n-]2)c1C ZINC000822559098 606175020 /nfs/dbraw/zinc/17/50/20/606175020.db2.gz WDPDRSOPANVFRH-ONEGZZNKSA-N -1 3 357.414 3.726 20 0 FHADHM Cc1sc(NC(=O)C/C=C/c2ccc(F)cc2)c(-c2nn[n-]n2)c1C ZINC000822559098 606175022 /nfs/dbraw/zinc/17/50/22/606175022.db2.gz WDPDRSOPANVFRH-ONEGZZNKSA-N -1 3 357.414 3.726 20 0 FHADHM C[C@@H](OC(=O)[C@@H](C)c1ccc(Cl)s1)c1cccc(-c2nnn[n-]2)c1 ZINC000820481536 606177016 /nfs/dbraw/zinc/17/70/16/606177016.db2.gz XDMFDPNFYQOYKR-VHSXEESVSA-N -1 3 362.842 3.990 20 0 FHADHM C[C@@H](OC(=O)[C@@H](C)c1ccc(Cl)s1)c1cccc(-c2nn[n-]n2)c1 ZINC000820481536 606177017 /nfs/dbraw/zinc/17/70/17/606177017.db2.gz XDMFDPNFYQOYKR-VHSXEESVSA-N -1 3 362.842 3.990 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)c2cc(SC)ccc2C)s1 ZINC000821465077 606184807 /nfs/dbraw/zinc/18/48/07/606184807.db2.gz AVDURPTWOXQGEF-UHFFFAOYSA-N -1 3 359.480 3.773 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)c2cc(SC)ccc2C)s1 ZINC000821465077 606184809 /nfs/dbraw/zinc/18/48/09/606184809.db2.gz AVDURPTWOXQGEF-UHFFFAOYSA-N -1 3 359.480 3.773 20 0 FHADHM C[C@H](NC(=O)c1ccc(OC(C)(C)C)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820396253 606184850 /nfs/dbraw/zinc/18/48/50/606184850.db2.gz DNEWMKYHOYLDMC-ZDUSSCGKSA-N -1 3 365.437 3.535 20 0 FHADHM C[C@H](NC(=O)c1ccc(OC(C)(C)C)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820396253 606184852 /nfs/dbraw/zinc/18/48/52/606184852.db2.gz DNEWMKYHOYLDMC-ZDUSSCGKSA-N -1 3 365.437 3.535 20 0 FHADHM Cc1ccc(CCCC(=O)O[C@H](C)c2ccc(-c3nnn[n-]3)cc2)s1 ZINC000822235968 606190416 /nfs/dbraw/zinc/19/04/16/606190416.db2.gz DOOOTWSNQFVRHJ-CYBMUJFWSA-N -1 3 356.451 3.864 20 0 FHADHM Cc1ccc(CCCC(=O)O[C@H](C)c2ccc(-c3nn[n-]n3)cc2)s1 ZINC000822235968 606190417 /nfs/dbraw/zinc/19/04/17/606190417.db2.gz DOOOTWSNQFVRHJ-CYBMUJFWSA-N -1 3 356.451 3.864 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1ccc(Cl)s1 ZINC000821122926 606192469 /nfs/dbraw/zinc/19/24/69/606192469.db2.gz CFVKWCVPMQRXOU-UHFFFAOYSA-N -1 3 362.846 3.656 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)NC(C)(C)c1ccc(F)c(F)c1 ZINC000822217325 606194491 /nfs/dbraw/zinc/19/44/91/606194491.db2.gz BBWNWZMHTIMGRH-UHFFFAOYSA-N -1 3 372.379 3.510 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)NC(C)(C)c1ccc(F)c(F)c1 ZINC000822217325 606194493 /nfs/dbraw/zinc/19/44/93/606194493.db2.gz BBWNWZMHTIMGRH-UHFFFAOYSA-N -1 3 372.379 3.510 20 0 FHADHM c1ccc(COC[C@H](Nc2ccc(-c3nnn[n-]3)nc2)c2ccccc2)cc1 ZINC000823788286 606221982 /nfs/dbraw/zinc/22/19/82/606221982.db2.gz XIHIGDSQOYZTET-FQEVSTJZSA-N -1 3 372.432 3.632 20 0 FHADHM c1ccc(COC[C@H](Nc2ccc(-c3nn[n-]n3)nc2)c2ccccc2)cc1 ZINC000823788286 606221983 /nfs/dbraw/zinc/22/19/83/606221983.db2.gz XIHIGDSQOYZTET-FQEVSTJZSA-N -1 3 372.432 3.632 20 0 FHADHM CCC1(C(=O)Nc2ccc(Oc3ccc(-c4nn[n-]n4)cc3)nc2)CCC1 ZINC000820945404 606229147 /nfs/dbraw/zinc/22/91/47/606229147.db2.gz SMBZKKIXGNGMEQ-UHFFFAOYSA-N -1 3 364.409 3.573 20 0 FHADHM Cc1cc(SC(C)(C)C)ccc1NC(=O)c1cc(-c2nnn[n-]2)cn1C ZINC000822213150 606241901 /nfs/dbraw/zinc/24/19/01/606241901.db2.gz WOWYPOQZGDTHEI-UHFFFAOYSA-N -1 3 370.482 3.657 20 0 FHADHM Cc1cc(SC(C)(C)C)ccc1NC(=O)c1cc(-c2nn[n-]n2)cn1C ZINC000822213150 606241902 /nfs/dbraw/zinc/24/19/02/606241902.db2.gz WOWYPOQZGDTHEI-UHFFFAOYSA-N -1 3 370.482 3.657 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)c1ccc(-c2ccccc2F)o1 ZINC000823344638 606265520 /nfs/dbraw/zinc/26/55/20/606265520.db2.gz ZIIZRBBBBKCQFO-UHFFFAOYSA-N -1 3 367.315 3.657 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)c1ccc(-c2ccccc2F)o1 ZINC000823344638 606265522 /nfs/dbraw/zinc/26/55/22/606265522.db2.gz ZIIZRBBBBKCQFO-UHFFFAOYSA-N -1 3 367.315 3.657 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@@H]2C(=O)Nc2ccc(F)cc2-c2nnn[n-]2)cc1 ZINC000820192783 606266217 /nfs/dbraw/zinc/26/62/17/606266217.db2.gz ZIJVRGKEKBHWFR-CVEARBPZSA-N -1 3 365.412 3.871 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@@H]2C(=O)Nc2ccc(F)cc2-c2nn[n-]n2)cc1 ZINC000820192783 606266218 /nfs/dbraw/zinc/26/62/18/606266218.db2.gz ZIJVRGKEKBHWFR-CVEARBPZSA-N -1 3 365.412 3.871 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)C(c1ccccc1)c1ccccc1 ZINC000823337639 606267290 /nfs/dbraw/zinc/26/72/90/606267290.db2.gz PKDVEACPTBNQOR-UHFFFAOYSA-N -1 3 373.391 3.776 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)C(c1ccccc1)c1ccccc1 ZINC000823337639 606267291 /nfs/dbraw/zinc/26/72/91/606267291.db2.gz PKDVEACPTBNQOR-UHFFFAOYSA-N -1 3 373.391 3.776 20 0 FHADHM CCCCN(C(=O)c1cc(-c2nnn[n-]2)c[nH]1)[C@@H](CC)c1ccccc1 ZINC000821061116 606275537 /nfs/dbraw/zinc/27/55/37/606275537.db2.gz NEEATXXYRFGAKP-KRWDZBQOSA-N -1 3 352.442 3.588 20 0 FHADHM CCCCN(C(=O)c1cc(-c2nn[n-]n2)c[nH]1)[C@@H](CC)c1ccccc1 ZINC000821061116 606275538 /nfs/dbraw/zinc/27/55/38/606275538.db2.gz NEEATXXYRFGAKP-KRWDZBQOSA-N -1 3 352.442 3.588 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1csc(C(C)C)n1 ZINC000821122903 606282937 /nfs/dbraw/zinc/28/29/37/606282937.db2.gz BMLIZXFEXTZATL-UHFFFAOYSA-N -1 3 371.470 3.521 20 0 FHADHM CC(C)=C(C)C(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000820005392 606285515 /nfs/dbraw/zinc/28/55/15/606285515.db2.gz PQADGWJSQRXIJJ-UHFFFAOYSA-N -1 3 363.421 3.741 20 0 FHADHM CC(C)=C(C)C(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000820005392 606285517 /nfs/dbraw/zinc/28/55/17/606285517.db2.gz PQADGWJSQRXIJJ-UHFFFAOYSA-N -1 3 363.421 3.741 20 0 FHADHM C[C@H](Sc1cccc(-c2nnn[n-]2)c1)c1nnc(-c2cccs2)o1 ZINC000820557331 606327086 /nfs/dbraw/zinc/32/70/86/606327086.db2.gz YLRCTVMFAPECEO-VIFPVBQESA-N -1 3 356.436 3.832 20 0 FHADHM C[C@H](Sc1cccc(-c2nn[n-]n2)c1)c1nnc(-c2cccs2)o1 ZINC000820557331 606327088 /nfs/dbraw/zinc/32/70/88/606327088.db2.gz YLRCTVMFAPECEO-VIFPVBQESA-N -1 3 356.436 3.832 20 0 FHADHM COc1ccccc1[C@@H](C)CC(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821882477 606341759 /nfs/dbraw/zinc/34/17/59/606341759.db2.gz BXWSRZVOQLMZLF-UONOGXRCSA-N -1 3 366.421 3.673 20 0 FHADHM COc1ccccc1[C@@H](C)CC(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821882477 606341760 /nfs/dbraw/zinc/34/17/60/606341760.db2.gz BXWSRZVOQLMZLF-UONOGXRCSA-N -1 3 366.421 3.673 20 0 FHADHM Cc1ccc2c(CC(=O)O[C@H](C)c3ccc(-c4nnn[n-]4)cc3)coc2c1 ZINC000822274790 606345315 /nfs/dbraw/zinc/34/53/15/606345315.db2.gz JKPNPHWMYYJGSK-CYBMUJFWSA-N -1 3 362.389 3.768 20 0 FHADHM Cc1ccc2c(CC(=O)O[C@H](C)c3ccc(-c4nn[n-]n4)cc3)coc2c1 ZINC000822274790 606345317 /nfs/dbraw/zinc/34/53/17/606345317.db2.gz JKPNPHWMYYJGSK-CYBMUJFWSA-N -1 3 362.389 3.768 20 0 FHADHM C[C@@H](Oc1cccc(Cl)c1)C(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820533329 606346362 /nfs/dbraw/zinc/34/63/62/606346362.db2.gz DNGCGWGPSRQJNK-VXGBXAGGSA-N -1 3 372.812 3.592 20 0 FHADHM C[C@@H](Oc1cccc(Cl)c1)C(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820533329 606346365 /nfs/dbraw/zinc/34/63/65/606346365.db2.gz DNGCGWGPSRQJNK-VXGBXAGGSA-N -1 3 372.812 3.592 20 0 FHADHM Cc1cccc(OCCC(=O)O[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1C ZINC000822327312 606347973 /nfs/dbraw/zinc/34/79/73/606347973.db2.gz FZDCULYGBALWQW-OAHLLOKOSA-N -1 3 366.421 3.557 20 0 FHADHM Cc1cccc(OCCC(=O)O[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1C ZINC000822327312 606347975 /nfs/dbraw/zinc/34/79/75/606347975.db2.gz FZDCULYGBALWQW-OAHLLOKOSA-N -1 3 366.421 3.557 20 0 FHADHM Cc1c(Cl)cccc1OCC(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000822035500 606348452 /nfs/dbraw/zinc/34/84/52/606348452.db2.gz VTAUMKAOCGWMLR-LBPRGKRZSA-N -1 3 372.812 3.512 20 0 FHADHM Cc1c(Cl)cccc1OCC(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000822035500 606348454 /nfs/dbraw/zinc/34/84/54/606348454.db2.gz VTAUMKAOCGWMLR-LBPRGKRZSA-N -1 3 372.812 3.512 20 0 FHADHM C[C@@H](OC(=O)CCc1c[nH]c2ccccc12)c1ccc(-c2nnn[n-]2)cc1 ZINC000820497874 606349424 /nfs/dbraw/zinc/34/94/24/606349424.db2.gz WAGMRWRTIFEDAB-CYBMUJFWSA-N -1 3 361.405 3.585 20 0 FHADHM C[C@@H](OC(=O)CCc1c[nH]c2ccccc12)c1ccc(-c2nn[n-]n2)cc1 ZINC000820497874 606349426 /nfs/dbraw/zinc/34/94/26/606349426.db2.gz WAGMRWRTIFEDAB-CYBMUJFWSA-N -1 3 361.405 3.585 20 0 FHADHM Cc1ccc(Cl)c(OCC(=O)O[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000822239860 606351549 /nfs/dbraw/zinc/35/15/49/606351549.db2.gz HZUFRDQHQQIFLB-LBPRGKRZSA-N -1 3 372.812 3.512 20 0 FHADHM Cc1ccc(Cl)c(OCC(=O)O[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000822239860 606351551 /nfs/dbraw/zinc/35/15/51/606351551.db2.gz HZUFRDQHQQIFLB-LBPRGKRZSA-N -1 3 372.812 3.512 20 0 FHADHM C[C@H](CC(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccc(F)cc1 ZINC000820225106 606352135 /nfs/dbraw/zinc/35/21/35/606352135.db2.gz AWQBLNMLWFLDPT-CHWSQXEVSA-N -1 3 354.385 3.804 20 0 FHADHM C[C@H](CC(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccc(F)cc1 ZINC000820225106 606352137 /nfs/dbraw/zinc/35/21/37/606352137.db2.gz AWQBLNMLWFLDPT-CHWSQXEVSA-N -1 3 354.385 3.804 20 0 FHADHM C[C@@H](OC(=O)C1(c2ccc(F)cc2)CCC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488655 606352240 /nfs/dbraw/zinc/35/22/40/606352240.db2.gz RFJHINPWQAYQIS-CYBMUJFWSA-N -1 3 366.396 3.732 20 0 FHADHM C[C@@H](OC(=O)C1(c2ccc(F)cc2)CCC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488655 606352242 /nfs/dbraw/zinc/35/22/42/606352242.db2.gz RFJHINPWQAYQIS-CYBMUJFWSA-N -1 3 366.396 3.732 20 0 FHADHM C[C@@H](OC(=O)C[C@H](C)c1ccccc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000820225478 606356018 /nfs/dbraw/zinc/35/60/18/606356018.db2.gz JORJMBMPLDOMBX-QWHCGFSZSA-N -1 3 354.385 3.804 20 0 FHADHM C[C@@H](OC(=O)C[C@H](C)c1ccccc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000820225478 606356019 /nfs/dbraw/zinc/35/60/19/606356019.db2.gz JORJMBMPLDOMBX-QWHCGFSZSA-N -1 3 354.385 3.804 20 0 FHADHM C[C@H](OC(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488686 606357527 /nfs/dbraw/zinc/35/75/27/606357527.db2.gz RQGIHIUJJGQDGW-ZLKJLUDKSA-N -1 3 368.359 3.840 20 0 FHADHM C[C@H](OC(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488686 606357530 /nfs/dbraw/zinc/35/75/30/606357530.db2.gz RQGIHIUJJGQDGW-ZLKJLUDKSA-N -1 3 368.359 3.840 20 0 FHADHM C[C@@H](OC(=O)Cc1coc2cc(F)ccc12)c1ccc(-c2nnn[n-]2)cc1 ZINC000820502240 606359200 /nfs/dbraw/zinc/35/92/00/606359200.db2.gz ONZZOIDLPFYOIR-LLVKDONJSA-N -1 3 366.352 3.599 20 0 FHADHM C[C@@H](OC(=O)Cc1coc2cc(F)ccc12)c1ccc(-c2nn[n-]n2)cc1 ZINC000820502240 606359202 /nfs/dbraw/zinc/35/92/02/606359202.db2.gz ONZZOIDLPFYOIR-LLVKDONJSA-N -1 3 366.352 3.599 20 0 FHADHM C[C@@H](OC(=O)Cc1coc2cc(F)ccc12)c1cccc(-c2nnn[n-]2)c1 ZINC000820501118 606395138 /nfs/dbraw/zinc/39/51/38/606395138.db2.gz HTICRVAJSBBINF-LLVKDONJSA-N -1 3 366.352 3.599 20 0 FHADHM C[C@@H](OC(=O)Cc1coc2cc(F)ccc12)c1cccc(-c2nn[n-]n2)c1 ZINC000820501118 606395140 /nfs/dbraw/zinc/39/51/40/606395140.db2.gz HTICRVAJSBBINF-LLVKDONJSA-N -1 3 366.352 3.599 20 0 FHADHM c1ccc2cc(-c3nnc(Sc4ncccc4-c4nnn[n-]4)o3)ccc2c1 ZINC000823809977 606431705 /nfs/dbraw/zinc/43/17/05/606431705.db2.gz UIOXFBPSOVXYAF-UHFFFAOYSA-N -1 3 373.401 3.616 20 0 FHADHM c1ccc2cc(-c3nnc(Sc4ncccc4-c4nn[n-]n4)o3)ccc2c1 ZINC000823809977 606431707 /nfs/dbraw/zinc/43/17/07/606431707.db2.gz UIOXFBPSOVXYAF-UHFFFAOYSA-N -1 3 373.401 3.616 20 0 FHADHM C[C@H](NC(=O)Nc1cccc(-c2nnn[n-]2)c1)c1c(F)cccc1Cl ZINC000820380277 606437536 /nfs/dbraw/zinc/43/75/36/606437536.db2.gz PAOLEOIMIMJLNF-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM C[C@H](NC(=O)Nc1cccc(-c2nn[n-]n2)c1)c1c(F)cccc1Cl ZINC000820380277 606437537 /nfs/dbraw/zinc/43/75/37/606437537.db2.gz PAOLEOIMIMJLNF-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM Fc1cc(-c2nnn[n-]2)cc(F)c1NCc1csc(-c2ccccc2)n1 ZINC000822739672 606445230 /nfs/dbraw/zinc/44/52/30/606445230.db2.gz BJPDVVCGTNFTPC-UHFFFAOYSA-N -1 3 370.388 3.881 20 0 FHADHM Fc1cc(-c2nn[n-]n2)cc(F)c1NCc1csc(-c2ccccc2)n1 ZINC000822739672 606445232 /nfs/dbraw/zinc/44/52/32/606445232.db2.gz BJPDVVCGTNFTPC-UHFFFAOYSA-N -1 3 370.388 3.881 20 0 FHADHM C[C@@H]1CCN(C(=O)c2cccc(Oc3ccc(-c4nnn[n-]4)cc3)c2)[C@@H]1C ZINC000820715687 606446073 /nfs/dbraw/zinc/44/60/73/606446073.db2.gz CIKDUAXHHYALIB-ZIAGYGMSSA-N -1 3 363.421 3.530 20 0 FHADHM C[C@@H]1CCN(C(=O)c2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)[C@@H]1C ZINC000820715687 606446074 /nfs/dbraw/zinc/44/60/74/606446074.db2.gz CIKDUAXHHYALIB-ZIAGYGMSSA-N -1 3 363.421 3.530 20 0 FHADHM C[C@@H](c1ccccc1Cl)N(C(=O)c1cc(-c2nnn[n-]2)cs1)C1CC1 ZINC000820570285 606490144 /nfs/dbraw/zinc/49/01/44/606490144.db2.gz GIWGJXDZSCKPSC-JTQLQIEISA-N -1 3 373.869 3.947 20 0 FHADHM C[C@@H](c1ccccc1Cl)N(C(=O)c1cc(-c2nn[n-]n2)cs1)C1CC1 ZINC000820570285 606490145 /nfs/dbraw/zinc/49/01/45/606490145.db2.gz GIWGJXDZSCKPSC-JTQLQIEISA-N -1 3 373.869 3.947 20 0 FHADHM CC(C)c1nc2ccc(NC(=O)c3cc(-c4nnn[n-]4)cs3)cc2s1 ZINC000820203138 606498631 /nfs/dbraw/zinc/49/86/31/606498631.db2.gz QDKLBZCUZRDSGW-UHFFFAOYSA-N -1 3 370.463 3.914 20 0 FHADHM CC(C)c1nc2ccc(NC(=O)c3cc(-c4nn[n-]n4)cs3)cc2s1 ZINC000820203138 606498632 /nfs/dbraw/zinc/49/86/32/606498632.db2.gz QDKLBZCUZRDSGW-UHFFFAOYSA-N -1 3 370.463 3.914 20 0 FHADHM Cc1nc(CSCc2ccc(-c3nnn[n-]3)cc2OC(F)F)cs1 ZINC000822444097 606598925 /nfs/dbraw/zinc/59/89/25/606598925.db2.gz AIRSWAPVMRUIQB-UHFFFAOYSA-N -1 3 369.422 3.666 20 0 FHADHM Cc1nc(CSCc2ccc(-c3nn[n-]n3)cc2OC(F)F)cs1 ZINC000822444097 606598927 /nfs/dbraw/zinc/59/89/27/606598927.db2.gz AIRSWAPVMRUIQB-UHFFFAOYSA-N -1 3 369.422 3.666 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NCc1cc(-c2ccccc2)no1 ZINC000821309766 606600072 /nfs/dbraw/zinc/60/00/72/606600072.db2.gz SCSYUYHCYMTJCL-UHFFFAOYSA-N -1 3 361.409 3.566 20 0 FHADHM O=C(CCc1ccoc1)Nc1sc2c(c1-c1nnn[n-]1)CCCCCC2 ZINC000822983876 606603231 /nfs/dbraw/zinc/60/32/31/606603231.db2.gz VWEJJIPYHFRZLV-UHFFFAOYSA-N -1 3 371.466 3.752 20 0 FHADHM O=C(CCc1ccoc1)Nc1sc2c(c1-c1nn[n-]n1)CCCCCC2 ZINC000822983876 606603232 /nfs/dbraw/zinc/60/32/32/606603232.db2.gz VWEJJIPYHFRZLV-UHFFFAOYSA-N -1 3 371.466 3.752 20 0 FHADHM Cc1sc(NC(=O)C/C=C/c2ccc(C)cc2)c(-c2nnn[n-]2)c1C ZINC000822233690 606621436 /nfs/dbraw/zinc/62/14/36/606621436.db2.gz SUFFISMUJRASDB-SNAWJCMRSA-N -1 3 353.451 3.895 20 0 FHADHM Cc1sc(NC(=O)C/C=C/c2ccc(C)cc2)c(-c2nn[n-]n2)c1C ZINC000822233690 606621438 /nfs/dbraw/zinc/62/14/38/606621438.db2.gz SUFFISMUJRASDB-SNAWJCMRSA-N -1 3 353.451 3.895 20 0 FHADHM CC[C@@H](C)Oc1ccc(C(=O)Nc2cc(-c3nnn[n-]3)ccc2C)cc1 ZINC000820876687 606629993 /nfs/dbraw/zinc/62/99/93/606629993.db2.gz RZPRYHDMZGLJHR-CYBMUJFWSA-N -1 3 351.410 3.605 20 0 FHADHM CC[C@@H](C)Oc1ccc(C(=O)Nc2cc(-c3nn[n-]n3)ccc2C)cc1 ZINC000820876687 606629994 /nfs/dbraw/zinc/62/99/94/606629994.db2.gz RZPRYHDMZGLJHR-CYBMUJFWSA-N -1 3 351.410 3.605 20 0 FHADHM Cc1ccc(NC(=O)CSc2ccc(Cl)cc2-c2nnn[n-]2)cc1 ZINC000822248343 606630685 /nfs/dbraw/zinc/63/06/85/606630685.db2.gz BBIIXDGMLDSDTF-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1ccc(NC(=O)CSc2ccc(Cl)cc2-c2nn[n-]n2)cc1 ZINC000822248343 606630686 /nfs/dbraw/zinc/63/06/86/606630686.db2.gz BBIIXDGMLDSDTF-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NCc1csc(C2CCCC2)n1 ZINC000821765895 606656371 /nfs/dbraw/zinc/65/63/71/606656371.db2.gz MUWOZISMPPCWHW-UHFFFAOYSA-N -1 3 356.455 3.602 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NCc1csc(C2CCCC2)n1 ZINC000821765895 606656372 /nfs/dbraw/zinc/65/63/72/606656372.db2.gz MUWOZISMPPCWHW-UHFFFAOYSA-N -1 3 356.455 3.602 20 0 FHADHM C[C@@H](c1ccco1)N(C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)C1CC1 ZINC000820570367 606657212 /nfs/dbraw/zinc/65/72/12/606657212.db2.gz IJSGNBQREMOTEA-JTQLQIEISA-N -1 3 372.816 3.871 20 0 FHADHM C[C@@H](c1ccco1)N(C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)C1CC1 ZINC000820570367 606657213 /nfs/dbraw/zinc/65/72/13/606657213.db2.gz IJSGNBQREMOTEA-JTQLQIEISA-N -1 3 372.816 3.871 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)N1CC[C@@H]1c1ccc(Cl)cc1 ZINC000823331181 606661028 /nfs/dbraw/zinc/66/10/28/606661028.db2.gz BTTWBLQFHPDHHP-OAHLLOKOSA-N -1 3 372.791 3.638 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)N1CC[C@@H]1c1ccc(Cl)cc1 ZINC000823331181 606661029 /nfs/dbraw/zinc/66/10/29/606661029.db2.gz BTTWBLQFHPDHHP-OAHLLOKOSA-N -1 3 372.791 3.638 20 0 FHADHM CC(C)(C)[C@@H](NC(=O)c1c(F)cc(-c2nnn[n-]2)cc1F)c1ccccc1 ZINC000819899076 606671680 /nfs/dbraw/zinc/67/16/80/606671680.db2.gz NATDESGIPMBXET-INIZCTEOSA-N -1 3 371.391 3.662 20 0 FHADHM CC(C)(C)[C@@H](NC(=O)c1c(F)cc(-c2nn[n-]n2)cc1F)c1ccccc1 ZINC000819899076 606671681 /nfs/dbraw/zinc/67/16/81/606671681.db2.gz NATDESGIPMBXET-INIZCTEOSA-N -1 3 371.391 3.662 20 0 FHADHM CC(C)CCc1ccccc1NC(=O)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000820081614 606674979 /nfs/dbraw/zinc/67/49/79/606674979.db2.gz NGFLDEHUHNCHHD-UHFFFAOYSA-N -1 3 371.391 3.986 20 0 FHADHM CC(C)CCc1ccccc1NC(=O)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000820081614 606674980 /nfs/dbraw/zinc/67/49/80/606674980.db2.gz NGFLDEHUHNCHHD-UHFFFAOYSA-N -1 3 371.391 3.986 20 0 FHADHM Cc1ccc([C@@H](C)NC(=O)Nc2cc(-c3nnn[n-]3)ccc2C)cc1F ZINC000822228953 606696662 /nfs/dbraw/zinc/69/66/62/606696662.db2.gz JKGGIIXRDSRFLU-GFCCVEGCSA-N -1 3 354.389 3.505 20 0 FHADHM Cc1ccc([C@@H](C)NC(=O)Nc2cc(-c3nn[n-]n3)ccc2C)cc1F ZINC000822228953 606696663 /nfs/dbraw/zinc/69/66/63/606696663.db2.gz JKGGIIXRDSRFLU-GFCCVEGCSA-N -1 3 354.389 3.505 20 0 FHADHM CCOCCC1(CNc2cc(-c3nnn[n-]3)c3ccccc3n2)CCCC1 ZINC000821373720 606720961 /nfs/dbraw/zinc/72/09/61/606720961.db2.gz LEYOMJSFRIMRDU-UHFFFAOYSA-N -1 3 366.469 3.814 20 0 FHADHM CCOCCC1(CNc2cc(-c3nn[n-]n3)c3ccccc3n2)CCCC1 ZINC000821373720 606720962 /nfs/dbraw/zinc/72/09/62/606720962.db2.gz LEYOMJSFRIMRDU-UHFFFAOYSA-N -1 3 366.469 3.814 20 0 FHADHM Fc1ccc([C@@H]2CCN(c3c(-c4nnn[n-]4)cnc4ccccc43)C2)cc1 ZINC000822767047 606728462 /nfs/dbraw/zinc/72/84/62/606728462.db2.gz UOFTXPAJOYWIRG-CQSZACIVSA-N -1 3 360.396 3.548 20 0 FHADHM Fc1ccc([C@@H]2CCN(c3c(-c4nn[n-]n4)cnc4ccccc43)C2)cc1 ZINC000822767047 606728465 /nfs/dbraw/zinc/72/84/65/606728465.db2.gz UOFTXPAJOYWIRG-CQSZACIVSA-N -1 3 360.396 3.548 20 0 FHADHM COc1ccc(C=C(Cl)c2nc3cc(F)ccc3o2)cc1-c1nnn[n-]1 ZINC000821786878 606763574 /nfs/dbraw/zinc/76/35/74/606763574.db2.gz KRKZXTMFASZIDY-KPKJPENVSA-N -1 3 371.759 3.893 20 0 FHADHM COc1ccc(C=C(Cl)c2nc3cc(F)ccc3o2)cc1-c1nn[n-]n1 ZINC000821786878 606763575 /nfs/dbraw/zinc/76/35/75/606763575.db2.gz KRKZXTMFASZIDY-KPKJPENVSA-N -1 3 371.759 3.893 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CCCC[C@H]1CCC(C)C ZINC000822217360 606770836 /nfs/dbraw/zinc/77/08/36/606770836.db2.gz BZZKAYQQAFLYKP-INIZCTEOSA-N -1 3 356.474 3.998 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CCCC[C@H]1CCC(C)C ZINC000822217360 606770837 /nfs/dbraw/zinc/77/08/37/606770837.db2.gz BZZKAYQQAFLYKP-INIZCTEOSA-N -1 3 356.474 3.998 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(OCc2csc(-c3ccco3)n2)c1 ZINC000822574220 606787075 /nfs/dbraw/zinc/78/70/75/606787075.db2.gz QYBSJBRUKJLGRI-UHFFFAOYSA-N -1 3 359.798 3.816 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(OCc2csc(-c3ccco3)n2)c1 ZINC000822574220 606787076 /nfs/dbraw/zinc/78/70/76/606787076.db2.gz QYBSJBRUKJLGRI-UHFFFAOYSA-N -1 3 359.798 3.816 20 0 FHADHM CC[C@@H]1CCC[C@@H]1NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)CC(C)C ZINC000820972556 606811471 /nfs/dbraw/zinc/81/14/71/606811471.db2.gz PGATYSJYYIJFRP-AEFFLSMTSA-N -1 3 370.501 3.613 20 0 FHADHM CC[C@@H]1CCC[C@@H]1NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)CC(C)C ZINC000820972556 606811473 /nfs/dbraw/zinc/81/14/73/606811473.db2.gz PGATYSJYYIJFRP-AEFFLSMTSA-N -1 3 370.501 3.613 20 0 FHADHM C[C@@H](SCc1cccc(-c2nnn[n-]2)c1)c1nc(-c2ccccc2)no1 ZINC000820548667 606827940 /nfs/dbraw/zinc/82/79/40/606827940.db2.gz DZVBCTRQWRMBRJ-GFCCVEGCSA-N -1 3 364.434 3.911 20 0 FHADHM C[C@@H](SCc1cccc(-c2nn[n-]n2)c1)c1nc(-c2ccccc2)no1 ZINC000820548667 606827942 /nfs/dbraw/zinc/82/79/42/606827942.db2.gz DZVBCTRQWRMBRJ-GFCCVEGCSA-N -1 3 364.434 3.911 20 0 FHADHM CCN(C(=O)CSc1ccc(-c2nnn[n-]2)cc1Cl)c1ccccc1 ZINC000821153410 606851582 /nfs/dbraw/zinc/85/15/82/606851582.db2.gz BEDWCJNORBSBAS-UHFFFAOYSA-N -1 3 373.869 3.665 20 0 FHADHM CCN(C(=O)CSc1ccc(-c2nn[n-]n2)cc1Cl)c1ccccc1 ZINC000821153410 606851584 /nfs/dbraw/zinc/85/15/84/606851584.db2.gz BEDWCJNORBSBAS-UHFFFAOYSA-N -1 3 373.869 3.665 20 0 FHADHM Cc1ccc(NC(=O)CSc2ccc(-c3nnn[n-]3)cc2Cl)c(C)c1 ZINC000822248804 606851776 /nfs/dbraw/zinc/85/17/76/606851776.db2.gz OMQATXRHDZUJHG-UHFFFAOYSA-N -1 3 373.869 3.868 20 0 FHADHM Cc1ccc(NC(=O)CSc2ccc(-c3nn[n-]n3)cc2Cl)c(C)c1 ZINC000822248804 606851778 /nfs/dbraw/zinc/85/17/78/606851778.db2.gz OMQATXRHDZUJHG-UHFFFAOYSA-N -1 3 373.869 3.868 20 0 FHADHM C[C@H]1c2cc(Cl)cc(Cl)c2CCN1c1ccc(-c2nnn[n-]2)cn1 ZINC000820822339 606858252 /nfs/dbraw/zinc/85/82/52/606858252.db2.gz YSECFZNVGJQEQR-VIFPVBQESA-N -1 3 361.236 3.692 20 0 FHADHM C[C@H]1c2cc(Cl)cc(Cl)c2CCN1c1ccc(-c2nn[n-]n2)cn1 ZINC000820822339 606858253 /nfs/dbraw/zinc/85/82/53/606858253.db2.gz YSECFZNVGJQEQR-VIFPVBQESA-N -1 3 361.236 3.692 20 0 FHADHM CC(C)c1cnc(SC[C@H](O)c2ccc(-c3nnn[n-]3)cc2)n1C(C)C ZINC000820197301 606862137 /nfs/dbraw/zinc/86/21/37/606862137.db2.gz IVDNOSBDNIVFOU-INIZCTEOSA-N -1 3 372.498 3.593 20 0 FHADHM CC(C)c1cnc(SC[C@H](O)c2ccc(-c3nn[n-]n3)cc2)n1C(C)C ZINC000820197301 606862138 /nfs/dbraw/zinc/86/21/38/606862138.db2.gz IVDNOSBDNIVFOU-INIZCTEOSA-N -1 3 372.498 3.593 20 0 FHADHM C[C@H](OC(=O)c1cncc(-c2ccccc2)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820518430 606867547 /nfs/dbraw/zinc/86/75/47/606867547.db2.gz DMSSEWMRAYXVPJ-AWEZNQCLSA-N -1 3 371.400 3.847 20 0 FHADHM C[C@H](OC(=O)c1cncc(-c2ccccc2)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820518430 606867548 /nfs/dbraw/zinc/86/75/48/606867548.db2.gz DMSSEWMRAYXVPJ-AWEZNQCLSA-N -1 3 371.400 3.847 20 0 FHADHM FC(F)(F)c1ccccc1C1=CCN(c2ncccc2-c2nnn[n-]2)CC1 ZINC000822729013 606880705 /nfs/dbraw/zinc/88/07/05/606880705.db2.gz QMQDJFSIYCZMEF-UHFFFAOYSA-N -1 3 372.354 3.574 20 0 FHADHM FC(F)(F)c1ccccc1C1=CCN(c2ncccc2-c2nn[n-]n2)CC1 ZINC000822729013 606880706 /nfs/dbraw/zinc/88/07/06/606880706.db2.gz QMQDJFSIYCZMEF-UHFFFAOYSA-N -1 3 372.354 3.574 20 0 FHADHM CCOc1cc(C(=O)N(C)c2cc(Cl)ccc2-c2nnn[n-]2)ccc1C ZINC000821394915 606960065 /nfs/dbraw/zinc/96/00/65/606960065.db2.gz QFUVZPJSEKQNGY-UHFFFAOYSA-N -1 3 371.828 3.504 20 0 FHADHM CCOc1cc(C(=O)N(C)c2cc(Cl)ccc2-c2nn[n-]n2)ccc1C ZINC000821394915 606960066 /nfs/dbraw/zinc/96/00/66/606960066.db2.gz QFUVZPJSEKQNGY-UHFFFAOYSA-N -1 3 371.828 3.504 20 0 FHADHM C[C@@H](CC(=O)N(C)c1cc(Cl)ccc1-c1nnn[n-]1)c1ccc(F)cc1 ZINC000820219944 606962210 /nfs/dbraw/zinc/96/22/10/606962210.db2.gz LWGTWOVEOYHJDB-NSHDSACASA-N -1 3 373.819 3.816 20 0 FHADHM C[C@@H](CC(=O)N(C)c1cc(Cl)ccc1-c1nn[n-]n1)c1ccc(F)cc1 ZINC000820219944 606962212 /nfs/dbraw/zinc/96/22/12/606962212.db2.gz LWGTWOVEOYHJDB-NSHDSACASA-N -1 3 373.819 3.816 20 0 FHADHM CN(C(=O)c1cc(Cl)sc1Cl)c1ccccc1-c1nnn[n-]1 ZINC000821573388 606972960 /nfs/dbraw/zinc/97/29/60/606972960.db2.gz OFZJCCCYFYWALS-UHFFFAOYSA-N -1 3 354.222 3.512 20 0 FHADHM CN(C(=O)c1cc(Cl)sc1Cl)c1ccccc1-c1nn[n-]n1 ZINC000821573388 606972962 /nfs/dbraw/zinc/97/29/62/606972962.db2.gz OFZJCCCYFYWALS-UHFFFAOYSA-N -1 3 354.222 3.512 20 0 FHADHM Cc1ccc(Cl)cc1NC(=O)C(C)(C)Oc1ccc(-c2nnn[n-]2)cc1 ZINC000822240104 606981065 /nfs/dbraw/zinc/98/10/65/606981065.db2.gz SCAXUQFRSRXFQN-UHFFFAOYSA-N -1 3 371.828 3.625 20 0 FHADHM Cc1ccc(Cl)cc1NC(=O)C(C)(C)Oc1ccc(-c2nn[n-]n2)cc1 ZINC000822240104 606981067 /nfs/dbraw/zinc/98/10/67/606981067.db2.gz SCAXUQFRSRXFQN-UHFFFAOYSA-N -1 3 371.828 3.625 20 0 FHADHM Cc1ccccc1[C@@H](C)CC(=O)OCc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000822345481 607000465 /nfs/dbraw/zinc/00/04/65/607000465.db2.gz JTYQLTCPBNFEJK-ZDUSSCGKSA-N -1 3 354.385 3.551 20 0 FHADHM Cc1ccccc1[C@@H](C)CC(=O)OCc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000822345481 607000466 /nfs/dbraw/zinc/00/04/66/607000466.db2.gz JTYQLTCPBNFEJK-ZDUSSCGKSA-N -1 3 354.385 3.551 20 0 FHADHM Cc1nc2ccccc2nc1SCc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000822463729 607008403 /nfs/dbraw/zinc/00/84/03/607008403.db2.gz VQGASTPGTWSSMG-UHFFFAOYSA-N -1 3 352.398 3.550 20 0 FHADHM Cc1nc2ccccc2nc1SCc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000822463729 607008405 /nfs/dbraw/zinc/00/84/05/607008405.db2.gz VQGASTPGTWSSMG-UHFFFAOYSA-N -1 3 352.398 3.550 20 0 FHADHM CCC(=CC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)CC(F)(F)F)CC ZINC000820833019 607027509 /nfs/dbraw/zinc/02/75/09/607027509.db2.gz QCWMUZOZBHPASH-UHFFFAOYSA-N -1 3 367.375 3.504 20 0 FHADHM CCC(=CC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)CC(F)(F)F)CC ZINC000820833019 607027510 /nfs/dbraw/zinc/02/75/10/607027510.db2.gz QCWMUZOZBHPASH-UHFFFAOYSA-N -1 3 367.375 3.504 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1OCc1cc(-c2ccc(F)cc2)no1 ZINC000822221409 607031773 /nfs/dbraw/zinc/03/17/73/607031773.db2.gz OBXMXOZWAHUYLL-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1OCc1cc(-c2ccc(F)cc2)no1 ZINC000822221409 607031774 /nfs/dbraw/zinc/03/17/74/607031774.db2.gz OBXMXOZWAHUYLL-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)cc1CSCc1cnn(-c2ccccc2)c1 ZINC000822761259 607033632 /nfs/dbraw/zinc/03/36/32/607033632.db2.gz FKDPXMOCGGMLHU-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CSCc1cnn(-c2ccccc2)c1 ZINC000822761259 607033633 /nfs/dbraw/zinc/03/36/33/607033633.db2.gz FKDPXMOCGGMLHU-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM Cc1cccc(-c2nnc(SCc3cc(F)ccc3-c3nnn[n-]3)o2)c1 ZINC000822283672 607037831 /nfs/dbraw/zinc/03/78/31/607037831.db2.gz AJEMCXGNXQYASE-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM Cc1cccc(-c2nnc(SCc3cc(F)ccc3-c3nn[n-]n3)o2)c1 ZINC000822283672 607037832 /nfs/dbraw/zinc/03/78/32/607037832.db2.gz AJEMCXGNXQYASE-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM CCC(=CC(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1)CC ZINC000820833359 607039393 /nfs/dbraw/zinc/03/93/93/607039393.db2.gz WAMPEZZPJDKYGY-UHFFFAOYSA-N -1 3 367.478 3.958 20 0 FHADHM CC(C)(C)OC1CCN(c2ccc(C(F)(F)F)cc2-c2nnn[n-]2)CC1 ZINC000819946539 607043915 /nfs/dbraw/zinc/04/39/15/607043915.db2.gz NIZYXJWDMYMIMD-UHFFFAOYSA-N -1 3 369.391 3.669 20 0 FHADHM CC(C)(C)OC1CCN(c2ccc(C(F)(F)F)cc2-c2nn[n-]n2)CC1 ZINC000819946539 607043916 /nfs/dbraw/zinc/04/39/16/607043916.db2.gz NIZYXJWDMYMIMD-UHFFFAOYSA-N -1 3 369.391 3.669 20 0 FHADHM CCC(CC)CC(=O)Nc1nc(-c2ccc(-c3nnn[n-]3)cc2)cs1 ZINC000820892550 607052859 /nfs/dbraw/zinc/05/28/59/607052859.db2.gz BHSBKCQJVCBCQN-UHFFFAOYSA-N -1 3 356.455 3.755 20 0 FHADHM CCC(CC)CC(=O)Nc1nc(-c2ccc(-c3nn[n-]n3)cc2)cs1 ZINC000820892550 607052861 /nfs/dbraw/zinc/05/28/61/607052861.db2.gz BHSBKCQJVCBCQN-UHFFFAOYSA-N -1 3 356.455 3.755 20 0 FHADHM CCCC1(C(=O)Nc2nc(-c3ccc(-c4nnn[n-]4)cc3)cs2)CCC1 ZINC000821026963 607052865 /nfs/dbraw/zinc/05/28/65/607052865.db2.gz IUVUOLXMXHRKMW-UHFFFAOYSA-N -1 3 368.466 3.899 20 0 FHADHM CCCC1(C(=O)Nc2nc(-c3ccc(-c4nn[n-]n4)cc3)cs2)CCC1 ZINC000821026963 607052867 /nfs/dbraw/zinc/05/28/67/607052867.db2.gz IUVUOLXMXHRKMW-UHFFFAOYSA-N -1 3 368.466 3.899 20 0 FHADHM CCOc1cc(Cl)ccc1NC(=O)C=Cc1ccccc1-c1nnn[n-]1 ZINC000821395232 607054405 /nfs/dbraw/zinc/05/44/05/607054405.db2.gz TXIFXEWKQHJSAO-JXMROGBWSA-N -1 3 369.812 3.571 20 0 FHADHM CCOc1cc(Cl)ccc1NC(=O)C=Cc1ccccc1-c1nn[n-]n1 ZINC000821395232 607054407 /nfs/dbraw/zinc/05/44/07/607054407.db2.gz TXIFXEWKQHJSAO-JXMROGBWSA-N -1 3 369.812 3.571 20 0 FHADHM CCCC1(C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)CC(C)C)CCC1 ZINC000821028093 607054729 /nfs/dbraw/zinc/05/47/29/607054729.db2.gz UKJOPTJLJOPMFY-UHFFFAOYSA-N -1 3 355.486 3.822 20 0 FHADHM CCCC1(C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)CC(C)C)CCC1 ZINC000821028093 607054731 /nfs/dbraw/zinc/05/47/31/607054731.db2.gz UKJOPTJLJOPMFY-UHFFFAOYSA-N -1 3 355.486 3.822 20 0 FHADHM O=C(c1ccc(-c2nnn[n-]2)cc1)N1CCc2cc(-c3ccccc3)ccc21 ZINC000823478681 607056890 /nfs/dbraw/zinc/05/68/90/607056890.db2.gz PEJXBHMCHRCXDM-UHFFFAOYSA-N -1 3 367.412 3.737 20 0 FHADHM O=C(c1ccc(-c2nn[n-]n2)cc1)N1CCc2cc(-c3ccccc3)ccc21 ZINC000823478681 607056892 /nfs/dbraw/zinc/05/68/92/607056892.db2.gz PEJXBHMCHRCXDM-UHFFFAOYSA-N -1 3 367.412 3.737 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NC(=O)C[C@H](C)c1ccc(F)cc1 ZINC000821292860 607101608 /nfs/dbraw/zinc/10/16/08/607101608.db2.gz FPLDAMHAJAVGET-LBPRGKRZSA-N -1 3 368.416 3.570 20 0 FHADHM Clc1cc(N2CCC3(CC2)OCc2ccccc23)ccc1-c1nnn[n-]1 ZINC000822567765 607119330 /nfs/dbraw/zinc/11/93/30/607119330.db2.gz HHEQBWKDFDZLIV-UHFFFAOYSA-N -1 3 367.840 3.546 20 0 FHADHM Clc1cc(N2CCC3(CC2)OCc2ccccc23)ccc1-c1nn[n-]n1 ZINC000822567765 607119332 /nfs/dbraw/zinc/11/93/32/607119332.db2.gz HHEQBWKDFDZLIV-UHFFFAOYSA-N -1 3 367.840 3.546 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1OCc1coc(-c2ccc(Cl)cc2)n1 ZINC000822748219 607135180 /nfs/dbraw/zinc/13/51/80/607135180.db2.gz NWABMBCVLLGDLW-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1OCc1coc(-c2ccc(Cl)cc2)n1 ZINC000822748219 607135182 /nfs/dbraw/zinc/13/51/82/607135182.db2.gz NWABMBCVLLGDLW-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1OCc1csc(-c2cccs2)n1 ZINC000822748447 607135590 /nfs/dbraw/zinc/13/55/90/607135590.db2.gz ZBWOAXMSFQJITD-UHFFFAOYSA-N -1 3 359.411 3.770 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1OCc1csc(-c2cccs2)n1 ZINC000822748447 607135592 /nfs/dbraw/zinc/13/55/92/607135592.db2.gz ZBWOAXMSFQJITD-UHFFFAOYSA-N -1 3 359.411 3.770 20 0 FHADHM Cc1oc(-c2ccsc2)nc1COc1ccc(-c2nnn[n-]2)cc1F ZINC000822535248 607136475 /nfs/dbraw/zinc/13/64/75/607136475.db2.gz LDKQPSBEIZRNDU-UHFFFAOYSA-N -1 3 357.370 3.610 20 0 FHADHM Cc1oc(-c2ccsc2)nc1COc1ccc(-c2nn[n-]n2)cc1F ZINC000822535248 607136476 /nfs/dbraw/zinc/13/64/76/607136476.db2.gz LDKQPSBEIZRNDU-UHFFFAOYSA-N -1 3 357.370 3.610 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1OCc1cc(Cl)cc2cccnc21 ZINC000822748070 607138431 /nfs/dbraw/zinc/13/84/31/607138431.db2.gz GALVMODBDWWYLV-UHFFFAOYSA-N -1 3 355.760 3.786 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1OCc1cc(Cl)cc2cccnc21 ZINC000822748070 607138432 /nfs/dbraw/zinc/13/84/32/607138432.db2.gz GALVMODBDWWYLV-UHFFFAOYSA-N -1 3 355.760 3.786 20 0 FHADHM Cc1ccccc1-c1noc([C@H](C)Oc2ccc(-c3nnn[n-]3)cc2F)n1 ZINC000822345107 607140071 /nfs/dbraw/zinc/14/00/71/607140071.db2.gz DQGQCXQFNDKESX-NSHDSACASA-N -1 3 366.356 3.504 20 0 FHADHM Cc1ccccc1-c1noc([C@H](C)Oc2ccc(-c3nn[n-]n3)cc2F)n1 ZINC000822345107 607140072 /nfs/dbraw/zinc/14/00/72/607140072.db2.gz DQGQCXQFNDKESX-NSHDSACASA-N -1 3 366.356 3.504 20 0 FHADHM Cc1ccccc1-c1cnc(COc2ccc(-c3nnn[n-]3)cc2F)o1 ZINC000822345848 607140350 /nfs/dbraw/zinc/14/03/50/607140350.db2.gz ULZIBPHOCINNCS-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM Cc1ccccc1-c1cnc(COc2ccc(-c3nn[n-]n3)cc2F)o1 ZINC000822345848 607140351 /nfs/dbraw/zinc/14/03/51/607140351.db2.gz ULZIBPHOCINNCS-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM CCC[C@H](C)[C@H]1CCCN1C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000821016406 607140893 /nfs/dbraw/zinc/14/08/93/607140893.db2.gz WFAXCVYFNKHEKV-DZGCQCFKSA-N -1 3 373.505 3.856 20 0 FHADHM CCC[C@H](C)[C@H]1CCCN1C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000821016406 607140895 /nfs/dbraw/zinc/14/08/95/607140895.db2.gz WFAXCVYFNKHEKV-DZGCQCFKSA-N -1 3 373.505 3.856 20 0 FHADHM CC(C)CC[C@H]1CCCN1C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820072291 607152890 /nfs/dbraw/zinc/15/28/90/607152890.db2.gz DTVGFJPZZWAPGT-RHSMWYFYSA-N -1 3 356.474 3.538 20 0 FHADHM CC(C)CC[C@H]1CCCN1C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820072291 607152891 /nfs/dbraw/zinc/15/28/91/607152891.db2.gz DTVGFJPZZWAPGT-RHSMWYFYSA-N -1 3 356.474 3.538 20 0 FHADHM COC(=O)c1oc([C@@H](C)Sc2ccc(-c3nnn[n-]3)cc2F)cc1C ZINC000821671410 607169745 /nfs/dbraw/zinc/16/97/45/607169745.db2.gz VDQBZOPUQYJLGS-SECBINFHSA-N -1 3 362.386 3.547 20 0 FHADHM COC(=O)c1oc([C@@H](C)Sc2ccc(-c3nn[n-]n3)cc2F)cc1C ZINC000821671410 607169746 /nfs/dbraw/zinc/16/97/46/607169746.db2.gz VDQBZOPUQYJLGS-SECBINFHSA-N -1 3 362.386 3.547 20 0 FHADHM Cc1cnc([C@H](C)Nc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)s1 ZINC000822389253 607173895 /nfs/dbraw/zinc/17/38/95/607173895.db2.gz QAFYRWWBFCDGQA-QMMMGPOBSA-N -1 3 354.361 3.824 20 0 FHADHM Cc1cnc([C@H](C)Nc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)s1 ZINC000822389253 607173896 /nfs/dbraw/zinc/17/38/96/607173896.db2.gz QAFYRWWBFCDGQA-QMMMGPOBSA-N -1 3 354.361 3.824 20 0 FHADHM Cc1cccc(OCCCC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)c1 ZINC000822328445 607189064 /nfs/dbraw/zinc/18/90/64/607189064.db2.gz PZZJPILOWSRNDH-UHFFFAOYSA-N -1 3 371.828 3.626 20 0 FHADHM Cc1cccc(OCCCC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)c1 ZINC000822328445 607189065 /nfs/dbraw/zinc/18/90/65/607189065.db2.gz PZZJPILOWSRNDH-UHFFFAOYSA-N -1 3 371.828 3.626 20 0 FHADHM O=C(CCc1c[nH]c2ccccc12)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822974699 607190914 /nfs/dbraw/zinc/19/09/14/607190914.db2.gz ZFJOQVMUAMEXTQ-UHFFFAOYSA-N -1 3 366.812 3.573 20 0 FHADHM O=C(CCc1c[nH]c2ccccc12)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822974699 607190915 /nfs/dbraw/zinc/19/09/15/607190915.db2.gz ZFJOQVMUAMEXTQ-UHFFFAOYSA-N -1 3 366.812 3.573 20 0 FHADHM CCC[C@@H](C)[C@@H]1CCCN1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000821015617 607197381 /nfs/dbraw/zinc/19/73/81/607197381.db2.gz RMUHDGVVZMZCJK-ABAIWWIYSA-N -1 3 362.865 3.953 20 0 FHADHM CCC[C@@H](C)[C@@H]1CCCN1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000821015617 607197382 /nfs/dbraw/zinc/19/73/82/607197382.db2.gz RMUHDGVVZMZCJK-ABAIWWIYSA-N -1 3 362.865 3.953 20 0 FHADHM CCN(Cc1ccccc1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000821220949 607203294 /nfs/dbraw/zinc/20/32/94/607203294.db2.gz GPQBKAUBLPGGIZ-UHFFFAOYSA-N -1 3 356.817 3.574 20 0 FHADHM CCN(Cc1ccccc1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000821220949 607203295 /nfs/dbraw/zinc/20/32/95/607203295.db2.gz GPQBKAUBLPGGIZ-UHFFFAOYSA-N -1 3 356.817 3.574 20 0 FHADHM C[C@@H](N[C@@H](c1ccccc1)c1ccccn1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820414282 607208706 /nfs/dbraw/zinc/20/87/06/607208706.db2.gz XLQNGZXHQZIQDD-QRWLVFNGSA-N -1 3 356.433 3.702 20 0 FHADHM C[C@@H](OC1CCCCCC1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820519195 607242073 /nfs/dbraw/zinc/24/20/73/607242073.db2.gz QKAQJKMHBCUOJR-LLVKDONJSA-N -1 3 363.849 3.587 20 0 FHADHM C[C@@H](OC1CCCCCC1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820519195 607242074 /nfs/dbraw/zinc/24/20/74/607242074.db2.gz QKAQJKMHBCUOJR-LLVKDONJSA-N -1 3 363.849 3.587 20 0 FHADHM COc1cccc([C@@H](C)CC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)c1 ZINC000821859270 607242414 /nfs/dbraw/zinc/24/24/14/607242414.db2.gz NKBBSPCYYXZWEW-NSHDSACASA-N -1 3 371.828 3.661 20 0 FHADHM COc1cccc([C@@H](C)CC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)c1 ZINC000821859270 607242415 /nfs/dbraw/zinc/24/24/15/607242415.db2.gz NKBBSPCYYXZWEW-NSHDSACASA-N -1 3 371.828 3.661 20 0 FHADHM CS[C@@H](C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccccc1 ZINC000821943211 607243596 /nfs/dbraw/zinc/24/35/96/607243596.db2.gz UORLBQZZTIAHAC-CQSZACIVSA-N -1 3 359.842 3.563 20 0 FHADHM CS[C@@H](C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccccc1 ZINC000821943211 607243597 /nfs/dbraw/zinc/24/35/97/607243597.db2.gz UORLBQZZTIAHAC-CQSZACIVSA-N -1 3 359.842 3.563 20 0 FHADHM Cc1ncc(NC(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)s1 ZINC000826330126 607773858 /nfs/dbraw/zinc/77/38/58/607773858.db2.gz GTUGGIRNHJLWGH-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1ncc(NC(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)s1 ZINC000826330126 607773859 /nfs/dbraw/zinc/77/38/59/607773859.db2.gz GTUGGIRNHJLWGH-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM C[C@H]1CC[C@@H](NC(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)c2ccccc21 ZINC000824914970 607774991 /nfs/dbraw/zinc/77/49/91/607774991.db2.gz AUMYLQITTQICRB-MGPLVRAMSA-N -1 3 369.375 3.513 20 0 FHADHM C[C@H]1CC[C@@H](NC(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)c2ccccc21 ZINC000824914970 607774992 /nfs/dbraw/zinc/77/49/92/607774992.db2.gz AUMYLQITTQICRB-MGPLVRAMSA-N -1 3 369.375 3.513 20 0 FHADHM C[C@@H](OC(=O)C[C@H](C)c1ccc(F)cc1F)c1cccc(-c2nnn[n-]2)c1 ZINC000824384531 607777251 /nfs/dbraw/zinc/77/72/51/607777251.db2.gz CZCQRKNXXNEPPL-NWDGAFQWSA-N -1 3 372.375 3.943 20 0 FHADHM C[C@@H](OC(=O)C[C@H](C)c1ccc(F)cc1F)c1cccc(-c2nn[n-]n2)c1 ZINC000824384531 607777252 /nfs/dbraw/zinc/77/72/52/607777252.db2.gz CZCQRKNXXNEPPL-NWDGAFQWSA-N -1 3 372.375 3.943 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@@H](C)c2ccccc2)cc1-c1nnn[n-]1 ZINC000825553208 607783988 /nfs/dbraw/zinc/78/39/88/607783988.db2.gz MVHIPPPQZTXARX-LBPRGKRZSA-N -1 3 352.398 3.608 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@@H](C)c2ccccc2)cc1-c1nn[n-]n1 ZINC000825553208 607783989 /nfs/dbraw/zinc/78/39/89/607783989.db2.gz MVHIPPPQZTXARX-LBPRGKRZSA-N -1 3 352.398 3.608 20 0 FHADHM Cc1nc(C2CCCC2)sc1C(=O)N(C)c1ccccc1-c1nnn[n-]1 ZINC000826324227 607786797 /nfs/dbraw/zinc/78/67/97/607786797.db2.gz JBTCPGNUCSRLQS-UHFFFAOYSA-N -1 3 368.466 3.566 20 0 FHADHM Cc1nc(C2CCCC2)sc1C(=O)N(C)c1ccccc1-c1nn[n-]n1 ZINC000826324227 607786798 /nfs/dbraw/zinc/78/67/98/607786798.db2.gz JBTCPGNUCSRLQS-UHFFFAOYSA-N -1 3 368.466 3.566 20 0 FHADHM CCCc1cc(C(=O)N(CC)c2ccc(-c3nnn[n-]3)cc2)sc1C ZINC000825348584 607797084 /nfs/dbraw/zinc/79/70/84/607797084.db2.gz QSGQEICTNLFHJK-UHFFFAOYSA-N -1 3 355.467 3.856 20 0 FHADHM CCCc1cc(C(=O)N(CC)c2ccc(-c3nn[n-]n3)cc2)sc1C ZINC000825348584 607797085 /nfs/dbraw/zinc/79/70/85/607797085.db2.gz QSGQEICTNLFHJK-UHFFFAOYSA-N -1 3 355.467 3.856 20 0 FHADHM CCN(C(=O)[C@@H](C)c1cccc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825362822 607798782 /nfs/dbraw/zinc/79/87/82/607798782.db2.gz RMBNARLCJRGUGE-LBPRGKRZSA-N -1 3 355.829 3.677 20 0 FHADHM CCN(C(=O)[C@@H](C)c1cccc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825362822 607798783 /nfs/dbraw/zinc/79/87/83/607798783.db2.gz RMBNARLCJRGUGE-LBPRGKRZSA-N -1 3 355.829 3.677 20 0 FHADHM CCN(C(=O)c1oc2c(cccc2F)c1C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825390436 607800559 /nfs/dbraw/zinc/80/05/59/607800559.db2.gz DXOFTPFORNOCSN-UHFFFAOYSA-N -1 3 365.368 3.727 20 0 FHADHM CCN(C(=O)c1oc2c(cccc2F)c1C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825390436 607800560 /nfs/dbraw/zinc/80/05/60/607800560.db2.gz DXOFTPFORNOCSN-UHFFFAOYSA-N -1 3 365.368 3.727 20 0 FHADHM C[C@@H](Cc1ccccc1Cl)C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000824458281 607819232 /nfs/dbraw/zinc/81/92/32/607819232.db2.gz VATOZVMCMVQYOW-STQMWFEESA-N -1 3 369.856 3.576 20 0 FHADHM C[C@@H](Cc1ccccc1Cl)C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000824458281 607819233 /nfs/dbraw/zinc/81/92/33/607819233.db2.gz VATOZVMCMVQYOW-STQMWFEESA-N -1 3 369.856 3.576 20 0 FHADHM Fc1cccc(N2CCC(Oc3ccccc3Cl)CC2)c1-c1nnn[n-]1 ZINC000826377571 607820387 /nfs/dbraw/zinc/82/03/87/607820387.db2.gz XIKFDPKCJYZGFF-UHFFFAOYSA-N -1 3 373.819 3.707 20 0 FHADHM Fc1cccc(N2CCC(Oc3ccccc3Cl)CC2)c1-c1nn[n-]n1 ZINC000826377571 607820388 /nfs/dbraw/zinc/82/03/88/607820388.db2.gz XIKFDPKCJYZGFF-UHFFFAOYSA-N -1 3 373.819 3.707 20 0 FHADHM Cc1ccc(CC(=O)N(Cc2ccccc2)c2ccccc2-c2nnn[n-]2)o1 ZINC000826286557 607827348 /nfs/dbraw/zinc/82/73/48/607827348.db2.gz HDVXHFDRAWHTHV-UHFFFAOYSA-N -1 3 373.416 3.544 20 0 FHADHM Cc1ccc(CC(=O)N(Cc2ccccc2)c2ccccc2-c2nn[n-]n2)o1 ZINC000826286557 607827349 /nfs/dbraw/zinc/82/73/49/607827349.db2.gz HDVXHFDRAWHTHV-UHFFFAOYSA-N -1 3 373.416 3.544 20 0 FHADHM O=C(NCCCC1CCCC1)c1c(Cl)cc(-c2nnn[n-]2)cc1Cl ZINC000826436413 607833858 /nfs/dbraw/zinc/83/38/58/607833858.db2.gz SCXOMPZVROCXMX-UHFFFAOYSA-N -1 3 368.268 3.874 20 0 FHADHM O=C(NCCCC1CCCC1)c1c(Cl)cc(-c2nn[n-]n2)cc1Cl ZINC000826436413 607833859 /nfs/dbraw/zinc/83/38/59/607833859.db2.gz SCXOMPZVROCXMX-UHFFFAOYSA-N -1 3 368.268 3.874 20 0 FHADHM CC(C)[C@@H](Sc1ccc(-c2nnn[n-]2)cc1Cl)C(=O)NC(C)(C)C ZINC000824206926 607844156 /nfs/dbraw/zinc/84/41/56/607844156.db2.gz LZRJJAKTYXEJNB-CYBMUJFWSA-N -1 3 367.906 3.552 20 0 FHADHM O[C@H](COc1cccc(Oc2ccccc2)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000826505256 607870071 /nfs/dbraw/zinc/87/00/71/607870071.db2.gz QPBHRJAEDADWKJ-HXUWFJFHSA-N -1 3 374.400 3.771 20 0 FHADHM O[C@H](COc1cccc(Oc2ccccc2)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000826505256 607870072 /nfs/dbraw/zinc/87/00/72/607870072.db2.gz QPBHRJAEDADWKJ-HXUWFJFHSA-N -1 3 374.400 3.771 20 0 FHADHM CCN(C(=O)CCCc1ccccc1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825371715 607877889 /nfs/dbraw/zinc/87/78/89/607877889.db2.gz ITLCZZAWOZMABK-UHFFFAOYSA-N -1 3 369.856 3.896 20 0 FHADHM CCN(C(=O)CCCc1ccccc1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825371715 607877890 /nfs/dbraw/zinc/87/78/90/607877890.db2.gz ITLCZZAWOZMABK-UHFFFAOYSA-N -1 3 369.856 3.896 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@@H]1CCCC(C)(C)C1 ZINC000824293402 607888335 /nfs/dbraw/zinc/88/83/35/607888335.db2.gz KLJPYDDWRMTWHJ-QGZVFWFLSA-N -1 3 355.486 3.820 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@@H]1CCCC(C)(C)C1 ZINC000824293402 607888336 /nfs/dbraw/zinc/88/83/36/607888336.db2.gz KLJPYDDWRMTWHJ-QGZVFWFLSA-N -1 3 355.486 3.820 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@@H](C)Cc1cccc(Cl)c1 ZINC000826277091 607889557 /nfs/dbraw/zinc/88/95/57/607889557.db2.gz IZHSDNGJTAQVCS-LBPRGKRZSA-N -1 3 355.829 3.646 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@@H](C)Cc1cccc(Cl)c1 ZINC000826277091 607889558 /nfs/dbraw/zinc/88/95/58/607889558.db2.gz IZHSDNGJTAQVCS-LBPRGKRZSA-N -1 3 355.829 3.646 20 0 FHADHM CN(C(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1ccc(-c2nnn[n-]2)cc1F ZINC000825812915 607926333 /nfs/dbraw/zinc/92/63/33/607926333.db2.gz XNQFFIURZAAYRE-GZBFAFLISA-N -1 3 357.433 3.575 20 0 FHADHM CN(C(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1ccc(-c2nn[n-]n2)cc1F ZINC000825812915 607926334 /nfs/dbraw/zinc/92/63/34/607926334.db2.gz XNQFFIURZAAYRE-GZBFAFLISA-N -1 3 357.433 3.575 20 0 FHADHM CC(C)C[C@@H](C(=O)N1CCc2ccc(-c3nnn[n-]3)cc21)c1ccccc1 ZINC000824229862 607950519 /nfs/dbraw/zinc/95/05/19/607950519.db2.gz WLOIQKYURMDEGS-GOSISDBHSA-N -1 3 361.449 3.586 20 0 FHADHM CC(C)C[C@@H](C(=O)N1CCc2ccc(-c3nn[n-]n3)cc21)c1ccccc1 ZINC000824229862 607950520 /nfs/dbraw/zinc/95/05/20/607950520.db2.gz WLOIQKYURMDEGS-GOSISDBHSA-N -1 3 361.449 3.586 20 0 FHADHM CS[C@@H](C)CC(=O)Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1 ZINC000826224532 607962428 /nfs/dbraw/zinc/96/24/28/607962428.db2.gz HBQDGGOIPQYFDV-JTQLQIEISA-N -1 3 359.480 3.675 20 0 FHADHM CS[C@@H](C)CC(=O)Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1 ZINC000826224532 607962429 /nfs/dbraw/zinc/96/24/29/607962429.db2.gz HBQDGGOIPQYFDV-JTQLQIEISA-N -1 3 359.480 3.675 20 0 FHADHM O=C(CCn1ccc2cc(Cl)ccc21)Nc1cccc(-c2nnn[n-]2)c1 ZINC000126559202 607964655 /nfs/dbraw/zinc/96/46/55/607964655.db2.gz JKGFQGSQTDXQRF-UHFFFAOYSA-N -1 3 366.812 3.504 20 0 FHADHM O=C(CCn1ccc2cc(Cl)ccc21)Nc1cccc(-c2nn[n-]n2)c1 ZINC000126559202 607964656 /nfs/dbraw/zinc/96/46/56/607964656.db2.gz JKGFQGSQTDXQRF-UHFFFAOYSA-N -1 3 366.812 3.504 20 0 FHADHM Cn1cc(-c2ccccc2CNc2cc(Cl)ccc2-c2nnn[n-]2)cn1 ZINC000826356373 607966742 /nfs/dbraw/zinc/96/67/42/607966742.db2.gz NTWOZOVSFVAICI-UHFFFAOYSA-N -1 3 365.828 3.533 20 0 FHADHM Cn1cc(-c2ccccc2CNc2cc(Cl)ccc2-c2nn[n-]n2)cn1 ZINC000826356373 607966743 /nfs/dbraw/zinc/96/67/43/607966743.db2.gz NTWOZOVSFVAICI-UHFFFAOYSA-N -1 3 365.828 3.533 20 0 FHADHM CCn1c2ccc(-c3nnn[n-]3)cc2nc1-c1cc2cccc(OC)c2o1 ZINC000825782770 607975257 /nfs/dbraw/zinc/97/52/57/607975257.db2.gz OMWLQXGZUDWGJW-UHFFFAOYSA-N -1 3 360.377 3.658 20 0 FHADHM CCn1c2ccc(-c3nn[n-]n3)cc2nc1-c1cc2cccc(OC)c2o1 ZINC000825782770 607975258 /nfs/dbraw/zinc/97/52/58/607975258.db2.gz OMWLQXGZUDWGJW-UHFFFAOYSA-N -1 3 360.377 3.658 20 0 FHADHM CCn1c2ccc(-c3nnn[n-]3)cc2nc1-c1cccc(-c2cccnc2)c1 ZINC000825782799 607975992 /nfs/dbraw/zinc/97/59/92/607975992.db2.gz PYLJICLEWRVNQS-UHFFFAOYSA-N -1 3 367.416 3.965 20 0 FHADHM CCn1c2ccc(-c3nn[n-]n3)cc2nc1-c1cccc(-c2cccnc2)c1 ZINC000825782799 607975993 /nfs/dbraw/zinc/97/59/93/607975993.db2.gz PYLJICLEWRVNQS-UHFFFAOYSA-N -1 3 367.416 3.965 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)N1CCCC12CCCCC2 ZINC000824148544 607977107 /nfs/dbraw/zinc/97/71/07/607977107.db2.gz ZHIVKSJEMITZLX-UHFFFAOYSA-N -1 3 371.489 3.754 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)N1CCCC12CCCCC2 ZINC000824148544 607977108 /nfs/dbraw/zinc/97/71/08/607977108.db2.gz ZHIVKSJEMITZLX-UHFFFAOYSA-N -1 3 371.489 3.754 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000823942806 607986057 /nfs/dbraw/zinc/98/60/57/607986057.db2.gz JOIBKDNQUWCGMZ-CNELAYHGSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000823942806 607986058 /nfs/dbraw/zinc/98/60/58/607986058.db2.gz JOIBKDNQUWCGMZ-CNELAYHGSA-N -1 3 367.840 3.801 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)N1CCCC12CCCCC2 ZINC000826452032 608006456 /nfs/dbraw/zinc/00/64/56/608006456.db2.gz FWLKVMYBGNJDBI-UHFFFAOYSA-N -1 3 360.849 3.851 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)N1CCCC12CCCCC2 ZINC000826452032 608006457 /nfs/dbraw/zinc/00/64/57/608006457.db2.gz FWLKVMYBGNJDBI-UHFFFAOYSA-N -1 3 360.849 3.851 20 0 FHADHM O=C(NC1(c2cccc(-c3nnn[n-]3)c2)CC1)c1cccc(-c2ccoc2)c1 ZINC000826428070 608030011 /nfs/dbraw/zinc/03/00/11/608030011.db2.gz NRUNJZKQIBNOHN-UHFFFAOYSA-N -1 3 371.400 3.546 20 0 FHADHM O=C(NC1(c2cccc(-c3nn[n-]n3)c2)CC1)c1cccc(-c2ccoc2)c1 ZINC000826428070 608030012 /nfs/dbraw/zinc/03/00/12/608030012.db2.gz NRUNJZKQIBNOHN-UHFFFAOYSA-N -1 3 371.400 3.546 20 0 FHADHM CC[C@H](C)NC(=O)c1ccc(Oc2ccccc2-c2nnn[n-]2)c(Cl)c1 ZINC000825068433 608046266 /nfs/dbraw/zinc/04/62/66/608046266.db2.gz RPSDLEYRLKAXPA-NSHDSACASA-N -1 3 371.828 3.841 20 0 FHADHM CC[C@H](C)NC(=O)c1ccc(Oc2ccccc2-c2nn[n-]n2)c(Cl)c1 ZINC000825068433 608046267 /nfs/dbraw/zinc/04/62/67/608046267.db2.gz RPSDLEYRLKAXPA-NSHDSACASA-N -1 3 371.828 3.841 20 0 FHADHM C[C@H](Nc1ccc(-c2nn[n-]n2)cc1Br)c1cccs1 ZINC000824647959 608047027 /nfs/dbraw/zinc/04/70/27/608047027.db2.gz CLTAWSWFNFRFIQ-QMMMGPOBSA-N -1 3 350.245 3.864 20 0 FHADHM COc1ccccc1[C@H](C)Nc1ccc(-c2nn[n-]n2)cc1Br ZINC000826219079 608047380 /nfs/dbraw/zinc/04/73/80/608047380.db2.gz SITMZFMNWOXIDQ-JTQLQIEISA-N -1 3 374.242 3.811 20 0 FHADHM CN(C(=O)c1ccc(Oc2ccccc2-c2nnn[n-]2)c(Cl)c1)C1CC1 ZINC000825830232 608054042 /nfs/dbraw/zinc/05/40/42/608054042.db2.gz PMPYMIWUJWWRCK-UHFFFAOYSA-N -1 3 369.812 3.547 20 0 FHADHM CN(C(=O)c1ccc(Oc2ccccc2-c2nn[n-]n2)c(Cl)c1)C1CC1 ZINC000825830232 608054043 /nfs/dbraw/zinc/05/40/43/608054043.db2.gz PMPYMIWUJWWRCK-UHFFFAOYSA-N -1 3 369.812 3.547 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1CNCc1c(Cl)oc2ccccc21 ZINC000826371423 608055174 /nfs/dbraw/zinc/05/51/74/608055174.db2.gz FWOFMHOOGYARAI-UHFFFAOYSA-N -1 3 357.776 3.695 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CNCc1c(Cl)oc2ccccc21 ZINC000826371423 608055175 /nfs/dbraw/zinc/05/51/75/608055175.db2.gz FWOFMHOOGYARAI-UHFFFAOYSA-N -1 3 357.776 3.695 20 0 FHADHM C[C@@H](c1ccccc1Cl)N1CCO[C@H](c2cccc(-c3nnn[n-]3)c2)C1 ZINC000824772609 608066295 /nfs/dbraw/zinc/06/62/95/608066295.db2.gz VRNKGADFIMEQGL-UGSOOPFHSA-N -1 3 369.856 3.655 20 0 FHADHM C[C@@H](c1ccccc1Cl)N1CCO[C@H](c2cccc(-c3nn[n-]n3)c2)C1 ZINC000824772609 608066296 /nfs/dbraw/zinc/06/62/96/608066296.db2.gz VRNKGADFIMEQGL-UGSOOPFHSA-N -1 3 369.856 3.655 20 0 FHADHM Cc1cc(C)c(C(=O)Nc2ccc(OC(C)C)c(-c3nnn[n-]3)c2)c(C)c1 ZINC000826262996 608072875 /nfs/dbraw/zinc/07/28/75/608072875.db2.gz HJIGGMJTSBLDTM-UHFFFAOYSA-N -1 3 365.437 3.831 20 0 FHADHM Cc1cc(C)c(C(=O)Nc2ccc(OC(C)C)c(-c3nn[n-]n3)c2)c(C)c1 ZINC000826262996 608072876 /nfs/dbraw/zinc/07/28/76/608072876.db2.gz HJIGGMJTSBLDTM-UHFFFAOYSA-N -1 3 365.437 3.831 20 0 FHADHM Fc1cccc(N2CCCC[C@H]2c2nc3ccccc3o2)c1-c1nnn[n-]1 ZINC000826377424 608077520 /nfs/dbraw/zinc/07/75/20/608077520.db2.gz RMPOSMRLOZVNKD-HNNXBMFYSA-N -1 3 364.384 3.879 20 0 FHADHM Fc1cccc(N2CCCC[C@H]2c2nc3ccccc3o2)c1-c1nn[n-]n1 ZINC000826377424 608077521 /nfs/dbraw/zinc/07/75/21/608077521.db2.gz RMPOSMRLOZVNKD-HNNXBMFYSA-N -1 3 364.384 3.879 20 0 FHADHM CN(C)c1ccc(C(F)(F)F)cc1NCc1cc(-c2nnn[n-]2)cs1 ZINC000825875531 608112154 /nfs/dbraw/zinc/11/21/54/608112154.db2.gz SBRLNRKEPOIFLD-UHFFFAOYSA-N -1 3 368.388 3.625 20 0 FHADHM CN(C)c1ccc(C(F)(F)F)cc1NCc1cc(-c2nn[n-]n2)cs1 ZINC000825875531 608112155 /nfs/dbraw/zinc/11/21/55/608112155.db2.gz SBRLNRKEPOIFLD-UHFFFAOYSA-N -1 3 368.388 3.625 20 0 FHADHM CC(C)(C)OC(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824114144 608151874 /nfs/dbraw/zinc/15/18/74/608151874.db2.gz KPLFVFWOHTZJJA-UHFFFAOYSA-N -1 3 367.409 3.793 20 0 FHADHM CC(C)(C)OC(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824114144 608151875 /nfs/dbraw/zinc/15/18/75/608151875.db2.gz KPLFVFWOHTZJJA-UHFFFAOYSA-N -1 3 367.409 3.793 20 0 FHADHM C[C@@H](OC(=O)[C@@H]1SCCc2sccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000824716607 608181904 /nfs/dbraw/zinc/18/19/04/608181904.db2.gz YUIZSWCGOFSIQH-MEBBXXQBSA-N -1 3 372.475 3.563 20 0 FHADHM C[C@@H](OC(=O)[C@@H]1SCCc2sccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000824716607 608181906 /nfs/dbraw/zinc/18/19/06/608181906.db2.gz YUIZSWCGOFSIQH-MEBBXXQBSA-N -1 3 372.475 3.563 20 0 FHADHM CC[C@H](OC1CCCCC1)C(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000825154324 608184049 /nfs/dbraw/zinc/18/40/49/608184049.db2.gz NOVIHFRRJGRABE-DYVFJYSZSA-N -1 3 358.442 3.599 20 0 FHADHM CC[C@H](OC1CCCCC1)C(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000825154324 608184050 /nfs/dbraw/zinc/18/40/50/608184050.db2.gz NOVIHFRRJGRABE-DYVFJYSZSA-N -1 3 358.442 3.599 20 0 FHADHM CC[C@H](OC1CCCCC1)C(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000825154326 608184342 /nfs/dbraw/zinc/18/43/42/608184342.db2.gz NOVIHFRRJGRABE-GUYCJALGSA-N -1 3 358.442 3.599 20 0 FHADHM CC[C@H](OC1CCCCC1)C(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000825154326 608184344 /nfs/dbraw/zinc/18/43/44/608184344.db2.gz NOVIHFRRJGRABE-GUYCJALGSA-N -1 3 358.442 3.599 20 0 FHADHM C[C@@H](c1ccccc1)n1ccc(Nc2snc(Cl)c2-c2nnn[n-]2)n1 ZINC000824770502 608189999 /nfs/dbraw/zinc/18/99/99/608189999.db2.gz LHDAYNDTFSXMSI-VIFPVBQESA-N -1 3 372.845 3.526 20 0 FHADHM O=C(N[C@H]1CC12CCCCC2)c1c(Cl)cc(-c2nn[n-]n2)cc1Cl ZINC000826428701 608198830 /nfs/dbraw/zinc/19/88/30/608198830.db2.gz IWSKUVXTMVGFKB-LBPRGKRZSA-N -1 3 366.252 3.626 20 0 FHADHM O=C(N[C@H]1CC12CCCCC2)c1c(Cl)cc(-c2nnn[n-]2)cc1Cl ZINC000826428701 608198828 /nfs/dbraw/zinc/19/88/28/608198828.db2.gz IWSKUVXTMVGFKB-LBPRGKRZSA-N -1 3 366.252 3.626 20 0 FHADHM COc1ccc(CSc2cccc(Cl)c2-c2nnn[n-]2)cc1F ZINC000826208116 608207446 /nfs/dbraw/zinc/20/74/46/608207446.db2.gz UEFIGMFLDGDZNT-UHFFFAOYSA-N -1 3 350.806 3.960 20 0 FHADHM COc1ccc(CSc2cccc(Cl)c2-c2nn[n-]n2)cc1F ZINC000826208116 608207448 /nfs/dbraw/zinc/20/74/48/608207448.db2.gz UEFIGMFLDGDZNT-UHFFFAOYSA-N -1 3 350.806 3.960 20 0 FHADHM Cc1cccn2cc(CSc3cccc(Cl)c3-c3nnn[n-]3)nc12 ZINC000826308335 608207468 /nfs/dbraw/zinc/20/74/68/608207468.db2.gz UXEAGINCLVILOH-UHFFFAOYSA-N -1 3 356.842 3.769 20 0 FHADHM Cc1cccn2cc(CSc3cccc(Cl)c3-c3nn[n-]n3)nc12 ZINC000826308335 608207470 /nfs/dbraw/zinc/20/74/70/608207470.db2.gz UXEAGINCLVILOH-UHFFFAOYSA-N -1 3 356.842 3.769 20 0 FHADHM Cc1cccnc1CSc1nc(-c2ccccc2)ccc1-c1nnn[n-]1 ZINC000826308645 608218673 /nfs/dbraw/zinc/21/86/73/608218673.db2.gz JDHICLLWNTUVTM-UHFFFAOYSA-N -1 3 360.446 3.924 20 0 FHADHM Cc1cccnc1CSc1nc(-c2ccccc2)ccc1-c1nn[n-]n1 ZINC000826308645 608218675 /nfs/dbraw/zinc/21/86/75/608218675.db2.gz JDHICLLWNTUVTM-UHFFFAOYSA-N -1 3 360.446 3.924 20 0 FHADHM C[C@H](Nc1ccc2cc(-c3nnn[n-]3)ccc2n1)c1c(F)cccc1F ZINC000824655349 608222950 /nfs/dbraw/zinc/22/29/50/608222950.db2.gz CIADYBSEVWXSLN-JTQLQIEISA-N -1 3 352.348 3.866 20 0 FHADHM C[C@H](Nc1ccc2cc(-c3nn[n-]n3)ccc2n1)c1c(F)cccc1F ZINC000824655349 608222951 /nfs/dbraw/zinc/22/29/51/608222951.db2.gz CIADYBSEVWXSLN-JTQLQIEISA-N -1 3 352.348 3.866 20 0 FHADHM Fc1cccc([C@@H]2CCN(c3ccc4cc(-c5nnn[n-]5)ccc4n3)C2)c1 ZINC000826376871 608227004 /nfs/dbraw/zinc/22/70/04/608227004.db2.gz WLTUEWHSTKCMEU-MRXNPFEDSA-N -1 3 360.396 3.548 20 0 FHADHM Fc1cccc([C@@H]2CCN(c3ccc4cc(-c5nn[n-]n5)ccc4n3)C2)c1 ZINC000826376871 608227005 /nfs/dbraw/zinc/22/70/05/608227005.db2.gz WLTUEWHSTKCMEU-MRXNPFEDSA-N -1 3 360.396 3.548 20 0 FHADHM CCc1nc([C@@H](C)Nc2ccc3cc(-c4nnn[n-]4)ccc3n2)cs1 ZINC000825746529 608228310 /nfs/dbraw/zinc/22/83/10/608228310.db2.gz YOVSLTSJIYXLRB-SNVBAGLBSA-N -1 3 351.439 3.607 20 0 FHADHM CCc1nc([C@@H](C)Nc2ccc3cc(-c4nn[n-]n4)ccc3n2)cs1 ZINC000825746529 608228312 /nfs/dbraw/zinc/22/83/12/608228312.db2.gz YOVSLTSJIYXLRB-SNVBAGLBSA-N -1 3 351.439 3.607 20 0 FHADHM Cc1cccc([C@H](Nc2cccc(F)c2-c2nnn[n-]2)c2ccccn2)c1 ZINC000826297242 608230936 /nfs/dbraw/zinc/23/09/36/608230936.db2.gz ZMRZODQJFQTPQT-IBGZPJMESA-N -1 3 360.396 3.911 20 0 FHADHM Cc1cccc([C@H](Nc2cccc(F)c2-c2nn[n-]n2)c2ccccn2)c1 ZINC000826297242 608230938 /nfs/dbraw/zinc/23/09/38/608230938.db2.gz ZMRZODQJFQTPQT-IBGZPJMESA-N -1 3 360.396 3.911 20 0 FHADHM CSc1cc(CNc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)ccn1 ZINC000826230340 608241686 /nfs/dbraw/zinc/24/16/86/608241686.db2.gz OHKIBMUUPKITBE-UHFFFAOYSA-N -1 3 366.372 3.615 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccc2[nH]ccc2c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824712825 608246347 /nfs/dbraw/zinc/24/63/47/608246347.db2.gz DEFXHKAIKRJUAA-WOLRVDTOSA-N -1 3 359.389 3.666 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccc2[nH]ccc2c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824712825 608246348 /nfs/dbraw/zinc/24/63/48/608246348.db2.gz DEFXHKAIKRJUAA-WOLRVDTOSA-N -1 3 359.389 3.666 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CSc1c(F)cc(F)cc1F ZINC000826173637 608264553 /nfs/dbraw/zinc/26/45/53/608264553.db2.gz NMVOAKAVIMSCKS-UHFFFAOYSA-N -1 3 352.341 3.585 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CSc1c(F)cc(F)cc1F ZINC000826173637 608264554 /nfs/dbraw/zinc/26/45/54/608264554.db2.gz NMVOAKAVIMSCKS-UHFFFAOYSA-N -1 3 352.341 3.585 20 0 FHADHM CC[C@H](OC(=O)c1cc(-c2nnn[n-]2)cs1)c1cc(C)ccc1OC ZINC000825153490 608272553 /nfs/dbraw/zinc/27/25/53/608272553.db2.gz HURODSYKYLCIEO-ZDUSSCGKSA-N -1 3 358.423 3.553 20 0 FHADHM CC[C@H](OC(=O)c1cc(-c2nn[n-]n2)cs1)c1cc(C)ccc1OC ZINC000825153490 608272554 /nfs/dbraw/zinc/27/25/54/608272554.db2.gz HURODSYKYLCIEO-ZDUSSCGKSA-N -1 3 358.423 3.553 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)C=Cc2ccc3[nH]ccc3c2)s1 ZINC000825694577 608275461 /nfs/dbraw/zinc/27/54/61/608275461.db2.gz UVZRFNKTHUTUHK-XQRVVYSFSA-N -1 3 364.434 3.624 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)C=Cc2ccc3[nH]ccc3c2)s1 ZINC000825694577 608275462 /nfs/dbraw/zinc/27/54/62/608275462.db2.gz UVZRFNKTHUTUHK-XQRVVYSFSA-N -1 3 364.434 3.624 20 0 FHADHM C[C@@H](Nc1nc2c(cc1-c1nnn[n-]1)CCCC2)c1c(F)cccc1F ZINC000824663185 608276598 /nfs/dbraw/zinc/27/65/98/608276598.db2.gz WLFODNJALCTFEJ-SNVBAGLBSA-N -1 3 356.380 3.592 20 0 FHADHM C[C@@H](Nc1nc2c(cc1-c1nn[n-]n1)CCCC2)c1c(F)cccc1F ZINC000824663185 608276599 /nfs/dbraw/zinc/27/65/99/608276599.db2.gz WLFODNJALCTFEJ-SNVBAGLBSA-N -1 3 356.380 3.592 20 0 FHADHM FC(F)(F)c1ccc(C2CCN(c3ccc(-c4nnn[n-]4)nc3)CC2)cc1 ZINC000826368079 608298219 /nfs/dbraw/zinc/29/82/19/608298219.db2.gz AYSJUQZGTUGCLO-UHFFFAOYSA-N -1 3 374.370 3.665 20 0 FHADHM FC(F)(F)c1ccc(C2CCN(c3ccc(-c4nn[n-]n4)nc3)CC2)cc1 ZINC000826368079 608298222 /nfs/dbraw/zinc/29/82/22/608298222.db2.gz AYSJUQZGTUGCLO-UHFFFAOYSA-N -1 3 374.370 3.665 20 0 FHADHM Cc1c(NC(=O)c2ccccc2COC(C)(C)C)cccc1-c1nnn[n-]1 ZINC000826242459 608316207 /nfs/dbraw/zinc/31/62/07/608316207.db2.gz PPLDZFWPWMQLMO-UHFFFAOYSA-N -1 3 365.437 3.743 20 0 FHADHM Cc1c(NC(=O)c2ccccc2COC(C)(C)C)cccc1-c1nn[n-]n1 ZINC000826242459 608316209 /nfs/dbraw/zinc/31/62/09/608316209.db2.gz PPLDZFWPWMQLMO-UHFFFAOYSA-N -1 3 365.437 3.743 20 0 FHADHM O=C(NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1)[C@H]1[C@@H]2CCCC[C@@H]21 ZINC000826440438 608328516 /nfs/dbraw/zinc/32/85/16/608328516.db2.gz MSGSMPPBLRBZPZ-RUYXUALKSA-N -1 3 373.460 3.586 20 0 FHADHM O=C(NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1)[C@H]1[C@@H]2CCCC[C@@H]21 ZINC000826440438 608328517 /nfs/dbraw/zinc/32/85/17/608328517.db2.gz MSGSMPPBLRBZPZ-RUYXUALKSA-N -1 3 373.460 3.586 20 0 FHADHM CCC/C(C)=C/C(=O)NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000825231871 608329189 /nfs/dbraw/zinc/32/91/89/608329189.db2.gz BODZFJHRLXCMRP-FYWRMAATSA-N -1 3 361.449 3.896 20 0 FHADHM CCC/C(C)=C/C(=O)NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000825231871 608329191 /nfs/dbraw/zinc/32/91/91/608329191.db2.gz BODZFJHRLXCMRP-FYWRMAATSA-N -1 3 361.449 3.896 20 0 FHADHM CCN(C(=O)c1cc(C)ccc1F)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825380786 608345385 /nfs/dbraw/zinc/34/53/85/608345385.db2.gz TWHSPRDZDDOSCL-UHFFFAOYSA-N -1 3 359.792 3.634 20 0 FHADHM CCN(C(=O)c1cc(C)ccc1F)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825380786 608345387 /nfs/dbraw/zinc/34/53/87/608345387.db2.gz TWHSPRDZDDOSCL-UHFFFAOYSA-N -1 3 359.792 3.634 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1NCc1cc(-c2ccccc2)no1 ZINC000826352965 608366024 /nfs/dbraw/zinc/36/60/24/608366024.db2.gz VXRAOCSIJBESCT-UHFFFAOYSA-N -1 3 352.785 3.787 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1NCc1cc(-c2ccccc2)no1 ZINC000826352965 608366025 /nfs/dbraw/zinc/36/60/25/608366025.db2.gz VXRAOCSIJBESCT-UHFFFAOYSA-N -1 3 352.785 3.787 20 0 FHADHM CSc1cccc(NC(=O)N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1C ZINC000826231093 608478160 /nfs/dbraw/zinc/47/81/60/608478160.db2.gz WZCMBMYJHDLELY-LBPRGKRZSA-N -1 3 368.466 3.780 20 0 FHADHM CSc1cccc(NC(=O)N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1C ZINC000826231093 608478161 /nfs/dbraw/zinc/47/81/61/608478161.db2.gz WZCMBMYJHDLELY-LBPRGKRZSA-N -1 3 368.466 3.780 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N[C@@H](C)c1ccccc1Cl ZINC000826277769 608479153 /nfs/dbraw/zinc/47/91/53/608479153.db2.gz GHSALXVVQGZUIK-NSHDSACASA-N -1 3 356.817 3.711 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N[C@@H](C)c1ccccc1Cl ZINC000826277769 608479155 /nfs/dbraw/zinc/47/91/55/608479155.db2.gz GHSALXVVQGZUIK-NSHDSACASA-N -1 3 356.817 3.711 20 0 FHADHM Fc1c(CNc2ccccc2OCC(F)(F)F)cccc1-c1nnn[n-]1 ZINC000826370808 608479560 /nfs/dbraw/zinc/47/95/60/608479560.db2.gz IGUZQKRBNYDNJZ-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM Fc1c(CNc2ccccc2OCC(F)(F)F)cccc1-c1nn[n-]n1 ZINC000826370808 608479561 /nfs/dbraw/zinc/47/95/61/608479561.db2.gz IGUZQKRBNYDNJZ-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM C[C@@H](NCc1ncc(-c2cccc(F)c2)o1)c1cccc(-c2nn[n-]n2)c1 ZINC000824634669 608482595 /nfs/dbraw/zinc/48/25/95/608482595.db2.gz WNBFRVDLJJWTQX-GFCCVEGCSA-N -1 3 364.384 3.512 20 0 FHADHM Cc1oc(-c2ccccc2)nc1CN[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000826339935 608486789 /nfs/dbraw/zinc/48/67/89/608486789.db2.gz ABNOKSPYFZQKKK-CYBMUJFWSA-N -1 3 360.421 3.681 20 0 FHADHM C[C@@H](NCc1coc(-c2cccc(F)c2)n1)c1cccc(-c2nn[n-]n2)c1 ZINC000824624945 608487434 /nfs/dbraw/zinc/48/74/34/608487434.db2.gz CRQVEBOOFXBEHU-GFCCVEGCSA-N -1 3 364.384 3.512 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1CNc1ccc(-c2nccs2)cc1 ZINC000826371906 608496677 /nfs/dbraw/zinc/49/66/77/608496677.db2.gz YMMVJGDITGKONT-UHFFFAOYSA-N -1 3 352.398 3.741 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CNc1ccc(-c2nccs2)cc1 ZINC000826371906 608496678 /nfs/dbraw/zinc/49/66/78/608496678.db2.gz YMMVJGDITGKONT-UHFFFAOYSA-N -1 3 352.398 3.741 20 0 FHADHM C[C@H](c1nc2ccccc2s1)N(C)Cc1cc(-c2nnn[n-]2)cs1 ZINC000824776483 608503355 /nfs/dbraw/zinc/50/33/55/608503355.db2.gz BGCXPTAOSVJBEK-SNVBAGLBSA-N -1 3 356.480 3.731 20 0 FHADHM C[C@H](c1nc2ccccc2s1)N(C)Cc1cc(-c2nn[n-]n2)cs1 ZINC000824776483 608503357 /nfs/dbraw/zinc/50/33/57/608503357.db2.gz BGCXPTAOSVJBEK-SNVBAGLBSA-N -1 3 356.480 3.731 20 0 FHADHM c1sc(C2CCCC2)nc1CNC1(c2cccc(-c3nnn[n-]3)c2)CC1 ZINC000826513406 608530078 /nfs/dbraw/zinc/53/00/78/608530078.db2.gz KPGCERAHKFKORE-UHFFFAOYSA-N -1 3 366.494 3.760 20 0 FHADHM c1sc(C2CCCC2)nc1CNC1(c2cccc(-c3nn[n-]n3)c2)CC1 ZINC000826513406 608530080 /nfs/dbraw/zinc/53/00/80/608530080.db2.gz KPGCERAHKFKORE-UHFFFAOYSA-N -1 3 366.494 3.760 20 0 FHADHM Cc1nc(C2CCCCC2)sc1C(=O)Nc1sccc1-c1nnn[n-]1 ZINC000826324518 608539711 /nfs/dbraw/zinc/53/97/11/608539711.db2.gz VEOUQEDUKZPYAS-UHFFFAOYSA-N -1 3 374.495 3.993 20 0 FHADHM Cc1nc(C2CCCCC2)sc1C(=O)Nc1sccc1-c1nn[n-]n1 ZINC000826324518 608539713 /nfs/dbraw/zinc/53/97/13/608539713.db2.gz VEOUQEDUKZPYAS-UHFFFAOYSA-N -1 3 374.495 3.993 20 0 FHADHM FC(F)(F)c1cc(N2CCC(c3cccnc3)CC2)ccc1-c1nnn[n-]1 ZINC000826368306 608554441 /nfs/dbraw/zinc/55/44/41/608554441.db2.gz KZNYBFUMNHRYRF-UHFFFAOYSA-N -1 3 374.370 3.665 20 0 FHADHM FC(F)(F)c1cc(N2CCC(c3cccnc3)CC2)ccc1-c1nn[n-]n1 ZINC000826368306 608554442 /nfs/dbraw/zinc/55/44/42/608554442.db2.gz KZNYBFUMNHRYRF-UHFFFAOYSA-N -1 3 374.370 3.665 20 0 FHADHM C[C@@H](NC(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1)c1ccccc1Cl ZINC000824520950 608572821 /nfs/dbraw/zinc/57/28/21/608572821.db2.gz GOVUPJIOALTZPC-SECBINFHSA-N -1 3 362.220 3.665 20 0 FHADHM C[C@@H](NC(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1)c1ccccc1Cl ZINC000824520950 608572823 /nfs/dbraw/zinc/57/28/23/608572823.db2.gz GOVUPJIOALTZPC-SECBINFHSA-N -1 3 362.220 3.665 20 0 FHADHM C[C@H]1CCN(C(=O)c2ccc(Cl)c(-c3nnn[n-]3)c2)c2ccccc21 ZINC000824957005 608574785 /nfs/dbraw/zinc/57/47/85/608574785.db2.gz VLLDPRSOIXPICC-NSHDSACASA-N -1 3 353.813 3.674 20 0 FHADHM C[C@H]1CCN(C(=O)c2ccc(Cl)c(-c3nn[n-]n3)c2)c2ccccc21 ZINC000824957005 608574786 /nfs/dbraw/zinc/57/47/86/608574786.db2.gz VLLDPRSOIXPICC-NSHDSACASA-N -1 3 353.813 3.674 20 0 FHADHM C[C@H]1CCN(C(=O)c2ccc(Cl)c(-c3nnn[n-]3)c2)[C@@H](c2ccco2)C1 ZINC000824947780 608576851 /nfs/dbraw/zinc/57/68/51/608576851.db2.gz QVJYOKHBCWHKOH-XHDPSFHLSA-N -1 3 371.828 3.727 20 0 FHADHM C[C@H]1CCN(C(=O)c2ccc(Cl)c(-c3nn[n-]n3)c2)[C@@H](c2ccco2)C1 ZINC000824947780 608576853 /nfs/dbraw/zinc/57/68/53/608576853.db2.gz QVJYOKHBCWHKOH-XHDPSFHLSA-N -1 3 371.828 3.727 20 0 FHADHM C[C@H]1CC[C@H](C)N(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)C1 ZINC000824909784 608605239 /nfs/dbraw/zinc/60/52/39/608605239.db2.gz UTACEAFEHCSWTC-UWVGGRQHSA-N -1 3 368.363 3.538 20 0 FHADHM C[C@H]1CC[C@H](C)N(C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)C1 ZINC000824909784 608605243 /nfs/dbraw/zinc/60/52/43/608605243.db2.gz UTACEAFEHCSWTC-UWVGGRQHSA-N -1 3 368.363 3.538 20 0 FHADHM Brc1ccc([C@@H]2CCCN2Cc2ccc(-c3nnn[n-]3)o2)cc1 ZINC000823826321 608613566 /nfs/dbraw/zinc/61/35/66/608613566.db2.gz HMRWZGXLOQJVHG-AWEZNQCLSA-N -1 3 374.242 3.559 20 0 FHADHM Brc1ccc([C@@H]2CCCN2Cc2ccc(-c3nn[n-]n3)o2)cc1 ZINC000823826321 608613568 /nfs/dbraw/zinc/61/35/68/608613568.db2.gz HMRWZGXLOQJVHG-AWEZNQCLSA-N -1 3 374.242 3.559 20 0 FHADHM c1cc(-c2nnn[n-]2)sc1CN1CCc2cc(-c3ccccc3)oc2C1 ZINC000826519056 608752384 /nfs/dbraw/zinc/75/23/84/608752384.db2.gz IDXDSJFAXVHXQP-UHFFFAOYSA-N -1 3 363.446 3.747 20 0 FHADHM CCOc1cccc2cc([C@@H](C)Nc3cnccc3-c3nnn[n-]3)oc21 ZINC000825653686 608769454 /nfs/dbraw/zinc/76/94/54/608769454.db2.gz IAWBUJMWXDFXEN-LLVKDONJSA-N -1 3 350.382 3.580 20 0 FHADHM CCOc1cccc2cc([C@@H](C)Nc3cnccc3-c3nn[n-]n3)oc21 ZINC000825653686 608769456 /nfs/dbraw/zinc/76/94/56/608769456.db2.gz IAWBUJMWXDFXEN-LLVKDONJSA-N -1 3 350.382 3.580 20 0 FHADHM FC(F)(F)CSCCNc1ccc(-c2nn[n-]n2)cc1C(F)(F)F ZINC000826367619 608797064 /nfs/dbraw/zinc/79/70/64/608797064.db2.gz HIJHGPBFAXIDQH-UHFFFAOYSA-N -1 3 371.310 3.593 20 0 FHADHM Cn1cc(CNc2ccc(-c3nn[n-]n3)cc2)c(-c2cc3ccccc3o2)n1 ZINC000826361932 608869422 /nfs/dbraw/zinc/86/94/22/608869422.db2.gz WOQCUDGGFKOQGZ-UHFFFAOYSA-N -1 3 371.404 3.626 20 0 FHADHM C[C@H](NCc1coc(-c2cccs2)n1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824626659 609137257 /nfs/dbraw/zinc/13/72/57/609137257.db2.gz QOUHBAXCGVUAQC-JTQLQIEISA-N -1 3 370.413 3.573 20 0 FHADHM C[C@H](NCc1coc(-c2cccs2)n1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824626659 609137259 /nfs/dbraw/zinc/13/72/59/609137259.db2.gz QOUHBAXCGVUAQC-JTQLQIEISA-N -1 3 370.413 3.573 20 0 FHADHM C[C@@H](N[C@H]1CCOc2c(Cl)cccc21)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824553537 609138107 /nfs/dbraw/zinc/13/81/07/609138107.db2.gz CKNPJNHICLAOPS-HWPZZCPQSA-N -1 3 373.819 3.834 20 0 FHADHM FC(F)Oc1ccc(N[C@@H]2CCCc3cc(-c4nnn[n-]4)ccc32)cc1 ZINC000826369456 609163231 /nfs/dbraw/zinc/16/32/31/609163231.db2.gz DHQSTRHBAMEFTH-MRXNPFEDSA-N -1 3 357.364 3.958 20 0 FHADHM FC(F)Oc1ccc(N[C@@H]2CCCc3cc(-c4nn[n-]n4)ccc32)cc1 ZINC000826369456 609163233 /nfs/dbraw/zinc/16/32/33/609163233.db2.gz DHQSTRHBAMEFTH-MRXNPFEDSA-N -1 3 357.364 3.958 20 0 FHADHM Cc1cc(NCc2ccc(-c3nnn[n-]3)cc2)nn1-c1cccc(Cl)c1 ZINC000826271345 609180901 /nfs/dbraw/zinc/18/09/01/609180901.db2.gz NVCSFPYKIPPZGP-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM Cc1cc(NCc2ccc(-c3nn[n-]n3)cc2)nn1-c1cccc(Cl)c1 ZINC000826271345 609180903 /nfs/dbraw/zinc/18/09/03/609180903.db2.gz NVCSFPYKIPPZGP-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM CCC(O)(CC)COc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000825154625 609186521 /nfs/dbraw/zinc/18/65/21/609186521.db2.gz RMJFBSFMUSVAPZ-UHFFFAOYSA-N -1 3 354.410 3.589 20 0 FHADHM CCC(O)(CC)COc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000825154625 609186522 /nfs/dbraw/zinc/18/65/22/609186522.db2.gz RMJFBSFMUSVAPZ-UHFFFAOYSA-N -1 3 354.410 3.589 20 0 FHADHM O=C(Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1)c1cccc(O)c1 ZINC000826455504 609214529 /nfs/dbraw/zinc/21/45/29/609214529.db2.gz QXHPNBTWJUUZDT-UHFFFAOYSA-N -1 3 373.372 3.617 20 0 FHADHM COc1ccc(N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1Br ZINC000826210278 609235859 /nfs/dbraw/zinc/23/58/59/609235859.db2.gz KZBSJCLIJSUGRB-SNVBAGLBSA-N -1 3 374.242 3.811 20 0 FHADHM COc1ccc(N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1Br ZINC000826210278 609235861 /nfs/dbraw/zinc/23/58/61/609235861.db2.gz KZBSJCLIJSUGRB-SNVBAGLBSA-N -1 3 374.242 3.811 20 0 FHADHM C[C@H](Nc1cc2c(cc1Cl)OCO2)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824648016 609254001 /nfs/dbraw/zinc/25/40/01/609254001.db2.gz CUAXNIZEJPFUMI-QMMMGPOBSA-N -1 3 361.764 3.561 20 0 FHADHM C[C@H](Nc1cc2c(cc1Cl)OCO2)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824648016 609254002 /nfs/dbraw/zinc/25/40/02/609254002.db2.gz CUAXNIZEJPFUMI-QMMMGPOBSA-N -1 3 361.764 3.561 20 0 FHADHM c1nn(Cc2ccccc2)cc1N[C@H]1CCCc2cc(-c3nnn[n-]3)ccc21 ZINC000826522003 609270109 /nfs/dbraw/zinc/27/01/09/609270109.db2.gz HQKNZVPVKKXYKN-FQEVSTJZSA-N -1 3 371.448 3.601 20 0 FHADHM c1nn(Cc2ccccc2)cc1N[C@H]1CCCc2cc(-c3nn[n-]n3)ccc21 ZINC000826522003 609270111 /nfs/dbraw/zinc/27/01/11/609270111.db2.gz HQKNZVPVKKXYKN-FQEVSTJZSA-N -1 3 371.448 3.601 20 0 FHADHM C[C@H](Nc1cccc(NC(=O)c2ccoc2)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824663369 609276215 /nfs/dbraw/zinc/27/62/15/609276215.db2.gz YNQYUPQXYUADRG-ZDUSSCGKSA-N -1 3 374.404 3.885 20 0 FHADHM C[C@H](Nc1cccc(NC(=O)c2ccoc2)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824663369 609276216 /nfs/dbraw/zinc/27/62/16/609276216.db2.gz YNQYUPQXYUADRG-ZDUSSCGKSA-N -1 3 374.404 3.885 20 0 FHADHM C[C@H](Nc1ccc2c(c1)CC(C)(C)O2)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824655357 609279357 /nfs/dbraw/zinc/27/93/57/609279357.db2.gz CICHYHSAWPLHFA-NSHDSACASA-N -1 3 353.401 3.892 20 0 FHADHM C[C@H](Nc1ccc2c(c1)CC(C)(C)O2)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824655357 609279359 /nfs/dbraw/zinc/27/93/59/609279359.db2.gz CICHYHSAWPLHFA-NSHDSACASA-N -1 3 353.401 3.892 20 0 FHADHM C[C@H](Nc1ccc2c(cnn2C(F)F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824657181 609279517 /nfs/dbraw/zinc/27/95/17/609279517.db2.gz PGUAHZQZMRWIFY-JTQLQIEISA-N -1 3 355.352 3.785 20 0 FHADHM C[C@H](Nc1ccc2c(cnn2C(F)F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824657181 609279519 /nfs/dbraw/zinc/27/95/19/609279519.db2.gz PGUAHZQZMRWIFY-JTQLQIEISA-N -1 3 355.352 3.785 20 0 FHADHM Cc1cc(C)c(-c2nnn[n-]2)c(S[C@H](C)c2nc3ccccc3o2)n1 ZINC000826262899 609305904 /nfs/dbraw/zinc/30/59/04/609305904.db2.gz CLLYWLPOLIURGC-LLVKDONJSA-N -1 3 352.423 3.873 20 0 FHADHM Cc1cc(C)c(-c2nn[n-]n2)c(S[C@H](C)c2nc3ccccc3o2)n1 ZINC000826262899 609305906 /nfs/dbraw/zinc/30/59/06/609305906.db2.gz CLLYWLPOLIURGC-LLVKDONJSA-N -1 3 352.423 3.873 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1NCc1ccccc1N1CCCCC1 ZINC000826372367 609321241 /nfs/dbraw/zinc/32/12/41/609321241.db2.gz SWOFBRFRJOOBEJ-UHFFFAOYSA-N -1 3 352.417 3.608 20 0 FHADHM C[C@@H](Nc1cc2c(cc1Cl)OCO2)c1ccc(-c2nnn[n-]2)cc1F ZINC000824649020 609347197 /nfs/dbraw/zinc/34/71/97/609347197.db2.gz KKSMRMCIRHNZFW-MRVPVSSYSA-N -1 3 361.764 3.561 20 0 FHADHM C[C@@H](Nc1cc2c(cc1Cl)OCO2)c1ccc(-c2nn[n-]n2)cc1F ZINC000824649020 609347199 /nfs/dbraw/zinc/34/71/99/609347199.db2.gz KKSMRMCIRHNZFW-MRVPVSSYSA-N -1 3 361.764 3.561 20 0 FHADHM CCc1c(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2F)cnn1CC(C)C ZINC000825693725 609347902 /nfs/dbraw/zinc/34/79/02/609347902.db2.gz BJSBQADAMORWBW-LBPRGKRZSA-N -1 3 357.437 3.594 20 0 FHADHM CCc1c(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2F)cnn1CC(C)C ZINC000825693725 609347903 /nfs/dbraw/zinc/34/79/03/609347903.db2.gz BJSBQADAMORWBW-LBPRGKRZSA-N -1 3 357.437 3.594 20 0 FHADHM COc1ccc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2F)c2cccnc12 ZINC000826210608 609349494 /nfs/dbraw/zinc/34/94/94/609349494.db2.gz XVJQQFDIBAXZER-NSHDSACASA-N -1 3 364.384 3.736 20 0 FHADHM COc1ccc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2F)c2cccnc12 ZINC000826210608 609349496 /nfs/dbraw/zinc/34/94/96/609349496.db2.gz XVJQQFDIBAXZER-NSHDSACASA-N -1 3 364.384 3.736 20 0 FHADHM O=C(Nc1ccc(O)cc1)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000826455069 609388777 /nfs/dbraw/zinc/38/87/77/609388777.db2.gz XPLYTOUHPZCBCC-UHFFFAOYSA-N -1 3 373.372 3.617 20 0 FHADHM O=C(Nc1ccc(O)cc1)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000826455069 609388780 /nfs/dbraw/zinc/38/87/80/609388780.db2.gz XPLYTOUHPZCBCC-UHFFFAOYSA-N -1 3 373.372 3.617 20 0 FHADHM Cc1ccc(Oc2ccccc2NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)cc1 ZINC000826292776 609411127 /nfs/dbraw/zinc/41/11/27/609411127.db2.gz LEKRRXRAJREENT-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM Cc1ccc(Oc2ccccc2NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)cc1 ZINC000826292776 609411129 /nfs/dbraw/zinc/41/11/29/609411129.db2.gz LEKRRXRAJREENT-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM CC(=O)c1ccc(-c2nnn[n-]2)cc1NCc1cccc(C(F)(F)F)c1 ZINC000824019674 609419717 /nfs/dbraw/zinc/41/97/17/609419717.db2.gz KFLQRPJMVPNAIS-UHFFFAOYSA-N -1 3 361.327 3.700 20 0 FHADHM CC(=O)c1ccc(-c2nn[n-]n2)cc1NCc1cccc(C(F)(F)F)c1 ZINC000824019674 609419720 /nfs/dbraw/zinc/41/97/20/609419720.db2.gz KFLQRPJMVPNAIS-UHFFFAOYSA-N -1 3 361.327 3.700 20 0 FHADHM Cc1noc(C)c1CCSc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000826339136 609451045 /nfs/dbraw/zinc/45/10/45/609451045.db2.gz SKVXZIUYJRHHJO-UHFFFAOYSA-N -1 3 369.372 3.825 20 0 FHADHM Cc1noc(C)c1CCSc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000826339136 609451046 /nfs/dbraw/zinc/45/10/46/609451046.db2.gz SKVXZIUYJRHHJO-UHFFFAOYSA-N -1 3 369.372 3.825 20 0 FHADHM CC(C)Cc1ncc(CNc2cc(-c3nnn[n-]3)ccc2OC(C)C)s1 ZINC000824280452 609477770 /nfs/dbraw/zinc/47/77/70/609477770.db2.gz OFIYPHDHFODWEH-UHFFFAOYSA-N -1 3 372.498 3.921 20 0 FHADHM CC(C)Cc1ncc(CNc2cc(-c3nn[n-]n3)ccc2OC(C)C)s1 ZINC000824280452 609477772 /nfs/dbraw/zinc/47/77/72/609477772.db2.gz OFIYPHDHFODWEH-UHFFFAOYSA-N -1 3 372.498 3.921 20 0 FHADHM Fc1c(CNc2cccc(Oc3ccccn3)c2)cccc1-c1nnn[n-]1 ZINC000826371264 609479418 /nfs/dbraw/zinc/47/94/18/609479418.db2.gz YWWLFSAPTIYCHI-UHFFFAOYSA-N -1 3 362.368 3.805 20 0 FHADHM Fc1c(CNc2cccc(Oc3ccccn3)c2)cccc1-c1nn[n-]n1 ZINC000826371264 609479421 /nfs/dbraw/zinc/47/94/21/609479421.db2.gz YWWLFSAPTIYCHI-UHFFFAOYSA-N -1 3 362.368 3.805 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NCc1cc(F)cc(C(F)(F)F)c1 ZINC000826186192 609481263 /nfs/dbraw/zinc/48/12/63/609481263.db2.gz IXBPSMWBCVHLFR-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NCc1cc(F)cc(C(F)(F)F)c1 ZINC000826186192 609481265 /nfs/dbraw/zinc/48/12/65/609481265.db2.gz IXBPSMWBCVHLFR-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM Cc1sc(NC(=O)C(F)(F)c2ccc(C)cc2)c(-c2nnn[n-]2)c1C ZINC000826284371 609509379 /nfs/dbraw/zinc/50/93/79/609509379.db2.gz RUKZXCLLTUKOFM-UHFFFAOYSA-N -1 3 363.393 3.584 20 0 FHADHM Cc1sc(NC(=O)C(F)(F)c2ccc(C)cc2)c(-c2nn[n-]n2)c1C ZINC000826284371 609509382 /nfs/dbraw/zinc/50/93/82/609509382.db2.gz RUKZXCLLTUKOFM-UHFFFAOYSA-N -1 3 363.393 3.584 20 0 FHADHM CCOc1cccc2cc([C@@H](C)Nc3nccc(C)c3-c3nnn[n-]3)oc21 ZINC000825654035 609524173 /nfs/dbraw/zinc/52/41/73/609524173.db2.gz MXSWKLQCRHJKHO-GFCCVEGCSA-N -1 3 364.409 3.888 20 0 FHADHM CCOc1cccc2cc([C@@H](C)Nc3nccc(C)c3-c3nn[n-]n3)oc21 ZINC000825654035 609524175 /nfs/dbraw/zinc/52/41/75/609524175.db2.gz MXSWKLQCRHJKHO-GFCCVEGCSA-N -1 3 364.409 3.888 20 0 FHADHM Cc1ccnc(N[C@H]2CCSc3ccc(Cl)cc32)c1-c1nnn[n-]1 ZINC000826313213 609525826 /nfs/dbraw/zinc/52/58/26/609525826.db2.gz YJYPRYPMKGULFZ-LBPRGKRZSA-N -1 3 358.858 3.873 20 0 FHADHM Cc1ccnc(N[C@H]2CCSc3ccc(Cl)cc32)c1-c1nn[n-]n1 ZINC000826313213 609525828 /nfs/dbraw/zinc/52/58/28/609525828.db2.gz YJYPRYPMKGULFZ-LBPRGKRZSA-N -1 3 358.858 3.873 20 0 FHADHM CC[C@H](C)[C@@H](C)C(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)nc1 ZINC000825049394 609529523 /nfs/dbraw/zinc/52/95/23/609529523.db2.gz BRGPCIGRYDIWAJ-QWHCGFSZSA-N -1 3 366.425 3.675 20 0 FHADHM Cc1ccnc(N[C@@H](C)c2cccc(Br)c2)c1-c1nnn[n-]1 ZINC000826311776 609531646 /nfs/dbraw/zinc/53/16/46/609531646.db2.gz MZYRKWWDSAOWCJ-JTQLQIEISA-N -1 3 359.231 3.506 20 0 FHADHM Cc1ccnc(N[C@@H](C)c2cccc(Br)c2)c1-c1nn[n-]n1 ZINC000826311776 609531649 /nfs/dbraw/zinc/53/16/49/609531649.db2.gz MZYRKWWDSAOWCJ-JTQLQIEISA-N -1 3 359.231 3.506 20 0 FHADHM COc1ccc(F)cc1[C@H](C)Nc1ncc(Cl)c(C)c1-c1nnn[n-]1 ZINC000826208977 609536106 /nfs/dbraw/zinc/53/61/06/609536106.db2.gz IIZQSSHTXZBEGZ-VIFPVBQESA-N -1 3 362.796 3.544 20 0 FHADHM COc1ccc(F)cc1[C@H](C)Nc1ncc(Cl)c(C)c1-c1nn[n-]n1 ZINC000826208977 609536107 /nfs/dbraw/zinc/53/61/07/609536107.db2.gz IIZQSSHTXZBEGZ-VIFPVBQESA-N -1 3 362.796 3.544 20 0 FHADHM Fc1cccc([C@@H](NCc2ccccc2-c2nnn[n-]2)C(F)(F)F)c1F ZINC000826376495 609608383 /nfs/dbraw/zinc/60/83/83/609608383.db2.gz GJKQYVGUGDJEDP-CQSZACIVSA-N -1 3 369.297 3.538 20 0 FHADHM Fc1cccc([C@@H](NCc2ccccc2-c2nn[n-]n2)C(F)(F)F)c1F ZINC000826376495 609608387 /nfs/dbraw/zinc/60/83/87/609608387.db2.gz GJKQYVGUGDJEDP-CQSZACIVSA-N -1 3 369.297 3.538 20 0 FHADHM Cc1c(C(=O)[O-])cnn1C1CCN([C@H]2CCc3c2cccc3Cl)CC1 ZINC000582128083 936318337 /nfs/dbraw/zinc/31/83/37/936318337.db2.gz WJNCJXMBVZJDCN-SFHVURJKSA-N -1 3 359.857 3.868 20 0 FHADHM O=C(c1ccccc1[O-])N1CCO[C@H](c2cccc(OC(F)(F)F)c2)C1 ZINC000582988999 936351373 /nfs/dbraw/zinc/35/13/73/936351373.db2.gz ASESJMTVYJSBBV-INIZCTEOSA-N -1 3 367.323 3.505 20 0 FHADHM O=S(=O)(Cc1ccccc1F)[N-]c1ccc(Br)cc1F ZINC000396529967 927379947 /nfs/dbraw/zinc/37/99/47/927379947.db2.gz YZSGYWJMLXYVOH-UHFFFAOYSA-N -1 3 362.195 3.669 20 0 FHADHM CCOc1ccccc1CC[N-]S(=O)(=O)c1cc(Cl)ccc1Cl ZINC000145975086 937185316 /nfs/dbraw/zinc/18/53/16/937185316.db2.gz FMYDZAOBFNFVDQ-UHFFFAOYSA-N -1 3 374.289 3.913 20 0 FHADHM COc1ccc([C@H](CC(=O)[O-])NCc2ccc(OCC3CC3)cc2)cc1 ZINC000683171787 927738891 /nfs/dbraw/zinc/73/88/91/927738891.db2.gz OZGKTDOZGCBQFX-FQEVSTJZSA-N -1 3 355.434 3.790 20 0 FHADHM COc1ccc([C@H](CC(=O)[O-])NCc2ccc(OCC(F)F)cc2)cc1 ZINC000683171215 927746850 /nfs/dbraw/zinc/74/68/50/927746850.db2.gz GZEKMPHQZNRLLL-KRWDZBQOSA-N -1 3 365.376 3.645 20 0 FHADHM CCOc1ccc(CN[C@H](C(=O)[O-])c2cccc(Br)c2)cc1 ZINC000683173145 927749333 /nfs/dbraw/zinc/74/93/33/927749333.db2.gz FEZSOTCKZUNGPJ-INIZCTEOSA-N -1 3 364.239 3.763 20 0 FHADHM COc1ccc([C@@H](CC(=O)[O-])NCc2cnc(-c3ccccn3)s2)cc1 ZINC000683172336 927755885 /nfs/dbraw/zinc/75/58/85/927755885.db2.gz WXEHFETTYINDSK-QGZVFWFLSA-N -1 3 369.446 3.519 20 0 FHADHM CC(C)[C@H](NC(=O)c1ccccc1F)C(=O)Nc1ccc(Cl)cc1[O-] ZINC000153583474 927771952 /nfs/dbraw/zinc/77/19/52/927771952.db2.gz IRVNNCXEMYEGMW-INIZCTEOSA-N -1 3 364.804 3.578 20 0 FHADHM O=C([O-])[C@H](NCc1ccc(F)c(F)c1)c1cccc(Br)c1 ZINC000683174840 927777912 /nfs/dbraw/zinc/77/79/12/927777912.db2.gz QXKJEKVWWAZWKC-CQSZACIVSA-N -1 3 356.166 3.643 20 0 FHADHM CC(C)(C)Oc1c(F)cc(-n2c([O-])c(CC(F)(F)F)[nH]c2=O)cc1F ZINC000278109514 937194199 /nfs/dbraw/zinc/19/41/99/937194199.db2.gz KUDCFAPQGBXRAA-SNVBAGLBSA-N -1 3 366.286 3.519 20 0 FHADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)[C@@H](C)c3ccccc3F)cc2)n1 ZINC000108967548 927816252 /nfs/dbraw/zinc/81/62/52/927816252.db2.gz MCEWFDOEVQUOSJ-ZDUSSCGKSA-N -1 3 351.381 3.627 20 0 FHADHM Cc1ncc(CNC(=O)N[C@H]2CCc3ccc(-c4ccccc4)cc32)c(=O)[n-]1 ZINC000430199554 927921206 /nfs/dbraw/zinc/92/12/06/927921206.db2.gz RSAZYERAZRMYAD-FQEVSTJZSA-N -1 3 374.444 3.644 20 0 FHADHM Cc1cc(C)c(C)c(S(=O)(=O)[N-]c2ccc3c(c2)CN(C)C(=O)N3)c1C ZINC000187064120 928016794 /nfs/dbraw/zinc/01/67/94/928016794.db2.gz KAVMGSCDFGJBEA-UHFFFAOYSA-N -1 3 373.478 3.698 20 0 FHADHM O=S(=O)([N-]CCc1nc2ccccc2s1)c1ccc(Cl)cc1F ZINC000008059436 928077775 /nfs/dbraw/zinc/07/77/75/928077775.db2.gz QGGZZAHHALZPMK-UHFFFAOYSA-N -1 3 370.858 3.610 20 0 FHADHM CC(=O)c1cccc(NC(=O)C2(c3ccc(C)c(C)c3)CCOCC2)c1[O-] ZINC000655081371 928080525 /nfs/dbraw/zinc/08/05/25/928080525.db2.gz BPTHQUHSAAXQMM-UHFFFAOYSA-N -1 3 367.445 3.899 20 0 FHADHM O=C(NCc1ccc([O-])c(F)c1)N1CCC[C@H]1c1ccc(F)cc1F ZINC000458426927 937231011 /nfs/dbraw/zinc/23/10/11/937231011.db2.gz UIAHVKQXTKPCCW-INIZCTEOSA-N -1 3 350.340 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COC(=O)c1ccc([N-]S(=O)(=O)/C=C\c2cccc(Cl)c2)c(F)c1 ZINC000588482309 934667615 /nfs/dbraw/zinc/66/76/15/934667615.db2.gz GQOAARFCITVWAO-FPLPWBNLSA-N -1 3 369.801 3.678 20 0 FHADHM CCOCCC1(C(=O)Nc2ccc(-c3nc(C)cc(=O)[n-]3)cc2)CCCC1 ZINC000150864909 934722671 /nfs/dbraw/zinc/72/26/71/934722671.db2.gz MKFWKHPOHKPCGI-UHFFFAOYSA-N -1 3 369.465 3.671 20 0 FHADHM COc1cccc([C@@H](CC(=O)[O-])NCc2ccc(OC(C)C)c(OC)c2)c1 ZINC000277184253 934763444 /nfs/dbraw/zinc/76/34/44/934763444.db2.gz FMQJMHQEFGDZQX-GOSISDBHSA-N -1 3 373.449 3.797 20 0 FHADHM Cc1nn(-c2ccc(F)cc2)c(Cl)c1CNCC[C@H](C)CC(=O)[O-] ZINC000277189858 934783937 /nfs/dbraw/zinc/78/39/37/934783937.db2.gz FTXSDULMNGKDEQ-NSHDSACASA-N -1 3 353.825 3.564 20 0 FHADHM COc1ccc([C@@H](CC(=O)[O-])NCc2ccc(OC(C)C)cc2)cc1OC ZINC000277195288 934796522 /nfs/dbraw/zinc/79/65/22/934796522.db2.gz GFOBWHOMZAGVOG-GOSISDBHSA-N -1 3 373.449 3.797 20 0 FHADHM O=S(=O)([N-][C@H]1CCC(F)(F)C1)c1cc(Cl)ccc1Br ZINC000684658840 934850769 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COc1cc(C)ccc1OCC(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000125386282 935031813 /nfs/dbraw/zinc/03/18/13/935031813.db2.gz PWXUDWYRMOGMCC-UHFFFAOYSA-N -1 3 355.312 3.746 20 0 FHADHM Cc1c2cc(F)ccc2oc1S(=O)(=O)[N-]Cc1ccc(F)c(F)c1 ZINC000472115654 935072201 /nfs/dbraw/zinc/07/22/01/935072201.db2.gz QAEVBRRHXVGUPH-UHFFFAOYSA-N -1 3 355.337 3.637 20 0 FHADHM CC1(C)CC[C@@H]2C[C@@H](NC(=O)NCc3ncccc3[O-])c3cccc1c32 ZINC000472127741 935102547 /nfs/dbraw/zinc/10/25/47/935102547.db2.gz IGENOXODUDLPGP-CZUORRHYSA-N -1 3 351.450 3.886 20 0 FHADHM CC1(C)CC[C@@H]2C[C@H](NC(=O)NCc3ncccc3[O-])c3cccc1c32 ZINC000472127740 935102759 /nfs/dbraw/zinc/10/27/59/935102759.db2.gz IGENOXODUDLPGP-CJNGLKHVSA-N -1 3 351.450 3.886 20 0 FHADHM CC(C)c1nnc([N-]C(=O)c2ccc(CSc3nccn3C)o2)s1 ZINC000105832957 935123309 /nfs/dbraw/zinc/12/33/09/935123309.db2.gz ZYAIMLQCWBRDBZ-UHFFFAOYSA-N -1 3 363.468 3.533 20 0 FHADHM CCOC(=O)c1[nH]c(C)c(C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)c1C ZINC000536518592 935127245 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CCC(O)(CC)CC[N-]S(=O)(=O)c1ccc(Cl)cc1C(F)(F)F ZINC000472211771 935511155 /nfs/dbraw/zinc/51/11/55/935511155.db2.gz UCJOSKDVCHKIPF-UHFFFAOYSA-N -1 3 373.824 3.578 20 0 FHADHM CCSc1nnc([N-]C(=O)c2sc([C@@H]3CCCOC3)nc2C)s1 ZINC000431391438 935585429 /nfs/dbraw/zinc/58/54/29/935585429.db2.gz VNRPIAAVUVOGQP-SECBINFHSA-N -1 3 370.525 3.561 20 0 FHADHM O=C(CSc1ccc2ccccc2c1)Nc1cccc(-c2nnn[n-]2)c1 ZINC000073001414 935741112 /nfs/dbraw/zinc/74/11/12/935741112.db2.gz UFOWVQCKNHHPBS-UHFFFAOYSA-N -1 3 361.430 3.751 20 0 FHADHM O=C(CSc1ccc2ccccc2c1)Nc1cccc(-c2nn[n-]n2)c1 ZINC000073001414 935741115 /nfs/dbraw/zinc/74/11/15/935741115.db2.gz UFOWVQCKNHHPBS-UHFFFAOYSA-N -1 3 361.430 3.751 20 0 FHADHM CCOC(=O)C(=Cc1ccc(F)nc1)c1nc(=O)c2c(C)c(C)sc2[n-]1 ZINC000588523579 935761836 /nfs/dbraw/zinc/76/18/36/935761836.db2.gz BVQXXHTWCIFYBA-GHXNOFRVSA-N -1 3 373.409 3.652 20 0 FHADHM CCN(C(=O)c1cc(=O)[n-]c(C2CC2)n1)[C@H](Cc1ccc(F)cc1)C(C)C ZINC000563387594 935816702 /nfs/dbraw/zinc/81/67/02/935816702.db2.gz 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936148649 /nfs/dbraw/zinc/14/86/49/936148649.db2.gz WMMDQXAXMNYCJN-UHFFFAOYSA-N -1 3 367.371 3.955 20 0 FHADHM CC(C)c1ccc(C(=O)N(C)CC(=O)Nc2ccccc2Cl)c([O-])c1 ZINC000051917960 936149790 /nfs/dbraw/zinc/14/97/90/936149790.db2.gz QSCJADFSRTYAGN-UHFFFAOYSA-N -1 3 360.841 3.880 20 0 FHADHM CSc1ccc([O-])c(C(=O)N2C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C2)c1 ZINC000611722775 936155185 /nfs/dbraw/zinc/15/51/85/936155185.db2.gz XTAZXMWNHDCZJY-NXEZZACHSA-N -1 3 373.318 3.927 20 0 FHADHM COC(=O)c1sc2ccccc2c1CN1CCC[C@H](CCC(=O)[O-])C1 ZINC000582848069 936213880 /nfs/dbraw/zinc/21/38/80/936213880.db2.gz FOYBKTUBDAVTDH-CYBMUJFWSA-N -1 3 361.463 3.765 20 0 FHADHM CC1(C)C[C@H]([N-]S(=O)(=O)c2ccc(Cl)cc2C(F)(F)F)CCO1 ZINC000156357007 938251486 /nfs/dbraw/zinc/25/14/86/938251486.db2.gz QKNFEYLSOCBXHX-SNVBAGLBSA-N -1 3 371.808 3.595 20 0 FHADHM CC1(C)C[C@@H]([N-]S(=O)(=O)c2ccc(Cl)cc2C(F)(F)F)CCO1 ZINC000156357123 938251534 /nfs/dbraw/zinc/25/15/34/938251534.db2.gz QKNFEYLSOCBXHX-JTQLQIEISA-N -1 3 371.808 3.595 20 0 FHADHM CC(C)Cn1ccc2cc(N3C(=O)NC(CC(F)(F)F)C3=O)ccc21 ZINC000278262676 938259716 /nfs/dbraw/zinc/25/97/16/938259716.db2.gz UTTRSYWRXAHBFZ-CYBMUJFWSA-N -1 3 353.344 3.675 20 0 FHADHM CC(C)Cn1ccc2cc(-n3c([O-])c(CC(F)(F)F)[nH]c3=O)ccc21 ZINC000278262676 938259718 /nfs/dbraw/zinc/25/97/18/938259718.db2.gz UTTRSYWRXAHBFZ-CYBMUJFWSA-N -1 3 353.344 3.675 20 0 FHADHM CCCCN(C)C(=O)C1CCN(C(=O)c2ccc(C(C)C)cc2[O-])CC1 ZINC000080400901 938260118 /nfs/dbraw/zinc/26/01/18/938260118.db2.gz XVJOXQUYPFUGEU-UHFFFAOYSA-N -1 3 360.498 3.626 20 0 FHADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CC[C@@H](O)C12CCCC2 ZINC000583459251 938262812 /nfs/dbraw/zinc/26/28/12/938262812.db2.gz OVVISPBNEWZTTJ-OAQYLSRUSA-N -1 3 365.473 3.697 20 0 FHADHM O=S(=O)(Cc1ccccc1F)[N-]c1ccc2[nH]c(-c3ccco3)nc2c1 ZINC000545152434 938291844 /nfs/dbraw/zinc/29/18/44/938291844.db2.gz FGFSEMUMDFWYIL-UHFFFAOYSA-N -1 3 371.393 3.904 20 0 FHADHM CCOC(=O)c1sc([N-]C(=O)c2cc(C(C)C)no2)nc1C(C)C ZINC000536074126 938306270 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Cc1ccc(-c2nc(CCNC(=O)NCc3ccc([O-])c(F)c3)co2)cc1 ZINC000158571256 938546732 /nfs/dbraw/zinc/54/67/32/938546732.db2.gz VLVBZKXQGKEEOM-UHFFFAOYSA-N -1 3 369.396 3.537 20 0 FHADHM CC(C)(C[N-]S(=O)(=O)c1cc(Cl)cc(Cl)c1)C(F)(F)F ZINC000584065298 938580999 /nfs/dbraw/zinc/58/09/99/938580999.db2.gz FNSUIBQOBYJXHI-UHFFFAOYSA-N -1 3 350.189 3.860 20 0 FHADHM C[C@@H](C(=O)NCc1ccc([O-])c(Br)c1)c1cccc(F)c1 ZINC000151577641 938586174 /nfs/dbraw/zinc/58/61/74/938586174.db2.gz SLMVUPDZDLVNRC-SNVBAGLBSA-N -1 3 352.203 3.714 20 0 FHADHM COc1ccc(C[C@H](C)C(=O)Nc2cc(Br)ccc2[O-])cc1 ZINC000536210260 938587701 /nfs/dbraw/zinc/58/77/01/938587701.db2.gz UHVCIUUBWWTCHI-NSHDSACASA-N -1 3 364.239 3.981 20 0 FHADHM C[C@@H](Cc1ccccc1F)C(=O)NCc1ccc([O-])c(Br)c1 ZINC000151612406 938603262 /nfs/dbraw/zinc/60/32/62/938603262.db2.gz VDGFYDWIOADIRB-NSHDSACASA-N -1 3 366.230 3.789 20 0 FHADHM C[C@H](Cc1ccccc1F)C(=O)NCc1ccc([O-])c(Br)c1 ZINC000151612477 938603362 /nfs/dbraw/zinc/60/33/62/938603362.db2.gz VDGFYDWIOADIRB-LLVKDONJSA-N -1 3 366.230 3.789 20 0 FHADHM O=C(NCc1ccc([O-])c(Br)c1)c1ccc(OC(F)F)cc1 ZINC000151622735 938606637 /nfs/dbraw/zinc/60/66/37/938606637.db2.gz NQDUEDHDJJGZLA-UHFFFAOYSA-N -1 3 372.165 3.686 20 0 FHADHM COc1cc(C(=O)N[C@@H]2CCc3sc(Cl)cc32)cc(OC)c1[O-] ZINC000584145274 938616705 /nfs/dbraw/zinc/61/67/05/938616705.db2.gz QTRBPGVPKYDRSX-SNVBAGLBSA-N -1 3 353.827 3.542 20 0 FHADHM Cc1ccc(OC[C@@H](C)[N-]S(=O)(=O)c2cc(F)ccc2Cl)cc1 ZINC000728586496 938689425 /nfs/dbraw/zinc/68/94/25/938689425.db2.gz UMBUMYNXQXIFBR-GFCCVEGCSA-N -1 3 357.834 3.533 20 0 FHADHM CCc1cccc(C(=O)N(C)Cc2ccc(OC)c(OC(F)F)c2)c1[O-] ZINC000081732309 938798248 /nfs/dbraw/zinc/79/82/48/938798248.db2.gz MDVYCDMLJVEYLT-UHFFFAOYSA-N -1 3 365.376 3.837 20 0 FHADHM CCc1cccc(C(=O)Nc2ccc(CN(C(C)=O)C(C)C)cc2)c1[O-] ZINC000081784331 938802695 /nfs/dbraw/zinc/80/26/95/938802695.db2.gz CTWBCBVWHXFLAH-UHFFFAOYSA-N -1 3 354.450 3.964 20 0 FHADHM CCc1cccc(C(=O)N(C)CC(=O)Nc2c(C)cc(C)cc2C)c1[O-] ZINC000081937714 938810223 /nfs/dbraw/zinc/81/02/23/938810223.db2.gz AXVIBSSCPOGAMX-UHFFFAOYSA-N -1 3 354.450 3.591 20 0 FHADHM CS(=O)(=O)[N-]c1ccc(-c2nc(-c3cc4ccccc4o3)no2)cc1 ZINC000088338459 938854285 /nfs/dbraw/zinc/85/42/85/938854285.db2.gz BETQZPYWZMRQEQ-UHFFFAOYSA-N -1 3 355.375 3.521 20 0 FHADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N(CCCCO)C1CC1 ZINC000093244340 938928110 /nfs/dbraw/zinc/92/81/10/938928110.db2.gz UGEURIWCGULOIK-UHFFFAOYSA-N -1 3 353.462 3.555 20 0 FHADHM Cc1ccc([O-])c(CN2CCO[C@H](c3cccc(C(F)(F)F)c3)C2)n1 ZINC000093760145 938929658 /nfs/dbraw/zinc/92/96/58/938929658.db2.gz KYUAOSBGPQPZHZ-KRWDZBQOSA-N -1 3 352.356 3.688 20 0 FHADHM COC(=O)c1ccc(NC(=O)c2cc(Oc3ccccc3)ccc2[O-])cn1 ZINC000611888687 938965132 /nfs/dbraw/zinc/96/51/32/938965132.db2.gz WCWJUBDFPWJMOS-UHFFFAOYSA-N -1 3 364.357 3.618 20 0 FHADHM CCN1CCN(Cc2ccc(Nc3ccc(C(=O)[O-])cc3C)cc2)CC1 ZINC001211623170 938967114 /nfs/dbraw/zinc/96/71/14/938967114.db2.gz ZXXYGGQTIVLWGD-UHFFFAOYSA-N -1 3 353.466 3.574 20 0 FHADHM Cc1ncc(S(=O)(=O)[N-][C@H]2CC(C)(C)CCc3ccccc32)s1 ZINC001211627422 939011907 /nfs/dbraw/zinc/01/19/07/939011907.db2.gz PLCUGWHOXOLZQN-HNNXBMFYSA-N -1 3 350.509 3.834 20 0 FHADHM C[C@H]1CC[C@@H](C[N-]S(=O)(=O)c2cc(Cl)ccc2Br)C1 ZINC001211734469 939018772 /nfs/dbraw/zinc/01/87/72/939018772.db2.gz LSYAMAJOMHHLRF-VHSXEESVSA-N -1 3 366.708 3.817 20 0 FHADHM O=C(/C=C/c1ccc(Cl)nc1)NCc1ccc([O-])c(Br)c1 ZINC000179363117 939093595 /nfs/dbraw/zinc/09/35/95/939093595.db2.gz QKXLWASHPUMINU-ZZXKWVIFSA-N -1 3 367.630 3.533 20 0 FHADHM COC(=O)c1cccc2[n-]c(NC(=O)C=Cc3ccc4ccccc4n3)nc21 ZINC000255755273 939165928 /nfs/dbraw/zinc/16/59/28/939165928.db2.gz LOQSYFOGXUJNKU-QXMHVHEDSA-N -1 3 372.384 3.550 20 0 FHADHM CN(C)Cc1ccc(NC(=O)[C@@H](C(=O)[O-])C2CCCC2)cc1C(F)(F)F ZINC000902757845 939287490 /nfs/dbraw/zinc/28/74/90/939287490.db2.gz ZGSUDLVBZNKYDQ-HNNXBMFYSA-N -1 3 372.387 3.597 20 0 FHADHM CCCCCCN(C)CC(=O)N[C@H](C(=O)[O-])c1ccc2ccccc2c1 ZINC000909528226 939402716 /nfs/dbraw/zinc/40/27/16/939402716.db2.gz 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VVAPDCBHXMHDNK-CYBMUJFWSA-N -1 3 373.840 3.928 20 0 FHADHM Cc1cc(=O)[n-]c(C(C)(C)NC(=O)[C@H](C)Sc2ccccc2Cl)n1 ZINC000636112758 940258478 /nfs/dbraw/zinc/25/84/78/940258478.db2.gz ADIJXOSIEWAPTK-NSHDSACASA-N -1 3 365.886 3.676 20 0 FHADHM Cc1csc([C@H]([N-]S(=O)(=O)c2ccc(Cl)c(F)c2)C2CC2)n1 ZINC000651579304 945312251 /nfs/dbraw/zinc/31/22/51/945312251.db2.gz WNUBSKDYYWVEHZ-CYBMUJFWSA-N -1 3 360.863 3.674 20 0 FHADHM COC1(C(=O)Nc2cc(Br)ccc2[O-])CCC(F)(F)CC1 ZINC000613025892 940398584 /nfs/dbraw/zinc/39/85/84/940398584.db2.gz DUPOADDDHCAMGT-UHFFFAOYSA-N -1 3 364.186 3.688 20 0 FHADHM CC(C)(C[N-]S(=O)(=O)c1ccc(Cl)c(Cl)c1)C(F)(F)F ZINC000548980203 940418560 /nfs/dbraw/zinc/41/85/60/940418560.db2.gz IGXADKGWWSRRNM-UHFFFAOYSA-N -1 3 350.189 3.860 20 0 FHADHM O=C(Nc1ncc(Cc2ccccc2F)s1)c1cc(F)cc2n[n-]nc21 ZINC000431746398 940464094 /nfs/dbraw/zinc/46/40/94/940464094.db2.gz VAYGJOHJABRPFV-UHFFFAOYSA-N -1 3 371.372 3.536 20 0 FHADHM Cc1ccc(-c2nsc([N-]C(=O)c3ccc(Cn4cccn4)o3)n2)s1 ZINC000066412993 940483426 /nfs/dbraw/zinc/48/34/26/940483426.db2.gz REESXECEHLWZPH-UHFFFAOYSA-N -1 3 371.447 3.665 20 0 FHADHM Cc1cccc([C@@]2(F)CCN(C(=O)c3cc(=O)c4ccccc4[n-]3)C2)c1 ZINC000376222401 940485739 /nfs/dbraw/zinc/48/57/39/940485739.db2.gz YMFYXAVHHPODDA-OAQYLSRUSA-N -1 3 350.393 3.547 20 0 FHADHM CCOCCOc1ccc(S(=O)(=O)[N-]c2ccc(F)c(CC)c2)cc1 ZINC000507578536 945329132 /nfs/dbraw/zinc/32/91/32/945329132.db2.gz GCMCYJPWRHQDNK-UHFFFAOYSA-N -1 3 367.442 3.604 20 0 FHADHM Cc1c2cccc(F)c2oc1C(=O)NCc1cc(=O)[n-]c(C2CCC2)n1 ZINC000636317880 940601293 /nfs/dbraw/zinc/60/12/93/940601293.db2.gz JZONCMWHQWPEOS-UHFFFAOYSA-N -1 3 355.369 3.573 20 0 FHADHM COc1ccccc1[N-]S(=O)(=O)/C=C/c1ccc(Br)cc1 ZINC000066574939 940678260 /nfs/dbraw/zinc/67/82/60/940678260.db2.gz FZBDXWXXYSNXJT-ZHACJKMWSA-N -1 3 368.252 3.870 20 0 FHADHM CC(C)(C)c1ncc([N-]S(=O)(=O)/C=C/c2ccccc2Cl)cn1 ZINC000066583487 940690114 /nfs/dbraw/zinc/69/01/14/940690114.db2.gz AQYYFLVWUWKFJT-CMDGGOBGSA-N -1 3 351.859 3.840 20 0 FHADHM CSc1ccc([O-])c(C(=O)N2CCC(CCCn3ccnc3)CC2)c1 ZINC000613423592 940697698 /nfs/dbraw/zinc/69/76/98/940697698.db2.gz JCVYAJKIDDEIMN-UHFFFAOYSA-N -1 3 359.495 3.643 20 0 FHADHM CC(=O)c1cc([N-]S(=O)(=O)c2ccc3c(c2)CC(C)(C)O3)ccc1F ZINC000507584621 945342643 /nfs/dbraw/zinc/34/26/43/945342643.db2.gz SGZUIUIIRALLOK-UHFFFAOYSA-N -1 3 363.410 3.543 20 0 FHADHM Cc1ncn(-c2ccc([N-]S(=O)(=O)c3cc(F)ccc3C)cc2)c1C ZINC000461209592 940850880 /nfs/dbraw/zinc/85/08/80/940850880.db2.gz DIWLIRIMJFCNLT-UHFFFAOYSA-N -1 3 359.426 3.737 20 0 FHADHM CCc1ccc([O-])c(C(=O)N2CCC[C@H](O)[C@H]2CCc2ccccc2)c1 ZINC001143469158 940898031 /nfs/dbraw/zinc/89/80/31/940898031.db2.gz VIGKNDQUBAYUCS-CTNGQTDRSA-N -1 3 353.462 3.553 20 0 FHADHM CC[C@@H](C(=O)Nc1nnc(C(F)(F)F)[n-]1)c1cccc(C(F)(F)F)c1 ZINC000175775959 940926274 /nfs/dbraw/zinc/92/62/74/940926274.db2.gz LZESDFCSWSPBSZ-SECBINFHSA-N -1 3 366.265 3.975 20 0 FHADHM CC[C@@H](C(=O)Nc1nc(C(F)(F)F)n[n-]1)c1cccc(C(F)(F)F)c1 ZINC000175775959 940926277 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ZINC000436591193 944437995 /nfs/dbraw/zinc/43/79/95/944437995.db2.gz PPWUYPQXUMYWDB-NSHDSACASA-N -1 3 357.381 3.673 20 0 FHADHM CCOC(=O)[C@H]1CCCN(C(=O)c2cc(Oc3ccccc3)ccc2[O-])C1 ZINC000436594965 944440247 /nfs/dbraw/zinc/44/02/47/944440247.db2.gz HDYVQXTTZMEDLD-HNNXBMFYSA-N -1 3 369.417 3.600 20 0 FHADHM CSCC[C@@H](O)C(=O)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000436599039 944441799 /nfs/dbraw/zinc/44/17/99/944441799.db2.gz BSDKGLVXBXVCPY-OAHLLOKOSA-N -1 3 374.487 3.721 20 0 FHADHM Cc1nc(CCNC(=O)c2cc(CCc3ccccc3)ccc2[O-])cs1 ZINC000436581441 944445489 /nfs/dbraw/zinc/44/54/89/944445489.db2.gz FDXIIFFKBSWTFH-UHFFFAOYSA-N -1 3 366.486 3.915 20 0 FHADHM CC(C)OC(=O)[C@H](C)N(C)C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436585085 944449035 /nfs/dbraw/zinc/44/90/35/944449035.db2.gz IQRZYEYSSJRBFR-INIZCTEOSA-N -1 3 369.461 3.590 20 0 FHADHM COc1ccc(C(=O)N[C@@H](c2cccc(Cl)c2)c2ccccn2)c([O-])c1 ZINC000436588362 944450852 /nfs/dbraw/zinc/45/08/52/944450852.db2.gz MNKYHHFCUNPUMT-IBGZPJMESA-N -1 3 368.820 3.969 20 0 FHADHM COc1ccc(C(=O)NCc2csc(CCc3ccccc3)n2)c([O-])c1 ZINC000436590798 944451173 /nfs/dbraw/zinc/45/11/73/944451173.db2.gz ZUEVJDWYMGXPPK-UHFFFAOYSA-N -1 3 368.458 3.573 20 0 FHADHM Cc1nc(C[N-]S(=O)(=O)c2c(Cl)ccc(C)c2Cl)sc1C ZINC000439222911 944451532 /nfs/dbraw/zinc/45/15/32/944451532.db2.gz GUUXXDZJEQOKAW-UHFFFAOYSA-N -1 3 365.307 3.854 20 0 FHADHM COc1cccc([C@H]2CN(C(=O)c3ccc(C(C)C)cc3[O-])CCO2)c1 ZINC000436600093 944452807 /nfs/dbraw/zinc/45/28/07/944452807.db2.gz ZTNRLCUEJBFTRL-HXUWFJFHSA-N -1 3 355.434 3.738 20 0 FHADHM Cc1cccc(C[C@@H](CNCc2nc3c(s2)C[C@H](C)CC3)C(=O)[O-])c1 ZINC000426668447 944455990 /nfs/dbraw/zinc/45/59/90/944455990.db2.gz FDOCPLSZNVJSQH-ZBFHGGJFSA-N -1 3 358.507 3.609 20 0 FHADHM Cc1ccc(C(=O)N2CCc3cc(Br)cc(F)c3C2)c([O-])c1 ZINC000436605768 944456401 /nfs/dbraw/zinc/45/64/01/944456401.db2.gz QEAVTYTXRHWONL-UHFFFAOYSA-N -1 3 364.214 3.801 20 0 FHADHM CC(=O)c1ccc(C(=O)Nc2ccccc2NCC(F)(F)F)cc1[O-] ZINC000436609555 944459509 /nfs/dbraw/zinc/45/95/09/944459509.db2.gz SADOSRKKWVSYBB-UHFFFAOYSA-N -1 3 352.312 3.821 20 0 FHADHM CCOc1cc(CNC(=O)CCCc2ccc([O-])c(F)c2)ccc1OC ZINC000469388741 944469410 /nfs/dbraw/zinc/46/94/10/944469410.db2.gz OKFWLQWHOQJEAE-UHFFFAOYSA-N -1 3 361.413 3.578 20 0 FHADHM CCn1c2ccccc2c2cc([N-]S(=O)(=O)CC(C)(C)OC)ccc21 ZINC000439243681 944471271 /nfs/dbraw/zinc/47/12/71/944471271.db2.gz FGGCSKUNNAXRRS-UHFFFAOYSA-N -1 3 360.479 3.981 20 0 FHADHM CCCCN(CCCO)C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436620672 944478207 /nfs/dbraw/zinc/47/82/07/944478207.db2.gz BOZKMANGCVHHNW-UHFFFAOYSA-N -1 3 355.478 3.802 20 0 FHADHM CCC(C)(C)N(C)C(=O)C[C@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436623809 944479992 /nfs/dbraw/zinc/47/99/92/944479992.db2.gz HRURMPTVIBABHO-IBGZPJMESA-N -1 3 368.477 3.900 20 0 FHADHM CC(=O)c1ccc(C(=O)NC[C@@H]2CCCO[C@@H]2c2ccc(C)cc2)cc1[O-] ZINC000436657888 944488219 /nfs/dbraw/zinc/48/82/19/944488219.db2.gz RXXIDEOZWTUXMA-GHTZIAJQSA-N -1 3 367.445 3.801 20 0 FHADHM O=c1[n-]c(CN2CC3(CCC3)[C@H]2[C@H]2CCCO2)nc2c3ccccc3oc21 ZINC000519569451 944499992 /nfs/dbraw/zinc/49/99/92/944499992.db2.gz RAYZAKVAYLTJEV-DNVCBOLYSA-N -1 3 365.433 3.615 20 0 FHADHM Cc1cccc(C(=O)Nc2ccc(OCC(F)(F)C(F)F)nc2)c1[O-] ZINC000436677955 944514731 /nfs/dbraw/zinc/51/47/31/944514731.db2.gz ZIXQNDMCXNYMOD-UHFFFAOYSA-N -1 3 358.291 3.627 20 0 FHADHM COc1cc(-c2nc(Cc3c[nH]c4c3cccc4C)no2)cc(OC)c1[O-] ZINC000436685760 944524849 /nfs/dbraw/zinc/52/48/49/944524849.db2.gz CHBMQDBCBVULBL-UHFFFAOYSA-N -1 3 365.389 3.840 20 0 FHADHM COC(=O)c1cccc2[n-]c(NC(=O)c3cc4ccccc4s3)nc21 ZINC000438345249 944525983 /nfs/dbraw/zinc/52/59/83/944525983.db2.gz LNUGBYDFHWQFEV-UHFFFAOYSA-N -1 3 351.387 3.817 20 0 FHADHM COc1cc(-c2nc(Cc3c(F)cccc3Cl)no2)cc(OC)c1[O-] ZINC000436689520 944528640 /nfs/dbraw/zinc/52/86/40/944528640.db2.gz OFYDEPNBGUEUMS-UHFFFAOYSA-N -1 3 364.760 3.843 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)NCc2cccc(COC(C)(C)C)c2)c1 ZINC000101959594 944528980 /nfs/dbraw/zinc/52/89/80/944528980.db2.gz MRPMSAADHVHFKZ-UHFFFAOYSA-N -1 3 370.449 3.596 20 0 FHADHM O=C(c1ccccc1[O-])N1CCN(Cc2ccc(-c3ccccc3)o2)CC1 ZINC000436696592 944536020 /nfs/dbraw/zinc/53/60/20/944536020.db2.gz JEPVQTCAFGAQPK-UHFFFAOYSA-N -1 3 362.429 3.610 20 0 FHADHM COc1ccc(C(=O)N2CCc3c(ccc(Cl)c3Cl)C2)c([O-])c1 ZINC000436697843 944536859 /nfs/dbraw/zinc/53/68/59/944536859.db2.gz OJCDSXCVHFAXIK-UHFFFAOYSA-N -1 3 352.217 3.906 20 0 FHADHM O=C(c1ccccc1[O-])N1CCN(Cc2cccc(Cl)c2Cl)CC1 ZINC000436699894 944538630 /nfs/dbraw/zinc/53/86/30/944538630.db2.gz WSZPVDQOGIZBPL-UHFFFAOYSA-N -1 3 365.260 3.657 20 0 FHADHM O=C(c1ccccc1[O-])N1CCN(Cc2ccc(Cl)cc2Cl)CC1 ZINC000436699898 944538762 /nfs/dbraw/zinc/53/87/62/944538762.db2.gz WTVGASRBAHEDTA-UHFFFAOYSA-N -1 3 365.260 3.657 20 0 FHADHM COC(=O)c1cccc2[n-]c(NC(=O)Cc3ccc4ccccc4c3)nc21 ZINC000438352774 944541314 /nfs/dbraw/zinc/54/13/14/944541314.db2.gz COCPPFZZVUKJEZ-UHFFFAOYSA-N -1 3 359.385 3.684 20 0 FHADHM COc1cccc(C(=O)Nc2nnc(-c3ccccc3Cl)s2)c1[O-] ZINC000436725484 944548674 /nfs/dbraw/zinc/54/86/74/944548674.db2.gz VCXOHQHBQCBUTF-UHFFFAOYSA-N -1 3 361.810 3.825 20 0 FHADHM COc1cccc(C(=O)Nc2cccc3c2CN(c2ccccn2)C3)c1[O-] ZINC000436718378 944557307 /nfs/dbraw/zinc/55/73/07/944557307.db2.gz WMRVTRGNHJXWEF-UHFFFAOYSA-N -1 3 361.401 3.568 20 0 FHADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CCC[C@H]1[C@@H]1CCCO1 ZINC000436718311 944557368 /nfs/dbraw/zinc/55/73/68/944557368.db2.gz ZLIHCGADVGZDFY-UNMCSNQZSA-N -1 3 365.473 3.961 20 0 FHADHM CC[C@@H](C)N[C@H](CNC(=O)c1cc(F)cc(Cl)c1[O-])c1ccco1 ZINC000436721014 944559343 /nfs/dbraw/zinc/55/93/43/944559343.db2.gz KUQQEHGPPKSREF-QMTHXVAHSA-N -1 3 354.809 3.637 20 0 FHADHM Cc1cc(CNC(=O)c2cc(CCc3ccccc3)ccc2[O-])nc(C)n1 ZINC000436721762 944561241 /nfs/dbraw/zinc/56/12/41/944561241.db2.gz HYJMVWNBSTUCCB-UHFFFAOYSA-N -1 3 361.445 3.514 20 0 FHADHM CCOc1cc(-c2nc3cc(C(=O)OC)ccc3n2C)cc(Cl)c1[O-] ZINC000436739556 944568953 /nfs/dbraw/zinc/56/89/53/944568953.db2.gz ONSYKLJPWKJALU-UHFFFAOYSA-N -1 3 360.797 3.785 20 0 FHADHM O=C(c1cc(F)ccc1[O-])N1CCN(Cc2cccc3ccccc32)CC1 ZINC000436757387 944580842 /nfs/dbraw/zinc/58/08/42/944580842.db2.gz TWYNANFGMWZPFT-UHFFFAOYSA-N -1 3 364.420 3.643 20 0 FHADHM CCN1CCN(Cc2ccc(Nc3ccc(C(=O)[O-])c(C)c3)cc2)CC1 ZINC001211657762 944586416 /nfs/dbraw/zinc/58/64/16/944586416.db2.gz YULZYWHUYQUTCZ-UHFFFAOYSA-N -1 3 353.466 3.574 20 0 FHADHM C[C@@H]1[C@@H](NC(=O)c2cc(F)c([O-])c(Cl)c2)CCN1Cc1ccccc1 ZINC000436752041 944591401 /nfs/dbraw/zinc/59/14/01/944591401.db2.gz WOKGVNMMNUXZLG-PXAZEXFGSA-N -1 3 362.832 3.578 20 0 FHADHM CC(C)c1ccc(C(=O)N2CCN(C(=O)CCC3CCCC3)CC2)c([O-])c1 ZINC000436752237 944592803 /nfs/dbraw/zinc/59/28/03/944592803.db2.gz XSGRTQZAQMBGKD-UHFFFAOYSA-N -1 3 372.509 3.770 20 0 FHADHM Cc1cccc(C(=O)Nc2cccc(CS(=O)(=O)C(C)(C)C)c2)c1[O-] ZINC000112255097 944594519 /nfs/dbraw/zinc/59/45/19/944594519.db2.gz SMUHCXRIFZBQGE-UHFFFAOYSA-N -1 3 361.463 3.666 20 0 FHADHM O=C(Nc1cccc(C(=O)N2CCCC2)c1)c1cc2c(cc1[O-])CCCC2 ZINC000436756818 944599072 /nfs/dbraw/zinc/59/90/72/944599072.db2.gz FNCKUCFMXWLNQD-UHFFFAOYSA-N -1 3 364.445 3.759 20 0 FHADHM CC(C)C(=O)Nc1cc(C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)ccn1 ZINC000436777998 944607315 /nfs/dbraw/zinc/60/73/15/944607315.db2.gz PBBGORZLTFKAKU-UHFFFAOYSA-N -1 3 367.327 3.653 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N[C@@H]2c3cccc(F)c3CC[C@H]2C)c1 ZINC000436785881 944631806 /nfs/dbraw/zinc/63/18/06/944631806.db2.gz HBUHIGTXMVCMIY-WYRIXSBYSA-N -1 3 356.397 3.543 20 0 FHADHM COc1ccc2c(c1)CCC[C@@H]2N(C)C(=O)c1cc(NC(C)=O)ccc1[O-] ZINC000436788246 944635103 /nfs/dbraw/zinc/63/51/03/944635103.db2.gz VSRVKEXUWZSHKT-IBGZPJMESA-N -1 3 368.433 3.509 20 0 FHADHM C[C@H](CC(=O)Nc1cccc(-c2nnn[n-]2)c1)Cc1ccc(Cl)cc1 ZINC000539038676 944637035 /nfs/dbraw/zinc/63/70/35/944637035.db2.gz JHKDBVSWCYLOPR-LBPRGKRZSA-N -1 3 355.829 3.728 20 0 FHADHM C[C@H](CC(=O)Nc1cccc(-c2nn[n-]n2)c1)Cc1ccc(Cl)cc1 ZINC000539038676 944637041 /nfs/dbraw/zinc/63/70/41/944637041.db2.gz JHKDBVSWCYLOPR-LBPRGKRZSA-N -1 3 355.829 3.728 20 0 FHADHM CC[C@H](C)Oc1cc(C)ccc1CNC(=O)c1cc(NC(C)=O)ccc1[O-] ZINC000436788524 944637356 /nfs/dbraw/zinc/63/73/56/944637356.db2.gz GYIHPALJJVOSOF-AWEZNQCLSA-N -1 3 370.449 3.766 20 0 FHADHM CC1(C)CC[C@H]1NC(=O)C[C@@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436793504 944645760 /nfs/dbraw/zinc/64/57/60/944645760.db2.gz RWXGWNDSUVOTQG-RTBURBONSA-N -1 3 366.461 3.558 20 0 FHADHM C[C@@H]1C[C@H](CC(=O)N2CCN(C(=O)c3ccccc3[O-])CC2)CC(C)(C)C1 ZINC000436795634 944648699 /nfs/dbraw/zinc/64/86/99/944648699.db2.gz ZRDUJFHSDDQERU-IAGOWNOFSA-N -1 3 372.509 3.529 20 0 FHADHM Cc1cccc(C(=O)Nc2ccc(-c3nnc4n3CCCCC4)cc2)c1[O-] ZINC000436804411 944659123 /nfs/dbraw/zinc/65/91/23/944659123.db2.gz AUQDMCMDOPZXKP-UHFFFAOYSA-N -1 3 362.433 3.938 20 0 FHADHM C[C@@H](O)C[C@H]1CCCCN1C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436804675 944659205 /nfs/dbraw/zinc/65/92/05/944659205.db2.gz PTOXVGCZZMXELC-YLJYHZDGSA-N -1 3 367.489 3.943 20 0 FHADHM COc1ccc(C(=O)NCCc2nc(C3CCCCC3)cs2)c([O-])c1 ZINC000436806385 944662591 /nfs/dbraw/zinc/66/25/91/944662591.db2.gz FUQWXTXLDPVYNZ-UHFFFAOYSA-N -1 3 360.479 3.878 20 0 FHADHM COc1cccc(C(=O)Nc2nnc(-c3ccc(C)cc3C)s2)c1[O-] ZINC000436812230 944667385 /nfs/dbraw/zinc/66/73/85/944667385.db2.gz ARNHJTHGSRXVFB-UHFFFAOYSA-N -1 3 355.419 3.788 20 0 FHADHM CCc1ccc(C(=O)N2CCC[C@H](C(=O)c3ccc(F)cc3)C2)c([O-])c1 ZINC000436835363 944684088 /nfs/dbraw/zinc/68/40/88/944684088.db2.gz VYANLVVMYFJACY-INIZCTEOSA-N -1 3 355.409 3.829 20 0 FHADHM CCCN(C(=O)c1ccc(CC)cc1[O-])[C@@H](C)C(=O)Nc1ccccc1 ZINC000436820286 944688350 /nfs/dbraw/zinc/68/83/50/944688350.db2.gz GHQHNNPMKFZRME-HNNXBMFYSA-N -1 3 354.450 3.834 20 0 FHADHM COc1ccc(C(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)c([O-])c1 ZINC000436823451 944693272 /nfs/dbraw/zinc/69/32/72/944693272.db2.gz UZAYGMJKHLNBKB-UHFFFAOYSA-N -1 3 361.388 3.774 20 0 FHADHM Cc1cccc(C(=O)Nc2cc(C(F)(F)F)ccc2[N-]S(C)(=O)=O)c1 ZINC000517832404 944700734 /nfs/dbraw/zinc/70/07/34/944700734.db2.gz GLEKEBBGZPLROU-UHFFFAOYSA-N -1 3 372.368 3.638 20 0 FHADHM C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)N=c1cc([C@@H]2CCCO2)[n-][nH]1 ZINC000473849383 944709749 /nfs/dbraw/zinc/70/97/49/944709749.db2.gz VZQQIAKZTMRSTN-BONVTDFDSA-N -1 3 368.264 3.807 20 0 FHADHM CCO[C@@H](C(=O)Nc1ccc(Br)cc1[O-])c1ccccc1 ZINC000516316295 944717340 /nfs/dbraw/zinc/71/73/40/944717340.db2.gz MUSXTGVPUJVDPP-OAHLLOKOSA-N -1 3 350.212 3.871 20 0 FHADHM C[C@H](C(=O)[O-])[C@@H](NCc1cnn(-c2ccc(F)cc2)c1)c1ccccc1 ZINC000426722535 944725343 /nfs/dbraw/zinc/72/53/43/944725343.db2.gz HWZZCVRZIDKQPY-IFXJQAMLSA-N -1 3 353.397 3.563 20 0 FHADHM CC(=O)Nc1ncccc1NC(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436893930 944746671 /nfs/dbraw/zinc/74/66/71/944746671.db2.gz QPFWBEGSLVHJCC-UHFFFAOYSA-N -1 3 361.401 3.589 20 0 FHADHM O=S(=O)([N-]CCc1cc(F)cc(F)c1)c1cccc(Cl)c1Cl ZINC000500396182 944747634 /nfs/dbraw/zinc/74/76/34/944747634.db2.gz JOHKLGFYGHLVEX-UHFFFAOYSA-N -1 3 366.216 3.793 20 0 FHADHM Cc1noc(C[C@@H](NC(=O)c2ccc(C(C)C)cc2[O-])c2ccccc2)n1 ZINC000436880093 944751714 /nfs/dbraw/zinc/75/17/14/944751714.db2.gz INLOOYSBEOFNDP-GOSISDBHSA-N -1 3 365.433 3.921 20 0 FHADHM CCC[C@@H](CC1CCCC1)C(=O)N1CCN(C(=O)c2ccc([O-])cc2)CC1 ZINC000436883187 944755570 /nfs/dbraw/zinc/75/55/70/944755570.db2.gz BKPVRMXMOAQECL-IBGZPJMESA-N -1 3 372.509 3.673 20 0 FHADHM O=C([O-])[C@H](NCc1ccc(OCC(F)F)cc1)c1cccc(Cl)c1 ZINC000426726670 944761363 /nfs/dbraw/zinc/76/13/63/944761363.db2.gz LCXSFCOEVKBZKX-MRXNPFEDSA-N -1 3 355.768 3.899 20 0 FHADHM C[C@@H](Nc1cc(=N[C@@H](C)c2ccccc2)nc2nc[n-]n21)c1ccccc1 ZINC000439567578 944770260 /nfs/dbraw/zinc/77/02/60/944770260.db2.gz HTQIHVAGKNBIBX-JKSUJKDBSA-N -1 3 358.449 3.892 20 0 FHADHM COc1ccc(C(=O)N[C@@H]2C[C@H]2c2ccc(Br)s2)c([O-])c1 ZINC000436905856 944774074 /nfs/dbraw/zinc/77/40/74/944774074.db2.gz BHMMUCAKUOZUMK-GHMZBOCLSA-N -1 3 368.252 3.511 20 0 FHADHM C[C@H]1CCC[C@H](C(=O)Nc2nc(-c3ccc(-c4nnn[n-]4)cc3)cs2)C1 ZINC000736245757 944775468 /nfs/dbraw/zinc/77/54/68/944775468.db2.gz WEXYPKPAKLUMFN-FZMZJTMJSA-N -1 3 368.466 3.755 20 0 FHADHM C[C@H]1CCC[C@H](C(=O)Nc2nc(-c3ccc(-c4nn[n-]n4)cc3)cs2)C1 ZINC000736245757 944775476 /nfs/dbraw/zinc/77/54/76/944775476.db2.gz WEXYPKPAKLUMFN-FZMZJTMJSA-N -1 3 368.466 3.755 20 0 FHADHM C[C@@H]1CCC[C@H](C(=O)Nc2nc(-c3ccc(-c4nnn[n-]4)cc3)cs2)C1 ZINC000736245758 944776159 /nfs/dbraw/zinc/77/61/59/944776159.db2.gz WEXYPKPAKLUMFN-RISCZKNCSA-N -1 3 368.466 3.755 20 0 FHADHM C[C@@H]1CCC[C@H](C(=O)Nc2nc(-c3ccc(-c4nn[n-]n4)cc3)cs2)C1 ZINC000736245758 944776168 /nfs/dbraw/zinc/77/61/68/944776168.db2.gz WEXYPKPAKLUMFN-RISCZKNCSA-N -1 3 368.466 3.755 20 0 FHADHM O=C(c1cc([O-])ccc1Cl)N1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000500405753 944785066 /nfs/dbraw/zinc/78/50/66/944785066.db2.gz BCFACXUIOYHIEA-INIZCTEOSA-N -1 3 352.217 3.913 20 0 FHADHM O=C(c1cc([O-])ccc1Cl)N1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000500405754 944785159 /nfs/dbraw/zinc/78/51/59/944785159.db2.gz BCFACXUIOYHIEA-MRXNPFEDSA-N -1 3 352.217 3.913 20 0 FHADHM CCC[C@@H](C)N(C)C(=O)C[C@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436914556 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CCc1cc(-c2nnn[n-]2)c(NC(=O)c2cc(C)nn2C(CC)CC)s1 ZINC000825694367 947292480 /nfs/dbraw/zinc/29/24/80/947292480.db2.gz PAHCNRXQJXACKB-UHFFFAOYSA-N -1 3 373.486 3.609 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)c2cc(C)nn2C(CC)CC)s1 ZINC000825694367 947292489 /nfs/dbraw/zinc/29/24/89/947292489.db2.gz PAHCNRXQJXACKB-UHFFFAOYSA-N -1 3 373.486 3.609 20 0 FHADHM O=S(=O)([N-]Cc1ccc(-c2nc3ccccc3s2)o1)c1ccco1 ZINC000188580197 947443802 /nfs/dbraw/zinc/44/38/02/947443802.db2.gz HJYGWCHQCVBGDF-UHFFFAOYSA-N -1 3 360.416 3.628 20 0 FHADHM COCC[C@@H](Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)c1ccco1 ZINC000826155350 947488921 /nfs/dbraw/zinc/48/89/21/947488921.db2.gz MZZBBUNWJFEICI-CYBMUJFWSA-N -1 3 367.331 3.668 20 0 FHADHM COCC[C@@H](Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)c1ccco1 ZINC000826155350 947488928 /nfs/dbraw/zinc/48/89/28/947488928.db2.gz MZZBBUNWJFEICI-CYBMUJFWSA-N -1 3 367.331 3.668 20 0 FHADHM COCCOc1ccc(-c2nnn[n-]2)cc1N[C@@H](C)c1ccccc1Cl ZINC000826162159 947508886 /nfs/dbraw/zinc/50/88/86/947508886.db2.gz PLFHBBLASHHTFK-LBPRGKRZSA-N -1 3 373.844 3.718 20 0 FHADHM COCCOc1ccc(-c2nn[n-]n2)cc1N[C@@H](C)c1ccccc1Cl ZINC000826162159 947508896 /nfs/dbraw/zinc/50/88/96/947508896.db2.gz PLFHBBLASHHTFK-LBPRGKRZSA-N -1 3 373.844 3.718 20 0 FHADHM O=C(NCc1ccc([O-])c(F)c1)c1c[nH]nc1-c1cc2ccccc2o1 ZINC000188780402 947516558 /nfs/dbraw/zinc/51/65/58/947516558.db2.gz LDTDGBXZWRWGEJ-UHFFFAOYSA-N -1 3 351.337 3.598 20 0 FHADHM CC(C)[C@H](N[C@@H]1CCN(CC(=O)[O-])C1=O)c1ccc(C2CCCCC2)cc1 ZINC000662210267 947534777 /nfs/dbraw/zinc/53/47/77/947534777.db2.gz DROATXDJSAQYJV-CTNGQTDRSA-N -1 3 372.509 3.707 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CNc1cc(Br)ccc1C ZINC000826170884 947535399 /nfs/dbraw/zinc/53/53/99/947535399.db2.gz SSOBLMMAOFXSDI-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CNc1cc(Br)ccc1C ZINC000826170884 947535405 /nfs/dbraw/zinc/53/54/05/947535405.db2.gz SSOBLMMAOFXSDI-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM O=C([O-])CC[C@H](CNCc1ccc(Br)c(F)c1)C(F)(F)F ZINC000663261217 947582276 /nfs/dbraw/zinc/58/22/76/947582276.db2.gz GYONQXJIYMQPOB-SECBINFHSA-N -1 3 372.156 3.721 20 0 FHADHM CCc1ccc(-c2nc(-c3cccc(CN4CCOCC4)c3)no2)c([O-])c1 ZINC000189166540 947653673 /nfs/dbraw/zinc/65/36/73/947653673.db2.gz SMANRNBOXJMDAN-UHFFFAOYSA-N -1 3 365.433 3.504 20 0 FHADHM CS/C=C\C(=O)N[C@@H](C)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000826226978 947667183 /nfs/dbraw/zinc/66/71/83/947667183.db2.gz JMJGAISYMXODFK-OEYXZAGESA-N -1 3 365.462 3.588 20 0 FHADHM CS/C=C\C(=O)N[C@@H](C)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000826226978 947667186 /nfs/dbraw/zinc/66/71/86/947667186.db2.gz JMJGAISYMXODFK-OEYXZAGESA-N -1 3 365.462 3.588 20 0 FHADHM COc1cc(C(=O)N[C@@H]2CC[C@H](Cc3ccccc3)C2)cc(OC)c1[O-] ZINC000189338816 947692963 /nfs/dbraw/zinc/69/29/63/947692963.db2.gz YGSGRIQJXHAFIH-NVXWUHKLSA-N -1 3 355.434 3.551 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1C[C@H](C)C[C@@H]1c1ccccc1F ZINC000826244096 947723153 /nfs/dbraw/zinc/72/31/53/947723153.db2.gz GXKDYLVQDROIIR-KZULUSFZSA-N -1 3 365.412 3.538 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1C[C@H](C)C[C@@H]1c1ccccc1F ZINC000826244096 947723159 /nfs/dbraw/zinc/72/31/59/947723159.db2.gz GXKDYLVQDROIIR-KZULUSFZSA-N -1 3 365.412 3.538 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1COC(=O)CCc1ccc(Cl)s1 ZINC000826253364 947728810 /nfs/dbraw/zinc/72/88/10/947728810.db2.gz NCVYOFJAFKFEKO-UHFFFAOYSA-N -1 3 362.842 3.566 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1COC(=O)CCc1ccc(Cl)s1 ZINC000826253364 947728817 /nfs/dbraw/zinc/72/88/17/947728817.db2.gz NCVYOFJAFKFEKO-UHFFFAOYSA-N -1 3 362.842 3.566 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1COC(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000826253578 947730801 /nfs/dbraw/zinc/73/08/01/947730801.db2.gz VRNHOADZLQJPSG-GXTWGEPZSA-N -1 3 368.359 3.587 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1COC(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000826253578 947730805 /nfs/dbraw/zinc/73/08/05/947730805.db2.gz VRNHOADZLQJPSG-GXTWGEPZSA-N -1 3 368.359 3.587 20 0 FHADHM CC(=Cc1ccc(C)cc1)C(=O)N(C)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC001573365726 947732667 /nfs/dbraw/zinc/73/26/67/947732667.db2.gz NBMPTBDIEWRZTB-RAXLEYEMSA-N -1 3 367.840 3.895 20 0 FHADHM CC(=Cc1ccc(C)cc1)C(=O)N(C)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC001573365726 947732675 /nfs/dbraw/zinc/73/26/75/947732675.db2.gz NBMPTBDIEWRZTB-RAXLEYEMSA-N -1 3 367.840 3.895 20 0 FHADHM CC(=CC(=O)N1CCc2ccc(-c3nnn[n-]3)cc21)c1ccccc1Cl ZINC001573365619 947732796 /nfs/dbraw/zinc/73/27/96/947732796.db2.gz TYVLKXNRFKIBDI-BENRWUELSA-N -1 3 365.824 3.513 20 0 FHADHM CC(=CC(=O)N1CCc2ccc(-c3nn[n-]n3)cc21)c1ccccc1Cl ZINC001573365619 947732802 /nfs/dbraw/zinc/73/28/02/947732802.db2.gz TYVLKXNRFKIBDI-BENRWUELSA-N -1 3 365.824 3.513 20 0 FHADHM Cc1oncc1C(=O)Nc1ccc([O-])c(C(=O)N[C@H]2CCC[C@H](C)CC2)c1 ZINC000189472389 947739008 /nfs/dbraw/zinc/73/90/08/947739008.db2.gz OZTUXUMEZNHMJB-JSGCOSHPSA-N -1 3 371.437 3.640 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC001573366375 947739086 /nfs/dbraw/zinc/73/90/86/947739086.db2.gz PMVFWLZLCOIFFC-XFXZXTDPSA-N -1 3 368.416 3.604 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC001573366375 947739096 /nfs/dbraw/zinc/73/90/96/947739096.db2.gz PMVFWLZLCOIFFC-XFXZXTDPSA-N -1 3 368.416 3.604 20 0 FHADHM CC(=Cc1ccc(C)cc1)C(=O)Nc1ccc(Cl)cc1-c1nnn[n-]1 ZINC001573366924 947750996 /nfs/dbraw/zinc/75/09/96/947750996.db2.gz VLIWJCQKZQUKMF-XFXZXTDPSA-N -1 3 353.813 3.871 20 0 FHADHM CC(=Cc1ccc(C)cc1)C(=O)Nc1ccc(Cl)cc1-c1nn[n-]n1 ZINC001573366924 947751003 /nfs/dbraw/zinc/75/10/03/947751003.db2.gz VLIWJCQKZQUKMF-XFXZXTDPSA-N -1 3 353.813 3.871 20 0 FHADHM CC(=Cc1ccc(C)cc1)C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC001573367162 947755353 /nfs/dbraw/zinc/75/53/53/947755353.db2.gz YIILOLSNCQOEEN-GXDHUFHOSA-N -1 3 364.453 3.774 20 0 FHADHM CC(=Cc1ccc(C)cc1)C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC001573367162 947755366 /nfs/dbraw/zinc/75/53/66/947755366.db2.gz YIILOLSNCQOEEN-GXDHUFHOSA-N -1 3 364.453 3.774 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)c(N2CCC[C@H](c3nc(C(C)C)cs3)C2)n1 ZINC000826274193 947794054 /nfs/dbraw/zinc/79/40/54/947794054.db2.gz JNTLRBXSVQNZOY-ZDUSSCGKSA-N -1 3 369.498 3.534 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)c(N2CCC[C@H](c3nc(C(C)C)cs3)C2)n1 ZINC000826274193 947794066 /nfs/dbraw/zinc/79/40/66/947794066.db2.gz JNTLRBXSVQNZOY-ZDUSSCGKSA-N -1 3 369.498 3.534 20 0 FHADHM Cc1ccc(C2CCN(c3c(-c4nnn[n-]4)cnc4ccccc43)CC2)cn1 ZINC000826286232 947827435 /nfs/dbraw/zinc/82/74/35/947827435.db2.gz WILKGZRQFWXXLY-UHFFFAOYSA-N -1 3 371.448 3.502 20 0 FHADHM Cc1ccc(C2CCN(c3c(-c4nn[n-]n4)cnc4ccccc43)CC2)cn1 ZINC000826286232 947827442 /nfs/dbraw/zinc/82/74/42/947827442.db2.gz WILKGZRQFWXXLY-UHFFFAOYSA-N -1 3 371.448 3.502 20 0 FHADHM O=C1Nc2ccc(S(=O)(=O)[N-]c3ccsc3Cl)c3cccc1c23 ZINC000189736673 947830140 /nfs/dbraw/zinc/83/01/40/947830140.db2.gz CHMKOWQRGAFTBO-UHFFFAOYSA-N -1 3 364.835 3.921 20 0 FHADHM Cc1nc(C(C)C)oc1C(=O)[N-]c1nnc(Cc2ccc(F)cc2)s1 ZINC000550412591 947864650 /nfs/dbraw/zinc/86/46/50/947864650.db2.gz OJNIPECCCGHLTQ-UHFFFAOYSA-N -1 3 360.414 3.940 20 0 FHADHM CCc1ccc(C(=O)N2CCC(Oc3ccc(F)cc3F)CC2)c([O-])c1 ZINC000189900688 947876090 /nfs/dbraw/zinc/87/60/90/947876090.db2.gz ZDSVDYACIVYICA-UHFFFAOYSA-N -1 3 361.388 3.916 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N2CC[C@@H](c3ccccc3)[C@@H](C)C2)c1 ZINC000076472733 947888776 /nfs/dbraw/zinc/88/87/76/947888776.db2.gz IZUIXZHMMKAWQU-KBXCAEBGSA-N -1 3 352.434 3.616 20 0 FHADHM Cc1ccnc(N[C@@H](C)c2ccc(-c3cccc(-c4nnn[n-]4)c3)cc2)n1 ZINC000826311530 947901454 /nfs/dbraw/zinc/90/14/54/947901454.db2.gz HGJCYTJHSWTXSF-AWEZNQCLSA-N -1 3 357.421 3.805 20 0 FHADHM Cc1ccnc(N[C@@H](C)c2ccc(-c3cccc(-c4nn[n-]n4)c3)cc2)n1 ZINC000826311530 947901461 /nfs/dbraw/zinc/90/14/61/947901461.db2.gz HGJCYTJHSWTXSF-AWEZNQCLSA-N -1 3 357.421 3.805 20 0 FHADHM CCCCOc1ccc(C(=O)N(C)Cc2nc3ccccc3n2C)c([O-])c1 ZINC000190372165 947954025 /nfs/dbraw/zinc/95/40/25/947954025.db2.gz ZZEKAXCVTRPIRI-UHFFFAOYSA-N -1 3 367.449 3.730 20 0 FHADHM C[C@H](Cc1ccc(Br)cc1)N[C@@H](C)c1ncc(C(=O)[O-])s1 ZINC000314653355 948009414 /nfs/dbraw/zinc/00/94/14/948009414.db2.gz MVYSQPZVCSVTES-ZJUUUORDSA-N -1 3 369.284 3.886 20 0 FHADHM O=C([N-]Cc1coc(-c2cccs2)n1)C(F)(F)c1ccc(F)cc1 ZINC000147568341 948023876 /nfs/dbraw/zinc/02/38/76/948023876.db2.gz QTXNAAIDSQHYIL-UHFFFAOYSA-N -1 3 352.337 3.950 20 0 FHADHM CC(C)(C)c1ccc2cc(C(=O)N[N-]C(=O)c3ccccc3F)[nH]c2c1 ZINC000029002583 948080088 /nfs/dbraw/zinc/08/00/88/948080088.db2.gz IIQGHDBWXHVPPW-UHFFFAOYSA-N -1 3 353.397 3.679 20 0 FHADHM Clc1ccc(C=Cc2ccc(-c3nnn[n-]3)cn2)cc1Br ZINC000826351849 948099619 /nfs/dbraw/zinc/09/96/19/948099619.db2.gz DBBBBXWUGKTIBI-RJRFIUFISA-N -1 3 362.618 3.848 20 0 FHADHM Clc1ccc(C=Cc2ccc(-c3nn[n-]n3)cn2)cc1Br ZINC000826351849 948099630 /nfs/dbraw/zinc/09/96/30/948099630.db2.gz DBBBBXWUGKTIBI-RJRFIUFISA-N -1 3 362.618 3.848 20 0 FHADHM Cn1cc(CNc2cccc(Cl)c2)c(-c2ccc(-c3nnn[n-]3)cc2)n1 ZINC000826361727 948133009 /nfs/dbraw/zinc/13/30/09/948133009.db2.gz LMUMTLXBLOQURW-UHFFFAOYSA-N -1 3 365.828 3.533 20 0 FHADHM Cn1cc(CNc2cccc(Cl)c2)c(-c2ccc(-c3nn[n-]n3)cc2)n1 ZINC000826361727 948133014 /nfs/dbraw/zinc/13/30/14/948133014.db2.gz LMUMTLXBLOQURW-UHFFFAOYSA-N -1 3 365.828 3.533 20 0 FHADHM CC(C)(C)OC1CC(CC[N-]S(=O)(=O)c2ccc(Cl)s2)C1 ZINC000432338563 948156190 /nfs/dbraw/zinc/15/61/90/948156190.db2.gz FLCBZHIPZXYIHU-UHFFFAOYSA-N -1 3 351.921 3.664 20 0 FHADHM Fc1ccc(CNc2ccc(Br)cc2-c2nnn[n-]2)cc1F ZINC000826374636 948162807 /nfs/dbraw/zinc/16/28/07/948162807.db2.gz GYZGCDPSXWDBKB-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1ccc(CNc2ccc(Br)cc2-c2nn[n-]n2)cc1F ZINC000826374636 948162813 /nfs/dbraw/zinc/16/28/13/948162813.db2.gz GYZGCDPSXWDBKB-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1cccc(N[C@H]2CCCc3cn(C4CCCC4)nc32)c1-c1nnn[n-]1 ZINC000826377177 948167799 /nfs/dbraw/zinc/16/77/99/948167799.db2.gz HYPNOHGDDRGLHT-INIZCTEOSA-N -1 3 367.432 3.807 20 0 FHADHM Fc1cccc(N[C@H]2CCCc3cn(C4CCCC4)nc32)c1-c1nn[n-]n1 ZINC000826377177 948167802 /nfs/dbraw/zinc/16/78/02/948167802.db2.gz HYPNOHGDDRGLHT-INIZCTEOSA-N -1 3 367.432 3.807 20 0 FHADHM Cc1cnc([C@H](C)C[N-]S(=O)(=O)c2oc3ccc(F)cc3c2C)s1 ZINC000544652873 948225011 /nfs/dbraw/zinc/22/50/11/948225011.db2.gz YEATVLKIJQCDGF-SECBINFHSA-N -1 3 368.455 3.727 20 0 FHADHM O=C(c1cc(Nc2cc(=O)[n-]c(C3CC3)n2)ccc1F)N1CCCCC1 ZINC001211868662 948226611 /nfs/dbraw/zinc/22/66/11/948226611.db2.gz MMFYOJQJUYMYLB-UHFFFAOYSA-N -1 3 356.401 3.568 20 0 FHADHM O=C(N[C@H](c1ccc(F)cc1)C1CCC1)c1cc(=O)c2ccccc2[n-]1 ZINC000520532246 948238891 /nfs/dbraw/zinc/23/88/91/948238891.db2.gz KBSLGAVYJHQTKA-FQEVSTJZSA-N -1 3 350.393 3.938 20 0 FHADHM CC(C)(C)n1cc(CN[C@@]2(C(=O)[O-])CCC(C)(C)c3ccccc32)cn1 ZINC000417576391 948279595 /nfs/dbraw/zinc/27/95/95/948279595.db2.gz HSTSRPLGVISQMB-NRFANRHFSA-N -1 3 355.482 3.779 20 0 FHADHM O=C(NCc1ccc(-c2nnn[n-]2)cc1)N(c1ccccc1)c1ccccc1 ZINC000826441130 948302930 /nfs/dbraw/zinc/30/29/30/948302930.db2.gz PGHQFQLBDAMVIA-UHFFFAOYSA-N -1 3 370.416 3.915 20 0 FHADHM O=C(NCc1ccc(-c2nn[n-]n2)cc1)N(c1ccccc1)c1ccccc1 ZINC000826441130 948302939 /nfs/dbraw/zinc/30/29/39/948302939.db2.gz PGHQFQLBDAMVIA-UHFFFAOYSA-N -1 3 370.416 3.915 20 0 FHADHM Cc1nn(C(C)(C)C)cc1C(=O)N=c1cc(-c2cc(C)cc(C)c2)[n-][nH]1 ZINC000544327328 948304096 /nfs/dbraw/zinc/30/40/96/948304096.db2.gz MGPIUFIQUBELLS-UHFFFAOYSA-N -1 3 351.454 3.628 20 0 FHADHM COc1ccc2ncc(C(=O)[O-])c(N3CCC(OCC(C)C)CC3)c2c1 ZINC000520588372 948341713 /nfs/dbraw/zinc/34/17/13/948341713.db2.gz NQPTZUGMLAIGBA-UHFFFAOYSA-N -1 3 358.438 3.583 20 0 FHADHM O=C(Nc1csc2ccccc12)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000826459670 948342904 /nfs/dbraw/zinc/34/29/04/948342904.db2.gz UBHBWBQAUQCGHM-UHFFFAOYSA-N -1 3 357.345 3.612 20 0 FHADHM O=C(Nc1csc2ccccc12)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000826459670 948342911 /nfs/dbraw/zinc/34/29/11/948342911.db2.gz UBHBWBQAUQCGHM-UHFFFAOYSA-N -1 3 357.345 3.612 20 0 FHADHM O=C(Oc1ccc(-c2ccc(-c3nnn[n-]3)cc2)cc1)[C@H]1CCCCS1 ZINC000826468243 948365359 /nfs/dbraw/zinc/36/53/59/948365359.db2.gz HYGAQYNKYSNUBX-QGZVFWFLSA-N -1 3 366.446 3.725 20 0 FHADHM O=C(Oc1ccc(-c2ccc(-c3nn[n-]n3)cc2)cc1)[C@H]1CCCCS1 ZINC000826468243 948365365 /nfs/dbraw/zinc/36/53/65/948365365.db2.gz HYGAQYNKYSNUBX-QGZVFWFLSA-N -1 3 366.446 3.725 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)NCCc2cc(Cl)cc(Cl)c2)c1 ZINC000520622974 948433296 /nfs/dbraw/zinc/43/32/96/948433296.db2.gz QFNGLQLYNKRDII-UHFFFAOYSA-N -1 3 367.232 3.630 20 0 FHADHM CCO[C@H](CC[N-]S(=O)(=O)c1c(Cl)cccc1Cl)C(C)C ZINC000467800156 948459141 /nfs/dbraw/zinc/45/91/41/948459141.db2.gz SKEALKMGCLCMSN-CYBMUJFWSA-N -1 3 354.299 3.723 20 0 FHADHM C[C@@H]1CC[C@@](C)(/C=C/C(=O)NCc2ccc(-c3nnn[n-]3)cc2)C1(C)C ZINC001464879545 948530893 /nfs/dbraw/zinc/53/08/93/948530893.db2.gz IARSHWQEYPNTAA-JDBPQYJSSA-N -1 3 353.470 3.502 20 0 FHADHM C[C@@H]1CC[C@@](C)(/C=C/C(=O)NCc2ccc(-c3nn[n-]n3)cc2)C1(C)C ZINC001464879545 948530899 /nfs/dbraw/zinc/53/08/99/948530899.db2.gz IARSHWQEYPNTAA-JDBPQYJSSA-N -1 3 353.470 3.502 20 0 FHADHM COc1cc(C)c(S(=O)(=O)[N-]c2ccc(Cl)c(OC)c2)cc1C ZINC000432481012 948555503 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O=C(COc1ccc2cc(Br)ccc2c1)Nc1ncccc1[O-] ZINC000059289896 212015789 /nfs/dbraw/zinc/01/57/89/212015789.db2.gz KOGLEICWLWPMBB-UHFFFAOYSA-N -1 3 373.206 3.720 20 0 FHADHM O=C(Nc1ccccc1NC(=O)N1CCCC1)c1cc(-c2ccco2)n[n-]1 ZINC000058386761 212008139 /nfs/dbraw/zinc/00/81/39/212008139.db2.gz VSYDLMDEYPPIMR-UHFFFAOYSA-N -1 3 365.393 3.550 20 0 FHADHM O=C(Nc1ccccc1NC(=O)N1CCCC1)c1cc(-c2ccco2)[n-]n1 ZINC000058386761 212008136 /nfs/dbraw/zinc/00/81/36/212008136.db2.gz VSYDLMDEYPPIMR-UHFFFAOYSA-N -1 3 365.393 3.550 20 0 FHADHM CCc1[nH]c(C(=O)Nc2cc(C(C)(C)C)ccc2[O-])c(C)c1C(=O)OC ZINC000021006718 211303017 /nfs/dbraw/zinc/30/30/17/211303017.db2.gz AOTOYADBAVEXLJ-UHFFFAOYSA-N -1 3 358.438 3.928 20 0 FHADHM CC(C)c1ccc([N-]S(=O)(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)cc1 ZINC000020939952 211301621 /nfs/dbraw/zinc/30/16/21/211301621.db2.gz QIMWUAUKVWRUPA-UHFFFAOYSA-N -1 3 358.463 3.841 20 0 FHADHM CCCc1ccc(S(=O)(=O)[N-]c2ccc(N3CCCC3=O)cc2)cc1 ZINC000007612594 210746149 /nfs/dbraw/zinc/74/61/49/210746149.db2.gz XSKGPOSGWUAMPJ-UHFFFAOYSA-N -1 3 358.463 3.567 20 0 FHADHM Cc1nnc([N-]C(=O)c2cc3c(C)nn(-c4ccccc4)c3s2)s1 ZINC000000795800 210272498 /nfs/dbraw/zinc/27/24/98/210272498.db2.gz UBHJMPWQEKWZJO-UHFFFAOYSA-N -1 3 355.448 3.808 20 0 FHADHM C[C@@H]1CCN(C)CCN1C(=O)N=c1[n-]nc(-c2cc3ccccc3o2)s1 ZINC000499497936 515346947 /nfs/dbraw/zinc/34/69/47/515346947.db2.gz BDHXTAZAIKZCAO-GFCCVEGCSA-N -1 3 371.466 3.509 20 0 FHADHM Cn1[n-]c(=NC(=O)[C@H]2C[C@@H]2c2c(F)cccc2Cl)cc1OC(F)F ZINC000490993195 515353195 /nfs/dbraw/zinc/35/31/95/515353195.db2.gz XICCABMUWVGRPB-YUMQZZPRSA-N -1 3 359.735 3.556 20 0 FHADHM Cc1cccc(OCCCCC(=O)N=c2cc(OC(F)F)n(C)[n-]2)c1 ZINC000491008289 515355983 /nfs/dbraw/zinc/35/59/83/515355983.db2.gz YLWFNWQSDLQKOK-UHFFFAOYSA-N -1 3 353.369 3.518 20 0 FHADHM Cc1ccccc1-c1cc(=NC(=O)c2cnc(-c3ncccn3)s2)[nH][n-]1 ZINC000512327317 516240371 /nfs/dbraw/zinc/24/03/71/516240371.db2.gz YFPSLSYTGFKRJO-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM C[C@H]1C[C@H](NC(=O)N=c2[n-]nc(-c3cc4ccccc4o3)s2)CCN1C ZINC000470514039 516276665 /nfs/dbraw/zinc/27/66/65/516276665.db2.gz NCPJBXHCBBQNFH-WCQYABFASA-N -1 3 371.466 3.556 20 0 FHADHM Cc1cc(C)cc(-c2cc(=NC(=O)CCNC(=O)c3ccsc3)[nH][n-]2)c1 ZINC000512550581 516303116 /nfs/dbraw/zinc/30/31/16/516303116.db2.gz JMVOWLFLHCOMJT-UHFFFAOYSA-N -1 3 368.462 3.514 20 0 FHADHM CCCc1ccc(-c2cc(=NC(=O)[C@H](C)NC(=O)C(C)(C)C)[nH][n-]2)cc1 ZINC000523821652 516588623 /nfs/dbraw/zinc/58/86/23/516588623.db2.gz OOBPRURPZNWNPY-ZDUSSCGKSA-N -1 3 356.470 3.519 20 0 FHADHM CC(=O)c1ccccc1C(=O)N=c1cc2ccc(Br)cn2[n-]1 ZINC000513737582 516735691 /nfs/dbraw/zinc/73/56/91/516735691.db2.gz FFGRJLYZWQRESW-UHFFFAOYSA-N -1 3 358.195 3.552 20 0 FHADHM CN(CCN(C)C1CC1)C(=O)N=c1[n-]nc(-c2cc3ccccc3o2)s1 ZINC000526068508 517324991 /nfs/dbraw/zinc/32/49/91/517324991.db2.gz VJZDWPXAONGPCI-UHFFFAOYSA-N -1 3 371.466 3.509 20 0 FHADHM CCN=c1[n-]c(C(=O)N2CCC[C@]3(CCc4ccccc4O3)C2)cs1 ZINC000529903445 517429261 /nfs/dbraw/zinc/42/92/61/517429261.db2.gz IZDJWXKAHNCBEU-IBGZPJMESA-N -1 3 357.479 3.575 20 0 FHADHM Cc1cc(C(=O)N=c2cc(-c3cc(F)cc(F)c3)[n-][nH]2)nn1C(F)F ZINC000534883642 518070377 /nfs/dbraw/zinc/07/03/77/518070377.db2.gz FKQFSLUZRBBEGI-UHFFFAOYSA-N -1 3 353.279 3.507 20 0 FHADHM CCN=c1[n-]c(C(=O)Nc2ccc(F)cc2OC2CCOCC2)cs1 ZINC000614706562 521099995 /nfs/dbraw/zinc/09/99/95/521099995.db2.gz NHVNSNOQXYDTIT-UHFFFAOYSA-N -1 3 365.430 3.524 20 0 FHADHM CC(C)C[C@H](CCO)CNC(=O)c1c[n-]nc1-c1ccc(Cl)s1 ZINC000186436096 567919853 /nfs/dbraw/zinc/91/98/53/567919853.db2.gz FEYHNDYMCAJEFT-NSHDSACASA-N -1 3 355.891 3.566 20 0 FHADHM CCOc1ncc(C(=O)N=c2[nH][n-]c(C)c2-c2ccccc2)cc1Cl ZINC000602324291 567967562 /nfs/dbraw/zinc/96/75/62/567967562.db2.gz HEPJSUIAEXDYTP-UHFFFAOYSA-N -1 3 356.813 3.506 20 0 FHADHM Cc1cccc([O-])c1C(=O)N1C[C@@H](O)C[C@H]1c1cccc(C(F)(F)F)c1 ZINC000626251246 567975859 /nfs/dbraw/zinc/97/58/59/567975859.db2.gz VXGHIYFJRSFHPZ-GJZGRUSLSA-N -1 3 365.351 3.668 20 0 FHADHM Cc1nnsc1C(=O)[N-]c1ccc(F)c(C(=O)OC(C)(C)C)c1Cl ZINC000602405174 567976320 /nfs/dbraw/zinc/97/63/20/567976320.db2.gz LLDWLEOYLDNLMH-UHFFFAOYSA-N -1 3 371.821 3.847 20 0 FHADHM COc1ccc(C(=O)N(C)C[C@H]2CCCO[C@@H]2c2ccccc2)c([O-])c1 ZINC000051468118 567979568 /nfs/dbraw/zinc/97/95/68/567979568.db2.gz BGPIVMIDEDQYRH-OXQOHEQNSA-N -1 3 355.434 3.641 20 0 FHADHM C[C@@H](Cc1ccc(O)cc1)NC(=O)c1c[n-]nc1-c1ccc(Cl)s1 ZINC000186841872 567991193 /nfs/dbraw/zinc/99/11/93/567991193.db2.gz DURIDMIYTPBEEM-JTQLQIEISA-N -1 3 361.854 3.858 20 0 FHADHM Cc1cc(C(=O)Nc2ccc([N-]S(=O)(=O)c3ccc(C)cc3)cc2)co1 ZINC000186898131 568004928 /nfs/dbraw/zinc/00/49/28/568004928.db2.gz IGPJLEZEQUGAGF-UHFFFAOYSA-N -1 3 370.430 3.950 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)c3cc4sccc4[nH]3)c2)n1 ZINC000188657225 568005375 /nfs/dbraw/zinc/00/53/75/568005375.db2.gz CUSLDZMBIXQCPQ-UHFFFAOYSA-N -1 3 364.430 3.794 20 0 FHADHM COc1ccc(F)cc1[C@@H](C)[N-]S(=O)(=O)c1ccccc1SC ZINC000186988092 568038175 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O=C(Nc1ccnc(OCC(F)(F)F)c1)c1cn[n-]c1-c1ccsc1 ZINC000647746166 568355411 /nfs/dbraw/zinc/35/54/11/568355411.db2.gz NOQQRODZUQQKHB-UHFFFAOYSA-N -1 3 368.340 3.727 20 0 FHADHM O=C(Nc1ccnc(OCC(F)(F)F)c1)c1c[n-]nc1-c1ccsc1 ZINC000647746166 568355412 /nfs/dbraw/zinc/35/54/12/568355412.db2.gz NOQQRODZUQQKHB-UHFFFAOYSA-N -1 3 368.340 3.727 20 0 FHADHM Cc1nn(C)c2nc(C)c(CC(=O)Nc3cc(Cl)cc(C)c3[O-])c(C)c12 ZINC000604902203 568385088 /nfs/dbraw/zinc/38/50/88/568385088.db2.gz VWVVWDLWRTUALF-UHFFFAOYSA-N -1 3 372.856 3.742 20 0 FHADHM C[C@]([N-]C(=O)c1ocnc1C(F)F)(c1ccc(F)cc1)C(F)(F)F ZINC000637099871 568386299 /nfs/dbraw/zinc/38/62/99/568386299.db2.gz UEKOIYYEZVCQHD-ZDUSSCGKSA-N -1 3 352.234 3.959 20 0 FHADHM CS(=O)(=O)c1ccc(C(=O)[N-]c2nc(/C=C/c3ccccc3)cs2)o1 ZINC000604962488 568428070 /nfs/dbraw/zinc/42/80/70/568428070.db2.gz FLSVGITWSLFEKU-BQYQJAHWSA-N -1 3 374.443 3.562 20 0 FHADHM O=C(Nc1nnc(-c2ccccn2)[n-]1)c1ccc(OC2CCCCC2)cc1 ZINC000605123273 568578739 /nfs/dbraw/zinc/57/87/39/568578739.db2.gz QUKKPZYTZZKCRI-UHFFFAOYSA-N -1 3 363.421 3.831 20 0 FHADHM O=C(Nc1nc(-c2ccccn2)n[n-]1)c1ccc(OC2CCCCC2)cc1 ZINC000605123273 568578741 /nfs/dbraw/zinc/57/87/41/568578741.db2.gz QUKKPZYTZZKCRI-UHFFFAOYSA-N -1 3 363.421 3.831 20 0 FHADHM O=C(Nc1n[n-]c(-c2ccccn2)n1)c1ccc(OC2CCCCC2)cc1 ZINC000605123273 568578743 /nfs/dbraw/zinc/57/87/43/568578743.db2.gz QUKKPZYTZZKCRI-UHFFFAOYSA-N -1 3 363.421 3.831 20 0 FHADHM CC[C@@H](OC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1ccc(F)cc1F ZINC000736380382 598823327 /nfs/dbraw/zinc/82/33/27/598823327.db2.gz FSGOFWMESZQYEN-CGQZWFTASA-N -1 3 370.359 3.853 20 0 FHADHM CC[C@@H](OC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1ccc(F)cc1F ZINC000736380382 598823329 /nfs/dbraw/zinc/82/33/29/598823329.db2.gz FSGOFWMESZQYEN-CGQZWFTASA-N -1 3 370.359 3.853 20 0 FHADHM CSCCCCC(=O)Nc1sc2c(c1-c1nnn[n-]1)CC[C@H](C)C2 ZINC000737180726 598830112 /nfs/dbraw/zinc/83/01/12/598830112.db2.gz CHVHMBBBYSQJJB-JTQLQIEISA-N -1 3 365.528 3.525 20 0 FHADHM CSCCCCC(=O)Nc1sc2c(c1-c1nn[n-]n1)CC[C@H](C)C2 ZINC000737180726 598830114 /nfs/dbraw/zinc/83/01/14/598830114.db2.gz CHVHMBBBYSQJJB-JTQLQIEISA-N -1 3 365.528 3.525 20 0 FHADHM COc1cccc(CNc2ccc(-c3nn[n-]n3)cc2)c1OC1CCCC1 ZINC000737132402 598830217 /nfs/dbraw/zinc/83/02/17/598830217.db2.gz MDYPCLVKAOJIDS-UHFFFAOYSA-N -1 3 365.437 3.809 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@H](C)c1cccc(C)c1 ZINC000736478883 598830586 /nfs/dbraw/zinc/83/05/86/598830586.db2.gz FMRPXKOFSTYWMI-MRXNPFEDSA-N -1 3 363.465 3.717 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@H](C)c1cccc(C)c1 ZINC000736478883 598830588 /nfs/dbraw/zinc/83/05/88/598830588.db2.gz FMRPXKOFSTYWMI-MRXNPFEDSA-N -1 3 363.465 3.717 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H](SC)c2ccccc2)c1-c1nnn[n-]1 ZINC000736669749 598832240 /nfs/dbraw/zinc/83/22/40/598832240.db2.gz JGQIUBNTOSULDQ-CQSZACIVSA-N -1 3 373.507 3.842 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H](SC)c2ccccc2)c1-c1nn[n-]n1 ZINC000736669749 598832241 /nfs/dbraw/zinc/83/22/41/598832241.db2.gz JGQIUBNTOSULDQ-CQSZACIVSA-N -1 3 373.507 3.842 20 0 FHADHM CCC[C@@H](C)C(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000736420402 598835410 /nfs/dbraw/zinc/83/54/10/598835410.db2.gz TVAGKUVXKANHON-GFCCVEGCSA-N -1 3 355.467 3.648 20 0 FHADHM CCCOc1ccccc1NC(=O)Nc1cc(-c2nnn[n-]2)ccc1C ZINC000736491898 598850216 /nfs/dbraw/zinc/85/02/16/598850216.db2.gz FMXZCVQNFNSQMV-UHFFFAOYSA-N -1 3 352.398 3.608 20 0 FHADHM CCCOc1ccccc1NC(=O)Nc1cc(-c2nn[n-]n2)ccc1C ZINC000736491898 598850218 /nfs/dbraw/zinc/85/02/18/598850218.db2.gz FMXZCVQNFNSQMV-UHFFFAOYSA-N -1 3 352.398 3.608 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N(C)CCc1ccc(Cl)cc1 ZINC000737292158 598851416 /nfs/dbraw/zinc/85/14/16/598851416.db2.gz SNYGKFQFHMWHGL-UHFFFAOYSA-N -1 3 370.844 3.535 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N(C)CCc1ccc(Cl)cc1 ZINC000737292158 598851418 /nfs/dbraw/zinc/85/14/18/598851418.db2.gz SNYGKFQFHMWHGL-UHFFFAOYSA-N -1 3 370.844 3.535 20 0 FHADHM c1cc(OCCCCc2nc(C3CCCCC3)no2)cc(-c2nnn[n-]2)c1 ZINC000738419032 598859216 /nfs/dbraw/zinc/85/92/16/598859216.db2.gz MGGZPIMUASWYEI-UHFFFAOYSA-N -1 3 368.441 3.699 20 0 FHADHM c1cc(OCCCCc2nc(C3CCCCC3)no2)cc(-c2nn[n-]n2)c1 ZINC000738419032 598859217 /nfs/dbraw/zinc/85/92/17/598859217.db2.gz MGGZPIMUASWYEI-UHFFFAOYSA-N -1 3 368.441 3.699 20 0 FHADHM Cc1ccccc1-c1noc(CSc2ccc(-c3nnn[n-]3)cc2)n1 ZINC000737418106 598859904 /nfs/dbraw/zinc/85/99/04/598859904.db2.gz MLSLNUMTLYOCIK-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM Cc1ccccc1-c1noc(CSc2ccc(-c3nn[n-]n3)cc2)n1 ZINC000737418106 598859907 /nfs/dbraw/zinc/85/99/07/598859907.db2.gz MLSLNUMTLYOCIK-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@H]1C[C@H](C)C[C@H](C)C1 ZINC000736481760 598890849 /nfs/dbraw/zinc/89/08/49/598890849.db2.gz UQDLHCVTNJMCPQ-HWWDLCQESA-N -1 3 370.501 3.613 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@H]1C[C@H](C)C[C@H](C)C1 ZINC000736481760 598890851 /nfs/dbraw/zinc/89/08/51/598890851.db2.gz UQDLHCVTNJMCPQ-HWWDLCQESA-N -1 3 370.501 3.613 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)ccc1OCc1cc(C)nc2ccccc12 ZINC000736625392 598891833 /nfs/dbraw/zinc/89/18/33/598891833.db2.gz FBFOVEUATLKJPJ-UHFFFAOYSA-N -1 3 361.405 3.701 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)ccc1OCc1cc(C)nc2ccccc12 ZINC000736625392 598891835 /nfs/dbraw/zinc/89/18/35/598891835.db2.gz FBFOVEUATLKJPJ-UHFFFAOYSA-N -1 3 361.405 3.701 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)OCc1ccc2ccccc2c1 ZINC000737797959 598896785 /nfs/dbraw/zinc/89/67/85/598896785.db2.gz GAALNXMVAHOJQG-VAWYXSNFSA-N -1 3 356.385 3.777 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)OCc1ccc2ccccc2c1 ZINC000737797959 598896786 /nfs/dbraw/zinc/89/67/86/598896786.db2.gz GAALNXMVAHOJQG-VAWYXSNFSA-N -1 3 356.385 3.777 20 0 FHADHM CC[C@@H](CC1CCCCC1)C(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1 ZINC000736351538 598903665 /nfs/dbraw/zinc/90/36/65/598903665.db2.gz RSFBVXNMYPCAIT-KRWDZBQOSA-N -1 3 355.486 3.822 20 0 FHADHM CC[C@@H](CC1CCCCC1)C(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1 ZINC000736351538 598903666 /nfs/dbraw/zinc/90/36/66/598903666.db2.gz RSFBVXNMYPCAIT-KRWDZBQOSA-N -1 3 355.486 3.822 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@H]2C(=O)N(C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000735924810 598911213 /nfs/dbraw/zinc/91/12/13/598911213.db2.gz VGFNTNRJPGPELQ-RBUKOAKNSA-N -1 3 361.449 3.757 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@H]2C(=O)N(C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000735924810 598911214 /nfs/dbraw/zinc/91/12/14/598911214.db2.gz VGFNTNRJPGPELQ-RBUKOAKNSA-N -1 3 361.449 3.757 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1Sc1ccc(Br)cc1 ZINC000737557668 598934931 /nfs/dbraw/zinc/93/49/31/598934931.db2.gz HCOPETMNDVCYOD-UHFFFAOYSA-N -1 3 368.647 3.829 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1Sc1ccc(Br)cc1 ZINC000737557668 598934932 /nfs/dbraw/zinc/93/49/32/598934932.db2.gz HCOPETMNDVCYOD-UHFFFAOYSA-N -1 3 368.647 3.829 20 0 FHADHM Cc1ccc(Oc2ncc(-c3nnn[n-]3)cc2Cl)c(Br)c1 ZINC000737364683 598934993 /nfs/dbraw/zinc/93/49/93/598934993.db2.gz CCZOOFQBYZJSCC-UHFFFAOYSA-N -1 3 366.606 3.778 20 0 FHADHM Cc1ccc(Oc2ncc(-c3nn[n-]n3)cc2Cl)c(Br)c1 ZINC000737364683 598934994 /nfs/dbraw/zinc/93/49/94/598934994.db2.gz CCZOOFQBYZJSCC-UHFFFAOYSA-N -1 3 366.606 3.778 20 0 FHADHM C[C@H]1C[C@@H]1c1ccc(CN(c2ncc(-c3nnn[n-]3)cc2Cl)C2CC2)o1 ZINC000736241999 598936617 /nfs/dbraw/zinc/93/66/17/598936617.db2.gz YKSSWDYGXSWPBW-HZMBPMFUSA-N -1 3 370.844 3.801 20 0 FHADHM C[C@H]1C[C@@H]1c1ccc(CN(c2ncc(-c3nn[n-]n3)cc2Cl)C2CC2)o1 ZINC000736241999 598936618 /nfs/dbraw/zinc/93/66/18/598936618.db2.gz YKSSWDYGXSWPBW-HZMBPMFUSA-N -1 3 370.844 3.801 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1Nc1cccc(OC2CCCC2)c1 ZINC000737558554 598937527 /nfs/dbraw/zinc/93/75/27/598937527.db2.gz NHFIRGBVSCDJOU-UHFFFAOYSA-N -1 3 356.817 3.980 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1Nc1cccc(OC2CCCC2)c1 ZINC000737558554 598937530 /nfs/dbraw/zinc/93/75/30/598937530.db2.gz NHFIRGBVSCDJOU-UHFFFAOYSA-N -1 3 356.817 3.980 20 0 FHADHM CCOc1ccccc1[C@H](CC)Nc1ncc(-c2nnn[n-]2)cc1Cl ZINC000736652834 598940076 /nfs/dbraw/zinc/94/00/76/598940076.db2.gz CFGJRDIGSXSBDW-AWEZNQCLSA-N -1 3 358.833 3.877 20 0 FHADHM CCOc1ccccc1[C@H](CC)Nc1ncc(-c2nn[n-]n2)cc1Cl ZINC000736652834 598940078 /nfs/dbraw/zinc/94/00/78/598940078.db2.gz CFGJRDIGSXSBDW-AWEZNQCLSA-N -1 3 358.833 3.877 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@H](CC(C)C)c1ccccc1 ZINC000737056921 598940963 /nfs/dbraw/zinc/94/09/63/598940963.db2.gz DSCXIMJOIMCUMU-MRXNPFEDSA-N -1 3 365.437 3.644 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@H](CC(C)C)c1ccccc1 ZINC000737056921 598940965 /nfs/dbraw/zinc/94/09/65/598940965.db2.gz DSCXIMJOIMCUMU-MRXNPFEDSA-N -1 3 365.437 3.644 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1Nc1cccc(Oc2ccncc2)c1 ZINC000737558648 598942734 /nfs/dbraw/zinc/94/27/34/598942734.db2.gz POGWDTCVESKIMQ-UHFFFAOYSA-N -1 3 365.784 3.846 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1Nc1cccc(Oc2ccncc2)c1 ZINC000737558648 598942736 /nfs/dbraw/zinc/94/27/36/598942736.db2.gz POGWDTCVESKIMQ-UHFFFAOYSA-N -1 3 365.784 3.846 20 0 FHADHM C[C@@H](c1ccccc1)N(CC1CCC1)C(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000736201749 598944518 /nfs/dbraw/zinc/94/45/18/598944518.db2.gz HJLFCCOBDRXNHB-HNNXBMFYSA-N -1 3 361.449 3.870 20 0 FHADHM C[C@@H](c1ccccc1)N(CC1CCC1)C(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC000736201749 598944519 /nfs/dbraw/zinc/94/45/19/598944519.db2.gz HJLFCCOBDRXNHB-HNNXBMFYSA-N -1 3 361.449 3.870 20 0 FHADHM Cc1c(COC(=O)CCc2ccc(-c3nnn[n-]3)cc2)oc2ccccc12 ZINC000737214977 598974766 /nfs/dbraw/zinc/97/47/66/598974766.db2.gz CGXBENPOPKSUQQ-UHFFFAOYSA-N -1 3 362.389 3.597 20 0 FHADHM Cc1c(COC(=O)CCc2ccc(-c3nn[n-]n3)cc2)oc2ccccc12 ZINC000737214977 598974768 /nfs/dbraw/zinc/97/47/68/598974768.db2.gz CGXBENPOPKSUQQ-UHFFFAOYSA-N -1 3 362.389 3.597 20 0 FHADHM CC(C)[C@@H](NC(=O)c1ccc(-c2nnn[n-]2)cc1)c1ccccc1Cl ZINC000735722302 599007098 /nfs/dbraw/zinc/00/70/98/599007098.db2.gz UQERPZJSFVBMFE-MRXNPFEDSA-N -1 3 355.829 3.647 20 0 FHADHM CC(C)[C@@H](NC(=O)c1ccc(-c2nn[n-]n2)cc1)c1ccccc1Cl ZINC000735722302 599007100 /nfs/dbraw/zinc/00/71/00/599007100.db2.gz UQERPZJSFVBMFE-MRXNPFEDSA-N -1 3 355.829 3.647 20 0 FHADHM O=C(C[C@H]1CCc2ccccc21)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000737817543 599016268 /nfs/dbraw/zinc/01/62/68/599016268.db2.gz BLAIAYAMFIRGMF-GFCCVEGCSA-N -1 3 353.813 3.579 20 0 FHADHM O=C(C[C@H]1CCc2ccccc21)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000737817543 599016271 /nfs/dbraw/zinc/01/62/71/599016271.db2.gz BLAIAYAMFIRGMF-GFCCVEGCSA-N -1 3 353.813 3.579 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@H]2C(=O)OCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000735922226 599016497 /nfs/dbraw/zinc/01/64/97/599016497.db2.gz CVOVCMRKFBNBCD-RTBURBONSA-N -1 3 362.433 3.837 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@H]2C(=O)OCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000735922226 599016499 /nfs/dbraw/zinc/01/64/99/599016499.db2.gz CVOVCMRKFBNBCD-RTBURBONSA-N -1 3 362.433 3.837 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CCCCC[C@H]1CC(C)C ZINC000737292181 599021068 /nfs/dbraw/zinc/02/10/68/599021068.db2.gz SYJCTAXNMHUXJX-INIZCTEOSA-N -1 3 356.474 3.998 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CCCCC[C@H]1CC(C)C ZINC000737292181 599021069 /nfs/dbraw/zinc/02/10/69/599021069.db2.gz SYJCTAXNMHUXJX-INIZCTEOSA-N -1 3 356.474 3.998 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccnc2ccccc12)c1cccc(-c2nnn[n-]2)c1 ZINC000736153120 599026951 /nfs/dbraw/zinc/02/69/51/599026951.db2.gz QADNEZCHLLSCHA-CFYYFVFUSA-N -1 3 371.400 3.733 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccnc2ccccc12)c1cccc(-c2nn[n-]n2)c1 ZINC000736153120 599026953 /nfs/dbraw/zinc/02/69/53/599026953.db2.gz QADNEZCHLLSCHA-CFYYFVFUSA-N -1 3 371.400 3.733 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(NCC2(c3ccccc3)CCC2)n1 ZINC000737631559 599041773 /nfs/dbraw/zinc/04/17/73/599041773.db2.gz GMXUTFLQNCEXPV-UHFFFAOYSA-N -1 3 374.370 3.814 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(NCC2(c3ccccc3)CCC2)n1 ZINC000737631559 599041777 /nfs/dbraw/zinc/04/17/77/599041777.db2.gz GMXUTFLQNCEXPV-UHFFFAOYSA-N -1 3 374.370 3.814 20 0 FHADHM Cc1ccccc1C[C@@H](C)Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000737425911 599047059 /nfs/dbraw/zinc/04/70/59/599047059.db2.gz GWMVIMMSCUEWIB-LLVKDONJSA-N -1 3 362.359 3.632 20 0 FHADHM Cc1ccccc1C[C@@H](C)Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000737425911 599047062 /nfs/dbraw/zinc/04/70/62/599047062.db2.gz GWMVIMMSCUEWIB-LLVKDONJSA-N -1 3 362.359 3.632 20 0 FHADHM CC(C)(C)C[C@@H]1CCCN1c1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000735604038 599048061 /nfs/dbraw/zinc/04/80/61/599048061.db2.gz QZBZKSOGOGHVGK-JTQLQIEISA-N -1 3 354.380 3.686 20 0 FHADHM CC(C)(C)C[C@@H]1CCCN1c1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000735604038 599048063 /nfs/dbraw/zinc/04/80/63/599048063.db2.gz QZBZKSOGOGHVGK-JTQLQIEISA-N -1 3 354.380 3.686 20 0 FHADHM Cc1ccccc1CN(c1nc(C(F)(F)F)ccc1-c1nnn[n-]1)C1CC1 ZINC000737428741 599049493 /nfs/dbraw/zinc/04/94/93/599049493.db2.gz VDHVHPPVVJPYGO-UHFFFAOYSA-N -1 3 374.370 3.758 20 0 FHADHM Cc1ccccc1CN(c1nc(C(F)(F)F)ccc1-c1nn[n-]n1)C1CC1 ZINC000737428741 599049495 /nfs/dbraw/zinc/04/94/95/599049495.db2.gz VDHVHPPVVJPYGO-UHFFFAOYSA-N -1 3 374.370 3.758 20 0 FHADHM C[C@H]1Cc2ccccc2[C@@H]1Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000736296466 599056308 /nfs/dbraw/zinc/05/63/08/599056308.db2.gz HKXLJSHEBBHODD-LKFCYVNXSA-N -1 3 360.343 3.626 20 0 FHADHM C[C@H]1Cc2ccccc2[C@@H]1Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000736296466 599056312 /nfs/dbraw/zinc/05/63/12/599056312.db2.gz HKXLJSHEBBHODD-LKFCYVNXSA-N -1 3 360.343 3.626 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N2CCCC3(CCCCC3)C2)n1 ZINC000737630997 599057189 /nfs/dbraw/zinc/05/71/89/599057189.db2.gz ASWNPUWZNHSQEZ-UHFFFAOYSA-N -1 3 366.391 3.831 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N2CCCC3(CCCCC3)C2)n1 ZINC000737630997 599057192 /nfs/dbraw/zinc/05/71/92/599057192.db2.gz ASWNPUWZNHSQEZ-UHFFFAOYSA-N -1 3 366.391 3.831 20 0 FHADHM Fc1cccc(N2CCC(OCC3CCCCC3)CC2)c1-c1nnn[n-]1 ZINC000822791253 599057800 /nfs/dbraw/zinc/05/78/00/599057800.db2.gz GKBAENSSUDFKSZ-UHFFFAOYSA-N -1 3 359.449 3.572 20 0 FHADHM Fc1cccc(N2CCC(OCC3CCCCC3)CC2)c1-c1nn[n-]n1 ZINC000822791253 599057803 /nfs/dbraw/zinc/05/78/03/599057803.db2.gz GKBAENSSUDFKSZ-UHFFFAOYSA-N -1 3 359.449 3.572 20 0 FHADHM FC(F)(F)c1ccc(N2CC[C@@H](Nc3ccc(-c4nn[n-]n4)cc3)C2)cc1 ZINC000737637127 599061111 /nfs/dbraw/zinc/06/11/11/599061111.db2.gz ZYSKHAVOJWELNK-OAHLLOKOSA-N -1 3 374.370 3.576 20 0 FHADHM Cc1cccc2c(CC(=O)O[C@H](C)c3cccc(-c4nnn[n-]4)c3)c[nH]c21 ZINC000737407165 599061672 /nfs/dbraw/zinc/06/16/72/599061672.db2.gz AGCVHFDQZLEAQZ-CYBMUJFWSA-N -1 3 361.405 3.503 20 0 FHADHM Cc1cccc2c(CC(=O)O[C@H](C)c3cccc(-c4nn[n-]n4)c3)c[nH]c21 ZINC000737407165 599061675 /nfs/dbraw/zinc/06/16/75/599061675.db2.gz AGCVHFDQZLEAQZ-CYBMUJFWSA-N -1 3 361.405 3.503 20 0 FHADHM Cc1ccc(NC(=O)[C@@H](C)Sc2ccc(-c3nnn[n-]3)cc2F)c(C)c1 ZINC000737355400 599064491 /nfs/dbraw/zinc/06/44/91/599064491.db2.gz GDWIRVRFXUVURG-GFCCVEGCSA-N -1 3 371.441 3.742 20 0 FHADHM Cc1ccc(NC(=O)[C@@H](C)Sc2ccc(-c3nn[n-]n3)cc2F)c(C)c1 ZINC000737355400 599064494 /nfs/dbraw/zinc/06/44/94/599064494.db2.gz GDWIRVRFXUVURG-GFCCVEGCSA-N -1 3 371.441 3.742 20 0 FHADHM Cc1ccc(O[C@H](C)CNc2cc(-c3nnn[n-]3)c3ccccc3n2)cc1 ZINC000822259352 599068358 /nfs/dbraw/zinc/06/83/58/599068358.db2.gz VPOSYRPASYBDJN-CQSZACIVSA-N -1 3 360.421 3.603 20 0 FHADHM Cc1ccc(O[C@H](C)CNc2cc(-c3nn[n-]n3)c3ccccc3n2)cc1 ZINC000822259352 599068361 /nfs/dbraw/zinc/06/83/61/599068361.db2.gz VPOSYRPASYBDJN-CQSZACIVSA-N -1 3 360.421 3.603 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@H]1CCC[C@@H](C)C1 ZINC000735829622 599069490 /nfs/dbraw/zinc/06/94/90/599069490.db2.gz MLFPSFRQRBRAQX-QAPCUYQASA-N -1 3 355.486 3.678 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@H]1CCC[C@@H](C)C1 ZINC000735829622 599069493 /nfs/dbraw/zinc/06/94/93/599069493.db2.gz MLFPSFRQRBRAQX-QAPCUYQASA-N -1 3 355.486 3.678 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@H]1C[C@H]1C1CCCCC1 ZINC000735903957 599070950 /nfs/dbraw/zinc/07/09/50/599070950.db2.gz JKFUQIHSVNFWPF-HOTGVXAUSA-N -1 3 369.469 3.809 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@H]1C[C@H]1C1CCCCC1 ZINC000735903957 599070953 /nfs/dbraw/zinc/07/09/53/599070953.db2.gz JKFUQIHSVNFWPF-HOTGVXAUSA-N -1 3 369.469 3.809 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)Nc1ccc(CC(F)(F)F)cc1 ZINC000737801153 599083110 /nfs/dbraw/zinc/08/31/10/599083110.db2.gz MAKHVBPWCYDGKR-YFHOEESVSA-N -1 3 373.338 3.623 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)Nc1ccc(CC(F)(F)F)cc1 ZINC000737801153 599083113 /nfs/dbraw/zinc/08/31/13/599083113.db2.gz MAKHVBPWCYDGKR-YFHOEESVSA-N -1 3 373.338 3.623 20 0 FHADHM C[C@@H](CNc1ccc(-c2nn[n-]n2)cc1)Oc1cccc(Br)c1 ZINC000820274262 599086761 /nfs/dbraw/zinc/08/67/61/599086761.db2.gz FYKGHGGGVQXNJM-NSHDSACASA-N -1 3 374.242 3.509 20 0 FHADHM Cc1cc(NC(=O)C=Cc2ccccc2-c2nnn[n-]2)ccc1OC(C)C ZINC000737270332 599090889 /nfs/dbraw/zinc/09/08/89/599090889.db2.gz GBQWEUOCMROQRT-DHZHZOJOSA-N -1 3 363.421 3.614 20 0 FHADHM Cc1cc(NC(=O)C=Cc2ccccc2-c2nn[n-]n2)ccc1OC(C)C ZINC000737270332 599090891 /nfs/dbraw/zinc/09/08/91/599090891.db2.gz GBQWEUOCMROQRT-DHZHZOJOSA-N -1 3 363.421 3.614 20 0 FHADHM CC(C)CC[C@H](NC(=O)NCc1cccc(-c2nnn[n-]2)c1)C(C)(C)C ZINC000735797426 599103241 /nfs/dbraw/zinc/10/32/41/599103241.db2.gz PEOVEFAUSIMVDR-INIZCTEOSA-N -1 3 358.490 3.517 20 0 FHADHM CC(C)CC[C@H](NC(=O)NCc1cccc(-c2nn[n-]n2)c1)C(C)(C)C ZINC000735797426 599103244 /nfs/dbraw/zinc/10/32/44/599103244.db2.gz PEOVEFAUSIMVDR-INIZCTEOSA-N -1 3 358.490 3.517 20 0 FHADHM Cc1ccc(-c2cc(C(F)(F)F)c(-c3nnn[n-]3)c(SCCF)n2)o1 ZINC000822214245 599128086 /nfs/dbraw/zinc/12/80/86/599128086.db2.gz WFWRLVAKRRJVLO-UHFFFAOYSA-N -1 3 373.335 3.911 20 0 FHADHM CC(C)[C@@H](C)SCCC(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820020935 599129727 /nfs/dbraw/zinc/12/97/27/599129727.db2.gz MSWPILONWVKERM-SNVBAGLBSA-N -1 3 353.879 3.626 20 0 FHADHM CC(C)[C@@H](C)SCCC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820020935 599129730 /nfs/dbraw/zinc/12/97/30/599129730.db2.gz MSWPILONWVKERM-SNVBAGLBSA-N -1 3 353.879 3.626 20 0 FHADHM Clc1ccccc1SCc1nnc(-c2ccc(-c3nnn[n-]3)cc2)o1 ZINC000737584572 599159978 /nfs/dbraw/zinc/15/99/78/599159978.db2.gz STPAFGXGLXVMMS-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1ccccc1SCc1nnc(-c2ccc(-c3nn[n-]n3)cc2)o1 ZINC000737584572 599159981 /nfs/dbraw/zinc/15/99/81/599159981.db2.gz STPAFGXGLXVMMS-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Cc1ccc([C@H]2CCC[C@H]2N(C)C(=O)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000822232973 599161737 /nfs/dbraw/zinc/16/17/37/599161737.db2.gz FPPUSWJBCZKRGB-RTBURBONSA-N -1 3 361.449 3.583 20 0 FHADHM Cc1ccc([C@H]2CCC[C@H]2N(C)C(=O)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000822232973 599161739 /nfs/dbraw/zinc/16/17/39/599161739.db2.gz FPPUSWJBCZKRGB-RTBURBONSA-N -1 3 361.449 3.583 20 0 FHADHM Cc1ccc([C@H]2CCC[C@@H]2N(C)C(=O)c2sccc2-c2nnn[n-]2)cc1 ZINC000822232851 599161749 /nfs/dbraw/zinc/16/17/49/599161749.db2.gz CGDRWHLMKCVTED-ZBFHGGJFSA-N -1 3 367.478 3.645 20 0 FHADHM Cc1ccc([C@H]2CCC[C@@H]2N(C)C(=O)c2sccc2-c2nn[n-]n2)cc1 ZINC000822232851 599161750 /nfs/dbraw/zinc/16/17/50/599161750.db2.gz CGDRWHLMKCVTED-ZBFHGGJFSA-N -1 3 367.478 3.645 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)C[C@H](C)c2cccc(F)c2)s1 ZINC000736678268 599160434 /nfs/dbraw/zinc/16/04/34/599160434.db2.gz BCAMJGNEQRBBGP-JTQLQIEISA-N -1 3 359.430 3.762 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)C[C@H](C)c2cccc(F)c2)s1 ZINC000736678268 599160436 /nfs/dbraw/zinc/16/04/36/599160436.db2.gz BCAMJGNEQRBBGP-JTQLQIEISA-N -1 3 359.430 3.762 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1SCc1ccccc1OC(F)F ZINC000737644810 599170492 /nfs/dbraw/zinc/17/04/92/599170492.db2.gz MTIVVPRZQOCZRJ-UHFFFAOYSA-N -1 3 352.341 3.900 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1SCc1ccccc1OC(F)F ZINC000737644810 599170493 /nfs/dbraw/zinc/17/04/93/599170493.db2.gz MTIVVPRZQOCZRJ-UHFFFAOYSA-N -1 3 352.341 3.900 20 0 FHADHM C[C@@H](C(=O)Oc1ccc(-c2nnn[n-]2)cc1)c1ccccc1C(F)(F)F ZINC000735572060 599174825 /nfs/dbraw/zinc/17/48/25/599174825.db2.gz PTJUKFRKQRHQBT-SNVBAGLBSA-N -1 3 362.311 3.595 20 0 FHADHM C[C@@H](C(=O)Oc1ccc(-c2nn[n-]n2)cc1)c1ccccc1C(F)(F)F ZINC000735572060 599174827 /nfs/dbraw/zinc/17/48/27/599174827.db2.gz PTJUKFRKQRHQBT-SNVBAGLBSA-N -1 3 362.311 3.595 20 0 FHADHM Cc1ccc([C@H]2CSCCN2Cc2cc(-c3nn[n-]n3)ccc2F)cc1 ZINC000737333749 599176404 /nfs/dbraw/zinc/17/64/04/599176404.db2.gz VQWGERSQTPSFLC-GOSISDBHSA-N -1 3 369.469 3.604 20 0 FHADHM Clc1ccc([C@@H]2CSCCN2Cc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000737570373 599176931 /nfs/dbraw/zinc/17/69/31/599176931.db2.gz GGQSHTYLCMXRSX-KRWDZBQOSA-N -1 3 371.897 3.810 20 0 FHADHM Clc1ccc([C@@H]2CSCCN2Cc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000737571243 599177256 /nfs/dbraw/zinc/17/72/56/599177256.db2.gz XWEXKHWXLZDQGP-KRWDZBQOSA-N -1 3 371.897 3.810 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1 ZINC000460694666 599177686 /nfs/dbraw/zinc/17/76/86/599177686.db2.gz PPAQZTGXTHVQSY-HUUCEWRRSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1 ZINC000460694666 599177688 /nfs/dbraw/zinc/17/76/88/599177688.db2.gz PPAQZTGXTHVQSY-HUUCEWRRSA-N -1 3 374.231 3.916 20 0 FHADHM Clc1ccc([C@H]2CSCCN2Cc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000737571244 599177824 /nfs/dbraw/zinc/17/78/24/599177824.db2.gz XWEXKHWXLZDQGP-QGZVFWFLSA-N -1 3 371.897 3.810 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)[C@H]1CCSc2ccccc21 ZINC000738146386 599181000 /nfs/dbraw/zinc/18/10/00/599181000.db2.gz XIGFELNJKZDPBB-LBPRGKRZSA-N -1 3 371.853 3.738 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)[C@H]1CCSc2ccccc21 ZINC000738146386 599181001 /nfs/dbraw/zinc/18/10/01/599181001.db2.gz XIGFELNJKZDPBB-LBPRGKRZSA-N -1 3 371.853 3.738 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@@H](C)c1cccc(F)c1 ZINC000736479975 599182099 /nfs/dbraw/zinc/18/20/99/599182099.db2.gz OIJZAROBZPNYHU-AWEZNQCLSA-N -1 3 367.428 3.548 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@@H](C)c1cccc(F)c1 ZINC000736479975 599182101 /nfs/dbraw/zinc/18/21/01/599182101.db2.gz OIJZAROBZPNYHU-AWEZNQCLSA-N -1 3 367.428 3.548 20 0 FHADHM C[C@@H](NC(=O)[C@@H](C)c1cccc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736094913 599182356 /nfs/dbraw/zinc/18/23/56/599182356.db2.gz AXMLJFHJMKGNAU-NWDGAFQWSA-N -1 3 355.829 3.501 20 0 FHADHM C[C@@H](NC(=O)[C@@H](C)c1cccc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736094913 599182358 /nfs/dbraw/zinc/18/23/58/599182358.db2.gz AXMLJFHJMKGNAU-NWDGAFQWSA-N -1 3 355.829 3.501 20 0 FHADHM CCN(C(=O)[C@@H](C)c1cccc(F)c1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736503355 599183096 /nfs/dbraw/zinc/18/30/96/599183096.db2.gz VPOSXCUOUZCBGA-UONOGXRCSA-N -1 3 367.428 3.719 20 0 FHADHM CCN(C(=O)[C@@H](C)c1cccc(F)c1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736503355 599183098 /nfs/dbraw/zinc/18/30/98/599183098.db2.gz VPOSXCUOUZCBGA-UONOGXRCSA-N -1 3 367.428 3.719 20 0 FHADHM CCCN(C)C(=O)c1cccc(Oc2ccc(Cl)cc2-c2nnn[n-]2)c1 ZINC000736472883 599194958 /nfs/dbraw/zinc/19/49/58/599194958.db2.gz VNFOVFWLAXLNMN-UHFFFAOYSA-N -1 3 371.828 3.794 20 0 FHADHM CCCN(C)C(=O)c1cccc(Oc2ccc(Cl)cc2-c2nn[n-]n2)c1 ZINC000736472883 599194959 /nfs/dbraw/zinc/19/49/59/599194959.db2.gz VNFOVFWLAXLNMN-UHFFFAOYSA-N -1 3 371.828 3.794 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)N1CCCC2(C1)CCCCCC2 ZINC000822928277 599202466 /nfs/dbraw/zinc/20/24/66/599202466.db2.gz GDJTWIVSHFWHQL-ZHACJKMWSA-N -1 3 365.481 3.843 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)N1CCCC2(C1)CCCCCC2 ZINC000822928277 599202468 /nfs/dbraw/zinc/20/24/68/599202468.db2.gz GDJTWIVSHFWHQL-ZHACJKMWSA-N -1 3 365.481 3.843 20 0 FHADHM C[C@H]1C[C@@H]1C(=O)N(Cc1ccc(Cl)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000736235295 599209424 /nfs/dbraw/zinc/20/94/24/599209424.db2.gz MYONNGJIGPHPLV-SJCJKPOMSA-N -1 3 367.840 3.709 20 0 FHADHM C[C@H]1C[C@@H]1C(=O)N(Cc1ccc(Cl)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000736235295 599209425 /nfs/dbraw/zinc/20/94/25/599209425.db2.gz MYONNGJIGPHPLV-SJCJKPOMSA-N -1 3 367.840 3.709 20 0 FHADHM CN(Cc1ccc(OC(F)F)cc1)c1cccc(Cl)c1-c1nnn[n-]1 ZINC000821610777 599215895 /nfs/dbraw/zinc/21/58/95/599215895.db2.gz FAEBCUPFATWKHE-UHFFFAOYSA-N -1 3 365.771 3.758 20 0 FHADHM CN(Cc1ccc(OC(F)F)cc1)c1cccc(Cl)c1-c1nn[n-]n1 ZINC000821610777 599215897 /nfs/dbraw/zinc/21/58/97/599215897.db2.gz FAEBCUPFATWKHE-UHFFFAOYSA-N -1 3 365.771 3.758 20 0 FHADHM CC(C)CC(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1 ZINC000820050823 599220054 /nfs/dbraw/zinc/22/00/54/599220054.db2.gz GWVXSWGTKUSCSU-UHFFFAOYSA-N -1 3 355.373 3.783 20 0 FHADHM CC(C)CC(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1 ZINC000820050823 599220057 /nfs/dbraw/zinc/22/00/57/599220057.db2.gz GWVXSWGTKUSCSU-UHFFFAOYSA-N -1 3 355.373 3.783 20 0 FHADHM CC[C@H](C)C(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1 ZINC000820859031 599220190 /nfs/dbraw/zinc/22/01/90/599220190.db2.gz APAMWQAJHPITQI-NSHDSACASA-N -1 3 355.373 3.783 20 0 FHADHM CC[C@H](C)C(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1 ZINC000820859031 599220193 /nfs/dbraw/zinc/22/01/93/599220193.db2.gz APAMWQAJHPITQI-NSHDSACASA-N -1 3 355.373 3.783 20 0 FHADHM CCC[C@@]1(C)CCCN(C(=O)CSCc2ccc(-c3nnn[n-]3)cc2)C1 ZINC000821028758 599221105 /nfs/dbraw/zinc/22/11/05/599221105.db2.gz ZDVSYLIVYBVJET-IBGZPJMESA-N -1 3 373.526 3.529 20 0 FHADHM CCC[C@@]1(C)CCCN(C(=O)CSCc2ccc(-c3nn[n-]n3)cc2)C1 ZINC000821028758 599221107 /nfs/dbraw/zinc/22/11/07/599221107.db2.gz ZDVSYLIVYBVJET-IBGZPJMESA-N -1 3 373.526 3.529 20 0 FHADHM C[C@@H](SCCc1ccc2c(c1)CCO2)c1ccc(-c2nnn[n-]2)cc1 ZINC000820549228 599222706 /nfs/dbraw/zinc/22/27/06/599222706.db2.gz LDQZMGZXIIFUOM-CYBMUJFWSA-N -1 3 352.463 3.839 20 0 FHADHM C[C@@H](SCCc1ccc2c(c1)CCO2)c1ccc(-c2nn[n-]n2)cc1 ZINC000820549228 599222709 /nfs/dbraw/zinc/22/27/09/599222709.db2.gz LDQZMGZXIIFUOM-CYBMUJFWSA-N -1 3 352.463 3.839 20 0 FHADHM Fc1ccc(-n2ccc(CSCc3ccccc3-c3nnn[n-]3)n2)cc1 ZINC000822761835 599224027 /nfs/dbraw/zinc/22/40/27/599224027.db2.gz TYZPRECPBHINKG-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM Fc1ccc(-n2ccc(CSCc3ccccc3-c3nn[n-]n3)n2)cc1 ZINC000822761835 599224030 /nfs/dbraw/zinc/22/40/30/599224030.db2.gz TYZPRECPBHINKG-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM Cc1ccccc1NC(=O)CCS[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000822362438 599227100 /nfs/dbraw/zinc/22/71/00/599227100.db2.gz SYFCNFRQKFDXMR-AWEZNQCLSA-N -1 3 367.478 3.998 20 0 FHADHM Cc1ccccc1NC(=O)CCS[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000822362438 599227102 /nfs/dbraw/zinc/22/71/02/599227102.db2.gz SYFCNFRQKFDXMR-AWEZNQCLSA-N -1 3 367.478 3.998 20 0 FHADHM C[C@@H](NC(=O)Nc1cccc2ccccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000820380198 599234919 /nfs/dbraw/zinc/23/49/19/599234919.db2.gz NELNGWFBMHWUEC-CYBMUJFWSA-N -1 3 358.405 3.903 20 0 FHADHM C[C@@H](NC(=O)Nc1cccc2ccccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000820380198 599234921 /nfs/dbraw/zinc/23/49/21/599234921.db2.gz NELNGWFBMHWUEC-CYBMUJFWSA-N -1 3 358.405 3.903 20 0 FHADHM Cc1c(NC(=O)[C@@H](C)CCc2ccccc2F)cccc1-c1nnn[n-]1 ZINC000822060439 607266925 /nfs/dbraw/zinc/26/69/25/607266925.db2.gz HJGKSBISSCHAEA-LBPRGKRZSA-N -1 3 353.401 3.522 20 0 FHADHM Cc1c(NC(=O)[C@@H](C)CCc2ccccc2F)cccc1-c1nn[n-]n1 ZINC000822060439 607266926 /nfs/dbraw/zinc/26/69/26/607266926.db2.gz HJGKSBISSCHAEA-LBPRGKRZSA-N -1 3 353.401 3.522 20 0 FHADHM Cc1ccc(NC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c(Cl)c1 ZINC000822248720 599239697 /nfs/dbraw/zinc/23/96/97/599239697.db2.gz KORAKHQFDQYENM-LLVKDONJSA-N -1 3 356.817 3.711 20 0 FHADHM Cc1ccc(NC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c(Cl)c1 ZINC000822248720 599239700 /nfs/dbraw/zinc/23/97/00/599239700.db2.gz KORAKHQFDQYENM-LLVKDONJSA-N -1 3 356.817 3.711 20 0 FHADHM CC[C@H]1CCCN(C(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(C)C)CC1 ZINC000736402026 599240830 /nfs/dbraw/zinc/24/08/30/599240830.db2.gz LDBQKHGLZBMSGD-AWEZNQCLSA-N -1 3 372.473 3.698 20 0 FHADHM CC[C@H]1CCCN(C(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(C)C)CC1 ZINC000736402026 599240831 /nfs/dbraw/zinc/24/08/31/599240831.db2.gz LDBQKHGLZBMSGD-AWEZNQCLSA-N -1 3 372.473 3.698 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc(F)cc1Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000820380522 599242696 /nfs/dbraw/zinc/24/26/96/599242696.db2.gz VSVLRNPELRTKHS-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc(F)cc1Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000820380522 599242699 /nfs/dbraw/zinc/24/26/99/599242699.db2.gz VSVLRNPELRTKHS-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM CCC[C@@H]1[C@@H](C)CCCN1C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000821034359 599249530 /nfs/dbraw/zinc/24/95/30/599249530.db2.gz KUMUUCZGPHUTLQ-XHDPSFHLSA-N -1 3 362.865 3.953 20 0 FHADHM CCC[C@@H]1[C@@H](C)CCCN1C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000821034359 599249533 /nfs/dbraw/zinc/24/95/33/599249533.db2.gz KUMUUCZGPHUTLQ-XHDPSFHLSA-N -1 3 362.865 3.953 20 0 FHADHM CCSCC[C@@H](C)N(C)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000821457393 599250096 /nfs/dbraw/zinc/25/00/96/599250096.db2.gz WBWXBFNQPWSUOE-SNVBAGLBSA-N -1 3 368.894 3.516 20 0 FHADHM CCSCC[C@@H](C)N(C)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000821457393 599250099 /nfs/dbraw/zinc/25/00/99/599250099.db2.gz WBWXBFNQPWSUOE-SNVBAGLBSA-N -1 3 368.894 3.516 20 0 FHADHM Cc1ccc(CC[C@@H](C)NC(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)o1 ZINC000822235191 599250332 /nfs/dbraw/zinc/25/03/32/599250332.db2.gz WZZPIFUZGBCPMC-SNVBAGLBSA-N -1 3 374.832 3.564 20 0 FHADHM Cc1ccc(CC[C@@H](C)NC(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)o1 ZINC000822235191 599250333 /nfs/dbraw/zinc/25/03/33/599250333.db2.gz WZZPIFUZGBCPMC-SNVBAGLBSA-N -1 3 374.832 3.564 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)Nc2cccc(-c3nnn[n-]3)c2C)cc1F ZINC000822228994 607284363 /nfs/dbraw/zinc/28/43/63/607284363.db2.gz KGFLVQRSRYVZJJ-LBPRGKRZSA-N -1 3 354.389 3.505 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)Nc2cccc(-c3nn[n-]n3)c2C)cc1F ZINC000822228994 607284364 /nfs/dbraw/zinc/28/43/64/607284364.db2.gz KGFLVQRSRYVZJJ-LBPRGKRZSA-N -1 3 354.389 3.505 20 0 FHADHM Cc1ccc([C@@H]2CCCN2C(=O)Nc2cccc(-c3nnn[n-]3)c2C)cc1 ZINC000822233888 607291248 /nfs/dbraw/zinc/29/12/48/607291248.db2.gz XKNKXYLQDJFDBA-SFHVURJKSA-N -1 3 362.437 3.853 20 0 FHADHM Cc1ccc([C@@H]2CCCN2C(=O)Nc2cccc(-c3nn[n-]n3)c2C)cc1 ZINC000822233888 607291249 /nfs/dbraw/zinc/29/12/49/607291249.db2.gz XKNKXYLQDJFDBA-SFHVURJKSA-N -1 3 362.437 3.853 20 0 FHADHM Cc1c(NC(=O)C(C)(C)c2ccc(Cl)cc2)cccc1-c1nnn[n-]1 ZINC000822059516 607295728 /nfs/dbraw/zinc/29/57/28/607295728.db2.gz BTICOENUSBCOIS-UHFFFAOYSA-N -1 3 355.829 3.745 20 0 FHADHM Cc1c(NC(=O)C(C)(C)c2ccc(Cl)cc2)cccc1-c1nn[n-]n1 ZINC000822059516 607295729 /nfs/dbraw/zinc/29/57/29/607295729.db2.gz BTICOENUSBCOIS-UHFFFAOYSA-N -1 3 355.829 3.745 20 0 FHADHM CCC[C@@]1(C)CCCN(C(=O)N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)C1 ZINC000821027693 599260401 /nfs/dbraw/zinc/26/04/01/599260401.db2.gz QQJVAMSRUSRBTR-KUHUBIRLSA-N -1 3 356.474 3.540 20 0 FHADHM CCC[C@@]1(C)CCCN(C(=O)N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)C1 ZINC000821027693 599260402 /nfs/dbraw/zinc/26/04/02/599260402.db2.gz QQJVAMSRUSRBTR-KUHUBIRLSA-N -1 3 356.474 3.540 20 0 FHADHM Cc1cc(F)cc2c1ncc(-c1nnn[n-]1)c2N(C)Cc1ccsc1 ZINC000737263835 599260768 /nfs/dbraw/zinc/26/07/68/599260768.db2.gz PNCNHJCUOQEKHO-UHFFFAOYSA-N -1 3 354.414 3.560 20 0 FHADHM Cc1cc(F)cc2c1ncc(-c1nn[n-]n1)c2N(C)Cc1ccsc1 ZINC000737263835 599260770 /nfs/dbraw/zinc/26/07/70/599260770.db2.gz PNCNHJCUOQEKHO-UHFFFAOYSA-N -1 3 354.414 3.560 20 0 FHADHM Cc1ccc(Br)cc1NCc1cc(-c2nnn[n-]2)cs1 ZINC000822224794 607308316 /nfs/dbraw/zinc/30/83/16/607308316.db2.gz AFJCFIPOXYCGKS-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM Cc1ccc(Br)cc1NCc1cc(-c2nn[n-]n2)cs1 ZINC000822224794 607308317 /nfs/dbraw/zinc/30/83/17/607308317.db2.gz AFJCFIPOXYCGKS-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM Cc1cc(C)c2ncc(-c3nnn[n-]3)c(N3CCc4sccc4C3)c2c1 ZINC000737249401 599264597 /nfs/dbraw/zinc/26/45/97/599264597.db2.gz XYJAUVFIOQOQSR-UHFFFAOYSA-N -1 3 362.462 3.656 20 0 FHADHM Cc1cc(C)c2ncc(-c3nn[n-]n3)c(N3CCc4sccc4C3)c2c1 ZINC000737249401 599264598 /nfs/dbraw/zinc/26/45/98/599264598.db2.gz XYJAUVFIOQOQSR-UHFFFAOYSA-N -1 3 362.462 3.656 20 0 FHADHM CCCOc1cc(C)ccc1NCc1ccc(OC)c(-c2nnn[n-]2)c1 ZINC000821127424 607311980 /nfs/dbraw/zinc/31/19/80/607311980.db2.gz HLIYLSFWAVXOQF-UHFFFAOYSA-N -1 3 353.426 3.585 20 0 FHADHM CCCOc1cc(C)ccc1NCc1ccc(OC)c(-c2nn[n-]n2)c1 ZINC000821127424 607311981 /nfs/dbraw/zinc/31/19/81/607311981.db2.gz HLIYLSFWAVXOQF-UHFFFAOYSA-N -1 3 353.426 3.585 20 0 FHADHM COc1c(Cl)cc(NCc2ccc(-c3nnn[n-]3)s2)cc1Cl ZINC000821698767 607316030 /nfs/dbraw/zinc/31/60/30/607316030.db2.gz XROBOFXNTPHKPM-UHFFFAOYSA-N -1 3 356.238 3.856 20 0 FHADHM c1ccc(CCc2ccnc(NCc3cccc(-c4nn[n-]n4)c3)c2)cc1 ZINC000823779565 607304309 /nfs/dbraw/zinc/30/43/09/607304309.db2.gz GMDXMTGWNFIULR-UHFFFAOYSA-N -1 3 356.433 3.659 20 0 FHADHM c1ccc2c(c1)nc(-c1nnn[n-]1)cc2Nc1ccc(N2CCCCC2)nc1 ZINC000738436951 599266168 /nfs/dbraw/zinc/26/61/68/599266168.db2.gz LMQAIEPJWNCNNY-UHFFFAOYSA-N -1 3 372.436 3.544 20 0 FHADHM C[C@@H](NC(=O)Nc1cccc(C(F)F)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820380211 599273640 /nfs/dbraw/zinc/27/36/40/599273640.db2.gz NKLMCQHRUQOWDL-SNVBAGLBSA-N -1 3 358.352 3.687 20 0 FHADHM C[C@@H](NC(=O)Nc1cccc(C(F)F)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820380211 599273642 /nfs/dbraw/zinc/27/36/42/599273642.db2.gz NKLMCQHRUQOWDL-SNVBAGLBSA-N -1 3 358.352 3.687 20 0 FHADHM COc1ccc(CNc2cc(C)c(C)c3ncccc23)cc1-c1nnn[n-]1 ZINC000821821469 607318342 /nfs/dbraw/zinc/31/83/42/607318342.db2.gz HDYXSONEPUFLJS-UHFFFAOYSA-N -1 3 360.421 3.652 20 0 FHADHM COc1ccc(CNc2cc(C)c(C)c3ncccc23)cc1-c1nn[n-]n1 ZINC000821821469 607318343 /nfs/dbraw/zinc/31/83/43/607318343.db2.gz HDYXSONEPUFLJS-UHFFFAOYSA-N -1 3 360.421 3.652 20 0 FHADHM C[C@@H]1CCC[C@H](NC(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)C1 ZINC000820697919 599288363 /nfs/dbraw/zinc/28/83/63/599288363.db2.gz NXVSKBAMNHZYOB-ZJUUUORDSA-N -1 3 368.363 3.586 20 0 FHADHM C[C@@H]1CCC[C@H](NC(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)C1 ZINC000820697919 599288365 /nfs/dbraw/zinc/28/83/65/599288365.db2.gz NXVSKBAMNHZYOB-ZJUUUORDSA-N -1 3 368.363 3.586 20 0 FHADHM Cc1c(NC(=O)c2nc(-c3ccccc3)cs2)cccc1-c1nnn[n-]1 ZINC000822115539 607321566 /nfs/dbraw/zinc/32/15/66/607321566.db2.gz FQUZAVXBFZZCEJ-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1c(NC(=O)c2nc(-c3ccccc3)cs2)cccc1-c1nn[n-]n1 ZINC000822115539 607321567 /nfs/dbraw/zinc/32/15/67/607321567.db2.gz FQUZAVXBFZZCEJ-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM CC1(CNC(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)CCCC1 ZINC000820619170 599291166 /nfs/dbraw/zinc/29/11/66/599291166.db2.gz YLMIKXIHXPXUGT-UHFFFAOYSA-N -1 3 368.363 3.587 20 0 FHADHM CC1(CNC(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)CCCC1 ZINC000820619170 599291168 /nfs/dbraw/zinc/29/11/68/599291168.db2.gz YLMIKXIHXPXUGT-UHFFFAOYSA-N -1 3 368.363 3.587 20 0 FHADHM Cc1cc(C(F)(F)F)c(-c2nnn[n-]2)c(SCc2cnccc2C)n1 ZINC000822191142 607326785 /nfs/dbraw/zinc/32/67/85/607326785.db2.gz GHOQDTQWPAJDMA-UHFFFAOYSA-N -1 3 366.372 3.585 20 0 FHADHM Cc1ccccc1NC(=O)CSc1ccc(-c2nnn[n-]2)cc1Cl ZINC000826307767 607844864 /nfs/dbraw/zinc/84/48/64/607844864.db2.gz WFARGROIFDOTNI-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1ccccc1NC(=O)CSc1ccc(-c2nn[n-]n2)cc1Cl ZINC000826307767 607844865 /nfs/dbraw/zinc/84/48/65/607844865.db2.gz WFARGROIFDOTNI-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM O=C(Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)c1ccccc1 ZINC000738182320 598231159 /nfs/dbraw/zinc/23/11/59/598231159.db2.gz CXSVEDZWFWGDHM-UHFFFAOYSA-N -1 3 357.373 3.911 20 0 FHADHM O=C(Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)c1ccccc1 ZINC000738182320 598231160 /nfs/dbraw/zinc/23/11/60/598231160.db2.gz CXSVEDZWFWGDHM-UHFFFAOYSA-N -1 3 357.373 3.911 20 0 FHADHM CCOc1ccc([C@@H]2CCCN2c2cccc(F)c2-c2nnn[n-]2)cc1 ZINC000736637853 598235595 /nfs/dbraw/zinc/23/55/95/598235595.db2.gz RRARFZZYQLGQFO-INIZCTEOSA-N -1 3 353.401 3.746 20 0 FHADHM CCOc1ccc([C@@H]2CCCN2c2cccc(F)c2-c2nn[n-]n2)cc1 ZINC000736637853 598235596 /nfs/dbraw/zinc/23/55/96/598235596.db2.gz RRARFZZYQLGQFO-INIZCTEOSA-N -1 3 353.401 3.746 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1NCCOc1ccc(C(F)(F)F)cc1 ZINC000737639468 598239587 /nfs/dbraw/zinc/23/95/87/598239587.db2.gz CFDDKJSQFQVAQC-UHFFFAOYSA-N -1 3 367.306 3.516 20 0 FHADHM CN(Cc1cccc(C(F)(F)F)c1)c1ccc(-c2nn[n-]n2)cc1F ZINC000736823316 598239641 /nfs/dbraw/zinc/23/96/41/598239641.db2.gz WGHCGAINTUDZNX-UHFFFAOYSA-N -1 3 351.307 3.661 20 0 FHADHM CC[C@@H](C)[C@@H](C)N(C(=O)CSCc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000736334578 598240913 /nfs/dbraw/zinc/24/09/13/598240913.db2.gz XFJRPHUCCVEPDU-ZIAGYGMSSA-N -1 3 373.526 3.526 20 0 FHADHM CC[C@@H](C)[C@@H](C)N(C(=O)CSCc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000736334578 598240915 /nfs/dbraw/zinc/24/09/15/598240915.db2.gz XFJRPHUCCVEPDU-ZIAGYGMSSA-N -1 3 373.526 3.526 20 0 FHADHM Fc1cc(Br)cc(CNc2ccc(-c3nn[n-]n3)cc2F)c1 ZINC000737643860 598241092 /nfs/dbraw/zinc/24/10/92/598241092.db2.gz GSTKOGYSLIBJQV-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM C[C@@H](Nc1ccc(-c2nn[n-]n2)cc1F)c1ccc(Br)cc1 ZINC000736136793 598241619 /nfs/dbraw/zinc/24/16/19/598241619.db2.gz HNDWUVFODJNOIF-SECBINFHSA-N -1 3 362.206 3.941 20 0 FHADHM O=C(Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)NC1CCCC1 ZINC000738186424 598254909 /nfs/dbraw/zinc/25/49/09/598254909.db2.gz YXVAZUGGECSZNA-UHFFFAOYSA-N -1 3 364.409 3.723 20 0 FHADHM O=C(Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)NC1CCCC1 ZINC000738186424 598254910 /nfs/dbraw/zinc/25/49/10/598254910.db2.gz YXVAZUGGECSZNA-UHFFFAOYSA-N -1 3 364.409 3.723 20 0 FHADHM FC(F)(F)c1ccc(N2CCc3sccc3C2)cc1-c1nnn[n-]1 ZINC000822723267 607346599 /nfs/dbraw/zinc/34/65/99/607346599.db2.gz BWKFYPYFKPEUAM-UHFFFAOYSA-N -1 3 351.357 3.510 20 0 FHADHM FC(F)(F)c1ccc(N2CCc3sccc3C2)cc1-c1nn[n-]n1 ZINC000822723267 607346601 /nfs/dbraw/zinc/34/66/01/607346601.db2.gz BWKFYPYFKPEUAM-UHFFFAOYSA-N -1 3 351.357 3.510 20 0 FHADHM CC[C@H](C)N(C)C(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736322257 598267443 /nfs/dbraw/zinc/26/74/43/598267443.db2.gz JOCXAFSJJGNDJG-ZDUSSCGKSA-N -1 3 366.425 3.921 20 0 FHADHM CC[C@H](C)N(C)C(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736322257 598267444 /nfs/dbraw/zinc/26/74/44/598267444.db2.gz JOCXAFSJJGNDJG-ZDUSSCGKSA-N -1 3 366.425 3.921 20 0 FHADHM FC(F)(F)c1cc(-c2nn[n-]n2)ccc1N1CCC[C@@H](C(F)(F)F)C1 ZINC000737625469 598274074 /nfs/dbraw/zinc/27/40/74/598274074.db2.gz AJRGQOSFACBTKP-SECBINFHSA-N -1 3 365.281 3.664 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)N1CCC[C@H]1C1CCCC1 ZINC000735659529 598278816 /nfs/dbraw/zinc/27/88/16/598278816.db2.gz BYNXLVJFLMHNTH-HNNXBMFYSA-N -1 3 371.489 3.610 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)N1CCC[C@H]1C1CCCC1 ZINC000735659529 598278818 /nfs/dbraw/zinc/27/88/18/598278818.db2.gz BYNXLVJFLMHNTH-HNNXBMFYSA-N -1 3 371.489 3.610 20 0 FHADHM CCSCc1ccc(C(=O)N(C)c2ccc(-c3nnn[n-]3)cc2F)cc1 ZINC000736667963 598279635 /nfs/dbraw/zinc/27/96/35/598279635.db2.gz VCJAOHFLKCQCRQ-UHFFFAOYSA-N -1 3 371.441 3.536 20 0 FHADHM CCSCc1ccc(C(=O)N(C)c2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000736667963 598279636 /nfs/dbraw/zinc/27/96/36/598279636.db2.gz VCJAOHFLKCQCRQ-UHFFFAOYSA-N -1 3 371.441 3.536 20 0 FHADHM C[C@H](NC(=O)Nc1cccc(C(F)F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736115344 598292076 /nfs/dbraw/zinc/29/20/76/598292076.db2.gz HHQDAXVHZGRYJC-JTQLQIEISA-N -1 3 358.352 3.687 20 0 FHADHM C[C@H](NC(=O)Nc1cccc(C(F)F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736115344 598292078 /nfs/dbraw/zinc/29/20/78/598292078.db2.gz HHQDAXVHZGRYJC-JTQLQIEISA-N -1 3 358.352 3.687 20 0 FHADHM C[C@H]1CCc2c(sc(NC(=O)C3CCCCCC3)c2-c2nnn[n-]2)C1 ZINC000736279736 598295527 /nfs/dbraw/zinc/29/55/27/598295527.db2.gz MBUXDZCUHSOCME-NSHDSACASA-N -1 3 359.499 3.962 20 0 FHADHM C[C@H]1CCc2c(sc(NC(=O)C3CCCCCC3)c2-c2nn[n-]n2)C1 ZINC000736279736 598295529 /nfs/dbraw/zinc/29/55/29/598295529.db2.gz MBUXDZCUHSOCME-NSHDSACASA-N -1 3 359.499 3.962 20 0 FHADHM O=C(c1cccc(-c2nnn[n-]2)c1)N1Cc2ccccc2-c2ccccc2C1 ZINC000738271577 598297857 /nfs/dbraw/zinc/29/78/57/598297857.db2.gz YGIAAJPLIGSXDE-UHFFFAOYSA-N -1 3 367.412 3.690 20 0 FHADHM O=C(c1cccc(-c2nn[n-]n2)c1)N1Cc2ccccc2-c2ccccc2C1 ZINC000738271577 598297859 /nfs/dbraw/zinc/29/78/59/598297859.db2.gz YGIAAJPLIGSXDE-UHFFFAOYSA-N -1 3 367.412 3.690 20 0 FHADHM O=C(c1ccc(-c2nnn[n-]2)cc1)N1Cc2ccccc2-c2ccccc2C1 ZINC000738261399 598297883 /nfs/dbraw/zinc/29/78/83/598297883.db2.gz MUDAWRVCFXYGGA-UHFFFAOYSA-N -1 3 367.412 3.690 20 0 FHADHM O=C(c1ccc(-c2nn[n-]n2)cc1)N1Cc2ccccc2-c2ccccc2C1 ZINC000738261399 598297884 /nfs/dbraw/zinc/29/78/84/598297884.db2.gz MUDAWRVCFXYGGA-UHFFFAOYSA-N -1 3 367.412 3.690 20 0 FHADHM Fc1cccc(N2CCc3c(ccc(Cl)c3Cl)C2)c1-c1nnn[n-]1 ZINC000737662275 598299038 /nfs/dbraw/zinc/29/90/38/598299038.db2.gz SVOCNNCHWPNROW-UHFFFAOYSA-N -1 3 364.211 3.875 20 0 FHADHM Fc1cccc(N2CCc3c(ccc(Cl)c3Cl)C2)c1-c1nn[n-]n1 ZINC000737662275 598299040 /nfs/dbraw/zinc/29/90/40/598299040.db2.gz SVOCNNCHWPNROW-UHFFFAOYSA-N -1 3 364.211 3.875 20 0 FHADHM CN(C(=O)c1cc2cc(Cl)ccc2o1)c1ccc(-c2nnn[n-]2)cc1F ZINC000736749278 598310285 /nfs/dbraw/zinc/31/02/85/598310285.db2.gz PQCCILVBJQERNZ-UHFFFAOYSA-N -1 3 371.759 3.682 20 0 FHADHM CN(C(=O)c1cc2cc(Cl)ccc2o1)c1ccc(-c2nn[n-]n2)cc1F ZINC000736749278 598310287 /nfs/dbraw/zinc/31/02/87/598310287.db2.gz PQCCILVBJQERNZ-UHFFFAOYSA-N -1 3 371.759 3.682 20 0 FHADHM Cc1ccc(NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c(F)c1 ZINC000737361690 598317881 /nfs/dbraw/zinc/31/78/81/598317881.db2.gz XKXUZYPIJWRZMU-UHFFFAOYSA-N -1 3 362.821 3.777 20 0 FHADHM Cc1ccc(NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c(F)c1 ZINC000737361690 598317883 /nfs/dbraw/zinc/31/78/83/598317883.db2.gz XKXUZYPIJWRZMU-UHFFFAOYSA-N -1 3 362.821 3.777 20 0 FHADHM S=C(Nc1ccc2c(c1)CCC2)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000738409049 598319340 /nfs/dbraw/zinc/31/93/40/598319340.db2.gz PEZKMCZPVVDZCN-UHFFFAOYSA-N -1 3 370.869 3.818 20 0 FHADHM S=C(Nc1ccc2c(c1)CCC2)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000738409049 598319342 /nfs/dbraw/zinc/31/93/42/598319342.db2.gz PEZKMCZPVVDZCN-UHFFFAOYSA-N -1 3 370.869 3.818 20 0 FHADHM CC[C@H]1CCCC[C@H]1NC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736400693 598319919 /nfs/dbraw/zinc/31/99/19/598319919.db2.gz RKSNXBFCLURBND-IINYFYTJSA-N -1 3 364.906 3.775 20 0 FHADHM CC[C@H]1CCCC[C@H]1NC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736400693 598319920 /nfs/dbraw/zinc/31/99/20/598319920.db2.gz RKSNXBFCLURBND-IINYFYTJSA-N -1 3 364.906 3.775 20 0 FHADHM CC(C)(C)c1ccc(NC(=O)NCc2ccc(-c3nnn[n-]3)cc2F)cc1 ZINC000735650492 598321643 /nfs/dbraw/zinc/32/16/43/598321643.db2.gz OXHVICYAAXJGGD-UHFFFAOYSA-N -1 3 368.416 3.625 20 0 FHADHM CC(C)(C)c1ccc(NC(=O)NCc2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000735650492 598321645 /nfs/dbraw/zinc/32/16/45/598321645.db2.gz OXHVICYAAXJGGD-UHFFFAOYSA-N -1 3 368.416 3.625 20 0 FHADHM Brc1cccc([C@H]2C[C@H]2Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735369818 598353587 /nfs/dbraw/zinc/35/35/87/598353587.db2.gz XKILONNHEYAXFE-HUUCEWRRSA-N -1 3 356.227 3.597 20 0 FHADHM CC(C)Oc1ccccc1C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000735914779 598358908 /nfs/dbraw/zinc/35/89/08/598358908.db2.gz ZTQGAKBKENWSGH-UHFFFAOYSA-N -1 3 357.801 3.560 20 0 FHADHM CC(C)Oc1ccccc1C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000735914779 598358910 /nfs/dbraw/zinc/35/89/10/598358910.db2.gz ZTQGAKBKENWSGH-UHFFFAOYSA-N -1 3 357.801 3.560 20 0 FHADHM Cc1oc(-c2ccsc2)nc1CSc1ccc(-c2nnn[n-]2)cn1 ZINC000737548812 598364155 /nfs/dbraw/zinc/36/41/55/598364155.db2.gz RZIIJZSMQZQPLJ-UHFFFAOYSA-N -1 3 356.436 3.579 20 0 FHADHM Cc1oc(-c2ccsc2)nc1CSc1ccc(-c2nn[n-]n2)cn1 ZINC000737548812 598364156 /nfs/dbraw/zinc/36/41/56/598364156.db2.gz RZIIJZSMQZQPLJ-UHFFFAOYSA-N -1 3 356.436 3.579 20 0 FHADHM COc1ccc2cc(CNc3ncc(-c4nnn[n-]4)cc3Cl)ccc2c1 ZINC000737120735 598388234 /nfs/dbraw/zinc/38/82/34/598388234.db2.gz TYGRYSKRYMCGQF-UHFFFAOYSA-N -1 3 366.812 3.689 20 0 FHADHM COc1ccc2cc(CNc3ncc(-c4nn[n-]n4)cc3Cl)ccc2c1 ZINC000737120735 598388236 /nfs/dbraw/zinc/38/82/36/598388236.db2.gz TYGRYSKRYMCGQF-UHFFFAOYSA-N -1 3 366.812 3.689 20 0 FHADHM CC(C)Oc1cccc([C@H](C)Nc2ncc(-c3nnn[n-]3)cc2Cl)c1 ZINC000735914326 598388857 /nfs/dbraw/zinc/38/88/57/598388857.db2.gz WPLAYNZDXXIFIE-NSHDSACASA-N -1 3 358.833 3.875 20 0 FHADHM CC(C)Oc1cccc([C@H](C)Nc2ncc(-c3nn[n-]n3)cc2Cl)c1 ZINC000735914326 598388858 /nfs/dbraw/zinc/38/88/58/598388858.db2.gz WPLAYNZDXXIFIE-NSHDSACASA-N -1 3 358.833 3.875 20 0 FHADHM Cc1ccccc1C1CCN(C(=O)Nc2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000737420870 598389853 /nfs/dbraw/zinc/38/98/53/598389853.db2.gz HOMXWFFAJBZICW-UHFFFAOYSA-N -1 3 362.437 3.587 20 0 FHADHM Cc1ccccc1C1CCN(C(=O)Nc2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000737420870 598389856 /nfs/dbraw/zinc/38/98/56/598389856.db2.gz HOMXWFFAJBZICW-UHFFFAOYSA-N -1 3 362.437 3.587 20 0 FHADHM CC(C)COc1ccccc1CNc1ncc(-c2nnn[n-]2)cc1Cl ZINC000735843994 598390400 /nfs/dbraw/zinc/39/04/00/598390400.db2.gz DUMQJOPUZAZGQY-UHFFFAOYSA-N -1 3 358.833 3.562 20 0 FHADHM CC(C)COc1ccccc1CNc1ncc(-c2nn[n-]n2)cc1Cl ZINC000735843994 598390402 /nfs/dbraw/zinc/39/04/02/598390402.db2.gz DUMQJOPUZAZGQY-UHFFFAOYSA-N -1 3 358.833 3.562 20 0 FHADHM Cc1[nH]c2ccc(CNc3ncc(-c4nnn[n-]4)cc3Cl)cc2c1C ZINC000737199576 598392568 /nfs/dbraw/zinc/39/25/68/598392568.db2.gz NSEQHGWNNWPPPN-UHFFFAOYSA-N -1 3 353.817 3.625 20 0 FHADHM Cc1[nH]c2ccc(CNc3ncc(-c4nn[n-]n4)cc3Cl)cc2c1C ZINC000737199576 598392571 /nfs/dbraw/zinc/39/25/71/598392571.db2.gz NSEQHGWNNWPPPN-UHFFFAOYSA-N -1 3 353.817 3.625 20 0 FHADHM Cc1ccsc1-c1nnc(SCc2ccccc2-c2nnn[n-]2)o1 ZINC000737441731 598394380 /nfs/dbraw/zinc/39/43/80/598394380.db2.gz JWDXGVWQDPSCCC-UHFFFAOYSA-N -1 3 356.436 3.579 20 0 FHADHM Cc1ccsc1-c1nnc(SCc2ccccc2-c2nn[n-]n2)o1 ZINC000737441731 598394381 /nfs/dbraw/zinc/39/43/81/598394381.db2.gz JWDXGVWQDPSCCC-UHFFFAOYSA-N -1 3 356.436 3.579 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1OCc1c(Cl)ccc2cccnc21 ZINC000737221832 598394666 /nfs/dbraw/zinc/39/46/66/598394666.db2.gz PLGVZURYLVTWHR-UHFFFAOYSA-N -1 3 351.797 3.956 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000499756026 598418925 /nfs/dbraw/zinc/41/89/25/598418925.db2.gz JZBVGEKJHYPFRW-UONOGXRCSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000499756026 598418926 /nfs/dbraw/zinc/41/89/26/598418926.db2.gz JZBVGEKJHYPFRW-UONOGXRCSA-N -1 3 374.231 3.916 20 0 FHADHM Cc1cc(OCc2ccc(-c3ccccc3-c3nnn[n-]3)cc2)nnc1C ZINC000737279784 598420082 /nfs/dbraw/zinc/42/00/82/598420082.db2.gz MVCCCIYWMJGRNJ-UHFFFAOYSA-N -1 3 358.405 3.520 20 0 FHADHM Cc1cc(OCc2ccc(-c3ccccc3-c3nn[n-]n3)cc2)nnc1C ZINC000737279784 598420083 /nfs/dbraw/zinc/42/00/83/598420083.db2.gz MVCCCIYWMJGRNJ-UHFFFAOYSA-N -1 3 358.405 3.520 20 0 FHADHM O=C(Nc1sccc1-c1nnn[n-]1)c1sccc1SC(F)F ZINC000738209215 598421931 /nfs/dbraw/zinc/42/19/31/598421931.db2.gz MXDUAHNARUOOQO-UHFFFAOYSA-N -1 3 359.408 3.557 20 0 FHADHM O=C(Nc1sccc1-c1nn[n-]n1)c1sccc1SC(F)F ZINC000738209215 598421933 /nfs/dbraw/zinc/42/19/33/598421933.db2.gz MXDUAHNARUOOQO-UHFFFAOYSA-N -1 3 359.408 3.557 20 0 FHADHM Cc1cccc(NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)c1C ZINC000737400465 598426960 /nfs/dbraw/zinc/42/69/60/598426960.db2.gz UNWBPVDQCRMZIB-UHFFFAOYSA-N -1 3 364.453 3.926 20 0 FHADHM Cc1cccc(NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)c1C ZINC000737400465 598426962 /nfs/dbraw/zinc/42/69/62/598426962.db2.gz UNWBPVDQCRMZIB-UHFFFAOYSA-N -1 3 364.453 3.926 20 0 FHADHM CCCCC[C@H](C)NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C(C)C ZINC000736440709 598428402 /nfs/dbraw/zinc/42/84/02/598428402.db2.gz FSQPUCMQWSGSBV-HNNXBMFYSA-N -1 3 358.490 3.756 20 0 FHADHM CCCCC[C@H](C)NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C(C)C ZINC000736440709 598428403 /nfs/dbraw/zinc/42/84/03/598428403.db2.gz FSQPUCMQWSGSBV-HNNXBMFYSA-N -1 3 358.490 3.756 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@H](C)c1ccccc1 ZINC000736481782 598429777 /nfs/dbraw/zinc/42/97/77/598429777.db2.gz UXFWSFZISWJSQR-OAHLLOKOSA-N -1 3 364.453 3.550 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@H](C)c1ccccc1 ZINC000736481782 598429779 /nfs/dbraw/zinc/42/97/79/598429779.db2.gz UXFWSFZISWJSQR-OAHLLOKOSA-N -1 3 364.453 3.550 20 0 FHADHM O=C(OCc1ccccc1-c1nnn[n-]1)c1sccc1SC(F)F ZINC000738235062 598432430 /nfs/dbraw/zinc/43/24/30/598432430.db2.gz MXEJJMAXQDQTOS-UHFFFAOYSA-N -1 3 368.390 3.600 20 0 FHADHM O=C(OCc1ccccc1-c1nn[n-]n1)c1sccc1SC(F)F ZINC000738235062 598432432 /nfs/dbraw/zinc/43/24/32/598432432.db2.gz MXEJJMAXQDQTOS-UHFFFAOYSA-N -1 3 368.390 3.600 20 0 FHADHM CC(=CC(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1)c1ccccc1Cl ZINC000735450083 598442478 /nfs/dbraw/zinc/44/24/78/598442478.db2.gz VEQYIIHVYLUJDT-RAXLEYEMSA-N -1 3 367.840 3.582 20 0 FHADHM CC(=CC(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1)c1ccccc1Cl ZINC000735450083 598442480 /nfs/dbraw/zinc/44/24/80/598442480.db2.gz VEQYIIHVYLUJDT-RAXLEYEMSA-N -1 3 367.840 3.582 20 0 FHADHM CCN(C(=O)c1ccc2[nH]ccc2c1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736507458 598459945 /nfs/dbraw/zinc/45/99/45/598459945.db2.gz DCZBLJDWFOIKCG-CYBMUJFWSA-N -1 3 360.421 3.571 20 0 FHADHM CCN(C(=O)c1ccc2[nH]ccc2c1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736507458 598459947 /nfs/dbraw/zinc/45/99/47/598459947.db2.gz DCZBLJDWFOIKCG-CYBMUJFWSA-N -1 3 360.421 3.571 20 0 FHADHM Cc1cc(O)c(C(C)C)cc1NC(=O)C=Cc1ccccc1-c1nnn[n-]1 ZINC000826271353 607357498 /nfs/dbraw/zinc/35/74/98/607357498.db2.gz OAHQCMLHICCUSC-CMDGGOBGSA-N -1 3 363.421 3.656 20 0 FHADHM Cc1cc(O)c(C(C)C)cc1NC(=O)C=Cc1ccccc1-c1nn[n-]n1 ZINC000826271353 607357500 /nfs/dbraw/zinc/35/75/00/607357500.db2.gz OAHQCMLHICCUSC-CMDGGOBGSA-N -1 3 363.421 3.656 20 0 FHADHM C[C@@H](Nc1nc(-c2cccc(Cl)c2)no1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736137050 598466560 /nfs/dbraw/zinc/46/65/60/598466560.db2.gz JYMVUXCBIUFJHI-SNVBAGLBSA-N -1 3 367.800 3.743 20 0 FHADHM CC(C)(NC(=O)Nc1ccc(-c2nnn[n-]2)cc1)c1ccc(Cl)cc1 ZINC000735671985 598467623 /nfs/dbraw/zinc/46/76/23/598467623.db2.gz YQKXIVNEMLFNSF-UHFFFAOYSA-N -1 3 356.817 3.577 20 0 FHADHM CC(C)(NC(=O)Nc1ccc(-c2nn[n-]n2)cc1)c1ccc(Cl)cc1 ZINC000735671985 598467625 /nfs/dbraw/zinc/46/76/25/598467625.db2.gz YQKXIVNEMLFNSF-UHFFFAOYSA-N -1 3 356.817 3.577 20 0 FHADHM CC(=CC(=O)OCc1cc(-c2nnn[n-]2)ccc1F)c1ccccc1Cl ZINC000735448120 598474031 /nfs/dbraw/zinc/47/40/31/598474031.db2.gz PIZPCLBOQNZTMI-DHZHZOJOSA-N -1 3 372.787 3.806 20 0 FHADHM CC(=CC(=O)OCc1cc(-c2nn[n-]n2)ccc1F)c1ccccc1Cl ZINC000735448120 598474033 /nfs/dbraw/zinc/47/40/33/598474033.db2.gz PIZPCLBOQNZTMI-DHZHZOJOSA-N -1 3 372.787 3.806 20 0 FHADHM O=C(NCCCC1CCCC1)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000738054040 598479050 /nfs/dbraw/zinc/47/90/50/598479050.db2.gz APAWZUDFBLPQLS-UHFFFAOYSA-N -1 3 368.485 3.511 20 0 FHADHM O=C(NCCCC1CCCC1)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000738054040 598479051 /nfs/dbraw/zinc/47/90/51/598479051.db2.gz APAWZUDFBLPQLS-UHFFFAOYSA-N -1 3 368.485 3.511 20 0 FHADHM C[C@H](OC(=O)CCSc1ccccc1)c1cccc(-c2nnn[n-]2)c1 ZINC000736152354 598485750 /nfs/dbraw/zinc/48/57/50/598485750.db2.gz TVMNCVWBEORMKC-ZDUSSCGKSA-N -1 3 354.435 3.653 20 0 FHADHM C[C@H](OC(=O)CCSc1ccccc1)c1cccc(-c2nn[n-]n2)c1 ZINC000736152354 598485751 /nfs/dbraw/zinc/48/57/51/598485751.db2.gz TVMNCVWBEORMKC-ZDUSSCGKSA-N -1 3 354.435 3.653 20 0 FHADHM Cc1ccccc1OCCCC(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000737431148 598488080 /nfs/dbraw/zinc/48/80/80/598488080.db2.gz FLOVHHLUFJALMU-HNNXBMFYSA-N -1 3 366.421 3.639 20 0 FHADHM Cc1ccccc1OCCCC(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000737431148 598488082 /nfs/dbraw/zinc/48/80/82/598488082.db2.gz FLOVHHLUFJALMU-HNNXBMFYSA-N -1 3 366.421 3.639 20 0 FHADHM CC(C)c1ccccc1OCC(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000735931677 598488407 /nfs/dbraw/zinc/48/84/07/598488407.db2.gz BOQNABSNHFAINT-CQSZACIVSA-N -1 3 366.421 3.673 20 0 FHADHM CC(C)c1ccccc1OCC(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000735931677 598488409 /nfs/dbraw/zinc/48/84/09/598488409.db2.gz BOQNABSNHFAINT-CQSZACIVSA-N -1 3 366.421 3.673 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccc(Cl)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000736147979 598490294 /nfs/dbraw/zinc/49/02/94/598490294.db2.gz BKXJFWVWASSLHA-OFFHKIPUSA-N -1 3 354.797 3.838 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccc(Cl)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000736147979 598490295 /nfs/dbraw/zinc/49/02/95/598490295.db2.gz BKXJFWVWASSLHA-OFFHKIPUSA-N -1 3 354.797 3.838 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)ccc1OC(=O)[C@H](C)c1ccc(CC)cc1 ZINC000736627055 598498083 /nfs/dbraw/zinc/49/80/83/598498083.db2.gz ILDNEPROJGOGCK-CYBMUJFWSA-N -1 3 366.421 3.537 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)ccc1OC(=O)[C@H](C)c1ccc(CC)cc1 ZINC000736627055 598498085 /nfs/dbraw/zinc/49/80/85/598498085.db2.gz ILDNEPROJGOGCK-CYBMUJFWSA-N -1 3 366.421 3.537 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@H](C)c1ccc(CC)cc1 ZINC000736634389 598498112 /nfs/dbraw/zinc/49/81/12/598498112.db2.gz HAIGRXCRWQTXMQ-CYBMUJFWSA-N -1 3 365.437 3.570 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@H](C)c1ccc(CC)cc1 ZINC000736634389 598498115 /nfs/dbraw/zinc/49/81/15/598498115.db2.gz HAIGRXCRWQTXMQ-CYBMUJFWSA-N -1 3 365.437 3.570 20 0 FHADHM COc1ccc([C@@H]2CCCN2c2ccc(Cl)cc2-c2nnn[n-]2)cc1 ZINC000737074426 598506457 /nfs/dbraw/zinc/50/64/57/598506457.db2.gz FXWYVCPGIASEQA-INIZCTEOSA-N -1 3 355.829 3.870 20 0 FHADHM COc1ccc([C@@H]2CCCN2c2ccc(Cl)cc2-c2nn[n-]n2)cc1 ZINC000737074426 598506459 /nfs/dbraw/zinc/50/64/59/598506459.db2.gz FXWYVCPGIASEQA-INIZCTEOSA-N -1 3 355.829 3.870 20 0 FHADHM Clc1ccc(NCCc2cccc3cccnc32)c(-c2nnn[n-]2)c1 ZINC000737575369 598508017 /nfs/dbraw/zinc/50/80/17/598508017.db2.gz RXBBWLGWGHCCCB-UHFFFAOYSA-N -1 3 350.813 3.723 20 0 FHADHM Clc1ccc(NCCc2cccc3cccnc32)c(-c2nn[n-]n2)c1 ZINC000737575369 598508018 /nfs/dbraw/zinc/50/80/18/598508018.db2.gz RXBBWLGWGHCCCB-UHFFFAOYSA-N -1 3 350.813 3.723 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)[C@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000521464922 598513249 /nfs/dbraw/zinc/51/32/49/598513249.db2.gz FSNVWUVHHIBMLG-STQMWFEESA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)[C@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000521464922 598513252 /nfs/dbraw/zinc/51/32/52/598513252.db2.gz FSNVWUVHHIBMLG-STQMWFEESA-N -1 3 374.231 3.916 20 0 FHADHM CCO[C@H](C(=O)Nc1sc(C)c(CC)c1-c1nnn[n-]1)c1ccccc1 ZINC000736616750 598514043 /nfs/dbraw/zinc/51/40/43/598514043.db2.gz PNWJDMMHICTTFL-HNNXBMFYSA-N -1 3 371.466 3.515 20 0 FHADHM CCO[C@H](C(=O)Nc1sc(C)c(CC)c1-c1nn[n-]n1)c1ccccc1 ZINC000736616750 598514045 /nfs/dbraw/zinc/51/40/45/598514045.db2.gz PNWJDMMHICTTFL-HNNXBMFYSA-N -1 3 371.466 3.515 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H](C)Cc2ccc(F)cc2)c1-c1nnn[n-]1 ZINC000736670823 598515764 /nfs/dbraw/zinc/51/57/64/598515764.db2.gz SQAYZDWOLYNOQY-SNVBAGLBSA-N -1 3 373.457 3.755 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H](C)Cc2ccc(F)cc2)c1-c1nn[n-]n1 ZINC000736670823 598515766 /nfs/dbraw/zinc/51/57/66/598515766.db2.gz SQAYZDWOLYNOQY-SNVBAGLBSA-N -1 3 373.457 3.755 20 0 FHADHM Cc1nnc(Nc2ccc(NCC3CCCC3)cc2)c(-c2nnn[n-]2)c1C ZINC000737531847 598520335 /nfs/dbraw/zinc/52/03/35/598520335.db2.gz FUVDDHFHDSLMFS-UHFFFAOYSA-N -1 3 364.457 3.619 20 0 FHADHM Cc1nnc(Nc2ccc(NCC3CCCC3)cc2)c(-c2nn[n-]n2)c1C ZINC000737531847 598520336 /nfs/dbraw/zinc/52/03/36/598520336.db2.gz FUVDDHFHDSLMFS-UHFFFAOYSA-N -1 3 364.457 3.619 20 0 FHADHM O[C@H](CCc1ccc(Nc2ccc(-c3nnn[n-]3)cn2)cc1)c1ccccc1 ZINC000738382356 598521959 /nfs/dbraw/zinc/52/19/59/598521959.db2.gz PNXQVZRMCKBEPC-LJQANCHMSA-N -1 3 372.432 3.672 20 0 FHADHM O[C@H](CCc1ccc(Nc2ccc(-c3nn[n-]n3)cn2)cc1)c1ccccc1 ZINC000738382356 598521960 /nfs/dbraw/zinc/52/19/60/598521960.db2.gz PNXQVZRMCKBEPC-LJQANCHMSA-N -1 3 372.432 3.672 20 0 FHADHM Cc1c(NCc2ccc(-c3nnn[n-]3)cc2)cccc1OCC(F)(F)F ZINC000737219959 598523614 /nfs/dbraw/zinc/52/36/14/598523614.db2.gz UQMDEEKZAYTFPM-UHFFFAOYSA-N -1 3 363.343 3.728 20 0 FHADHM Cc1c(NCc2ccc(-c3nn[n-]n3)cc2)cccc1OCC(F)(F)F ZINC000737219959 598523616 /nfs/dbraw/zinc/52/36/16/598523616.db2.gz UQMDEEKZAYTFPM-UHFFFAOYSA-N -1 3 363.343 3.728 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1N[C@@H]1CCc2c1cccc2Br ZINC000737640768 598523710 /nfs/dbraw/zinc/52/37/10/598523710.db2.gz PLXZXHAQAHJNNW-CQSZACIVSA-N -1 3 374.217 3.868 20 0 FHADHM O=C(OCCCOc1ccc2ccccc2c1)c1cccc(-c2nnn[n-]2)c1 ZINC000738219307 598532194 /nfs/dbraw/zinc/53/21/94/598532194.db2.gz BGQXHCSMLXFOLZ-UHFFFAOYSA-N -1 3 374.400 3.646 20 0 FHADHM O=C(OCCCOc1ccc2ccccc2c1)c1cccc(-c2nn[n-]n2)c1 ZINC000738219307 598532197 /nfs/dbraw/zinc/53/21/97/598532197.db2.gz BGQXHCSMLXFOLZ-UHFFFAOYSA-N -1 3 374.400 3.646 20 0 FHADHM O=C(Nc1ccccc1-c1nnn[n-]1)[C@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000738191040 598533867 /nfs/dbraw/zinc/53/38/67/598533867.db2.gz IAFYPAXPXFYZPY-MSOLQXFVSA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1ccccc1-c1nn[n-]n1)[C@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000738191040 598533868 /nfs/dbraw/zinc/53/38/68/598533868.db2.gz IAFYPAXPXFYZPY-MSOLQXFVSA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1sccc1-c1nnn[n-]1)[C@@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000738206769 598534119 /nfs/dbraw/zinc/53/41/19/598534119.db2.gz GWMDKVFJTKNRDB-JKSUJKDBSA-N -1 3 361.430 3.824 20 0 FHADHM O=C(Nc1sccc1-c1nn[n-]n1)[C@@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000738206769 598534120 /nfs/dbraw/zinc/53/41/20/598534120.db2.gz GWMDKVFJTKNRDB-JKSUJKDBSA-N -1 3 361.430 3.824 20 0 FHADHM C[C@H](Nc1nc(C(F)F)nc2ccccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000736138701 598536004 /nfs/dbraw/zinc/53/60/04/598536004.db2.gz QWCVBKVAWNMYGW-JTQLQIEISA-N -1 3 367.363 3.921 20 0 FHADHM C[C@H](Nc1nc(C(F)F)nc2ccccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000736138701 598536006 /nfs/dbraw/zinc/53/60/06/598536006.db2.gz QWCVBKVAWNMYGW-JTQLQIEISA-N -1 3 367.363 3.921 20 0 FHADHM CCCCC(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736438342 598543603 /nfs/dbraw/zinc/54/36/03/598543603.db2.gz IMXFVOSZUBNFFJ-UHFFFAOYSA-N -1 3 351.410 3.574 20 0 FHADHM CCCCC(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736438342 598543604 /nfs/dbraw/zinc/54/36/04/598543604.db2.gz IMXFVOSZUBNFFJ-UHFFFAOYSA-N -1 3 351.410 3.574 20 0 FHADHM CC[C@@H](C)c1ccc(NC(=O)COc2ccc(-c3nnn[n-]3)c(F)c2)cc1 ZINC000736327946 598547360 /nfs/dbraw/zinc/54/73/60/598547360.db2.gz MXINYGFAJVFFJY-GFCCVEGCSA-N -1 3 369.400 3.537 20 0 FHADHM CC[C@@H](C)c1ccc(NC(=O)COc2ccc(-c3nn[n-]n3)c(F)c2)cc1 ZINC000736327946 598547362 /nfs/dbraw/zinc/54/73/62/598547362.db2.gz MXINYGFAJVFFJY-GFCCVEGCSA-N -1 3 369.400 3.537 20 0 FHADHM CC(C)(C)NC(=S)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000735624066 598551756 /nfs/dbraw/zinc/55/17/56/598551756.db2.gz STASDHIMALYHAR-UHFFFAOYSA-N -1 3 368.466 3.744 20 0 FHADHM CC(C)(C)NC(=S)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000735624066 598551757 /nfs/dbraw/zinc/55/17/57/598551757.db2.gz STASDHIMALYHAR-UHFFFAOYSA-N -1 3 368.466 3.744 20 0 FHADHM CCN(C(=O)[C@H](C)c1ccccc1F)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736503229 598552621 /nfs/dbraw/zinc/55/26/21/598552621.db2.gz UEHLLJAPMUIQNU-ZIAGYGMSSA-N -1 3 367.428 3.719 20 0 FHADHM CCN(C(=O)[C@H](C)c1ccccc1F)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736503229 598552623 /nfs/dbraw/zinc/55/26/23/598552623.db2.gz UEHLLJAPMUIQNU-ZIAGYGMSSA-N -1 3 367.428 3.719 20 0 FHADHM C/C(=C/C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1)C1CC1 ZINC000735449181 598554052 /nfs/dbraw/zinc/55/40/52/598554052.db2.gz XBNBODTWFFGAFO-QBFSEMIESA-N -1 3 361.405 3.954 20 0 FHADHM C/C(=C/C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1)C1CC1 ZINC000735449181 598554053 /nfs/dbraw/zinc/55/40/53/598554053.db2.gz XBNBODTWFFGAFO-QBFSEMIESA-N -1 3 361.405 3.954 20 0 FHADHM CC(C)(CNC(=O)Nc1cccc(-c2nnn[n-]2)c1)c1ccccc1Cl ZINC000735670513 598555188 /nfs/dbraw/zinc/55/51/88/598555188.db2.gz RULXXUNECWUDFC-UHFFFAOYSA-N -1 3 370.844 3.619 20 0 FHADHM CC(C)(CNC(=O)Nc1cccc(-c2nn[n-]n2)c1)c1ccccc1Cl ZINC000735670513 598555191 /nfs/dbraw/zinc/55/51/91/598555191.db2.gz RULXXUNECWUDFC-UHFFFAOYSA-N -1 3 370.844 3.619 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(Oc3cccc(-c4nnn[n-]4)c3)cc2)n1C ZINC000737316083 598557332 /nfs/dbraw/zinc/55/73/32/598557332.db2.gz RHLOLFIGBRHODW-UHFFFAOYSA-N -1 3 374.404 3.558 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(Oc3cccc(-c4nn[n-]n4)c3)cc2)n1C ZINC000737316083 598557333 /nfs/dbraw/zinc/55/73/33/598557333.db2.gz RHLOLFIGBRHODW-UHFFFAOYSA-N -1 3 374.404 3.558 20 0 FHADHM C[C@@H](NC(=O)Nc1cc(F)ccc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000736117546 598558657 /nfs/dbraw/zinc/55/86/57/598558657.db2.gz QDZQSLVAUAXHNZ-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM C[C@@H](NC(=O)Nc1cc(F)ccc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000736117546 598558658 /nfs/dbraw/zinc/55/86/58/598558658.db2.gz QDZQSLVAUAXHNZ-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM C[C@@H](Nc1nc2ccccn2c1-c1nnn[n-]1)c1ccc2c(c1)CCCC2 ZINC000736136020 598566017 /nfs/dbraw/zinc/56/60/17/598566017.db2.gz DBCYFGSRVCPHER-CYBMUJFWSA-N -1 3 359.437 3.566 20 0 FHADHM C[C@@H](Nc1nc2ccccn2c1-c1nn[n-]n1)c1ccc2c(c1)CCCC2 ZINC000736136020 598566018 /nfs/dbraw/zinc/56/60/18/598566018.db2.gz DBCYFGSRVCPHER-CYBMUJFWSA-N -1 3 359.437 3.566 20 0 FHADHM C[C@@H](NC(=O)CCCCCc1cccs1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736100360 598567825 /nfs/dbraw/zinc/56/78/25/598567825.db2.gz KEZMYRZRZQCOGQ-CQSZACIVSA-N -1 3 369.494 3.909 20 0 FHADHM C[C@@H](NC(=O)CCCCCc1cccs1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736100360 598567827 /nfs/dbraw/zinc/56/78/27/598567827.db2.gz KEZMYRZRZQCOGQ-CQSZACIVSA-N -1 3 369.494 3.909 20 0 FHADHM Cc1c2cc(F)ccc2sc1C(=O)Nc1ccccc1-c1nnn[n-]1 ZINC000737210068 598571979 /nfs/dbraw/zinc/57/19/79/598571979.db2.gz XRNCDUVDVULYAF-UHFFFAOYSA-N -1 3 353.382 3.781 20 0 FHADHM Cc1c2cc(F)ccc2sc1C(=O)Nc1ccccc1-c1nn[n-]n1 ZINC000737210068 598571980 /nfs/dbraw/zinc/57/19/80/598571980.db2.gz XRNCDUVDVULYAF-UHFFFAOYSA-N -1 3 353.382 3.781 20 0 FHADHM CC(=O)c1c(C)cc(C)c(CNc2ccc(F)c(-c3nnn[n-]3)c2)c1C ZINC000735498242 598603277 /nfs/dbraw/zinc/60/32/77/598603277.db2.gz WWBQSFVXRAOHFS-UHFFFAOYSA-N -1 3 353.401 3.746 20 0 FHADHM CC(=O)c1c(C)cc(C)c(CNc2ccc(F)c(-c3nn[n-]n3)c2)c1C ZINC000735498242 598603279 /nfs/dbraw/zinc/60/32/79/598603279.db2.gz WWBQSFVXRAOHFS-UHFFFAOYSA-N -1 3 353.401 3.746 20 0 FHADHM CCC[C@H](NC(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1)C1CCCCC1 ZINC000736431560 598607121 /nfs/dbraw/zinc/60/71/21/598607121.db2.gz MVBSRCODNQEZKG-SFHVURJKSA-N -1 3 370.501 3.757 20 0 FHADHM CCC[C@H](NC(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1)C1CCCCC1 ZINC000736431560 598607123 /nfs/dbraw/zinc/60/71/23/598607123.db2.gz MVBSRCODNQEZKG-SFHVURJKSA-N -1 3 370.501 3.757 20 0 FHADHM CCC[C@H](NC(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)C1CCCCC1 ZINC000736431993 598607220 /nfs/dbraw/zinc/60/72/20/598607220.db2.gz ZVBKHKIPQNCPDD-KSSFIOAISA-N -1 3 370.501 3.976 20 0 FHADHM CCC[C@H](NC(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)C1CCCCC1 ZINC000736431993 598607222 /nfs/dbraw/zinc/60/72/22/598607222.db2.gz ZVBKHKIPQNCPDD-KSSFIOAISA-N -1 3 370.501 3.976 20 0 FHADHM C[C@H](Oc1ccccc1-c1nnn[n-]1)c1nc(-c2cccc(Cl)c2)no1 ZINC000736186862 598608750 /nfs/dbraw/zinc/60/87/50/598608750.db2.gz FDASLOSJKOBECQ-JTQLQIEISA-N -1 3 368.784 3.710 20 0 FHADHM C[C@H](Oc1ccccc1-c1nn[n-]n1)c1nc(-c2cccc(Cl)c2)no1 ZINC000736186862 598608752 /nfs/dbraw/zinc/60/87/52/598608752.db2.gz FDASLOSJKOBECQ-JTQLQIEISA-N -1 3 368.784 3.710 20 0 FHADHM C[C@H](Oc1ccc(-c2nn[n-]n2)cc1)c1nc(-c2ccc(Cl)cc2)no1 ZINC000736166897 598608800 /nfs/dbraw/zinc/60/88/00/598608800.db2.gz AAEFZFJMFBOCKD-JTQLQIEISA-N -1 3 368.784 3.710 20 0 FHADHM Cc1cc(-c2noc([C@@H](C)Oc3ccccc3-c3nnn[n-]3)n2)ccc1F ZINC000737226626 598611333 /nfs/dbraw/zinc/61/13/33/598611333.db2.gz XDOLVYVJWXJCFI-LLVKDONJSA-N -1 3 366.356 3.504 20 0 FHADHM Cc1cc(-c2noc([C@@H](C)Oc3ccccc3-c3nn[n-]n3)n2)ccc1F ZINC000737226626 598611336 /nfs/dbraw/zinc/61/13/36/598611336.db2.gz XDOLVYVJWXJCFI-LLVKDONJSA-N -1 3 366.356 3.504 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)C1(Sc2ccccc2)CCCC1 ZINC000523972619 598616604 /nfs/dbraw/zinc/61/66/04/598616604.db2.gz JBDHCFJFHRUBTK-UHFFFAOYSA-N -1 3 365.462 3.910 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)C1(Sc2ccccc2)CCCC1 ZINC000523972619 598616605 /nfs/dbraw/zinc/61/66/05/598616605.db2.gz JBDHCFJFHRUBTK-UHFFFAOYSA-N -1 3 365.462 3.910 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccc(Cl)cc1 ZINC000736116867 598624301 /nfs/dbraw/zinc/62/43/01/598624301.db2.gz OTOILQQBLSEZAR-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccc(Cl)cc1 ZINC000736116867 598624302 /nfs/dbraw/zinc/62/43/02/598624302.db2.gz OTOILQQBLSEZAR-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM Cc1ccccc1[C@H](C)N(C)C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000737420624 598626473 /nfs/dbraw/zinc/62/64/73/598626473.db2.gz IIDPRJWHHDKRCH-LBPRGKRZSA-N -1 3 354.389 3.539 20 0 FHADHM Cc1ccccc1[C@H](C)N(C)C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000737420624 598626475 /nfs/dbraw/zinc/62/64/75/598626475.db2.gz IIDPRJWHHDKRCH-LBPRGKRZSA-N -1 3 354.389 3.539 20 0 FHADHM CCN(Cc1cccc(Cl)c1)C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000736557813 598629157 /nfs/dbraw/zinc/62/91/57/598629157.db2.gz BDRGVXNPRPPCCI-UHFFFAOYSA-N -1 3 374.807 3.713 20 0 FHADHM CCN(Cc1cccc(Cl)c1)C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000736557813 598629158 /nfs/dbraw/zinc/62/91/58/598629158.db2.gz BDRGVXNPRPPCCI-UHFFFAOYSA-N -1 3 374.807 3.713 20 0 FHADHM C[C@H](Nc1ccc(F)cc1-c1nnn[n-]1)c1ccccc1Br ZINC000736138385 598630927 /nfs/dbraw/zinc/63/09/27/598630927.db2.gz MZRHNUMQAGJQCA-VIFPVBQESA-N -1 3 362.206 3.941 20 0 FHADHM C[C@H](Nc1ccc(F)cc1-c1nn[n-]n1)c1ccccc1Br ZINC000736138385 598630928 /nfs/dbraw/zinc/63/09/28/598630928.db2.gz MZRHNUMQAGJQCA-VIFPVBQESA-N -1 3 362.206 3.941 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1N1CCC(OCc2ccccc2)CC1 ZINC000737575250 598633704 /nfs/dbraw/zinc/63/37/04/598633704.db2.gz OAVISKBUZLMIMH-UHFFFAOYSA-N -1 3 369.856 3.706 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1N1CCC(OCc2ccccc2)CC1 ZINC000737575250 598633706 /nfs/dbraw/zinc/63/37/06/598633706.db2.gz OAVISKBUZLMIMH-UHFFFAOYSA-N -1 3 369.856 3.706 20 0 FHADHM CCc1cccc(NC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)c1 ZINC000736697460 598644982 /nfs/dbraw/zinc/64/49/82/598644982.db2.gz FTMCRDWAUVRCCE-UHFFFAOYSA-N -1 3 365.437 3.617 20 0 FHADHM CCc1cccc(NC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)c1 ZINC000736697460 598644984 /nfs/dbraw/zinc/64/49/84/598644984.db2.gz FTMCRDWAUVRCCE-UHFFFAOYSA-N -1 3 365.437 3.617 20 0 FHADHM Cc1ccccc1OC(=O)c1ccc(Oc2ccc(-c3nnn[n-]3)cn2)cc1 ZINC000737435886 598645138 /nfs/dbraw/zinc/64/51/38/598645138.db2.gz MQNQFGMMDYNDDB-UHFFFAOYSA-N -1 3 373.372 3.582 20 0 FHADHM Cc1ccccc1OC(=O)c1ccc(Oc2ccc(-c3nn[n-]n3)cn2)cc1 ZINC000737435886 598645140 /nfs/dbraw/zinc/64/51/40/598645140.db2.gz MQNQFGMMDYNDDB-UHFFFAOYSA-N -1 3 373.372 3.582 20 0 FHADHM CCCCCNC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736451209 598645550 /nfs/dbraw/zinc/64/55/50/598645550.db2.gz KNIKRIQWINMIJM-UHFFFAOYSA-N -1 3 351.410 3.579 20 0 FHADHM CCCCCNC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736451209 598645552 /nfs/dbraw/zinc/64/55/52/598645552.db2.gz KNIKRIQWINMIJM-UHFFFAOYSA-N -1 3 351.410 3.579 20 0 FHADHM COc1ccccc1[C@@H](C)CC(=O)Nc1sc(C)c(C)c1-c1nnn[n-]1 ZINC000737142358 598647344 /nfs/dbraw/zinc/64/73/44/598647344.db2.gz NBAWOWWRAGEXGE-JTQLQIEISA-N -1 3 371.466 3.686 20 0 FHADHM COc1ccccc1[C@@H](C)CC(=O)Nc1sc(C)c(C)c1-c1nn[n-]n1 ZINC000737142358 598647346 /nfs/dbraw/zinc/64/73/46/598647346.db2.gz NBAWOWWRAGEXGE-JTQLQIEISA-N -1 3 371.466 3.686 20 0 FHADHM CC[C@@H](NC(=O)CSc1ccc(-c2nnn[n-]2)cc1)c1ccc(C)cc1 ZINC000736363113 598648237 /nfs/dbraw/zinc/64/82/37/598648237.db2.gz MLWQGJBBLRYGMJ-QGZVFWFLSA-N -1 3 367.478 3.535 20 0 FHADHM CC[C@@H](NC(=O)CSc1ccc(-c2nn[n-]n2)cc1)c1ccc(C)cc1 ZINC000736363113 598648238 /nfs/dbraw/zinc/64/82/38/598648238.db2.gz MLWQGJBBLRYGMJ-QGZVFWFLSA-N -1 3 367.478 3.535 20 0 FHADHM COc1cc(CNc2ccc(-c3nnn[n-]3)c(Cl)c2)ccc1OC(C)C ZINC000737047631 598648794 /nfs/dbraw/zinc/64/87/94/598648794.db2.gz NPWVTXURMRKNRK-UHFFFAOYSA-N -1 3 373.844 3.928 20 0 FHADHM COc1cc(CNc2ccc(-c3nn[n-]n3)c(Cl)c2)ccc1OC(C)C ZINC000737047631 598648795 /nfs/dbraw/zinc/64/87/95/598648795.db2.gz NPWVTXURMRKNRK-UHFFFAOYSA-N -1 3 373.844 3.928 20 0 FHADHM CCN(C(=O)CSc1ccc(-c2nnn[n-]2)cc1)c1ccccc1Cl ZINC000736506246 598652132 /nfs/dbraw/zinc/65/21/32/598652132.db2.gz ZKMIMLCGFLKRMK-UHFFFAOYSA-N -1 3 373.869 3.665 20 0 FHADHM CCN(C(=O)CSc1ccc(-c2nn[n-]n2)cc1)c1ccccc1Cl ZINC000736506246 598652134 /nfs/dbraw/zinc/65/21/34/598652134.db2.gz ZKMIMLCGFLKRMK-UHFFFAOYSA-N -1 3 373.869 3.665 20 0 FHADHM CN(CC(C)(C)C)C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736787834 598658398 /nfs/dbraw/zinc/65/83/98/598658398.db2.gz GFVSGCNHHIAQAL-UHFFFAOYSA-N -1 3 365.437 3.777 20 0 FHADHM CN(CC(C)(C)C)C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736787834 598658400 /nfs/dbraw/zinc/65/84/00/598658400.db2.gz GFVSGCNHHIAQAL-UHFFFAOYSA-N -1 3 365.437 3.777 20 0 FHADHM CC[C@H](C)CN(C)C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736322073 598666556 /nfs/dbraw/zinc/66/65/56/598666556.db2.gz HTOXGJUNNSTDQC-AWEZNQCLSA-N -1 3 365.437 3.777 20 0 FHADHM CC[C@H](C)CN(C)C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736322073 598666557 /nfs/dbraw/zinc/66/65/57/598666557.db2.gz HTOXGJUNNSTDQC-AWEZNQCLSA-N -1 3 365.437 3.777 20 0 FHADHM CC[C@H]1CCCN1C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736402586 598668470 /nfs/dbraw/zinc/66/84/70/598668470.db2.gz OKOIVAAUOIBZCE-INIZCTEOSA-N -1 3 363.421 3.674 20 0 FHADHM CC[C@H]1CCCN1C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736402586 598668473 /nfs/dbraw/zinc/66/84/73/598668473.db2.gz OKOIVAAUOIBZCE-INIZCTEOSA-N -1 3 363.421 3.674 20 0 FHADHM Cc1cc(C)c(-c2nnn[n-]2)c(NCc2ccc(Br)cc2C)n1 ZINC000737240456 598675666 /nfs/dbraw/zinc/67/56/66/598675666.db2.gz KZXNSCSDSFWZCR-UHFFFAOYSA-N -1 3 373.258 3.562 20 0 FHADHM Cc1cc(C)c(-c2nn[n-]n2)c(NCc2ccc(Br)cc2C)n1 ZINC000737240456 598675668 /nfs/dbraw/zinc/67/56/68/598675668.db2.gz KZXNSCSDSFWZCR-UHFFFAOYSA-N -1 3 373.258 3.562 20 0 FHADHM COc1ccccc1-c1cccc(NC(=O)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000737143653 598693211 /nfs/dbraw/zinc/69/32/11/598693211.db2.gz SCPHWAZMJLFNSF-UHFFFAOYSA-N -1 3 371.400 3.795 20 0 FHADHM COc1ccccc1-c1cccc(NC(=O)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000737143653 598693213 /nfs/dbraw/zinc/69/32/13/598693213.db2.gz SCPHWAZMJLFNSF-UHFFFAOYSA-N -1 3 371.400 3.795 20 0 FHADHM Cc1nc2ccccc2nc1CSCc1ccc(F)cc1-c1nnn[n-]1 ZINC000737489680 598694901 /nfs/dbraw/zinc/69/49/01/598694901.db2.gz KYKVBURELMIGBW-UHFFFAOYSA-N -1 3 366.425 3.691 20 0 FHADHM Cc1nc2ccccc2nc1CSCc1ccc(F)cc1-c1nn[n-]n1 ZINC000737489680 598694903 /nfs/dbraw/zinc/69/49/03/598694903.db2.gz KYKVBURELMIGBW-UHFFFAOYSA-N -1 3 366.425 3.691 20 0 FHADHM O=c1[nH]c2ccccc2cc1CSCc1cc(-c2nnn[n-]2)ccc1F ZINC000738372396 598713512 /nfs/dbraw/zinc/71/35/12/598713512.db2.gz PMTZUSYIJCCQJG-UHFFFAOYSA-N -1 3 367.409 3.693 20 0 FHADHM O=c1[nH]c2ccccc2cc1CSCc1cc(-c2nn[n-]n2)ccc1F ZINC000738372396 598713514 /nfs/dbraw/zinc/71/35/14/598713514.db2.gz PMTZUSYIJCCQJG-UHFFFAOYSA-N -1 3 367.409 3.693 20 0 FHADHM CCC(=CC(=O)Nc1sc(C)c(C)c1-c1nnn[n-]1)c1ccccc1 ZINC000736305830 598734706 /nfs/dbraw/zinc/73/47/06/598734706.db2.gz XCLKOCXOXAYHJJ-JLHYYAGUSA-N -1 3 353.451 3.977 20 0 FHADHM CCC(=CC(=O)Nc1sc(C)c(C)c1-c1nn[n-]n1)c1ccccc1 ZINC000736305830 598734708 /nfs/dbraw/zinc/73/47/08/598734708.db2.gz XCLKOCXOXAYHJJ-JLHYYAGUSA-N -1 3 353.451 3.977 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H](C)Cc2ccccc2)c1-c1nnn[n-]1 ZINC000736669258 598741864 /nfs/dbraw/zinc/74/18/64/598741864.db2.gz BDWIOJAJXKQMNJ-NSHDSACASA-N -1 3 355.467 3.616 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H](C)Cc2ccccc2)c1-c1nn[n-]n1 ZINC000736669258 598741865 /nfs/dbraw/zinc/74/18/65/598741865.db2.gz BDWIOJAJXKQMNJ-NSHDSACASA-N -1 3 355.467 3.616 20 0 FHADHM Cc1ccccc1[C@H](CC(C)C)NC(=O)c1sccc1-c1nnn[n-]1 ZINC000737422693 598764641 /nfs/dbraw/zinc/76/46/41/598764641.db2.gz OKOVARLIFYMRSD-HNNXBMFYSA-N -1 3 355.467 3.754 20 0 FHADHM Cc1ccccc1[C@H](CC(C)C)NC(=O)c1sccc1-c1nn[n-]n1 ZINC000737422693 598764642 /nfs/dbraw/zinc/76/46/42/598764642.db2.gz OKOVARLIFYMRSD-HNNXBMFYSA-N -1 3 355.467 3.754 20 0 FHADHM Cc1ccc(CNc2c(-c3nnn[n-]3)cnc3c(F)cc(F)cc32)s1 ZINC000737341468 598770822 /nfs/dbraw/zinc/77/08/22/598770822.db2.gz HUURWXLISSEXNY-UHFFFAOYSA-N -1 3 358.377 3.675 20 0 FHADHM Cc1ccc(CNc2c(-c3nn[n-]n3)cnc3c(F)cc(F)cc32)s1 ZINC000737341468 598770823 /nfs/dbraw/zinc/77/08/23/598770823.db2.gz HUURWXLISSEXNY-UHFFFAOYSA-N -1 3 358.377 3.675 20 0 FHADHM CCN(C(=O)Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1)C(C)C ZINC000736504645 598781931 /nfs/dbraw/zinc/78/19/31/598781931.db2.gz CGLNQEMYAZYFGS-UHFFFAOYSA-N -1 3 366.425 3.921 20 0 FHADHM CCN(C(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1)C(C)C ZINC000736504645 598781932 /nfs/dbraw/zinc/78/19/32/598781932.db2.gz CGLNQEMYAZYFGS-UHFFFAOYSA-N -1 3 366.425 3.921 20 0 FHADHM C[C@@H](OC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)C1CC1 ZINC000736163857 598785972 /nfs/dbraw/zinc/78/59/72/598785972.db2.gz RTEYAZLGUABQLW-GFCCVEGCSA-N -1 3 350.378 3.614 20 0 FHADHM C[C@@H](OC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)C1CC1 ZINC000736163857 598785973 /nfs/dbraw/zinc/78/59/73/598785973.db2.gz RTEYAZLGUABQLW-GFCCVEGCSA-N -1 3 350.378 3.614 20 0 FHADHM COc1ccc(Nc2cccc(F)c2-c2nnn[n-]2)cc1Br ZINC000737104947 598789011 /nfs/dbraw/zinc/78/90/11/598789011.db2.gz BNXJSRNQGFICTD-UHFFFAOYSA-N -1 3 364.178 3.521 20 0 FHADHM COc1ccc(Nc2cccc(F)c2-c2nn[n-]n2)cc1Br ZINC000737104947 598789013 /nfs/dbraw/zinc/78/90/13/598789013.db2.gz BNXJSRNQGFICTD-UHFFFAOYSA-N -1 3 364.178 3.521 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)N1CCC[C@H]1c1ccc(F)c(F)c1 ZINC000738150957 598799652 /nfs/dbraw/zinc/79/96/52/598799652.db2.gz DQGNOZPNILKVRW-INIZCTEOSA-N -1 3 370.363 3.514 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)N1CCC[C@H]1c1ccc(F)c(F)c1 ZINC000738150957 598799653 /nfs/dbraw/zinc/79/96/53/598799653.db2.gz DQGNOZPNILKVRW-INIZCTEOSA-N -1 3 370.363 3.514 20 0 FHADHM C[C@H]1C[C@@H]1C(=O)N(Cc1ccccc1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000736235643 598807378 /nfs/dbraw/zinc/80/73/78/598807378.db2.gz PCFDATMAQYMXMB-LRDDRELGSA-N -1 3 367.840 3.709 20 0 FHADHM C[C@H]1C[C@@H]1C(=O)N(Cc1ccccc1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000736235643 598807380 /nfs/dbraw/zinc/80/73/80/598807380.db2.gz PCFDATMAQYMXMB-LRDDRELGSA-N -1 3 367.840 3.709 20 0 FHADHM CCC[C@@H](CC1CCCCC1)C(=O)NCc1cccc(-c2nnn[n-]2)c1 ZINC000736423628 598821651 /nfs/dbraw/zinc/82/16/51/598821651.db2.gz WEZTZMGTWLAODU-SFHVURJKSA-N -1 3 355.486 3.870 20 0 FHADHM CCC[C@@H](CC1CCCCC1)C(=O)NCc1cccc(-c2nn[n-]n2)c1 ZINC000736423628 598821652 /nfs/dbraw/zinc/82/16/52/598821652.db2.gz WEZTZMGTWLAODU-SFHVURJKSA-N -1 3 355.486 3.870 20 0 FHADHM C[C@H](SCc1noc(-c2cccs2)n1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736192168 599325746 /nfs/dbraw/zinc/32/57/46/599325746.db2.gz LGVOLOLGZBQECH-JTQLQIEISA-N -1 3 370.463 3.973 20 0 FHADHM C[C@H](SCc1noc(-c2cccs2)n1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736192168 599325748 /nfs/dbraw/zinc/32/57/48/599325748.db2.gz LGVOLOLGZBQECH-JTQLQIEISA-N -1 3 370.463 3.973 20 0 FHADHM C[C@@H](S[C@@H](C)C(=O)N[C@H]1CCCC[C@H]1C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736189208 599327563 /nfs/dbraw/zinc/32/75/63/599327563.db2.gz OLMCSQQETPZMJG-WVZRYYJFSA-N -1 3 373.526 3.744 20 0 FHADHM C[C@@H](S[C@@H](C)C(=O)N[C@H]1CCCC[C@H]1C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736189208 599327566 /nfs/dbraw/zinc/32/75/66/599327566.db2.gz OLMCSQQETPZMJG-WVZRYYJFSA-N -1 3 373.526 3.744 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NCc1csc(-c2ccsc2)n1 ZINC000737296586 599328967 /nfs/dbraw/zinc/32/89/67/599328967.db2.gz LTNOXRAZZZBOJI-UHFFFAOYSA-N -1 3 354.464 3.972 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NCc1csc(-c2ccsc2)n1 ZINC000737296586 599328969 /nfs/dbraw/zinc/32/89/69/599328969.db2.gz LTNOXRAZZZBOJI-UHFFFAOYSA-N -1 3 354.464 3.972 20 0 FHADHM Cc1ccc(NC(=O)CS[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c(C)c1 ZINC000737356877 599329334 /nfs/dbraw/zinc/32/93/34/599329334.db2.gz JBNINXPHXYNDFY-AWEZNQCLSA-N -1 3 367.478 3.916 20 0 FHADHM Cc1ccc(NC(=O)CS[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c(C)c1 ZINC000737356877 599329336 /nfs/dbraw/zinc/32/93/36/599329336.db2.gz JBNINXPHXYNDFY-AWEZNQCLSA-N -1 3 367.478 3.916 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1CNc1ccc(Br)cc1C ZINC000821736280 607369415 /nfs/dbraw/zinc/36/94/15/607369415.db2.gz ILAOYTICESHCSR-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CNc1ccc(Br)cc1C ZINC000821736280 607369417 /nfs/dbraw/zinc/36/94/17/607369417.db2.gz ILAOYTICESHCSR-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM C[C@H](SCC(=O)N[C@@H]1CCC[C@@H](C)[C@@H]1C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736190497 599333131 /nfs/dbraw/zinc/33/31/31/599333131.db2.gz SMZGDWZAUXINKV-XJIUQZFPSA-N -1 3 373.526 3.602 20 0 FHADHM C[C@H](SCC(=O)N[C@@H]1CCC[C@@H](C)[C@@H]1C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736190497 599333134 /nfs/dbraw/zinc/33/31/34/599333134.db2.gz SMZGDWZAUXINKV-XJIUQZFPSA-N -1 3 373.526 3.602 20 0 FHADHM Cc1cccc(NC(=O)CS[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1C ZINC000737401560 599333830 /nfs/dbraw/zinc/33/38/30/599333830.db2.gz ZKVWASWDMXFXQK-CQSZACIVSA-N -1 3 367.478 3.916 20 0 FHADHM Cc1cccc(NC(=O)CS[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1C ZINC000737401560 599333833 /nfs/dbraw/zinc/33/38/33/599333833.db2.gz ZKVWASWDMXFXQK-CQSZACIVSA-N -1 3 367.478 3.916 20 0 FHADHM CSc1cccc(NC(=O)[C@@H](C)Sc2ccccc2-c2nnn[n-]2)c1 ZINC000821983111 599343134 /nfs/dbraw/zinc/34/31/34/599343134.db2.gz DTEYSQPWPYRWAZ-LLVKDONJSA-N -1 3 371.491 3.708 20 0 FHADHM CSc1cccc(NC(=O)[C@@H](C)Sc2ccccc2-c2nn[n-]n2)c1 ZINC000821983111 599343135 /nfs/dbraw/zinc/34/31/35/599343135.db2.gz DTEYSQPWPYRWAZ-LLVKDONJSA-N -1 3 371.491 3.708 20 0 FHADHM c1ccc(-c2noc(CCCSc3ccccc3-c3nnn[n-]3)n2)cc1 ZINC000823773567 599351421 /nfs/dbraw/zinc/35/14/21/599351421.db2.gz WBDGHRWDZZPCDM-UHFFFAOYSA-N -1 3 364.434 3.642 20 0 FHADHM c1ccc(-c2noc(CCCSc3ccccc3-c3nn[n-]n3)n2)cc1 ZINC000823773567 599351423 /nfs/dbraw/zinc/35/14/23/599351423.db2.gz WBDGHRWDZZPCDM-UHFFFAOYSA-N -1 3 364.434 3.642 20 0 FHADHM Brc1ccc(NCc2cc3ccccc3[nH]2)c(-c2nnn[n-]2)c1 ZINC000735369406 599363125 /nfs/dbraw/zinc/36/31/25/599363125.db2.gz SZVMDXPKBXOLMY-UHFFFAOYSA-N -1 3 369.226 3.723 20 0 FHADHM Brc1ccc(NCc2cc3ccccc3[nH]2)c(-c2nn[n-]n2)c1 ZINC000735369406 599363128 /nfs/dbraw/zinc/36/31/28/599363128.db2.gz SZVMDXPKBXOLMY-UHFFFAOYSA-N -1 3 369.226 3.723 20 0 FHADHM C[C@@H](CC(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCCC2)n1cccc1 ZINC000735978427 599369304 /nfs/dbraw/zinc/36/93/04/599369304.db2.gz WFRZJVGNYCWPIW-LBPRGKRZSA-N -1 3 370.482 3.588 20 0 FHADHM C[C@@H](CC(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCCC2)n1cccc1 ZINC000735978427 599369306 /nfs/dbraw/zinc/36/93/06/599369306.db2.gz WFRZJVGNYCWPIW-LBPRGKRZSA-N -1 3 370.482 3.588 20 0 FHADHM C[C@@H](NCc1ccc(-c2nnn[n-]2)cc1F)c1ncc(-c2ccccc2)o1 ZINC000820426685 599375385 /nfs/dbraw/zinc/37/53/85/599375385.db2.gz MJTGMLWLJCPZDM-GFCCVEGCSA-N -1 3 364.384 3.512 20 0 FHADHM C[C@@H](NCc1ccc(-c2nn[n-]n2)cc1F)c1ncc(-c2ccccc2)o1 ZINC000820426685 599375387 /nfs/dbraw/zinc/37/53/87/599375387.db2.gz MJTGMLWLJCPZDM-GFCCVEGCSA-N -1 3 364.384 3.512 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1CNc1ccc(OC2CCC2)c(F)c1 ZINC000821737558 607371729 /nfs/dbraw/zinc/37/17/29/607371729.db2.gz XTWSPLJLVLPOQZ-UHFFFAOYSA-N -1 3 369.400 3.558 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CNc1ccc(OC2CCC2)c(F)c1 ZINC000821737558 607371730 /nfs/dbraw/zinc/37/17/30/607371730.db2.gz XTWSPLJLVLPOQZ-UHFFFAOYSA-N -1 3 369.400 3.558 20 0 FHADHM C[C@H](CCC(C)(C)C)NC(=O)CCCCOc1cccc(-c2nnn[n-]2)c1 ZINC000735984976 599379913 /nfs/dbraw/zinc/37/99/13/599379913.db2.gz HUHQVIDJBBDGBZ-OAHLLOKOSA-N -1 3 373.501 3.747 20 0 FHADHM C[C@H](CCC(C)(C)C)NC(=O)CCCCOc1cccc(-c2nn[n-]n2)c1 ZINC000735984976 599379916 /nfs/dbraw/zinc/37/99/16/599379916.db2.gz HUHQVIDJBBDGBZ-OAHLLOKOSA-N -1 3 373.501 3.747 20 0 FHADHM Cc1cc(-c2nn[n-]n2)cc(C)c1OCc1cc(-c2cccs2)on1 ZINC000822130456 599387137 /nfs/dbraw/zinc/38/71/37/599387137.db2.gz TUUXIJUNTOLOIH-UHFFFAOYSA-N -1 3 353.407 3.779 20 0 FHADHM Fc1ccc(COc2ccc(OCC(F)(F)F)cc2)c(-c2nnn[n-]2)c1 ZINC000822771764 599389629 /nfs/dbraw/zinc/38/96/29/599389629.db2.gz MBFKWBNINNLDPT-UHFFFAOYSA-N -1 3 368.290 3.526 20 0 FHADHM Fc1ccc(COc2ccc(OCC(F)(F)F)cc2)c(-c2nn[n-]n2)c1 ZINC000822771764 599389631 /nfs/dbraw/zinc/38/96/31/599389631.db2.gz MBFKWBNINNLDPT-UHFFFAOYSA-N -1 3 368.290 3.526 20 0 FHADHM CCOc1cc(Cl)ccc1NCc1cc(-c2nnn[n-]2)ccc1OC ZINC000821395374 607372741 /nfs/dbraw/zinc/37/27/41/607372741.db2.gz XREBGTFUEJRYQZ-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM CCOc1cc(Cl)ccc1NCc1cc(-c2nn[n-]n2)ccc1OC ZINC000821395374 607372743 /nfs/dbraw/zinc/37/27/43/607372743.db2.gz XREBGTFUEJRYQZ-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM Cc1cc([C@H](C)NC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c(C)s1 ZINC000822191344 599407853 /nfs/dbraw/zinc/40/78/53/599407853.db2.gz IUPUYKTUNVJJLL-RYUDHWBXSA-N -1 3 370.482 3.666 20 0 FHADHM Cc1cc([C@H](C)NC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c(C)s1 ZINC000822191344 599407855 /nfs/dbraw/zinc/40/78/55/599407855.db2.gz IUPUYKTUNVJJLL-RYUDHWBXSA-N -1 3 370.482 3.666 20 0 FHADHM O=C(NCc1ccc(-c2nnn[n-]2)cc1)N1CCCC2(C1)CCCCCC2 ZINC000823246341 599410606 /nfs/dbraw/zinc/41/06/06/599410606.db2.gz LNRFXDWODIJTGO-UHFFFAOYSA-N -1 3 368.485 3.513 20 0 FHADHM O=C(NCc1ccc(-c2nn[n-]n2)cc1)N1CCCC2(C1)CCCCCC2 ZINC000823246341 599410609 /nfs/dbraw/zinc/41/06/09/599410609.db2.gz LNRFXDWODIJTGO-UHFFFAOYSA-N -1 3 368.485 3.513 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c(C)c1 ZINC000822229421 599418542 /nfs/dbraw/zinc/41/85/42/599418542.db2.gz UPAISJDMSPCKOP-GJZGRUSLSA-N -1 3 364.453 3.605 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c(C)c1 ZINC000822229421 599418545 /nfs/dbraw/zinc/41/85/45/599418545.db2.gz UPAISJDMSPCKOP-GJZGRUSLSA-N -1 3 364.453 3.605 20 0 FHADHM CCn1c(CCNc2cc(Cl)ccc2-c2nnn[n-]2)nc2ccccc21 ZINC000736720962 599420126 /nfs/dbraw/zinc/42/01/26/599420126.db2.gz ZIDZZQPBSJIOMU-UHFFFAOYSA-N -1 3 367.844 3.544 20 0 FHADHM CCn1c(CCNc2cc(Cl)ccc2-c2nn[n-]n2)nc2ccccc21 ZINC000736720962 599420128 /nfs/dbraw/zinc/42/01/28/599420128.db2.gz ZIDZZQPBSJIOMU-UHFFFAOYSA-N -1 3 367.844 3.544 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(NCCCc2nc3c(s2)CCCC3)c1 ZINC000737571197 599427298 /nfs/dbraw/zinc/42/72/98/599427298.db2.gz VYTPHCYQQBZXFR-UHFFFAOYSA-N -1 3 374.901 3.900 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(NCCCc2nc3c(s2)CCCC3)c1 ZINC000737571197 599427301 /nfs/dbraw/zinc/42/73/01/599427301.db2.gz VYTPHCYQQBZXFR-UHFFFAOYSA-N -1 3 374.901 3.900 20 0 FHADHM Cc1ccccc1OCCCNc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000737430834 599429291 /nfs/dbraw/zinc/42/92/91/599429291.db2.gz AAGKSIJLJHUGQY-UHFFFAOYSA-N -1 3 360.421 3.604 20 0 FHADHM Cc1ccccc1OCCCNc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000737430834 599429293 /nfs/dbraw/zinc/42/92/93/599429293.db2.gz AAGKSIJLJHUGQY-UHFFFAOYSA-N -1 3 360.421 3.604 20 0 FHADHM O[C@@H](CNc1cc(Cl)ccc1-c1nnn[n-]1)c1ccc2ccccc2c1 ZINC000738385855 599435294 /nfs/dbraw/zinc/43/52/94/599435294.db2.gz ZCNOGQDDNYEFPQ-SFHVURJKSA-N -1 3 365.824 3.819 20 0 FHADHM O[C@@H](CNc1cc(Cl)ccc1-c1nn[n-]n1)c1ccc2ccccc2c1 ZINC000738385855 599435299 /nfs/dbraw/zinc/43/52/99/599435299.db2.gz ZCNOGQDDNYEFPQ-SFHVURJKSA-N -1 3 365.824 3.819 20 0 FHADHM CC(C)(C)[C@H]1OCCC[C@@H]1CNc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000735595219 599440878 /nfs/dbraw/zinc/44/08/78/599440878.db2.gz FFBCGKKONZIELH-ACJLOTCBSA-N -1 3 366.469 3.668 20 0 FHADHM CC(C)(C)[C@H]1OCCC[C@@H]1CNc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000735595219 599440882 /nfs/dbraw/zinc/44/08/82/599440882.db2.gz FFBCGKKONZIELH-ACJLOTCBSA-N -1 3 366.469 3.668 20 0 FHADHM C[C@H](CCC1CCCCC1)NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820243012 599440922 /nfs/dbraw/zinc/44/09/22/599440922.db2.gz SXIMFZDKQAYCEF-CABCVRRESA-N -1 3 370.501 3.976 20 0 FHADHM C[C@H](CCC1CCCCC1)NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820243012 599440923 /nfs/dbraw/zinc/44/09/23/599440923.db2.gz SXIMFZDKQAYCEF-CABCVRRESA-N -1 3 370.501 3.976 20 0 FHADHM Fc1cc(NCc2cccc(-c3nnn[n-]3)c2)ccc1OC1CCCC1 ZINC000822753218 599455323 /nfs/dbraw/zinc/45/53/23/599455323.db2.gz JIGYEKMQMJGJDU-UHFFFAOYSA-N -1 3 353.401 3.939 20 0 FHADHM Fc1cc(NCc2cccc(-c3nn[n-]n3)c2)ccc1OC1CCCC1 ZINC000822753218 599455324 /nfs/dbraw/zinc/45/53/24/599455324.db2.gz JIGYEKMQMJGJDU-UHFFFAOYSA-N -1 3 353.401 3.939 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1NCCc1cccc2cccnc21 ZINC000822586056 599468361 /nfs/dbraw/zinc/46/83/61/599468361.db2.gz RIHDLAWRXLHWHB-UHFFFAOYSA-N -1 3 350.813 3.723 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1NCCc1cccc2cccnc21 ZINC000822586056 599468362 /nfs/dbraw/zinc/46/83/62/599468362.db2.gz RIHDLAWRXLHWHB-UHFFFAOYSA-N -1 3 350.813 3.723 20 0 FHADHM Fc1ccc(NCc2ccc(F)cc2C(F)(F)F)c(-c2nnn[n-]2)c1 ZINC000822782962 599479161 /nfs/dbraw/zinc/47/91/61/599479161.db2.gz NUJSEJMCCUYWPU-UHFFFAOYSA-N -1 3 355.270 3.776 20 0 FHADHM Fc1ccc(NCc2ccc(F)cc2C(F)(F)F)c(-c2nn[n-]n2)c1 ZINC000822782962 599479162 /nfs/dbraw/zinc/47/91/62/599479162.db2.gz NUJSEJMCCUYWPU-UHFFFAOYSA-N -1 3 355.270 3.776 20 0 FHADHM Cc1cccc([C@H](C)NC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1C ZINC000822288545 599482317 /nfs/dbraw/zinc/48/23/17/599482317.db2.gz BBTPYLVFQAFKHI-GJZGRUSLSA-N -1 3 364.453 3.605 20 0 FHADHM Cc1cccc([C@H](C)NC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1C ZINC000822288545 599482318 /nfs/dbraw/zinc/48/23/18/599482318.db2.gz BBTPYLVFQAFKHI-GJZGRUSLSA-N -1 3 364.453 3.605 20 0 FHADHM Fc1ccc(N2CC[C@H](CNc3c(Cl)cccc3-c3nnn[n-]3)C2)cc1 ZINC000822779540 599493116 /nfs/dbraw/zinc/49/31/16/599493116.db2.gz WCFBMYLLJBFMIG-GFCCVEGCSA-N -1 3 372.835 3.598 20 0 FHADHM Fc1ccc(N2CC[C@H](CNc3c(Cl)cccc3-c3nn[n-]n3)C2)cc1 ZINC000822779540 599493119 /nfs/dbraw/zinc/49/31/19/599493119.db2.gz WCFBMYLLJBFMIG-GFCCVEGCSA-N -1 3 372.835 3.598 20 0 FHADHM CCC(=CC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(C)cc1 ZINC000820832772 599500325 /nfs/dbraw/zinc/50/03/25/599500325.db2.gz NPKMHRLSPFOWIY-WTNDLDAUSA-N -1 3 361.449 3.846 20 0 FHADHM CCC(=CC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(C)cc1 ZINC000820832772 599500327 /nfs/dbraw/zinc/50/03/27/599500327.db2.gz NPKMHRLSPFOWIY-WTNDLDAUSA-N -1 3 361.449 3.846 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1NCCc1ccc2ccccc2n1 ZINC000822585596 599501700 /nfs/dbraw/zinc/50/17/00/599501700.db2.gz GNZQJPAHAMXVLQ-UHFFFAOYSA-N -1 3 350.813 3.723 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1NCCc1ccc2ccccc2n1 ZINC000822585596 599501702 /nfs/dbraw/zinc/50/17/02/599501702.db2.gz GNZQJPAHAMXVLQ-UHFFFAOYSA-N -1 3 350.813 3.723 20 0 FHADHM Cc1ccc(C)c(N[C@H](C)C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c1 ZINC000737326891 599502846 /nfs/dbraw/zinc/50/28/46/599502846.db2.gz SYDAFAFBJHKEJK-GFCCVEGCSA-N -1 3 370.844 3.576 20 0 FHADHM Cc1ccc(C)c(N[C@H](C)C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c1 ZINC000737326891 599502848 /nfs/dbraw/zinc/50/28/48/599502848.db2.gz SYDAFAFBJHKEJK-GFCCVEGCSA-N -1 3 370.844 3.576 20 0 FHADHM CC(C)(C)OCc1cccc(CNc2ccc(F)cc2-c2nnn[n-]2)c1 ZINC000819950277 599515277 /nfs/dbraw/zinc/51/52/77/599515277.db2.gz HLRWAAFDFFLDLG-UHFFFAOYSA-N -1 3 355.417 3.933 20 0 FHADHM CC(C)(C)OCc1cccc(CNc2ccc(F)cc2-c2nn[n-]n2)c1 ZINC000819950277 599515279 /nfs/dbraw/zinc/51/52/79/599515279.db2.gz HLRWAAFDFFLDLG-UHFFFAOYSA-N -1 3 355.417 3.933 20 0 FHADHM C[C@@H](NC(=O)c1cc(Cl)cc(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820391430 599517102 /nfs/dbraw/zinc/51/71/02/599517102.db2.gz PSZIPFOYWKSPPL-SECBINFHSA-N -1 3 362.220 3.665 20 0 FHADHM C[C@@H](NC(=O)c1cc(Cl)cc(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820391430 599517104 /nfs/dbraw/zinc/51/71/04/599517104.db2.gz PSZIPFOYWKSPPL-SECBINFHSA-N -1 3 362.220 3.665 20 0 FHADHM C[C@H](SCCC(=O)Nc1cccc(-c2nnn[n-]2)c1)c1cccs1 ZINC000736187542 599524021 /nfs/dbraw/zinc/52/40/21/599524021.db2.gz BPHLVOIVSUDFQN-NSHDSACASA-N -1 3 359.480 3.751 20 0 FHADHM C[C@H](SCCC(=O)Nc1cccc(-c2nn[n-]n2)c1)c1cccs1 ZINC000736187542 599524022 /nfs/dbraw/zinc/52/40/22/599524022.db2.gz BPHLVOIVSUDFQN-NSHDSACASA-N -1 3 359.480 3.751 20 0 FHADHM CCS[C@@H]1CCCCN(c2ccc(-c3nn[n-]n3)cc2C(F)(F)F)C1 ZINC000736668093 599525791 /nfs/dbraw/zinc/52/57/91/599525791.db2.gz XHJHDSKLWNZVBI-GFCCVEGCSA-N -1 3 371.432 3.998 20 0 FHADHM C[C@H](NC(=O)CCc1ccc2ccccc2c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820328595 599528549 /nfs/dbraw/zinc/52/85/49/599528549.db2.gz PTBYKJJINPVAQG-HNNXBMFYSA-N -1 3 371.444 3.830 20 0 FHADHM C[C@H](NC(=O)CCc1ccc2ccccc2c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820328595 599528552 /nfs/dbraw/zinc/52/85/52/599528552.db2.gz PTBYKJJINPVAQG-HNNXBMFYSA-N -1 3 371.444 3.830 20 0 FHADHM Cc1ccc(C[C@H](C)Nc2cc(-c3nnn[n-]3)c3ccccc3n2)s1 ZINC000737335133 599529590 /nfs/dbraw/zinc/52/95/90/599529590.db2.gz QIJRETPXEZTZCN-NSHDSACASA-N -1 3 350.451 3.828 20 0 FHADHM Cc1ccc(C[C@H](C)Nc2cc(-c3nn[n-]n3)c3ccccc3n2)s1 ZINC000737335133 599529593 /nfs/dbraw/zinc/52/95/93/599529593.db2.gz QIJRETPXEZTZCN-NSHDSACASA-N -1 3 350.451 3.828 20 0 FHADHM Cc1cc(C)c(C=CC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1C ZINC000822194160 599532338 /nfs/dbraw/zinc/53/23/38/599532338.db2.gz LFJKRXYMTLVCAK-HLRDLLSLSA-N -1 3 361.449 3.683 20 0 FHADHM Cc1cc(C)c(C=CC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1C ZINC000822194160 599532340 /nfs/dbraw/zinc/53/23/40/599532340.db2.gz LFJKRXYMTLVCAK-HLRDLLSLSA-N -1 3 361.449 3.683 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)CCC(C)(C)C ZINC000736625540 599539564 /nfs/dbraw/zinc/53/95/64/599539564.db2.gz BHEPYKXNAFROAA-UHFFFAOYSA-N -1 3 352.822 3.651 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)CCC(C)(C)C ZINC000736625540 599539565 /nfs/dbraw/zinc/53/95/65/599539565.db2.gz BHEPYKXNAFROAA-UHFFFAOYSA-N -1 3 352.822 3.651 20 0 FHADHM O=C(CC/C=C/c1ccccc1)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000737825079 599540162 /nfs/dbraw/zinc/54/01/62/599540162.db2.gz JQGFYMDPGWYYAC-XBXARRHUSA-N -1 3 353.813 3.952 20 0 FHADHM O=C(CC/C=C/c1ccccc1)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000737825079 599540165 /nfs/dbraw/zinc/54/01/65/599540165.db2.gz JQGFYMDPGWYYAC-XBXARRHUSA-N -1 3 353.813 3.952 20 0 FHADHM CC(C)(C)CCC(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)nc1 ZINC000735602662 599541319 /nfs/dbraw/zinc/54/13/19/599541319.db2.gz FCXYBJAPTAEZTE-UHFFFAOYSA-N -1 3 366.425 3.819 20 0 FHADHM CCN(C(=O)[C@H](C)c1cccs1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736502379 599542193 /nfs/dbraw/zinc/54/21/93/599542193.db2.gz MDOUUTSQNZRAIE-CHWSQXEVSA-N -1 3 355.467 3.641 20 0 FHADHM CCN(C(=O)[C@H](C)c1cccs1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736502379 599542195 /nfs/dbraw/zinc/54/21/95/599542195.db2.gz MDOUUTSQNZRAIE-CHWSQXEVSA-N -1 3 355.467 3.641 20 0 FHADHM CC[C@H](CC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccc(C)cc1 ZINC000736330316 599543980 /nfs/dbraw/zinc/54/39/80/599543980.db2.gz CFKIHBNAWJIUSW-CYBMUJFWSA-N -1 3 353.401 3.837 20 0 FHADHM CC[C@H](CC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccc(C)cc1 ZINC000736330316 599543982 /nfs/dbraw/zinc/54/39/82/599543982.db2.gz CFKIHBNAWJIUSW-CYBMUJFWSA-N -1 3 353.401 3.837 20 0 FHADHM CC(C)CCN(C)C(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735803322 599563632 /nfs/dbraw/zinc/56/36/32/599563632.db2.gz AZWAGMQPDDKCEN-UHFFFAOYSA-N -1 3 364.453 3.728 20 0 FHADHM CC[C@@H](C)[C@@H](C)NC(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736335543 599564543 /nfs/dbraw/zinc/56/45/43/599564543.db2.gz YSOJPDZBMJHCTP-ZIAGYGMSSA-N -1 3 364.453 3.775 20 0 FHADHM O=C(c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1)N1CCC[C@H]1C1CC1 ZINC000738273816 599569002 /nfs/dbraw/zinc/56/90/02/599569002.db2.gz NLVCVZSSJLOEFH-IBGZPJMESA-N -1 3 374.448 3.625 20 0 FHADHM Cc1cccc([C@H]2CCCN2c2ncc(-c3nnn[n-]3)cc2Cl)c1C ZINC000822299893 599578204 /nfs/dbraw/zinc/57/82/04/599578204.db2.gz YNHJVAUOZKITNT-MRXNPFEDSA-N -1 3 354.845 3.873 20 0 FHADHM Cc1cccc([C@H]2CCCN2c2ncc(-c3nn[n-]n3)cc2Cl)c1C ZINC000822299893 599578206 /nfs/dbraw/zinc/57/82/06/599578206.db2.gz YNHJVAUOZKITNT-MRXNPFEDSA-N -1 3 354.845 3.873 20 0 FHADHM CC[C@@H](SCC(=O)Nc1cccc(-c2nnn[n-]2)c1)c1ccc(F)cc1 ZINC000736393338 599599052 /nfs/dbraw/zinc/59/90/52/599599052.db2.gz XCZDDLDQVREQDI-MRXNPFEDSA-N -1 3 371.441 3.829 20 0 FHADHM CC[C@@H](SCC(=O)Nc1cccc(-c2nn[n-]n2)c1)c1ccc(F)cc1 ZINC000736393338 599599054 /nfs/dbraw/zinc/59/90/54/599599054.db2.gz XCZDDLDQVREQDI-MRXNPFEDSA-N -1 3 371.441 3.829 20 0 FHADHM CC(C)(NC(=O)Nc1ccc(-c2nnn[n-]2)cc1)c1cccc(Cl)c1 ZINC000735671824 599599185 /nfs/dbraw/zinc/59/91/85/599599185.db2.gz MENPWRXFTJXAQL-UHFFFAOYSA-N -1 3 356.817 3.577 20 0 FHADHM CC(C)(NC(=O)Nc1ccc(-c2nn[n-]n2)cc1)c1cccc(Cl)c1 ZINC000735671824 599599187 /nfs/dbraw/zinc/59/91/87/599599187.db2.gz MENPWRXFTJXAQL-UHFFFAOYSA-N -1 3 356.817 3.577 20 0 FHADHM CC(C)(NC(=O)Nc1cccc(-c2nnn[n-]2)c1)c1cccc(Cl)c1 ZINC000735671717 599599555 /nfs/dbraw/zinc/59/95/55/599599555.db2.gz CSNHGLJXQRAREZ-UHFFFAOYSA-N -1 3 356.817 3.577 20 0 FHADHM CC(C)(NC(=O)Nc1cccc(-c2nn[n-]n2)c1)c1cccc(Cl)c1 ZINC000735671717 599599556 /nfs/dbraw/zinc/59/95/56/599599556.db2.gz CSNHGLJXQRAREZ-UHFFFAOYSA-N -1 3 356.817 3.577 20 0 FHADHM CS[C@H]1CCCCN(c2ccc(C(F)(F)F)cc2-c2nnn[n-]2)C1 ZINC000821956699 607386118 /nfs/dbraw/zinc/38/61/18/607386118.db2.gz VUFCHFAFXQAGSO-NSHDSACASA-N -1 3 357.405 3.607 20 0 FHADHM CS[C@H]1CCCCN(c2ccc(C(F)(F)F)cc2-c2nn[n-]n2)C1 ZINC000821956699 607386120 /nfs/dbraw/zinc/38/61/20/607386120.db2.gz VUFCHFAFXQAGSO-NSHDSACASA-N -1 3 357.405 3.607 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)NC(C)(C)c1cccc(Cl)c1 ZINC000737291498 599610708 /nfs/dbraw/zinc/61/07/08/599610708.db2.gz NFFVGQJECMAEBK-UHFFFAOYSA-N -1 3 370.844 3.885 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)NC(C)(C)c1cccc(Cl)c1 ZINC000737291498 599610709 /nfs/dbraw/zinc/61/07/09/599610709.db2.gz NFFVGQJECMAEBK-UHFFFAOYSA-N -1 3 370.844 3.885 20 0 FHADHM CC(=CC(=O)Nc1ccccc1-c1nnn[n-]1)c1cccc(C(F)(F)F)c1 ZINC000819765386 599627515 /nfs/dbraw/zinc/62/75/15/599627515.db2.gz PFDXJKQCFTVPLZ-PKNBQFBNSA-N -1 3 373.338 3.928 20 0 FHADHM CC(=CC(=O)Nc1ccccc1-c1nn[n-]n1)c1cccc(C(F)(F)F)c1 ZINC000819765386 599627516 /nfs/dbraw/zinc/62/75/16/599627516.db2.gz PFDXJKQCFTVPLZ-PKNBQFBNSA-N -1 3 373.338 3.928 20 0 FHADHM Cc1cc(F)cc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCC3)c1 ZINC000822203288 599628722 /nfs/dbraw/zinc/62/87/22/599628722.db2.gz MRFVBPDYZKAYRE-UHFFFAOYSA-N -1 3 357.414 3.507 20 0 FHADHM Cc1cc(F)cc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCC3)c1 ZINC000822203288 599628723 /nfs/dbraw/zinc/62/87/23/599628723.db2.gz MRFVBPDYZKAYRE-UHFFFAOYSA-N -1 3 357.414 3.507 20 0 FHADHM Cc1cc(F)cc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CC[C@H](C)C3)c1 ZINC000822203043 599628743 /nfs/dbraw/zinc/62/87/43/599628743.db2.gz BBIIBOPPZFDZSC-VIFPVBQESA-N -1 3 371.441 3.753 20 0 FHADHM Cc1cc(F)cc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CC[C@H](C)C3)c1 ZINC000822203043 599628744 /nfs/dbraw/zinc/62/87/44/599628744.db2.gz BBIIBOPPZFDZSC-VIFPVBQESA-N -1 3 371.441 3.753 20 0 FHADHM Cc1nc(-c2cccc(C(=O)Nc3ccccc3-c3nnn[n-]3)c2)cs1 ZINC000822420043 599628860 /nfs/dbraw/zinc/62/88/60/599628860.db2.gz YZVOTCUZWMPAJZ-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1nc(-c2cccc(C(=O)Nc3ccccc3-c3nn[n-]n3)c2)cs1 ZINC000822420043 599628861 /nfs/dbraw/zinc/62/88/61/599628861.db2.gz YZVOTCUZWMPAJZ-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM CCC(C)(C)CC(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)nc1 ZINC000820848261 599648117 /nfs/dbraw/zinc/64/81/17/599648117.db2.gz UPRVKDUVDLTUGS-UHFFFAOYSA-N -1 3 366.425 3.819 20 0 FHADHM Cc1cccc(NC(=O)CSc2ccc(-c3nnn[n-]3)cc2)c1Cl ZINC000822324252 599656251 /nfs/dbraw/zinc/65/62/51/599656251.db2.gz YDLILJOPPHFDQC-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1cccc(NC(=O)CSc2ccc(-c3nn[n-]n3)cc2)c1Cl ZINC000822324252 599656252 /nfs/dbraw/zinc/65/62/52/599656252.db2.gz YDLILJOPPHFDQC-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1c(F)cccc1NC(=O)CCCCOc1cccc(-c2nnn[n-]2)c1 ZINC000822035637 599657465 /nfs/dbraw/zinc/65/74/65/599657465.db2.gz XUFZCKWORCPAOW-UHFFFAOYSA-N -1 3 369.400 3.502 20 0 FHADHM Cc1c(F)cccc1NC(=O)CCCCOc1cccc(-c2nn[n-]n2)c1 ZINC000822035637 599657466 /nfs/dbraw/zinc/65/74/66/599657466.db2.gz XUFZCKWORCPAOW-UHFFFAOYSA-N -1 3 369.400 3.502 20 0 FHADHM CC(C)[C@H]1CC[C@@H](C)C[C@@H]1NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820683427 599667131 /nfs/dbraw/zinc/66/71/31/599667131.db2.gz AZSRRQVEJFWHPT-DTDBQYNISA-N -1 3 370.501 3.688 20 0 FHADHM CC(C)[C@H]1CC[C@@H](C)C[C@@H]1NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820683427 599667132 /nfs/dbraw/zinc/66/71/32/599667132.db2.gz AZSRRQVEJFWHPT-DTDBQYNISA-N -1 3 370.501 3.688 20 0 FHADHM CC[C@](C)(NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000820852633 599675106 /nfs/dbraw/zinc/67/51/06/599675106.db2.gz DOVOMUYCQCKKJV-VLIAUNLRSA-N -1 3 364.453 3.552 20 0 FHADHM CC[C@](C)(NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000820852633 599675107 /nfs/dbraw/zinc/67/51/07/599675107.db2.gz DOVOMUYCQCKKJV-VLIAUNLRSA-N -1 3 364.453 3.552 20 0 FHADHM C[C@H](CCOc1ccccc1)C(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820248587 599684194 /nfs/dbraw/zinc/68/41/94/599684194.db2.gz KTILHLGPXPRILS-HUUCEWRRSA-N -1 3 366.421 3.576 20 0 FHADHM C[C@H](CCOc1ccccc1)C(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820248587 599684195 /nfs/dbraw/zinc/68/41/95/599684195.db2.gz KTILHLGPXPRILS-HUUCEWRRSA-N -1 3 366.421 3.576 20 0 FHADHM COc1ccc2cc([C@H](C)OC(=O)c3cccc(-c4nnn[n-]4)c3)ccc2c1 ZINC000821854811 599684801 /nfs/dbraw/zinc/68/48/01/599684801.db2.gz WINMQQWCVJACRT-ZDUSSCGKSA-N -1 3 374.400 3.947 20 0 FHADHM COc1ccc2cc([C@H](C)OC(=O)c3cccc(-c4nn[n-]n4)c3)ccc2c1 ZINC000821854811 599684802 /nfs/dbraw/zinc/68/48/02/599684802.db2.gz WINMQQWCVJACRT-ZDUSSCGKSA-N -1 3 374.400 3.947 20 0 FHADHM O=C(OC[C@H]1CCCS1)c1ccccc1-c1ccccc1-c1nnn[n-]1 ZINC000823400970 599685090 /nfs/dbraw/zinc/68/50/90/599685090.db2.gz MOJUXNYIFPEEOX-CYBMUJFWSA-N -1 3 366.446 3.586 20 0 FHADHM O=C(OC[C@H]1CCCS1)c1ccccc1-c1ccccc1-c1nn[n-]n1 ZINC000823400970 599685091 /nfs/dbraw/zinc/68/50/91/599685091.db2.gz MOJUXNYIFPEEOX-CYBMUJFWSA-N -1 3 366.446 3.586 20 0 FHADHM CSc1ccc(F)cc1CNc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000821985008 599686825 /nfs/dbraw/zinc/68/68/25/599686825.db2.gz XHHJKBIWJOHQPF-UHFFFAOYSA-N -1 3 366.425 3.888 20 0 FHADHM CSc1ccc(F)cc1CNc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000821985008 599686826 /nfs/dbraw/zinc/68/68/26/599686826.db2.gz XHHJKBIWJOHQPF-UHFFFAOYSA-N -1 3 366.425 3.888 20 0 FHADHM CCC(C)(C)CC(=O)N(Cc1ccco1)c1ccccc1-c1nnn[n-]1 ZINC000820848338 599689757 /nfs/dbraw/zinc/68/97/57/599689757.db2.gz VBCWVWUQLFFHRM-UHFFFAOYSA-N -1 3 353.426 3.819 20 0 FHADHM CCC(C)(C)CC(=O)N(Cc1ccco1)c1ccccc1-c1nn[n-]n1 ZINC000820848338 599689758 /nfs/dbraw/zinc/68/97/58/599689758.db2.gz VBCWVWUQLFFHRM-UHFFFAOYSA-N -1 3 353.426 3.819 20 0 FHADHM Cc1ccc(C(=O)C2CCN([C@@H](C(=O)[O-])c3ccc(F)cc3)CC2)cc1 ZINC000579967343 599711304 /nfs/dbraw/zinc/71/13/04/599711304.db2.gz DSZBDCQTEONNQA-LJQANCHMSA-N -1 3 355.409 3.855 20 0 FHADHM O=C([O-])Nc1ccc(CNC(=O)CN[C@@H](c2ccccc2)C2CCC2)cc1 ZINC000740025700 599793847 /nfs/dbraw/zinc/79/38/47/599793847.db2.gz UEZMSOIYQDMUSU-FQEVSTJZSA-N -1 3 367.449 3.524 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)O[C@@H](c1ccccc1)c1cccnc1 ZINC000826250986 607399529 /nfs/dbraw/zinc/39/95/29/607399529.db2.gz BNCYDGLZBGNEJU-IBGZPJMESA-N -1 3 371.400 3.517 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)O[C@@H](c1ccccc1)c1cccnc1 ZINC000826250986 607399531 /nfs/dbraw/zinc/39/95/31/607399531.db2.gz BNCYDGLZBGNEJU-IBGZPJMESA-N -1 3 371.400 3.517 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)O[C@@H](c1ccccc1)c1ccncc1 ZINC000826251644 607399861 /nfs/dbraw/zinc/39/98/61/607399861.db2.gz WOPAUPMXAZHEDR-IBGZPJMESA-N -1 3 371.400 3.517 20 0 FHADHM 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CCc1ccc(C(=O)Nc2ccc(OC(C)C)c(-c3nn[n-]n3)c2)s1 ZINC000821475811 607403696 /nfs/dbraw/zinc/40/36/96/607403696.db2.gz AEJVXPOVSFNVLY-UHFFFAOYSA-N -1 3 357.439 3.530 20 0 FHADHM O=C([O-])c1ccc(NC(=O)CN[C@H](c2ccc(Cl)cc2)C2CC2)cc1 ZINC000739307464 600049246 /nfs/dbraw/zinc/04/92/46/600049246.db2.gz NZYADWIOKZTTNT-SFHVURJKSA-N -1 3 358.825 3.718 20 0 FHADHM C[C@H](C(=O)Nc1cccc(CSCCC(=O)[O-])c1)N1[C@H](C)CC[C@@H]1C ZINC000736762747 600109624 /nfs/dbraw/zinc/10/96/24/600109624.db2.gz LUQJMMNZNHOKHN-QLFBSQMISA-N -1 3 364.511 3.594 20 0 FHADHM CC(C)C[C@@H]1CCN(C(=O)Nc2ccc(OC(C)C)c(-c3nnn[n-]3)c2)C1 ZINC000820068147 607423595 /nfs/dbraw/zinc/42/35/95/607423595.db2.gz OIHUKDHDKPOJHG-AWEZNQCLSA-N -1 3 372.473 3.554 20 0 FHADHM CC(C)C[C@@H]1CCN(C(=O)Nc2ccc(OC(C)C)c(-c3nn[n-]n3)c2)C1 ZINC000820068147 607423597 /nfs/dbraw/zinc/42/35/97/607423597.db2.gz OIHUKDHDKPOJHG-AWEZNQCLSA-N -1 3 372.473 3.554 20 0 FHADHM Cc1cc(C)cc([C@@H](C)N[C@H](C)C(=O)Nc2cc(C(=O)[O-])ccc2C)c1 ZINC000738364506 600139794 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Cc1cc(C)c(NC(=O)CN[C@H](c2ccccc2)[C@H](C)C(=O)[O-])c(Cl)c1 ZINC000832875528 601655003 /nfs/dbraw/zinc/65/50/03/601655003.db2.gz YYARXAXWHCADSO-LIRRHRJNSA-N -1 3 374.868 3.947 20 0 FHADHM CC(C)CNC(=O)c1cccc(CN[C@@H](c2ccccc2)[C@H](C)C(=O)[O-])c1 ZINC000826891265 601658059 /nfs/dbraw/zinc/65/80/59/601658059.db2.gz MILZHROTZWUDFF-OXJNMPFZSA-N -1 3 368.477 3.624 20 0 FHADHM Cc1ccc(Cl)cc1NC(=O)CN[C@H](c1ccccc1)[C@@H](C)C(=O)[O-] ZINC000832934314 601658584 /nfs/dbraw/zinc/65/85/84/601658584.db2.gz CNRWMRIPAXOCRG-ACJLOTCBSA-N -1 3 360.841 3.639 20 0 FHADHM O=C([O-])CC1(NCc2coc(-c3ccc(F)c(F)c3)n2)CCCCC1 ZINC000833205384 601882499 /nfs/dbraw/zinc/88/24/99/601882499.db2.gz BYHPXWQSFJISEW-UHFFFAOYSA-N -1 3 350.365 3.887 20 0 FHADHM C[C@H]1C[C@H](NC(=O)Nc2cccc(NC(=O)[O-])c2)CN1Cc1ccccc1 ZINC000828178024 601930556 /nfs/dbraw/zinc/93/05/56/601930556.db2.gz YUOUMRPSSHZLIR-KSSFIOAISA-N -1 3 368.437 3.561 20 0 FHADHM C[C@H](c1nnc(-c2ccc(Cl)cc2Cl)o1)N1C[C@H](C(=O)[O-])[C@H](C)C1 ZINC000828421483 601964098 /nfs/dbraw/zinc/96/40/98/601964098.db2.gz GDADWBHLTXXLSC-LNLATYFQSA-N -1 3 370.236 3.757 20 0 FHADHM C[C@@H](CCC(=O)OCc1cc(-c2nnn[n-]2)ccc1F)c1ccccc1 ZINC000824400274 607540229 /nfs/dbraw/zinc/54/02/29/607540229.db2.gz DJNOOQVUDBKGJG-ZDUSSCGKSA-N -1 3 354.385 3.633 20 0 FHADHM C[C@@H](CCC(=O)OCc1cc(-c2nn[n-]n2)ccc1F)c1ccccc1 ZINC000824400274 607540230 /nfs/dbraw/zinc/54/02/30/607540230.db2.gz DJNOOQVUDBKGJG-ZDUSSCGKSA-N -1 3 354.385 3.633 20 0 FHADHM Cc1nccn1[C@H]1CCCN([C@H](C(=O)[O-])c2cc(Cl)cc(Cl)c2)C1 ZINC000833011554 602040379 /nfs/dbraw/zinc/04/03/79/602040379.db2.gz YAZVDJPMNUAMJI-HOTGVXAUSA-N -1 3 368.264 3.961 20 0 FHADHM COc1cc(OC)cc([C@H](N[C@H]2CCc3cc(Cl)ccc32)C(=O)[O-])c1 ZINC000832051527 602168430 /nfs/dbraw/zinc/16/84/30/602168430.db2.gz WETZLYMYMQRGDG-ROUUACIJSA-N -1 3 361.825 3.760 20 0 FHADHM COc1cc(OC)cc([C@H](NCc2ccc(OC(C)(C)C)cc2)C(=O)[O-])c1 ZINC000832058069 602168898 /nfs/dbraw/zinc/16/88/98/602168898.db2.gz VEXBBWRYPBCXPA-IBGZPJMESA-N -1 3 373.449 3.797 20 0 FHADHM CCC(C)(C)[C@H]1CCCN1C(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000825039232 607548126 /nfs/dbraw/zinc/54/81/26/607548126.db2.gz OQSREHROHPKDOV-MRXNPFEDSA-N -1 3 373.526 3.527 20 0 FHADHM CCC(C)(C)[C@H]1CCCN1C(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000825039232 607548128 /nfs/dbraw/zinc/54/81/28/607548128.db2.gz OQSREHROHPKDOV-MRXNPFEDSA-N -1 3 373.526 3.527 20 0 FHADHM CC[C@@](C)(CC(=O)[O-])NCc1ncc(-c2ccc(Br)cc2)o1 ZINC000828671525 602217836 /nfs/dbraw/zinc/21/78/36/602217836.db2.gz FAFSCCRHZGIXIU-INIZCTEOSA-N -1 3 367.243 3.837 20 0 FHADHM Cc1c([C@H](C)NCc2cccc(C(=O)[O-])c2)cnn1-c1ccc(F)cc1 ZINC000832854375 602232648 /nfs/dbraw/zinc/23/26/48/602232648.db2.gz WSYPDISEKVFIBV-ZDUSSCGKSA-N -1 3 353.397 3.869 20 0 FHADHM C[C@@H](NC(=O)[O-])[C@@H]1CCCCN1Cc1ccc(OCc2ccccn2)cc1 ZINC000738999823 602259790 /nfs/dbraw/zinc/25/97/90/602259790.db2.gz IHXQBAAPHWHXHW-UZLBHIALSA-N -1 3 369.465 3.671 20 0 FHADHM CN(CC1CCN(Cc2ccccc2Oc2cccnc2)CC1)C(=O)[O-] ZINC000739666616 602381668 /nfs/dbraw/zinc/38/16/68/602381668.db2.gz SKYMJUMQOXOKEG-UHFFFAOYSA-N -1 3 355.438 3.696 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)c1ccc(Cl)c(C(F)(F)F)c1 ZINC000132810992 607570456 /nfs/dbraw/zinc/57/04/56/607570456.db2.gz YWZUVFMZOHJMCP-UHFFFAOYSA-N -1 3 367.718 3.791 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)c1ccc(Cl)c(C(F)(F)F)c1 ZINC000132810992 607570457 /nfs/dbraw/zinc/57/04/57/607570457.db2.gz YWZUVFMZOHJMCP-UHFFFAOYSA-N -1 3 367.718 3.791 20 0 FHADHM O=C([O-])NCCCNCc1csc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000740652271 602877449 /nfs/dbraw/zinc/87/74/49/602877449.db2.gz LMFDYNMZOYEMJY-UHFFFAOYSA-N -1 3 359.373 3.576 20 0 FHADHM C[C@@H](NCc1ccc(NC(=O)[O-])nc1)c1ccc(Br)cc1 ZINC000825502858 603529414 /nfs/dbraw/zinc/52/94/14/603529414.db2.gz LSIJZCUYTQTSIB-SNVBAGLBSA-N -1 3 350.216 3.785 20 0 FHADHM CC[C@@H](NC[C@H]1CCCN(C(=O)[O-])C1)c1nc(C(F)(F)F)cs1 ZINC000826620666 603604014 /nfs/dbraw/zinc/60/40/14/603604014.db2.gz SNFKJUVFCDFVSZ-NXEZZACHSA-N -1 3 351.394 3.593 20 0 FHADHM c1csc(CCNc2nc(-c3cccc(-c4nnn[n-]4)c3)cs2)c1 ZINC000826512569 607645208 /nfs/dbraw/zinc/64/52/08/607645208.db2.gz FXRWYICKRZKGRK-UHFFFAOYSA-N -1 3 354.464 3.706 20 0 FHADHM c1csc(CCNc2nc(-c3cccc(-c4nn[n-]n4)c3)cs2)c1 ZINC000826512569 607645210 /nfs/dbraw/zinc/64/52/10/607645210.db2.gz FXRWYICKRZKGRK-UHFFFAOYSA-N -1 3 354.464 3.706 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1ccc(OC2CCCC2)cc1 ZINC000826249924 607659115 /nfs/dbraw/zinc/65/91/15/607659115.db2.gz BMAGIELFVVALCR-UHFFFAOYSA-N -1 3 363.421 3.749 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1ccc(OC2CCCC2)cc1 ZINC000826249924 607659116 /nfs/dbraw/zinc/65/91/16/607659116.db2.gz BMAGIELFVVALCR-UHFFFAOYSA-N -1 3 363.421 3.749 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N(C)[C@H](C)c1ccc(Cl)cc1 ZINC000826243278 607660189 /nfs/dbraw/zinc/66/01/89/607660189.db2.gz BJXQRPHPCQHMME-GFCCVEGCSA-N -1 3 355.829 3.662 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N(C)[C@H](C)c1ccc(Cl)cc1 ZINC000826243278 607660190 /nfs/dbraw/zinc/66/01/90/607660190.db2.gz BJXQRPHPCQHMME-GFCCVEGCSA-N -1 3 355.829 3.662 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1ccccc1OC1CCCC1 ZINC000826250669 607667710 /nfs/dbraw/zinc/66/77/10/607667710.db2.gz LVXRAHWIPWYVMI-UHFFFAOYSA-N -1 3 363.421 3.749 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1ccccc1OC1CCCC1 ZINC000826250669 607667712 /nfs/dbraw/zinc/66/77/12/607667712.db2.gz LVXRAHWIPWYVMI-UHFFFAOYSA-N -1 3 363.421 3.749 20 0 FHADHM Cc1ccc(C)c2sc(NC(=O)c3ccc(-c4nnn[n-]4)cc3C)nc21 ZINC000826250445 607687380 /nfs/dbraw/zinc/68/73/80/607687380.db2.gz BJOSOXSIWMIKIJ-UHFFFAOYSA-N -1 3 364.434 3.654 20 0 FHADHM Cc1ccc(C)c2sc(NC(=O)c3ccc(-c4nn[n-]n4)cc3C)nc21 ZINC000826250445 607687382 /nfs/dbraw/zinc/68/73/82/607687382.db2.gz BJOSOXSIWMIKIJ-UHFFFAOYSA-N -1 3 364.434 3.654 20 0 FHADHM Cc1cccc(Oc2ccc(NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)cc2)c1 ZINC000826301280 607682936 /nfs/dbraw/zinc/68/29/36/607682936.db2.gz ZBZIHBLSGVGLGF-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM Cc1cccc(Oc2ccc(NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)cc2)c1 ZINC000826301280 607682938 /nfs/dbraw/zinc/68/29/38/607682938.db2.gz ZBZIHBLSGVGLGF-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM O=C([O-])[C@H](NCc1ccc2c(c1)COC2)c1cc(Cl)cc(Cl)c1 ZINC000833170638 604401324 /nfs/dbraw/zinc/40/13/24/604401324.db2.gz ZVZKZVGBYGYFRQ-MRXNPFEDSA-N -1 3 352.217 3.939 20 0 FHADHM C[C@H](Oc1ccc(CN(C)Cc2ccccc2N2CCCC2)cc1)C(=O)[O-] ZINC000833539122 604522996 /nfs/dbraw/zinc/52/29/96/604522996.db2.gz WSZIMZUOZCAWEV-KRWDZBQOSA-N -1 3 368.477 3.771 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1CCCC2(C1)CCCCCC2 ZINC000826245248 607696980 /nfs/dbraw/zinc/69/69/80/607696980.db2.gz RXTLHBYBTXUXFG-UHFFFAOYSA-N -1 3 353.470 3.752 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1CCCC2(C1)CCCCCC2 ZINC000826245248 607696982 /nfs/dbraw/zinc/69/69/82/607696982.db2.gz RXTLHBYBTXUXFG-UHFFFAOYSA-N -1 3 353.470 3.752 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1cccc(Oc2ccccn2)c1 ZINC000826250456 607698758 /nfs/dbraw/zinc/69/87/58/607698758.db2.gz BVCSWDWLJPIOHY-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1cccc(Oc2ccccn2)c1 ZINC000826250456 607698760 /nfs/dbraw/zinc/69/87/60/607698760.db2.gz BVCSWDWLJPIOHY-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1ccc(COC(C)(C)C)cc1 ZINC000826250404 607702496 /nfs/dbraw/zinc/70/24/96/607702496.db2.gz ZJJWVDXQWSNVBW-UHFFFAOYSA-N -1 3 365.437 3.743 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1ccc(COC(C)(C)C)cc1 ZINC000826250404 607702498 /nfs/dbraw/zinc/70/24/98/607702498.db2.gz ZJJWVDXQWSNVBW-UHFFFAOYSA-N -1 3 365.437 3.743 20 0 FHADHM C[C@]1(C(=O)[O-])CCN(Cc2coc(-c3ccc(C(F)(F)F)cc3)n2)C1 ZINC000566015158 604611430 /nfs/dbraw/zinc/61/14/30/604611430.db2.gz LYCMBBXMHQFCMX-INIZCTEOSA-N -1 3 354.328 3.657 20 0 FHADHM C[C@@H](Oc1ccc(CN2CCC[C@@H]2c2ccc3c(c2)OCO3)cc1)C(=O)[O-] ZINC000833538494 604631123 /nfs/dbraw/zinc/63/11/23/604631123.db2.gz CVACENGMLAAPIE-RDTXWAMCSA-N -1 3 369.417 3.604 20 0 FHADHM CCCCCCOCc1cccc(NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)c1 ZINC000825271718 607708345 /nfs/dbraw/zinc/70/83/45/607708345.db2.gz MXUKLYFQGIUUDH-UHFFFAOYSA-N -1 3 368.441 3.544 20 0 FHADHM CCCCCCOCc1cccc(NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)c1 ZINC000825271718 607708347 /nfs/dbraw/zinc/70/83/47/607708347.db2.gz MXUKLYFQGIUUDH-UHFFFAOYSA-N -1 3 368.441 3.544 20 0 FHADHM Cc1ccc(C)c([C@@H]2CCCN2C(=O)c2ccc(-c3nnn[n-]3)cc2C)c1 ZINC000826285076 607709376 /nfs/dbraw/zinc/70/93/76/607709376.db2.gz OWENGAUPOZNTOU-IBGZPJMESA-N -1 3 361.449 3.769 20 0 FHADHM Cc1ccc(C)c([C@@H]2CCCN2C(=O)c2ccc(-c3nn[n-]n3)cc2C)c1 ZINC000826285076 607709377 /nfs/dbraw/zinc/70/93/77/607709377.db2.gz OWENGAUPOZNTOU-IBGZPJMESA-N -1 3 361.449 3.769 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1CCC[C@@H]1CCC1CCCC1 ZINC000826244993 607710286 /nfs/dbraw/zinc/71/02/86/607710286.db2.gz KIYXBWGJUVMTAV-QGZVFWFLSA-N -1 3 353.470 3.750 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1CCC[C@@H]1CCC1CCCC1 ZINC000826244993 607710287 /nfs/dbraw/zinc/71/02/87/607710287.db2.gz KIYXBWGJUVMTAV-QGZVFWFLSA-N -1 3 353.470 3.750 20 0 FHADHM CC[C@H](CC(=O)Nc1cc(-c2nnn[n-]2)ccc1C)c1ccc(OC)cc1 ZINC000825080730 607711704 /nfs/dbraw/zinc/71/17/04/607711704.db2.gz BSJRWPFAULKPOI-CQSZACIVSA-N -1 3 365.437 3.706 20 0 FHADHM CC[C@H](CC(=O)Nc1cc(-c2nn[n-]n2)ccc1C)c1ccc(OC)cc1 ZINC000825080730 607711706 /nfs/dbraw/zinc/71/17/06/607711706.db2.gz BSJRWPFAULKPOI-CQSZACIVSA-N -1 3 365.437 3.706 20 0 FHADHM CCc1nc(C)c([C@@H](C)NC[C@H](NC(=O)[O-])c2ccccc2OC)s1 ZINC000827626513 604759002 /nfs/dbraw/zinc/75/90/02/604759002.db2.gz MDBFUBCWUJTARB-RISCZKNCSA-N -1 3 363.483 3.682 20 0 FHADHM COc1ccccc1[C@H](CN[C@@H](C)c1cnc2ccsc2c1)NC(=O)[O-] ZINC000829600290 604761196 /nfs/dbraw/zinc/76/11/96/604761196.db2.gz ZBKJINDAJNESBW-LRDDRELGSA-N -1 3 371.462 3.964 20 0 FHADHM FC(F)(F)CCCCOc1ccc(Br)cc1-c1nnn[n-]1 ZINC000826367595 607713403 /nfs/dbraw/zinc/71/34/03/607713403.db2.gz GFQZMKSFWXQFMX-UHFFFAOYSA-N -1 3 365.153 3.741 20 0 FHADHM FC(F)(F)CCCCOc1ccc(Br)cc1-c1nn[n-]n1 ZINC000826367595 607713405 /nfs/dbraw/zinc/71/34/05/607713405.db2.gz GFQZMKSFWXQFMX-UHFFFAOYSA-N -1 3 365.153 3.741 20 0 FHADHM CN(C(=O)CN[C@@H](c1ccccc1)C(C)(C)C)c1ccccc1C(=O)[O-] ZINC000833685711 604922300 /nfs/dbraw/zinc/92/23/00/604922300.db2.gz KWTDVQCBLUXWCZ-IBGZPJMESA-N -1 3 354.450 3.725 20 0 FHADHM O=C([O-])NCCc1ccc(CN[C@H]2CCSc3c(F)cccc32)cc1 ZINC000832672425 604943585 /nfs/dbraw/zinc/94/35/85/604943585.db2.gz QFQJALQDPJEFRJ-KRWDZBQOSA-N -1 3 360.454 3.963 20 0 FHADHM Cc1nc(-c2ccc([C@H](C)N[C@H](C(=O)[O-])c3cccnc3)cc2)cs1 ZINC000832990627 604973881 /nfs/dbraw/zinc/97/38/81/604973881.db2.gz HICWMDOMNAKJBU-SGTLLEGYSA-N -1 3 353.447 3.990 20 0 FHADHM O=C([O-])c1occc1CNCc1ccccc1COCc1ccccc1 ZINC000833785135 605058413 /nfs/dbraw/zinc/05/84/13/605058413.db2.gz FMNQOUZCHZUUJI-UHFFFAOYSA-N -1 3 351.402 3.984 20 0 FHADHM CCc1oc(C(=O)[O-])cc1CN[C@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000833680202 605078674 /nfs/dbraw/zinc/07/86/74/605078674.db2.gz DXEZWNUROVHVAI-IBGZPJMESA-N -1 3 357.406 3.552 20 0 FHADHM Cc1noc(C)c1[C@H](C)CNc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000826339317 607734331 /nfs/dbraw/zinc/73/43/31/607734331.db2.gz ZHYQNOHCERTQRR-MRVPVSSYSA-N -1 3 366.347 3.706 20 0 FHADHM Cc1noc(C)c1[C@H](C)CNc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000826339317 607734332 /nfs/dbraw/zinc/73/43/32/607734332.db2.gz ZHYQNOHCERTQRR-MRVPVSSYSA-N -1 3 366.347 3.706 20 0 FHADHM C[C@@H](CC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(F)cc1F ZINC000824384586 607745326 /nfs/dbraw/zinc/74/53/26/607745326.db2.gz FFUMOHUIHMINRR-RYUDHWBXSA-N -1 3 371.391 3.516 20 0 FHADHM C[C@@H](CC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(F)cc1F ZINC000824384586 607745327 /nfs/dbraw/zinc/74/53/27/607745327.db2.gz FFUMOHUIHMINRR-RYUDHWBXSA-N -1 3 371.391 3.516 20 0 FHADHM CCCC[C@@H](CC)C(=O)Nc1ccc(NC(=O)OCC)c(-c2nnn[n-]2)c1 ZINC000825261124 607759676 /nfs/dbraw/zinc/75/96/76/607759676.db2.gz UYUOYEDWFQTXAF-GFCCVEGCSA-N -1 3 374.445 3.590 20 0 FHADHM CCCC[C@@H](CC)C(=O)Nc1ccc(NC(=O)OCC)c(-c2nn[n-]n2)c1 ZINC000825261124 607759677 /nfs/dbraw/zinc/75/96/77/607759677.db2.gz UYUOYEDWFQTXAF-GFCCVEGCSA-N -1 3 374.445 3.590 20 0 FHADHM COc1cccc(CN2CCC[C@H](C(C)(C)C(=O)[O-])C2)c1OC(F)F ZINC000833735544 605550440 /nfs/dbraw/zinc/55/04/40/605550440.db2.gz MRLLYLDSIDROEH-ZDUSSCGKSA-N -1 3 357.397 3.619 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)N1CC[C@H]1c1ccc(Cl)cc1 ZINC000826454364 607764723 /nfs/dbraw/zinc/76/47/23/607764723.db2.gz TWOMAKJDLKDXSV-HNNXBMFYSA-N -1 3 372.791 3.638 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)N1CC[C@H]1c1ccc(Cl)cc1 ZINC000826454364 607764724 /nfs/dbraw/zinc/76/47/24/607764724.db2.gz TWOMAKJDLKDXSV-HNNXBMFYSA-N -1 3 372.791 3.638 20 0 FHADHM O=C(CC1CCCC1)Nc1nc(-c2cccc(-c3nnn[n-]3)c2)cs1 ZINC000826403768 607769846 /nfs/dbraw/zinc/76/98/46/607769846.db2.gz BYYUMMQNMZKOSB-UHFFFAOYSA-N -1 3 354.439 3.509 20 0 FHADHM O=C(CC1CCCC1)Nc1nc(-c2cccc(-c3nn[n-]n3)c2)cs1 ZINC000826403768 607769847 /nfs/dbraw/zinc/76/98/47/607769847.db2.gz BYYUMMQNMZKOSB-UHFFFAOYSA-N -1 3 354.439 3.509 20 0 FHADHM Cc1ccccc1C(=O)Nc1nc(-c2cccc(-c3nnn[n-]3)c2)cs1 ZINC000826306031 607770460 /nfs/dbraw/zinc/77/04/60/607770460.db2.gz OLEIHFYZMXREHV-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1ccccc1C(=O)Nc1nc(-c2cccc(-c3nn[n-]n3)c2)cs1 ZINC000826306031 607770461 /nfs/dbraw/zinc/77/04/61/607770461.db2.gz OLEIHFYZMXREHV-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM C[C@@H]1CC[C@@H](NC(=O)CCc2ccc(-c3nnn[n-]3)cc2)c2ccccc21 ZINC000824914922 607772076 /nfs/dbraw/zinc/77/20/76/607772076.db2.gz ADKRCWJFKFUNBM-AUUYWEPGSA-N -1 3 361.449 3.554 20 0 FHADHM C[C@@H]1CC[C@@H](NC(=O)CCc2ccc(-c3nn[n-]n3)cc2)c2ccccc21 ZINC000824914922 607772077 /nfs/dbraw/zinc/77/20/77/607772077.db2.gz ADKRCWJFKFUNBM-AUUYWEPGSA-N -1 3 361.449 3.554 20 0 FHADHM O=C([O-])N1CCC[C@@H]1[C@H]1CCC[C@H]1NCc1nc(C(F)(F)F)cs1 ZINC000834103362 605989550 /nfs/dbraw/zinc/98/95/50/605989550.db2.gz AOJVXBBYQAGZEK-HBNTYKKESA-N -1 3 363.405 3.563 20 0 FHADHM CC[C@@H]1CN(C(=O)c2cccc(-c3nnn[n-]3)c2)CC[C@H]1c1ccccc1 ZINC000820988640 606029941 /nfs/dbraw/zinc/02/99/41/606029941.db2.gz GWURUWFWOMXIEI-DNVCBOLYSA-N -1 3 361.449 3.523 20 0 FHADHM CC[C@@H]1CN(C(=O)c2cccc(-c3nn[n-]n3)c2)CC[C@H]1c1ccccc1 ZINC000820988640 606029943 /nfs/dbraw/zinc/02/99/43/606029943.db2.gz GWURUWFWOMXIEI-DNVCBOLYSA-N -1 3 361.449 3.523 20 0 FHADHM CC[C@H]1CN(C(=O)c2cccc(-c3nnn[n-]3)c2)CC[C@@H]1c1ccccc1 ZINC000820988644 606029975 /nfs/dbraw/zinc/02/99/75/606029975.db2.gz GWURUWFWOMXIEI-KXBFYZLASA-N -1 3 361.449 3.523 20 0 FHADHM CC[C@H]1CN(C(=O)c2cccc(-c3nn[n-]n3)c2)CC[C@@H]1c1ccccc1 ZINC000820988644 606029976 /nfs/dbraw/zinc/02/99/76/606029976.db2.gz GWURUWFWOMXIEI-KXBFYZLASA-N -1 3 361.449 3.523 20 0 FHADHM CC[C@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)cc2)CC[C@H]1c1ccccc1 ZINC000820989300 606030653 /nfs/dbraw/zinc/03/06/53/606030653.db2.gz QCMZNAHMQBALSL-HNAYVOBHSA-N -1 3 361.449 3.523 20 0 FHADHM CC[C@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)cc2)CC[C@H]1c1ccccc1 ZINC000820989300 606030659 /nfs/dbraw/zinc/03/06/59/606030659.db2.gz QCMZNAHMQBALSL-HNAYVOBHSA-N -1 3 361.449 3.523 20 0 FHADHM CCCCOc1ccc([C@@H](C)Nc2ccc(-c3nnn[n-]3)nc2)cc1OC ZINC000821077727 606049708 /nfs/dbraw/zinc/04/97/08/606049708.db2.gz RHMXIRQISXEHKH-CYBMUJFWSA-N -1 3 368.441 3.622 20 0 FHADHM CCCCOc1ccc([C@@H](C)Nc2ccc(-c3nn[n-]n3)nc2)cc1OC ZINC000821077727 606049712 /nfs/dbraw/zinc/04/97/12/606049712.db2.gz RHMXIRQISXEHKH-CYBMUJFWSA-N -1 3 368.441 3.622 20 0 FHADHM C[C@@H](C(=O)Nc1cccc(-c2nnn[n-]2)c1)c1ccc(Cl)c(Cl)c1 ZINC000471671497 606099572 /nfs/dbraw/zinc/09/95/72/606099572.db2.gz NUMLBGJYYYCUEI-SECBINFHSA-N -1 3 362.220 3.916 20 0 FHADHM C[C@@H](C(=O)Nc1cccc(-c2nn[n-]n2)c1)c1ccc(Cl)c(Cl)c1 ZINC000471671497 606099575 /nfs/dbraw/zinc/09/95/75/606099575.db2.gz NUMLBGJYYYCUEI-SECBINFHSA-N -1 3 362.220 3.916 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)C/C=C/c1cccc(F)c1 ZINC000819975782 606126284 /nfs/dbraw/zinc/12/62/84/606126284.db2.gz CPXSDZYLYXUWMU-FNORWQNLSA-N -1 3 368.416 3.604 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)C/C=C/c1cccc(F)c1 ZINC000819975782 606126285 /nfs/dbraw/zinc/12/62/85/606126285.db2.gz CPXSDZYLYXUWMU-FNORWQNLSA-N -1 3 368.416 3.604 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)c2ccc(O[C@@H](C)CC)cc2)s1 ZINC000821466387 606126758 /nfs/dbraw/zinc/12/67/58/606126758.db2.gz WDFAAZBYVBFCTR-NSHDSACASA-N -1 3 371.466 3.920 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)c2ccc(O[C@@H](C)CC)cc2)s1 ZINC000821466387 606126760 /nfs/dbraw/zinc/12/67/60/606126760.db2.gz WDFAAZBYVBFCTR-NSHDSACASA-N -1 3 371.466 3.920 20 0 FHADHM Cc1c(Cl)cc(NC(=O)Cc2cccc(-c3nnn[n-]3)c2)cc1Cl ZINC000822034533 606131116 /nfs/dbraw/zinc/13/11/16/606131116.db2.gz GFGPMQAYJWAFIM-UHFFFAOYSA-N -1 3 362.220 3.663 20 0 FHADHM Cc1c(Cl)cc(NC(=O)Cc2cccc(-c3nn[n-]n3)c2)cc1Cl ZINC000822034533 606131117 /nfs/dbraw/zinc/13/11/17/606131117.db2.gz GFGPMQAYJWAFIM-UHFFFAOYSA-N -1 3 362.220 3.663 20 0 FHADHM CCN(C(=O)c1cccc2[nH]ccc21)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821160623 606136533 /nfs/dbraw/zinc/13/65/33/606136533.db2.gz NQNWAHFZILQFPH-ZDUSSCGKSA-N -1 3 360.421 3.571 20 0 FHADHM CCN(C(=O)c1cccc2[nH]ccc21)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821160623 606136534 /nfs/dbraw/zinc/13/65/34/606136534.db2.gz NQNWAHFZILQFPH-ZDUSSCGKSA-N -1 3 360.421 3.571 20 0 FHADHM O=C(Nc1sc2c(c1-c1nnn[n-]1)CCCCC2)[C@@H]1CC12CCCC2 ZINC000823387706 606147149 /nfs/dbraw/zinc/14/71/49/606147149.db2.gz VFSBJXUOSPIHHS-LBPRGKRZSA-N -1 3 357.483 3.716 20 0 FHADHM O=C(Nc1sc2c(c1-c1nn[n-]n1)CCCCC2)[C@@H]1CC12CCCC2 ZINC000823387706 606147151 /nfs/dbraw/zinc/14/71/51/606147151.db2.gz VFSBJXUOSPIHHS-LBPRGKRZSA-N -1 3 357.483 3.716 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1cccc2[nH]ccc21 ZINC000820087703 606150216 /nfs/dbraw/zinc/15/02/16/606150216.db2.gz XJVZPOLPSZVBFJ-UHFFFAOYSA-N -1 3 374.448 3.646 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1cccc2[nH]ccc21 ZINC000820087703 606150217 /nfs/dbraw/zinc/15/02/17/606150217.db2.gz XJVZPOLPSZVBFJ-UHFFFAOYSA-N -1 3 374.448 3.646 20 0 FHADHM CC(C)CN(C(=O)c1cccc2[nH]ccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000820081579 606150227 /nfs/dbraw/zinc/15/02/27/606150227.db2.gz LTFSOVMLMHPFKA-UHFFFAOYSA-N -1 3 360.421 3.651 20 0 FHADHM CC(C)CN(C(=O)c1cccc2[nH]ccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000820081579 606150228 /nfs/dbraw/zinc/15/02/28/606150228.db2.gz LTFSOVMLMHPFKA-UHFFFAOYSA-N -1 3 360.421 3.651 20 0 FHADHM Cc1ccc(CCCC(=O)O[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)s1 ZINC000822235969 606190347 /nfs/dbraw/zinc/19/03/47/606190347.db2.gz DOOOTWSNQFVRHJ-ZDUSSCGKSA-N -1 3 356.451 3.864 20 0 FHADHM Cc1ccc(CCCC(=O)O[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)s1 ZINC000822235969 606190348 /nfs/dbraw/zinc/19/03/48/606190348.db2.gz DOOOTWSNQFVRHJ-ZDUSSCGKSA-N -1 3 356.451 3.864 20 0 FHADHM Oc1ccc(C2CCN(c3cc(Cl)ccc3-c3nnn[n-]3)CC2)cc1 ZINC000823727179 606213957 /nfs/dbraw/zinc/21/39/57/606213957.db2.gz RRJLZVNIWQSUBD-UHFFFAOYSA-N -1 3 355.829 3.610 20 0 FHADHM Oc1ccc(C2CCN(c3cc(Cl)ccc3-c3nn[n-]n3)CC2)cc1 ZINC000823727179 606213958 /nfs/dbraw/zinc/21/39/58/606213958.db2.gz RRJLZVNIWQSUBD-UHFFFAOYSA-N -1 3 355.829 3.610 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@H](C)c1cccc(C)c1 ZINC000821118397 606281238 /nfs/dbraw/zinc/28/12/38/606281238.db2.gz LYHJXPAEQJRTOF-CQSZACIVSA-N -1 3 364.453 3.739 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cccc(F)c1Cl ZINC000821122964 606281718 /nfs/dbraw/zinc/28/17/18/606281718.db2.gz DPJCNTLPWZYVQV-UHFFFAOYSA-N -1 3 374.807 3.733 20 0 FHADHM CC(C)=C(C)C(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000820004981 606289452 /nfs/dbraw/zinc/28/94/52/606289452.db2.gz HIZBLNKZAGPTCZ-UHFFFAOYSA-N -1 3 353.451 3.568 20 0 FHADHM C/C=C(/C)C(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1 ZINC000820825846 606294177 /nfs/dbraw/zinc/29/41/77/606294177.db2.gz FNHDGHQMTQCHRJ-JYOAFUTRSA-N -1 3 353.357 3.703 20 0 FHADHM C/C=C(/C)C(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1 ZINC000820825846 606294178 /nfs/dbraw/zinc/29/41/78/606294178.db2.gz FNHDGHQMTQCHRJ-JYOAFUTRSA-N -1 3 353.357 3.703 20 0 FHADHM O=C(Nc1cccnc1)c1ccc(Sc2ccccc2-c2nnn[n-]2)cc1 ZINC000823372579 606313374 /nfs/dbraw/zinc/31/33/74/606313374.db2.gz GDACPOIQFZTPDU-UHFFFAOYSA-N -1 3 374.429 3.665 20 0 FHADHM O=C(Nc1cccnc1)c1ccc(Sc2ccccc2-c2nn[n-]n2)cc1 ZINC000823372579 606313375 /nfs/dbraw/zinc/31/33/75/606313375.db2.gz GDACPOIQFZTPDU-UHFFFAOYSA-N -1 3 374.429 3.665 20 0 FHADHM O=C(Nc1ccccc1)c1ccc(CNc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000823368006 606322818 /nfs/dbraw/zinc/32/28/18/606322818.db2.gz QVWGBLAGGNEOBP-UHFFFAOYSA-N -1 3 370.416 3.731 20 0 FHADHM O=C(Nc1ccccc1)c1ccc(CNc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000823368006 606322819 /nfs/dbraw/zinc/32/28/19/606322819.db2.gz QVWGBLAGGNEOBP-UHFFFAOYSA-N -1 3 370.416 3.731 20 0 FHADHM c1ccc(-n2nc(CSc3cccc(-c4nnn[n-]4)c3)c3c2CCC3)cc1 ZINC000823772779 606328713 /nfs/dbraw/zinc/32/87/13/606328713.db2.gz NQOMTGRXAAUYPU-UHFFFAOYSA-N -1 3 374.473 3.833 20 0 FHADHM c1ccc(-n2nc(CSc3cccc(-c4nn[n-]n4)c3)c3c2CCC3)cc1 ZINC000823772779 606328715 /nfs/dbraw/zinc/32/87/15/606328715.db2.gz NQOMTGRXAAUYPU-UHFFFAOYSA-N -1 3 374.473 3.833 20 0 FHADHM CCN(CC)C(=O)[C@@H](Sc1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000821169978 606328719 /nfs/dbraw/zinc/32/87/19/606328719.db2.gz KCZGKIOGMODXLL-KRWDZBQOSA-N -1 3 367.478 3.569 20 0 FHADHM CCN(CC)C(=O)[C@@H](Sc1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000821169978 606328721 /nfs/dbraw/zinc/32/87/21/606328721.db2.gz KCZGKIOGMODXLL-KRWDZBQOSA-N -1 3 367.478 3.569 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)Cc2coc3cc(F)ccc23)s1 ZINC000821466479 606335868 /nfs/dbraw/zinc/33/58/68/606335868.db2.gz XTOMMHPMDXSOSN-UHFFFAOYSA-N -1 3 371.397 3.557 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)Cc2coc3cc(F)ccc23)s1 ZINC000821466479 606335870 /nfs/dbraw/zinc/33/58/70/606335870.db2.gz XTOMMHPMDXSOSN-UHFFFAOYSA-N -1 3 371.397 3.557 20 0 FHADHM C[C@H](OC(=O)C1(c2cccc(Cl)c2)CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488028 606352370 /nfs/dbraw/zinc/35/23/70/606352370.db2.gz KJCASSSATCKYOA-LBPRGKRZSA-N -1 3 368.824 3.856 20 0 FHADHM C[C@H](OC(=O)C1(c2cccc(Cl)c2)CC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488028 606352371 /nfs/dbraw/zinc/35/23/71/606352371.db2.gz KJCASSSATCKYOA-LBPRGKRZSA-N -1 3 368.824 3.856 20 0 FHADHM Cc1ccc2c(CC(=O)O[C@H](C)c3ccc(-c4nnn[n-]4)cc3)c[nH]c2c1 ZINC000822275879 606356925 /nfs/dbraw/zinc/35/69/25/606356925.db2.gz ZATKNOARBSLJQE-CYBMUJFWSA-N -1 3 361.405 3.503 20 0 FHADHM Cc1ccc2c(CC(=O)O[C@H](C)c3ccc(-c4nn[n-]n4)cc3)c[nH]c2c1 ZINC000822275879 606356927 /nfs/dbraw/zinc/35/69/27/606356927.db2.gz ZATKNOARBSLJQE-CYBMUJFWSA-N -1 3 361.405 3.503 20 0 FHADHM C[C@H](OC(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488684 606357640 /nfs/dbraw/zinc/35/76/40/606357640.db2.gz RQGIHIUJJGQDGW-GDLCADMTSA-N -1 3 368.359 3.840 20 0 FHADHM C[C@H](OC(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488684 606357641 /nfs/dbraw/zinc/35/76/41/606357641.db2.gz RQGIHIUJJGQDGW-GDLCADMTSA-N -1 3 368.359 3.840 20 0 FHADHM CCCC[C@@H](CCC)NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000821042507 606385975 /nfs/dbraw/zinc/38/59/75/606385975.db2.gz CXZDOOBIWRLBSA-QGZVFWFLSA-N -1 3 370.501 3.900 20 0 FHADHM CCCC[C@@H](CCC)NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000821042507 606385976 /nfs/dbraw/zinc/38/59/76/606385976.db2.gz CXZDOOBIWRLBSA-QGZVFWFLSA-N -1 3 370.501 3.900 20 0 FHADHM C[C@H](OC(=O)c1cccn1Cc1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820512539 606399201 /nfs/dbraw/zinc/39/92/01/606399201.db2.gz LZOUMGIBWXTEDH-HNNXBMFYSA-N -1 3 373.416 3.635 20 0 FHADHM C[C@H](OC(=O)c1cccn1Cc1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820512539 606399202 /nfs/dbraw/zinc/39/92/02/606399202.db2.gz LZOUMGIBWXTEDH-HNNXBMFYSA-N -1 3 373.416 3.635 20 0 FHADHM Cc1ccccc1SCC(=O)N(C)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000822366932 606413088 /nfs/dbraw/zinc/41/30/88/606413088.db2.gz WXYOHHOHNXYLEM-UHFFFAOYSA-N -1 3 373.869 3.584 20 0 FHADHM Cc1ccccc1SCC(=O)N(C)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000822366932 606413089 /nfs/dbraw/zinc/41/30/89/606413089.db2.gz WXYOHHOHNXYLEM-UHFFFAOYSA-N -1 3 373.869 3.584 20 0 FHADHM O[C@@H](CCc1ccc(Nc2ncccc2-c2nnn[n-]2)cc1)c1ccccc1 ZINC000823674796 606433092 /nfs/dbraw/zinc/43/30/92/606433092.db2.gz RPUKXXDEBXNWQN-IBGZPJMESA-N -1 3 372.432 3.672 20 0 FHADHM O[C@@H](CCc1ccc(Nc2ncccc2-c2nn[n-]n2)cc1)c1ccccc1 ZINC000823674796 606433095 /nfs/dbraw/zinc/43/30/95/606433095.db2.gz RPUKXXDEBXNWQN-IBGZPJMESA-N -1 3 372.432 3.672 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1N(Cc1ccco1)Cc1ccccc1 ZINC000822563165 606438838 /nfs/dbraw/zinc/43/88/38/606438838.db2.gz FUWPHKIHGPBJEP-UHFFFAOYSA-N -1 3 366.812 3.715 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1N(Cc1ccco1)Cc1ccccc1 ZINC000822563165 606438840 /nfs/dbraw/zinc/43/88/40/606438840.db2.gz FUWPHKIHGPBJEP-UHFFFAOYSA-N -1 3 366.812 3.715 20 0 FHADHM FC(F)(F)[C@H]1CCC[C@@H](Nc2cc(-c3nnn[n-]3)c3ccccc3n2)C1 ZINC000822714378 606447186 /nfs/dbraw/zinc/44/71/86/606447186.db2.gz MRNWOJVKTLDJMP-WDEREUQCSA-N -1 3 362.359 3.948 20 0 FHADHM FC(F)(F)[C@H]1CCC[C@@H](Nc2cc(-c3nn[n-]n3)c3ccccc3n2)C1 ZINC000822714378 606447187 /nfs/dbraw/zinc/44/71/87/606447187.db2.gz MRNWOJVKTLDJMP-WDEREUQCSA-N -1 3 362.359 3.948 20 0 FHADHM Fc1ccc([C@@H]2CCCN2c2cc(-c3nnn[n-]3)c3ccccc3n2)cc1 ZINC000822766981 606447534 /nfs/dbraw/zinc/44/75/34/606447534.db2.gz RIPYCJGNBPIGEO-SFHVURJKSA-N -1 3 360.396 3.896 20 0 FHADHM Fc1ccc([C@@H]2CCCN2c2cc(-c3nn[n-]n3)c3ccccc3n2)cc1 ZINC000822766981 606447535 /nfs/dbraw/zinc/44/75/35/606447535.db2.gz RIPYCJGNBPIGEO-SFHVURJKSA-N -1 3 360.396 3.896 20 0 FHADHM Fc1ccc(N2CCC[C@@H](c3nc4ccccc4o3)C2)c(-c2nnn[n-]2)c1 ZINC000822779716 606452863 /nfs/dbraw/zinc/45/28/63/606452863.db2.gz ZVIOAYHXCOPNIR-GFCCVEGCSA-N -1 3 364.384 3.531 20 0 FHADHM Fc1ccc(N2CCC[C@@H](c3nc4ccccc4o3)C2)c(-c2nn[n-]n2)c1 ZINC000822779716 606452866 /nfs/dbraw/zinc/45/28/66/606452866.db2.gz ZVIOAYHXCOPNIR-GFCCVEGCSA-N -1 3 364.384 3.531 20 0 FHADHM CN(c1ccccc1)C1CCN(c2ccc(-c3nnn[n-]3)c(Cl)c2)CC1 ZINC000821619025 606471124 /nfs/dbraw/zinc/47/11/24/606471124.db2.gz GGGZXXCCPFCMPO-UHFFFAOYSA-N -1 3 368.872 3.625 20 0 FHADHM CN(c1ccccc1)C1CCN(c2ccc(-c3nn[n-]n3)c(Cl)c2)CC1 ZINC000821619025 606471126 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FC(F)(F)[C@H]1CCC[C@@H](CNc2ncc(-c3nnn[n-]3)cc2Cl)C1 ZINC000822714487 606595202 /nfs/dbraw/zinc/59/52/02/606595202.db2.gz NVSLEEUAVXDXMN-SCZZXKLOSA-N -1 3 360.771 3.696 20 0 FHADHM FC(F)(F)[C@H]1CCC[C@@H](CNc2ncc(-c3nn[n-]n3)cc2Cl)C1 ZINC000822714487 606595203 /nfs/dbraw/zinc/59/52/03/606595203.db2.gz NVSLEEUAVXDXMN-SCZZXKLOSA-N -1 3 360.771 3.696 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NCc1cccc(SC(=O)N(C)C)c1 ZINC000822221115 606597202 /nfs/dbraw/zinc/59/72/02/606597202.db2.gz ANJRTZTYRPETTA-UHFFFAOYSA-N -1 3 368.466 3.561 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NCc1cccc(SC(=O)N(C)C)c1 ZINC000822221115 606597203 /nfs/dbraw/zinc/59/72/03/606597203.db2.gz ANJRTZTYRPETTA-UHFFFAOYSA-N -1 3 368.466 3.561 20 0 FHADHM FC(F)Oc1cc(-c2nnn[n-]2)ccc1CNc1ccc(Cl)cc1 ZINC000822733233 606597271 /nfs/dbraw/zinc/59/72/71/606597271.db2.gz UKOWLKZXQNUIKA-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM FC(F)Oc1cc(-c2nn[n-]n2)ccc1CNc1ccc(Cl)cc1 ZINC000822733233 606597273 /nfs/dbraw/zinc/59/72/73/606597273.db2.gz 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FHADHM O=C(Nc1ccc(Oc2ccccc2-c2nn[n-]n2)cc1)C1CC(F)(F)C1 ZINC000823356504 606619450 /nfs/dbraw/zinc/61/94/50/606619450.db2.gz NKEIVYYRPILVOA-UHFFFAOYSA-N -1 3 371.347 3.643 20 0 FHADHM Cc1ccc(Oc2ccccc2)c(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)c1 ZINC000822267466 606622589 /nfs/dbraw/zinc/62/25/89/606622589.db2.gz VDEGMVFEHYLTPF-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM Cc1ccc(Oc2ccccc2)c(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)c1 ZINC000822267466 606622591 /nfs/dbraw/zinc/62/25/91/606622591.db2.gz VDEGMVFEHYLTPF-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM CC(=CC(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1)c1cccc(Cl)c1 ZINC000819766032 606625977 /nfs/dbraw/zinc/62/59/77/606625977.db2.gz UOBTWLZGJQDAEO-RSKUSDAESA-N -1 3 367.840 3.801 20 0 FHADHM CC(=CC(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1)c1cccc(Cl)c1 ZINC000819766032 606625979 /nfs/dbraw/zinc/62/59/79/606625979.db2.gz UOBTWLZGJQDAEO-RSKUSDAESA-N -1 3 367.840 3.801 20 0 FHADHM C[C@H](NC(=O)[C@H](C)c1ccc(Cl)s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820315584 606626220 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CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@H]1[C@H](C)CCC[C@@H]1C ZINC000820691394 606658838 /nfs/dbraw/zinc/65/88/38/606658838.db2.gz WYGVCIIOSBFYTI-HWWDLCQESA-N -1 3 370.501 3.611 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@H]1[C@H](C)CCC[C@@H]1C ZINC000820691394 606658839 /nfs/dbraw/zinc/65/88/39/606658839.db2.gz WYGVCIIOSBFYTI-HWWDLCQESA-N -1 3 370.501 3.611 20 0 FHADHM CC(C)c1ccc([C@H](C)NC(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)cc1 ZINC000820192730 606661924 /nfs/dbraw/zinc/66/19/24/606661924.db2.gz WWBZSTKSEJHHGU-NSHDSACASA-N -1 3 371.391 3.759 20 0 FHADHM CC(C)c1ccc([C@H](C)NC(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)cc1 ZINC000820192730 606661925 /nfs/dbraw/zinc/66/19/25/606661925.db2.gz WWBZSTKSEJHHGU-NSHDSACASA-N -1 3 371.391 3.759 20 0 FHADHM O=C(Oc1ccc2ccccc2c1)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000823454797 606663403 /nfs/dbraw/zinc/66/34/03/606663403.db2.gz UYKKWNNQWKWQDW-UHFFFAOYSA-N -1 3 352.300 3.517 20 0 FHADHM O=C(Oc1ccc2ccccc2c1)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000823454797 606663404 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CC(C)CC1CCN(C(=O)Nc2cc(-c3nn[n-]n3)cn2C(C)(C)C)CC1 ZINC000820067231 606722589 /nfs/dbraw/zinc/72/25/89/606722589.db2.gz GZAAIVYURDSLFH-UHFFFAOYSA-N -1 3 373.505 3.713 20 0 FHADHM C[C@@H](Nc1cccc(F)c1-c1nnn[n-]1)c1cccc(N2CCCC2)c1 ZINC000820461211 606732860 /nfs/dbraw/zinc/73/28/60/606732860.db2.gz FZQNGBCDJYKVLN-CYBMUJFWSA-N -1 3 352.417 3.779 20 0 FHADHM C[C@@H](Nc1cccc(F)c1-c1nn[n-]n1)c1cccc(N2CCCC2)c1 ZINC000820461211 606732862 /nfs/dbraw/zinc/73/28/62/606732862.db2.gz FZQNGBCDJYKVLN-CYBMUJFWSA-N -1 3 352.417 3.779 20 0 FHADHM C[C@H](Nc1ncc(-c2nnn[n-]2)cc1Cl)c1cccc(N2CCCC2)c1 ZINC000820460763 606733064 /nfs/dbraw/zinc/73/30/64/606733064.db2.gz BQKTUBWQCFDOAL-LBPRGKRZSA-N -1 3 369.860 3.688 20 0 FHADHM C[C@H](Nc1ncc(-c2nn[n-]n2)cc1Cl)c1cccc(N2CCCC2)c1 ZINC000820460763 606733066 /nfs/dbraw/zinc/73/30/66/606733066.db2.gz BQKTUBWQCFDOAL-LBPRGKRZSA-N -1 3 369.860 3.688 20 0 FHADHM CCCC(=O)Nc1ccc(Cl)c(NCc2ccccc2-c2nnn[n-]2)c1 ZINC000821009642 606745450 /nfs/dbraw/zinc/74/54/50/606745450.db2.gz XOBJXFHCINYYQN-UHFFFAOYSA-N -1 3 370.844 3.871 20 0 FHADHM CCCC(=O)Nc1ccc(Cl)c(NCc2ccccc2-c2nn[n-]n2)c1 ZINC000821009642 606745453 /nfs/dbraw/zinc/74/54/53/606745453.db2.gz XOBJXFHCINYYQN-UHFFFAOYSA-N -1 3 370.844 3.871 20 0 FHADHM Cc1cc(Oc2ccc(-c3nnn[n-]3)cc2)ccc1NC(=O)N(C)C(C)C ZINC000822211557 606770806 /nfs/dbraw/zinc/77/08/06/606770806.db2.gz DUQVXRGNADGSSJ-UHFFFAOYSA-N -1 3 366.425 3.840 20 0 FHADHM Cc1cc(Oc2ccc(-c3nn[n-]n3)cc2)ccc1NC(=O)N(C)C(C)C ZINC000822211557 606770807 /nfs/dbraw/zinc/77/08/07/606770807.db2.gz DUQVXRGNADGSSJ-UHFFFAOYSA-N -1 3 366.425 3.840 20 0 FHADHM CC[C@H]1CCC[C@@H]1NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)CC(C)C ZINC000820972559 606811494 /nfs/dbraw/zinc/81/14/94/606811494.db2.gz PGATYSJYYIJFRP-WMZOPIPTSA-N -1 3 370.501 3.613 20 0 FHADHM CC[C@H]1CCC[C@@H]1NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)CC(C)C ZINC000820972559 606811495 /nfs/dbraw/zinc/81/14/95/606811495.db2.gz PGATYSJYYIJFRP-WMZOPIPTSA-N -1 3 370.501 3.613 20 0 FHADHM CC(C)(C)c1cnc(CSCCCOc2cccc(-c3nnn[n-]3)c2)o1 ZINC000819965597 606840651 /nfs/dbraw/zinc/84/06/51/606840651.db2.gz JDNZNMAZNVIQQP-UHFFFAOYSA-N -1 3 373.482 3.855 20 0 FHADHM CC(C)(C)c1cnc(CSCCCOc2cccc(-c3nn[n-]n3)c2)o1 ZINC000819965597 606840652 /nfs/dbraw/zinc/84/06/52/606840652.db2.gz JDNZNMAZNVIQQP-UHFFFAOYSA-N -1 3 373.482 3.855 20 0 FHADHM Clc1cc(Br)ccc1NCc1ccccc1-c1nnn[n-]1 ZINC000822568137 606841004 /nfs/dbraw/zinc/84/10/04/606841004.db2.gz MBCYXZBFDRXFMD-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM Clc1cc(Br)ccc1NCc1ccccc1-c1nn[n-]n1 ZINC000822568137 606841006 /nfs/dbraw/zinc/84/10/06/606841006.db2.gz MBCYXZBFDRXFMD-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM COC(=O)c1ccc(CS[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1F ZINC000821669332 606848420 /nfs/dbraw/zinc/84/84/20/606848420.db2.gz GVYGHQPXGKQTLV-NSHDSACASA-N -1 3 372.425 3.787 20 0 FHADHM COC(=O)c1ccc(CS[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1F ZINC000821669332 606848421 /nfs/dbraw/zinc/84/84/21/606848421.db2.gz GVYGHQPXGKQTLV-NSHDSACASA-N -1 3 372.425 3.787 20 0 FHADHM CC(C)[C@H]1c2ccccc2CCN1C(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000820051591 606869609 /nfs/dbraw/zinc/86/96/09/606869609.db2.gz RCFJMJZDPAYQOU-SFHVURJKSA-N -1 3 362.437 3.654 20 0 FHADHM CC(C)[C@H]1c2ccccc2CCN1C(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000820051591 606869611 /nfs/dbraw/zinc/86/96/11/606869611.db2.gz RCFJMJZDPAYQOU-SFHVURJKSA-N -1 3 362.437 3.654 20 0 FHADHM CC(C)[C@@H]1c2ccccc2CCN1C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000820051964 606870005 /nfs/dbraw/zinc/87/00/05/606870005.db2.gz ZFJMXYHWVWGDPN-GOSISDBHSA-N -1 3 362.437 3.654 20 0 FHADHM CC(C)[C@@H]1c2ccccc2CCN1C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000820051964 606870008 /nfs/dbraw/zinc/87/00/08/606870008.db2.gz ZFJMXYHWVWGDPN-GOSISDBHSA-N -1 3 362.437 3.654 20 0 FHADHM O[C@H](CNc1ccc(Cl)cc1-c1nnn[n-]1)c1cc2ccccc2s1 ZINC000823690265 606878191 /nfs/dbraw/zinc/87/81/91/606878191.db2.gz MQPGHHOHNQFDGQ-CQSZACIVSA-N -1 3 371.853 3.880 20 0 FHADHM O[C@H](CNc1ccc(Cl)cc1-c1nn[n-]n1)c1cc2ccccc2s1 ZINC000823690265 606878193 /nfs/dbraw/zinc/87/81/93/606878193.db2.gz MQPGHHOHNQFDGQ-CQSZACIVSA-N -1 3 371.853 3.880 20 0 FHADHM O[C@H](CNc1cc(Cl)ccc1-c1nnn[n-]1)c1cc2ccccc2s1 ZINC000823690870 606878315 /nfs/dbraw/zinc/87/83/15/606878315.db2.gz WPGXSKMYDZVKOY-CQSZACIVSA-N -1 3 371.853 3.880 20 0 FHADHM O[C@H](CNc1cc(Cl)ccc1-c1nn[n-]n1)c1cc2ccccc2s1 ZINC000823690870 606878317 /nfs/dbraw/zinc/87/83/17/606878317.db2.gz WPGXSKMYDZVKOY-CQSZACIVSA-N -1 3 371.853 3.880 20 0 FHADHM C[C@@H]1CC[C@H](C)N1C(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000820686576 606914055 /nfs/dbraw/zinc/91/40/55/606914055.db2.gz YKMYIWZSDXLFJW-OKILXGFUSA-N -1 3 362.437 3.623 20 0 FHADHM CN(C[C@H](O)c1ccc(-c2nnn[n-]2)cc1)c1ccccc1-c1ccccc1 ZINC000821596365 606921139 /nfs/dbraw/zinc/92/11/39/606921139.db2.gz IEWBUKBFEDYQJX-NRFANRHFSA-N -1 3 371.444 3.704 20 0 FHADHM CN(C[C@H](O)c1ccc(-c2nn[n-]n2)cc1)c1ccccc1-c1ccccc1 ZINC000821596365 606921140 /nfs/dbraw/zinc/92/11/40/606921140.db2.gz IEWBUKBFEDYQJX-NRFANRHFSA-N -1 3 371.444 3.704 20 0 FHADHM Cc1ccc(Br)cc1NCc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000822225171 606928038 /nfs/dbraw/zinc/92/80/38/606928038.db2.gz RCWZOFWGWILDTG-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Cc1ccc(Br)cc1NCc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000822225171 606928039 /nfs/dbraw/zinc/92/80/39/606928039.db2.gz RCWZOFWGWILDTG-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Fc1ccc(Br)c(NCc2ccc(F)c(-c3nnn[n-]3)c2)c1 ZINC000822761353 606931809 /nfs/dbraw/zinc/93/18/09/606931809.db2.gz JXRZGMCYJSNTJY-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1ccc(Br)c(NCc2ccc(F)c(-c3nn[n-]n3)c2)c1 ZINC000822761353 606931810 /nfs/dbraw/zinc/93/18/10/606931810.db2.gz JXRZGMCYJSNTJY-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)c2cccc(Cl)c2F)s1 ZINC000821465665 606957322 /nfs/dbraw/zinc/95/73/22/606957322.db2.gz NCPDMVBTTHMHIL-UHFFFAOYSA-N -1 3 351.794 3.535 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)c2cccc(Cl)c2F)s1 ZINC000821465665 606957323 /nfs/dbraw/zinc/95/73/23/606957323.db2.gz NCPDMVBTTHMHIL-UHFFFAOYSA-N -1 3 351.794 3.535 20 0 FHADHM Cc1cc(Cl)cc(C(=O)Nc2cc(-c3nnn[n-]3)cn2C(C)(C)C)c1 ZINC000822202323 606957837 /nfs/dbraw/zinc/95/78/37/606957837.db2.gz VMWIJKDDPZIDDN-UHFFFAOYSA-N -1 3 358.833 3.637 20 0 FHADHM Cc1cc(Cl)cc(C(=O)Nc2cc(-c3nn[n-]n3)cn2C(C)(C)C)c1 ZINC000822202323 606957838 /nfs/dbraw/zinc/95/78/38/606957838.db2.gz VMWIJKDDPZIDDN-UHFFFAOYSA-N -1 3 358.833 3.637 20 0 FHADHM O=C(c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1)N1CCC2(CCC2)C1 ZINC000823493250 606959064 /nfs/dbraw/zinc/95/90/64/606959064.db2.gz JPDJKFPHGBTUJH-UHFFFAOYSA-N -1 3 374.448 3.627 20 0 FHADHM C[C@H](CC(=O)N(C)c1cc(Cl)ccc1-c1nnn[n-]1)c1ccc(F)cc1 ZINC000820219943 606962359 /nfs/dbraw/zinc/96/23/59/606962359.db2.gz LWGTWOVEOYHJDB-LLVKDONJSA-N -1 3 373.819 3.816 20 0 FHADHM C[C@H](CC(=O)N(C)c1cc(Cl)ccc1-c1nn[n-]n1)c1ccc(F)cc1 ZINC000820219943 606962361 /nfs/dbraw/zinc/96/23/61/606962361.db2.gz LWGTWOVEOYHJDB-LLVKDONJSA-N -1 3 373.819 3.816 20 0 FHADHM C[C@H](Cc1ccccc1F)C(=O)N(C)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000820300320 606964013 /nfs/dbraw/zinc/96/40/13/606964013.db2.gz PIZLRZXOUIEVLC-LLVKDONJSA-N -1 3 373.819 3.501 20 0 FHADHM C[C@H](Cc1ccccc1F)C(=O)N(C)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000820300320 606964014 /nfs/dbraw/zinc/96/40/14/606964014.db2.gz PIZLRZXOUIEVLC-LLVKDONJSA-N -1 3 373.819 3.501 20 0 FHADHM Cc1c(C)c(C)c(C[S@](=O)Cc2ccc(-c3nnn[n-]3)cc2)c(C)c1C ZINC000822020359 606978959 /nfs/dbraw/zinc/97/89/59/606978959.db2.gz AMNXDJJSKKACHC-AREMUKBSSA-N -1 3 368.506 3.858 20 0 FHADHM Cc1c(C)c(C)c(C[S@](=O)Cc2ccc(-c3nn[n-]n3)cc2)c(C)c1C ZINC000822020359 606978960 /nfs/dbraw/zinc/97/89/60/606978960.db2.gz AMNXDJJSKKACHC-AREMUKBSSA-N -1 3 368.506 3.858 20 0 FHADHM Cc1ccccc1[C@H](C)SCC(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000822345453 606989356 /nfs/dbraw/zinc/98/93/56/606989356.db2.gz JOHKCKIRUHGSTC-ZDUSSCGKSA-N -1 3 353.451 3.608 20 0 FHADHM Cc1ccccc1[C@H](C)SCC(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000822345453 606989357 /nfs/dbraw/zinc/98/93/57/606989357.db2.gz JOHKCKIRUHGSTC-ZDUSSCGKSA-N -1 3 353.451 3.608 20 0 FHADHM COc1cc(CSc2cccc(-c3nnn[n-]3)c2)ccc1OC(F)F ZINC000821716906 607010607 /nfs/dbraw/zinc/01/06/07/607010607.db2.gz GQXWOJPMRVYWIT-UHFFFAOYSA-N -1 3 364.377 3.769 20 0 FHADHM COc1cc(CSc2cccc(-c3nn[n-]n3)c2)ccc1OC(F)F ZINC000821716906 607010609 /nfs/dbraw/zinc/01/06/09/607010609.db2.gz GQXWOJPMRVYWIT-UHFFFAOYSA-N -1 3 364.377 3.769 20 0 FHADHM c1ccc(-c2noc(CCCSc3cccc(-c4nnn[n-]4)c3)n2)cc1 ZINC000823774065 607016297 /nfs/dbraw/zinc/01/62/97/607016297.db2.gz YQQLNEJCOAFGCS-UHFFFAOYSA-N -1 3 364.434 3.642 20 0 FHADHM c1ccc(-c2noc(CCCSc3cccc(-c4nn[n-]n4)c3)n2)cc1 ZINC000823774065 607016299 /nfs/dbraw/zinc/01/62/99/607016299.db2.gz YQQLNEJCOAFGCS-UHFFFAOYSA-N -1 3 364.434 3.642 20 0 FHADHM Cc1cc(Cl)ccc1NC(=O)CSc1cccc(-c2nnn[n-]2)c1 ZINC000822201922 607017774 /nfs/dbraw/zinc/01/77/74/607017774.db2.gz BRIONOTUFGBUCY-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1cc(Cl)ccc1NC(=O)CSc1cccc(-c2nn[n-]n2)c1 ZINC000822201922 607017777 /nfs/dbraw/zinc/01/77/77/607017777.db2.gz BRIONOTUFGBUCY-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM CCC(CC)CC(=O)Nc1ncc(Cc2ccc(-c3nnn[n-]3)cc2)s1 ZINC000820892538 607027049 /nfs/dbraw/zinc/02/70/49/607027049.db2.gz BEUURVMIJXSAAQ-UHFFFAOYSA-N -1 3 370.482 3.679 20 0 FHADHM CCC(CC)CC(=O)Nc1ncc(Cc2ccc(-c3nn[n-]n3)cc2)s1 ZINC000820892538 607027052 /nfs/dbraw/zinc/02/70/52/607027052.db2.gz BEUURVMIJXSAAQ-UHFFFAOYSA-N -1 3 370.482 3.679 20 0 FHADHM CCOc1cc(Cl)ccc1NCc1ccc(OC)c(-c2nnn[n-]2)c1 ZINC000821395333 607052968 /nfs/dbraw/zinc/05/29/68/607052968.db2.gz VYWJSSUVRNYEDE-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM CCOc1cc(Cl)ccc1NCc1ccc(OC)c(-c2nn[n-]n2)c1 ZINC000821395333 607052970 /nfs/dbraw/zinc/05/29/70/607052970.db2.gz VYWJSSUVRNYEDE-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NC(=O)C[C@H](C)c1ccccc1C ZINC000821293618 607099325 /nfs/dbraw/zinc/09/93/25/607099325.db2.gz MAJSOYATYZSUBA-AWEZNQCLSA-N -1 3 364.453 3.739 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NC(=O)C[C@@H](C)c1ccccc1C ZINC000821293619 607099392 /nfs/dbraw/zinc/09/93/92/607099392.db2.gz MAJSOYATYZSUBA-CQSZACIVSA-N -1 3 364.453 3.739 20 0 FHADHM O=C(c1sccc1-c1nnn[n-]1)N1CCc2cc(-c3ccccc3)ccc21 ZINC000823498662 607100745 /nfs/dbraw/zinc/10/07/45/607100745.db2.gz XZRRZSFNRFQMPM-UHFFFAOYSA-N -1 3 373.441 3.798 20 0 FHADHM O=C(c1sccc1-c1nn[n-]n1)N1CCc2cc(-c3ccccc3)ccc21 ZINC000823498662 607100747 /nfs/dbraw/zinc/10/07/47/607100747.db2.gz XZRRZSFNRFQMPM-UHFFFAOYSA-N -1 3 373.441 3.798 20 0 FHADHM C[C@@H](Nc1c(F)cc(-c2nnn[n-]2)cc1F)c1ccccc1-n1cccn1 ZINC000820452082 607118878 /nfs/dbraw/zinc/11/88/78/607118878.db2.gz ZHXNAKCLGCDBRG-LLVKDONJSA-N -1 3 367.363 3.504 20 0 FHADHM C[C@@H](Nc1c(F)cc(-c2nn[n-]n2)cc1F)c1ccccc1-n1cccn1 ZINC000820452082 607118880 /nfs/dbraw/zinc/11/88/80/607118880.db2.gz ZHXNAKCLGCDBRG-LLVKDONJSA-N -1 3 367.363 3.504 20 0 FHADHM C[C@@H](OC(=O)/C=C/SCc1ccco1)c1cccc(-c2nnn[n-]2)c1 ZINC000820489093 607130188 /nfs/dbraw/zinc/13/01/88/607130188.db2.gz ZELIJTBEJHMNKG-YPUOHESYSA-N -1 3 356.407 3.511 20 0 FHADHM C[C@@H](OC(=O)/C=C/SCc1ccco1)c1cccc(-c2nn[n-]n2)c1 ZINC000820489093 607130190 /nfs/dbraw/zinc/13/01/90/607130190.db2.gz ZELIJTBEJHMNKG-YPUOHESYSA-N -1 3 356.407 3.511 20 0 FHADHM O=C(NC1(c2c(Cl)cccc2Cl)CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000823139266 607133425 /nfs/dbraw/zinc/13/34/25/607133425.db2.gz AYPIKTMHKKTKTQ-UHFFFAOYSA-N -1 3 374.231 3.593 20 0 FHADHM O=C(NC1(c2c(Cl)cccc2Cl)CC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000823139266 607133426 /nfs/dbraw/zinc/13/34/26/607133426.db2.gz AYPIKTMHKKTKTQ-UHFFFAOYSA-N -1 3 374.231 3.593 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1OCc1ncc(-c2cccc(Cl)c2)o1 ZINC000822748115 607135643 /nfs/dbraw/zinc/13/56/43/607135643.db2.gz IPPLPWKZCMNDKZ-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1OCc1ncc(-c2cccc(Cl)c2)o1 ZINC000822748115 607135645 /nfs/dbraw/zinc/13/56/45/607135645.db2.gz IPPLPWKZCMNDKZ-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM Cc1cccc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CC[C@H](C)C3)c1F ZINC000822284534 607150777 /nfs/dbraw/zinc/15/07/77/607150777.db2.gz TYMYJQYSZVLNQA-VIFPVBQESA-N -1 3 371.441 3.753 20 0 FHADHM Cc1cccc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CC[C@H](C)C3)c1F ZINC000822284534 607150778 /nfs/dbraw/zinc/15/07/78/607150778.db2.gz TYMYJQYSZVLNQA-VIFPVBQESA-N -1 3 371.441 3.753 20 0 FHADHM C[C@@H](OC1CCCCCC1)C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000820519340 607151931 /nfs/dbraw/zinc/15/19/31/607151931.db2.gz RVWUWJKVLMZIKP-LLVKDONJSA-N -1 3 363.849 3.587 20 0 FHADHM C[C@@H](OC1CCCCCC1)C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000820519340 607151932 /nfs/dbraw/zinc/15/19/32/607151932.db2.gz RVWUWJKVLMZIKP-LLVKDONJSA-N -1 3 363.849 3.587 20 0 FHADHM CCCC1(C(=O)Nc2ccc(Oc3ccc(-c4nn[n-]n4)cc3)nc2)CC1 ZINC000821028020 607154816 /nfs/dbraw/zinc/15/48/16/607154816.db2.gz RPWCSBGHEDTHJM-UHFFFAOYSA-N -1 3 364.409 3.573 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@@H](C)OC2CCCCCC2)s1 ZINC000821465661 607157387 /nfs/dbraw/zinc/15/73/87/607157387.db2.gz NBORZRWSEFQCOV-LLVKDONJSA-N -1 3 363.487 3.557 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@@H](C)OC2CCCCCC2)s1 ZINC000821465661 607157389 /nfs/dbraw/zinc/15/73/89/607157389.db2.gz NBORZRWSEFQCOV-LLVKDONJSA-N -1 3 363.487 3.557 20 0 FHADHM CCC[C@H](C)[C@H]1CCCN1C(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000821015139 607164546 /nfs/dbraw/zinc/16/45/46/607164546.db2.gz OHLZURWCIIAFEG-WMLDXEAASA-N -1 3 373.526 3.527 20 0 FHADHM CCC[C@H](C)[C@H]1CCCN1C(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000821015139 607164547 /nfs/dbraw/zinc/16/45/47/607164547.db2.gz OHLZURWCIIAFEG-WMLDXEAASA-N -1 3 373.526 3.527 20 0 FHADHM CCC[C@@H](C)[C@H]1CCCN1C(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000821015137 607164564 /nfs/dbraw/zinc/16/45/64/607164564.db2.gz OHLZURWCIIAFEG-RHSMWYFYSA-N -1 3 373.526 3.527 20 0 FHADHM CCC[C@@H](C)[C@H]1CCCN1C(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000821015137 607164565 /nfs/dbraw/zinc/16/45/65/607164565.db2.gz OHLZURWCIIAFEG-RHSMWYFYSA-N -1 3 373.526 3.527 20 0 FHADHM CCC[C@@H](C)[C@@H]1CCCN1C(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000821015135 607164591 /nfs/dbraw/zinc/16/45/91/607164591.db2.gz OHLZURWCIIAFEG-PBHICJAKSA-N -1 3 373.526 3.527 20 0 FHADHM CCC[C@@H](C)[C@@H]1CCCN1C(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000821015135 607164592 /nfs/dbraw/zinc/16/45/92/607164592.db2.gz OHLZURWCIIAFEG-PBHICJAKSA-N -1 3 373.526 3.527 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccc(C(F)(F)F)cc1 ZINC000823319318 607189610 /nfs/dbraw/zinc/18/96/10/607189610.db2.gz SALGADSEWMYOOR-UHFFFAOYSA-N -1 3 367.718 3.791 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccc(C(F)(F)F)cc1 ZINC000823319318 607189611 /nfs/dbraw/zinc/18/96/11/607189611.db2.gz SALGADSEWMYOOR-UHFFFAOYSA-N -1 3 367.718 3.791 20 0 FHADHM CC(C)CC[C@H]1CCCN1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820073089 607197900 /nfs/dbraw/zinc/19/79/00/607197900.db2.gz POHGLDLFNKWSTB-CYBMUJFWSA-N -1 3 362.865 3.953 20 0 FHADHM CC(C)CC[C@H]1CCCN1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820073089 607197901 /nfs/dbraw/zinc/19/79/01/607197901.db2.gz POHGLDLFNKWSTB-CYBMUJFWSA-N -1 3 362.865 3.953 20 0 FHADHM CC(C)(CNC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccccc1 ZINC000819980914 607199866 /nfs/dbraw/zinc/19/98/66/607199866.db2.gz IYOGYTZOOKXJFN-UHFFFAOYSA-N -1 3 370.844 3.619 20 0 FHADHM CC(C)(CNC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccccc1 ZINC000819980914 607199867 /nfs/dbraw/zinc/19/98/67/607199867.db2.gz IYOGYTZOOKXJFN-UHFFFAOYSA-N -1 3 370.844 3.619 20 0 FHADHM CCSCC[C@H](C)N(C)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000821455942 607199987 /nfs/dbraw/zinc/19/99/87/607199987.db2.gz MVQAEEQMYOFTCL-JTQLQIEISA-N -1 3 368.894 3.516 20 0 FHADHM CCSCC[C@H](C)N(C)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000821455942 607199988 /nfs/dbraw/zinc/19/99/88/607199988.db2.gz MVQAEEQMYOFTCL-JTQLQIEISA-N -1 3 368.894 3.516 20 0 FHADHM C[C@@H]1C[C@@H]1c1ccc(CNC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)o1 ZINC000820674860 607202350 /nfs/dbraw/zinc/20/23/50/607202350.db2.gz GTRHYLMXHMDXLX-SKDRFNHKSA-N -1 3 372.816 3.558 20 0 FHADHM C[C@@H]1C[C@@H]1c1ccc(CNC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)o1 ZINC000820674860 607202351 /nfs/dbraw/zinc/20/23/51/607202351.db2.gz GTRHYLMXHMDXLX-SKDRFNHKSA-N -1 3 372.816 3.558 20 0 FHADHM C[C@@H](N[C@H](c1ccccc1)c1ccccn1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820414272 607208772 /nfs/dbraw/zinc/20/87/72/607208772.db2.gz XLQNGZXHQZIQDD-FOIQADDNSA-N -1 3 356.433 3.702 20 0 FHADHM CSCc1ccc(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000821970777 607240724 /nfs/dbraw/zinc/24/07/24/607240724.db2.gz RVKBTYNMCKSRNL-UHFFFAOYSA-N -1 3 359.842 3.635 20 0 FHADHM CSCc1ccc(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000821970777 607240725 /nfs/dbraw/zinc/24/07/25/607240725.db2.gz RVKBTYNMCKSRNL-UHFFFAOYSA-N -1 3 359.842 3.635 20 0 FHADHM Cc1ccccc1[C@H](C)OC(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000822345898 607240911 /nfs/dbraw/zinc/24/09/11/607240911.db2.gz VXILEBXQNRLFHC-ZDUSSCGKSA-N -1 3 354.435 3.572 20 0 FHADHM Cc1ccccc1[C@H](C)OC(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000822345898 607240912 /nfs/dbraw/zinc/24/09/12/607240912.db2.gz VXILEBXQNRLFHC-ZDUSSCGKSA-N -1 3 354.435 3.572 20 0 FHADHM O=C(Oc1ccc(-c2nnn[n-]2)cc1F)c1sccc1SC(F)F ZINC000823450401 607251146 /nfs/dbraw/zinc/25/11/46/607251146.db2.gz QCLQZBPMQKKJRV-UHFFFAOYSA-N -1 3 372.353 3.601 20 0 FHADHM O=C(Oc1ccc(-c2nn[n-]n2)cc1F)c1sccc1SC(F)F ZINC000823450401 607251147 /nfs/dbraw/zinc/25/11/47/607251147.db2.gz QCLQZBPMQKKJRV-UHFFFAOYSA-N -1 3 372.353 3.601 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(Oc3cccc(-c4nnn[n-]4)c3)cc2)nc1 ZINC000826282461 607796006 /nfs/dbraw/zinc/79/60/06/607796006.db2.gz PMLFDFNOMIJNCH-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(Oc3cccc(-c4nn[n-]n4)c3)cc2)nc1 ZINC000826282461 607796007 /nfs/dbraw/zinc/79/60/07/607796007.db2.gz PMLFDFNOMIJNCH-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM CCSc1ccc(CC(=O)N(CC)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000825674026 607798567 /nfs/dbraw/zinc/79/85/67/607798567.db2.gz FRDSSEFMVADDEB-UHFFFAOYSA-N -1 3 367.478 3.574 20 0 FHADHM CCSc1ccc(CC(=O)N(CC)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000825674026 607798568 /nfs/dbraw/zinc/79/85/68/607798568.db2.gz FRDSSEFMVADDEB-UHFFFAOYSA-N -1 3 367.478 3.574 20 0 FHADHM CCN(C(=O)[C@H]1C[C@H]1c1cccc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825367322 607798917 /nfs/dbraw/zinc/79/89/17/607798917.db2.gz NGWHJFCKQTVDEB-IRXDYDNUSA-N -1 3 367.840 3.677 20 0 FHADHM CCN(C(=O)[C@H]1C[C@H]1c1cccc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825367322 607798918 /nfs/dbraw/zinc/79/89/18/607798918.db2.gz NGWHJFCKQTVDEB-IRXDYDNUSA-N -1 3 367.840 3.677 20 0 FHADHM CCN(C(=O)[C@@H](C)CSc1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825362642 607799470 /nfs/dbraw/zinc/79/94/70/607799470.db2.gz QGZKSVGRDPMCLC-AWEZNQCLSA-N -1 3 367.478 3.648 20 0 FHADHM CCN(C(=O)[C@@H](C)CSc1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825362642 607799471 /nfs/dbraw/zinc/79/94/71/607799471.db2.gz QGZKSVGRDPMCLC-AWEZNQCLSA-N -1 3 367.478 3.648 20 0 FHADHM CCN(C(=O)[C@@H](C)c1ccc(Cl)s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825361654 607800842 /nfs/dbraw/zinc/80/08/42/607800842.db2.gz HBNLQXRTITWMKT-JTQLQIEISA-N -1 3 361.858 3.738 20 0 FHADHM CCN(C(=O)[C@@H](C)c1ccc(Cl)s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825361654 607800843 /nfs/dbraw/zinc/80/08/43/607800843.db2.gz HBNLQXRTITWMKT-JTQLQIEISA-N -1 3 361.858 3.738 20 0 FHADHM C[C@@H](OC(=O)c1sccc1-c1nnn[n-]1)c1ccc(C(F)(F)F)cc1 ZINC000736164363 607800924 /nfs/dbraw/zinc/80/09/24/607800924.db2.gz NFJRCTJUKWGTQA-MRVPVSSYSA-N -1 3 368.340 3.865 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1OC(=O)CCC(C)(C)c1ccccc1 ZINC000826174356 607813953 /nfs/dbraw/zinc/81/39/53/607813953.db2.gz SYLNNCRXLUBTKD-UHFFFAOYSA-N -1 3 366.421 3.539 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1OC(=O)CCC(C)(C)c1ccccc1 ZINC000826174356 607813954 /nfs/dbraw/zinc/81/39/54/607813954.db2.gz SYLNNCRXLUBTKD-UHFFFAOYSA-N -1 3 366.421 3.539 20 0 FHADHM O=C(Nc1ccc(F)c(F)c1)c1c(Cl)cc(-c2nnn[n-]2)cc1Cl ZINC000826454232 607832636 /nfs/dbraw/zinc/83/26/36/607832636.db2.gz OAMKSYYOMWTZDL-UHFFFAOYSA-N -1 3 370.146 3.704 20 0 FHADHM O=C(Nc1ccc(F)c(F)c1)c1c(Cl)cc(-c2nn[n-]n2)cc1Cl ZINC000826454232 607832637 /nfs/dbraw/zinc/83/26/37/607832637.db2.gz OAMKSYYOMWTZDL-UHFFFAOYSA-N -1 3 370.146 3.704 20 0 FHADHM Cc1ccc(NC(=O)c2c(Cl)cc(-c3nnn[n-]3)cc2Cl)c(F)c1 ZINC000826291193 607833557 /nfs/dbraw/zinc/83/35/57/607833557.db2.gz UGBPVHIRADUTGS-UHFFFAOYSA-N -1 3 366.183 3.873 20 0 FHADHM Cc1ccc(NC(=O)c2c(Cl)cc(-c3nn[n-]n3)cc2Cl)c(F)c1 ZINC000826291193 607833558 /nfs/dbraw/zinc/83/35/58/607833558.db2.gz UGBPVHIRADUTGS-UHFFFAOYSA-N -1 3 366.183 3.873 20 0 FHADHM COc1cccc([C@@H]2CCCN2c2ccc3cc(-c4nnn[n-]4)ccc3n2)c1 ZINC000826215359 607839774 /nfs/dbraw/zinc/83/97/74/607839774.db2.gz MYRMRCLECYDDJO-IBGZPJMESA-N -1 3 372.432 3.765 20 0 FHADHM COc1cccc([C@@H]2CCCN2c2ccc3cc(-c4nn[n-]n4)ccc3n2)c1 ZINC000826215359 607839775 /nfs/dbraw/zinc/83/97/75/607839775.db2.gz MYRMRCLECYDDJO-IBGZPJMESA-N -1 3 372.432 3.765 20 0 FHADHM CCCOCc1ccccc1CNc1ccc2cc(-c3nnn[n-]3)ccc2n1 ZINC000825339226 607840222 /nfs/dbraw/zinc/84/02/22/607840222.db2.gz SGAWXKDPDCNEAM-UHFFFAOYSA-N -1 3 374.448 3.954 20 0 FHADHM CCCOCc1ccccc1CNc1ccc2cc(-c3nn[n-]n3)ccc2n1 ZINC000825339226 607840223 /nfs/dbraw/zinc/84/02/23/607840223.db2.gz SGAWXKDPDCNEAM-UHFFFAOYSA-N -1 3 374.448 3.954 20 0 FHADHM Cc1cccc(NC(=O)[C@@H](C)Sc2ccc(-c3nnn[n-]3)cc2Cl)c1 ZINC000826299057 607844768 /nfs/dbraw/zinc/84/47/68/607844768.db2.gz PHKRNLREONCOIO-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM Cc1cccc(NC(=O)[C@@H](C)Sc2ccc(-c3nn[n-]n3)cc2Cl)c1 ZINC000826299057 607844769 /nfs/dbraw/zinc/84/47/69/607844769.db2.gz PHKRNLREONCOIO-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM Cc1c(C(=O)OCc2cccc(-c3nnn[n-]3)c2)cccc1-c1ccccn1 ZINC000826234637 607857159 /nfs/dbraw/zinc/85/71/59/607857159.db2.gz HKSIIRXJTXOSNQ-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM Cc1c(C(=O)OCc2cccc(-c3nn[n-]n3)c2)cccc1-c1ccccn1 ZINC000826234637 607857160 /nfs/dbraw/zinc/85/71/60/607857160.db2.gz HKSIIRXJTXOSNQ-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM O[C@@H](COc1ccccc1-c1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000826505182 607869714 /nfs/dbraw/zinc/86/97/14/607869714.db2.gz PAWWOBCQBZACAX-IBGZPJMESA-N -1 3 358.401 3.646 20 0 FHADHM O[C@@H](COc1ccccc1-c1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000826505182 607869715 /nfs/dbraw/zinc/86/97/15/607869715.db2.gz PAWWOBCQBZACAX-IBGZPJMESA-N -1 3 358.401 3.646 20 0 FHADHM O[C@@H](COc1ccccc1Cc1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000826505507 607870591 /nfs/dbraw/zinc/87/05/91/607870591.db2.gz WYYCDCSWIADGIA-FQEVSTJZSA-N -1 3 372.428 3.570 20 0 FHADHM O[C@@H](COc1ccccc1Cc1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000826505507 607870592 /nfs/dbraw/zinc/87/05/92/607870592.db2.gz WYYCDCSWIADGIA-FQEVSTJZSA-N -1 3 372.428 3.570 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1 ZINC000823942768 607881024 /nfs/dbraw/zinc/88/10/24/607881024.db2.gz JIDGPUIBLZPJTK-JLHYYAGUSA-N -1 3 367.840 3.582 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1 ZINC000823942768 607881025 /nfs/dbraw/zinc/88/10/25/607881025.db2.gz JIDGPUIBLZPJTK-JLHYYAGUSA-N -1 3 367.840 3.582 20 0 FHADHM CC(C)[C@@H](C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccc(F)cc1 ZINC000824473019 607881216 /nfs/dbraw/zinc/88/12/16/607881216.db2.gz YPETWAAJZOPYAM-SCLBCKFNSA-N -1 3 367.428 3.623 20 0 FHADHM CC(C)[C@@H](C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccc(F)cc1 ZINC000824473019 607881217 /nfs/dbraw/zinc/88/12/17/607881217.db2.gz YPETWAAJZOPYAM-SCLBCKFNSA-N -1 3 367.428 3.623 20 0 FHADHM O=C(Nc1cccc2ccccc21)N1CCc2ccc(-c3nnn[n-]3)cc21 ZINC000826456958 607931973 /nfs/dbraw/zinc/93/19/73/607931973.db2.gz GHPUSOARBNSMHN-UHFFFAOYSA-N -1 3 356.389 3.615 20 0 FHADHM O=C(Nc1cccc2ccccc21)N1CCc2ccc(-c3nn[n-]n3)cc21 ZINC000826456958 607931974 /nfs/dbraw/zinc/93/19/74/607931974.db2.gz GHPUSOARBNSMHN-UHFFFAOYSA-N -1 3 356.389 3.615 20 0 FHADHM CCc1nc2sccc2c(Oc2ccc(-c3nnn[n-]3)cc2Cl)n1 ZINC000825749278 607964839 /nfs/dbraw/zinc/96/48/39/607964839.db2.gz AZYVOCXOTLEEGR-UHFFFAOYSA-N -1 3 358.814 3.880 20 0 FHADHM CCc1nc2sccc2c(Oc2ccc(-c3nn[n-]n3)cc2Cl)n1 ZINC000825749278 607964840 /nfs/dbraw/zinc/96/48/40/607964840.db2.gz AZYVOCXOTLEEGR-UHFFFAOYSA-N -1 3 358.814 3.880 20 0 FHADHM Cc1cc(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)ncc1Br ZINC000826270873 607965084 /nfs/dbraw/zinc/96/50/84/607965084.db2.gz RYAXJRNFQOJLCF-SNVBAGLBSA-N -1 3 359.231 3.506 20 0 FHADHM Cc1cc(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)ncc1Br ZINC000826270873 607965085 /nfs/dbraw/zinc/96/50/85/607965085.db2.gz RYAXJRNFQOJLCF-SNVBAGLBSA-N -1 3 359.231 3.506 20 0 FHADHM Cn1cc(-c2ccccc2CNc2ccc(-c3nnn[n-]3)c(Cl)c2)cn1 ZINC000826356451 607966629 /nfs/dbraw/zinc/96/66/29/607966629.db2.gz REFMZOIVYZPLRK-UHFFFAOYSA-N -1 3 365.828 3.533 20 0 FHADHM Cn1cc(-c2ccccc2CNc2ccc(-c3nn[n-]n3)c(Cl)c2)cn1 ZINC000826356451 607966630 /nfs/dbraw/zinc/96/66/30/607966630.db2.gz REFMZOIVYZPLRK-UHFFFAOYSA-N -1 3 365.828 3.533 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(N2CCc3c4ccccc4[nH]c3C2)c1 ZINC000826351426 607968802 /nfs/dbraw/zinc/96/88/02/607968802.db2.gz MGZIUZGTFCQFEO-UHFFFAOYSA-N -1 3 350.813 3.564 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(N2CCc3c4ccccc4[nH]c3C2)c1 ZINC000826351426 607968803 /nfs/dbraw/zinc/96/88/03/607968803.db2.gz MGZIUZGTFCQFEO-UHFFFAOYSA-N -1 3 350.813 3.564 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1 ZINC000823942936 607970251 /nfs/dbraw/zinc/97/02/51/607970251.db2.gz LKBRMHGAGNNZOC-UKTHLTGXSA-N -1 3 367.840 3.582 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1 ZINC000823942936 607970252 /nfs/dbraw/zinc/97/02/52/607970252.db2.gz LKBRMHGAGNNZOC-UKTHLTGXSA-N -1 3 367.840 3.582 20 0 FHADHM CCn1c2ccc(-c3nnn[n-]3)cc2nc1-c1ccc(F)c2cccnc12 ZINC000825782632 607975945 /nfs/dbraw/zinc/97/59/45/607975945.db2.gz JQIGOBKHHZKSJC-UHFFFAOYSA-N -1 3 359.368 3.591 20 0 FHADHM CCn1c2ccc(-c3nn[n-]n3)cc2nc1-c1ccc(F)c2cccnc12 ZINC000825782632 607975946 /nfs/dbraw/zinc/97/59/46/607975946.db2.gz JQIGOBKHHZKSJC-UHFFFAOYSA-N -1 3 359.368 3.591 20 0 FHADHM CCN(C(=O)C1CCC(F)(F)CC1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825366851 607978436 /nfs/dbraw/zinc/97/84/36/607978436.db2.gz GZBPVXOMNZWDOD-LBPRGKRZSA-N -1 3 363.412 3.602 20 0 FHADHM CCN(C(=O)C1CCC(F)(F)CC1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825366851 607978437 /nfs/dbraw/zinc/97/84/37/607978437.db2.gz GZBPVXOMNZWDOD-LBPRGKRZSA-N -1 3 363.412 3.602 20 0 FHADHM COc1ccc(CSCc2cccc3cccnc32)cc1-c1nnn[n-]1 ZINC000826207927 607984603 /nfs/dbraw/zinc/98/46/03/607984603.db2.gz KZABPOXWVYUVJS-UHFFFAOYSA-N -1 3 363.446 3.857 20 0 FHADHM COc1ccc(CSCc2cccc3cccnc32)cc1-c1nn[n-]n1 ZINC000826207927 607984604 /nfs/dbraw/zinc/98/46/04/607984604.db2.gz KZABPOXWVYUVJS-UHFFFAOYSA-N -1 3 363.446 3.857 20 0 FHADHM Cc1ccc2cc(C(=O)O[C@H](C)c3cccc(-c4nnn[n-]4)c3)ccc2n1 ZINC000826295003 607990136 /nfs/dbraw/zinc/99/01/36/607990136.db2.gz MVZBAQYTMXCURG-CYBMUJFWSA-N -1 3 359.389 3.641 20 0 FHADHM Cc1ccc2cc(C(=O)O[C@H](C)c3cccc(-c4nn[n-]n4)c3)ccc2n1 ZINC000826295003 607990137 /nfs/dbraw/zinc/99/01/37/607990137.db2.gz MVZBAQYTMXCURG-CYBMUJFWSA-N -1 3 359.389 3.641 20 0 FHADHM O=C(Nc1ccccc1-c1nnn[n-]1)c1ccccc1CCC(F)(F)F ZINC000826457931 608000444 /nfs/dbraw/zinc/00/04/44/608000444.db2.gz VYPWPZADULPTKG-UHFFFAOYSA-N -1 3 361.327 3.614 20 0 FHADHM O=C(Nc1ccccc1-c1nn[n-]n1)c1ccccc1CCC(F)(F)F ZINC000826457931 608000445 /nfs/dbraw/zinc/00/04/45/608000445.db2.gz VYPWPZADULPTKG-UHFFFAOYSA-N -1 3 361.327 3.614 20 0 FHADHM CC(C)c1ccc([C@@H]2CCCN2C(=O)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824347659 608008125 /nfs/dbraw/zinc/00/81/25/608008125.db2.gz JJRLOTDDDDEXRP-IBGZPJMESA-N -1 3 361.449 3.967 20 0 FHADHM CC(C)c1ccc([C@@H]2CCCN2C(=O)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824347659 608008126 /nfs/dbraw/zinc/00/81/26/608008126.db2.gz JJRLOTDDDDEXRP-IBGZPJMESA-N -1 3 361.449 3.967 20 0 FHADHM CN(C(=O)c1cccc(-c2ccoc2)c1)c1ccc(-c2nnn[n-]2)cc1F ZINC000825829483 608026899 /nfs/dbraw/zinc/02/68/99/608026899.db2.gz FUILGPYQTBUASI-UHFFFAOYSA-N -1 3 363.352 3.542 20 0 FHADHM CN(C(=O)c1cccc(-c2ccoc2)c1)c1ccc(-c2nn[n-]n2)cc1F ZINC000825829483 608026900 /nfs/dbraw/zinc/02/69/00/608026900.db2.gz FUILGPYQTBUASI-UHFFFAOYSA-N -1 3 363.352 3.542 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1OCc1csc(-c2cccs2)n1 ZINC000826176312 608033004 /nfs/dbraw/zinc/03/30/04/608033004.db2.gz JZZQRVHPOJNFBX-UHFFFAOYSA-N -1 3 371.447 3.639 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1OCc1csc(-c2cccs2)n1 ZINC000826176312 608033005 /nfs/dbraw/zinc/03/30/05/608033005.db2.gz JZZQRVHPOJNFBX-UHFFFAOYSA-N -1 3 371.447 3.639 20 0 FHADHM Brc1cc(-c2nn[n-]n2)ccc1NCc1cc2ccccc2[nH]1 ZINC000823826509 608048457 /nfs/dbraw/zinc/04/84/57/608048457.db2.gz KHZZOXXUHQYVAB-UHFFFAOYSA-N -1 3 369.226 3.723 20 0 FHADHM CCN(C(=O)CCCc1cc(F)ccc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000825371766 608066325 /nfs/dbraw/zinc/06/63/25/608066325.db2.gz KVFHEYFNPVUHSW-UHFFFAOYSA-N -1 3 371.391 3.521 20 0 FHADHM CCN(C(=O)CCCc1cc(F)ccc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000825371766 608066326 /nfs/dbraw/zinc/06/63/26/608066326.db2.gz KVFHEYFNPVUHSW-UHFFFAOYSA-N -1 3 371.391 3.521 20 0 FHADHM C[C@@H](c1ccc(Cl)cc1)N1CCO[C@H](c2cccc(-c3nnn[n-]3)c2)C1 ZINC000824763503 608071603 /nfs/dbraw/zinc/07/16/03/608071603.db2.gz MYKSRWKEQBOMMP-UGSOOPFHSA-N -1 3 369.856 3.655 20 0 FHADHM C[C@@H](c1ccc(Cl)cc1)N1CCO[C@H](c2cccc(-c3nn[n-]n3)c2)C1 ZINC000824763503 608071604 /nfs/dbraw/zinc/07/16/04/608071604.db2.gz MYKSRWKEQBOMMP-UGSOOPFHSA-N -1 3 369.856 3.655 20 0 FHADHM CC[C@H](C)n1ncc(Nc2ncc(-c3nnn[n-]3)cc2Cl)c1C1CC1 ZINC000825080921 608098484 /nfs/dbraw/zinc/09/84/84/608098484.db2.gz DCSSXGILLYHWHP-VIFPVBQESA-N -1 3 358.837 3.704 20 0 FHADHM CC[C@H](C)n1ncc(Nc2ncc(-c3nn[n-]n3)cc2Cl)c1C1CC1 ZINC000825080921 608098485 /nfs/dbraw/zinc/09/84/85/608098485.db2.gz DCSSXGILLYHWHP-VIFPVBQESA-N -1 3 358.837 3.704 20 0 FHADHM CC[C@@H](C)n1ncc(NC(=O)Nc2cccc(-c3nnn[n-]3)c2)c1C1CC1 ZINC000825081182 608100464 /nfs/dbraw/zinc/10/04/64/608100464.db2.gz HGJKQAQWJURTKT-LLVKDONJSA-N -1 3 366.429 3.556 20 0 FHADHM CC[C@@H](C)n1ncc(NC(=O)Nc2cccc(-c3nn[n-]n3)c2)c1C1CC1 ZINC000825081182 608100465 /nfs/dbraw/zinc/10/04/65/608100465.db2.gz HGJKQAQWJURTKT-LLVKDONJSA-N -1 3 366.429 3.556 20 0 FHADHM CC(C)(C)[C@@H]1C[C@H](Nc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)CCO1 ZINC000824080475 608149992 /nfs/dbraw/zinc/14/99/92/608149992.db2.gz XXNPLGNLMGLIRN-RISCZKNCSA-N -1 3 369.391 3.891 20 0 FHADHM CC(C)(C)[C@@H]1C[C@H](Nc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)CCO1 ZINC000824080475 608149993 /nfs/dbraw/zinc/14/99/93/608149993.db2.gz XXNPLGNLMGLIRN-RISCZKNCSA-N -1 3 369.391 3.891 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@@H](C)c2c(F)cccc2F)s1 ZINC000825694138 608155130 /nfs/dbraw/zinc/15/51/30/608155130.db2.gz LJEUJLBSAFLKFA-QMMMGPOBSA-N -1 3 363.393 3.511 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@@H](C)c2c(F)cccc2F)s1 ZINC000825694138 608155132 /nfs/dbraw/zinc/15/51/32/608155132.db2.gz LJEUJLBSAFLKFA-QMMMGPOBSA-N -1 3 363.393 3.511 20 0 FHADHM CCSc1cccc(C(=O)Nc2sc(CC)cc2-c2nnn[n-]2)c1 ZINC000825674105 608155305 /nfs/dbraw/zinc/15/53/05/608155305.db2.gz IBKVTRCXRUETRW-UHFFFAOYSA-N -1 3 359.480 3.855 20 0 FHADHM CCSc1cccc(C(=O)Nc2sc(CC)cc2-c2nn[n-]n2)c1 ZINC000825674105 608155307 /nfs/dbraw/zinc/15/53/07/608155307.db2.gz IBKVTRCXRUETRW-UHFFFAOYSA-N -1 3 359.480 3.855 20 0 FHADHM CC(C)c1ccc([C@H]2CCCCN2C(=O)c2ccc(-c3nnn[n-]3)[nH]2)cc1 ZINC000824347975 608158989 /nfs/dbraw/zinc/15/89/89/608158989.db2.gz VHLKYISHMDJLFC-GOSISDBHSA-N -1 3 364.453 3.686 20 0 FHADHM CC(C)c1ccc([C@H]2CCCCN2C(=O)c2ccc(-c3nn[n-]n3)[nH]2)cc1 ZINC000824347975 608158990 /nfs/dbraw/zinc/15/89/90/608158990.db2.gz VHLKYISHMDJLFC-GOSISDBHSA-N -1 3 364.453 3.686 20 0 FHADHM C[C@@H](OC(=O)C1(c2ccc(F)cc2)CCC1)c1cccc(-c2nnn[n-]2)c1 ZINC000824712870 608181819 /nfs/dbraw/zinc/18/18/19/608181819.db2.gz DTIKBNRPWKNTHN-CYBMUJFWSA-N -1 3 366.396 3.732 20 0 FHADHM C[C@@H](OC(=O)C1(c2ccc(F)cc2)CCC1)c1cccc(-c2nn[n-]n2)c1 ZINC000824712870 608181820 /nfs/dbraw/zinc/18/18/20/608181820.db2.gz DTIKBNRPWKNTHN-CYBMUJFWSA-N -1 3 366.396 3.732 20 0 FHADHM CC[C@@H](OC1CCCCC1)C(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000825154322 608184235 /nfs/dbraw/zinc/18/42/35/608184235.db2.gz NOVIHFRRJGRABE-CXAGYDPISA-N -1 3 358.442 3.599 20 0 FHADHM CC[C@@H](OC1CCCCC1)C(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000825154322 608184236 /nfs/dbraw/zinc/18/42/36/608184236.db2.gz NOVIHFRRJGRABE-CXAGYDPISA-N -1 3 358.442 3.599 20 0 FHADHM Clc1cccc(SCc2ccc(-n3cccn3)cc2)c1-c1nnn[n-]1 ZINC000826353262 608207696 /nfs/dbraw/zinc/20/76/96/608207696.db2.gz IJJMKYIWUOHHRH-UHFFFAOYSA-N -1 3 368.853 3.998 20 0 FHADHM Clc1cccc(SCc2ccc(-n3cccn3)cc2)c1-c1nn[n-]n1 ZINC000826353262 608207698 /nfs/dbraw/zinc/20/76/98/608207698.db2.gz IJJMKYIWUOHHRH-UHFFFAOYSA-N -1 3 368.853 3.998 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1ccc(Cl)c(F)c1 ZINC000825319142 608228567 /nfs/dbraw/zinc/22/85/67/608228567.db2.gz ZLYHVOVMRFOMFY-UHFFFAOYSA-N -1 3 373.819 3.712 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1ccc(Cl)c(F)c1 ZINC000825319142 608228569 /nfs/dbraw/zinc/22/85/69/608228569.db2.gz ZLYHVOVMRFOMFY-UHFFFAOYSA-N -1 3 373.819 3.712 20 0 FHADHM c1ccc(OC2CCC2)c(CNc2ccc3cc(-c4nnn[n-]4)ccc3n2)c1 ZINC000826521868 608229669 /nfs/dbraw/zinc/22/96/69/608229669.db2.gz BSCRBDKTWMESBV-UHFFFAOYSA-N -1 3 372.432 3.958 20 0 FHADHM c1ccc(OC2CCC2)c(CNc2ccc3cc(-c4nn[n-]n4)ccc3n2)c1 ZINC000826521868 608229671 /nfs/dbraw/zinc/22/96/71/608229671.db2.gz BSCRBDKTWMESBV-UHFFFAOYSA-N -1 3 372.432 3.958 20 0 FHADHM COc1ccc([C@H](OC)[C@H](C)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1 ZINC000826189929 608239180 /nfs/dbraw/zinc/23/91/80/608239180.db2.gz JPICCYYRBQHGMS-APPDUMDISA-N -1 3 373.844 3.717 20 0 FHADHM COc1ccc([C@H](OC)[C@H](C)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1 ZINC000826189929 608239181 /nfs/dbraw/zinc/23/91/81/608239181.db2.gz JPICCYYRBQHGMS-APPDUMDISA-N -1 3 373.844 3.717 20 0 FHADHM Cc1cccc([C@@H](NCc2ccc(-c3nnn[n-]3)cc2F)c2ccccn2)c1 ZINC000826297067 608241715 /nfs/dbraw/zinc/24/17/15/608241715.db2.gz UKEPGSJQTLEXQI-HXUWFJFHSA-N -1 3 374.423 3.588 20 0 FHADHM Cc1cccc([C@@H](NCc2ccc(-c3nn[n-]n3)cc2F)c2ccccn2)c1 ZINC000826297067 608241717 /nfs/dbraw/zinc/24/17/17/608241717.db2.gz UKEPGSJQTLEXQI-HXUWFJFHSA-N -1 3 374.423 3.588 20 0 FHADHM CC(C)[C@@H]1C[C@H](Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)CCO1 ZINC000824216636 608242757 /nfs/dbraw/zinc/24/27/57/608242757.db2.gz UFWISTDLDBXFLL-RISCZKNCSA-N -1 3 355.364 3.501 20 0 FHADHM CC(C)[C@@H]1C[C@H](Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)CCO1 ZINC000824216636 608242758 /nfs/dbraw/zinc/24/27/58/608242758.db2.gz UFWISTDLDBXFLL-RISCZKNCSA-N -1 3 355.364 3.501 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccc2[nH]ccc2c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824716574 608247814 /nfs/dbraw/zinc/24/78/14/608247814.db2.gz YGMWBTUSMJAHCP-XOUYHXJHSA-N -1 3 359.389 3.666 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccc2[nH]ccc2c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824716574 608247816 /nfs/dbraw/zinc/24/78/16/608247816.db2.gz YGMWBTUSMJAHCP-XOUYHXJHSA-N -1 3 359.389 3.666 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CSc1nc2ccccc2s1 ZINC000826173466 608261505 /nfs/dbraw/zinc/26/15/05/608261505.db2.gz FNMCJBGXPHHYCB-UHFFFAOYSA-N -1 3 355.448 3.777 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CSc1nc2ccccc2s1 ZINC000826173466 608261507 /nfs/dbraw/zinc/26/15/07/608261507.db2.gz FNMCJBGXPHHYCB-UHFFFAOYSA-N -1 3 355.448 3.777 20 0 FHADHM C[C@@H]1CCC[C@@H](OCCCCCC(=O)Nc2cccc(-c3nnn[n-]3)c2)C1 ZINC000160668768 608261642 /nfs/dbraw/zinc/26/16/42/608261642.db2.gz YFOIJXMWRCUGKV-CRAIPNDOSA-N -1 3 371.485 3.961 20 0 FHADHM C[C@@H]1CCC[C@@H](OCCCCCC(=O)Nc2cccc(-c3nn[n-]n3)c2)C1 ZINC000160668768 608261643 /nfs/dbraw/zinc/26/16/43/608261643.db2.gz YFOIJXMWRCUGKV-CRAIPNDOSA-N -1 3 371.485 3.961 20 0 FHADHM C[C@@H]1CCC[C@H](OCCCCCC(=O)Nc2ccccc2-c2nnn[n-]2)C1 ZINC000824930058 608262023 /nfs/dbraw/zinc/26/20/23/608262023.db2.gz ZXLSGAQKMQIAPO-CVEARBPZSA-N -1 3 371.485 3.961 20 0 FHADHM C[C@@H]1CCC[C@H](OCCCCCC(=O)Nc2ccccc2-c2nn[n-]n2)C1 ZINC000824930058 608262026 /nfs/dbraw/zinc/26/20/26/608262026.db2.gz ZXLSGAQKMQIAPO-CVEARBPZSA-N -1 3 371.485 3.961 20 0 FHADHM C[C@H]1CCC[C@@H](OCCCCCC(=O)Nc2ccccc2-c2nnn[n-]2)C1 ZINC000824930061 608262102 /nfs/dbraw/zinc/26/21/02/608262102.db2.gz ZXLSGAQKMQIAPO-JKSUJKDBSA-N -1 3 371.485 3.961 20 0 FHADHM C[C@H]1CCC[C@@H](OCCCCCC(=O)Nc2ccccc2-c2nn[n-]n2)C1 ZINC000824930061 608262104 /nfs/dbraw/zinc/26/21/04/608262104.db2.gz ZXLSGAQKMQIAPO-JKSUJKDBSA-N -1 3 371.485 3.961 20 0 FHADHM CC[C@@H]1CC[C@@H](C)N1C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000825195354 608264005 /nfs/dbraw/zinc/26/40/05/608264005.db2.gz WHCSSSDKBSMTAX-MWLCHTKSSA-N -1 3 368.363 3.680 20 0 FHADHM CC[C@@H]1CC[C@@H](C)N1C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000825195354 608264007 /nfs/dbraw/zinc/26/40/07/608264007.db2.gz WHCSSSDKBSMTAX-MWLCHTKSSA-N -1 3 368.363 3.680 20 0 FHADHM CSc1cc(C(=O)Nc2sc(C)c(C)c2-c2nnn[n-]2)ccc1F ZINC000826230019 608264944 /nfs/dbraw/zinc/26/49/44/608264944.db2.gz AKEAOTCUXCLJCP-UHFFFAOYSA-N -1 3 363.443 3.658 20 0 FHADHM CSc1cc(C(=O)Nc2sc(C)c(C)c2-c2nn[n-]n2)ccc1F ZINC000826230019 608264946 /nfs/dbraw/zinc/26/49/46/608264946.db2.gz AKEAOTCUXCLJCP-UHFFFAOYSA-N -1 3 363.443 3.658 20 0 FHADHM CN(C(=O)C=Cc1ccccc1-c1nnn[n-]1)c1c(Cl)cccc1Cl ZINC000825812586 608265315 /nfs/dbraw/zinc/26/53/15/608265315.db2.gz NUHQBRFQAIQQFY-KTKRTIGZSA-N -1 3 374.231 3.850 20 0 FHADHM CN(C(=O)C=Cc1ccccc1-c1nn[n-]n1)c1c(Cl)cccc1Cl ZINC000825812586 608265317 /nfs/dbraw/zinc/26/53/17/608265317.db2.gz NUHQBRFQAIQQFY-KTKRTIGZSA-N -1 3 374.231 3.850 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)c(N[C@H]2C[C@@H]2c2ccccc2C(F)(F)F)n1 ZINC000826275179 608281910 /nfs/dbraw/zinc/28/19/10/608281910.db2.gz RBUXLDOYQBWXDB-OCCSQVGLSA-N -1 3 360.343 3.557 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)c(N[C@H]2C[C@@H]2c2ccccc2C(F)(F)F)n1 ZINC000826275179 608281911 /nfs/dbraw/zinc/28/19/11/608281911.db2.gz RBUXLDOYQBWXDB-OCCSQVGLSA-N -1 3 360.343 3.557 20 0 FHADHM FC(F)(F)c1ccc(C2CCN(c3ccc(-c4nnn[n-]4)cn3)CC2)cc1 ZINC000826368621 608298055 /nfs/dbraw/zinc/29/80/55/608298055.db2.gz WVNNCOFUQRCASG-UHFFFAOYSA-N -1 3 374.370 3.665 20 0 FHADHM FC(F)(F)c1ccc(C2CCN(c3ccc(-c4nn[n-]n4)cn3)CC2)cc1 ZINC000826368621 608298057 /nfs/dbraw/zinc/29/80/57/608298057.db2.gz WVNNCOFUQRCASG-UHFFFAOYSA-N -1 3 374.370 3.665 20 0 FHADHM CCC1(C(=O)NCc2ccc(-c3ccccc3-c3nnn[n-]3)cc2)CCC1 ZINC000825160282 608327584 /nfs/dbraw/zinc/32/75/84/608327584.db2.gz YSVRSEGZCSMKNZ-UHFFFAOYSA-N -1 3 361.449 3.730 20 0 FHADHM CCC1(C(=O)NCc2ccc(-c3ccccc3-c3nn[n-]n3)cc2)CCC1 ZINC000825160282 608327586 /nfs/dbraw/zinc/32/75/86/608327586.db2.gz YSVRSEGZCSMKNZ-UHFFFAOYSA-N -1 3 361.449 3.730 20 0 FHADHM CC1=C(C(=O)NCc2ccc(-c3ccccc3-c3nnn[n-]3)cc2)CCC1 ZINC000824851718 608329044 /nfs/dbraw/zinc/32/90/44/608329044.db2.gz DKKMQNIXULHTIE-UHFFFAOYSA-N -1 3 359.433 3.650 20 0 FHADHM CC1=C(C(=O)NCc2ccc(-c3ccccc3-c3nn[n-]n3)cc2)CCC1 ZINC000824851718 608329045 /nfs/dbraw/zinc/32/90/45/608329045.db2.gz DKKMQNIXULHTIE-UHFFFAOYSA-N -1 3 359.433 3.650 20 0 FHADHM CCN(C(=O)C=Cc1ccsc1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825367586 608343752 /nfs/dbraw/zinc/34/37/52/608343752.db2.gz SVYADBPWSBVLGE-UTCJRWHESA-N -1 3 359.842 3.648 20 0 FHADHM CCN(C(=O)C=Cc1ccsc1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825367586 608343753 /nfs/dbraw/zinc/34/37/53/608343753.db2.gz SVYADBPWSBVLGE-UTCJRWHESA-N -1 3 359.842 3.648 20 0 FHADHM CCN(C(=O)CCc1cccs1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825371438 608346480 /nfs/dbraw/zinc/34/64/80/608346480.db2.gz GMQFJDCXQTXRJP-UHFFFAOYSA-N -1 3 361.858 3.567 20 0 FHADHM CCN(C(=O)CCc1cccs1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825371438 608346482 /nfs/dbraw/zinc/34/64/82/608346482.db2.gz GMQFJDCXQTXRJP-UHFFFAOYSA-N -1 3 361.858 3.567 20 0 FHADHM c1c(CNc2ccc3cc(-c4nnn[n-]4)ccc3n2)onc1-c1ccccc1 ZINC000826519423 608366526 /nfs/dbraw/zinc/36/65/26/608366526.db2.gz YATVZIKRSNIOQT-UHFFFAOYSA-N -1 3 369.388 3.682 20 0 FHADHM c1c(CNc2ccc3cc(-c4nn[n-]n4)ccc3n2)onc1-c1ccccc1 ZINC000826519423 608366527 /nfs/dbraw/zinc/36/65/27/608366527.db2.gz YATVZIKRSNIOQT-UHFFFAOYSA-N -1 3 369.388 3.682 20 0 FHADHM Fc1cccc([C@@H]2CCCN2c2ccc3cc(-c4nnn[n-]4)ccc3n2)c1 ZINC000826376576 608371702 /nfs/dbraw/zinc/37/17/02/608371702.db2.gz JRMCZHYXUOVSOV-SFHVURJKSA-N -1 3 360.396 3.896 20 0 FHADHM Fc1cccc([C@@H]2CCCN2c2ccc3cc(-c4nn[n-]n4)ccc3n2)c1 ZINC000826376576 608371704 /nfs/dbraw/zinc/37/17/04/608371704.db2.gz JRMCZHYXUOVSOV-SFHVURJKSA-N -1 3 360.396 3.896 20 0 FHADHM O=C(OCc1cccc(-c2nnn[n-]2)c1F)[C@@H]1C[C@H]1c1cccc(Cl)c1 ZINC000826465992 608445059 /nfs/dbraw/zinc/44/50/59/608445059.db2.gz LAEWQHWAPOZMNX-LSDHHAIUSA-N -1 3 372.787 3.506 20 0 FHADHM O=C(OCc1cccc(-c2nn[n-]n2)c1F)[C@@H]1C[C@H]1c1cccc(Cl)c1 ZINC000826465992 608445061 /nfs/dbraw/zinc/44/50/61/608445061.db2.gz LAEWQHWAPOZMNX-LSDHHAIUSA-N -1 3 372.787 3.506 20 0 FHADHM C[C@H](CCC(=O)OCc1cccc(-c2nnn[n-]2)c1F)c1ccccc1 ZINC000824401631 608452889 /nfs/dbraw/zinc/45/28/89/608452889.db2.gz RHFFFAMFFQDUMZ-CYBMUJFWSA-N -1 3 354.385 3.633 20 0 FHADHM C[C@H](CCC(=O)OCc1cccc(-c2nn[n-]n2)c1F)c1ccccc1 ZINC000824401631 608452890 /nfs/dbraw/zinc/45/28/90/608452890.db2.gz RHFFFAMFFQDUMZ-CYBMUJFWSA-N -1 3 354.385 3.633 20 0 FHADHM C[C@H](NCc1coc(-c2ccc(F)cc2)n1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824625716 608462593 /nfs/dbraw/zinc/46/25/93/608462593.db2.gz JEROVLGATNMKOT-LBPRGKRZSA-N -1 3 364.384 3.512 20 0 FHADHM C[C@@H](NCc1coc(-c2cccc(F)c2)n1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824627260 608465682 /nfs/dbraw/zinc/46/56/82/608465682.db2.gz VMLFITLREGFDIW-GFCCVEGCSA-N -1 3 364.384 3.512 20 0 FHADHM C[C@@H]1CCC[C@@H](CC(=O)N2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)C1 ZINC000824925521 608477961 /nfs/dbraw/zinc/47/79/61/608477961.db2.gz DQTKHVJBUVMVHZ-HZPDHXFCSA-N -1 3 365.481 3.699 20 0 FHADHM C[C@@H]1CCC[C@@H](CC(=O)N2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)C1 ZINC000824925521 608477963 /nfs/dbraw/zinc/47/79/63/608477963.db2.gz DQTKHVJBUVMVHZ-HZPDHXFCSA-N -1 3 365.481 3.699 20 0 FHADHM Cc1ccc(NCc2cccc(-c3nnn[n-]3)c2F)c(Br)c1 ZINC000826291649 608479017 /nfs/dbraw/zinc/47/90/17/608479017.db2.gz PAJZTGNBCZFYTM-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Cc1ccc(NCc2cccc(-c3nn[n-]n3)c2F)c(Br)c1 ZINC000826291649 608479019 /nfs/dbraw/zinc/47/90/19/608479019.db2.gz PAJZTGNBCZFYTM-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM CC(C)c1ccc(C(=O)N2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)cc1 ZINC000824347701 608484074 /nfs/dbraw/zinc/48/40/74/608484074.db2.gz KXXUPEGCFIPDQJ-UHFFFAOYSA-N -1 3 373.460 3.920 20 0 FHADHM CC(C)c1ccc(C(=O)N2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)cc1 ZINC000824347701 608484076 /nfs/dbraw/zinc/48/40/76/608484076.db2.gz KXXUPEGCFIPDQJ-UHFFFAOYSA-N -1 3 373.460 3.920 20 0 FHADHM c1c(CN[C@@H]2CCCc3cc(-c4nn[n-]n4)ccc32)noc1-c1ccccc1 ZINC000826518924 608508584 /nfs/dbraw/zinc/50/85/84/608508584.db2.gz CQJPCRXRMTWGDV-LJQANCHMSA-N -1 3 372.432 3.689 20 0 FHADHM CCc1nc([C@H](C)N[C@H]2CCCc3cc(-c4nn[n-]n4)ccc32)cs1 ZINC000825746167 608510862 /nfs/dbraw/zinc/51/08/62/608510862.db2.gz SJPHVJKLPSXUQC-NHYWBVRUSA-N -1 3 354.483 3.614 20 0 FHADHM CN(Cc1nc(-c2ccccc2)cs1)Cc1cccc(-c2nn[n-]n2)c1 ZINC000825976768 608521581 /nfs/dbraw/zinc/52/15/81/608521581.db2.gz PLYZVVVGBYEVFJ-UHFFFAOYSA-N -1 3 362.462 3.622 20 0 FHADHM CN(Cc1c(Cl)oc2ccccc21)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000825957818 608525761 /nfs/dbraw/zinc/52/57/61/608525761.db2.gz HADHHBPMCHHKAJ-UHFFFAOYSA-N -1 3 353.813 3.898 20 0 FHADHM CN(Cc1cc(-c2nnn[n-]2)cs1)Cc1c(Cl)cccc1Cl ZINC000825953495 608533156 /nfs/dbraw/zinc/53/31/56/608533156.db2.gz IJXIQRDJSODQIG-UHFFFAOYSA-N -1 3 354.266 3.867 20 0 FHADHM CN(Cc1cc(-c2nn[n-]n2)cs1)Cc1c(Cl)cccc1Cl ZINC000825953495 608533158 /nfs/dbraw/zinc/53/31/58/608533158.db2.gz IJXIQRDJSODQIG-UHFFFAOYSA-N -1 3 354.266 3.867 20 0 FHADHM Brc1cccc([C@H]2CCCN2Cc2ccc(-c3nnn[n-]3)o2)c1 ZINC000823831707 608543147 /nfs/dbraw/zinc/54/31/47/608543147.db2.gz AEVDGSPBBLNEFA-CQSZACIVSA-N -1 3 374.242 3.559 20 0 FHADHM Brc1cccc([C@H]2CCCN2Cc2ccc(-c3nn[n-]n3)o2)c1 ZINC000823831707 608543148 /nfs/dbraw/zinc/54/31/48/608543148.db2.gz AEVDGSPBBLNEFA-CQSZACIVSA-N -1 3 374.242 3.559 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)Nc1ccc(-c2ccc[nH]2)cc1 ZINC000826401750 608561162 /nfs/dbraw/zinc/56/11/62/608561162.db2.gz GAIIHPARIPFULZ-FMIVXFBMSA-N -1 3 356.389 3.514 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)Nc1ccc(-c2ccc[nH]2)cc1 ZINC000826401750 608561164 /nfs/dbraw/zinc/56/11/64/608561164.db2.gz GAIIHPARIPFULZ-FMIVXFBMSA-N -1 3 356.389 3.514 20 0 FHADHM O=C(Nc1nc2c(cc1-c1nnn[n-]1)CCCC2)c1ccc2ccccc2c1 ZINC000826459948 608572691 /nfs/dbraw/zinc/57/26/91/608572691.db2.gz GWUOVTWBWRREHX-UHFFFAOYSA-N -1 3 370.416 3.546 20 0 FHADHM O=C(Nc1nc2c(cc1-c1nn[n-]n1)CCCC2)c1ccc2ccccc2c1 ZINC000826459948 608572692 /nfs/dbraw/zinc/57/26/92/608572692.db2.gz GWUOVTWBWRREHX-UHFFFAOYSA-N -1 3 370.416 3.546 20 0 FHADHM O=C(Nc1ccc(F)c(Cl)c1)c1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000826454177 608573933 /nfs/dbraw/zinc/57/39/33/608573933.db2.gz MHTVVDYSORZLKN-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(F)c(Cl)c1)c1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000826454177 608573934 /nfs/dbraw/zinc/57/39/34/608573934.db2.gz MHTVVDYSORZLKN-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM C[C@@H]1CCN(C(=O)c2ccc(Cl)c(-c3nnn[n-]3)c2)[C@@H](c2ccco2)C1 ZINC000824947777 608576735 /nfs/dbraw/zinc/57/67/35/608576735.db2.gz QVJYOKHBCWHKOH-IAQYHMDHSA-N -1 3 371.828 3.727 20 0 FHADHM C[C@@H]1CCN(C(=O)c2ccc(Cl)c(-c3nn[n-]n3)c2)[C@@H](c2ccco2)C1 ZINC000824947777 608576737 /nfs/dbraw/zinc/57/67/37/608576737.db2.gz QVJYOKHBCWHKOH-IAQYHMDHSA-N -1 3 371.828 3.727 20 0 FHADHM CCCOc1ccc(NC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000825338744 608615126 /nfs/dbraw/zinc/61/51/26/608615126.db2.gz HDNYDXYGYYARAO-CYBMUJFWSA-N -1 3 366.425 3.538 20 0 FHADHM CCCOc1ccc(NC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000825338744 608615128 /nfs/dbraw/zinc/61/51/28/608615128.db2.gz HDNYDXYGYYARAO-CYBMUJFWSA-N -1 3 366.425 3.538 20 0 FHADHM Cc1ccc(C)c([C@@H]2CN(Cc3ccc(-c4nnn[n-]4)s3)[C@H](C)CO2)c1 ZINC000826284841 608729019 /nfs/dbraw/zinc/72/90/19/608729019.db2.gz HTRGOZBZPLNXKP-PBHICJAKSA-N -1 3 369.494 3.507 20 0 FHADHM Cc1ccc(C)c([C@@H]2CN(Cc3ccc(-c4nn[n-]n4)s3)[C@H](C)CO2)c1 ZINC000826284841 608729021 /nfs/dbraw/zinc/72/90/21/608729021.db2.gz HTRGOZBZPLNXKP-PBHICJAKSA-N -1 3 369.494 3.507 20 0 FHADHM Cc1nc(-c2ccc([C@@H](C)Nc3cnccc3-c3nnn[n-]3)cc2)cs1 ZINC000826322567 608772692 /nfs/dbraw/zinc/77/26/92/608772692.db2.gz RYYPJPZKVIPIQB-LLVKDONJSA-N -1 3 363.450 3.867 20 0 FHADHM Cc1nc(-c2ccc([C@@H](C)Nc3cnccc3-c3nn[n-]n3)cc2)cs1 ZINC000826322567 608772695 /nfs/dbraw/zinc/77/26/95/608772695.db2.gz RYYPJPZKVIPIQB-LLVKDONJSA-N -1 3 363.450 3.867 20 0 FHADHM CCCCOc1ccc([C@H](C)Nc2cnccc2-c2nnn[n-]2)cc1OC ZINC000825290657 608774008 /nfs/dbraw/zinc/77/40/08/608774008.db2.gz DBFMUBASIDIHCW-ZDUSSCGKSA-N -1 3 368.441 3.622 20 0 FHADHM CCCCOc1ccc([C@H](C)Nc2cnccc2-c2nn[n-]n2)cc1OC ZINC000825290657 608774009 /nfs/dbraw/zinc/77/40/09/608774009.db2.gz DBFMUBASIDIHCW-ZDUSSCGKSA-N -1 3 368.441 3.622 20 0 FHADHM Fc1ccc2ccnc(N3CC=C(c4ccc(-c5nnn[n-]5)cc4)CC3)c2c1 ZINC000826375751 608796896 /nfs/dbraw/zinc/79/68/96/608796896.db2.gz AONLACDUILTZFV-UHFFFAOYSA-N -1 3 372.407 3.848 20 0 FHADHM Fc1ccc2ccnc(N3CC=C(c4ccc(-c5nn[n-]n5)cc4)CC3)c2c1 ZINC000826375751 608796897 /nfs/dbraw/zinc/79/68/97/608796897.db2.gz AONLACDUILTZFV-UHFFFAOYSA-N -1 3 372.407 3.848 20 0 FHADHM Clc1cccc(-c2n[nH]cc2CNc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000826352690 608868351 /nfs/dbraw/zinc/86/83/51/608868351.db2.gz KOEFCOUNKIIAQQ-UHFFFAOYSA-N -1 3 351.801 3.522 20 0 FHADHM CC[C@@H](C)Oc1cc(CNc2cccc(-c3nnn[n-]3)c2)ccc1OC ZINC000825076860 608870712 /nfs/dbraw/zinc/87/07/12/608870712.db2.gz YFQLJPFTBOEHKW-CYBMUJFWSA-N -1 3 353.426 3.665 20 0 FHADHM CC[C@@H](C)Oc1cc(CNc2cccc(-c3nn[n-]n3)c2)ccc1OC ZINC000825076860 608870715 /nfs/dbraw/zinc/87/07/15/608870715.db2.gz YFQLJPFTBOEHKW-CYBMUJFWSA-N -1 3 353.426 3.665 20 0 FHADHM CCC(=O)Nc1ccc(C)c(N[C@@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)c1 ZINC000825034923 609157851 /nfs/dbraw/zinc/15/78/51/609157851.db2.gz UJMRXNFCQOFSJV-LBPRGKRZSA-N -1 3 368.416 3.836 20 0 FHADHM CCC(=O)Nc1ccc(C)c(N[C@@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)c1 ZINC000825034923 609157852 /nfs/dbraw/zinc/15/78/52/609157852.db2.gz UJMRXNFCQOFSJV-LBPRGKRZSA-N -1 3 368.416 3.836 20 0 FHADHM C[C@H](Nc1ccc(N2CCCC2)cc1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824655908 609162150 /nfs/dbraw/zinc/16/21/50/609162150.db2.gz GTJKNTIDLMMPAF-ZDUSSCGKSA-N -1 3 352.417 3.779 20 0 FHADHM C[C@H](Nc1ccc(N2CCCC2)cc1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824655908 609162151 /nfs/dbraw/zinc/16/21/51/609162151.db2.gz GTJKNTIDLMMPAF-ZDUSSCGKSA-N -1 3 352.417 3.779 20 0 FHADHM CCOc1ccc(N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1OCC ZINC000825643983 609162495 /nfs/dbraw/zinc/16/24/95/609162495.db2.gz ZBRIXFZAQVGVTI-ZDUSSCGKSA-N -1 3 353.426 3.837 20 0 FHADHM CCOc1ccc(N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1OCC ZINC000825643983 609162496 /nfs/dbraw/zinc/16/24/96/609162496.db2.gz ZBRIXFZAQVGVTI-ZDUSSCGKSA-N -1 3 353.426 3.837 20 0 FHADHM C[C@@H]1CCN(c2ccc3cc(-c4nnn[n-]4)ccc3n2)[C@H](c2ccco2)C1 ZINC000824963030 609164393 /nfs/dbraw/zinc/16/43/93/609164393.db2.gz YUAIWWSZLXLSKX-DYVFJYSZSA-N -1 3 360.421 3.986 20 0 FHADHM C[C@@H]1CCN(c2ccc3cc(-c4nn[n-]n4)ccc3n2)[C@H](c2ccco2)C1 ZINC000824963030 609164395 /nfs/dbraw/zinc/16/43/95/609164395.db2.gz YUAIWWSZLXLSKX-DYVFJYSZSA-N -1 3 360.421 3.986 20 0 FHADHM CCc1nc2cc(N[C@H](C)c3ccc(-c4nnn[n-]4)c(F)c3)ccc2o1 ZINC000825750029 609176405 /nfs/dbraw/zinc/17/64/05/609176405.db2.gz IOOLRWHXNXPNNA-SNVBAGLBSA-N -1 3 352.373 3.883 20 0 FHADHM CCc1nc2cc(N[C@H](C)c3ccc(-c4nn[n-]n4)c(F)c3)ccc2o1 ZINC000825750029 609176407 /nfs/dbraw/zinc/17/64/07/609176407.db2.gz IOOLRWHXNXPNNA-SNVBAGLBSA-N -1 3 352.373 3.883 20 0 FHADHM C[C@@H](Nc1cc(F)c(N2CCCC2)c(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824648416 609179948 /nfs/dbraw/zinc/17/99/48/609179948.db2.gz FVSOCQQHGSNFBR-GFCCVEGCSA-N -1 3 370.407 3.918 20 0 FHADHM C[C@@H](Nc1cc(F)c(N2CCCC2)c(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824648416 609179950 /nfs/dbraw/zinc/17/99/50/609179950.db2.gz FVSOCQQHGSNFBR-GFCCVEGCSA-N -1 3 370.407 3.918 20 0 FHADHM Cc1cc(NCc2ccc(-c3nnn[n-]3)cc2)nn1-c1ccccc1Cl ZINC000826271563 609180496 /nfs/dbraw/zinc/18/04/96/609180496.db2.gz XEDOPSHVGDWPOO-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM Cc1cc(NCc2ccc(-c3nn[n-]n3)cc2)nn1-c1ccccc1Cl ZINC000826271563 609180498 /nfs/dbraw/zinc/18/04/98/609180498.db2.gz XEDOPSHVGDWPOO-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM Cc1cc(NCc2ccccc2-c2nnn[n-]2)nn1-c1ccccc1Cl ZINC000826271206 609180659 /nfs/dbraw/zinc/18/06/59/609180659.db2.gz HWZGQPUAOAMELW-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM Cc1cc(NCc2ccccc2-c2nn[n-]n2)nn1-c1ccccc1Cl ZINC000826271206 609180660 /nfs/dbraw/zinc/18/06/60/609180660.db2.gz HWZGQPUAOAMELW-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM Cc1cc(NCc2cc(-c3nnn[n-]3)cs2)nn1-c1cccc(Cl)c1 ZINC000826271454 609187912 /nfs/dbraw/zinc/18/79/12/609187912.db2.gz RWWKKYRWIQPLOQ-UHFFFAOYSA-N -1 3 371.857 3.688 20 0 FHADHM Cc1cc(NCc2cc(-c3nn[n-]n3)cs2)nn1-c1cccc(Cl)c1 ZINC000826271454 609187914 /nfs/dbraw/zinc/18/79/14/609187914.db2.gz RWWKKYRWIQPLOQ-UHFFFAOYSA-N -1 3 371.857 3.688 20 0 FHADHM C[C@@H](c1ccc2ccccc2c1)N(C(=O)c1c[nH]c(-c2nnn[n-]2)c1)C1CC1 ZINC000824762640 609218713 /nfs/dbraw/zinc/21/87/13/609218713.db2.gz IBEOHWWWAJHARU-ZDUSSCGKSA-N -1 3 372.432 3.714 20 0 FHADHM C[C@@H](c1ccc2ccccc2c1)N(C(=O)c1c[nH]c(-c2nn[n-]n2)c1)C1CC1 ZINC000824762640 609218715 /nfs/dbraw/zinc/21/87/15/609218715.db2.gz IBEOHWWWAJHARU-ZDUSSCGKSA-N -1 3 372.432 3.714 20 0 FHADHM C[C@H](Nc1cc(F)ccc1OC(F)F)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824650864 609247086 /nfs/dbraw/zinc/24/70/86/609247086.db2.gz VBKBLNROVOWTDB-QMMMGPOBSA-N -1 3 367.306 3.919 20 0 FHADHM C[C@H](Nc1cc(F)ccc1OC(F)F)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824650864 609247088 /nfs/dbraw/zinc/24/70/88/609247088.db2.gz VBKBLNROVOWTDB-QMMMGPOBSA-N -1 3 367.306 3.919 20 0 FHADHM O=C(c1ccccc1-c1ccccc1-c1nnn[n-]1)N1CC2(C1)CCCCC2 ZINC000826474569 609249375 /nfs/dbraw/zinc/24/93/75/609249375.db2.gz VXLBEZWKGRPTEN-UHFFFAOYSA-N -1 3 373.460 3.940 20 0 FHADHM O=C(c1ccccc1-c1ccccc1-c1nn[n-]n1)N1CC2(C1)CCCCC2 ZINC000826474569 609249376 /nfs/dbraw/zinc/24/93/76/609249376.db2.gz VXLBEZWKGRPTEN-UHFFFAOYSA-N -1 3 373.460 3.940 20 0 FHADHM C[C@@H](Nc1ccc(F)cc1OCC(F)F)c1cccc(-c2nnn[n-]2)c1 ZINC000824656237 609254066 /nfs/dbraw/zinc/25/40/66/609254066.db2.gz JMCPVJYDMGKKMT-SNVBAGLBSA-N -1 3 363.343 3.823 20 0 FHADHM C[C@@H](Nc1ccc(F)cc1OCC(F)F)c1cccc(-c2nn[n-]n2)c1 ZINC000824656237 609254068 /nfs/dbraw/zinc/25/40/68/609254068.db2.gz JMCPVJYDMGKKMT-SNVBAGLBSA-N -1 3 363.343 3.823 20 0 FHADHM Fc1ccc(Oc2ccc(NCc3cc(-c4nnn[n-]4)cs3)cn2)cc1 ZINC000826375853 609266262 /nfs/dbraw/zinc/26/62/62/609266262.db2.gz DXLBLFVHNUWIMH-UHFFFAOYSA-N -1 3 368.397 3.867 20 0 FHADHM Fc1ccc(Oc2ccc(NCc3cc(-c4nn[n-]n4)cs3)cn2)cc1 ZINC000826375853 609266263 /nfs/dbraw/zinc/26/62/63/609266263.db2.gz DXLBLFVHNUWIMH-UHFFFAOYSA-N -1 3 368.397 3.867 20 0 FHADHM c1sc(CNc2nnc(CC3CCCCC3)s2)cc1-c1nnn[n-]1 ZINC000826526615 609266820 /nfs/dbraw/zinc/26/68/20/609266820.db2.gz FMDOKVVUJXBQLJ-UHFFFAOYSA-N -1 3 361.500 3.515 20 0 FHADHM c1sc(CNc2nnc(CC3CCCCC3)s2)cc1-c1nn[n-]n1 ZINC000826526615 609266822 /nfs/dbraw/zinc/26/68/22/609266822.db2.gz FMDOKVVUJXBQLJ-UHFFFAOYSA-N -1 3 361.500 3.515 20 0 FHADHM CCC(=O)Nc1ccc(N[C@@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)cc1 ZINC000825034201 609269086 /nfs/dbraw/zinc/26/90/86/609269086.db2.gz GPMCUPRETBWWCU-NSHDSACASA-N -1 3 354.389 3.527 20 0 FHADHM CCC(=O)Nc1ccc(N[C@@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)cc1 ZINC000825034201 609269088 /nfs/dbraw/zinc/26/90/88/609269088.db2.gz GPMCUPRETBWWCU-NSHDSACASA-N -1 3 354.389 3.527 20 0 FHADHM FC(F)Oc1ccccc1N[C@@H]1CCCc2cc(-c3nnn[n-]3)ccc21 ZINC000826370462 609272504 /nfs/dbraw/zinc/27/25/04/609272504.db2.gz UIMRVJUUVFNJBS-CQSZACIVSA-N -1 3 357.364 3.958 20 0 FHADHM FC(F)Oc1ccccc1N[C@@H]1CCCc2cc(-c3nn[n-]n3)ccc21 ZINC000826370462 609272506 /nfs/dbraw/zinc/27/25/06/609272506.db2.gz UIMRVJUUVFNJBS-CQSZACIVSA-N -1 3 357.364 3.958 20 0 FHADHM C[C@@H](Nc1cccc(C(=O)NC(C)(C)C)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824662566 609273179 /nfs/dbraw/zinc/27/31/79/609273179.db2.gz NFMUUWQJWJNAQC-CYBMUJFWSA-N -1 3 364.453 3.568 20 0 FHADHM C[C@@H](Nc1cccc(C(=O)NC(C)(C)C)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824662566 609273181 /nfs/dbraw/zinc/27/31/81/609273181.db2.gz NFMUUWQJWJNAQC-CYBMUJFWSA-N -1 3 364.453 3.568 20 0 FHADHM C[C@@H](Nc1ccc2c(c1)OC(C)(C)O2)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824656569 609274338 /nfs/dbraw/zinc/27/43/38/609274338.db2.gz LYLPXDHHDRBAPN-SNVBAGLBSA-N -1 3 355.373 3.686 20 0 FHADHM C[C@@H](Nc1ccc2c(c1)OC(C)(C)O2)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824656569 609274340 /nfs/dbraw/zinc/27/43/40/609274340.db2.gz LYLPXDHHDRBAPN-SNVBAGLBSA-N -1 3 355.373 3.686 20 0 FHADHM COc1ccc(N[C@@H]2CCCc3cc(-c4nnn[n-]4)ccc32)c2cccnc12 ZINC000826210132 609276957 /nfs/dbraw/zinc/27/69/57/609276957.db2.gz FTSIDWSUTVCQFR-QGZVFWFLSA-N -1 3 372.432 3.913 20 0 FHADHM COc1ccc(N[C@@H]2CCCc3cc(-c4nn[n-]n4)ccc32)c2cccnc12 ZINC000826210132 609276959 /nfs/dbraw/zinc/27/69/59/609276959.db2.gz FTSIDWSUTVCQFR-QGZVFWFLSA-N -1 3 372.432 3.913 20 0 FHADHM C[C@@H](Nc1ccc(F)cc1OC(F)F)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824655083 609278780 /nfs/dbraw/zinc/27/87/80/609278780.db2.gz BFCHOURPTBFZJT-MRVPVSSYSA-N -1 3 367.306 3.919 20 0 FHADHM C[C@@H](Nc1ccc(F)cc1OC(F)F)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824655083 609278782 /nfs/dbraw/zinc/27/87/82/609278782.db2.gz BFCHOURPTBFZJT-MRVPVSSYSA-N -1 3 367.306 3.919 20 0 FHADHM Cc1cc(N[C@H](C)c2cccc(-c3nnn[n-]3)c2)nn1-c1ccc(C)cc1 ZINC000826281292 609281688 /nfs/dbraw/zinc/28/16/88/609281688.db2.gz LRVYRKKHYOULFZ-OAHLLOKOSA-N -1 3 359.437 3.842 20 0 FHADHM Cc1cc(N[C@H](C)c2cccc(-c3nn[n-]n3)c2)nn1-c1ccc(C)cc1 ZINC000826281292 609281689 /nfs/dbraw/zinc/28/16/89/609281689.db2.gz LRVYRKKHYOULFZ-OAHLLOKOSA-N -1 3 359.437 3.842 20 0 FHADHM CCC[C@@H](C)NC(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000825232961 609302445 /nfs/dbraw/zinc/30/24/45/609302445.db2.gz LSRIFLMXLVCJJQ-CYBMUJFWSA-N -1 3 351.410 3.577 20 0 FHADHM CCC[C@@H](C)NC(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000825232961 609302446 /nfs/dbraw/zinc/30/24/46/609302446.db2.gz LSRIFLMXLVCJJQ-CYBMUJFWSA-N -1 3 351.410 3.577 20 0 FHADHM CCC[C@H](C)NC(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000825232971 609302501 /nfs/dbraw/zinc/30/25/01/609302501.db2.gz LSRIFLMXLVCJJQ-ZDUSSCGKSA-N -1 3 351.410 3.577 20 0 FHADHM CCC[C@H](C)NC(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000825232971 609302504 /nfs/dbraw/zinc/30/25/04/609302504.db2.gz LSRIFLMXLVCJJQ-ZDUSSCGKSA-N -1 3 351.410 3.577 20 0 FHADHM Cc1nnc(SCCCSCc2ccccc2)c(-c2nnn[n-]2)c1C ZINC000826336601 609306005 /nfs/dbraw/zinc/30/60/05/609306005.db2.gz FOTCVAOXGMTZMV-UHFFFAOYSA-N -1 3 372.523 3.689 20 0 FHADHM Cc1nnc(SCCCSCc2ccccc2)c(-c2nn[n-]n2)c1C ZINC000826336601 609306007 /nfs/dbraw/zinc/30/60/07/609306007.db2.gz FOTCVAOXGMTZMV-UHFFFAOYSA-N -1 3 372.523 3.689 20 0 FHADHM COCCC[C@H](C)C(=O)Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1 ZINC000826155484 609315176 /nfs/dbraw/zinc/31/51/76/609315176.db2.gz RKMICKQIOFUAHL-LBPRGKRZSA-N -1 3 371.466 3.596 20 0 FHADHM COCCC[C@H](C)C(=O)Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1 ZINC000826155484 609315178 /nfs/dbraw/zinc/31/51/78/609315178.db2.gz RKMICKQIOFUAHL-LBPRGKRZSA-N -1 3 371.466 3.596 20 0 FHADHM O=C(Nc1ccsc1)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000826458852 609321825 /nfs/dbraw/zinc/32/18/25/609321825.db2.gz JMVLLECZHOSFHV-UHFFFAOYSA-N -1 3 363.402 3.973 20 0 FHADHM O=C(Nc1ccsc1)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000826458852 609321827 /nfs/dbraw/zinc/32/18/27/609321827.db2.gz JMVLLECZHOSFHV-UHFFFAOYSA-N -1 3 363.402 3.973 20 0 FHADHM CCC(CC)[C@@H]1C[C@H](Nc2c(F)cc(-c3nnn[n-]3)cc2F)CCO1 ZINC000825107550 609322119 /nfs/dbraw/zinc/32/21/19/609322119.db2.gz QRULXIGJLROEFG-DOMZBBRYSA-N -1 3 351.401 3.541 20 0 FHADHM CCC(CC)[C@@H]1C[C@H](Nc2c(F)cc(-c3nn[n-]n3)cc2F)CCO1 ZINC000825107550 609322121 /nfs/dbraw/zinc/32/21/21/609322121.db2.gz QRULXIGJLROEFG-DOMZBBRYSA-N -1 3 351.401 3.541 20 0 FHADHM CCC(CC)[C@H]1C[C@H](Nc2c(F)cc(-c3nnn[n-]3)cc2F)CCO1 ZINC000825107551 609322399 /nfs/dbraw/zinc/32/23/99/609322399.db2.gz QRULXIGJLROEFG-IUODEOHRSA-N -1 3 351.401 3.541 20 0 FHADHM CCC(CC)[C@H]1C[C@H](Nc2c(F)cc(-c3nn[n-]n3)cc2F)CCO1 ZINC000825107551 609322401 /nfs/dbraw/zinc/32/24/01/609322401.db2.gz QRULXIGJLROEFG-IUODEOHRSA-N -1 3 351.401 3.541 20 0 FHADHM COc1ccc(C)cc1[C@H](C)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000826189750 609323899 /nfs/dbraw/zinc/32/38/99/609323899.db2.gz DHUNMAXXAJMKIC-OLZOCXBDSA-N -1 3 355.417 3.735 20 0 FHADHM C[C@H](N[C@H](c1ccccc1)c1cccnc1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824540296 609333003 /nfs/dbraw/zinc/33/30/03/609333003.db2.gz VNACIGQTNPVRIV-VBKZILBWSA-N -1 3 374.423 3.841 20 0 FHADHM C[C@H](N[C@H](c1ccccc1)c1cccnc1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824540296 609333005 /nfs/dbraw/zinc/33/30/05/609333005.db2.gz VNACIGQTNPVRIV-VBKZILBWSA-N -1 3 374.423 3.841 20 0 FHADHM Cc1c(NCc2ccccc2-c2nnn[n-]2)cnn1-c1cc(C)ccc1C ZINC000826284193 609344395 /nfs/dbraw/zinc/34/43/95/609344395.db2.gz MRZOOZBJMHJSBC-UHFFFAOYSA-N -1 3 359.437 3.590 20 0 FHADHM Cc1c(NCc2ccccc2-c2nn[n-]n2)cnn1-c1cc(C)ccc1C ZINC000826284193 609344396 /nfs/dbraw/zinc/34/43/96/609344396.db2.gz MRZOOZBJMHJSBC-UHFFFAOYSA-N -1 3 359.437 3.590 20 0 FHADHM CCc1c(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2F)cnn1CC(C)C ZINC000825693724 609347869 /nfs/dbraw/zinc/34/78/69/609347869.db2.gz BJSBQADAMORWBW-GFCCVEGCSA-N -1 3 357.437 3.594 20 0 FHADHM CCc1c(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2F)cnn1CC(C)C ZINC000825693724 609347871 /nfs/dbraw/zinc/34/78/71/609347871.db2.gz BJSBQADAMORWBW-GFCCVEGCSA-N -1 3 357.437 3.594 20 0 FHADHM C[C@@H](Nc1ccc(N(C)C)c(Cl)c1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824658552 609349347 /nfs/dbraw/zinc/34/93/47/609349347.db2.gz YAUAGWPSQZBAOT-SNVBAGLBSA-N -1 3 360.824 3.898 20 0 FHADHM C[C@@H](Nc1ccc(N(C)C)c(Cl)c1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824658552 609349349 /nfs/dbraw/zinc/34/93/49/609349349.db2.gz YAUAGWPSQZBAOT-SNVBAGLBSA-N -1 3 360.824 3.898 20 0 FHADHM C[C@H](Nc1ccn(-c2cccc(F)c2-c2nnn[n-]2)n1)c1ccccc1F ZINC000824662569 609351078 /nfs/dbraw/zinc/35/10/78/609351078.db2.gz NGDKKSRCNPVPMF-NSHDSACASA-N -1 3 367.363 3.504 20 0 FHADHM Cc1nn(-c2ccccc2)cc1N[C@H]1CCCc2cc(-c3nnn[n-]3)ccc21 ZINC000826332646 609351675 /nfs/dbraw/zinc/35/16/75/609351675.db2.gz BAFRALKCKHAMEC-IBGZPJMESA-N -1 3 371.448 3.850 20 0 FHADHM Cc1nn(-c2ccccc2)cc1N[C@H]1CCCc2cc(-c3nn[n-]n3)ccc21 ZINC000826332646 609351676 /nfs/dbraw/zinc/35/16/76/609351676.db2.gz BAFRALKCKHAMEC-IBGZPJMESA-N -1 3 371.448 3.850 20 0 FHADHM CC(=O)c1ccc(-c2nnn[n-]2)cc1N1CCC(Cc2ccccc2)CC1 ZINC000824015791 609417478 /nfs/dbraw/zinc/41/74/78/609417478.db2.gz ZBWWZRCHBFFZOW-UHFFFAOYSA-N -1 3 361.449 3.528 20 0 FHADHM CC(=O)c1ccc(-c2nn[n-]n2)cc1N1CCC(Cc2ccccc2)CC1 ZINC000824015791 609417480 /nfs/dbraw/zinc/41/74/80/609417480.db2.gz ZBWWZRCHBFFZOW-UHFFFAOYSA-N -1 3 361.449 3.528 20 0 FHADHM CCn1c2ccccc2c2cc(NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)ccc21 ZINC000825796812 609418626 /nfs/dbraw/zinc/41/86/26/609418626.db2.gz PAVQADHPJIOKRA-UHFFFAOYSA-N -1 3 371.404 3.575 20 0 FHADHM CCn1c2ccccc2c2cc(NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)ccc21 ZINC000825796812 609418628 /nfs/dbraw/zinc/41/86/28/609418628.db2.gz PAVQADHPJIOKRA-UHFFFAOYSA-N -1 3 371.404 3.575 20 0 FHADHM Cc1ccncc1CSc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000826315661 609451551 /nfs/dbraw/zinc/45/15/51/609451551.db2.gz PKHCHNAEFBKPDV-UHFFFAOYSA-N -1 3 351.357 3.881 20 0 FHADHM Cc1ccncc1CSc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000826315661 609451553 /nfs/dbraw/zinc/45/15/53/609451553.db2.gz PKHCHNAEFBKPDV-UHFFFAOYSA-N -1 3 351.357 3.881 20 0 FHADHM Cc1csc(CSc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)n1 ZINC000826321300 609452659 /nfs/dbraw/zinc/45/26/59/609452659.db2.gz ZQPAPTQWVCWKOG-UHFFFAOYSA-N -1 3 357.386 3.943 20 0 FHADHM Cc1csc(CSc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)n1 ZINC000826321300 609452661 /nfs/dbraw/zinc/45/26/61/609452661.db2.gz ZQPAPTQWVCWKOG-UHFFFAOYSA-N -1 3 357.386 3.943 20 0 FHADHM Cc1c2ccccc2oc1[C@H](C)Nc1nc2ccccn2c1-c1nnn[n-]1 ZINC000826235035 609464121 /nfs/dbraw/zinc/46/41/21/609464121.db2.gz ADQFROVNCMJYKG-LBPRGKRZSA-N -1 3 359.393 3.742 20 0 FHADHM Cc1c2ccccc2oc1[C@H](C)Nc1nc2ccccn2c1-c1nn[n-]n1 ZINC000826235035 609464123 /nfs/dbraw/zinc/46/41/23/609464123.db2.gz ADQFROVNCMJYKG-LBPRGKRZSA-N -1 3 359.393 3.742 20 0 FHADHM Cc1c(NCc2ccc(CSC(F)F)o2)cccc1-c1nnn[n-]1 ZINC000826242644 609487120 /nfs/dbraw/zinc/48/71/20/609487120.db2.gz YXJBSMRRUHQEAP-UHFFFAOYSA-N -1 3 351.382 3.836 20 0 FHADHM Cc1c(NCc2ccc(CSC(F)F)o2)cccc1-c1nn[n-]n1 ZINC000826242644 609487123 /nfs/dbraw/zinc/48/71/23/609487123.db2.gz YXJBSMRRUHQEAP-UHFFFAOYSA-N -1 3 351.382 3.836 20 0 FHADHM CCOC(=O)Nc1ccc(NC/C=C/c2ccccc2)cc1-c1nnn[n-]1 ZINC000825553021 609487910 /nfs/dbraw/zinc/48/79/10/609487910.db2.gz IDCCDNMRJFPXPY-RMKNXTFCSA-N -1 3 364.409 3.560 20 0 FHADHM CCOC(=O)Nc1ccc(NC/C=C/c2ccccc2)cc1-c1nn[n-]n1 ZINC000825553021 609487911 /nfs/dbraw/zinc/48/79/11/609487911.db2.gz IDCCDNMRJFPXPY-RMKNXTFCSA-N -1 3 364.409 3.560 20 0 FHADHM O=C(CSc1ccc(-c2nnn[n-]2)cc1)c1cccc(C(F)(F)F)c1 ZINC000826420981 609489007 /nfs/dbraw/zinc/48/90/07/609489007.db2.gz MBTORJZCACQMJK-UHFFFAOYSA-N -1 3 364.352 3.861 20 0 FHADHM O=C(CSc1ccc(-c2nn[n-]n2)cc1)c1cccc(C(F)(F)F)c1 ZINC000826420981 609489008 /nfs/dbraw/zinc/48/90/08/609489008.db2.gz MBTORJZCACQMJK-UHFFFAOYSA-N -1 3 364.352 3.861 20 0 FHADHM CC(C)Cc1ncc(CNc2ccc(OC(C)C)c(-c3nnn[n-]3)c2)s1 ZINC000824280651 609490037 /nfs/dbraw/zinc/49/00/37/609490037.db2.gz SFLRTVQYVKYQCK-UHFFFAOYSA-N -1 3 372.498 3.921 20 0 FHADHM CC(C)Cc1ncc(CNc2ccc(OC(C)C)c(-c3nn[n-]n3)c2)s1 ZINC000824280651 609490038 /nfs/dbraw/zinc/49/00/38/609490038.db2.gz SFLRTVQYVKYQCK-UHFFFAOYSA-N -1 3 372.498 3.921 20 0 FHADHM CC(C)Oc1ccc(NCc2ccc3ncccc3c2)cc1-c1nnn[n-]1 ZINC000824329964 609490144 /nfs/dbraw/zinc/49/01/44/609490144.db2.gz ZGDUEOFNEUKYKT-UHFFFAOYSA-N -1 3 360.421 3.814 20 0 FHADHM CC(C)Oc1ccc(NCc2ccc3ncccc3c2)cc1-c1nn[n-]n1 ZINC000824329964 609490145 /nfs/dbraw/zinc/49/01/45/609490145.db2.gz ZGDUEOFNEUKYKT-UHFFFAOYSA-N -1 3 360.421 3.814 20 0 FHADHM Cc1cc(C)n(-c2ccc([C@@H](C)Nc3nccc(C)c3-c3nnn[n-]3)cc2)n1 ZINC000826265268 609575558 /nfs/dbraw/zinc/57/55/58/609575558.db2.gz RYYOYTIOIOAQNP-OAHLLOKOSA-N -1 3 374.452 3.546 20 0 FHADHM Cc1cc(C)n(-c2ccc([C@@H](C)Nc3nccc(C)c3-c3nn[n-]n3)cc2)n1 ZINC000826265268 609575560 /nfs/dbraw/zinc/57/55/60/609575560.db2.gz RYYOYTIOIOAQNP-OAHLLOKOSA-N -1 3 374.452 3.546 20 0 FHADHM COc1ccccc1CCCOc1c(Cl)cc(-c2nnn[n-]2)cc1OC ZINC000826219441 609583052 /nfs/dbraw/zinc/58/30/52/609583052.db2.gz BYGPLVOYHBTSHC-UHFFFAOYSA-N -1 3 374.828 3.549 20 0 FHADHM COc1ccccc1CCCOc1c(Cl)cc(-c2nn[n-]n2)cc1OC ZINC000826219441 609583053 /nfs/dbraw/zinc/58/30/53/609583053.db2.gz BYGPLVOYHBTSHC-UHFFFAOYSA-N -1 3 374.828 3.549 20 0 FHADHM CCC(CC)[C@H]1C[C@H](Nc2ncc(Cl)c(C)c2-c2nnn[n-]2)CCO1 ZINC000825106664 609585315 /nfs/dbraw/zinc/58/53/15/609585315.db2.gz HTBZJTSMCISGRY-TZMCWYRMSA-N -1 3 364.881 3.619 20 0 FHADHM CCC(CC)[C@H]1C[C@H](Nc2ncc(Cl)c(C)c2-c2nn[n-]n2)CCO1 ZINC000825106664 609585317 /nfs/dbraw/zinc/58/53/17/609585317.db2.gz HTBZJTSMCISGRY-TZMCWYRMSA-N -1 3 364.881 3.619 20 0 FHADHM Cc1nc(-c2ccccc2)sc1NC(=O)c1sccc1-c1nnn[n-]1 ZINC000826322996 609591475 /nfs/dbraw/zinc/59/14/75/609591475.db2.gz LIILWTXGSIWYLW-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM Cc1nc(-c2ccccc2)sc1NC(=O)c1sccc1-c1nn[n-]n1 ZINC000826322996 609591476 /nfs/dbraw/zinc/59/14/76/609591476.db2.gz LIILWTXGSIWYLW-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM C[C@H]1C[C@@H](CCNc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)CCO1 ZINC000824885570 609596443 /nfs/dbraw/zinc/59/64/43/609596443.db2.gz SVBXVEADZJEMTJ-QWRGUYRKSA-N -1 3 355.364 3.503 20 0 FHADHM C[C@@H]1CC(C)(C)c2ccccc2N1C(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000824874585 609622587 /nfs/dbraw/zinc/62/25/87/609622587.db2.gz DYMRGZFLENMJCD-LLVKDONJSA-N -1 3 353.451 3.645 20 0 FHADHM C[C@@H]1CC(C)(C)c2ccccc2N1C(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000824874585 609622589 /nfs/dbraw/zinc/62/25/89/609622589.db2.gz DYMRGZFLENMJCD-LLVKDONJSA-N -1 3 353.451 3.645 20 0 FHADHM C[C@@H]1CC(C)(C)c2ccccc2N1C(=O)c1sccc1-c1nnn[n-]1 ZINC000824875928 609622642 /nfs/dbraw/zinc/62/26/42/609622642.db2.gz POGUYVMFNCXZDT-LLVKDONJSA-N -1 3 353.451 3.645 20 0 FHADHM C[C@@H]1CC(C)(C)c2ccccc2N1C(=O)c1sccc1-c1nn[n-]n1 ZINC000824875928 609622643 /nfs/dbraw/zinc/62/26/43/609622643.db2.gz POGUYVMFNCXZDT-LLVKDONJSA-N -1 3 353.451 3.645 20 0 FHADHM COc1cc(C(=O)N2C[C@@H](c3ccc(F)cc3)C[C@H]2C)cc(OC)c1[O-] ZINC000162216247 936357406 /nfs/dbraw/zinc/35/74/06/936357406.db2.gz VPDJSCVIUULCRX-DOMZBBRYSA-N -1 3 359.397 3.567 20 0 FHADHM O=C(c1cc([O-])ccc1Cl)N1CCC(c2nc3ccccc3[nH]2)CC1 ZINC000431515640 936371418 /nfs/dbraw/zinc/37/14/18/936371418.db2.gz BYOAFMIDPPJULM-UHFFFAOYSA-N -1 3 355.825 3.942 20 0 FHADHM COc1ccc(-c2ncc(C(=O)Nc3cccc([O-])c3F)s2)cc1OC ZINC000562470136 927283277 /nfs/dbraw/zinc/28/32/77/927283277.db2.gz QYWGBDVEGFSUMM-UHFFFAOYSA-N -1 3 374.393 3.924 20 0 FHADHM Cc1cc([N-]S(=O)(=O)c2cc(Cl)cc(C(F)(F)F)c2)c(C)cn1 ZINC000547628621 927408015 /nfs/dbraw/zinc/40/80/15/927408015.db2.gz XQBFBLZDMQANBZ-UHFFFAOYSA-N -1 3 364.776 3.593 20 0 FHADHM O=C(NCc1ncccc1[O-])Nc1ncc(Cc2cccc(Cl)c2)s1 ZINC000471131124 927660935 /nfs/dbraw/zinc/66/09/35/927660935.db2.gz OHBYVBNNWDJTFS-UHFFFAOYSA-N -1 3 374.853 3.810 20 0 FHADHM O=c1[nH]c(CC(F)(F)F)c([O-])n1-c1ccc(CCC(F)(F)F)cc1 ZINC000278106528 937184591 /nfs/dbraw/zinc/18/45/91/937184591.db2.gz KRGCJZZGAIDVMD-SNVBAGLBSA-N -1 3 354.250 3.559 20 0 FHADHM COc1ccc([C@@H](CC(=O)[O-])NCc2csc(Br)c2)cc1 ZINC000683171596 927747486 /nfs/dbraw/zinc/74/74/86/927747486.db2.gz MVNARCIUKQNYOJ-CYBMUJFWSA-N -1 3 370.268 3.825 20 0 FHADHM Cc1cc(CN[C@H](C(=O)[O-])c2cccc(Br)c2)ccc1F ZINC000683173842 927759582 /nfs/dbraw/zinc/75/95/82/927759582.db2.gz LNQXRQMZQGLHGR-HNNXBMFYSA-N -1 3 352.203 3.812 20 0 FHADHM Cc1cc(CN[C@@H](C(=O)[O-])c2cccc(Br)c2)ccc1F ZINC000683173843 927760118 /nfs/dbraw/zinc/76/01/18/927760118.db2.gz LNQXRQMZQGLHGR-OAHLLOKOSA-N -1 3 352.203 3.812 20 0 FHADHM Cc1ccc(-c2ccc(C)c(-n3c([O-])c(CC(F)(F)F)[nH]c3=O)c2)o1 ZINC000583160931 937191869 /nfs/dbraw/zinc/19/18/69/937191869.db2.gz XOUYCEZINVPNGF-LBPRGKRZSA-N -1 3 352.312 3.941 20 0 FHADHM Cc1c(NC([O-])=NO[C@H]2CCCCO2)cccc1C(=O)Nc1ccccc1 ZINC000274745692 927814994 /nfs/dbraw/zinc/81/49/94/927814994.db2.gz GLEIQWFPFYVAGG-SFHVURJKSA-N -1 3 369.421 3.827 20 0 FHADHM Cc1c(NC(=O)[N-]O[C@H]2CCCCO2)cccc1C(=O)Nc1ccccc1 ZINC000274745692 927815001 /nfs/dbraw/zinc/81/50/01/927815001.db2.gz GLEIQWFPFYVAGG-SFHVURJKSA-N -1 3 369.421 3.827 20 0 FHADHM Cc1cc(C)n(-c2ccc([N-]S(=O)(=O)c3cc(C)ccc3C)cc2)n1 ZINC000029403598 927874105 /nfs/dbraw/zinc/87/41/05/927874105.db2.gz YSGFHCSVKSWNSH-UHFFFAOYSA-N -1 3 355.463 3.907 20 0 FHADHM Cc1csc(C(=O)OCc2noc(-c3ccccc3[O-])n2)c1Cl ZINC000784931300 927886590 /nfs/dbraw/zinc/88/65/90/927886590.db2.gz MVFHGPUIVJAZPK-UHFFFAOYSA-N -1 3 350.783 3.823 20 0 FHADHM CCCCOCCOCc1cccc(NC([O-])=NO[C@@H]2CCCCO2)c1 ZINC000274760582 928069389 /nfs/dbraw/zinc/06/93/89/928069389.db2.gz KASQDDOSXGJMEB-GOSISDBHSA-N -1 3 366.458 3.600 20 0 FHADHM CCCCOCCOCc1cccc(NC(=O)[N-]O[C@@H]2CCCCO2)c1 ZINC000274760582 928069403 /nfs/dbraw/zinc/06/94/03/928069403.db2.gz KASQDDOSXGJMEB-GOSISDBHSA-N -1 3 366.458 3.600 20 0 FHADHM COc1ccc([O-])c(-c2nc(Cc3cccc(Br)c3)no2)c1 ZINC000109037343 928116117 /nfs/dbraw/zinc/11/61/17/928116117.db2.gz WCDXYJYTEHQHRC-UHFFFAOYSA-N -1 3 361.195 3.804 20 0 FHADHM O=c1[nH]c(CC(F)(F)F)c([O-])n1-c1ccc(Cl)c(C(F)(F)F)c1 ZINC000278122048 937220948 /nfs/dbraw/zinc/22/09/48/937220948.db2.gz QKAGSVJCHHAQEV-MRVPVSSYSA-N -1 3 360.641 3.736 20 0 FHADHM COC(=O)c1ccc(Br)c(Nc2cc(F)c([O-])c(F)c2)c1 ZINC001213379213 937221623 /nfs/dbraw/zinc/22/16/23/937221623.db2.gz GDFYGYHBHQQTFW-UHFFFAOYSA-N -1 3 358.138 3.963 20 0 FHADHM Cc1nc(C)c(CCC(=O)N(C)c2ccccc2-c2ccccc2)c(=O)[n-]1 ZINC000064815371 928266204 /nfs/dbraw/zinc/26/62/04/928266204.db2.gz YKASZGLIBZUORL-UHFFFAOYSA-N -1 3 361.445 3.649 20 0 FHADHM COC(=O)[C@@H](C)S[C@H](C)c1nc(=O)c2c(-c3ccco3)csc2[n-]1 ZINC000154446318 928838221 /nfs/dbraw/zinc/83/82/21/928838221.db2.gz SFUSYMOHYCULKG-RKDXNWHRSA-N -1 3 364.448 3.600 20 0 FHADHM COC(=O)c1ccccc1S(=O)(=O)[N-]c1cc(Cl)ccc1Cl ZINC000007402182 929339496 /nfs/dbraw/zinc/33/94/96/929339496.db2.gz HJOHCZTYIOTFNR-UHFFFAOYSA-N -1 3 360.218 3.581 20 0 FHADHM Cc1cccc(NC(=O)Cc2nc(=O)c3c4ccccc4sc3[n-]2)c1C ZINC000077251865 929387079 /nfs/dbraw/zinc/38/70/79/929387079.db2.gz CCSXEGFXIYRXEL-UHFFFAOYSA-N -1 3 363.442 3.936 20 0 FHADHM CC(C)(C)c1ccccc1S(=O)(=O)[N-]c1ccc(N2CCOCC2)cc1 ZINC000078234742 929470798 /nfs/dbraw/zinc/47/07/98/929470798.db2.gz DKWYFDGEPPKMEN-UHFFFAOYSA-N -1 3 374.506 3.622 20 0 FHADHM CCCC[C@H]1CCC[C@H]1NC(=O)c1c[n-]c2cc(OC)cc(OC)c2c1=O ZINC000625213093 929515845 /nfs/dbraw/zinc/51/58/45/929515845.db2.gz UNDRRGHHJUIHSM-XJKSGUPXSA-N -1 3 372.465 3.634 20 0 FHADHM O=c1[nH]c(CC(F)(F)F)c([O-])n1-c1cccc(C2SCCS2)c1 ZINC000278196115 937340787 /nfs/dbraw/zinc/34/07/87/937340787.db2.gz WCEWHRBMZMIFEI-JTQLQIEISA-N -1 3 362.398 3.542 20 0 FHADHM O=S(=O)(Cc1nc(-c2cccs2)n[n-]1)c1cc(Cl)ccc1Cl ZINC000683681544 929772626 /nfs/dbraw/zinc/77/26/26/929772626.db2.gz LGVCCQDEFUXKOY-UHFFFAOYSA-N -1 3 374.274 3.814 20 0 FHADHM Cc1ccc(S(=O)(=O)[N-]c2cccc(CC(=O)OC(C)(C)C)c2)cc1 ZINC000610336250 930012161 /nfs/dbraw/zinc/01/21/61/930012161.db2.gz JYDGARUBCZBJCI-UHFFFAOYSA-N -1 3 361.463 3.680 20 0 FHADHM C[C@H](NCc1csc(COc2ccccc2)n1)[C@@H]1C[C@H](C(=O)[O-])C1(C)C ZINC000656099067 930158782 /nfs/dbraw/zinc/15/87/82/930158782.db2.gz RVJGESLGTFDHQW-RRQGHBQHSA-N -1 3 374.506 3.947 20 0 FHADHM Cc1nc(C(=O)[N-]c2cc(C3(C)CCCC3)on2)c(Br)s1 ZINC000580047098 930172318 /nfs/dbraw/zinc/17/23/18/930172318.db2.gz WKCQUEQVJGYTAR-UHFFFAOYSA-N -1 3 370.272 3.708 20 0 FHADHM O=C(c1cc([O-])ccc1Cl)N1CCC(Oc2cncc(Cl)c2)CC1 ZINC000580344293 930545401 /nfs/dbraw/zinc/54/54/01/930545401.db2.gz KXTNELOAFUZUCW-UHFFFAOYSA-N -1 3 367.232 3.778 20 0 FHADHM Cc1ccc(CN(CCC(=O)[O-])Cc2cccc(Br)c2)cn1 ZINC000656191322 930565788 /nfs/dbraw/zinc/56/57/88/930565788.db2.gz RQUXUPQBNXPLAD-UHFFFAOYSA-N -1 3 363.255 3.629 20 0 FHADHM CCS(=O)(=O)[N-]c1ccc(NC(=O)/C=C\C2CCCCC2)cc1OC ZINC000255202386 930625911 /nfs/dbraw/zinc/62/59/11/930625911.db2.gz IGECCLTZQNWMOO-XFXZXTDPSA-N -1 3 366.483 3.532 20 0 FHADHM O=C(N1CCc2c(=O)[n-]cnc2C1)C1(Cc2cccc(Cl)c2)CCCC1 ZINC000580627710 930946027 /nfs/dbraw/zinc/94/60/27/930946027.db2.gz RZEXDRZCPAAYOL-UHFFFAOYSA-N -1 3 371.868 3.523 20 0 FHADHM O=C(C[C@@H](c1ccccc1)N1CCOC1=O)Nc1cc(Cl)ccc1[O-] ZINC000728307032 931146154 /nfs/dbraw/zinc/14/61/54/931146154.db2.gz LJFFWKMQJTXITC-HNNXBMFYSA-N -1 3 360.797 3.568 20 0 FHADHM CC(C)c1cccc(NC(=O)[C@@H]2CCCN2C(=O)c2ccccc2[O-])c1 ZINC000048029806 931167452 /nfs/dbraw/zinc/16/74/52/931167452.db2.gz HHZIGPQMXNPFIY-SFHVURJKSA-N -1 3 352.434 3.759 20 0 FHADHM CC(C)c1ccc(C(=O)N[C@@H](C)c2ccc3c(c2)CC(=O)N3C)c([O-])c1 ZINC000728306246 931184020 /nfs/dbraw/zinc/18/40/20/931184020.db2.gz BWHSMVNPOZWWRH-ZDUSSCGKSA-N -1 3 352.434 3.526 20 0 FHADHM CCOc1ccccc1-c1nnc(S[C@@H](C)c2nc(C)cc(=O)[n-]2)o1 ZINC000155903445 931315543 /nfs/dbraw/zinc/31/55/43/931315543.db2.gz QGYNSSHPSYJSJS-NSHDSACASA-N -1 3 358.423 3.793 20 0 FHADHM O=C(CCC(=O)c1ccccc1)[N-]OCc1ccc(C(F)(F)F)cc1 ZINC000160708523 931409003 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ZINC000436692623 944531094 /nfs/dbraw/zinc/53/10/94/944531094.db2.gz XTLANIICJCEREN-UHFFFAOYSA-N -1 3 364.304 3.728 20 0 FHADHM O=C(CCc1ncc[nH]1)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000436708907 944531287 /nfs/dbraw/zinc/53/12/87/944531287.db2.gz UACYFVOJEYVCER-UHFFFAOYSA-N -1 3 364.430 3.963 20 0 FHADHM COC(=O)c1cccc2[n-]c(NC(=O)CCSc3ccccc3F)nc21 ZINC000438356913 944544113 /nfs/dbraw/zinc/54/41/13/944544113.db2.gz QZSQIZZGRWMWNN-UHFFFAOYSA-N -1 3 373.409 3.610 20 0 FHADHM COc1ccc([C@@H](NC(=O)c2ccc(O)cc2[O-])c2ccc(F)cc2)cc1 ZINC000436726926 944549441 /nfs/dbraw/zinc/54/94/41/944549441.db2.gz WVTPMHYOBHMGFN-FQEVSTJZSA-N -1 3 367.376 3.765 20 0 FHADHM COc1cccc(C(=O)Nc2cccc(COCCOC(C)C)c2)c1[O-] ZINC000436711477 944552055 /nfs/dbraw/zinc/55/20/55/944552055.db2.gz IKIARVVOFGTXET-UHFFFAOYSA-N -1 3 359.422 3.595 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)N3CC4(C3)CCCCC4)cc2)cc(=O)[n-]1 ZINC000518626758 944556121 /nfs/dbraw/zinc/55/61/21/944556121.db2.gz DVZWQRKYUPHQGL-UHFFFAOYSA-N -1 3 352.438 3.956 20 0 FHADHM Cc1ccc(C(=O)Nc2cccc3c2CN(c2nccs2)C3)c([O-])c1 ZINC000436721429 944561202 /nfs/dbraw/zinc/56/12/02/944561202.db2.gz HTAXULPMJBWMRX-UHFFFAOYSA-N -1 3 351.431 3.930 20 0 FHADHM CC[C@@H](C)c1nc([C@H](C)NC(=O)c2ccc(C(F)(F)F)cc2[O-])n[nH]1 ZINC000436737474 944567180 /nfs/dbraw/zinc/56/71/80/944567180.db2.gz KZWSBFGZTIFODB-BDAKNGLRSA-N -1 3 356.348 3.534 20 0 FHADHM C/C=C\c1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2ccccc2[O-])cc1 ZINC000436741526 944571363 /nfs/dbraw/zinc/57/13/63/944571363.db2.gz CJWMVHDOCIWWPQ-OWIVYFSNSA-N -1 3 350.418 3.669 20 0 FHADHM Cc1ccc(C(=O)NCc2nc3cc(Br)ccc3o2)c([O-])c1 ZINC000436745399 944571462 /nfs/dbraw/zinc/57/14/62/944571462.db2.gz CABQIWBZDNFUJF-UHFFFAOYSA-N -1 3 361.195 3.534 20 0 FHADHM COc1cccc(C(=O)Nc2cc(-c3ccc(Cl)s3)nn2C)c1[O-] ZINC000436727662 944574667 /nfs/dbraw/zinc/57/46/67/944574667.db2.gz BFMFVCFWHQHFEC-UHFFFAOYSA-N -1 3 363.826 3.769 20 0 FHADHM COc1ccc(CN(C)C(=O)c2ccc(C)cc2[O-])cc1OC(F)F ZINC000436759989 944581702 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FHADHM CC1(C)CC(=O)c2cc([N-]S(=O)(=O)c3ccc4c(c3)CCC4)ccc2O1 ZINC000507612518 945374796 /nfs/dbraw/zinc/37/47/96/945374796.db2.gz DJOYVOWLTFCDPW-UHFFFAOYSA-N -1 3 371.458 3.720 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)N(C)[C@@H](C)c3cccnc3)cc2)cc(=O)[n-]1 ZINC000519410868 945385372 /nfs/dbraw/zinc/38/53/72/945385372.db2.gz VNIBKZKMQCZCQJ-ZDUSSCGKSA-N -1 3 363.421 3.778 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)c1cc2c(cccc2Cl)s1 ZINC000636654888 945389769 /nfs/dbraw/zinc/38/97/69/945389769.db2.gz CPSUCLFEUSRDJH-UHFFFAOYSA-N -1 3 355.810 3.987 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)c1cc2c(cccc2Cl)s1 ZINC000636654888 945389778 /nfs/dbraw/zinc/38/97/78/945389778.db2.gz CPSUCLFEUSRDJH-UHFFFAOYSA-N -1 3 355.810 3.987 20 0 FHADHM CC[C@@H]1CCC[C@@H]1C[N-]S(=O)(=O)c1ccc(Br)cc1F ZINC001211889559 945395977 /nfs/dbraw/zinc/39/59/77/945395977.db2.gz CUIHQPSGRARPFC-GHMZBOCLSA-N -1 3 364.280 3.693 20 0 FHADHM CC[C@H]1CCC[C@@H]1C[N-]S(=O)(=O)c1ccc(Br)cc1F ZINC001211889565 945396057 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CCc1cc(=O)[n-]c(-c2ccc(NCc3ccc(-n4cccn4)cc3)nc2)n1 ZINC000301518949 945825844 /nfs/dbraw/zinc/82/58/44/945825844.db2.gz KRKBEVAQZDHBDF-UHFFFAOYSA-N -1 3 372.432 3.604 20 0 FHADHM O=C(Nc1cc(F)cc(Cl)c1[O-])C(C[C@@H]1CCCO1)C(F)(F)F ZINC000651756566 945841192 /nfs/dbraw/zinc/84/11/92/945841192.db2.gz ZTSQOCURAPGECA-IUCAKERBSA-N -1 3 355.715 3.871 20 0 FHADHM C[C@@H]1CN(Cc2ccc(C(=O)Nc3cc(Cl)ccc3[O-])cc2)C[C@H](C)O1 ZINC000111210370 945845320 /nfs/dbraw/zinc/84/53/20/945845320.db2.gz CINICLMQFLVTCB-OKILXGFUSA-N -1 3 374.868 3.907 20 0 FHADHM COc1ccccc1C1(C(=O)Nc2ccc(Br)cc2[O-])CC1 ZINC000522831463 945943403 /nfs/dbraw/zinc/94/34/03/945943403.db2.gz MDMCBJWGLBLMIX-UHFFFAOYSA-N -1 3 362.223 3.834 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@]3(C)CC3(Cl)Cl)c2)n1 ZINC000049304482 945972893 /nfs/dbraw/zinc/97/28/93/945972893.db2.gz RMLGMKSTBONGNR-INIZCTEOSA-N -1 3 366.248 3.522 20 0 FHADHM Cc1cc(Oc2ccc(-c3nnn[n-]3)cc2)ccc1NC(=O)[C@@H](C)C1CC1 ZINC000822211496 945996568 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Cc1cccc(Cl)c1NC(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000822303528 946048430 /nfs/dbraw/zinc/04/84/30/946048430.db2.gz DNDIZNHAOPLOLO-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM C[C@@]12COC[C@]1(C)CN(Cc1nc(=O)c3c(-c4ccco4)csc3[n-]1)C2 ZINC000661496225 946184485 /nfs/dbraw/zinc/18/44/85/946184485.db2.gz HZJHXVUBBSTEPT-KDURUIRLSA-N -1 3 371.462 3.515 20 0 FHADHM Cc1cc(C)c2cc(C(=O)[N-]c3nnc(C4CCOCC4)s3)sc2n1 ZINC000661509336 946195261 /nfs/dbraw/zinc/19/52/61/946195261.db2.gz RTPVXRIDFHQVHZ-UHFFFAOYSA-N -1 3 374.491 3.911 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NCC[C@](C)(O)c3ccccc3)nc2)n1 ZINC000302391912 946215534 /nfs/dbraw/zinc/21/55/34/946215534.db2.gz IJODOHMOORAYMK-NRFANRHFSA-N -1 3 364.449 3.516 20 0 FHADHM CC(C)[C@@H](CC(=O)Nc1ccccc1[N-]S(C)(=O)=O)c1ccccc1 ZINC000103067151 946217748 /nfs/dbraw/zinc/21/77/48/946217748.db2.gz UEFLNXLWCLMRJX-MRXNPFEDSA-N -1 3 360.479 3.827 20 0 FHADHM CCSc1cc(CNc2ccc(-c3nc(CC)cc(=O)[n-]3)cn2)ccn1 ZINC000302442101 946225723 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O=S(=O)([N-]C[C@H]1CCCC1(F)F)c1csnc1-c1ccccc1 ZINC001211893834 946390257 /nfs/dbraw/zinc/39/02/57/946390257.db2.gz GEGBBJBPMKYBAN-GFCCVEGCSA-N -1 3 358.435 3.524 20 0 FHADHM [O-]c1cc(F)cc(CN2CCO[C@@H](c3cccc(Br)c3)C2)c1 ZINC000473133294 946424256 /nfs/dbraw/zinc/42/42/56/946424256.db2.gz QLGHNDTXLSRQDQ-QGZVFWFLSA-N -1 3 366.230 3.867 20 0 FHADHM CN(CC(=O)Nc1ccc(Cl)c(Cl)c1)Cc1cc([O-])cc(F)c1 ZINC000473136887 946459362 /nfs/dbraw/zinc/45/93/62/946459362.db2.gz BIYGQLGJEOOQCK-UHFFFAOYSA-N -1 3 357.212 3.909 20 0 FHADHM Cc1ccc(F)cc1-c1nnc([N-]C(=O)c2cn3ccnc3s2)s1 ZINC000469895544 946468902 /nfs/dbraw/zinc/46/89/02/946468902.db2.gz BTRMEPZEFGHSNS-UHFFFAOYSA-N -1 3 359.411 3.614 20 0 FHADHM CC(=Cc1ccc(C)cc1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000823942283 946524633 /nfs/dbraw/zinc/52/46/33/946524633.db2.gz AIOFFMSALYPXFR-XFXZXTDPSA-N -1 3 353.813 3.871 20 0 FHADHM CC(=Cc1ccc(C)cc1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000823942283 946524637 /nfs/dbraw/zinc/52/46/37/946524637.db2.gz AIOFFMSALYPXFR-XFXZXTDPSA-N -1 3 353.813 3.871 20 0 FHADHM CC(=O)c1ccc(-c2nnn[n-]2)c(N[C@H](C)c2ccc(OC(F)F)cc2)c1 ZINC000824014495 946551075 /nfs/dbraw/zinc/55/10/75/946551075.db2.gz JTVFEICTPCKJGE-SNVBAGLBSA-N -1 3 373.363 3.844 20 0 FHADHM CC(=O)c1ccc(-c2nn[n-]n2)c(N[C@H](C)c2ccc(OC(F)F)cc2)c1 ZINC000824014495 946551085 /nfs/dbraw/zinc/55/10/85/946551085.db2.gz JTVFEICTPCKJGE-SNVBAGLBSA-N -1 3 373.363 3.844 20 0 FHADHM CC(C)(C)[C@@H]1CCN(C(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)C1 ZINC000824079095 946578214 /nfs/dbraw/zinc/57/82/14/946578214.db2.gz MIKVQFSRZSNYBJ-SNVBAGLBSA-N -1 3 364.906 3.585 20 0 FHADHM CC(C)(C)[C@@H]1CCN(C(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)C1 ZINC000824079095 946578221 /nfs/dbraw/zinc/57/82/21/946578221.db2.gz MIKVQFSRZSNYBJ-SNVBAGLBSA-N -1 3 364.906 3.585 20 0 FHADHM Cc1cc(S(=O)(=O)[N-][C@H](c2ccccc2)[C@H]2CCCO2)sc1Cl ZINC000473910446 946624164 /nfs/dbraw/zinc/62/41/64/946624164.db2.gz GNUBGKKURTXUEV-UKRRQHHQSA-N -1 3 371.911 3.909 20 0 FHADHM Brc1ccc(CN2CCCc3cc(-c4nn[n-]n4)ccc32)cc1 ZINC001573279357 946636936 /nfs/dbraw/zinc/63/69/36/946636936.db2.gz IAOOHMSQCRMPER-UHFFFAOYSA-N -1 3 370.254 3.582 20 0 FHADHM COc1cc(Cl)c(S(=O)(=O)[N-]c2cc(C)ccc2F)cc1OC ZINC000192773896 946648987 /nfs/dbraw/zinc/64/89/87/946648987.db2.gz QJAQUVWFZKMPIR-UHFFFAOYSA-N -1 3 359.806 3.606 20 0 FHADHM Brc1ccccc1CCSc1cccc(-c2nnn[n-]2)c1 ZINC001573280135 946654469 /nfs/dbraw/zinc/65/44/69/946654469.db2.gz RCQVGEIRVYLSAI-UHFFFAOYSA-N -1 3 361.268 3.964 20 0 FHADHM Brc1ccccc1CCSc1cccc(-c2nn[n-]n2)c1 ZINC001573280135 946654475 /nfs/dbraw/zinc/65/44/75/946654475.db2.gz RCQVGEIRVYLSAI-UHFFFAOYSA-N -1 3 361.268 3.964 20 0 FHADHM Brc1cccc(-c2nnn[n-]2)c1Nc1ccc2c(c1)CCCO2 ZINC001573280173 946656637 /nfs/dbraw/zinc/65/66/37/946656637.db2.gz ROKDWYHGAQVRFR-UHFFFAOYSA-N -1 3 372.226 3.698 20 0 FHADHM Brc1cccc(-c2nn[n-]n2)c1Nc1ccc2c(c1)CCCO2 ZINC001573280173 946656646 /nfs/dbraw/zinc/65/66/46/946656646.db2.gz ROKDWYHGAQVRFR-UHFFFAOYSA-N -1 3 372.226 3.698 20 0 FHADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)c3coc4cc(F)ccc34)cc2)n1 ZINC000475192556 946661016 /nfs/dbraw/zinc/66/10/16/946661016.db2.gz QXWZBEPPLUUBEQ-UHFFFAOYSA-N -1 3 363.348 3.883 20 0 FHADHM Brc1cc(NC[C@H]2C[C@H]2C2CCCC2)ccc1-c1nnn[n-]1 ZINC001573281077 946672869 /nfs/dbraw/zinc/67/28/69/946672869.db2.gz YHJALXONWZXOIS-RISCZKNCSA-N -1 3 362.275 3.867 20 0 FHADHM Brc1cc(NC[C@H]2C[C@H]2C2CCCC2)ccc1-c1nn[n-]n1 ZINC001573281077 946672871 /nfs/dbraw/zinc/67/28/71/946672871.db2.gz YHJALXONWZXOIS-RISCZKNCSA-N -1 3 362.275 3.867 20 0 FHADHM COC(=O)c1ccc(C(=O)[N-]c2cc(F)ccc2SCC(F)F)nc1 ZINC000121409449 946673928 /nfs/dbraw/zinc/67/39/28/946673928.db2.gz DDXLUPUSBQGVPG-UHFFFAOYSA-N -1 3 370.352 3.617 20 0 FHADHM CC(=O)Nc1cc(F)c(S(=O)(=O)[N-]CCC2=CCCCC2)cc1Cl ZINC000104732293 946746449 /nfs/dbraw/zinc/74/64/49/946746449.db2.gz JTJZTYYAJCWWSJ-UHFFFAOYSA-N -1 3 374.865 3.606 20 0 FHADHM Cc1nn(-c2ccccc2)c2sc(C(=O)Nc3ccc4nn[n-]c4c3)cc12 ZINC000473929920 946750634 /nfs/dbraw/zinc/75/06/34/946750634.db2.gz XEAKFMVNTQNARA-UHFFFAOYSA-N -1 3 374.429 3.919 20 0 FHADHM C[C@H](N[C@@H](c1cccc(F)c1)c1ccccn1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824540086 946780140 /nfs/dbraw/zinc/78/01/40/946780140.db2.gz RKCHRFYCGKTBHV-XOBRGWDASA-N -1 3 374.423 3.841 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)CO[C@@H]3CCCC[C@H]3C)c2)n1 ZINC000112793020 946787550 /nfs/dbraw/zinc/78/75/50/946787550.db2.gz OCTKERNCSVPCHY-RDTXWAMCSA-N -1 3 369.465 3.533 20 0 FHADHM CC(C)=CCC[C@H](C)CC(=O)Nc1ccc(-c2nnn[n-]2)cc1C(C)=O ZINC001573551302 946870130 /nfs/dbraw/zinc/87/01/30/946870130.db2.gz IZVQQICWUJABAL-ZDUSSCGKSA-N -1 3 355.442 3.780 20 0 FHADHM CC(C)=CCC[C@H](C)CC(=O)Nc1ccc(-c2nn[n-]n2)cc1C(C)=O ZINC001573551302 946870142 /nfs/dbraw/zinc/87/01/42/946870142.db2.gz IZVQQICWUJABAL-ZDUSSCGKSA-N -1 3 355.442 3.780 20 0 FHADHM C[C@@H](Nc1ccc(OC(F)F)c(F)c1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824657179 946887565 /nfs/dbraw/zinc/88/75/65/946887565.db2.gz PFTFRYURXYWTHP-MRVPVSSYSA-N -1 3 367.306 3.919 20 0 FHADHM C[C@@H](Nc1ccc(OC(F)F)c(F)c1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824657179 946887572 /nfs/dbraw/zinc/88/75/72/946887572.db2.gz PFTFRYURXYWTHP-MRVPVSSYSA-N -1 3 367.306 3.919 20 0 FHADHM C[C@@H](OC(=O)[C@@H]1CCc2c1cccc2Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000824712541 946906445 /nfs/dbraw/zinc/90/64/45/946906445.db2.gz ATCUJUGDWAPTMS-BDJLRTHQSA-N -1 3 368.824 3.854 20 0 FHADHM C[C@@H](OC(=O)[C@@H]1CCc2c1cccc2Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000824712541 946906450 /nfs/dbraw/zinc/90/64/50/946906450.db2.gz ATCUJUGDWAPTMS-BDJLRTHQSA-N -1 3 368.824 3.854 20 0 FHADHM C[C@H](OC(=O)[C@@H]1CCc2c1cccc2Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000824712543 946907304 /nfs/dbraw/zinc/90/73/04/946907304.db2.gz ATCUJUGDWAPTMS-MEDUHNTESA-N -1 3 368.824 3.854 20 0 FHADHM C[C@H](OC(=O)[C@@H]1CCc2c1cccc2Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000824712543 946907314 /nfs/dbraw/zinc/90/73/14/946907314.db2.gz ATCUJUGDWAPTMS-MEDUHNTESA-N -1 3 368.824 3.854 20 0 FHADHM COc1ccc(Cl)c(S(=O)(=O)[N-][C@@H]2CCC[C@H](C(F)(F)F)C2)c1 ZINC000112361193 946913749 /nfs/dbraw/zinc/91/37/49/946913749.db2.gz KUMSEDDAOVFMQK-VHSXEESVSA-N -1 3 371.808 3.748 20 0 FHADHM CC[C@@H](C)[C@@H]([N-]S(=O)(=O)c1cc(Cl)c(OC)cc1C)C(F)(F)F ZINC001211677537 946933644 /nfs/dbraw/zinc/93/36/44/946933644.db2.gz JNARTPSFDVBGJX-AMIZOPFISA-N -1 3 373.824 3.912 20 0 FHADHM Cc1cc(S(=O)(=O)[N-][C@@H]2CCCc3cc(N)ccc32)sc1Cl ZINC000188456740 946946218 /nfs/dbraw/zinc/94/62/18/946946218.db2.gz OPAXGCWDIDBUGF-CYBMUJFWSA-N -1 3 356.900 3.648 20 0 FHADHM CCC[C@@]1(CO)CCCN1C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000444553085 946992237 /nfs/dbraw/zinc/99/22/37/946992237.db2.gz USWBXAWAYWOCSW-QFIPXVFZSA-N -1 3 353.462 3.750 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CC[C@@H](C)C2)c1ccccc1 ZINC000824966633 947008908 /nfs/dbraw/zinc/00/89/08/947008908.db2.gz CTKBUPGFEIVXIO-VXGBXAGGSA-N -1 3 367.478 3.795 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CC[C@@H](C)C2)c1ccccc1 ZINC000824966633 947008920 /nfs/dbraw/zinc/00/89/20/947008920.db2.gz CTKBUPGFEIVXIO-VXGBXAGGSA-N -1 3 367.478 3.795 20 0 FHADHM CC[C@@H]1CC[C@H](C)N1C(=O)c1c[n-]c2ccc(Br)cc2c1=O ZINC000444350843 947089517 /nfs/dbraw/zinc/08/95/17/947089517.db2.gz INIZITHTGVYSDA-CMPLNLGQSA-N -1 3 363.255 3.694 20 0 FHADHM Cc1nc(CCCC(=O)N=c2cc(-c3cc(F)cc(F)c3)[n-][nH]2)cs1 ZINC000467718206 947092960 /nfs/dbraw/zinc/09/29/60/947092960.db2.gz MQVQNYFJDWWGGK-UHFFFAOYSA-N -1 3 362.405 3.503 20 0 FHADHM CC[C@H](Nc1nccc(C)c1-c1nnn[n-]1)c1nc(-c2ccccc2)c[nH]1 ZINC000825148515 947100037 /nfs/dbraw/zinc/10/00/37/947100037.db2.gz QQQSJZABKWXBON-AWEZNQCLSA-N -1 3 360.425 3.523 20 0 FHADHM CC[C@H](Nc1nccc(C)c1-c1nn[n-]n1)c1nc(-c2ccccc2)c[nH]1 ZINC000825148515 947100043 /nfs/dbraw/zinc/10/00/43/947100043.db2.gz QQQSJZABKWXBON-AWEZNQCLSA-N -1 3 360.425 3.523 20 0 FHADHM CCCN(C)C(=O)N[C@H](C)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000825300673 947145557 /nfs/dbraw/zinc/14/55/57/947145557.db2.gz CLZBDVHLDRFPSA-CQSZACIVSA-N -1 3 364.453 3.646 20 0 FHADHM CCCN(C)C(=O)N[C@H](C)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000825300673 947145566 /nfs/dbraw/zinc/14/55/66/947145566.db2.gz CLZBDVHLDRFPSA-CQSZACIVSA-N -1 3 364.453 3.646 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)CCCc1ccsc1 ZINC000825332156 947155919 /nfs/dbraw/zinc/15/59/19/947155919.db2.gz FEKWBCBPKRJBJB-UHFFFAOYSA-N -1 3 370.482 3.712 20 0 FHADHM CCN(C(=O)CCc1ccccc1F)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825372413 947166963 /nfs/dbraw/zinc/16/69/63/947166963.db2.gz XMDJPEUQDJKVJZ-UHFFFAOYSA-N -1 3 373.819 3.645 20 0 FHADHM CCN(C(=O)CCc1ccccc1F)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825372413 947166973 /nfs/dbraw/zinc/16/69/73/947166973.db2.gz XMDJPEUQDJKVJZ-UHFFFAOYSA-N -1 3 373.819 3.645 20 0 FHADHM C[C@H](CN(Cc1ccccc1)Cc1ncccc1C(F)(F)F)C(=O)[O-] ZINC000652456438 947171974 /nfs/dbraw/zinc/17/19/74/947171974.db2.gz FJXWICFMSAWALR-CYBMUJFWSA-N -1 3 352.356 3.823 20 0 FHADHM CCCC(=O)N1CCCC[C@H]1C(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000125381398 947242031 /nfs/dbraw/zinc/24/20/31/947242031.db2.gz VBRBQCPTMPPBKN-ZDUSSCGKSA-N -1 3 358.360 3.531 20 0 FHADHM C[C@H](Oc1cc(Cl)cc(Cl)c1)C(=O)NCc1ccc([O-])c(F)c1 ZINC000523423917 947256288 /nfs/dbraw/zinc/25/62/88/947256288.db2.gz QWURFPKZKHFHEO-VIFPVBQESA-N -1 3 358.196 3.922 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)[C@H](C)c1ccccc1 ZINC000825609274 947256452 /nfs/dbraw/zinc/25/64/52/947256452.db2.gz JDDXGNAURRFFCG-LLVKDONJSA-N -1 3 372.812 3.628 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)[C@H](C)c1ccccc1 ZINC000825609274 947256460 /nfs/dbraw/zinc/25/64/60/947256460.db2.gz JDDXGNAURRFFCG-LLVKDONJSA-N -1 3 372.812 3.628 20 0 FHADHM CC(C)[C@H]1C[C@H](CC(=O)Nc2cc(Br)ccc2[O-])CCO1 ZINC000330805727 947278514 /nfs/dbraw/zinc/27/85/14/947278514.db2.gz JRMKRNOZMKPNDD-IAQYHMDHSA-N -1 3 356.260 3.935 20 0 FHADHM O=S(=O)([N-][C@H](COc1ccccc1F)c1ccccc1)c1ccco1 ZINC000188609851 947500429 /nfs/dbraw/zinc/50/04/29/947500429.db2.gz JSMPUKNTPXDRON-MRXNPFEDSA-N -1 3 361.394 3.517 20 0 FHADHM O=S(=O)([N-]CCC[C@@H]1CCCC[C@H]1O)c1c(Cl)cccc1Cl ZINC000127728479 947565190 /nfs/dbraw/zinc/56/51/90/947565190.db2.gz DZFPKGDQBPZAOH-SMDDNHRTSA-N -1 3 366.310 3.603 20 0 FHADHM Cc1ccc(CNC(=O)Cc2nc(=O)c3c4ccccc4sc3[n-]2)cc1 ZINC000523762910 947580953 /nfs/dbraw/zinc/58/09/53/947580953.db2.gz OFMNEKNUVWOTDR-UHFFFAOYSA-N -1 3 363.442 3.717 20 0 FHADHM COc1cc([N-]S(=O)(=O)c2ccc(C)c(C)c2)ccc1OC(F)F ZINC000663261057 947589350 /nfs/dbraw/zinc/58/93/50/947589350.db2.gz INBQZODWHXZCRV-UHFFFAOYSA-N -1 3 357.378 3.714 20 0 FHADHM COc1ccc(C(=O)N(C)CCOc2ccc(C(F)(F)F)cc2)c([O-])c1 ZINC000189067625 947593571 /nfs/dbraw/zinc/59/35/71/947593571.db2.gz OVRBFQYEEZRFBK-UHFFFAOYSA-N -1 3 369.339 3.571 20 0 FHADHM CC(C)(C)CN(CC(=O)[O-])Cc1cc(Br)cc(F)c1F ZINC000662221938 947599344 /nfs/dbraw/zinc/59/93/44/947599344.db2.gz CWANCYOHBUFQKF-UHFFFAOYSA-N -1 3 350.203 3.660 20 0 FHADHM COc1ccc([O-])c(-c2nc(-c3ccc(N4CCCCC4)nc3)no2)c1 ZINC000184851121 947633212 /nfs/dbraw/zinc/63/32/12/947633212.db2.gz OFCCIESHNFGUPX-UHFFFAOYSA-N -1 3 352.394 3.503 20 0 FHADHM CCc1cccc(CC)c1NC(=O)Cc1noc(-c2ccccc2[O-])n1 ZINC000445308529 947695670 /nfs/dbraw/zinc/69/56/70/947695670.db2.gz ACNTWVLANYJNGM-UHFFFAOYSA-N -1 3 351.406 3.748 20 0 FHADHM CC(C)COc1ccc(S(=O)(=O)[N-]c2cccc(-n3ccnc3)c2)cc1 ZINC000523883675 947708882 /nfs/dbraw/zinc/70/88/82/947708882.db2.gz YKPHRPCRANODND-UHFFFAOYSA-N -1 3 371.462 3.708 20 0 FHADHM C[C@@H](C(=O)N1CCC(c2ccc(-c3nnn[n-]3)cc2)CC1)[C@@H](C)C(C)(C)C ZINC001573627172 947719678 /nfs/dbraw/zinc/71/96/78/947719678.db2.gz ZVVQRHISXIRBNN-HUUCEWRRSA-N -1 3 369.513 3.891 20 0 FHADHM C[C@@H](C(=O)N1CCC(c2ccc(-c3nn[n-]n3)cc2)CC1)[C@@H](C)C(C)(C)C ZINC001573627172 947719688 /nfs/dbraw/zinc/71/96/88/947719688.db2.gz ZVVQRHISXIRBNN-HUUCEWRRSA-N -1 3 369.513 3.891 20 0 FHADHM Cc1cc(C)c2cc(NC(=O)CCc3c(C)nc(C)[n-]c3=O)ccc2n1 ZINC000895063144 947719902 /nfs/dbraw/zinc/71/99/02/947719902.db2.gz NWZAXVCECQAWAG-UHFFFAOYSA-N -1 3 350.422 3.535 20 0 FHADHM CCc1ccc(-c2nc(-c3ccc(N4CCCNC4=O)cc3)no2)c([O-])c1 ZINC000665047815 947722791 /nfs/dbraw/zinc/72/27/91/947722791.db2.gz SYMZTWBMOIWUEA-UHFFFAOYSA-N -1 3 364.405 3.591 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)Nc1ccc(-c2nnn[n-]2)c(F)c1 ZINC001573365028 947726800 /nfs/dbraw/zinc/72/68/00/947726800.db2.gz KWINWGJERPZDSL-JXMROGBWSA-N -1 3 357.776 3.701 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)Nc1ccc(-c2nn[n-]n2)c(F)c1 ZINC001573365028 947726805 /nfs/dbraw/zinc/72/68/05/947726805.db2.gz KWINWGJERPZDSL-JXMROGBWSA-N -1 3 357.776 3.701 20 0 FHADHM Cc1ccc(C(=O)N(C)c2ccc(-c3nnn[n-]3)cc2F)c(Cl)c1C ZINC000826281489 947806269 /nfs/dbraw/zinc/80/62/69/947806269.db2.gz VCEGOLDIGJJMRY-UHFFFAOYSA-N -1 3 359.792 3.553 20 0 FHADHM Cc1ccc(C(=O)N(C)c2ccc(-c3nn[n-]n3)cc2F)c(Cl)c1C ZINC000826281489 947806278 /nfs/dbraw/zinc/80/62/78/947806278.db2.gz VCEGOLDIGJJMRY-UHFFFAOYSA-N -1 3 359.792 3.553 20 0 FHADHM COC(=O)c1ccc([N-]C(=O)c2cc(-c3ccc(F)cc3)no2)c(F)c1 ZINC001126506425 947810542 /nfs/dbraw/zinc/81/05/42/947810542.db2.gz CHIBMKMZBVJART-UHFFFAOYSA-N -1 3 358.300 3.659 20 0 FHADHM Cc1ccc(C[C@H](Nc2nccc(C)c2-c2nnn[n-]2)c2ccccn2)cc1 ZINC000826287392 947831702 /nfs/dbraw/zinc/83/17/02/947831702.db2.gz NGMWQUNQWSJJRU-SFHVURJKSA-N -1 3 371.448 3.669 20 0 FHADHM Cc1ccc(C[C@H](Nc2nccc(C)c2-c2nn[n-]n2)c2ccccn2)cc1 ZINC000826287392 947831712 /nfs/dbraw/zinc/83/17/12/947831712.db2.gz NGMWQUNQWSJJRU-SFHVURJKSA-N -1 3 371.448 3.669 20 0 FHADHM Cc1ncc(C(=O)[N-]c2nnc(Cc3ccc(Cl)cc3)s2)s1 ZINC000189810305 947841212 /nfs/dbraw/zinc/84/12/12/947841212.db2.gz ANXFVZWRSQKEED-UHFFFAOYSA-N -1 3 350.856 3.800 20 0 FHADHM O=S(=O)([N-]Cc1ccoc1)c1csc(-c2ccc(Cl)cc2)n1 ZINC000500440654 947852333 /nfs/dbraw/zinc/85/23/33/947852333.db2.gz MXJZAKQIDNZBAM-UHFFFAOYSA-N -1 3 354.840 3.535 20 0 FHADHM Cc1cccc([C@@H]2CCN(c3nc(C(F)(F)F)ccc3-c3nnn[n-]3)C2)c1 ZINC000826297632 947861260 /nfs/dbraw/zinc/86/12/60/947861260.db2.gz NICJNGNZPPSXJK-CYBMUJFWSA-N -1 3 374.370 3.583 20 0 FHADHM Cc1cccc([C@@H]2CCN(c3nc(C(F)(F)F)ccc3-c3nn[n-]n3)C2)c1 ZINC000826297632 947861263 /nfs/dbraw/zinc/86/12/63/947861263.db2.gz NICJNGNZPPSXJK-CYBMUJFWSA-N -1 3 374.370 3.583 20 0 FHADHM Cc1cccc2c(=O)[nH]c(C(Cl)=Cc3ccccc3-c3nnn[n-]3)nc12 ZINC000826304796 947873728 /nfs/dbraw/zinc/87/37/28/947873728.db2.gz YMYOOHMQZYKZJY-NTEUORMPSA-N -1 3 364.796 3.561 20 0 FHADHM Cc1cccc2c(=O)[nH]c(C(Cl)=Cc3ccccc3-c3nn[n-]n3)nc12 ZINC000826304796 947873735 /nfs/dbraw/zinc/87/37/35/947873735.db2.gz YMYOOHMQZYKZJY-NTEUORMPSA-N -1 3 364.796 3.561 20 0 FHADHM CCc1ccc(C(=O)Nc2ccc(OCc3nccn3C)cc2)c([O-])c1 ZINC000189905729 947877411 /nfs/dbraw/zinc/87/74/11/947877411.db2.gz BLJKJTCNKYXNOV-UHFFFAOYSA-N -1 3 351.406 3.519 20 0 FHADHM CCCCOc1ccc(C(=O)Nc2cc(C(F)(F)F)c[nH]c2=O)c([O-])c1 ZINC000190152764 947935857 /nfs/dbraw/zinc/93/58/57/947935857.db2.gz DMNMAWYIWDUWBK-UHFFFAOYSA-N -1 3 370.327 3.531 20 0 FHADHM Cc1cc([C@@H]2CCCN2Cc2nc3c4ccccc4oc3c(=O)[n-]2)no1 ZINC000027886313 947949595 /nfs/dbraw/zinc/94/95/95/947949595.db2.gz DVJBENHJBMTLLT-AWEZNQCLSA-N -1 3 350.378 3.715 20 0 FHADHM Cc1nn(C)c(Cl)c1CSc1cccc(Cl)c1-c1nnn[n-]1 ZINC000826334231 947967779 /nfs/dbraw/zinc/96/77/79/947967779.db2.gz MSQFOHYTMCVPBW-UHFFFAOYSA-N -1 3 355.254 3.508 20 0 FHADHM Cc1nn(C)c(Cl)c1CSc1cccc(Cl)c1-c1nn[n-]n1 ZINC000826334231 947967785 /nfs/dbraw/zinc/96/77/85/947967785.db2.gz MSQFOHYTMCVPBW-UHFFFAOYSA-N -1 3 355.254 3.508 20 0 FHADHM Cc1cccc2[nH]cc(CC(=O)OCc3noc(-c4ccccc4[O-])n3)c21 ZINC000783474701 948140850 /nfs/dbraw/zinc/14/08/50/948140850.db2.gz WSFZUEJXMBLDJR-UHFFFAOYSA-N -1 3 363.373 3.518 20 0 FHADHM O=C([O-])[C@@H](CNCc1cnc(C2CCCC2)s1)Oc1ccc(F)cc1 ZINC000417560890 948225679 /nfs/dbraw/zinc/22/56/79/948225679.db2.gz HWAAYSMIOJXTOU-MRXNPFEDSA-N -1 3 364.442 3.562 20 0 FHADHM CC(C)(C)OC(=O)N[C@H](CCC(=O)Nc1ncccc1[O-])c1ccccc1 ZINC000729510507 948330338 /nfs/dbraw/zinc/33/03/38/948330338.db2.gz QGNGVEXNSYOXAO-OAHLLOKOSA-N -1 3 371.437 3.772 20 0 FHADHM O=C([N-]c1cc(Cl)cc(F)c1F)c1csc(-c2cnccn2)n1 ZINC000441599198 948340549 /nfs/dbraw/zinc/34/05/49/948340549.db2.gz CJQVGVGGKNDLLP-UHFFFAOYSA-N -1 3 352.753 3.784 20 0 FHADHM CCOc1ccccc1NC(=O)NCc1ccc([O-])c(Br)c1 ZINC000152357038 948348814 /nfs/dbraw/zinc/34/88/14/948348814.db2.gz PVUNFURZBNZBGD-UHFFFAOYSA-N -1 3 365.227 3.875 20 0 FHADHM CCOC(=O)c1c2ccccc2sc1[N-]C(=O)c1ccc(C(=O)OC)o1 ZINC000432413102 948361896 /nfs/dbraw/zinc/36/18/96/948361896.db2.gz KEFNCSLUXRMJFJ-UHFFFAOYSA-N -1 3 373.386 3.710 20 0 FHADHM COC(=O)c1sc2[n-]c(CSc3cc(C)ccc3C)nc(=O)c2c1C ZINC000016655638 948424781 /nfs/dbraw/zinc/42/47/81/948424781.db2.gz NXRMFTVXSBORRF-UHFFFAOYSA-N -1 3 374.487 3.989 20 0 FHADHM c1ccc2c(c1)cccc2C1CCN(c2cnccc2-c2nnn[n-]2)CC1 ZINC000826523044 948456783 /nfs/dbraw/zinc/45/67/83/948456783.db2.gz YJNAQGPBMHAFOI-UHFFFAOYSA-N -1 3 356.433 3.799 20 0 FHADHM c1ccc2c(c1)cccc2C1CCN(c2cnccc2-c2nn[n-]n2)CC1 ZINC000826523044 948456787 /nfs/dbraw/zinc/45/67/87/948456787.db2.gz YJNAQGPBMHAFOI-UHFFFAOYSA-N -1 3 356.433 3.799 20 0 FHADHM CC(C)COc1ccc(-c2nnc(-c3ccc(-c4nnn[n-]4)cc3)o2)cc1 ZINC001256214763 948496559 /nfs/dbraw/zinc/49/65/59/948496559.db2.gz AIJMXSGWAFXUGC-UHFFFAOYSA-N -1 3 362.393 3.619 20 0 FHADHM CC(C)COc1ccc(-c2nnc(-c3ccc(-c4nn[n-]n4)cc3)o2)cc1 ZINC001256214763 948496562 /nfs/dbraw/zinc/49/65/62/948496562.db2.gz AIJMXSGWAFXUGC-UHFFFAOYSA-N -1 3 362.393 3.619 20 0 FHADHM CC(C)c1cccc(S(=O)(=O)[N-]c2cccc3c2OCC[C@@H]3N(C)C)c1 ZINC000432485300 948560962 /nfs/dbraw/zinc/56/09/62/948560962.db2.gz JZGMUAMTJSWQST-IBGZPJMESA-N -1 3 374.506 3.996 20 0 FHADHM Cc1nc(C)c(CC(=O)O[C@@H](c2ccc(Cl)cc2)C(F)(F)F)c(=O)[n-]1 ZINC000893655199 948703441 /nfs/dbraw/zinc/70/34/41/948703441.db2.gz GWEIUNFGGWPHCH-AWEZNQCLSA-N -1 3 374.746 3.842 20 0 FHADHM CC(C)c1ccc2c(c1)CCCN2C(=O)c1ccc(-c2nnn[n-]2)cc1F ZINC001574417086 948765869 /nfs/dbraw/zinc/76/58/69/948765869.db2.gz KYCIWUKMIKIMBN-UHFFFAOYSA-N -1 3 365.412 3.722 20 0 FHADHM CC(C)c1ccc2c(c1)CCCN2C(=O)c1ccc(-c2nn[n-]n2)cc1F ZINC001574417086 948765885 /nfs/dbraw/zinc/76/58/85/948765885.db2.gz KYCIWUKMIKIMBN-UHFFFAOYSA-N -1 3 365.412 3.722 20 0 FHADHM C[C@H](Cc1ccccc1Cl)[N-]S(=O)(=O)c1ccc(Cl)s1 ZINC000049335213 948766015 /nfs/dbraw/zinc/76/60/15/948766015.db2.gz ZZOLRPNBWUBGOA-SECBINFHSA-N -1 3 350.292 3.964 20 0 FHADHM CC(C)c1cccc(C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)c1 ZINC001574418462 948776389 /nfs/dbraw/zinc/77/63/89/948776389.db2.gz WCRPBOKFWFLNHX-UHFFFAOYSA-N -1 3 361.449 3.795 20 0 FHADHM CC(C)c1cccc(C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)c1 ZINC001574418462 948776399 /nfs/dbraw/zinc/77/63/99/948776399.db2.gz WCRPBOKFWFLNHX-UHFFFAOYSA-N -1 3 361.449 3.795 20 0 FHADHM C[C@@H](C(=O)Nc1cc(F)cc(-c2nnn[n-]2)c1)c1ccc2ccccc2c1 ZINC001573756520 948819817 /nfs/dbraw/zinc/81/98/17/948819817.db2.gz SRMVDXCRBBIUIP-GFCCVEGCSA-N -1 3 361.380 3.901 20 0 FHADHM C[C@@H](C(=O)Nc1cc(F)cc(-c2nn[n-]n2)c1)c1ccc2ccccc2c1 ZINC001573756520 948819841 /nfs/dbraw/zinc/81/98/41/948819841.db2.gz SRMVDXCRBBIUIP-GFCCVEGCSA-N -1 3 361.380 3.901 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)c3ccc(F)cc3F)c2)n1 ZINC000049302998 210190118 /nfs/dbraw/zinc/19/01/18/210190118.db2.gz HNIIKDVPVBUVMY-UHFFFAOYSA-N -1 3 355.344 3.530 20 0 FHADHM CCCC(=O)Nc1cccc(S(=O)(=O)[N-]c2ccccc2Cl)c1 ZINC000021221570 211310877 /nfs/dbraw/zinc/31/08/77/211310877.db2.gz NGYZFBZEGOPHMK-UHFFFAOYSA-N -1 3 352.843 3.879 20 0 FHADHM O=S(=O)([N-][C@H](c1ccccc1)c1ccccn1)c1ccc(Cl)s1 ZINC000069093627 221321558 /nfs/dbraw/zinc/32/15/58/221321558.db2.gz KKWJJSLSRPXXJC-MRXNPFEDSA-N -1 3 364.879 3.864 20 0 FHADHM Cc1ccc(C)c(S(=O)(=O)[N-]c2ccc3nc([C@H]4CCCO4)[nH]c3c2)c1 ZINC000072035754 221397808 /nfs/dbraw/zinc/39/78/08/221397808.db2.gz RZEYDPDBCACQLE-QGZVFWFLSA-N -1 3 371.462 3.832 20 0 FHADHM Cn1[n-]c(=NC(=O)CSCc2ccc(Cl)cc2)cc1OC(F)F ZINC000490940616 515338169 /nfs/dbraw/zinc/33/81/69/515338169.db2.gz NVJVLDRJPUWDQF-UHFFFAOYSA-N -1 3 361.801 3.547 20 0 FHADHM Cc1cc(C)cc(-c2cc(=NC(=O)c3cnc(OCC4CC4)cn3)[nH][n-]2)c1 ZINC000493950084 515694694 /nfs/dbraw/zinc/69/46/94/515694694.db2.gz NTGDEWIYADBVJP-UHFFFAOYSA-N -1 3 363.421 3.525 20 0 FHADHM Cc1ccc([O-])c(C(=O)Nc2ccn(-c3ncccc3C(F)(F)F)n2)c1 ZINC000532019122 516758979 /nfs/dbraw/zinc/75/89/79/516758979.db2.gz FQZLEHIKQCJASM-UHFFFAOYSA-N -1 3 362.311 3.552 20 0 FHADHM O=C(N=c1cc(-c2cc(F)cc(F)c2)[n-][nH]1)c1ccc(NC2CC2)nc1 ZINC000532331369 516916706 /nfs/dbraw/zinc/91/67/06/516916706.db2.gz GLPPIKHFUYOQRW-UHFFFAOYSA-N -1 3 355.348 3.577 20 0 FHADHM Cc1[n-][nH]c(=NC(=O)C2CCC(C(=O)N(C)C)CC2)c1-c1ccc(C)cc1 ZINC000530271763 517670888 /nfs/dbraw/zinc/67/08/88/517670888.db2.gz BVPWLMNLXCSSCY-UHFFFAOYSA-N -1 3 368.481 3.527 20 0 FHADHM Cc1cc(C)c(-c2cc(=NC(=O)c3ccc4nnn(C)c4c3)[nH][n-]2)cc1C ZINC000542689701 517687921 /nfs/dbraw/zinc/68/79/21/517687921.db2.gz QDYKAQPTJQHKES-UHFFFAOYSA-N -1 3 360.421 3.536 20 0 FHADHM C[C@@H](CC(=O)c1ccco1)NC(=O)c1c[n-]nc1-c1ccc(Cl)s1 ZINC000186363731 567908081 /nfs/dbraw/zinc/90/80/81/567908081.db2.gz ZNYIPBIZTGDSRL-VIFPVBQESA-N -1 3 363.826 3.776 20 0 FHADHM COc1ccc(C(=O)N(C)C[C@H]2CCCO[C@H]2c2ccccc2)c([O-])c1 ZINC000051468120 567979564 /nfs/dbraw/zinc/97/95/64/567979564.db2.gz BGPIVMIDEDQYRH-UZLBHIALSA-N -1 3 355.434 3.641 20 0 FHADHM Cc1nc(C)c(CC(=O)Nc2ncc(-c3ccc(Cl)cc3)s2)c(=O)[n-]1 ZINC000461107435 567994684 /nfs/dbraw/zinc/99/46/84/567994684.db2.gz IWGGUELJNYZIEC-UHFFFAOYSA-N -1 3 374.853 3.757 20 0 FHADHM C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCN2C(=O)c2cc([O-])c3ccccc3c2)C1 ZINC000408223656 568032415 /nfs/dbraw/zinc/03/24/15/568032415.db2.gz CDMSHCUVQYMVJE-FCDRMGDPSA-N -1 3 353.462 3.947 20 0 FHADHM CCSCC[C@H](C)N(C)C(=O)N=c1[n-]n(CC(F)(F)F)cc1Cl ZINC000603043136 568055000 /nfs/dbraw/zinc/05/50/00/568055000.db2.gz LMTHLVVUGMJPJQ-VIFPVBQESA-N -1 3 372.844 3.516 20 0 FHADHM C[C@@H](c1ccc(F)c(F)c1)S(=O)(=O)c1nc(CCC2CCCC2)n[n-]1 ZINC000605986909 568065023 /nfs/dbraw/zinc/06/50/23/568065023.db2.gz BYXJMKQYDPCUEO-NSHDSACASA-N -1 3 369.437 3.741 20 0 FHADHM C[C@@H](c1ccc(F)c(F)c1)S(=O)(=O)c1nnc(CCC2CCCC2)[n-]1 ZINC000605986909 568065024 /nfs/dbraw/zinc/06/50/24/568065024.db2.gz BYXJMKQYDPCUEO-NSHDSACASA-N -1 3 369.437 3.741 20 0 FHADHM O=S(=O)([N-]C[C@@H]1OCCc2ccccc21)c1cc(Cl)cc(Cl)c1 ZINC000603506596 568109773 /nfs/dbraw/zinc/10/97/73/568109773.db2.gz VWMBXQYTEAAOOH-INIZCTEOSA-N -1 3 372.273 3.586 20 0 FHADHM [O-]c1cc(CNC2(c3noc(C(F)F)n3)CCC2)cc(C(F)(F)F)c1 ZINC000644839337 568109883 /nfs/dbraw/zinc/10/98/83/568109883.db2.gz NMBWTTOCZSCHPW-UHFFFAOYSA-N -1 3 363.286 3.901 20 0 FHADHM C[C@H](SCCC(N)=O)c1nc(=O)c2c(-c3ccccc3)csc2[n-]1 ZINC000603585064 568122707 /nfs/dbraw/zinc/12/27/07/568122707.db2.gz STPGWXHVEMMBOH-JTQLQIEISA-N -1 3 359.476 3.734 20 0 FHADHM Cc1ccc(-c2csc3[n-]c(CSCCC(N)=O)nc(=O)c23)s1 ZINC000603585029 568122736 /nfs/dbraw/zinc/12/27/36/568122736.db2.gz AZXQHJVUEUSBPT-UHFFFAOYSA-N -1 3 365.505 3.542 20 0 FHADHM O=C(c1ccc(Br)cc1F)N1CCCc2cccc([O-])c21 ZINC000063063865 568177813 /nfs/dbraw/zinc/17/78/13/568177813.db2.gz VIWMNHFRHTWUEP-UHFFFAOYSA-N -1 3 350.187 3.887 20 0 FHADHM Cc1cccnc1[C@@H]([N-]S(=O)(=O)c1ccc(Cl)cc1F)C(C)C ZINC000604407146 568268442 /nfs/dbraw/zinc/26/84/42/568268442.db2.gz YLPOVBTWLGNQTA-HNNXBMFYSA-N -1 3 356.850 3.858 20 0 FHADHM C[C@@H](Sc1nccn1C)c1nc(=O)c2c(-c3ccco3)csc2[n-]1 ZINC000028078438 568299267 /nfs/dbraw/zinc/29/92/67/568299267.db2.gz XFUPCMBQDMWGGP-SECBINFHSA-N -1 3 358.448 3.831 20 0 FHADHM COc1ccccc1-c1cc(=NC(=O)[C@@H](C)SCc2ccccc2)[nH][n-]1 ZINC000604498887 568304927 /nfs/dbraw/zinc/30/49/27/568304927.db2.gz VQBDNOCYXWZDLL-CQSZACIVSA-N -1 3 367.474 3.768 20 0 FHADHM O=C(Cc1c[nH]c2ccc(F)cc12)N=c1cc(-c2cccc(Cl)c2)[n-][nH]1 ZINC000604601294 568323445 /nfs/dbraw/zinc/32/34/45/568323445.db2.gz ATLRGSUVSKWTPP-UHFFFAOYSA-N -1 3 368.799 3.954 20 0 FHADHM O=S(=O)([N-][C@@H]1C[C@@H]1c1c(F)cccc1F)c1ccc(Cl)cc1F ZINC000604771906 568363313 /nfs/dbraw/zinc/36/33/13/568363313.db2.gz KLEBUVUWYDVQND-TVQRCGJNSA-N -1 3 361.772 3.592 20 0 FHADHM Cc1ccc(CCNC(=O)Nc2ccc(-c3cc(=O)[n-]c(C)n3)cc2)cc1 ZINC000604774441 568364887 /nfs/dbraw/zinc/36/48/87/568364887.db2.gz XHWMLGYJSNYERX-UHFFFAOYSA-N -1 3 362.433 3.830 20 0 FHADHM O=S(=O)([N-][C@@H](Cc1ccccc1)c1cccs1)c1cncc(F)c1 ZINC000604890343 568381706 /nfs/dbraw/zinc/38/17/06/568381706.db2.gz YGCAPRHYEKHPSX-INIZCTEOSA-N -1 3 362.451 3.545 20 0 FHADHM Cc1cccc(N2C[C@@H](C(=O)Nc3cc(Cl)cc(C)c3[O-])CC2=O)c1C ZINC000604901882 568384981 /nfs/dbraw/zinc/38/49/81/568384981.db2.gz ALIWJDGQDAMFFT-AWEZNQCLSA-N -1 3 372.852 3.962 20 0 FHADHM O=C(c1csc(=O)[n-]1)N1CCSC[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000365323660 568503755 /nfs/dbraw/zinc/50/37/55/568503755.db2.gz ZLLVSAGXEBCEOO-GFCCVEGCSA-N -1 3 374.409 3.798 20 0 FHADHM Cn1ncc2c1nc(CN1CCCCC[C@@H]1c1ccc(Cl)cc1)[n-]c2=O ZINC000605000291 568513857 /nfs/dbraw/zinc/51/38/57/568513857.db2.gz DXELRTWMFGFLEK-MRXNPFEDSA-N -1 3 371.872 3.840 20 0 FHADHM [O-]c1cc(F)cc(CNCc2noc(-c3ccc(Cl)cc3F)n2)c1 ZINC000365336923 568524705 /nfs/dbraw/zinc/52/47/05/568524705.db2.gz MISVDNRMSKHUAS-UHFFFAOYSA-N -1 3 351.740 3.664 20 0 FHADHM CC(C)[C@H]1CC[C@@H](C)C[C@@H]1OCC(=O)[N-]c1nncn1Cc1ccccc1 ZINC000605117170 568572996 /nfs/dbraw/zinc/57/29/96/568572996.db2.gz NNUCWEZTDBUYQT-QRQLOZEOSA-N -1 3 370.497 3.742 20 0 FHADHM Cc1ccc([N-]S(C)(=O)=O)c(NC(=O)C[C@@]23CCCC[C@@H]2C3(F)F)c1 ZINC000669204102 568645728 /nfs/dbraw/zinc/64/57/28/568645728.db2.gz FRALZZDQLMSTMH-HOCLYGCPSA-N -1 3 372.437 3.521 20 0 FHADHM Cc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@H]3C[C@@H]3c3cccc(O)c3)c2)n1 ZINC000365422438 568650678 /nfs/dbraw/zinc/65/06/78/568650678.db2.gz SOSRKCOOEOWMHZ-MSOLQXFVSA-N -1 3 361.401 3.605 20 0 FHADHM CS[C@H](C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccccc1 ZINC000737170401 598829297 /nfs/dbraw/zinc/82/92/97/598829297.db2.gz JWWCFCSBRJDNBP-AWEZNQCLSA-N -1 3 359.842 3.563 20 0 FHADHM CS[C@H](C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccccc1 ZINC000737170401 598829299 /nfs/dbraw/zinc/82/92/99/598829299.db2.gz JWWCFCSBRJDNBP-AWEZNQCLSA-N -1 3 359.842 3.563 20 0 FHADHM CCC[C@H](C)C(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000736420404 598835516 /nfs/dbraw/zinc/83/55/16/598835516.db2.gz TVAGKUVXKANHON-LBPRGKRZSA-N -1 3 355.467 3.648 20 0 FHADHM CC(C)[C@@H](C)CNC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000735701711 598836988 /nfs/dbraw/zinc/83/69/88/598836988.db2.gz KLYUCKWWIIVMSY-AWEZNQCLSA-N -1 3 365.437 3.681 20 0 FHADHM CC(C)[C@@H](C)CNC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735701711 598836991 /nfs/dbraw/zinc/83/69/91/598836991.db2.gz KLYUCKWWIIVMSY-AWEZNQCLSA-N -1 3 365.437 3.681 20 0 FHADHM CCC/C=C\C(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000736439776 598846535 /nfs/dbraw/zinc/84/65/35/598846535.db2.gz VNKXLNOXSNTOPU-YWEYNIOJSA-N -1 3 353.451 3.568 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(NCc2ccccc2OCC2CC2)c1 ZINC000737570386 598855818 /nfs/dbraw/zinc/85/58/18/598855818.db2.gz GPIDMDAZGMQFNP-UHFFFAOYSA-N -1 3 355.829 3.921 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(NCc2ccccc2OCC2CC2)c1 ZINC000737570386 598855820 /nfs/dbraw/zinc/85/58/20/598855820.db2.gz GPIDMDAZGMQFNP-UHFFFAOYSA-N -1 3 355.829 3.921 20 0 FHADHM Clc1cc(N[C@@H](c2ccccc2)[C@@H]2CCCO2)ccc1-c1nnn[n-]1 ZINC000737562909 598870319 /nfs/dbraw/zinc/87/03/19/598870319.db2.gz AFOAORFLGYPSHJ-IRXDYDNUSA-N -1 3 355.829 3.852 20 0 FHADHM Clc1cc(N[C@@H](c2ccccc2)[C@@H]2CCCO2)ccc1-c1nn[n-]n1 ZINC000737562909 598870322 /nfs/dbraw/zinc/87/03/22/598870322.db2.gz AFOAORFLGYPSHJ-IRXDYDNUSA-N -1 3 355.829 3.852 20 0 FHADHM CCC[C@H](C)NC(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000736426156 598888886 /nfs/dbraw/zinc/88/88/86/598888886.db2.gz XVDZOFLOACFFRE-LBPRGKRZSA-N -1 3 370.482 3.583 20 0 FHADHM C(=Cc1ccccc1-c1nnn[n-]1)c1nc(-c2nccc3ccccc32)no1 ZINC000735399231 598890393 /nfs/dbraw/zinc/89/03/93/598890393.db2.gz JNUBAQLUDWMTEC-KTKRTIGZSA-N -1 3 367.372 3.635 20 0 FHADHM C(=Cc1ccccc1-c1nn[n-]n1)c1nc(-c2nccc3ccccc32)no1 ZINC000735399231 598890395 /nfs/dbraw/zinc/89/03/95/598890395.db2.gz JNUBAQLUDWMTEC-KTKRTIGZSA-N -1 3 367.372 3.635 20 0 FHADHM CC[C@H]1CCCCCN1C(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(C)C ZINC000736399819 598904452 /nfs/dbraw/zinc/90/44/52/598904452.db2.gz KGTNECNTOVOIQJ-HNNXBMFYSA-N -1 3 372.473 3.840 20 0 FHADHM CC[C@H]1CCCCCN1C(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(C)C ZINC000736399819 598904453 /nfs/dbraw/zinc/90/44/53/598904453.db2.gz KGTNECNTOVOIQJ-HNNXBMFYSA-N -1 3 372.473 3.840 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1OCCSc1cc(C)ccc1C ZINC000737032637 598938207 /nfs/dbraw/zinc/93/82/07/598938207.db2.gz NLNMCRVIBWJNQI-UHFFFAOYSA-N -1 3 356.451 3.663 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1OCCSc1cc(C)ccc1C ZINC000737032637 598938209 /nfs/dbraw/zinc/93/82/09/598938209.db2.gz NLNMCRVIBWJNQI-UHFFFAOYSA-N -1 3 356.451 3.663 20 0 FHADHM FC(F)(F)COc1ccc(Nc2ncc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000737627395 598936849 /nfs/dbraw/zinc/93/68/49/598936849.db2.gz QRFPBIBXCGWKJA-UHFFFAOYSA-N -1 3 370.722 3.600 20 0 FHADHM FC(F)(F)COc1ccc(Nc2ncc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000737627395 598936851 /nfs/dbraw/zinc/93/68/51/598936851.db2.gz QRFPBIBXCGWKJA-UHFFFAOYSA-N -1 3 370.722 3.600 20 0 FHADHM Cc1nc(C)c(-c2nnn[n-]2)c(SCCCc2ccc(Cl)cc2)n1 ZINC000737472253 598938560 /nfs/dbraw/zinc/93/85/60/598938560.db2.gz XRFISOVFSGOPPF-UHFFFAOYSA-N -1 3 360.874 3.652 20 0 FHADHM Cc1nc(C)c(-c2nn[n-]n2)c(SCCCc2ccc(Cl)cc2)n1 ZINC000737472253 598938562 /nfs/dbraw/zinc/93/85/62/598938562.db2.gz XRFISOVFSGOPPF-UHFFFAOYSA-N -1 3 360.874 3.652 20 0 FHADHM CC(C)C[C@@H]1CCCCCN1C(=O)CCc1ccc(-c2nnn[n-]2)cc1 ZINC000735795923 598943293 /nfs/dbraw/zinc/94/32/93/598943293.db2.gz PKPLNGMXHURHQF-SFHVURJKSA-N -1 3 355.486 3.617 20 0 FHADHM CC(C)C[C@@H]1CCCCCN1C(=O)CCc1ccc(-c2nn[n-]n2)cc1 ZINC000735795923 598943294 /nfs/dbraw/zinc/94/32/94/598943294.db2.gz PKPLNGMXHURHQF-SFHVURJKSA-N -1 3 355.486 3.617 20 0 FHADHM CCCN(c1ncc(-c2nnn[n-]2)cc1Cl)[C@@H](C)c1ccccc1OC ZINC000736478661 598940163 /nfs/dbraw/zinc/94/01/63/598940163.db2.gz CDZGSUCBPOVXNB-LBPRGKRZSA-N -1 3 372.860 3.901 20 0 FHADHM CCCN(c1ncc(-c2nn[n-]n2)cc1Cl)[C@@H](C)c1ccccc1OC ZINC000736478661 598940165 /nfs/dbraw/zinc/94/01/65/598940165.db2.gz CDZGSUCBPOVXNB-LBPRGKRZSA-N -1 3 372.860 3.901 20 0 FHADHM O=C(Nc1cccc(N2CCCCCC2)c1)c1sccc1-c1nnn[n-]1 ZINC000738182014 598944504 /nfs/dbraw/zinc/94/45/04/598944504.db2.gz DFUGSBKTULWKQE-UHFFFAOYSA-N -1 3 368.466 3.561 20 0 FHADHM O=C(Nc1cccc(N2CCCCCC2)c1)c1sccc1-c1nn[n-]n1 ZINC000738182014 598944505 /nfs/dbraw/zinc/94/45/05/598944505.db2.gz DFUGSBKTULWKQE-UHFFFAOYSA-N -1 3 368.466 3.561 20 0 FHADHM CC(C)[C@@H](NC(=O)c1cccc(-c2nnn[n-]2)c1)c1ccccc1Cl ZINC000735725206 599006762 /nfs/dbraw/zinc/00/67/62/599006762.db2.gz UZQTUZQGALLTBJ-MRXNPFEDSA-N -1 3 355.829 3.647 20 0 FHADHM CC(C)[C@@H](NC(=O)c1cccc(-c2nn[n-]n2)c1)c1ccccc1Cl ZINC000735725206 599006764 /nfs/dbraw/zinc/00/67/64/599006764.db2.gz UZQTUZQGALLTBJ-MRXNPFEDSA-N -1 3 355.829 3.647 20 0 FHADHM CCCCC[C@H](NC(=O)CCc1ccc(-c2nnn[n-]2)cc1)C(C)(C)C ZINC000736441537 599008789 /nfs/dbraw/zinc/00/87/89/599008789.db2.gz RTHYGBVKOLQSGY-KRWDZBQOSA-N -1 3 357.502 3.911 20 0 FHADHM CCCCC[C@H](NC(=O)CCc1ccc(-c2nn[n-]n2)cc1)C(C)(C)C ZINC000736441537 599008791 /nfs/dbraw/zinc/00/87/91/599008791.db2.gz RTHYGBVKOLQSGY-KRWDZBQOSA-N -1 3 357.502 3.911 20 0 FHADHM Fc1cccc(F)c1-c1ccc(C=Cc2ccc(-c3nnn[n-]3)cn2)o1 ZINC000737659227 599012249 /nfs/dbraw/zinc/01/22/49/599012249.db2.gz BEUXKDZALJRSPB-SREVYHEPSA-N -1 3 351.316 3.970 20 0 FHADHM Fc1cccc(F)c1-c1ccc(C=Cc2ccc(-c3nn[n-]n3)cn2)o1 ZINC000737659227 599012250 /nfs/dbraw/zinc/01/22/50/599012250.db2.gz BEUXKDZALJRSPB-SREVYHEPSA-N -1 3 351.316 3.970 20 0 FHADHM CC(C)C[C@@H](C(=O)OCc1ccc(-c2nnn[n-]2)cc1F)c1ccccc1 ZINC000735758198 599018815 /nfs/dbraw/zinc/01/88/15/599018815.db2.gz XYIACLUVPFSIIY-QGZVFWFLSA-N -1 3 368.412 3.879 20 0 FHADHM CC(C)C[C@@H](C(=O)OCc1ccc(-c2nn[n-]n2)cc1F)c1ccccc1 ZINC000735758198 599018816 /nfs/dbraw/zinc/01/88/16/599018816.db2.gz XYIACLUVPFSIIY-QGZVFWFLSA-N -1 3 368.412 3.879 20 0 FHADHM C[C@@H](CCc1ccccc1)Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000735992991 599036704 /nfs/dbraw/zinc/03/67/04/599036704.db2.gz NROHVUUCHFINKW-NSHDSACASA-N -1 3 362.359 3.714 20 0 FHADHM C[C@@H](CCc1ccccc1)Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000735992991 599036707 /nfs/dbraw/zinc/03/67/07/599036707.db2.gz NROHVUUCHFINKW-NSHDSACASA-N -1 3 362.359 3.714 20 0 FHADHM C[C@H]1CN(c2ccc(Cl)cc2-c2nnn[n-]2)C[C@@H](c2ccc(F)cc2)O1 ZINC000820778454 599039665 /nfs/dbraw/zinc/03/96/65/599039665.db2.gz WYVOVYJEBQTLDO-GTNSWQLSSA-N -1 3 373.819 3.626 20 0 FHADHM C[C@H]1CN(c2ccc(Cl)cc2-c2nn[n-]n2)C[C@@H](c2ccc(F)cc2)O1 ZINC000820778454 599039667 /nfs/dbraw/zinc/03/96/67/599039667.db2.gz WYVOVYJEBQTLDO-GTNSWQLSSA-N -1 3 373.819 3.626 20 0 FHADHM Cc1ccc([C@@H](C)N(C)c2nc(C(F)(F)F)ccc2-c2nnn[n-]2)cc1 ZINC000737320286 599045270 /nfs/dbraw/zinc/04/52/70/599045270.db2.gz JYJBNVKUXSSEBT-LLVKDONJSA-N -1 3 362.359 3.786 20 0 FHADHM Cc1ccc([C@@H](C)N(C)c2nc(C(F)(F)F)ccc2-c2nn[n-]n2)cc1 ZINC000737320286 599045273 /nfs/dbraw/zinc/04/52/73/599045273.db2.gz JYJBNVKUXSSEBT-LLVKDONJSA-N -1 3 362.359 3.786 20 0 FHADHM CO[C@@H](CNc1ccc(Cl)cc1-c1nnn[n-]1)c1ccc(Cl)cc1 ZINC000821676875 599045850 /nfs/dbraw/zinc/04/58/50/599045850.db2.gz JDZNAEAVBHVUSR-HNNXBMFYSA-N -1 3 364.236 3.973 20 0 FHADHM CO[C@@H](CNc1ccc(Cl)cc1-c1nn[n-]n1)c1ccc(Cl)cc1 ZINC000821676875 599045853 /nfs/dbraw/zinc/04/58/53/599045853.db2.gz JDZNAEAVBHVUSR-HNNXBMFYSA-N -1 3 364.236 3.973 20 0 FHADHM Cc1ccccc1[C@H](C)N(C)c1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000737424779 599047026 /nfs/dbraw/zinc/04/70/26/599047026.db2.gz XJAMCRTZQDWRRO-NSHDSACASA-N -1 3 362.359 3.786 20 0 FHADHM Cc1ccccc1[C@H](C)N(C)c1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000737424779 599047029 /nfs/dbraw/zinc/04/70/29/599047029.db2.gz XJAMCRTZQDWRRO-NSHDSACASA-N -1 3 362.359 3.786 20 0 FHADHM C[C@@H](c1ncc(-c2ccccc2)o1)N(C)Cc1cccc(-c2nn[n-]n2)c1 ZINC000736203287 599048128 /nfs/dbraw/zinc/04/81/28/599048128.db2.gz LSHQJOGOOPNYCS-AWEZNQCLSA-N -1 3 360.421 3.715 20 0 FHADHM Fc1ccc(F)c2c1ncc(-c1nn[n-]n1)c2N1CCC2(C1)CCCCC2 ZINC000822774191 599051462 /nfs/dbraw/zinc/05/14/62/599051462.db2.gz GUDBMILUBBHNSD-UHFFFAOYSA-N -1 3 370.407 3.854 20 0 FHADHM Cc1cc(C)c(CNc2nc(C(F)(F)F)ccc2-c2nnn[n-]2)c(C)c1 ZINC000737246112 599049349 /nfs/dbraw/zinc/04/93/49/599049349.db2.gz JRJPZZZWFBKMTH-UHFFFAOYSA-N -1 3 362.359 3.818 20 0 FHADHM Cc1cc(C)c(CNc2nc(C(F)(F)F)ccc2-c2nn[n-]n2)c(C)c1 ZINC000737246112 599049355 /nfs/dbraw/zinc/04/93/55/599049355.db2.gz JRJPZZZWFBKMTH-UHFFFAOYSA-N -1 3 362.359 3.818 20 0 FHADHM C[C@@H](CCNc1nc(C(F)(F)F)ccc1-c1nnn[n-]1)c1ccccc1 ZINC000735987684 599051074 /nfs/dbraw/zinc/05/10/74/599051074.db2.gz XHZSYMFFZMRUEP-NSHDSACASA-N -1 3 362.359 3.886 20 0 FHADHM C[C@@H](CCNc1nc(C(F)(F)F)ccc1-c1nn[n-]n1)c1ccccc1 ZINC000735987684 599051077 /nfs/dbraw/zinc/05/10/77/599051077.db2.gz XHZSYMFFZMRUEP-NSHDSACASA-N -1 3 362.359 3.886 20 0 FHADHM Fc1ccc(F)c2c1ncc(-c1nnn[n-]1)c2N1CCC2(C1)CCCCC2 ZINC000822774191 599051459 /nfs/dbraw/zinc/05/14/59/599051459.db2.gz GUDBMILUBBHNSD-UHFFFAOYSA-N -1 3 370.407 3.854 20 0 FHADHM CC[C@H](Cc1ccccc1)Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000736353245 599053303 /nfs/dbraw/zinc/05/33/03/599053303.db2.gz VNVMCGTXOBNXRI-GFCCVEGCSA-N -1 3 362.359 3.714 20 0 FHADHM CC[C@H](Cc1ccccc1)Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000736353245 599053306 /nfs/dbraw/zinc/05/33/06/599053306.db2.gz VNVMCGTXOBNXRI-GFCCVEGCSA-N -1 3 362.359 3.714 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N2CCC[C@@]3(CC=CCC3)C2)n1 ZINC000737631002 599057362 /nfs/dbraw/zinc/05/73/62/599057362.db2.gz AWAMNQVMGQULDS-INIZCTEOSA-N -1 3 364.375 3.607 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N2CCC[C@@]3(CC=CCC3)C2)n1 ZINC000737631002 599057365 /nfs/dbraw/zinc/05/73/65/599057365.db2.gz AWAMNQVMGQULDS-INIZCTEOSA-N -1 3 364.375 3.607 20 0 FHADHM C[C@H]1C[C@H](c2cccc(F)c2)N(c2ncc(-c3nnn[n-]3)cc2Cl)C1 ZINC000820667623 599059705 /nfs/dbraw/zinc/05/97/05/599059705.db2.gz NCPCMANPEFDECM-ZUZCIYMTSA-N -1 3 358.808 3.642 20 0 FHADHM C[C@H]1C[C@H](c2cccc(F)c2)N(c2ncc(-c3nn[n-]n3)cc2Cl)C1 ZINC000820667623 599059708 /nfs/dbraw/zinc/05/97/08/599059708.db2.gz NCPCMANPEFDECM-ZUZCIYMTSA-N -1 3 358.808 3.642 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1N1CC[C@@H](COCc2ccccc2)C1 ZINC000822581713 599063053 /nfs/dbraw/zinc/06/30/53/599063053.db2.gz LLHBODBYXAWIGN-OAHLLOKOSA-N -1 3 369.856 3.563 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1N1CC[C@@H](COCc2ccccc2)C1 ZINC000822581713 599063056 /nfs/dbraw/zinc/06/30/56/599063056.db2.gz LLHBODBYXAWIGN-OAHLLOKOSA-N -1 3 369.856 3.563 20 0 FHADHM Cc1[nH]c2ccccc2c1C(=O)CSc1ccc(-c2nnn[n-]2)cc1F ZINC000737201024 599066317 /nfs/dbraw/zinc/06/63/17/599066317.db2.gz XIQNRUSLRHBBTD-UHFFFAOYSA-N -1 3 367.409 3.771 20 0 FHADHM Cc1[nH]c2ccccc2c1C(=O)CSc1ccc(-c2nn[n-]n2)cc1F ZINC000737201024 599066319 /nfs/dbraw/zinc/06/63/19/599066319.db2.gz XIQNRUSLRHBBTD-UHFFFAOYSA-N -1 3 367.409 3.771 20 0 FHADHM Cc1ccc([C@H]2CCCCN2C(=O)C=Cc2ccccc2-c2nnn[n-]2)o1 ZINC000737330387 599082632 /nfs/dbraw/zinc/08/26/32/599082632.db2.gz NLGODTAVNZTGIA-DPCFLFMUSA-N -1 3 363.421 3.535 20 0 FHADHM Cc1ccc([C@H]2CCCCN2C(=O)C=Cc2ccccc2-c2nn[n-]n2)o1 ZINC000737330387 599082634 /nfs/dbraw/zinc/08/26/34/599082634.db2.gz NLGODTAVNZTGIA-DPCFLFMUSA-N -1 3 363.421 3.535 20 0 FHADHM CC[C@@]1(C)CCCN(c2c(-c3nnn[n-]3)cnc3c(F)cc(F)cc32)C1 ZINC000820950255 599089502 /nfs/dbraw/zinc/08/95/02/599089502.db2.gz LCQKVUZXPYHHTL-SFHVURJKSA-N -1 3 358.396 3.710 20 0 FHADHM CC[C@@]1(C)CCCN(c2c(-c3nn[n-]n3)cnc3c(F)cc(F)cc32)C1 ZINC000820950255 599089505 /nfs/dbraw/zinc/08/95/05/599089505.db2.gz LCQKVUZXPYHHTL-SFHVURJKSA-N -1 3 358.396 3.710 20 0 FHADHM C[C@@H]1C[C@H](c2ccccc2)[C@H](C)N1C(=O)C=Cc1ccccc1-c1nnn[n-]1 ZINC000736235679 599090151 /nfs/dbraw/zinc/09/01/51/599090151.db2.gz PLAIXLZHMRYMBV-HZHAGGDASA-N -1 3 373.460 3.673 20 0 FHADHM C[C@@H]1C[C@H](c2ccccc2)[C@H](C)N1C(=O)C=Cc1ccccc1-c1nn[n-]n1 ZINC000736235679 599090155 /nfs/dbraw/zinc/09/01/55/599090155.db2.gz PLAIXLZHMRYMBV-HZHAGGDASA-N -1 3 373.460 3.673 20 0 FHADHM FC(F)n1c(CSc2ccccc2-c2nnn[n-]2)nc2ccccc21 ZINC000737638527 599110257 /nfs/dbraw/zinc/11/02/57/599110257.db2.gz HVRUGJPZTYKRAD-UHFFFAOYSA-N -1 3 358.377 3.904 20 0 FHADHM FC(F)n1c(CSc2ccccc2-c2nn[n-]n2)nc2ccccc21 ZINC000737638527 599110260 /nfs/dbraw/zinc/11/02/60/599110260.db2.gz HVRUGJPZTYKRAD-UHFFFAOYSA-N -1 3 358.377 3.904 20 0 FHADHM Cc1cccc(C)c1NC(=O)[C@@H](C)Sc1ccccc1-c1nnn[n-]1 ZINC000737391269 599111969 /nfs/dbraw/zinc/11/19/69/599111969.db2.gz XCDJMSODALXFHJ-CYBMUJFWSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1cccc(C)c1NC(=O)[C@@H](C)Sc1ccccc1-c1nn[n-]n1 ZINC000737391269 599111971 /nfs/dbraw/zinc/11/19/71/599111971.db2.gz XCDJMSODALXFHJ-CYBMUJFWSA-N -1 3 353.451 3.603 20 0 FHADHM CC(=CC(=O)Nc1ccc(-c2nnn[n-]2)cc1)c1cccc(C(F)(F)F)c1 ZINC000742610739 599133847 /nfs/dbraw/zinc/13/38/47/599133847.db2.gz GQWYKAXINPJVOK-LUAWRHEFSA-N -1 3 373.338 3.928 20 0 FHADHM CC(=CC(=O)Nc1ccc(-c2nn[n-]n2)cc1)c1cccc(C(F)(F)F)c1 ZINC000742610739 599133849 /nfs/dbraw/zinc/13/38/49/599133849.db2.gz GQWYKAXINPJVOK-LUAWRHEFSA-N -1 3 373.338 3.928 20 0 FHADHM Cc1ccc([C@H](C)C(=O)N(CC(C)C)c2ccc(-c3nn[n-]n3)cc2)o1 ZINC000822227679 599147956 /nfs/dbraw/zinc/14/79/56/599147956.db2.gz RHFAPGYEKWOMFL-AWEZNQCLSA-N -1 3 353.426 3.561 20 0 FHADHM Cc1ccc([C@H](C)C(=O)N(CC(C)C)c2ccc(-c3nnn[n-]3)cc2)o1 ZINC000822227679 599147955 /nfs/dbraw/zinc/14/79/55/599147955.db2.gz RHFAPGYEKWOMFL-AWEZNQCLSA-N -1 3 353.426 3.561 20 0 FHADHM O=C(Nc1ccc(OC2CCCCC2)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000738175664 599164191 /nfs/dbraw/zinc/16/41/91/599164191.db2.gz ZGUSQZKIIGORNG-UHFFFAOYSA-N -1 3 363.421 3.831 20 0 FHADHM O=C(Nc1ccc(OC2CCCCC2)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000738175664 599164193 /nfs/dbraw/zinc/16/41/93/599164193.db2.gz ZGUSQZKIIGORNG-UHFFFAOYSA-N -1 3 363.421 3.831 20 0 FHADHM CCO[C@H](C)c1nc(CSc2ccc(-c3nnn[n-]3)cc2F)cs1 ZINC000736619723 599169327 /nfs/dbraw/zinc/16/93/27/599169327.db2.gz ZCFVYOZUEJGRFS-SECBINFHSA-N -1 3 365.459 3.852 20 0 FHADHM CCO[C@H](C)c1nc(CSc2ccc(-c3nn[n-]n3)cc2F)cs1 ZINC000736619723 599169328 /nfs/dbraw/zinc/16/93/28/599169328.db2.gz ZCFVYOZUEJGRFS-SECBINFHSA-N -1 3 365.459 3.852 20 0 FHADHM C[C@@H](C(=O)Nc1ccccc1-c1nnn[n-]1)c1ccccc1C(F)(F)F ZINC000735560212 599177346 /nfs/dbraw/zinc/17/73/46/599177346.db2.gz BUMKLZWEBZKGSS-SNVBAGLBSA-N -1 3 361.327 3.628 20 0 FHADHM C[C@@H](C(=O)Nc1ccccc1-c1nn[n-]n1)c1ccccc1C(F)(F)F ZINC000735560212 599177347 /nfs/dbraw/zinc/17/73/47/599177347.db2.gz BUMKLZWEBZKGSS-SNVBAGLBSA-N -1 3 361.327 3.628 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2)c1cccc(Cl)c1 ZINC000735570308 599177593 /nfs/dbraw/zinc/17/75/93/599177593.db2.gz NHGLPNAEFPHQOV-SECBINFHSA-N -1 3 373.869 3.813 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2)c1cccc(Cl)c1 ZINC000735570308 599177595 /nfs/dbraw/zinc/17/75/95/599177595.db2.gz NHGLPNAEFPHQOV-SECBINFHSA-N -1 3 373.869 3.813 20 0 FHADHM C[C@H](C(=O)Nc1cccc(-c2nnn[n-]2)c1)c1ccccc1C(F)(F)F ZINC000607884789 599177600 /nfs/dbraw/zinc/17/76/00/599177600.db2.gz AHBVDBZUWIKUDH-JTQLQIEISA-N -1 3 361.327 3.628 20 0 FHADHM C[C@H](C(=O)Nc1cccc(-c2nn[n-]n2)c1)c1ccccc1C(F)(F)F ZINC000607884789 599177601 /nfs/dbraw/zinc/17/76/01/599177601.db2.gz AHBVDBZUWIKUDH-JTQLQIEISA-N -1 3 361.327 3.628 20 0 FHADHM C[C@H](C(=O)Nc1ccc(-c2nnn[n-]2)cc1)c1ccccc1C(F)(F)F ZINC000607818793 599177611 /nfs/dbraw/zinc/17/76/11/599177611.db2.gz WRROAXFWRFYXBN-JTQLQIEISA-N -1 3 361.327 3.628 20 0 FHADHM C[C@H](C(=O)Nc1ccc(-c2nn[n-]n2)cc1)c1ccccc1C(F)(F)F ZINC000607818793 599177613 /nfs/dbraw/zinc/17/76/13/599177613.db2.gz WRROAXFWRFYXBN-JTQLQIEISA-N -1 3 361.327 3.628 20 0 FHADHM Cc1sc(NC(=O)[C@@H]2CCSc3ccccc32)c(-c2nnn[n-]2)c1C ZINC000737559861 599178293 /nfs/dbraw/zinc/17/82/93/599178293.db2.gz BJPNSSHFXTWPQD-GFCCVEGCSA-N -1 3 371.491 3.763 20 0 FHADHM Cc1sc(NC(=O)[C@@H]2CCSc3ccccc32)c(-c2nn[n-]n2)c1C ZINC000737559861 599178295 /nfs/dbraw/zinc/17/82/95/599178295.db2.gz BJPNSSHFXTWPQD-GFCCVEGCSA-N -1 3 371.491 3.763 20 0 FHADHM CC(C)=CCOc1cccc(C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)c1 ZINC000735680468 599186199 /nfs/dbraw/zinc/18/61/99/599186199.db2.gz WILKDZKEHJISRL-UHFFFAOYSA-N -1 3 367.384 3.603 20 0 FHADHM CC(C)=CCOc1cccc(C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)c1 ZINC000735680468 599186200 /nfs/dbraw/zinc/18/62/00/599186200.db2.gz WILKDZKEHJISRL-UHFFFAOYSA-N -1 3 367.384 3.603 20 0 FHADHM O=C(NCCC1CC1)c1ccccc1Sc1ccccc1-c1nnn[n-]1 ZINC000823181926 599192216 /nfs/dbraw/zinc/19/22/16/599192216.db2.gz FXXMFCPTXZQXCV-UHFFFAOYSA-N -1 3 365.462 3.548 20 0 FHADHM O=C(NCCC1CC1)c1ccccc1Sc1ccccc1-c1nn[n-]n1 ZINC000823181926 599192218 /nfs/dbraw/zinc/19/22/18/599192218.db2.gz FXXMFCPTXZQXCV-UHFFFAOYSA-N -1 3 365.462 3.548 20 0 FHADHM c1ccc2cc(OCc3nnc(-c4ccc(-c5nnn[n-]5)cc4)o3)ccc2c1 ZINC000738443064 599193351 /nfs/dbraw/zinc/19/33/51/599193351.db2.gz UYCPGQYEEKWIMN-UHFFFAOYSA-N -1 3 370.372 3.649 20 0 FHADHM c1ccc2cc(OCc3nnc(-c4ccc(-c5nn[n-]n5)cc4)o3)ccc2c1 ZINC000738443064 599193354 /nfs/dbraw/zinc/19/33/54/599193354.db2.gz UYCPGQYEEKWIMN-UHFFFAOYSA-N -1 3 370.372 3.649 20 0 FHADHM CCCN(C)C(=O)c1cccc(Oc2cccc(Cl)c2-c2nnn[n-]2)c1 ZINC000736471265 599194644 /nfs/dbraw/zinc/19/46/44/599194644.db2.gz JEYSHDKQMIWHDW-UHFFFAOYSA-N -1 3 371.828 3.794 20 0 FHADHM Cc1nn(-c2ccccc2)c(CSc2cccs2)c1-c1nnn[n-]1 ZINC000737504339 599222600 /nfs/dbraw/zinc/22/26/00/599222600.db2.gz UKTUTGARCPZXAF-UHFFFAOYSA-N -1 3 354.464 3.715 20 0 FHADHM C[C@H](SCCc1ccc2c(c1)CCO2)c1ccc(-c2nnn[n-]2)cc1 ZINC000820549230 599222657 /nfs/dbraw/zinc/22/26/57/599222657.db2.gz LDQZMGZXIIFUOM-ZDUSSCGKSA-N -1 3 352.463 3.839 20 0 FHADHM C[C@H](SCCc1ccc2c(c1)CCO2)c1ccc(-c2nn[n-]n2)cc1 ZINC000820549230 599222660 /nfs/dbraw/zinc/22/26/60/599222660.db2.gz LDQZMGZXIIFUOM-ZDUSSCGKSA-N -1 3 352.463 3.839 20 0 FHADHM C[C@@H]1CN(C(=O)C=Cc2ccccc2-c2nnn[n-]2)CC[C@@H]1c1ccccc1 ZINC000736278835 599222801 /nfs/dbraw/zinc/22/28/01/599222801.db2.gz IVZCXRHRNZZKGZ-DUSJZKHYSA-N -1 3 373.460 3.532 20 0 FHADHM C[C@@H]1CN(C(=O)C=Cc2ccccc2-c2nn[n-]n2)CC[C@@H]1c1ccccc1 ZINC000736278835 599222804 /nfs/dbraw/zinc/22/28/04/599222804.db2.gz IVZCXRHRNZZKGZ-DUSJZKHYSA-N -1 3 373.460 3.532 20 0 FHADHM COc1ccc(Cl)c(NC(=S)Nc2cc(-c3nnn[n-]3)ccc2C)c1 ZINC000821824898 599225465 /nfs/dbraw/zinc/22/54/65/599225465.db2.gz PZFZPACBVAPTFD-UHFFFAOYSA-N -1 3 374.857 3.646 20 0 FHADHM COc1ccc(Cl)c(NC(=S)Nc2cc(-c3nn[n-]n3)ccc2C)c1 ZINC000821824898 599225467 /nfs/dbraw/zinc/22/54/67/599225467.db2.gz PZFZPACBVAPTFD-UHFFFAOYSA-N -1 3 374.857 3.646 20 0 FHADHM C[C@@H]1C[C@H]1[C@H](NC(=O)c1sccc1-c1nnn[n-]1)c1ccc(Cl)cc1 ZINC000736233678 599227017 /nfs/dbraw/zinc/22/70/17/599227017.db2.gz GJIRQBGKTVUXJE-OWYVNGRQSA-N -1 3 373.869 3.709 20 0 FHADHM C[C@@H]1C[C@H]1[C@H](NC(=O)c1sccc1-c1nn[n-]n1)c1ccc(Cl)cc1 ZINC000736233678 599227020 /nfs/dbraw/zinc/22/70/20/599227020.db2.gz GJIRQBGKTVUXJE-OWYVNGRQSA-N -1 3 373.869 3.709 20 0 FHADHM O=C(Nc1nc(C=Cc2ccccc2)cs1)c1cccc(-c2nnn[n-]2)c1 ZINC000738212697 599227538 /nfs/dbraw/zinc/22/75/38/599227538.db2.gz TWXNJAQWLVDNSV-MDZDMXLPSA-N -1 3 374.429 3.746 20 0 FHADHM O=C(Nc1nc(C=Cc2ccccc2)cs1)c1cccc(-c2nn[n-]n2)c1 ZINC000738212697 599227539 /nfs/dbraw/zinc/22/75/39/599227539.db2.gz TWXNJAQWLVDNSV-MDZDMXLPSA-N -1 3 374.429 3.746 20 0 FHADHM CC[C@H](C)C[C@@H](C)NC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820870539 599227960 /nfs/dbraw/zinc/22/79/60/599227960.db2.gz URDNYLQVDCJOLL-VHSXEESVSA-N -1 3 352.895 3.631 20 0 FHADHM CC[C@H](C)C[C@@H](C)NC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820870539 599227963 /nfs/dbraw/zinc/22/79/63/599227963.db2.gz URDNYLQVDCJOLL-VHSXEESVSA-N -1 3 352.895 3.631 20 0 FHADHM CC[C@H](C)Oc1ccc(C(=O)Nc2cccc(-c3nnn[n-]3)c2C)cc1 ZINC000820876939 607268581 /nfs/dbraw/zinc/26/85/81/607268581.db2.gz WVXJTZPLXVCXJB-LBPRGKRZSA-N -1 3 351.410 3.605 20 0 FHADHM CC[C@H](C)Oc1ccc(C(=O)Nc2cccc(-c3nn[n-]n3)c2C)cc1 ZINC000820876939 607268582 /nfs/dbraw/zinc/26/85/82/607268582.db2.gz WVXJTZPLXVCXJB-LBPRGKRZSA-N -1 3 351.410 3.605 20 0 FHADHM Cc1c(NC(=O)[C@@H](C)CSc2ccccc2)cccc1-c1nnn[n-]1 ZINC000822061525 607267058 /nfs/dbraw/zinc/26/70/58/607267058.db2.gz OXPDBGIMPJRNLQ-LBPRGKRZSA-N -1 3 353.451 3.542 20 0 FHADHM Cc1c(NC(=O)[C@@H](C)CSc2ccccc2)cccc1-c1nn[n-]n1 ZINC000822061525 607267059 /nfs/dbraw/zinc/26/70/59/607267059.db2.gz OXPDBGIMPJRNLQ-LBPRGKRZSA-N -1 3 353.451 3.542 20 0 FHADHM Cc1c(NC(=O)CCCCC(=O)c2ccccc2)cccc1-c1nnn[n-]1 ZINC000822065728 607267088 /nfs/dbraw/zinc/26/70/88/607267088.db2.gz ASJRSOIHQYJWNS-UHFFFAOYSA-N -1 3 363.421 3.557 20 0 FHADHM Cc1c(NC(=O)CCCCC(=O)c2ccccc2)cccc1-c1nn[n-]n1 ZINC000822065728 607267089 /nfs/dbraw/zinc/26/70/89/607267089.db2.gz ASJRSOIHQYJWNS-UHFFFAOYSA-N -1 3 363.421 3.557 20 0 FHADHM Cc1c(Cl)cccc1NC(=S)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000822034461 599239358 /nfs/dbraw/zinc/23/93/58/599239358.db2.gz DSLFOSHGZOBCMU-NSHDSACASA-N -1 3 372.885 3.876 20 0 FHADHM Cc1c(Cl)cccc1NC(=S)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000822034461 599239359 /nfs/dbraw/zinc/23/93/59/599239359.db2.gz DSLFOSHGZOBCMU-NSHDSACASA-N -1 3 372.885 3.876 20 0 FHADHM Cc1sc(NC(=O)c2cc3cc(F)ccc3o2)c(-c2nnn[n-]2)c1C ZINC000737565025 599245997 /nfs/dbraw/zinc/24/59/97/599245997.db2.gz VALUHGSRWNHYOX-UHFFFAOYSA-N -1 3 357.370 3.683 20 0 FHADHM Cc1sc(NC(=O)c2cc3cc(F)ccc3o2)c(-c2nn[n-]n2)c1C ZINC000737565025 599245999 /nfs/dbraw/zinc/24/59/99/599245999.db2.gz VALUHGSRWNHYOX-UHFFFAOYSA-N -1 3 357.370 3.683 20 0 FHADHM COc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)/C=C\C1CCCCC1 ZINC000737027039 599246472 /nfs/dbraw/zinc/24/64/72/599246472.db2.gz XWVZRBDEQQIFIN-FPLPWBNLSA-N -1 3 362.817 3.571 20 0 FHADHM COc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)/C=C\C1CCCCC1 ZINC000737027039 599246474 /nfs/dbraw/zinc/24/64/74/599246474.db2.gz XWVZRBDEQQIFIN-FPLPWBNLSA-N -1 3 362.817 3.571 20 0 FHADHM CC(C)Oc1ccc(NC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000820164358 599253908 /nfs/dbraw/zinc/25/39/08/599253908.db2.gz IXAVXCBJMZIGKS-ZDUSSCGKSA-N -1 3 366.425 3.537 20 0 FHADHM CC(C)Oc1ccc(NC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000820164358 599253909 /nfs/dbraw/zinc/25/39/09/599253909.db2.gz IXAVXCBJMZIGKS-ZDUSSCGKSA-N -1 3 366.425 3.537 20 0 FHADHM Cc1c(NC(=O)N(C)Cc2cccc3ccccc32)cccc1-c1nnn[n-]1 ZINC000822075636 607282932 /nfs/dbraw/zinc/28/29/32/607282932.db2.gz GTKZJWPVWJJRLZ-UHFFFAOYSA-N -1 3 372.432 3.992 20 0 FHADHM Cc1c(NC(=O)N(C)Cc2cccc3ccccc32)cccc1-c1nn[n-]n1 ZINC000822075636 607282933 /nfs/dbraw/zinc/28/29/33/607282933.db2.gz GTKZJWPVWJJRLZ-UHFFFAOYSA-N -1 3 372.432 3.992 20 0 FHADHM Cc1c(CNC(=O)Nc2cccc(-c3nnn[n-]3)c2C)oc2ccccc12 ZINC000822105927 607280843 /nfs/dbraw/zinc/28/08/43/607280843.db2.gz YIRGNIWUJOFREB-UHFFFAOYSA-N -1 3 362.393 3.551 20 0 FHADHM Cc1c(CNC(=O)Nc2cccc(-c3nn[n-]n3)c2C)oc2ccccc12 ZINC000822105927 607280844 /nfs/dbraw/zinc/28/08/44/607280844.db2.gz YIRGNIWUJOFREB-UHFFFAOYSA-N -1 3 362.393 3.551 20 0 FHADHM Cc1c(NC(=O)N(C)Cc2ccc(F)cc2Cl)cccc1-c1nnn[n-]1 ZINC000822077096 607283077 /nfs/dbraw/zinc/28/30/77/607283077.db2.gz SZFVEUUDDVSOHT-UHFFFAOYSA-N -1 3 374.807 3.632 20 0 FHADHM Cc1c(NC(=O)N(C)Cc2ccc(F)cc2Cl)cccc1-c1nn[n-]n1 ZINC000822077096 607283078 /nfs/dbraw/zinc/28/30/78/607283078.db2.gz SZFVEUUDDVSOHT-UHFFFAOYSA-N -1 3 374.807 3.632 20 0 FHADHM Cc1c(NC(=O)N[C@H](C)Cc2ccccc2Cl)cccc1-c1nnn[n-]1 ZINC000822089876 607281701 /nfs/dbraw/zinc/28/17/01/607281701.db2.gz HXOSBKPVMILTNA-LLVKDONJSA-N -1 3 370.844 3.581 20 0 FHADHM Cc1c(NC(=O)N[C@H](C)Cc2ccccc2Cl)cccc1-c1nn[n-]n1 ZINC000822089876 607281702 /nfs/dbraw/zinc/28/17/02/607281702.db2.gz HXOSBKPVMILTNA-LLVKDONJSA-N -1 3 370.844 3.581 20 0 FHADHM CCCN(Cc1ccc(F)cc1)C(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000821109464 607286004 /nfs/dbraw/zinc/28/60/04/607286004.db2.gz JLKLWLCIPGQCJN-UHFFFAOYSA-N -1 3 368.416 3.758 20 0 FHADHM CCCN(Cc1ccc(F)cc1)C(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000821109464 607286005 /nfs/dbraw/zinc/28/60/05/607286005.db2.gz JLKLWLCIPGQCJN-UHFFFAOYSA-N -1 3 368.416 3.758 20 0 FHADHM CC[C@@H](c1ccncc1)N(CC)C(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000820945470 607291302 /nfs/dbraw/zinc/29/13/02/607291302.db2.gz ULTYTBVXNXPKMI-KRWDZBQOSA-N -1 3 365.441 3.575 20 0 FHADHM CC[C@@H](c1ccncc1)N(CC)C(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000820945470 607291303 /nfs/dbraw/zinc/29/13/03/607291303.db2.gz ULTYTBVXNXPKMI-KRWDZBQOSA-N -1 3 365.441 3.575 20 0 FHADHM Cc1c(NC(=O)C(C)(C)c2ccccc2Cl)cccc1-c1nnn[n-]1 ZINC000822059576 607297251 /nfs/dbraw/zinc/29/72/51/607297251.db2.gz CRSLZEAASQEQFH-UHFFFAOYSA-N -1 3 355.829 3.745 20 0 FHADHM Cc1c(NC(=O)C(C)(C)c2ccccc2Cl)cccc1-c1nn[n-]n1 ZINC000822059576 607297252 /nfs/dbraw/zinc/29/72/52/607297252.db2.gz CRSLZEAASQEQFH-UHFFFAOYSA-N -1 3 355.829 3.745 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NC(=O)N1C[C@H](C)CCC[C@@H]1C ZINC000820690217 599262777 /nfs/dbraw/zinc/26/27/77/599262777.db2.gz HSHSDUFBONGCDC-KGLIPLIRSA-N -1 3 372.473 3.696 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NC(=O)N1C[C@H](C)CCC[C@@H]1C ZINC000820690217 599262779 /nfs/dbraw/zinc/26/27/79/599262779.db2.gz HSHSDUFBONGCDC-KGLIPLIRSA-N -1 3 372.473 3.696 20 0 FHADHM Cc1ccc(NCc2cc(-c3nnn[n-]3)cs2)cc1Br ZINC000822254534 607311820 /nfs/dbraw/zinc/31/18/20/607311820.db2.gz MIUQHYCPWFYSQH-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM Cc1ccc(NCc2cc(-c3nn[n-]n3)cs2)cc1Br ZINC000822254534 607311821 /nfs/dbraw/zinc/31/18/21/607311821.db2.gz MIUQHYCPWFYSQH-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM CCSc1ccc(CC(=O)O[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000825675167 607778930 /nfs/dbraw/zinc/77/89/30/607778930.db2.gz YRACNHGFLVSJCE-ZDUSSCGKSA-N -1 3 368.462 3.826 20 0 FHADHM CCSc1ccc(CC(=O)O[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000825675167 607778931 /nfs/dbraw/zinc/77/89/31/607778931.db2.gz YRACNHGFLVSJCE-ZDUSSCGKSA-N -1 3 368.462 3.826 20 0 FHADHM CC1CCN(c2cccc(NCc3cc(-c4nnn[n-]4)cs3)c2)CC1 ZINC000820727065 607317361 /nfs/dbraw/zinc/31/73/61/607317361.db2.gz GHTYWALONTWTNX-UHFFFAOYSA-N -1 3 354.483 3.777 20 0 FHADHM CC1CCN(c2cccc(NCc3cc(-c4nn[n-]n4)cs3)c2)CC1 ZINC000820727065 607317362 /nfs/dbraw/zinc/31/73/62/607317362.db2.gz GHTYWALONTWTNX-UHFFFAOYSA-N -1 3 354.483 3.777 20 0 FHADHM CCc1nc2ccccc2c(C(=O)Nc2cccc(-c3nnn[n-]3)c2C)c1C ZINC000821510110 607320699 /nfs/dbraw/zinc/32/06/99/607320699.db2.gz WXXWCLYJSRVUNH-UHFFFAOYSA-N -1 3 372.432 3.846 20 0 FHADHM CCc1nc2ccccc2c(C(=O)Nc2cccc(-c3nn[n-]n3)c2C)c1C ZINC000821510110 607320700 /nfs/dbraw/zinc/32/07/00/607320700.db2.gz WXXWCLYJSRVUNH-UHFFFAOYSA-N -1 3 372.432 3.846 20 0 FHADHM Cc1ccc2cccc(NC(=O)N[C@@H](C)c3cccc(-c4nnn[n-]4)c3)c2n1 ZINC000822279591 599282548 /nfs/dbraw/zinc/28/25/48/599282548.db2.gz BQTJVEABOBOBFE-ZDUSSCGKSA-N -1 3 373.420 3.606 20 0 FHADHM Cc1ccc2cccc(NC(=O)N[C@@H](C)c3cccc(-c4nn[n-]n4)c3)c2n1 ZINC000822279591 599282550 /nfs/dbraw/zinc/28/25/50/599282550.db2.gz BQTJVEABOBOBFE-ZDUSSCGKSA-N -1 3 373.420 3.606 20 0 FHADHM CCc1ccc([C@@H]2CCCN2C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)o1 ZINC000736686013 599280360 /nfs/dbraw/zinc/28/03/60/599280360.db2.gz NOBANGARPQKSRL-HNNXBMFYSA-N -1 3 370.388 3.530 20 0 FHADHM CCc1ccc([C@@H]2CCCN2C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)o1 ZINC000736686013 599280362 /nfs/dbraw/zinc/28/03/62/599280362.db2.gz NOBANGARPQKSRL-HNNXBMFYSA-N -1 3 370.388 3.530 20 0 FHADHM C[C@H](Sc1nc2cc(Cl)cnc2[nH]1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736191049 599284651 /nfs/dbraw/zinc/28/46/51/599284651.db2.gz HFVZRKWCELSNQT-QMMMGPOBSA-N -1 3 357.830 3.645 20 0 FHADHM CC(C)[C@H]1CCCN1C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000820037815 599288356 /nfs/dbraw/zinc/28/83/56/599288356.db2.gz INZNHPZEXIZLGT-CYBMUJFWSA-N -1 3 368.363 3.538 20 0 FHADHM CC(C)[C@H]1CCCN1C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000820037815 599288358 /nfs/dbraw/zinc/28/83/58/599288358.db2.gz INZNHPZEXIZLGT-CYBMUJFWSA-N -1 3 368.363 3.538 20 0 FHADHM CCC1CCN(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)CC1 ZINC000820979184 599289409 /nfs/dbraw/zinc/28/94/09/599289409.db2.gz FZKKEZQWOJQOAT-UHFFFAOYSA-N -1 3 368.363 3.539 20 0 FHADHM CCC1CCN(C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)CC1 ZINC000820979184 599289410 /nfs/dbraw/zinc/28/94/10/599289410.db2.gz FZKKEZQWOJQOAT-UHFFFAOYSA-N -1 3 368.363 3.539 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H]2CSc3ccccc32)c1-c1nnn[n-]1 ZINC000736670748 599292418 /nfs/dbraw/zinc/29/24/18/599292418.db2.gz QGMWTKACVDFZIS-LBPRGKRZSA-N -1 3 371.491 3.627 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H]2CSc3ccccc32)c1-c1nn[n-]n1 ZINC000736670748 599292419 /nfs/dbraw/zinc/29/24/19/599292419.db2.gz QGMWTKACVDFZIS-LBPRGKRZSA-N -1 3 371.491 3.627 20 0 FHADHM C[C@H](NCc1cccc(C(=O)[O-])c1)c1ccc(OCc2nccn2C)cc1 ZINC000820148203 598192025 /nfs/dbraw/zinc/19/20/25/598192025.db2.gz MCLIADUOMBWWJO-HNNXBMFYSA-N -1 3 365.433 3.548 20 0 FHADHM Cc1c[nH]cc1C(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737219170 598232233 /nfs/dbraw/zinc/23/22/33/598232233.db2.gz QGPYKNRXCCSZFW-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM Cc1c[nH]cc1C(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737219170 598232235 /nfs/dbraw/zinc/23/22/35/598232235.db2.gz QGPYKNRXCCSZFW-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1NC[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000737641781 598242444 /nfs/dbraw/zinc/24/24/44/598242444.db2.gz YLEOOBXCIGGOHO-YJBOKZPZSA-N -1 3 353.401 3.586 20 0 FHADHM CN(C[C@H]1CCCO[C@H]1c1ccccc1)c1ccc(-c2nn[n-]n2)cc1F ZINC000736793384 598242904 /nfs/dbraw/zinc/24/29/04/598242904.db2.gz WSMNNXGJQYYJFY-APWZRJJASA-N -1 3 367.428 3.610 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1Oc1ccc(Nc2nccs2)cc1 ZINC000737032107 598245447 /nfs/dbraw/zinc/24/54/47/598245447.db2.gz JKNPPIJPFSIXEY-UHFFFAOYSA-N -1 3 366.406 3.868 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1Oc1ccc(Nc2nccs2)cc1 ZINC000737032107 598245449 /nfs/dbraw/zinc/24/54/49/598245449.db2.gz JKNPPIJPFSIXEY-UHFFFAOYSA-N -1 3 366.406 3.868 20 0 FHADHM COc1c(Cl)cc(NCc2ccc(-c3nnn[n-]3)cc2)cc1Cl ZINC000737027046 598249865 /nfs/dbraw/zinc/24/98/65/598249865.db2.gz YDRSDAAASQNBBR-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM COc1c(Cl)cc(NCc2ccc(-c3nn[n-]n3)cc2)cc1Cl ZINC000737027046 598249866 /nfs/dbraw/zinc/24/98/66/598249866.db2.gz YDRSDAAASQNBBR-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM CC(C)[C@@H](C)NC(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000735706786 598266517 /nfs/dbraw/zinc/26/65/17/598266517.db2.gz DHBKCIOFPZAGFG-CYBMUJFWSA-N -1 3 366.425 3.825 20 0 FHADHM CC(C)[C@@H](C)NC(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735706786 598266518 /nfs/dbraw/zinc/26/65/18/598266518.db2.gz DHBKCIOFPZAGFG-CYBMUJFWSA-N -1 3 366.425 3.825 20 0 FHADHM C[C@@H]1CCN(C(=O)Nc2cccc(Oc3ccc(-c4nnn[n-]4)cc3)c2)C1 ZINC000736278620 598267280 /nfs/dbraw/zinc/26/72/80/598267280.db2.gz SAYJSSCAFXTJLS-CYBMUJFWSA-N -1 3 364.409 3.533 20 0 FHADHM C[C@@H]1CCN(C(=O)Nc2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)C1 ZINC000736278620 598267288 /nfs/dbraw/zinc/26/72/88/598267288.db2.gz SAYJSSCAFXTJLS-CYBMUJFWSA-N -1 3 364.409 3.533 20 0 FHADHM CCN(CC)C(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736528820 598267303 /nfs/dbraw/zinc/26/73/03/598267303.db2.gz FCMPGZMAHHKKQA-UHFFFAOYSA-N -1 3 352.398 3.533 20 0 FHADHM CCN(CC)C(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736528820 598267305 /nfs/dbraw/zinc/26/73/05/598267305.db2.gz FCMPGZMAHHKKQA-UHFFFAOYSA-N -1 3 352.398 3.533 20 0 FHADHM CC[C@H](SCC(=O)Nc1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000736392798 598273099 /nfs/dbraw/zinc/27/30/99/598273099.db2.gz SIGGAFCUCRBJOW-INIZCTEOSA-N -1 3 353.451 3.690 20 0 FHADHM CC[C@H](SCC(=O)Nc1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000736392798 598273100 /nfs/dbraw/zinc/27/31/00/598273100.db2.gz SIGGAFCUCRBJOW-INIZCTEOSA-N -1 3 353.451 3.690 20 0 FHADHM COCc1ccccc1CNc1ccc(-c2nn[n-]n2)cc1C(F)(F)F ZINC000737022494 598275197 /nfs/dbraw/zinc/27/51/97/598275197.db2.gz USBSOFCEFCPFMA-UHFFFAOYSA-N -1 3 363.343 3.644 20 0 FHADHM CC[C@H](CC(=O)Oc1c(Cl)cc(-c2nnn[n-]2)cc1OC)C(C)C ZINC000736333545 598277877 /nfs/dbraw/zinc/27/78/77/598277877.db2.gz AOANOKWJWLKRNQ-SNVBAGLBSA-N -1 3 352.822 3.506 20 0 FHADHM CC[C@H](CC(=O)Oc1c(Cl)cc(-c2nn[n-]n2)cc1OC)C(C)C ZINC000736333545 598277878 /nfs/dbraw/zinc/27/78/78/598277878.db2.gz AOANOKWJWLKRNQ-SNVBAGLBSA-N -1 3 352.822 3.506 20 0 FHADHM O=C(CCSc1cccc(Cl)c1)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000575484670 598293709 /nfs/dbraw/zinc/29/37/09/598293709.db2.gz PRDIOWHHCITMGM-UHFFFAOYSA-N -1 3 359.842 3.641 20 0 FHADHM O=C(CCSc1cccc(Cl)c1)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000575484670 598293710 /nfs/dbraw/zinc/29/37/10/598293710.db2.gz PRDIOWHHCITMGM-UHFFFAOYSA-N -1 3 359.842 3.641 20 0 FHADHM O=C(O[C@H](c1ccccc1)c1cccc(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000738216046 598307754 /nfs/dbraw/zinc/30/77/54/598307754.db2.gz VNMVAONIHLXARO-LJQANCHMSA-N -1 3 374.375 3.952 20 0 FHADHM O=C(O[C@H](c1ccccc1)c1cccc(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000738216046 598307755 /nfs/dbraw/zinc/30/77/55/598307755.db2.gz VNMVAONIHLXARO-LJQANCHMSA-N -1 3 374.375 3.952 20 0 FHADHM Fc1cccc(-n2ccc(CSCc3ccccc3-c3nnn[n-]3)n2)c1 ZINC000737664786 598313813 /nfs/dbraw/zinc/31/38/13/598313813.db2.gz DOGNSBWDOKEARX-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM Fc1cccc(-n2ccc(CSCc3ccccc3-c3nn[n-]n3)n2)c1 ZINC000737664786 598313815 /nfs/dbraw/zinc/31/38/15/598313815.db2.gz DOGNSBWDOKEARX-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM Fc1ccccc1-c1ccc(CNCc2ccc(-c3nnn[n-]3)cc2F)o1 ZINC000737639366 598314947 /nfs/dbraw/zinc/31/49/47/598314947.db2.gz PRUMPNVVXZRJOK-UHFFFAOYSA-N -1 3 367.359 3.695 20 0 FHADHM Fc1ccccc1-c1ccc(CNCc2ccc(-c3nn[n-]n3)cc2F)o1 ZINC000737639366 598314949 /nfs/dbraw/zinc/31/49/49/598314949.db2.gz PRUMPNVVXZRJOK-UHFFFAOYSA-N -1 3 367.359 3.695 20 0 FHADHM Cc1cc(F)ccc1C(=O)Nc1sc2c(c1-c1nnn[n-]1)CC[C@@H](C)C2 ZINC000822205615 607349739 /nfs/dbraw/zinc/34/97/39/607349739.db2.gz AINPHBSYFRAQFB-SECBINFHSA-N -1 3 371.441 3.753 20 0 FHADHM Cc1cc(F)ccc1C(=O)Nc1sc2c(c1-c1nn[n-]n1)CC[C@@H](C)C2 ZINC000822205615 607349741 /nfs/dbraw/zinc/34/97/41/607349741.db2.gz AINPHBSYFRAQFB-SECBINFHSA-N -1 3 371.441 3.753 20 0 FHADHM CC1CCC(N(C)C(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)CC1 ZINC000736241446 598318156 /nfs/dbraw/zinc/31/81/56/598318156.db2.gz NPVNFMGAHRFBCV-UHFFFAOYSA-N -1 3 364.906 3.727 20 0 FHADHM CC1CCC(N(C)C(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)CC1 ZINC000736241446 598318158 /nfs/dbraw/zinc/31/81/58/598318158.db2.gz NPVNFMGAHRFBCV-UHFFFAOYSA-N -1 3 364.906 3.727 20 0 FHADHM S=C(Nc1ccc(Cl)cc1)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000738409029 598318197 /nfs/dbraw/zinc/31/81/97/598318197.db2.gz OLNQPGKJEGBDJF-UHFFFAOYSA-N -1 3 365.249 3.982 20 0 FHADHM S=C(Nc1ccc(Cl)cc1)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000738409029 598318199 /nfs/dbraw/zinc/31/81/99/598318199.db2.gz OLNQPGKJEGBDJF-UHFFFAOYSA-N -1 3 365.249 3.982 20 0 FHADHM C[C@@H]1CCC[C@H](N(C)C(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)C1 ZINC000736247112 598318624 /nfs/dbraw/zinc/31/86/24/598318624.db2.gz AALYXPLVBKMRAZ-PWSUYJOCSA-N -1 3 364.906 3.727 20 0 FHADHM C[C@@H]1CCC[C@H](N(C)C(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)C1 ZINC000736247112 598318626 /nfs/dbraw/zinc/31/86/26/598318626.db2.gz AALYXPLVBKMRAZ-PWSUYJOCSA-N -1 3 364.906 3.727 20 0 FHADHM C[C@H](c1ccco1)N(C)C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736203416 598323918 /nfs/dbraw/zinc/32/39/18/598323918.db2.gz NRJYINLQTDYMPE-SECBINFHSA-N -1 3 362.846 3.503 20 0 FHADHM C[C@H](c1ccco1)N(C)C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736203416 598323920 /nfs/dbraw/zinc/32/39/20/598323920.db2.gz NRJYINLQTDYMPE-SECBINFHSA-N -1 3 362.846 3.503 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1ccc(C(F)F)cc1 ZINC000735873168 598326648 /nfs/dbraw/zinc/32/66/48/598326648.db2.gz AODILJOWKFOSFV-UHFFFAOYSA-N -1 3 371.391 3.855 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1ccc(C(F)F)cc1 ZINC000735873168 598326649 /nfs/dbraw/zinc/32/66/49/598326649.db2.gz AODILJOWKFOSFV-UHFFFAOYSA-N -1 3 371.391 3.855 20 0 FHADHM CCN(C(=O)c1csc(C(C)C)n1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736508841 598327664 /nfs/dbraw/zinc/32/76/64/598327664.db2.gz OSLOBQJUDSDSKO-GFCCVEGCSA-N -1 3 370.482 3.670 20 0 FHADHM CCN(C(=O)c1csc(C(C)C)n1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736508841 598327665 /nfs/dbraw/zinc/32/76/65/598327665.db2.gz OSLOBQJUDSDSKO-GFCCVEGCSA-N -1 3 370.482 3.670 20 0 FHADHM CCN(Cc1ccoc1)C(=O)c1ccccc1-c1ccccc1-c1nnn[n-]1 ZINC000736556787 598327825 /nfs/dbraw/zinc/32/78/25/598327825.db2.gz UJHPGRNHVXSSCS-UHFFFAOYSA-N -1 3 373.416 3.789 20 0 FHADHM CCN(Cc1ccoc1)C(=O)c1ccccc1-c1ccccc1-c1nn[n-]n1 ZINC000736556787 598327827 /nfs/dbraw/zinc/32/78/27/598327827.db2.gz UJHPGRNHVXSSCS-UHFFFAOYSA-N -1 3 373.416 3.789 20 0 FHADHM c1ccc2c(c1)CSC(SCCOc1ccc(-c3nn[n-]n3)cc1)=N2 ZINC000738443594 598357974 /nfs/dbraw/zinc/35/79/74/598357974.db2.gz YNLNDUQOKLFABL-UHFFFAOYSA-N -1 3 369.475 3.913 20 0 FHADHM C[C@H](NC(=O)N1CCC2(CCCCC2)CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736113444 598358012 /nfs/dbraw/zinc/35/80/12/598358012.db2.gz NXSGHVSVKDWTAK-HNNXBMFYSA-N -1 3 368.485 3.684 20 0 FHADHM C[C@H](NC(=O)N1CCC2(CCCCC2)CC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736113444 598358013 /nfs/dbraw/zinc/35/80/13/598358013.db2.gz NXSGHVSVKDWTAK-HNNXBMFYSA-N -1 3 368.485 3.684 20 0 FHADHM c1ccc(-c2nnc(SCc3cccc(-c4nnn[n-]4)c3)s2)cc1 ZINC000738424129 598360223 /nfs/dbraw/zinc/36/02/23/598360223.db2.gz WJCXRGSAXIGFIN-UHFFFAOYSA-N -1 3 352.448 3.678 20 0 FHADHM c1ccc(-c2nnc(SCc3cccc(-c4nn[n-]n4)c3)s2)cc1 ZINC000738424129 598360225 /nfs/dbraw/zinc/36/02/25/598360225.db2.gz WJCXRGSAXIGFIN-UHFFFAOYSA-N -1 3 352.448 3.678 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)C[C@@H](C)c2ccccc2F)s1 ZINC000736678444 598365068 /nfs/dbraw/zinc/36/50/68/598365068.db2.gz CPKNGHNBSQRFQD-SNVBAGLBSA-N -1 3 359.430 3.762 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)C[C@@H](C)c2ccccc2F)s1 ZINC000736678444 598365070 /nfs/dbraw/zinc/36/50/70/598365070.db2.gz CPKNGHNBSQRFQD-SNVBAGLBSA-N -1 3 359.430 3.762 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)C[C@H](C)c2ccccc2F)s1 ZINC000736678443 598365233 /nfs/dbraw/zinc/36/52/33/598365233.db2.gz CPKNGHNBSQRFQD-JTQLQIEISA-N -1 3 359.430 3.762 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)C[C@H](C)c2ccccc2F)s1 ZINC000736678443 598365235 /nfs/dbraw/zinc/36/52/35/598365235.db2.gz CPKNGHNBSQRFQD-JTQLQIEISA-N -1 3 359.430 3.762 20 0 FHADHM CC(C)c1ccc(OCCNc2ncc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000735928344 598390980 /nfs/dbraw/zinc/39/09/80/598390980.db2.gz JNSORVDEKFDYGA-UHFFFAOYSA-N -1 3 358.833 3.529 20 0 FHADHM CC(C)c1ccc(OCCNc2ncc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000735928344 598390982 /nfs/dbraw/zinc/39/09/82/598390982.db2.gz JNSORVDEKFDYGA-UHFFFAOYSA-N -1 3 358.833 3.529 20 0 FHADHM CC1(C)CCN(c2c(-c3nnn[n-]3)cnc3ccc(OC(F)F)cc32)CC1 ZINC000736210316 598394224 /nfs/dbraw/zinc/39/42/24/598394224.db2.gz DCXGPMVFIOTLDM-UHFFFAOYSA-N -1 3 374.395 3.643 20 0 FHADHM CC1(C)CCN(c2c(-c3nn[n-]n3)cnc3ccc(OC(F)F)cc32)CC1 ZINC000736210316 598394226 /nfs/dbraw/zinc/39/42/26/598394226.db2.gz DCXGPMVFIOTLDM-UHFFFAOYSA-N -1 3 374.395 3.643 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1OCc1csc(Br)c1 ZINC000737222470 598395197 /nfs/dbraw/zinc/39/51/97/598395197.db2.gz ZWLPRNCMPCCDGZ-UHFFFAOYSA-N -1 3 351.229 3.578 20 0 FHADHM CSc1cccc(NC(=O)[C@@H](C)Sc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737190963 598414427 /nfs/dbraw/zinc/41/44/27/598414427.db2.gz KPGCEXUMGUZONB-LLVKDONJSA-N -1 3 371.491 3.708 20 0 FHADHM CSc1cccc(NC(=O)[C@@H](C)Sc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737190963 598414428 /nfs/dbraw/zinc/41/44/28/598414428.db2.gz KPGCEXUMGUZONB-LLVKDONJSA-N -1 3 371.491 3.708 20 0 FHADHM Cc1ccc(F)c(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CC[C@@H](C)C3)c1 ZINC000737344829 598414685 /nfs/dbraw/zinc/41/46/85/598414685.db2.gz KYFXWSJNYPXIQS-SNVBAGLBSA-N -1 3 371.441 3.753 20 0 FHADHM Cc1ccc(F)c(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CC[C@@H](C)C3)c1 ZINC000737344829 598414687 /nfs/dbraw/zinc/41/46/87/598414687.db2.gz KYFXWSJNYPXIQS-SNVBAGLBSA-N -1 3 371.441 3.753 20 0 FHADHM Cc1ccc(NC(=O)[C@@H](C)Sc2ccc(-c3nnn[n-]3)cc2)c(Cl)c1 ZINC000737357395 598414850 /nfs/dbraw/zinc/41/48/50/598414850.db2.gz YMYURKDXKWUORJ-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM Cc1ccc(NC(=O)[C@@H](C)Sc2ccc(-c3nn[n-]n3)cc2)c(Cl)c1 ZINC000737357395 598414851 /nfs/dbraw/zinc/41/48/51/598414851.db2.gz YMYURKDXKWUORJ-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM CSc1ccc(NC(=O)[C@H](C)Sc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000737191598 598417477 /nfs/dbraw/zinc/41/74/77/598417477.db2.gz SILCJANUBYFRLT-NSHDSACASA-N -1 3 371.491 3.708 20 0 FHADHM CSc1ccc(NC(=O)[C@H](C)Sc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000737191598 598417479 /nfs/dbraw/zinc/41/74/79/598417479.db2.gz SILCJANUBYFRLT-NSHDSACASA-N -1 3 371.491 3.708 20 0 FHADHM CSc1ccsc1C(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C(C)C ZINC000737192579 598421093 /nfs/dbraw/zinc/42/10/93/598421093.db2.gz UKWKGDMHKCXOHZ-UHFFFAOYSA-N -1 3 373.507 3.701 20 0 FHADHM CSc1ccsc1C(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C(C)C ZINC000737192579 598421095 /nfs/dbraw/zinc/42/10/95/598421095.db2.gz UKWKGDMHKCXOHZ-UHFFFAOYSA-N -1 3 373.507 3.701 20 0 FHADHM CCc1ccc(NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)cc1 ZINC000736691514 598426320 /nfs/dbraw/zinc/42/63/20/598426320.db2.gz OXPGCRZJMPADBC-UHFFFAOYSA-N -1 3 364.453 3.872 20 0 FHADHM CCc1ccc(NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)cc1 ZINC000736691514 598426323 /nfs/dbraw/zinc/42/63/23/598426323.db2.gz OXPGCRZJMPADBC-UHFFFAOYSA-N -1 3 364.453 3.872 20 0 FHADHM Cc1ccc(NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)cc1F ZINC000737358086 598426608 /nfs/dbraw/zinc/42/66/08/598426608.db2.gz XIOHEXJMFDRZDT-UHFFFAOYSA-N -1 3 368.416 3.757 20 0 FHADHM Cc1ccc(NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)cc1F ZINC000737358086 598426610 /nfs/dbraw/zinc/42/66/10/598426610.db2.gz XIOHEXJMFDRZDT-UHFFFAOYSA-N -1 3 368.416 3.757 20 0 FHADHM C[C@@H](NC(=O)Nc1cccc(-c2nnn[n-]2)c1)c1cc2ccccc2s1 ZINC000736117470 598428713 /nfs/dbraw/zinc/42/87/13/598428713.db2.gz PMWFHFZPOFNESC-LLVKDONJSA-N -1 3 364.434 3.964 20 0 FHADHM C[C@@H](NC(=O)Nc1cccc(-c2nn[n-]n2)c1)c1cc2ccccc2s1 ZINC000736117470 598428714 /nfs/dbraw/zinc/42/87/14/598428714.db2.gz PMWFHFZPOFNESC-LLVKDONJSA-N -1 3 364.434 3.964 20 0 FHADHM CC[C@H]1CCCC[C@H]1NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C(C)C ZINC000736399621 598429770 /nfs/dbraw/zinc/42/97/70/598429770.db2.gz JDBSSDHOKWRBAL-FUHWJXTLSA-N -1 3 370.501 3.756 20 0 FHADHM CC[C@H]1CCCC[C@H]1NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C(C)C ZINC000736399621 598429772 /nfs/dbraw/zinc/42/97/72/598429772.db2.gz JDBSSDHOKWRBAL-FUHWJXTLSA-N -1 3 370.501 3.756 20 0 FHADHM Cc1cc(C)cc([C@@H](C)NC(=O)N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737253963 598430374 /nfs/dbraw/zinc/43/03/74/598430374.db2.gz VKOQRFVRHLUPPZ-LSDHHAIUSA-N -1 3 364.453 3.605 20 0 FHADHM Cc1cc(C)cc([C@@H](C)NC(=O)N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737253963 598430377 /nfs/dbraw/zinc/43/03/77/598430377.db2.gz VKOQRFVRHLUPPZ-LSDHHAIUSA-N -1 3 364.453 3.605 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)N1CCCc2sccc2C1 ZINC000738150908 598432270 /nfs/dbraw/zinc/43/22/70/598432270.db2.gz CVOSYEOLALGSIA-UHFFFAOYSA-N -1 3 374.857 3.562 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)N1CCCc2sccc2C1 ZINC000738150908 598432272 /nfs/dbraw/zinc/43/22/72/598432272.db2.gz CVOSYEOLALGSIA-UHFFFAOYSA-N -1 3 374.857 3.562 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)[C@@H]1C[C@@H]1c1cccc2ccccc21 ZINC000107583954 598435276 /nfs/dbraw/zinc/43/52/76/598435276.db2.gz JRIDAOCVIGCARV-RTBURBONSA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)[C@@H]1C[C@@H]1c1cccc2ccccc21 ZINC000107583954 598435278 /nfs/dbraw/zinc/43/52/78/598435278.db2.gz JRIDAOCVIGCARV-RTBURBONSA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Oc1ccc(-c2nnn[n-]2)cc1)[C@H]1C[C@H]1c1cccc2ccccc21 ZINC000738251891 598436244 /nfs/dbraw/zinc/43/62/44/598436244.db2.gz STUHRMLDURRKSZ-OALUTQOASA-N -1 3 356.385 3.729 20 0 FHADHM O=C(Oc1ccc(-c2nn[n-]n2)cc1)[C@H]1C[C@H]1c1cccc2ccccc21 ZINC000738251891 598436246 /nfs/dbraw/zinc/43/62/46/598436246.db2.gz STUHRMLDURRKSZ-OALUTQOASA-N -1 3 356.385 3.729 20 0 FHADHM O=C(Nc1sccc1-c1nnn[n-]1)[C@H]1C[C@@H]1c1cccc2ccccc21 ZINC000738208293 598437570 /nfs/dbraw/zinc/43/75/70/598437570.db2.gz LIMMSVFEQWVMMS-CVEARBPZSA-N -1 3 361.430 3.824 20 0 FHADHM O=C(Nc1sccc1-c1nn[n-]n1)[C@H]1C[C@@H]1c1cccc2ccccc21 ZINC000738208293 598437572 /nfs/dbraw/zinc/43/75/72/598437572.db2.gz LIMMSVFEQWVMMS-CVEARBPZSA-N -1 3 361.430 3.824 20 0 FHADHM Cc1ccccc1-c1nc(C(=O)Oc2ccc(-c3nnn[n-]3)cc2)cs1 ZINC000737416434 598441890 /nfs/dbraw/zinc/44/18/90/598441890.db2.gz ADJCECPTCOCCRT-UHFFFAOYSA-N -1 3 363.402 3.518 20 0 FHADHM Cc1ccccc1-c1nc(C(=O)Oc2ccc(-c3nn[n-]n3)cc2)cs1 ZINC000737416434 598441892 /nfs/dbraw/zinc/44/18/92/598441892.db2.gz ADJCECPTCOCCRT-UHFFFAOYSA-N -1 3 363.402 3.518 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)Nc1cccc(SC(F)F)c1 ZINC000737803693 598450783 /nfs/dbraw/zinc/45/07/83/598450783.db2.gz VPILFPPSEHOYIA-HJWRWDBZSA-N -1 3 373.388 3.833 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)Nc1cccc(SC(F)F)c1 ZINC000737803693 598450785 /nfs/dbraw/zinc/45/07/85/598450785.db2.gz VPILFPPSEHOYIA-HJWRWDBZSA-N -1 3 373.388 3.833 20 0 FHADHM CC(=CC(=O)OCc1cccc(-c2nnn[n-]2)c1)c1ccccc1Cl ZINC000735448103 598473848 /nfs/dbraw/zinc/47/38/48/598473848.db2.gz OTWBXSWOULUGEB-FMIVXFBMSA-N -1 3 354.797 3.667 20 0 FHADHM CC(=CC(=O)OCc1cccc(-c2nn[n-]n2)c1)c1ccccc1Cl ZINC000735448103 598473849 /nfs/dbraw/zinc/47/38/49/598473849.db2.gz OTWBXSWOULUGEB-FMIVXFBMSA-N -1 3 354.797 3.667 20 0 FHADHM CC[C@](C)(NC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccccc1 ZINC000736314014 598483862 /nfs/dbraw/zinc/48/38/62/598483862.db2.gz HXJQMVZKUDJFFK-SFHVURJKSA-N -1 3 370.844 3.967 20 0 FHADHM CC[C@](C)(NC(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccccc1 ZINC000736314014 598483861 /nfs/dbraw/zinc/48/38/61/598483861.db2.gz HXJQMVZKUDJFFK-SFHVURJKSA-N -1 3 370.844 3.967 20 0 FHADHM CCN(Cc1nc(C)c2ccccc2n1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736555709 598486823 /nfs/dbraw/zinc/48/68/23/598486823.db2.gz JRBPNLUYSVQMEV-OAHLLOKOSA-N -1 3 373.464 3.701 20 0 FHADHM Cc1[nH]c2ccccc2c1CC(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000737200474 598488453 /nfs/dbraw/zinc/48/84/53/598488453.db2.gz UPBFSNDZYZMPFJ-ZDUSSCGKSA-N -1 3 361.405 3.503 20 0 FHADHM Cc1[nH]c2ccccc2c1CC(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000737200474 598488455 /nfs/dbraw/zinc/48/84/55/598488455.db2.gz UPBFSNDZYZMPFJ-ZDUSSCGKSA-N -1 3 361.405 3.503 20 0 FHADHM CSc1ccc(C)c(C(=O)O[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000737193485 598489582 /nfs/dbraw/zinc/48/95/82/598489582.db2.gz SXBMWRCWXLQINS-LBPRGKRZSA-N -1 3 354.435 3.815 20 0 FHADHM CSc1ccc(C)c(C(=O)O[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000737193485 598489585 /nfs/dbraw/zinc/48/95/85/598489585.db2.gz SXBMWRCWXLQINS-LBPRGKRZSA-N -1 3 354.435 3.815 20 0 FHADHM Cc1ccc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCC3)cc1F ZINC000737316148 598493381 /nfs/dbraw/zinc/49/33/81/598493381.db2.gz URKTWBIIEZORTA-UHFFFAOYSA-N -1 3 357.414 3.507 20 0 FHADHM Cc1ccc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCC3)cc1F ZINC000737316148 598493382 /nfs/dbraw/zinc/49/33/82/598493382.db2.gz URKTWBIIEZORTA-UHFFFAOYSA-N -1 3 357.414 3.507 20 0 FHADHM Cc1sc(NC(=O)C[C@@H]2CCCc3ccccc32)c(-c2nnn[n-]2)c1C ZINC000737564869 598493858 /nfs/dbraw/zinc/49/38/58/598493858.db2.gz XWOCXYBSXOGOHB-AWEZNQCLSA-N -1 3 367.478 3.994 20 0 FHADHM Cc1sc(NC(=O)C[C@@H]2CCCc3ccccc32)c(-c2nn[n-]n2)c1C ZINC000737564869 598493860 /nfs/dbraw/zinc/49/38/60/598493860.db2.gz XWOCXYBSXOGOHB-AWEZNQCLSA-N -1 3 367.478 3.994 20 0 FHADHM Cc1ccc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCCC3)cc1F ZINC000737314817 598495108 /nfs/dbraw/zinc/49/51/08/598495108.db2.gz ILIDWNQYCNCRIP-UHFFFAOYSA-N -1 3 371.441 3.897 20 0 FHADHM Cc1ccc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCCC3)cc1F ZINC000737314817 598495109 /nfs/dbraw/zinc/49/51/09/598495109.db2.gz ILIDWNQYCNCRIP-UHFFFAOYSA-N -1 3 371.441 3.897 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@H](C)c2ccc(CC)cc2)s1 ZINC000736685577 598498024 /nfs/dbraw/zinc/49/80/24/598498024.db2.gz GXVRZESJAGZCPT-LLVKDONJSA-N -1 3 355.467 3.795 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@H](C)c2ccc(CC)cc2)s1 ZINC000736685577 598498025 /nfs/dbraw/zinc/49/80/25/598498025.db2.gz GXVRZESJAGZCPT-LLVKDONJSA-N -1 3 355.467 3.795 20 0 FHADHM Fc1cccc(Oc2ccccc2CNc2ncccc2-c2nnn[n-]2)c1 ZINC000737664890 598504425 /nfs/dbraw/zinc/50/44/25/598504425.db2.gz PUKLEWZHTTYMRV-UHFFFAOYSA-N -1 3 362.368 3.805 20 0 FHADHM Fc1cccc(Oc2ccccc2CNc2ncccc2-c2nn[n-]n2)c1 ZINC000737664890 598504426 /nfs/dbraw/zinc/50/44/26/598504426.db2.gz PUKLEWZHTTYMRV-UHFFFAOYSA-N -1 3 362.368 3.805 20 0 FHADHM CCc1c(C)sc(NC(=O)CSCCC(C)C)c1-c1nnn[n-]1 ZINC000736677010 598514226 /nfs/dbraw/zinc/51/42/26/598514226.db2.gz XXDZGRATPCRQNM-UHFFFAOYSA-N -1 3 353.517 3.517 20 0 FHADHM CCc1c(C)sc(NC(=O)CSCCC(C)C)c1-c1nn[n-]n1 ZINC000736677010 598514227 /nfs/dbraw/zinc/51/42/27/598514227.db2.gz XXDZGRATPCRQNM-UHFFFAOYSA-N -1 3 353.517 3.517 20 0 FHADHM CCc1c(C)sc(NC(=O)C23CC4CC(CC(C4)C2)C3)c1-c1nnn[n-]1 ZINC000736669325 598518517 /nfs/dbraw/zinc/51/85/17/598518517.db2.gz DNLYBDMEZRUEQM-UHFFFAOYSA-N -1 3 371.510 3.954 20 0 FHADHM CCc1c(C)sc(NC(=O)C23CC4CC(CC(C4)C2)C3)c1-c1nn[n-]n1 ZINC000736669325 598518518 /nfs/dbraw/zinc/51/85/18/598518518.db2.gz DNLYBDMEZRUEQM-UHFFFAOYSA-N -1 3 371.510 3.954 20 0 FHADHM CCc1c(C)sc(NC(=O)CSc2ccc(C)cc2)c1-c1nnn[n-]1 ZINC000736676975 598519230 /nfs/dbraw/zinc/51/92/30/598519230.db2.gz XLVNWUDPIVDFHC-UHFFFAOYSA-N -1 3 373.507 3.838 20 0 FHADHM CCc1c(C)sc(NC(=O)CSc2ccc(C)cc2)c1-c1nn[n-]n1 ZINC000736676975 598519231 /nfs/dbraw/zinc/51/92/31/598519231.db2.gz XLVNWUDPIVDFHC-UHFFFAOYSA-N -1 3 373.507 3.838 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)[C@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000108769627 598532734 /nfs/dbraw/zinc/53/27/34/598532734.db2.gz PIKBQMYOZGOYDN-MOPGFXCFSA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)[C@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000108769627 598532737 /nfs/dbraw/zinc/53/27/37/598532737.db2.gz PIKBQMYOZGOYDN-MOPGFXCFSA-N -1 3 355.401 3.762 20 0 FHADHM CC1(CNC(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)CCCC1 ZINC000736217619 598534647 /nfs/dbraw/zinc/53/46/47/598534647.db2.gz ZBYPIBPYUQPXBE-UHFFFAOYSA-N -1 3 361.449 3.844 20 0 FHADHM CC1(CNC(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)CCCC1 ZINC000736217619 598534648 /nfs/dbraw/zinc/53/46/48/598534648.db2.gz ZBYPIBPYUQPXBE-UHFFFAOYSA-N -1 3 361.449 3.844 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)NCC1(C)CCCC1 ZINC000735830505 598541641 /nfs/dbraw/zinc/54/16/41/598541641.db2.gz HIIRJMQLKWWSOS-UHFFFAOYSA-N -1 3 370.501 3.615 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)NCC1(C)CCCC1 ZINC000735830505 598541643 /nfs/dbraw/zinc/54/16/43/598541643.db2.gz HIIRJMQLKWWSOS-UHFFFAOYSA-N -1 3 370.501 3.615 20 0 FHADHM C[C@@H]1CCC[C@H](CC(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(F)F)C1 ZINC000736247185 598543347 /nfs/dbraw/zinc/54/33/47/598543347.db2.gz AZHDAALLUXKNMO-MNOVXSKESA-N -1 3 365.384 3.623 20 0 FHADHM C[C@@H]1CCC[C@H](CC(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(F)F)C1 ZINC000736247185 598543350 /nfs/dbraw/zinc/54/33/50/598543350.db2.gz AZHDAALLUXKNMO-MNOVXSKESA-N -1 3 365.384 3.623 20 0 FHADHM CC(=CC(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(F)F)c1ccccc1 ZINC000735449452 598544756 /nfs/dbraw/zinc/54/47/56/598544756.db2.gz YOKMJNIBZDTAJF-PKNBQFBNSA-N -1 3 371.347 3.510 20 0 FHADHM CC(=CC(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(F)F)c1ccccc1 ZINC000735449452 598544757 /nfs/dbraw/zinc/54/47/57/598544757.db2.gz YOKMJNIBZDTAJF-PKNBQFBNSA-N -1 3 371.347 3.510 20 0 FHADHM Fc1cc(OCc2csc(Nc3ccccc3)n2)ccc1-c1nnn[n-]1 ZINC000737654043 598547909 /nfs/dbraw/zinc/54/79/09/598547909.db2.gz XDTWLMKTWGIYMR-UHFFFAOYSA-N -1 3 368.397 3.785 20 0 FHADHM Fc1cc(OCc2csc(Nc3ccccc3)n2)ccc1-c1nn[n-]n1 ZINC000737654043 598547910 /nfs/dbraw/zinc/54/79/10/598547910.db2.gz XDTWLMKTWGIYMR-UHFFFAOYSA-N -1 3 368.397 3.785 20 0 FHADHM c1csc(Nc2ccc(OCc3cccc(-c4nnn[n-]4)c3)cc2)n1 ZINC000738412212 598551707 /nfs/dbraw/zinc/55/17/07/598551707.db2.gz CNDQOYZAVMWXJL-UHFFFAOYSA-N -1 3 350.407 3.646 20 0 FHADHM c1csc(Nc2ccc(OCc3cccc(-c4nn[n-]n4)c3)cc2)n1 ZINC000738412212 598551709 /nfs/dbraw/zinc/55/17/09/598551709.db2.gz CNDQOYZAVMWXJL-UHFFFAOYSA-N -1 3 350.407 3.646 20 0 FHADHM CCN(C(=O)[C@@H](C)c1ccccc1F)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736503224 598552865 /nfs/dbraw/zinc/55/28/65/598552865.db2.gz UEHLLJAPMUIQNU-KBPBESRZSA-N -1 3 367.428 3.719 20 0 FHADHM CCN(C(=O)[C@@H](C)c1ccccc1F)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736503224 598552866 /nfs/dbraw/zinc/55/28/66/598552866.db2.gz UEHLLJAPMUIQNU-KBPBESRZSA-N -1 3 367.428 3.719 20 0 FHADHM CSC[C@@H](C)C(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737180118 598553656 /nfs/dbraw/zinc/55/36/56/598553656.db2.gz PELQMPWYDNSEJX-GFCCVEGCSA-N -1 3 369.450 3.597 20 0 FHADHM CSC[C@@H](C)C(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737180118 598553657 /nfs/dbraw/zinc/55/36/57/598553657.db2.gz PELQMPWYDNSEJX-GFCCVEGCSA-N -1 3 369.450 3.597 20 0 FHADHM O=C(C[C@H]1C=CCC1)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000737814364 598555170 /nfs/dbraw/zinc/55/51/70/598555170.db2.gz NICSFFVCTVRCHX-AWEZNQCLSA-N -1 3 361.405 3.954 20 0 FHADHM O=C(C[C@H]1C=CCC1)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000737814364 598555172 /nfs/dbraw/zinc/55/51/72/598555172.db2.gz NICSFFVCTVRCHX-AWEZNQCLSA-N -1 3 361.405 3.954 20 0 FHADHM Cc1cccc(C(=O)Nc2ccc(Oc3cccc(-c4nnn[n-]4)c3)cc2)n1 ZINC000737383888 598555200 /nfs/dbraw/zinc/55/52/00/598555200.db2.gz FPDRXCUZGOGZDI-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1cccc(C(=O)Nc2ccc(Oc3cccc(-c4nn[n-]n4)c3)cc2)n1 ZINC000737383888 598555202 /nfs/dbraw/zinc/55/52/02/598555202.db2.gz FPDRXCUZGOGZDI-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM CC[C@H](C)NC(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736323964 598565039 /nfs/dbraw/zinc/56/50/39/598565039.db2.gz FVCXPZHFGZVOMF-LBPRGKRZSA-N -1 3 352.398 3.579 20 0 FHADHM CC[C@H](C)NC(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736323964 598565041 /nfs/dbraw/zinc/56/50/41/598565041.db2.gz FVCXPZHFGZVOMF-LBPRGKRZSA-N -1 3 352.398 3.579 20 0 FHADHM CCC[C@@H](C)NC(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736426115 598565397 /nfs/dbraw/zinc/56/53/97/598565397.db2.gz XMEZHYQBJIQUOH-CYBMUJFWSA-N -1 3 366.425 3.969 20 0 FHADHM CCC[C@@H](C)NC(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736426115 598565398 /nfs/dbraw/zinc/56/53/98/598565398.db2.gz XMEZHYQBJIQUOH-CYBMUJFWSA-N -1 3 366.425 3.969 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)CCCCCc1cccs1 ZINC000737292059 598568385 /nfs/dbraw/zinc/56/83/85/598568385.db2.gz QWRGQTPMARSUPR-UHFFFAOYSA-N -1 3 355.467 3.978 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)CCCCCc1cccs1 ZINC000737292059 598568384 /nfs/dbraw/zinc/56/83/84/598568384.db2.gz QWRGQTPMARSUPR-UHFFFAOYSA-N -1 3 355.467 3.978 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1OC(=O)CCCCCc1cccs1 ZINC000737023115 598568485 /nfs/dbraw/zinc/56/84/85/598568485.db2.gz BGEUMSWWPLJDSA-UHFFFAOYSA-N -1 3 372.450 3.645 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1OC(=O)CCCCCc1cccs1 ZINC000737023115 598568487 /nfs/dbraw/zinc/56/84/87/598568487.db2.gz BGEUMSWWPLJDSA-UHFFFAOYSA-N -1 3 372.450 3.645 20 0 FHADHM C[C@H](NC(=O)Nc1cccc(-n2cccc2)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736116234 598582881 /nfs/dbraw/zinc/58/28/81/598582881.db2.gz LTIFJQHFGNSVKX-AWEZNQCLSA-N -1 3 373.420 3.540 20 0 FHADHM C[C@H](NC(=O)Nc1cccc(-n2cccc2)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736116234 598582883 /nfs/dbraw/zinc/58/28/83/598582883.db2.gz LTIFJQHFGNSVKX-AWEZNQCLSA-N -1 3 373.420 3.540 20 0 FHADHM Cc1cccc(C2(C(=O)Nc3ccc(F)c(-c4nnn[n-]4)c3)CCCC2)c1 ZINC000737391064 598583817 /nfs/dbraw/zinc/58/38/17/598583817.db2.gz XOUKJYXEOKCSFN-UHFFFAOYSA-N -1 3 365.412 3.765 20 0 FHADHM Cc1cccc(C2(C(=O)Nc3ccc(F)c(-c4nn[n-]n4)c3)CCCC2)c1 ZINC000737391064 598583819 /nfs/dbraw/zinc/58/38/19/598583819.db2.gz XOUKJYXEOKCSFN-UHFFFAOYSA-N -1 3 365.412 3.765 20 0 FHADHM CCSCc1ccc(C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)cc1 ZINC000736668054 598584505 /nfs/dbraw/zinc/58/45/05/598584505.db2.gz WYFAFEILZQZVKQ-UHFFFAOYSA-N -1 3 357.414 3.511 20 0 FHADHM CCSCc1ccc(C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)cc1 ZINC000736668054 598584507 /nfs/dbraw/zinc/58/45/07/598584507.db2.gz WYFAFEILZQZVKQ-UHFFFAOYSA-N -1 3 357.414 3.511 20 0 FHADHM CC[C@@H](OC(=O)CCc1ccc(-c2nnn[n-]2)cc1)c1ccc(OC)cc1 ZINC000736383324 598584569 /nfs/dbraw/zinc/58/45/69/598584569.db2.gz QBTWOWWWLPWJPF-GOSISDBHSA-N -1 3 366.421 3.502 20 0 FHADHM CC[C@@H](OC(=O)CCc1ccc(-c2nn[n-]n2)cc1)c1ccc(OC)cc1 ZINC000736383324 598584571 /nfs/dbraw/zinc/58/45/71/598584571.db2.gz QBTWOWWWLPWJPF-GOSISDBHSA-N -1 3 366.421 3.502 20 0 FHADHM CC[C@@H](C)c1ccccc1OCC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000736325693 598587651 /nfs/dbraw/zinc/58/76/51/598587651.db2.gz GSUYOSDWJWTORE-GFCCVEGCSA-N -1 3 369.400 3.537 20 0 FHADHM CC[C@@H](C)c1ccccc1OCC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000736325693 598587653 /nfs/dbraw/zinc/58/76/53/598587653.db2.gz GSUYOSDWJWTORE-GFCCVEGCSA-N -1 3 369.400 3.537 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccc(-c2ccccc2F)o1 ZINC000738167757 598589776 /nfs/dbraw/zinc/58/97/76/598589776.db2.gz UFZRXKSAVBEYAK-UHFFFAOYSA-N -1 3 367.315 3.657 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccc(-c2ccccc2F)o1 ZINC000738167757 598589778 /nfs/dbraw/zinc/58/97/78/598589778.db2.gz UFZRXKSAVBEYAK-UHFFFAOYSA-N -1 3 367.315 3.657 20 0 FHADHM CCC[C@@H]1CCCC[C@H]1NC(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000736436575 598608950 /nfs/dbraw/zinc/60/89/50/598608950.db2.gz RWKMHTIXUJKLIL-NVXWUHKLSA-N -1 3 373.526 3.575 20 0 FHADHM CCC[C@@H]1CCCC[C@H]1NC(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000736436575 598608951 /nfs/dbraw/zinc/60/89/51/598608951.db2.gz RWKMHTIXUJKLIL-NVXWUHKLSA-N -1 3 373.526 3.575 20 0 FHADHM Clc1cccc(Cc2noc(C=Cc3ccccc3-c3nnn[n-]3)n2)c1 ZINC000737573927 598612688 /nfs/dbraw/zinc/61/26/88/598612688.db2.gz HGYNVZCWYBQMNH-CMDGGOBGSA-N -1 3 364.796 3.664 20 0 FHADHM Clc1cccc(Cc2noc(C=Cc3ccccc3-c3nn[n-]n3)n2)c1 ZINC000737573927 598612689 /nfs/dbraw/zinc/61/26/89/598612689.db2.gz HGYNVZCWYBQMNH-CMDGGOBGSA-N -1 3 364.796 3.664 20 0 FHADHM Clc1ccc(Cc2noc(C=Cc3ccccc3-c3nnn[n-]3)n2)cc1 ZINC000737574455 598612931 /nfs/dbraw/zinc/61/29/31/598612931.db2.gz FSSLUSFOPWMGBN-JXMROGBWSA-N -1 3 364.796 3.664 20 0 FHADHM Clc1ccc(Cc2noc(C=Cc3ccccc3-c3nn[n-]n3)n2)cc1 ZINC000737574455 598612933 /nfs/dbraw/zinc/61/29/33/598612933.db2.gz FSSLUSFOPWMGBN-JXMROGBWSA-N -1 3 364.796 3.664 20 0 FHADHM C[C@H](Sc1cccs1)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736191032 598613583 /nfs/dbraw/zinc/61/35/83/598613583.db2.gz GXZOFYLFJVNBRX-QMMMGPOBSA-N -1 3 365.871 3.701 20 0 FHADHM C[C@H](Sc1cccs1)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736191032 598613585 /nfs/dbraw/zinc/61/35/85/598613585.db2.gz GXZOFYLFJVNBRX-QMMMGPOBSA-N -1 3 365.871 3.701 20 0 FHADHM CC[C@H](NC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccc(C)cc1 ZINC000736360266 598624188 /nfs/dbraw/zinc/62/41/88/598624188.db2.gz AYOHKSSGHUCLEP-INIZCTEOSA-N -1 3 354.389 3.587 20 0 FHADHM CC[C@H](NC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccc(C)cc1 ZINC000736360266 598624189 /nfs/dbraw/zinc/62/41/89/598624189.db2.gz AYOHKSSGHUCLEP-INIZCTEOSA-N -1 3 354.389 3.587 20 0 FHADHM CC(C)C[C@H](NC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1cccs1 ZINC000735787042 598625484 /nfs/dbraw/zinc/62/54/84/598625484.db2.gz HIRSAFBYNAXDEK-AWEZNQCLSA-N -1 3 374.445 3.976 20 0 FHADHM CC(C)C[C@H](NC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1cccs1 ZINC000735787042 598625485 /nfs/dbraw/zinc/62/54/85/598625485.db2.gz HIRSAFBYNAXDEK-AWEZNQCLSA-N -1 3 374.445 3.976 20 0 FHADHM CCCN(CC1CCCCC1)C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000736469223 598626551 /nfs/dbraw/zinc/62/65/51/598626551.db2.gz BJZBZPGWAMNMSW-UHFFFAOYSA-N -1 3 360.437 3.830 20 0 FHADHM CCCN(CC1CCCCC1)C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000736469223 598626553 /nfs/dbraw/zinc/62/65/53/598626553.db2.gz BJZBZPGWAMNMSW-UHFFFAOYSA-N -1 3 360.437 3.830 20 0 FHADHM O=C(c1ccccc1)c1ccc(OCc2ccc(F)cc2-c2nnn[n-]2)cc1 ZINC000738279438 598643856 /nfs/dbraw/zinc/64/38/56/598643856.db2.gz RXEYMKDZDLULLM-UHFFFAOYSA-N -1 3 374.375 3.816 20 0 FHADHM O=C(c1ccccc1)c1ccc(OCc2ccc(F)cc2-c2nn[n-]n2)cc1 ZINC000738279438 598643858 /nfs/dbraw/zinc/64/38/58/598643858.db2.gz RXEYMKDZDLULLM-UHFFFAOYSA-N -1 3 374.375 3.816 20 0 FHADHM C[C@H]1CCC[C@H](OC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)C1 ZINC000736253333 598646259 /nfs/dbraw/zinc/64/62/59/598646259.db2.gz MXSOKXZLUDUGMI-YOEHRIQHSA-N -1 3 358.442 3.538 20 0 FHADHM C[C@H]1CCC[C@H](OC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)C1 ZINC000736253333 598646261 /nfs/dbraw/zinc/64/62/61/598646261.db2.gz MXSOKXZLUDUGMI-YOEHRIQHSA-N -1 3 358.442 3.538 20 0 FHADHM CCC(C)(C)NC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736312546 598647433 /nfs/dbraw/zinc/64/74/33/598647433.db2.gz DKBFSOATIDLAAZ-UHFFFAOYSA-N -1 3 351.410 3.577 20 0 FHADHM CCC(C)(C)NC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736312546 598647434 /nfs/dbraw/zinc/64/74/34/598647434.db2.gz DKBFSOATIDLAAZ-UHFFFAOYSA-N -1 3 351.410 3.577 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1OC(=O)C[C@@H](c1ccccc1)C(C)C ZINC000737024057 598649020 /nfs/dbraw/zinc/64/90/20/598649020.db2.gz JMFKJBUJQFYTMC-MRXNPFEDSA-N -1 3 366.421 3.611 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1OC(=O)C[C@@H](c1ccccc1)C(C)C ZINC000737024057 598649021 /nfs/dbraw/zinc/64/90/21/598649021.db2.gz JMFKJBUJQFYTMC-MRXNPFEDSA-N -1 3 366.421 3.611 20 0 FHADHM Cc1ccc(NC(=O)c2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)nc1 ZINC000737361656 598649169 /nfs/dbraw/zinc/64/91/69/598649169.db2.gz XBNPUGZDXLFWDO-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Clc1cc(NCc2ccc(OC3CCCC3)nc2)ccc1-c1nnn[n-]1 ZINC000737563887 598653427 /nfs/dbraw/zinc/65/34/27/598653427.db2.gz HTHARNMBSDBCFR-UHFFFAOYSA-N -1 3 370.844 3.849 20 0 FHADHM Clc1cc(NCc2ccc(OC3CCCC3)nc2)ccc1-c1nn[n-]n1 ZINC000737563887 598653430 /nfs/dbraw/zinc/65/34/30/598653430.db2.gz HTHARNMBSDBCFR-UHFFFAOYSA-N -1 3 370.844 3.849 20 0 FHADHM Cc1ccc(N2CCCN(c3ccc(-c4nnn[n-]4)c(Cl)c3)CC2)cc1 ZINC000737350875 598655020 /nfs/dbraw/zinc/65/50/20/598655020.db2.gz IYPJINHIOZBTMR-UHFFFAOYSA-N -1 3 368.872 3.545 20 0 FHADHM Cc1ccc(N2CCCN(c3ccc(-c4nn[n-]n4)c(Cl)c3)CC2)cc1 ZINC000737350875 598655022 /nfs/dbraw/zinc/65/50/22/598655022.db2.gz IYPJINHIOZBTMR-UHFFFAOYSA-N -1 3 368.872 3.545 20 0 FHADHM Fc1ccc2c(c1)[C@H](Nc1ccc(-c3nnn[n-]3)c(Cl)c1)CCCO2 ZINC000737664100 598656545 /nfs/dbraw/zinc/65/65/45/598656545.db2.gz BFQGNIZCABDRJU-OAHLLOKOSA-N -1 3 359.792 3.985 20 0 FHADHM Fc1ccc2c(c1)[C@H](Nc1ccc(-c3nn[n-]n3)c(Cl)c1)CCCO2 ZINC000737664100 598656547 /nfs/dbraw/zinc/65/65/47/598656547.db2.gz BFQGNIZCABDRJU-OAHLLOKOSA-N -1 3 359.792 3.985 20 0 FHADHM CN(C(=O)CSc1ccc(-c2nnn[n-]2)cc1)C1CCCCCCC1 ZINC000736740006 598658492 /nfs/dbraw/zinc/65/84/92/598658492.db2.gz XBFBPBDGBZHDSZ-UHFFFAOYSA-N -1 3 359.499 3.530 20 0 FHADHM CN(C(=O)CSc1ccc(-c2nn[n-]n2)cc1)C1CCCCCCC1 ZINC000736740006 598658494 /nfs/dbraw/zinc/65/84/94/598658494.db2.gz XBFBPBDGBZHDSZ-UHFFFAOYSA-N -1 3 359.499 3.530 20 0 FHADHM CCCC[C@H](NC(=O)c1cccc(-c2nnn[n-]2)c1)c1ccc(OC)cc1 ZINC000736437729 598661299 /nfs/dbraw/zinc/66/12/99/598661299.db2.gz KPYHWAILAKXLCJ-SFHVURJKSA-N -1 3 365.437 3.537 20 0 FHADHM CCCC[C@H](NC(=O)c1cccc(-c2nn[n-]n2)c1)c1ccc(OC)cc1 ZINC000736437729 598661301 /nfs/dbraw/zinc/66/13/01/598661301.db2.gz KPYHWAILAKXLCJ-SFHVURJKSA-N -1 3 365.437 3.537 20 0 FHADHM Cc1cc(Br)ccc1CNc1cccc(F)c1-c1nnn[n-]1 ZINC000737231718 598675715 /nfs/dbraw/zinc/67/57/15/598675715.db2.gz SICJSZKFGJYSDO-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Cc1cc(Br)ccc1CNc1cccc(F)c1-c1nn[n-]n1 ZINC000737231718 598675717 /nfs/dbraw/zinc/67/57/17/598675717.db2.gz SICJSZKFGJYSDO-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM O=C(CSc1ccc(-c2nnn[n-]2)cc1)N1CCCC2(CCCCC2)C1 ZINC000737944182 598699284 /nfs/dbraw/zinc/69/92/84/598699284.db2.gz WLSFXGULPGHKRR-UHFFFAOYSA-N -1 3 371.510 3.532 20 0 FHADHM O=C(CSc1ccc(-c2nn[n-]n2)cc1)N1CCCC2(CCCCC2)C1 ZINC000737944182 598699285 /nfs/dbraw/zinc/69/92/85/598699285.db2.gz WLSFXGULPGHKRR-UHFFFAOYSA-N -1 3 371.510 3.532 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)N1CCCC2(CCCCC2)C1 ZINC000738160835 598731456 /nfs/dbraw/zinc/73/14/56/598731456.db2.gz CXMXHAYNYYCDFX-UHFFFAOYSA-N -1 3 358.421 3.584 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)N1CCCC2(CCCCC2)C1 ZINC000738160835 598731458 /nfs/dbraw/zinc/73/14/58/598731458.db2.gz CXMXHAYNYYCDFX-UHFFFAOYSA-N -1 3 358.421 3.584 20 0 FHADHM CC(C)CCCOC(=O)c1ccc(Oc2ccc(-c3nnn[n-]3)cn2)cc1 ZINC000735797737 598733476 /nfs/dbraw/zinc/73/34/76/598733476.db2.gz SIUTZOFLJCCFKD-UHFFFAOYSA-N -1 3 367.409 3.647 20 0 FHADHM CC(C)CCCOC(=O)c1ccc(Oc2ccc(-c3nn[n-]n3)cn2)cc1 ZINC000735797737 598733478 /nfs/dbraw/zinc/73/34/78/598733478.db2.gz SIUTZOFLJCCFKD-UHFFFAOYSA-N -1 3 367.409 3.647 20 0 FHADHM CC[C@@H](CC(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2)c1ccccc1 ZINC000736333058 598734393 /nfs/dbraw/zinc/73/43/93/598734393.db2.gz PHNFIKPRUHPNRL-LBPRGKRZSA-N -1 3 367.478 3.939 20 0 FHADHM CC[C@@H](CC(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2)c1ccccc1 ZINC000736333058 598734394 /nfs/dbraw/zinc/73/43/94/598734394.db2.gz PHNFIKPRUHPNRL-LBPRGKRZSA-N -1 3 367.478 3.939 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)ccc1OC(=O)C[C@@H](CC)c1ccccc1 ZINC000736629602 598734402 /nfs/dbraw/zinc/73/44/02/598734402.db2.gz XIVWZOOVKMDJQE-CQSZACIVSA-N -1 3 366.421 3.755 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)ccc1OC(=O)C[C@@H](CC)c1ccccc1 ZINC000736629602 598734403 /nfs/dbraw/zinc/73/44/03/598734403.db2.gz XIVWZOOVKMDJQE-CQSZACIVSA-N -1 3 366.421 3.755 20 0 FHADHM CCN(C(=O)CCc1ccccc1C)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736504161 598736238 /nfs/dbraw/zinc/73/62/38/598736238.db2.gz ARULJRDGFWLFSI-MRXNPFEDSA-N -1 3 363.465 3.717 20 0 FHADHM CCN(C(=O)CCc1ccccc1C)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736504161 598736239 /nfs/dbraw/zinc/73/62/39/598736239.db2.gz ARULJRDGFWLFSI-MRXNPFEDSA-N -1 3 363.465 3.717 20 0 FHADHM C[C@H](Cc1ccccc1)C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCC2 ZINC000736059208 598741178 /nfs/dbraw/zinc/74/11/78/598741178.db2.gz RBPWUCJJNMFMMN-GFCCVEGCSA-N -1 3 367.478 3.624 20 0 FHADHM C[C@H](Cc1ccccc1)C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCC2 ZINC000736059208 598741179 /nfs/dbraw/zinc/74/11/79/598741179.db2.gz RBPWUCJJNMFMMN-GFCCVEGCSA-N -1 3 367.478 3.624 20 0 FHADHM CCN(C(=O)[C@H](C)Cc1ccccc1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736503600 598741539 /nfs/dbraw/zinc/74/15/39/598741539.db2.gz YRERQYZSUDCKBY-CVEARBPZSA-N -1 3 363.465 3.655 20 0 FHADHM CCN(C(=O)[C@H](C)Cc1ccccc1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736503600 598741540 /nfs/dbraw/zinc/74/15/40/598741540.db2.gz YRERQYZSUDCKBY-CVEARBPZSA-N -1 3 363.465 3.655 20 0 FHADHM C[C@H](Sc1ccc(-c2nnn[n-]2)cn1)c1ccc(Br)cc1 ZINC000736190694 598761621 /nfs/dbraw/zinc/76/16/21/598761621.db2.gz GVKYPFKPKACJOS-VIFPVBQESA-N -1 3 362.256 3.878 20 0 FHADHM C[C@H](Sc1ccc(-c2nn[n-]n2)cn1)c1ccc(Br)cc1 ZINC000736190694 598761623 /nfs/dbraw/zinc/76/16/23/598761623.db2.gz GVKYPFKPKACJOS-VIFPVBQESA-N -1 3 362.256 3.878 20 0 FHADHM C[C@@H](SC1CCCCC1)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736189589 598762225 /nfs/dbraw/zinc/76/22/25/598762225.db2.gz PZPGLGJWCAHKIH-SNVBAGLBSA-N -1 3 365.890 3.913 20 0 FHADHM C[C@@H](SC1CCCCC1)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736189589 598762226 /nfs/dbraw/zinc/76/22/26/598762226.db2.gz PZPGLGJWCAHKIH-SNVBAGLBSA-N -1 3 365.890 3.913 20 0 FHADHM CC[C@@H](Cc1ccccc1)C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000736354939 598763057 /nfs/dbraw/zinc/76/30/57/598763057.db2.gz WJEOCJOHRLMWGI-HNNXBMFYSA-N -1 3 366.469 3.631 20 0 FHADHM CC[C@@H](Cc1ccccc1)C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000736354939 598763059 /nfs/dbraw/zinc/76/30/59/598763059.db2.gz WJEOCJOHRLMWGI-HNNXBMFYSA-N -1 3 366.469 3.631 20 0 FHADHM CC[C@@H](Cc1ccccc1)C(=O)Nc1sc(C)c(C)c1-c1nnn[n-]1 ZINC000736351147 598763237 /nfs/dbraw/zinc/76/32/37/598763237.db2.gz OKVYVUAUJFLUJE-AWEZNQCLSA-N -1 3 355.467 3.752 20 0 FHADHM CC[C@@H](Cc1ccccc1)C(=O)Nc1sc(C)c(C)c1-c1nn[n-]n1 ZINC000736351147 598763238 /nfs/dbraw/zinc/76/32/38/598763238.db2.gz OKVYVUAUJFLUJE-AWEZNQCLSA-N -1 3 355.467 3.752 20 0 FHADHM Cc1ccccc1[C@H](C(C)C)N(C)C(=O)c1sccc1-c1nnn[n-]1 ZINC000737414931 598764960 /nfs/dbraw/zinc/76/49/60/598764960.db2.gz HKMBHLXZGMKMLF-HNNXBMFYSA-N -1 3 355.467 3.706 20 0 FHADHM Cc1ccccc1[C@H](C(C)C)N(C)C(=O)c1sccc1-c1nn[n-]n1 ZINC000737414931 598764962 /nfs/dbraw/zinc/76/49/62/598764962.db2.gz HKMBHLXZGMKMLF-HNNXBMFYSA-N -1 3 355.467 3.706 20 0 FHADHM Clc1ccc(NCc2coc(-c3cccs3)n2)c(-c2nnn[n-]2)c1 ZINC000737573466 598792050 /nfs/dbraw/zinc/79/20/50/598792050.db2.gz IFUNIZGVRIAUSJ-UHFFFAOYSA-N -1 3 358.814 3.849 20 0 FHADHM Clc1ccc(NCc2coc(-c3cccs3)n2)c(-c2nn[n-]n2)c1 ZINC000737573466 598792052 /nfs/dbraw/zinc/79/20/52/598792052.db2.gz IFUNIZGVRIAUSJ-UHFFFAOYSA-N -1 3 358.814 3.849 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)c1cccc(Oc2ccncc2)c1 ZINC000737294337 598793304 /nfs/dbraw/zinc/79/33/04/598793304.db2.gz LUCSBGCYKHBJJP-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cccc(Oc2ccncc2)c1 ZINC000737294337 598793305 /nfs/dbraw/zinc/79/33/05/598793305.db2.gz LUCSBGCYKHBJJP-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Clc1ccc(NCC2(c3ccccc3)CCOCC2)c(-c2nnn[n-]2)c1 ZINC000737574041 598793562 /nfs/dbraw/zinc/79/35/62/598793562.db2.gz KBDLEAJXEDEKBA-UHFFFAOYSA-N -1 3 369.856 3.680 20 0 FHADHM Clc1ccc(NCC2(c3ccccc3)CCOCC2)c(-c2nn[n-]n2)c1 ZINC000737574041 598793563 /nfs/dbraw/zinc/79/35/63/598793563.db2.gz KBDLEAJXEDEKBA-UHFFFAOYSA-N -1 3 369.856 3.680 20 0 FHADHM Cc1ccc(-c2ccsc2C(=O)Nc2ccc(-c3nnn[n-]3)cn2)cc1 ZINC000737288471 598804631 /nfs/dbraw/zinc/80/46/31/598804631.db2.gz OVVNAQKDSZWFBK-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1ccc(-c2ccsc2C(=O)Nc2ccc(-c3nn[n-]n3)cn2)cc1 ZINC000737288471 598804632 /nfs/dbraw/zinc/80/46/32/598804632.db2.gz OVVNAQKDSZWFBK-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM CC(C)[C@H](C)C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000735703786 598805023 /nfs/dbraw/zinc/80/50/23/598805023.db2.gz WBPZBMVHZWFRKH-ZDUSSCGKSA-N -1 3 351.410 3.890 20 0 FHADHM CC(C)[C@H](C)C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000735703786 598805025 /nfs/dbraw/zinc/80/50/25/598805025.db2.gz WBPZBMVHZWFRKH-ZDUSSCGKSA-N -1 3 351.410 3.890 20 0 FHADHM CC(C)Oc1ccc(NC(=S)Nc2ccc(F)cc2)cc1-c1nnn[n-]1 ZINC000820174224 607367256 /nfs/dbraw/zinc/36/72/56/607367256.db2.gz PHHSSBNATOZBMB-UHFFFAOYSA-N -1 3 372.429 3.602 20 0 FHADHM CC(C)Oc1ccc(NC(=S)Nc2ccc(F)cc2)cc1-c1nn[n-]n1 ZINC000820174224 607367258 /nfs/dbraw/zinc/36/72/58/607367258.db2.gz PHHSSBNATOZBMB-UHFFFAOYSA-N -1 3 372.429 3.602 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)C1(c2ccccc2)CCC1 ZINC000738144445 598811464 /nfs/dbraw/zinc/81/14/64/598811464.db2.gz MAEHYPKYAITRCH-UHFFFAOYSA-N -1 3 353.813 3.581 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)C1(c2ccccc2)CCC1 ZINC000738144445 598811466 /nfs/dbraw/zinc/81/14/66/598811466.db2.gz MAEHYPKYAITRCH-UHFFFAOYSA-N -1 3 353.813 3.581 20 0 FHADHM c1cc(OCC2CC2)ccc1NCCCOc1ccc(-c2nn[n-]n2)cc1 ZINC000738419504 598819724 /nfs/dbraw/zinc/81/97/24/598819724.db2.gz NXJYVPZYSMFHFD-UHFFFAOYSA-N -1 3 365.437 3.537 20 0 FHADHM CCC[C@H](CC1CCCC1)C(=O)Nc1cc(-c2nnn[n-]2)ccc1OC ZINC000736421881 598822381 /nfs/dbraw/zinc/82/23/81/598822381.db2.gz FAIYOVYFKOTMIT-OAHLLOKOSA-N -1 3 357.458 3.810 20 0 FHADHM CCC[C@H](CC1CCCC1)C(=O)Nc1cc(-c2nn[n-]n2)ccc1OC ZINC000736421881 598822382 /nfs/dbraw/zinc/82/23/82/598822382.db2.gz FAIYOVYFKOTMIT-OAHLLOKOSA-N -1 3 357.458 3.810 20 0 FHADHM CN(CC1CCCC1)C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000821596604 599294789 /nfs/dbraw/zinc/29/47/89/599294789.db2.gz PMULXNIQGLUKLS-UHFFFAOYSA-N -1 3 368.363 3.539 20 0 FHADHM CN(CC1CCCC1)C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000821596604 599294790 /nfs/dbraw/zinc/29/47/90/599294790.db2.gz PMULXNIQGLUKLS-UHFFFAOYSA-N -1 3 368.363 3.539 20 0 FHADHM CC(C)CNC(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1 ZINC000820097353 599296211 /nfs/dbraw/zinc/29/62/11/599296211.db2.gz NJOOTKPXHJJCTE-UHFFFAOYSA-N -1 3 370.388 3.576 20 0 FHADHM CC(C)CNC(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1 ZINC000820097353 599296212 /nfs/dbraw/zinc/29/62/12/599296212.db2.gz NJOOTKPXHJJCTE-UHFFFAOYSA-N -1 3 370.388 3.576 20 0 FHADHM CCN(CC)C(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1 ZINC000821175048 599299812 /nfs/dbraw/zinc/29/98/12/599299812.db2.gz AVGKSCPJMQDWQM-UHFFFAOYSA-N -1 3 370.388 3.672 20 0 FHADHM CCN(CC)C(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1 ZINC000821175048 599299815 /nfs/dbraw/zinc/29/98/15/599299815.db2.gz AVGKSCPJMQDWQM-UHFFFAOYSA-N -1 3 370.388 3.672 20 0 FHADHM CCCCc1noc([C@@H](C)SCc2cc(-c3nnn[n-]3)ccc2OC)n1 ZINC000821082769 607367831 /nfs/dbraw/zinc/36/78/31/607367831.db2.gz NRRNSJMGNYAYOP-LLVKDONJSA-N -1 3 374.470 3.595 20 0 FHADHM CCCCc1noc([C@@H](C)SCc2cc(-c3nn[n-]n3)ccc2OC)n1 ZINC000821082769 607367833 /nfs/dbraw/zinc/36/78/33/607367833.db2.gz NRRNSJMGNYAYOP-LLVKDONJSA-N -1 3 374.470 3.595 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1CSCc1nc2ccccc2s1 ZINC000821752311 607368129 /nfs/dbraw/zinc/36/81/29/607368129.db2.gz JSJGMECAOQTODK-UHFFFAOYSA-N -1 3 369.475 3.918 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CSCc1nc2ccccc2s1 ZINC000821752311 607368131 /nfs/dbraw/zinc/36/81/31/607368131.db2.gz JSJGMECAOQTODK-UHFFFAOYSA-N -1 3 369.475 3.918 20 0 FHADHM C[C@@H](c1ccc(-c2nnn[n-]2)cc1)N1CCO[C@H](c2ccccc2Cl)C1 ZINC000736201246 599314336 /nfs/dbraw/zinc/31/43/36/599314336.db2.gz WJIMRIVWZPHXSV-UGSOOPFHSA-N -1 3 369.856 3.655 20 0 FHADHM C[C@@H](c1ccc(-c2nn[n-]n2)cc1)N1CCO[C@H](c2ccccc2Cl)C1 ZINC000736201246 599314338 /nfs/dbraw/zinc/31/43/38/599314338.db2.gz WJIMRIVWZPHXSV-UGSOOPFHSA-N -1 3 369.856 3.655 20 0 FHADHM Clc1cc(-c2nnn[n-]2)ccc1Oc1ncnc2sc3c(c21)CCC3 ZINC000822563736 599316843 /nfs/dbraw/zinc/31/68/43/599316843.db2.gz MKFUFYFBOIAYTD-UHFFFAOYSA-N -1 3 370.825 3.806 20 0 FHADHM Clc1cc(-c2nn[n-]n2)ccc1Oc1ncnc2sc3c(c21)CCC3 ZINC000822563736 599316845 /nfs/dbraw/zinc/31/68/45/599316845.db2.gz MKFUFYFBOIAYTD-UHFFFAOYSA-N -1 3 370.825 3.806 20 0 FHADHM C[C@H](SCc1cccc2c1OCCO2)c1ccc(-c2nnn[n-]2)cc1 ZINC000736194264 599326584 /nfs/dbraw/zinc/32/65/84/599326584.db2.gz YTOSCPPCNZZEIV-LBPRGKRZSA-N -1 3 354.435 3.632 20 0 FHADHM C[C@H](SCc1cccc2c1OCCO2)c1ccc(-c2nn[n-]n2)cc1 ZINC000736194264 599326586 /nfs/dbraw/zinc/32/65/86/599326586.db2.gz YTOSCPPCNZZEIV-LBPRGKRZSA-N -1 3 354.435 3.632 20 0 FHADHM C[C@@H](SCc1cccc2c1OCCO2)c1ccc(-c2nnn[n-]2)cc1 ZINC000736194263 599326741 /nfs/dbraw/zinc/32/67/41/599326741.db2.gz YTOSCPPCNZZEIV-GFCCVEGCSA-N -1 3 354.435 3.632 20 0 FHADHM C[C@@H](SCc1cccc2c1OCCO2)c1ccc(-c2nn[n-]n2)cc1 ZINC000736194263 599326745 /nfs/dbraw/zinc/32/67/45/599326745.db2.gz YTOSCPPCNZZEIV-GFCCVEGCSA-N -1 3 354.435 3.632 20 0 FHADHM COc1cc2nc(C)sc2cc1N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000737056022 599326908 /nfs/dbraw/zinc/32/69/08/599326908.db2.gz SSGPFJRNKPCUIJ-JTQLQIEISA-N -1 3 366.450 3.967 20 0 FHADHM COc1cc2nc(C)sc2cc1N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000737056022 599326911 /nfs/dbraw/zinc/32/69/11/599326911.db2.gz SSGPFJRNKPCUIJ-JTQLQIEISA-N -1 3 366.450 3.967 20 0 FHADHM C[C@H](SCC(=O)NC1CCCCCCC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736191840 599328456 /nfs/dbraw/zinc/32/84/56/599328456.db2.gz XDJFPIARKCULGD-AWEZNQCLSA-N -1 3 373.526 3.890 20 0 FHADHM C[C@H](SCC(=O)NC1CCCCCCC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736191840 599328458 /nfs/dbraw/zinc/32/84/58/599328458.db2.gz XDJFPIARKCULGD-AWEZNQCLSA-N -1 3 373.526 3.890 20 0 FHADHM C[C@H](S[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)C(=O)Nc1cccc(F)c1 ZINC000736191812 599328499 /nfs/dbraw/zinc/32/84/99/599328499.db2.gz XANXDXJINLIIJQ-RYUDHWBXSA-N -1 3 371.441 3.827 20 0 FHADHM C[C@H](S[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)C(=O)Nc1cccc(F)c1 ZINC000736191812 599328501 /nfs/dbraw/zinc/32/85/01/599328501.db2.gz XANXDXJINLIIJQ-RYUDHWBXSA-N -1 3 371.441 3.827 20 0 FHADHM C[C@@H](S[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)C(=O)Nc1cccc(F)c1 ZINC000736191810 599328542 /nfs/dbraw/zinc/32/85/42/599328542.db2.gz XANXDXJINLIIJQ-NWDGAFQWSA-N -1 3 371.441 3.827 20 0 FHADHM C[C@@H](S[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)C(=O)Nc1cccc(F)c1 ZINC000736191810 599328544 /nfs/dbraw/zinc/32/85/44/599328544.db2.gz XANXDXJINLIIJQ-NWDGAFQWSA-N -1 3 371.441 3.827 20 0 FHADHM Cc1cccc(NC(=O)CS[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737398623 599331781 /nfs/dbraw/zinc/33/17/81/599331781.db2.gz IWDJTWYRMCBZOG-CYBMUJFWSA-N -1 3 353.451 3.608 20 0 FHADHM Cc1cccc(NC(=O)CS[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737398623 599331783 /nfs/dbraw/zinc/33/17/83/599331783.db2.gz IWDJTWYRMCBZOG-CYBMUJFWSA-N -1 3 353.451 3.608 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1CNc1cccc(OC2CCCC2)c1 ZINC000821736851 607369461 /nfs/dbraw/zinc/36/94/61/607369461.db2.gz PEHTUJMWSCGPAI-UHFFFAOYSA-N -1 3 365.437 3.809 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CNc1cccc(OC2CCCC2)c1 ZINC000821736851 607369463 /nfs/dbraw/zinc/36/94/63/607369463.db2.gz PEHTUJMWSCGPAI-UHFFFAOYSA-N -1 3 365.437 3.809 20 0 FHADHM CC(C)[C@H](Sc1ccccc1-c1nnn[n-]1)C(=O)N[C@H]1CCCC[C@@H]1C ZINC000820033592 599349292 /nfs/dbraw/zinc/34/92/92/599349292.db2.gz XJHUDMJSFDVJMM-QRTARXTBSA-N -1 3 373.526 3.678 20 0 FHADHM CC(C)[C@H](Sc1ccccc1-c1nn[n-]n1)C(=O)N[C@H]1CCCC[C@@H]1C ZINC000820033592 599349294 /nfs/dbraw/zinc/34/92/94/599349294.db2.gz XJHUDMJSFDVJMM-QRTARXTBSA-N -1 3 373.526 3.678 20 0 FHADHM CCCCOc1ccccc1NCc1cc(-c2nnn[n-]2)ccc1OC ZINC000821077699 607370510 /nfs/dbraw/zinc/37/05/10/607370510.db2.gz QMJWPZYERGPXGC-UHFFFAOYSA-N -1 3 353.426 3.666 20 0 FHADHM CCCCOc1ccccc1NCc1cc(-c2nn[n-]n2)ccc1OC ZINC000821077699 607370512 /nfs/dbraw/zinc/37/05/12/607370512.db2.gz QMJWPZYERGPXGC-UHFFFAOYSA-N -1 3 353.426 3.666 20 0 FHADHM C[C@@H](Nc1ccc(N2CCCC2)c(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820454991 599368738 /nfs/dbraw/zinc/36/87/38/599368738.db2.gz AODFLCPZNPHWDN-CYBMUJFWSA-N -1 3 352.417 3.779 20 0 FHADHM C[C@@H](Nc1ccc(N2CCCC2)c(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820454991 599368741 /nfs/dbraw/zinc/36/87/41/599368741.db2.gz AODFLCPZNPHWDN-CYBMUJFWSA-N -1 3 352.417 3.779 20 0 FHADHM CCN(C(=O)c1cc2occc2s1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736505736 599371565 /nfs/dbraw/zinc/37/15/65/599371565.db2.gz LUTRRELCQVMACS-LLVKDONJSA-N -1 3 367.434 3.898 20 0 FHADHM CCN(C(=O)c1cc2occc2s1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736505736 599371566 /nfs/dbraw/zinc/37/15/66/599371566.db2.gz LUTRRELCQVMACS-LLVKDONJSA-N -1 3 367.434 3.898 20 0 FHADHM Cc1cccc([C@@H](C)OC(=O)CSc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737385978 599376792 /nfs/dbraw/zinc/37/67/92/599376792.db2.gz AADDFHWQNBAOCX-CYBMUJFWSA-N -1 3 354.435 3.572 20 0 FHADHM Cc1cccc([C@@H](C)OC(=O)CSc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737385978 599376794 /nfs/dbraw/zinc/37/67/94/599376794.db2.gz AADDFHWQNBAOCX-CYBMUJFWSA-N -1 3 354.435 3.572 20 0 FHADHM c1ccc2cc(OCc3nnc(-c4cccc(-c5nnn[n-]5)c4)o3)ccc2c1 ZINC000823737510 599383496 /nfs/dbraw/zinc/38/34/96/599383496.db2.gz GEYSSTZFVVJHES-UHFFFAOYSA-N -1 3 370.372 3.649 20 0 FHADHM c1ccc2cc(OCc3nnc(-c4cccc(-c5nn[n-]n5)c4)o3)ccc2c1 ZINC000823737510 599383498 /nfs/dbraw/zinc/38/34/98/599383498.db2.gz GEYSSTZFVVJHES-UHFFFAOYSA-N -1 3 370.372 3.649 20 0 FHADHM COc1cc(COc2c(C)cc(-c3nn[n-]n3)cc2C)ccc1SC ZINC000821716623 599388894 /nfs/dbraw/zinc/38/88/94/599388894.db2.gz CMGMOPWGFSIMGM-UHFFFAOYSA-N -1 3 356.451 3.793 20 0 FHADHM COc1ccc(OCc2ccc(F)cc2-c2nnn[n-]2)c2ccccc12 ZINC000821846502 599388981 /nfs/dbraw/zinc/38/89/81/599388981.db2.gz SYKARVBACJFYDJ-UHFFFAOYSA-N -1 3 350.353 3.747 20 0 FHADHM COc1ccc(OCc2ccc(F)cc2-c2nn[n-]n2)c2ccccc12 ZINC000821846502 599388984 /nfs/dbraw/zinc/38/89/84/599388984.db2.gz SYKARVBACJFYDJ-UHFFFAOYSA-N -1 3 350.353 3.747 20 0 FHADHM FC(F)Oc1ccc(CNc2cc(-c3nnn[n-]3)c3ccccc3n2)cc1 ZINC000737639618 599397798 /nfs/dbraw/zinc/39/77/98/599397798.db2.gz UETZYIRCLSMJMF-UHFFFAOYSA-N -1 3 368.347 3.628 20 0 FHADHM FC(F)Oc1ccc(CNc2cc(-c3nn[n-]n3)c3ccccc3n2)cc1 ZINC000737639618 599397801 /nfs/dbraw/zinc/39/78/01/599397801.db2.gz UETZYIRCLSMJMF-UHFFFAOYSA-N -1 3 368.347 3.628 20 0 FHADHM C[C@@H](NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1Cl ZINC000820352346 599397993 /nfs/dbraw/zinc/39/79/93/599397993.db2.gz UWPJJDUWTJOOHB-NWDGAFQWSA-N -1 3 370.844 3.642 20 0 FHADHM C[C@@H](NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1Cl ZINC000820352346 599397997 /nfs/dbraw/zinc/39/79/97/599397997.db2.gz UWPJJDUWTJOOHB-NWDGAFQWSA-N -1 3 370.844 3.642 20 0 FHADHM CC(C)[C@H](NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000820356942 599401047 /nfs/dbraw/zinc/40/10/47/599401047.db2.gz CYCTVFUJMRPXDZ-KDOFPFPSSA-N -1 3 364.453 3.624 20 0 FHADHM CC(C)[C@H](NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000820356942 599401049 /nfs/dbraw/zinc/40/10/49/599401049.db2.gz CYCTVFUJMRPXDZ-KDOFPFPSSA-N -1 3 364.453 3.624 20 0 FHADHM CCC[C@H](NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000821021916 599404802 /nfs/dbraw/zinc/40/48/02/599404802.db2.gz PVGLEUTTYJRMJD-KSSFIOAISA-N -1 3 364.453 3.768 20 0 FHADHM CCC[C@H](NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000821021916 599404804 /nfs/dbraw/zinc/40/48/04/599404804.db2.gz PVGLEUTTYJRMJD-KSSFIOAISA-N -1 3 364.453 3.768 20 0 FHADHM COc1ccc(CC[C@H](C)Nc2cc(-c3nnn[n-]3)c3ccccc3n2)cc1 ZINC000737085744 599418927 /nfs/dbraw/zinc/41/89/27/599418927.db2.gz AEYVWXQDYQBGFY-AWEZNQCLSA-N -1 3 374.448 3.857 20 0 FHADHM COc1ccc(CC[C@H](C)Nc2cc(-c3nn[n-]n3)c3ccccc3n2)cc1 ZINC000737085744 599418928 /nfs/dbraw/zinc/41/89/28/599418928.db2.gz AEYVWXQDYQBGFY-AWEZNQCLSA-N -1 3 374.448 3.857 20 0 FHADHM Cc1nc(-c2ccccc2)sc1[C@@H](C)NCc1ccc(-c2nnn[n-]2)o1 ZINC000822423481 599421553 /nfs/dbraw/zinc/42/15/53/599421553.db2.gz LHLAPNUCPWQXEU-LLVKDONJSA-N -1 3 366.450 3.742 20 0 FHADHM COc1ccc([C@H]2CCN(c3cc(Cl)ccc3-c3nnn[n-]3)C2)cc1 ZINC000737074104 599422198 /nfs/dbraw/zinc/42/21/98/599422198.db2.gz FAAOCHBWQWFVCV-ZDUSSCGKSA-N -1 3 355.829 3.523 20 0 FHADHM COc1ccc([C@H]2CCN(c3cc(Cl)ccc3-c3nn[n-]n3)C2)cc1 ZINC000737074104 599422200 /nfs/dbraw/zinc/42/22/00/599422200.db2.gz FAAOCHBWQWFVCV-ZDUSSCGKSA-N -1 3 355.829 3.523 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CSc1nc2ccccc2s1 ZINC000821752926 607376667 /nfs/dbraw/zinc/37/66/67/607376667.db2.gz WIWSENRVBHSWMW-UHFFFAOYSA-N -1 3 355.448 3.777 20 0 FHADHM CCCCn1c(C)c(C)nc1SCc1cc(-c2nn[n-]n2)ccc1OC ZINC000821081841 607376941 /nfs/dbraw/zinc/37/69/41/607376941.db2.gz BIZZHAYCWBNRAO-UHFFFAOYSA-N -1 3 372.498 3.781 20 0 FHADHM Cc1ccccc1Oc1ccccc1CNCc1ccc(-c2nnn[n-]2)o1 ZINC000822366106 599431782 /nfs/dbraw/zinc/43/17/82/599431782.db2.gz BYIJQZPQRRIZOW-UHFFFAOYSA-N -1 3 361.405 3.850 20 0 FHADHM Cc1ccccc1Oc1ccccc1CNCc1ccc(-c2nn[n-]n2)o1 ZINC000822366106 599431784 /nfs/dbraw/zinc/43/17/84/599431784.db2.gz BYIJQZPQRRIZOW-UHFFFAOYSA-N -1 3 361.405 3.850 20 0 FHADHM CCCC[C@@H]1CCC[C@@H]1NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821043627 599434557 /nfs/dbraw/zinc/43/45/57/599434557.db2.gz QVYXKRYKJHGPHF-CPUCHLNUSA-N -1 3 356.474 3.586 20 0 FHADHM CCCC[C@@H]1CCC[C@@H]1NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821043627 599434559 /nfs/dbraw/zinc/43/45/59/599434559.db2.gz QVYXKRYKJHGPHF-CPUCHLNUSA-N -1 3 356.474 3.586 20 0 FHADHM CCOc1cc(CNc2cc(Cl)ccc2-c2nnn[n-]2)ccc1OC ZINC000736624581 599438251 /nfs/dbraw/zinc/43/82/51/599438251.db2.gz FBGVIBVIKDDAKJ-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM CCOc1cc(CNc2cc(Cl)ccc2-c2nn[n-]n2)ccc1OC ZINC000736624581 599438255 /nfs/dbraw/zinc/43/82/55/599438255.db2.gz FBGVIBVIKDDAKJ-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM Fc1ccccc1C1CCN(c2c(F)cc(-c3nnn[n-]3)cc2F)CC1 ZINC000737666288 599441598 /nfs/dbraw/zinc/44/15/98/599441598.db2.gz WINIUESDVROZFU-UHFFFAOYSA-N -1 3 359.355 3.668 20 0 FHADHM Fc1ccccc1C1CCN(c2c(F)cc(-c3nn[n-]n3)cc2F)CC1 ZINC000737666288 599441600 /nfs/dbraw/zinc/44/16/00/599441600.db2.gz WINIUESDVROZFU-UHFFFAOYSA-N -1 3 359.355 3.668 20 0 FHADHM CC[C@@H](C)C[C@H](C)NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)CC(C)C ZINC000820870781 599459266 /nfs/dbraw/zinc/45/92/66/599459266.db2.gz ZHXXLXKLJBMKSY-CVEARBPZSA-N -1 3 372.517 3.859 20 0 FHADHM CC[C@@H](C)C[C@H](C)NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)CC(C)C ZINC000820870781 599459269 /nfs/dbraw/zinc/45/92/69/599459269.db2.gz ZHXXLXKLJBMKSY-CVEARBPZSA-N -1 3 372.517 3.859 20 0 FHADHM Cc1cc2nc(C=Cc3cnc4ccc(-c5nnn[n-]5)cn34)sc2cc1C ZINC000737285487 599461425 /nfs/dbraw/zinc/46/14/25/599461425.db2.gz SSPFMPCLOWUJHS-XQRVVYSFSA-N -1 3 373.445 3.911 20 0 FHADHM Cc1cc2nc(C=Cc3cnc4ccc(-c5nn[n-]n5)cn34)sc2cc1C ZINC000737285487 599461427 /nfs/dbraw/zinc/46/14/27/599461427.db2.gz SSPFMPCLOWUJHS-XQRVVYSFSA-N -1 3 373.445 3.911 20 0 FHADHM COc1ccc([C@H]2CCCN2c2c(Cl)cccc2-c2nnn[n-]2)cc1 ZINC000821786806 599465675 /nfs/dbraw/zinc/46/56/75/599465675.db2.gz JXWCHMYVORWATE-MRXNPFEDSA-N -1 3 355.829 3.870 20 0 FHADHM COc1ccc([C@H]2CCCN2c2c(Cl)cccc2-c2nn[n-]n2)cc1 ZINC000821786806 599465676 /nfs/dbraw/zinc/46/56/76/599465676.db2.gz JXWCHMYVORWATE-MRXNPFEDSA-N -1 3 355.829 3.870 20 0 FHADHM O=C(CCc1ccc(-c2nnn[n-]2)cc1)N1CCCCC[C@@H]1c1ccco1 ZINC000737851815 599468710 /nfs/dbraw/zinc/46/87/10/599468710.db2.gz JVIVAVQFRWZZOK-QGZVFWFLSA-N -1 3 365.437 3.536 20 0 FHADHM O=C(CCc1ccc(-c2nn[n-]n2)cc1)N1CCCCC[C@@H]1c1ccco1 ZINC000737851815 599468711 /nfs/dbraw/zinc/46/87/11/599468711.db2.gz JVIVAVQFRWZZOK-QGZVFWFLSA-N -1 3 365.437 3.536 20 0 FHADHM CO[C@H](CNc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)c1ccccc1 ZINC000821677404 599468762 /nfs/dbraw/zinc/46/87/62/599468762.db2.gz WHQSLAMCLBDCKF-OAHLLOKOSA-N -1 3 363.343 3.685 20 0 FHADHM CO[C@H](CNc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)c1ccccc1 ZINC000821677404 599468765 /nfs/dbraw/zinc/46/87/65/599468765.db2.gz WHQSLAMCLBDCKF-OAHLLOKOSA-N -1 3 363.343 3.685 20 0 FHADHM CC[C@H](NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(C)cc1 ZINC000820921132 599473967 /nfs/dbraw/zinc/47/39/67/599473967.db2.gz WFBDMDKUZJBLKP-KSSFIOAISA-N -1 3 364.453 3.687 20 0 FHADHM CC[C@H](NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(C)cc1 ZINC000820921132 599473969 /nfs/dbraw/zinc/47/39/69/599473969.db2.gz WFBDMDKUZJBLKP-KSSFIOAISA-N -1 3 364.453 3.687 20 0 FHADHM CCO[C@@H](C)c1nc(CSCc2ccccc2-c2nnn[n-]2)cs1 ZINC000736617131 599480875 /nfs/dbraw/zinc/48/08/75/599480875.db2.gz PWBLJEFTKBPFFA-NSHDSACASA-N -1 3 361.496 3.854 20 0 FHADHM CCO[C@@H](C)c1nc(CSCc2ccccc2-c2nn[n-]n2)cs1 ZINC000736617131 599480879 /nfs/dbraw/zinc/48/08/79/599480879.db2.gz PWBLJEFTKBPFFA-NSHDSACASA-N -1 3 361.496 3.854 20 0 FHADHM Fc1ccc(N2CCc3[nH]c4ccc(Cl)cc4c3C2)c(-c2nnn[n-]2)c1 ZINC000822779632 599483429 /nfs/dbraw/zinc/48/34/29/599483429.db2.gz ZCJBQLSQVNZALX-UHFFFAOYSA-N -1 3 368.803 3.703 20 0 FHADHM Fc1ccc(N2CCc3[nH]c4ccc(Cl)cc4c3C2)c(-c2nn[n-]n2)c1 ZINC000822779632 599483432 /nfs/dbraw/zinc/48/34/32/599483432.db2.gz ZCJBQLSQVNZALX-UHFFFAOYSA-N -1 3 368.803 3.703 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1NC1CCN(c2ccccc2)CC1 ZINC000822581522 599492007 /nfs/dbraw/zinc/49/20/07/599492007.db2.gz IVNLBEFOIJNRNJ-UHFFFAOYSA-N -1 3 354.845 3.601 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1NC1CCN(c2ccccc2)CC1 ZINC000822581522 599492008 /nfs/dbraw/zinc/49/20/08/599492008.db2.gz IVNLBEFOIJNRNJ-UHFFFAOYSA-N -1 3 354.845 3.601 20 0 FHADHM CC(C)(C(=O)OCc1ccccc1-c1nnn[n-]1)c1cccc(Cl)c1 ZINC000735582646 599499309 /nfs/dbraw/zinc/49/93/09/599499309.db2.gz MJMIDMQSFCRWGI-UHFFFAOYSA-N -1 3 356.813 3.541 20 0 FHADHM CC(C)(C(=O)OCc1ccccc1-c1nn[n-]n1)c1cccc(Cl)c1 ZINC000735582646 599499311 /nfs/dbraw/zinc/49/93/11/599499311.db2.gz MJMIDMQSFCRWGI-UHFFFAOYSA-N -1 3 356.813 3.541 20 0 FHADHM CC(C)(NC(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1cccc(F)c1 ZINC000735671772 599499361 /nfs/dbraw/zinc/49/93/61/599499361.db2.gz HLSDRQKFPSHRBB-UHFFFAOYSA-N -1 3 374.807 3.716 20 0 FHADHM CC(C)(NC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1cccc(F)c1 ZINC000735671772 599499363 /nfs/dbraw/zinc/49/93/63/599499363.db2.gz HLSDRQKFPSHRBB-UHFFFAOYSA-N -1 3 374.807 3.716 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N[C@H](C)c1ccc(F)cc1Cl ZINC000737292641 599502196 /nfs/dbraw/zinc/50/21/96/599502196.db2.gz WTUIBKNLJVCIOE-SNVBAGLBSA-N -1 3 374.807 3.850 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N[C@H](C)c1ccc(F)cc1Cl ZINC000737292641 599502199 /nfs/dbraw/zinc/50/21/99/599502199.db2.gz WTUIBKNLJVCIOE-SNVBAGLBSA-N -1 3 374.807 3.850 20 0 FHADHM Cc1cccc(C(C)(C)NC(=O)Nc2cc(-c3nnn[n-]3)ccc2C)c1 ZINC000737384587 599502205 /nfs/dbraw/zinc/50/22/05/599502205.db2.gz KZZWXUVSQQQGLI-UHFFFAOYSA-N -1 3 350.426 3.540 20 0 FHADHM Cc1cccc(C(C)(C)NC(=O)Nc2cc(-c3nn[n-]n3)ccc2C)c1 ZINC000737384587 599502208 /nfs/dbraw/zinc/50/22/08/599502208.db2.gz KZZWXUVSQQQGLI-UHFFFAOYSA-N -1 3 350.426 3.540 20 0 FHADHM Cc1ccc(N[C@H](C)C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1C ZINC000737360545 599504409 /nfs/dbraw/zinc/50/44/09/599504409.db2.gz QFDGXMDXIPKSJE-GFCCVEGCSA-N -1 3 370.844 3.576 20 0 FHADHM Cc1ccc(N[C@H](C)C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1C ZINC000737360545 599504413 /nfs/dbraw/zinc/50/44/13/599504413.db2.gz QFDGXMDXIPKSJE-GFCCVEGCSA-N -1 3 370.844 3.576 20 0 FHADHM C[C@H](NC(=O)c1csc2c1CC[C@@H](C)C2)c1cccc(-c2nnn[n-]2)c1 ZINC000820727091 599506912 /nfs/dbraw/zinc/50/69/12/599506912.db2.gz GMVMIZAXLOWDJE-NEPJUHHUSA-N -1 3 367.478 3.544 20 0 FHADHM C[C@H](NC(=O)c1csc2c1CC[C@@H](C)C2)c1cccc(-c2nn[n-]n2)c1 ZINC000820727091 599506913 /nfs/dbraw/zinc/50/69/13/599506913.db2.gz GMVMIZAXLOWDJE-NEPJUHHUSA-N -1 3 367.478 3.544 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1N1CCC(OC2CCCCC2)CC1 ZINC000822581559 599507552 /nfs/dbraw/zinc/50/75/52/599507552.db2.gz JUUBXQZHKGZSRW-UHFFFAOYSA-N -1 3 361.877 3.838 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1N1CCC(OC2CCCCC2)CC1 ZINC000822581559 599507554 /nfs/dbraw/zinc/50/75/54/599507554.db2.gz JUUBXQZHKGZSRW-UHFFFAOYSA-N -1 3 361.877 3.838 20 0 FHADHM CC(C)[C@H](CC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000820323779 599508701 /nfs/dbraw/zinc/50/87/01/599508701.db2.gz ZBOZAYGOBYUCTH-BEFAXECRSA-N -1 3 363.465 3.874 20 0 FHADHM CC(C)[C@H](CC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000820323779 599508702 /nfs/dbraw/zinc/50/87/02/599508702.db2.gz ZBOZAYGOBYUCTH-BEFAXECRSA-N -1 3 363.465 3.874 20 0 FHADHM C[C@@H](NC(=O)CCCc1ccc(Cl)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000820322404 599508967 /nfs/dbraw/zinc/50/89/67/599508967.db2.gz SCMIVZOMXQZOLD-CYBMUJFWSA-N -1 3 369.856 3.720 20 0 FHADHM C[C@@H](NC(=O)CCCc1ccc(Cl)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000820322404 599508970 /nfs/dbraw/zinc/50/89/70/599508970.db2.gz SCMIVZOMXQZOLD-CYBMUJFWSA-N -1 3 369.856 3.720 20 0 FHADHM C[C@@H](NC(=O)[C@H](C)c1cccc(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820315229 599511581 /nfs/dbraw/zinc/51/15/81/599511581.db2.gz MHORDSRGJXUZGE-VXGBXAGGSA-N -1 3 355.829 3.501 20 0 FHADHM C[C@@H](NC(=O)[C@H](C)c1cccc(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820315229 599511582 /nfs/dbraw/zinc/51/15/82/599511582.db2.gz MHORDSRGJXUZGE-VXGBXAGGSA-N -1 3 355.829 3.501 20 0 FHADHM CC(=CC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1Cl ZINC000819764147 599520297 /nfs/dbraw/zinc/52/02/97/599520297.db2.gz FWKCPFCTARKSIX-UKVQZPPCSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=CC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1Cl ZINC000819764147 599520299 /nfs/dbraw/zinc/52/02/99/599520299.db2.gz FWKCPFCTARKSIX-UKVQZPPCSA-N -1 3 367.840 3.801 20 0 FHADHM CC(C)C[C@@H](C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000820051795 599527493 /nfs/dbraw/zinc/52/74/93/599527493.db2.gz WNEVSLJLGWPKGB-DNVCBOLYSA-N -1 3 363.465 3.874 20 0 FHADHM CC(C)C[C@@H](C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000820051795 599527495 /nfs/dbraw/zinc/52/74/95/599527495.db2.gz WNEVSLJLGWPKGB-DNVCBOLYSA-N -1 3 363.465 3.874 20 0 FHADHM CC[C@H](Nc1ncc(-c2nnn[n-]2)cc1Cl)c1ccc(F)cc1F ZINC000736368935 599528198 /nfs/dbraw/zinc/52/81/98/599528198.db2.gz IRSGZXFMXGMRHT-ZDUSSCGKSA-N -1 3 350.760 3.757 20 0 FHADHM CC[C@H](Nc1ncc(-c2nn[n-]n2)cc1Cl)c1ccc(F)cc1F ZINC000736368935 599528199 /nfs/dbraw/zinc/52/81/99/599528199.db2.gz IRSGZXFMXGMRHT-ZDUSSCGKSA-N -1 3 350.760 3.757 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CC[C@H](C)C2)c1ccsc1 ZINC000736282015 599539123 /nfs/dbraw/zinc/53/91/23/599539123.db2.gz ZQWVBORVHLLDCG-VHSXEESVSA-N -1 3 373.507 3.857 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CC[C@H](C)C2)c1ccsc1 ZINC000736282015 599539125 /nfs/dbraw/zinc/53/91/25/599539125.db2.gz ZQWVBORVHLLDCG-VHSXEESVSA-N -1 3 373.507 3.857 20 0 FHADHM CCN(C(=O)[C@@H](C)c1cccs1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736502383 599542141 /nfs/dbraw/zinc/54/21/41/599542141.db2.gz MDOUUTSQNZRAIE-QWHCGFSZSA-N -1 3 355.467 3.641 20 0 FHADHM CCN(C(=O)[C@@H](C)c1cccs1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736502383 599542142 /nfs/dbraw/zinc/54/21/42/599542142.db2.gz MDOUUTSQNZRAIE-QWHCGFSZSA-N -1 3 355.467 3.641 20 0 FHADHM CC[C@H](CC(=O)N(C)c1ccc(-c2nnn[n-]2)cc1F)c1ccc(C)cc1 ZINC000736331816 599543861 /nfs/dbraw/zinc/54/38/61/599543861.db2.gz LKNSZWHDVOHZAA-CQSZACIVSA-N -1 3 367.428 3.861 20 0 FHADHM CC[C@H](CC(=O)N(C)c1ccc(-c2nn[n-]n2)cc1F)c1ccc(C)cc1 ZINC000736331816 599543864 /nfs/dbraw/zinc/54/38/64/599543864.db2.gz LKNSZWHDVOHZAA-CQSZACIVSA-N -1 3 367.428 3.861 20 0 FHADHM O=C(NC(c1cccs1)c1cccs1)c1cccc(-c2nnn[n-]2)c1 ZINC000738002184 599549822 /nfs/dbraw/zinc/54/98/22/599549822.db2.gz POZPCNISGJFFQR-UHFFFAOYSA-N -1 3 367.459 3.509 20 0 FHADHM O=C(NC(c1cccs1)c1cccs1)c1cccc(-c2nn[n-]n2)c1 ZINC000738002184 599549824 /nfs/dbraw/zinc/54/98/24/599549824.db2.gz POZPCNISGJFFQR-UHFFFAOYSA-N -1 3 367.459 3.509 20 0 FHADHM Fc1ccc(NCc2ccc(Br)cc2F)c(-c2nnn[n-]2)c1 ZINC000822782864 599550934 /nfs/dbraw/zinc/55/09/34/599550934.db2.gz JUQNYZXZFKSFCG-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1ccc(NCc2ccc(Br)cc2F)c(-c2nn[n-]n2)c1 ZINC000822782864 599550936 /nfs/dbraw/zinc/55/09/36/599550936.db2.gz JUQNYZXZFKSFCG-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM C[C@H]1CCCCN1C(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736265456 599561764 /nfs/dbraw/zinc/56/17/64/599561764.db2.gz BACJFYKNFRGOET-AWEZNQCLSA-N -1 3 362.437 3.625 20 0 FHADHM C[C@H]1C[C@@H](c2ccc(F)cc2)CN1c1c(-c2nnn[n-]2)cnc2ccccc21 ZINC000820668820 599563777 /nfs/dbraw/zinc/56/37/77/599563777.db2.gz XBXYNAVXMQFAAT-DZGCQCFKSA-N -1 3 374.423 3.936 20 0 FHADHM C[C@H]1C[C@@H](c2ccc(F)cc2)CN1c1c(-c2nn[n-]n2)cnc2ccccc21 ZINC000820668820 599563779 /nfs/dbraw/zinc/56/37/79/599563779.db2.gz XBXYNAVXMQFAAT-DZGCQCFKSA-N -1 3 374.423 3.936 20 0 FHADHM CC[C@H](C)[C@H](C)NC(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736335540 599564746 /nfs/dbraw/zinc/56/47/46/599564746.db2.gz YSOJPDZBMJHCTP-KBPBESRZSA-N -1 3 364.453 3.775 20 0 FHADHM CC[C@@H](C)CN(C)C(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736321942 599569173 /nfs/dbraw/zinc/56/91/73/599569173.db2.gz GSTAJTMDJFRVRX-CQSZACIVSA-N -1 3 364.453 3.728 20 0 FHADHM Cc1cccc2c1ncc(-c1nnn[n-]1)c2N1CC[C@H](Cc2ccccc2)C1 ZINC000822331937 599579579 /nfs/dbraw/zinc/57/95/79/599579579.db2.gz JOEZJBRPBGUSIM-QGZVFWFLSA-N -1 3 370.460 3.792 20 0 FHADHM Cc1cccc2c1ncc(-c1nn[n-]n1)c2N1CC[C@H](Cc2ccccc2)C1 ZINC000822331937 599579581 /nfs/dbraw/zinc/57/95/81/599579581.db2.gz JOEZJBRPBGUSIM-QGZVFWFLSA-N -1 3 370.460 3.792 20 0 FHADHM CS[C@@H]1CCCCN(c2c(-c3nnn[n-]3)cnc3c(C)cc(F)cc32)C1 ZINC000821956289 607385660 /nfs/dbraw/zinc/38/56/60/607385660.db2.gz LPOLVDYEXZYHMV-CYBMUJFWSA-N -1 3 372.473 3.584 20 0 FHADHM CS[C@@H]1CCCCN(c2c(-c3nn[n-]n3)cnc3c(C)cc(F)cc32)C1 ZINC000821956289 607385661 /nfs/dbraw/zinc/38/56/61/607385661.db2.gz LPOLVDYEXZYHMV-CYBMUJFWSA-N -1 3 372.473 3.584 20 0 FHADHM CC[C@H](C)[C@H]1CCCCN1C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000736330632 599599503 /nfs/dbraw/zinc/59/95/03/599599503.db2.gz NBXDFPDCTGRMAA-DZGCQCFKSA-N -1 3 373.505 3.856 20 0 FHADHM CC[C@H](C)[C@H]1CCCCN1C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000736330632 599599505 /nfs/dbraw/zinc/59/95/05/599599505.db2.gz NBXDFPDCTGRMAA-DZGCQCFKSA-N -1 3 373.505 3.856 20 0 FHADHM Cc1ccc([C@@H]2CCCCCN2C(=O)Nc2cccc(-c3nnn[n-]3)c2)o1 ZINC000737331042 599601915 /nfs/dbraw/zinc/60/19/15/599601915.db2.gz OMUKGYPSDKPNNX-INIZCTEOSA-N -1 3 366.425 3.917 20 0 FHADHM Cc1ccc([C@@H]2CCCCCN2C(=O)Nc2cccc(-c3nn[n-]n3)c2)o1 ZINC000737331042 599601917 /nfs/dbraw/zinc/60/19/17/599601917.db2.gz OMUKGYPSDKPNNX-INIZCTEOSA-N -1 3 366.425 3.917 20 0 FHADHM O=C(CC/C=C\c1ccccc1)OCc1cn2ccccc2c1-c1nnn[n-]1 ZINC000737825627 599606356 /nfs/dbraw/zinc/60/63/56/599606356.db2.gz NDLAQDBTMBGVFY-WMZJFQQLSA-N -1 3 373.416 3.656 20 0 FHADHM O=C(CC/C=C\c1ccccc1)OCc1cn2ccccc2c1-c1nn[n-]n1 ZINC000737825627 599606358 /nfs/dbraw/zinc/60/63/58/599606358.db2.gz NDLAQDBTMBGVFY-WMZJFQQLSA-N -1 3 373.416 3.656 20 0 FHADHM CC[C@H](C)[C@H]1CCCCN1C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736333244 599608472 /nfs/dbraw/zinc/60/84/72/599608472.db2.gz URPAMKSQLPTWSK-XHDPSFHLSA-N -1 3 362.865 3.953 20 0 FHADHM CC[C@H](C)[C@H]1CCCCN1C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736333244 599608473 /nfs/dbraw/zinc/60/84/73/599608473.db2.gz URPAMKSQLPTWSK-XHDPSFHLSA-N -1 3 362.865 3.953 20 0 FHADHM CC[C@H](NC(=O)Nc1cc(-c2nnn[n-]2)ccc1C)c1ccc(F)cc1F ZINC000736361642 599609878 /nfs/dbraw/zinc/60/98/78/599609878.db2.gz GYPHDBBKYOIERZ-HNNXBMFYSA-N -1 3 372.379 3.726 20 0 FHADHM CC[C@H](NC(=O)Nc1cc(-c2nn[n-]n2)ccc1C)c1ccc(F)cc1F ZINC000736361642 599609880 /nfs/dbraw/zinc/60/98/80/599609880.db2.gz GYPHDBBKYOIERZ-HNNXBMFYSA-N -1 3 372.379 3.726 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)N1CCC2(CCCC2)CC1 ZINC000738151566 599609884 /nfs/dbraw/zinc/60/98/84/599609884.db2.gz JJPXTZZZQJTKGU-UHFFFAOYSA-N -1 3 360.849 3.708 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)N1CCC2(CCCC2)CC1 ZINC000738151566 599609887 /nfs/dbraw/zinc/60/98/87/599609887.db2.gz JJPXTZZZQJTKGU-UHFFFAOYSA-N -1 3 360.849 3.708 20 0 FHADHM Cc1nc(C2CCCC2)sc1C(=O)OCc1cccc(-c2nnn[n-]2)c1 ZINC000822431870 599624001 /nfs/dbraw/zinc/62/40/01/599624001.db2.gz MYHAUWMJMIDKDP-UHFFFAOYSA-N -1 3 369.450 3.646 20 0 FHADHM Cc1nc(C2CCCC2)sc1C(=O)OCc1cccc(-c2nn[n-]n2)c1 ZINC000822431870 599624002 /nfs/dbraw/zinc/62/40/02/599624002.db2.gz MYHAUWMJMIDKDP-UHFFFAOYSA-N -1 3 369.450 3.646 20 0 FHADHM O=C(OCc1ccsc1)c1ccccc1-c1ccccc1-c1nnn[n-]1 ZINC000823440218 599626743 /nfs/dbraw/zinc/62/67/43/599626743.db2.gz IDIOPCMPITWBIL-UHFFFAOYSA-N -1 3 362.414 3.952 20 0 FHADHM O=C(OCc1ccsc1)c1ccccc1-c1ccccc1-c1nn[n-]n1 ZINC000823440218 599626744 /nfs/dbraw/zinc/62/67/44/599626744.db2.gz IDIOPCMPITWBIL-UHFFFAOYSA-N -1 3 362.414 3.952 20 0 FHADHM Cc1sc(NC(=O)[C@]2(C)CCc3ccccc3C2)c(-c2nnn[n-]2)c1C ZINC000822556362 599628815 /nfs/dbraw/zinc/62/88/15/599628815.db2.gz BMZSOODPJIQOIR-LJQANCHMSA-N -1 3 367.478 3.679 20 0 FHADHM Cc1sc(NC(=O)[C@]2(C)CCc3ccccc3C2)c(-c2nn[n-]n2)c1C ZINC000822556362 599628816 /nfs/dbraw/zinc/62/88/16/599628816.db2.gz BMZSOODPJIQOIR-LJQANCHMSA-N -1 3 367.478 3.679 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1cccc(F)c1Cl ZINC000823309449 599629820 /nfs/dbraw/zinc/62/98/20/599629820.db2.gz ZBKBJSCZXLRBFP-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1cccc(F)c1Cl ZINC000823309449 599629821 /nfs/dbraw/zinc/62/98/21/599629821.db2.gz ZBKBJSCZXLRBFP-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCCCC2)C(F)(F)F ZINC000819875675 599630324 /nfs/dbraw/zinc/63/03/24/599630324.db2.gz BKEDZMRGZFXDHF-QMMMGPOBSA-N -1 3 373.404 3.724 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCCCC2)C(F)(F)F ZINC000819875675 599630325 /nfs/dbraw/zinc/63/03/25/599630325.db2.gz BKEDZMRGZFXDHF-QMMMGPOBSA-N -1 3 373.404 3.724 20 0 FHADHM O=C(CCC1CCCC1)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000822950472 599633231 /nfs/dbraw/zinc/63/32/31/599633231.db2.gz PBAGGEUBGRBQPC-UHFFFAOYSA-N -1 3 353.348 3.794 20 0 FHADHM O=C(CCC1CCCC1)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000822950472 599633232 /nfs/dbraw/zinc/63/32/32/599633232.db2.gz PBAGGEUBGRBQPC-UHFFFAOYSA-N -1 3 353.348 3.794 20 0 FHADHM O=C(C=Cc1ccsc1)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000822936697 599633943 /nfs/dbraw/zinc/63/39/43/599633943.db2.gz XAEFVKJCAODRNB-RJRFIUFISA-N -1 3 365.340 3.599 20 0 FHADHM O=C(C=Cc1ccsc1)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000822936697 599633944 /nfs/dbraw/zinc/63/39/44/599633944.db2.gz XAEFVKJCAODRNB-RJRFIUFISA-N -1 3 365.340 3.599 20 0 FHADHM C[C@@H]1CC[C@@H](C)N(C(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)C1 ZINC000820686730 599635222 /nfs/dbraw/zinc/63/52/22/599635222.db2.gz ZRAFHLPVFZHRSF-HUUCEWRRSA-N -1 3 361.449 3.794 20 0 FHADHM C[C@@H]1CC[C@@H](C)N(C(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)C1 ZINC000820686730 599635223 /nfs/dbraw/zinc/63/52/23/599635223.db2.gz ZRAFHLPVFZHRSF-HUUCEWRRSA-N -1 3 361.449 3.794 20 0 FHADHM C[C@H](C(=O)OCc1cc(-c2nnn[n-]2)ccc1F)c1cccc(Cl)c1 ZINC000819884212 599665501 /nfs/dbraw/zinc/66/55/01/599665501.db2.gz UMHBLBVTJSWRKA-JTQLQIEISA-N -1 3 360.776 3.506 20 0 FHADHM C[C@H](C(=O)OCc1cc(-c2nn[n-]n2)ccc1F)c1cccc(Cl)c1 ZINC000819884212 599665502 /nfs/dbraw/zinc/66/55/02/599665502.db2.gz UMHBLBVTJSWRKA-JTQLQIEISA-N -1 3 360.776 3.506 20 0 FHADHM CCCC1CCC(NC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)CC1 ZINC000821040985 599672814 /nfs/dbraw/zinc/67/28/14/599672814.db2.gz WOSIJEFJCNDJAK-CBCUQQMYSA-N -1 3 356.474 3.586 20 0 FHADHM CCCC1CCC(NC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)CC1 ZINC000821040985 599672815 /nfs/dbraw/zinc/67/28/15/599672815.db2.gz WOSIJEFJCNDJAK-CBCUQQMYSA-N -1 3 356.474 3.586 20 0 FHADHM CC(C)CCN(C(=O)NCc1cc(-c2nnn[n-]2)ccc1F)C1CCCC1 ZINC000820072941 599679251 /nfs/dbraw/zinc/67/92/51/599679251.db2.gz OJOZAFGZLCLKLM-UHFFFAOYSA-N -1 3 374.464 3.506 20 0 FHADHM CC(C)CCN(C(=O)NCc1cc(-c2nn[n-]n2)ccc1F)C1CCCC1 ZINC000820072941 599679252 /nfs/dbraw/zinc/67/92/52/599679252.db2.gz OJOZAFGZLCLKLM-UHFFFAOYSA-N -1 3 374.464 3.506 20 0 FHADHM C[C@H](NC(=O)N1CCC(C2CCCC2)CC1)c1cccc(-c2nnn[n-]2)c1 ZINC000820339844 599682101 /nfs/dbraw/zinc/68/21/01/599682101.db2.gz HAXPBBGFQMILGB-AWEZNQCLSA-N -1 3 368.485 3.540 20 0 FHADHM C[C@H](NC(=O)N1CCC(C2CCCC2)CC1)c1cccc(-c2nn[n-]n2)c1 ZINC000820339844 599682102 /nfs/dbraw/zinc/68/21/02/599682102.db2.gz HAXPBBGFQMILGB-AWEZNQCLSA-N -1 3 368.485 3.540 20 0 FHADHM C[C@@H](CCOc1ccccc1)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820248658 599689471 /nfs/dbraw/zinc/68/94/71/599689471.db2.gz LZHVZKHCGQGTCN-LBPRGKRZSA-N -1 3 371.828 3.564 20 0 FHADHM C[C@@H](CCOc1ccccc1)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820248658 599689472 /nfs/dbraw/zinc/68/94/72/599689472.db2.gz LZHVZKHCGQGTCN-LBPRGKRZSA-N -1 3 371.828 3.564 20 0 FHADHM C[C@H](CCOc1ccccc1)C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000820249323 599689605 /nfs/dbraw/zinc/68/96/05/599689605.db2.gz USJRXKUJYMHCHA-GFCCVEGCSA-N -1 3 371.828 3.564 20 0 FHADHM C[C@H](CCOc1ccccc1)C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000820249323 599689606 /nfs/dbraw/zinc/68/96/06/599689606.db2.gz USJRXKUJYMHCHA-GFCCVEGCSA-N -1 3 371.828 3.564 20 0 FHADHM CC[C@@H](C)N(CC(=O)NCc1ccc(NC(=O)[O-])cc1)Cc1ccccc1 ZINC000736885524 599712452 /nfs/dbraw/zinc/71/24/52/599712452.db2.gz YBZMVSSPQPZNFO-MRXNPFEDSA-N -1 3 369.465 3.693 20 0 FHADHM Cc1cc(CNCc2ccc(F)c(Cl)c2)cc(C)c1OCC(=O)[O-] ZINC000738391393 599735598 /nfs/dbraw/zinc/73/55/98/599735598.db2.gz BTUHDGKPKBUCAX-UHFFFAOYSA-N -1 3 351.805 3.849 20 0 FHADHM C[C@@H](N[C@@H](c1ccccc1)C1CCC1)C(=O)NCc1ccc(C(=O)[O-])cc1 ZINC000736661645 599792487 /nfs/dbraw/zinc/79/24/87/599792487.db2.gz GOEHKCIXAVAHBB-QRWLVFNGSA-N -1 3 366.461 3.521 20 0 FHADHM CCCN(Cc1cc(C(=O)[O-])oc1C)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000737019342 599793807 /nfs/dbraw/zinc/79/38/07/599793807.db2.gz GWEGYZLISJBBKV-HNNXBMFYSA-N -1 3 366.458 3.508 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)Nc1cscc1C ZINC000825317839 607396071 /nfs/dbraw/zinc/39/60/71/607396071.db2.gz DJEDNUSWHLNQHL-UHFFFAOYSA-N -1 3 356.455 3.681 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)Nc1cscc1C ZINC000825317839 607396073 /nfs/dbraw/zinc/39/60/73/607396073.db2.gz DJEDNUSWHLNQHL-UHFFFAOYSA-N -1 3 356.455 3.681 20 0 FHADHM Cc1cc(C(=O)Nc2ccc(OC(C)C)c(-c3nnn[n-]3)c2)c(C)s1 ZINC000822177041 607398072 /nfs/dbraw/zinc/39/80/72/607398072.db2.gz RSXBQHREWXLQBM-UHFFFAOYSA-N -1 3 357.439 3.585 20 0 FHADHM Cc1cc(C(=O)Nc2ccc(OC(C)C)c(-c3nn[n-]n3)c2)c(C)s1 ZINC000822177041 607398074 /nfs/dbraw/zinc/39/80/74/607398074.db2.gz RSXBQHREWXLQBM-UHFFFAOYSA-N -1 3 357.439 3.585 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(OC(C)C)c(-c3nnn[n-]3)c2)c(C)c1 ZINC000822226438 607399787 /nfs/dbraw/zinc/39/97/87/607399787.db2.gz SATIMERDYHPGAH-UHFFFAOYSA-N -1 3 351.410 3.523 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(OC(C)C)c(-c3nn[n-]n3)c2)c(C)c1 ZINC000822226438 607399789 /nfs/dbraw/zinc/39/97/89/607399789.db2.gz SATIMERDYHPGAH-UHFFFAOYSA-N -1 3 351.410 3.523 20 0 FHADHM CN(CCCc1cc(-c2cccc(F)c2)n[nH]1)Cc1cc(C(=O)[O-])co1 ZINC000582611455 599856566 /nfs/dbraw/zinc/85/65/66/599856566.db2.gz DCYDWBPGOUKCQZ-UHFFFAOYSA-N -1 3 357.385 3.572 20 0 FHADHM O=C([O-])Nc1cccc(C(=O)NC[C@@H]2CCCCN2Cc2ccccc2)c1 ZINC000740029183 599910877 /nfs/dbraw/zinc/91/08/77/599910877.db2.gz PYPFNIMUPQSUDG-IBGZPJMESA-N -1 3 367.449 3.561 20 0 FHADHM COc1ccccc1C(C)(C)NCc1cc(C)c(OCC(=O)[O-])c(C)c1 ZINC000738120215 599986727 /nfs/dbraw/zinc/98/67/27/599986727.db2.gz LFYQMNFKMQNDSY-UHFFFAOYSA-N -1 3 357.450 3.800 20 0 FHADHM Cc1cc(NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)ccc1C(=O)[O-] ZINC000738441212 600012696 /nfs/dbraw/zinc/01/26/96/600012696.db2.gz JWENICLUIDUHOI-CRAIPNDOSA-N -1 3 367.449 3.650 20 0 FHADHM O=C([O-])c1ccc(NC(=O)CN[C@@H](c2ccc(Cl)cc2)C2CC2)cc1 ZINC000739307460 600048978 /nfs/dbraw/zinc/04/89/78/600048978.db2.gz NZYADWIOKZTTNT-GOSISDBHSA-N -1 3 358.825 3.718 20 0 FHADHM CC[C@H](C)c1ccc([C@H](NCC(=O)N2CCC(C(=O)[O-])CC2)C(C)C)cc1 ZINC000736891282 600049837 /nfs/dbraw/zinc/04/98/37/600049837.db2.gz MOXVQCACHHBGOD-HRAATJIYSA-N -1 3 374.525 3.810 20 0 FHADHM C[C@H](c1ccc(C(=O)[O-])o1)N1CCC([C@H](C)NC(=O)OC(C)(C)C)CC1 ZINC000736651659 600093520 /nfs/dbraw/zinc/09/35/20/600093520.db2.gz ZWZXGEQTDRUEPT-QWHCGFSZSA-N -1 3 366.458 3.664 20 0 FHADHM CCCCc1ccc([C@@H](NCC(=O)N2CCC(C(=O)[O-])CC2)C(C)C)cc1 ZINC000737000842 600097101 /nfs/dbraw/zinc/09/71/01/600097101.db2.gz DSCUZERKCHGZOX-NRFANRHFSA-N -1 3 374.525 3.639 20 0 FHADHM CN(Cc1nc2ccccc2c(-c2ccccc2)c1C(=O)[O-])[C@H]1CCOC1 ZINC000579719682 600111362 /nfs/dbraw/zinc/11/13/62/600111362.db2.gz HEZNBESOKSAVKU-INIZCTEOSA-N -1 3 362.429 3.821 20 0 FHADHM Cc1ccc(C(=O)[O-])cc1NC(=O)CN[C@H](c1ccc(F)cc1)C(C)C ZINC000738530616 600119120 /nfs/dbraw/zinc/11/91/20/600119120.db2.gz GALVRQFVHBWJDV-IBGZPJMESA-N -1 3 358.413 3.758 20 0 FHADHM Cc1ccc(C(=O)[O-])cc1NC(=O)CN[C@@H](c1ccc(F)cc1)C(C)C ZINC000738530619 600119162 /nfs/dbraw/zinc/11/91/62/600119162.db2.gz GALVRQFVHBWJDV-LJQANCHMSA-N -1 3 358.413 3.758 20 0 FHADHM CC[C@@](NCc1cc(=O)oc2cc(C)ccc12)(C(=O)[O-])c1ccccc1 ZINC000736917496 600127121 /nfs/dbraw/zinc/12/71/21/600127121.db2.gz NCTMHULYMIFCIA-NRFANRHFSA-N -1 3 351.402 3.581 20 0 FHADHM CC[C@](NCc1csc(Br)c1)(C(=O)[O-])c1ccccc1 ZINC000736920157 600132888 /nfs/dbraw/zinc/13/28/88/600132888.db2.gz IMAQLNQFHRZLRB-OAHLLOKOSA-N -1 3 354.269 3.990 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@@H]2C[C@H]2c2sccc2C)s1 ZINC000825694649 607429754 /nfs/dbraw/zinc/42/97/54/607429754.db2.gz YHGYWRWLWRFFIH-GHMZBOCLSA-N -1 3 359.480 3.603 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@@H]2C[C@H]2c2sccc2C)s1 ZINC000825694649 607429756 /nfs/dbraw/zinc/42/97/56/607429756.db2.gz YHGYWRWLWRFFIH-GHMZBOCLSA-N -1 3 359.480 3.603 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1CCCc2ccc(Cl)c(C)c21 ZINC000826245355 607432404 /nfs/dbraw/zinc/43/24/04/607432404.db2.gz VKSROBGDWWGYRH-UHFFFAOYSA-N -1 3 367.840 3.730 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1CCCc2ccc(Cl)c(C)c21 ZINC000826245355 607432405 /nfs/dbraw/zinc/43/24/05/607432405.db2.gz VKSROBGDWWGYRH-UHFFFAOYSA-N -1 3 367.840 3.730 20 0 FHADHM CC(C)c1ccc(SCC(=O)N(C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000824347902 607434497 /nfs/dbraw/zinc/43/44/97/607434497.db2.gz RXTFZIDLERKULJ-UHFFFAOYSA-N -1 3 367.478 3.745 20 0 FHADHM CC(C)c1ccc(SCC(=O)N(C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000824347902 607434498 /nfs/dbraw/zinc/43/44/98/607434498.db2.gz RXTFZIDLERKULJ-UHFFFAOYSA-N -1 3 367.478 3.745 20 0 FHADHM C[C@@H]1CN2CCCC[C@@H]2CN1Cc1csc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000736822095 600321595 /nfs/dbraw/zinc/32/15/95/600321595.db2.gz PBVXATYXKVMZQF-RDTXWAMCSA-N -1 3 371.506 3.567 20 0 FHADHM CCC[C@@](C)(NCc1csc(-c2cccc(OC)c2OC)n1)C(=O)[O-] ZINC000736963213 600322682 /nfs/dbraw/zinc/32/26/82/600322682.db2.gz UWOJLJWYSFDFBN-GOSISDBHSA-N -1 3 364.467 3.560 20 0 FHADHM O=C([O-])[C@@H](c1cccc(Cl)c1)N1CCC([C@@H](O)c2ccccc2)CC1 ZINC000739519227 600397307 /nfs/dbraw/zinc/39/73/07/600397307.db2.gz WTHIQXFZKDGQFV-MOPGFXCFSA-N -1 3 359.853 3.911 20 0 FHADHM CC(C)c1nc([C@@H]2CCCN([C@H](C(=O)[O-])c3cccc(Cl)c3)C2)no1 ZINC000581374928 600401938 /nfs/dbraw/zinc/40/19/38/600401938.db2.gz HXJZMHAWCPIMQZ-HIFRSBDPSA-N -1 3 363.845 3.852 20 0 FHADHM CN(C)Cc1c2ccccc2oc1C(=O)Nc1ccc(F)c(C(=O)[O-])c1 ZINC000737367651 600405158 /nfs/dbraw/zinc/40/51/58/600405158.db2.gz ARJXLEULQVYMEV-UHFFFAOYSA-N -1 3 356.353 3.584 20 0 FHADHM C[C@@H](C(=O)Nc1cccc(CSCCC(=O)[O-])c1)N1CCCCCC1 ZINC000736218512 600409390 /nfs/dbraw/zinc/40/93/90/600409390.db2.gz OYAVSPYIDDLRAM-HNNXBMFYSA-N -1 3 364.511 3.598 20 0 FHADHM Cc1ccc(-c2cncc(C(=O)N(C)c3ccc(-c4nnn[n-]4)cc3)c2)cc1 ZINC000826273507 607442653 /nfs/dbraw/zinc/44/26/53/607442653.db2.gz HODMKSAUXGCHBG-UHFFFAOYSA-N -1 3 370.416 3.514 20 0 FHADHM Cc1ccc(-c2cncc(C(=O)N(C)c3ccc(-c4nn[n-]n4)cc3)c2)cc1 ZINC000826273507 607442654 /nfs/dbraw/zinc/44/26/54/607442654.db2.gz HODMKSAUXGCHBG-UHFFFAOYSA-N -1 3 370.416 3.514 20 0 FHADHM O=C([O-])[C@H](NCc1ccc(COCC(F)(F)F)cc1)c1ccc(F)cc1 ZINC000739498578 600419964 /nfs/dbraw/zinc/41/99/64/600419964.db2.gz AWHBYOUOVLOFHV-MRXNPFEDSA-N -1 3 371.330 3.820 20 0 FHADHM COc1ccc(CN[C@H](C(=O)[O-])c2cccc(Cl)c2)cc1OC(F)F ZINC000426739217 600422015 /nfs/dbraw/zinc/42/20/15/600422015.db2.gz AQPWAAGZIJWPOB-HNNXBMFYSA-N -1 3 371.767 3.866 20 0 FHADHM COCc1cccc(CN[C@@H](C(=O)[O-])c2ccc(Br)cc2)c1 ZINC000426796618 600423381 /nfs/dbraw/zinc/42/33/81/600423381.db2.gz CNWQXLVNPPMUEB-MRXNPFEDSA-N -1 3 364.239 3.511 20 0 FHADHM C[C@H](N[C@H](C(=O)[O-])c1cccc(Cl)c1)c1ccc2c(c1)CCC(=O)N2 ZINC000736661267 600424107 /nfs/dbraw/zinc/42/41/07/600424107.db2.gz DNUZQFPEDATECJ-VOJFVSQTSA-N -1 3 358.825 3.701 20 0 FHADHM CC[C@H](C)C(=O)Nc1cccc(CN[C@H](C(=O)[O-])c2ccc(F)cc2)c1 ZINC000736870175 600424902 /nfs/dbraw/zinc/42/49/02/600424902.db2.gz JWZBTTCBKFQIEN-UGSOOPFHSA-N -1 3 358.413 3.726 20 0 FHADHM CCOc1c(Cl)cc(CN[C@@H](C(=O)[O-])c2ccc(F)cc2)cc1OC ZINC000737179407 600426421 /nfs/dbraw/zinc/42/64/21/600426421.db2.gz IGTGJEOQRBNCRV-MRXNPFEDSA-N -1 3 367.804 3.802 20 0 FHADHM O=C([O-])[C@@H](NCc1cccc(NC(=O)C2CCCC2)c1)c1ccccc1 ZINC000738511024 600426750 /nfs/dbraw/zinc/42/67/50/600426750.db2.gz RZGXEESRHWQCML-IBGZPJMESA-N -1 3 352.434 3.731 20 0 FHADHM COc1cc(CN[C@H](C(=O)[O-])c2ccc(Br)cc2)ccc1C ZINC000737885625 600427392 /nfs/dbraw/zinc/42/73/92/600427392.db2.gz CXLMUVNNOBVBKS-INIZCTEOSA-N -1 3 364.239 3.682 20 0 FHADHM O=C([O-])[C@H](NCc1ccc(Br)c(F)c1)c1ccc(F)cc1 ZINC000739499873 600431109 /nfs/dbraw/zinc/43/11/09/600431109.db2.gz KPZVCRKEKVLVPU-CQSZACIVSA-N -1 3 356.166 3.643 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@@H]1C(=O)N(C)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000826316542 607444376 /nfs/dbraw/zinc/44/43/76/607444376.db2.gz RMMCKQWOBHSMIR-OLZOCXBDSA-N -1 3 373.869 3.657 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@@H]1C(=O)N(C)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000826316542 607444378 /nfs/dbraw/zinc/44/43/78/607444378.db2.gz RMMCKQWOBHSMIR-OLZOCXBDSA-N -1 3 373.869 3.657 20 0 FHADHM Cc1ccc(C(=O)[O-])cc1NC(=O)[C@@H](C)N1CCC[C@]2(CC=CCC2)C1 ZINC000738518669 600449926 /nfs/dbraw/zinc/44/99/26/600449926.db2.gz MPAJSEOISUTNFZ-IIBYNOLFSA-N -1 3 356.466 3.843 20 0 FHADHM Cc1cc(NC(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)ccc1O ZINC000822209515 607446542 /nfs/dbraw/zinc/44/65/42/607446542.db2.gz MBXZVEQLHQQPKG-UHFFFAOYSA-N -1 3 371.400 3.800 20 0 FHADHM Cc1cc(NC(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)ccc1O ZINC000822209515 607446543 /nfs/dbraw/zinc/44/65/43/607446543.db2.gz MBXZVEQLHQQPKG-UHFFFAOYSA-N -1 3 371.400 3.800 20 0 FHADHM Cc1cc(C)c(-c2nnn[n-]2)c(SCc2noc(C3CCCCC3)n2)n1 ZINC000822192886 607461978 /nfs/dbraw/zinc/46/19/78/607461978.db2.gz DWHFFSVDHANPRF-UHFFFAOYSA-N -1 3 371.470 3.602 20 0 FHADHM Cc1cc(C)c(-c2nn[n-]n2)c(SCc2noc(C3CCCCC3)n2)n1 ZINC000822192886 607461980 /nfs/dbraw/zinc/46/19/80/607461980.db2.gz DWHFFSVDHANPRF-UHFFFAOYSA-N -1 3 371.470 3.602 20 0 FHADHM Cc1cccc([C@H](C)N[C@@H]2CCN(c3sccc3C(=O)[O-])C2=O)c1C ZINC000832966302 600694034 /nfs/dbraw/zinc/69/40/34/600694034.db2.gz MJFQFCCSVGSUNH-XJKSGUPXSA-N -1 3 358.463 3.519 20 0 FHADHM O=C([O-])[C@@H](NCCOc1ccc(C(F)(F)F)cc1)c1ccccc1F ZINC000833165285 600740128 /nfs/dbraw/zinc/74/01/28/600740128.db2.gz HWMRRIISSABHFY-HNNXBMFYSA-N -1 3 357.303 3.639 20 0 FHADHM O=C([O-])[C@@H](N[C@@H]1CCN(c2ccccc2)C1)c1ccc(Cl)cc1Cl ZINC000833168563 600748487 /nfs/dbraw/zinc/74/84/87/600748487.db2.gz YLIKGPGIJVEINZ-DYVFJYSZSA-N -1 3 365.260 3.988 20 0 FHADHM O=C([O-])[C@H](N[C@H]1CCN(c2ccccc2)C1)c1ccc(Cl)cc1Cl ZINC000833168565 600748645 /nfs/dbraw/zinc/74/86/45/600748645.db2.gz YLIKGPGIJVEINZ-SUMWQHHRSA-N -1 3 365.260 3.988 20 0 FHADHM COc1cc(CN(C)[C@@H](C(=O)[O-])c2ccccc2)c(SC)cc1OC ZINC000737881437 600795596 /nfs/dbraw/zinc/79/55/96/600795596.db2.gz OCCOJVFAKPFRKT-GOSISDBHSA-N -1 3 361.463 3.683 20 0 FHADHM CC[C@H](Cc1ccc(C)cc1)N(C)CC(=O)N(C)c1ccccc1C(=O)[O-] ZINC000828890531 600839519 /nfs/dbraw/zinc/83/95/19/600839519.db2.gz ILEOMDWODMZTNL-GOSISDBHSA-N -1 3 368.477 3.609 20 0 FHADHM Cc1cccc([C@@H]2CCCN2CC(=O)N(C)c2ccccc2C(=O)[O-])c1C ZINC000738698629 600978960 /nfs/dbraw/zinc/97/89/60/600978960.db2.gz PXQOMDFLXLIXOO-FQEVSTJZSA-N -1 3 366.461 3.802 20 0 FHADHM C[C@H](c1ccc(C(=O)[O-])o1)N1CCC[C@@H](c2cc(C(F)(F)F)n[nH]2)C1 ZINC000736715926 601118700 /nfs/dbraw/zinc/11/87/00/601118700.db2.gz DCERUPNENWATAB-NXEZZACHSA-N -1 3 357.332 3.660 20 0 FHADHM C[C@@H](C(=O)[O-])[C@H](NCC(=O)N[C@@H](C)c1ccccc1Cl)c1ccccc1 ZINC000827637397 601202941 /nfs/dbraw/zinc/20/29/41/601202941.db2.gz SQMXMDPTDTWARK-TYILLQQXSA-N -1 3 374.868 3.569 20 0 FHADHM C[C@H](C(=O)[O-])[C@@H](NCC(=O)Nc1cccc2ccccc21)c1ccccc1 ZINC000826054322 601204006 /nfs/dbraw/zinc/20/40/06/601204006.db2.gz LZZURIAYOXHJRK-YCRPNKLZSA-N -1 3 362.429 3.830 20 0 FHADHM O=C([O-])c1sc(NC[C@H](c2cccs2)N2CCCC2)nc1Cl ZINC000833347222 601246176 /nfs/dbraw/zinc/24/61/76/601246176.db2.gz YTWBNBFERAUKHW-SECBINFHSA-N -1 3 357.888 3.805 20 0 FHADHM CCN(C(=O)c1cnc(C(C)C)s1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821160664 607498682 /nfs/dbraw/zinc/49/86/82/607498682.db2.gz OIMZDUWAGOFZIG-GFCCVEGCSA-N -1 3 370.482 3.670 20 0 FHADHM CCN(C(=O)c1cnc(C(C)C)s1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821160664 607498684 /nfs/dbraw/zinc/49/86/84/607498684.db2.gz OIMZDUWAGOFZIG-GFCCVEGCSA-N -1 3 370.482 3.670 20 0 FHADHM Cc1ccc(NC(=O)[C@H](NCC2(C(=O)[O-])CCCC2)c2ccccc2)cc1 ZINC000832941159 601369479 /nfs/dbraw/zinc/36/94/79/601369479.db2.gz GRGAYEALHFZXHN-LJQANCHMSA-N -1 3 366.461 3.909 20 0 FHADHM O=C([O-])c1sccc1CN(Cc1ccccc1)C[C@H](O)c1ccco1 ZINC000833347980 601493488 /nfs/dbraw/zinc/49/34/88/601493488.db2.gz YOBGUDAESAZKSY-INIZCTEOSA-N -1 3 357.431 3.775 20 0 FHADHM C[C@@H]1CN(Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)C[C@@H]1C(=O)[O-] ZINC000828465983 601518856 /nfs/dbraw/zinc/51/88/56/601518856.db2.gz ZVTLPYJYGXHUBH-YGRLFVJLSA-N -1 3 370.396 3.981 20 0 FHADHM CSc1ccc2cc(CN3C[C@@H](C)[C@H](C(=O)[O-])C3)c(Cl)nc2c1 ZINC000817872924 601528360 /nfs/dbraw/zinc/52/83/60/601528360.db2.gz JYYCQLNQDYYIPU-QMTHXVAHSA-N -1 3 350.871 3.763 20 0 FHADHM O=C([O-])c1ccc(CN(Cc2ccccc2)C[C@@H](O)c2ccco2)cc1 ZINC000833315536 601611713 /nfs/dbraw/zinc/61/17/13/601611713.db2.gz YSBNGQKUYJZKPP-LJQANCHMSA-N -1 3 351.402 3.714 20 0 FHADHM O=C([O-])c1ccc(CN2CCC(OCCc3ccccc3)CC2)cc1F ZINC000579007404 601623065 /nfs/dbraw/zinc/62/30/65/601623065.db2.gz KQLOPWJXFLBGNT-UHFFFAOYSA-N -1 3 357.425 3.748 20 0 FHADHM CC(C)c1ccc(NC(=O)CN[C@@H](c2ccccc2)[C@@H](C)C(=O)[O-])cc1 ZINC000827123806 601655544 /nfs/dbraw/zinc/65/55/44/601655544.db2.gz DTFDSVWHHAZNET-FOIQADDNSA-N -1 3 354.450 3.800 20 0 FHADHM COc1cc(CNCc2c[nH]c(C(=O)[O-])c2)ccc1OCc1ccccc1 ZINC000832000491 601831444 /nfs/dbraw/zinc/83/14/44/601831444.db2.gz QCOXJVWHRJRSTP-UHFFFAOYSA-N -1 3 366.417 3.590 20 0 FHADHM C[C@@H](CCC(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2)c1ccccc1 ZINC000824402382 607530233 /nfs/dbraw/zinc/53/02/33/607530233.db2.gz WFVZYHFMIXBDAW-LBPRGKRZSA-N -1 3 367.478 3.939 20 0 FHADHM C[C@@H](CCC(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2)c1ccccc1 ZINC000824402382 607530235 /nfs/dbraw/zinc/53/02/35/607530235.db2.gz WFVZYHFMIXBDAW-LBPRGKRZSA-N -1 3 367.478 3.939 20 0 FHADHM CN(Cc1cccc2cccnc21)[C@H](C(=O)[O-])c1cc(F)c(F)c(F)c1 ZINC000830851505 601906468 /nfs/dbraw/zinc/90/64/68/601906468.db2.gz AIPATEJEGSIWNC-SFHVURJKSA-N -1 3 360.335 3.910 20 0 FHADHM C[C@@H](c1nnc(-c2ccc(Cl)cc2Cl)o1)N1CC[C@](C)(C(=O)[O-])C1 ZINC000827966705 601919842 /nfs/dbraw/zinc/91/98/42/601919842.db2.gz UEDICSLEMRFLIX-FVMDXXJSSA-N -1 3 370.236 3.901 20 0 FHADHM C[C@]1(C(=O)[O-])CCN([C@@H](c2nc(-c3ccccc3)no2)c2ccccc2)C1 ZINC000263078670 601944412 /nfs/dbraw/zinc/94/44/12/601944412.db2.gz GQSUWOUNSDGQAU-UTKZUKDTSA-N -1 3 363.417 3.623 20 0 FHADHM C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCCCN1Cc1ccc(C(=O)[O-])s1 ZINC000827688040 601946830 /nfs/dbraw/zinc/94/68/30/601946830.db2.gz QQKAMBVGSHAJNV-GXTWGEPZSA-N -1 3 368.499 3.714 20 0 FHADHM O=C([O-])N1CCC[C@H](CNCc2csc(-c3ccc(Cl)cc3)n2)C1 ZINC000740511529 602002638 /nfs/dbraw/zinc/00/26/38/602002638.db2.gz FXPSHWGDPMSTCK-GFCCVEGCSA-N -1 3 365.886 3.943 20 0 FHADHM O=C([O-])NCCc1ccc(CNCc2ccc(Br)cc2)cc1 ZINC000740672550 602003805 /nfs/dbraw/zinc/00/38/05/602003805.db2.gz JLBFYKBUVOYBCG-UHFFFAOYSA-N -1 3 363.255 3.549 20 0 FHADHM C[C@@H](CCC(=O)OCc1ccc(F)c(-c2nnn[n-]2)c1)c1ccccc1 ZINC000824402133 607553152 /nfs/dbraw/zinc/55/31/52/607553152.db2.gz UPDCORSABXMEQO-ZDUSSCGKSA-N -1 3 354.385 3.633 20 0 FHADHM C[C@@H](CCC(=O)OCc1ccc(F)c(-c2nn[n-]n2)c1)c1ccccc1 ZINC000824402133 607553154 /nfs/dbraw/zinc/55/31/54/607553154.db2.gz UPDCORSABXMEQO-ZDUSSCGKSA-N -1 3 354.385 3.633 20 0 FHADHM CC[C@@](C)(CC(=O)[O-])NCc1ncc(-c2ccccc2Br)o1 ZINC000828672869 602221050 /nfs/dbraw/zinc/22/10/50/602221050.db2.gz XFMWVECNCFWMMD-INIZCTEOSA-N -1 3 367.243 3.837 20 0 FHADHM C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2ccc(NC(=O)[O-])cc2)C1 ZINC000739056255 602603964 /nfs/dbraw/zinc/60/39/64/602603964.db2.gz CWARDSDQRZZRJV-KDOFPFPSSA-N -1 3 368.437 3.734 20 0 FHADHM CC[C@@H](SC)C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCCCC2 ZINC000825158997 607577731 /nfs/dbraw/zinc/57/77/31/607577731.db2.gz GSHADCFEZGNMEO-LLVKDONJSA-N -1 3 365.528 3.667 20 0 FHADHM CC[C@@H](SC)C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCCCC2 ZINC000825158997 607577732 /nfs/dbraw/zinc/57/77/32/607577732.db2.gz GSHADCFEZGNMEO-LLVKDONJSA-N -1 3 365.528 3.667 20 0 FHADHM CC[C@@H](SC)C(=O)Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000825159134 607577985 /nfs/dbraw/zinc/57/79/85/607577985.db2.gz JNWIULNABXHMQC-MRXNPFEDSA-N -1 3 369.450 3.739 20 0 FHADHM CC[C@@H](SC)C(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000825159134 607577987 /nfs/dbraw/zinc/57/79/87/607577987.db2.gz JNWIULNABXHMQC-MRXNPFEDSA-N -1 3 369.450 3.739 20 0 FHADHM COc1cc(CN2CCC[C@H]([C@@H]3CCCN3C(=O)[O-])C2)ccc1SC ZINC000739856471 602735551 /nfs/dbraw/zinc/73/55/51/602735551.db2.gz BEJUZMYEBPFYLW-HOTGVXAUSA-N -1 3 364.511 3.772 20 0 FHADHM Cc1ccc(-c2nc(CN[C@H](C)[C@@H]3CCCN(C(=O)[O-])C3)cs2)cc1 ZINC000740092644 602876567 /nfs/dbraw/zinc/87/65/67/602876567.db2.gz OOJZGUXHQARROU-GDBMZVCRSA-N -1 3 359.495 3.987 20 0 FHADHM CC(C)(C)CCN1CCN(C(=O)Nc2cc(NC(=O)[O-])ccc2F)CC1 ZINC000738696695 603038870 /nfs/dbraw/zinc/03/88/70/603038870.db2.gz KAPQHZIFDIRXRR-UHFFFAOYSA-N -1 3 366.437 3.501 20 0 FHADHM O=C([O-])NC[C@H]1CCCC[C@@H]1NCc1csc(-c2cccs2)n1 ZINC000832514573 603172524 /nfs/dbraw/zinc/17/25/24/603172524.db2.gz NIHRFDRKTHZFPV-YPMHNXCESA-N -1 3 351.497 3.788 20 0 FHADHM O=C([O-])N[C@@H](CNCc1ccc(Br)s1)c1ccccc1 ZINC000832142144 603176659 /nfs/dbraw/zinc/17/66/59/603176659.db2.gz ZLQDGXLWYYDBIG-LBPRGKRZSA-N -1 3 355.257 3.609 20 0 FHADHM C[C@@H]1CN(Cc2c(-c3ccccc3)nc3sccn23)CC[C@H]1NC(=O)[O-] ZINC000739185909 603185723 /nfs/dbraw/zinc/18/57/23/603185723.db2.gz RCRPZOAUIZQIMA-UKRRQHHQSA-N -1 3 370.478 3.541 20 0 FHADHM Cc1cc(C(F)(F)F)c(-c2nnn[n-]2)c(SC[C@@H](C)C(F)(F)F)n1 ZINC000826262277 607656262 /nfs/dbraw/zinc/65/62/62/607656262.db2.gz KJBFJYYWCZYMTO-RXMQYKEDSA-N -1 3 371.310 3.879 20 0 FHADHM CC[C@H](C)Oc1cccc(NC(=O)c2ccc(-c3nnn[n-]3)cc2C)c1 ZINC000825076996 607669187 /nfs/dbraw/zinc/66/91/87/607669187.db2.gz ZXPHAWZLYLMNIQ-ZDUSSCGKSA-N -1 3 351.410 3.605 20 0 FHADHM CC[C@H](C)Oc1cccc(NC(=O)c2ccc(-c3nn[n-]n3)cc2C)c1 ZINC000825076996 607669188 /nfs/dbraw/zinc/66/91/88/607669188.db2.gz ZXPHAWZLYLMNIQ-ZDUSSCGKSA-N -1 3 351.410 3.605 20 0 FHADHM Cc1ccc(CN(C)C)cc1NC(=O)[C@H](C)[C@@H](NC(=O)[O-])c1ccccc1 ZINC000830308824 604084626 /nfs/dbraw/zinc/08/46/26/604084626.db2.gz OUPPHZDTOIJIDQ-DNVCBOLYSA-N -1 3 369.465 3.640 20 0 FHADHM Cc1ccc(CN(C)C)cc1NC(=O)[C@@H](C)[C@@H](NC(=O)[O-])c1ccccc1 ZINC000830308825 604084908 /nfs/dbraw/zinc/08/49/08/604084908.db2.gz OUPPHZDTOIJIDQ-HNAYVOBHSA-N -1 3 369.465 3.640 20 0 FHADHM Cc1ccc([C@@H]2CCCN2C(=O)c2ccc(-c3nnn[n-]3)cc2C)cc1C ZINC000826285862 607672345 /nfs/dbraw/zinc/67/23/45/607672345.db2.gz LWOFIZPEFQEFQI-IBGZPJMESA-N -1 3 361.449 3.769 20 0 FHADHM Cc1ccc([C@@H]2CCCN2C(=O)c2ccc(-c3nn[n-]n3)cc2C)cc1C ZINC000826285862 607672347 /nfs/dbraw/zinc/67/23/47/607672347.db2.gz LWOFIZPEFQEFQI-IBGZPJMESA-N -1 3 361.449 3.769 20 0 FHADHM CCN(C(=O)c1ccc(-c2nnn[n-]2)cc1C)c1cccc2ccccc21 ZINC000825379911 607674920 /nfs/dbraw/zinc/67/49/20/607674920.db2.gz MBHBSIHIWMWRQK-UHFFFAOYSA-N -1 3 357.417 3.995 20 0 FHADHM CCN(C(=O)c1ccc(-c2nn[n-]n2)cc1C)c1cccc2ccccc21 ZINC000825379911 607674922 /nfs/dbraw/zinc/67/49/22/607674922.db2.gz MBHBSIHIWMWRQK-UHFFFAOYSA-N -1 3 357.417 3.995 20 0 FHADHM Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)c2ccc(-c3nnn[n-]3)cc2C)C1 ZINC000826244232 607693422 /nfs/dbraw/zinc/69/34/22/607693422.db2.gz KZRLKCVBUOHIBC-NVXWUHKLSA-N -1 3 361.449 3.502 20 0 FHADHM Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)c2ccc(-c3nn[n-]n3)cc2C)C1 ZINC000826244232 607693423 /nfs/dbraw/zinc/69/34/23/607693423.db2.gz KZRLKCVBUOHIBC-NVXWUHKLSA-N -1 3 361.449 3.502 20 0 FHADHM C[C@H](c1ccc2ccccc2c1)N(C(=O)c1ccc(-c2nnn[n-]2)[nH]1)C1CC1 ZINC000824762543 607704631 /nfs/dbraw/zinc/70/46/31/607704631.db2.gz HDIYGDXRCKFNNM-CYBMUJFWSA-N -1 3 372.432 3.714 20 0 FHADHM C[C@H](c1ccc2ccccc2c1)N(C(=O)c1ccc(-c2nn[n-]n2)[nH]1)C1CC1 ZINC000824762543 607704633 /nfs/dbraw/zinc/70/46/33/607704633.db2.gz HDIYGDXRCKFNNM-CYBMUJFWSA-N -1 3 372.432 3.714 20 0 FHADHM CC[C@H](Cc1ccccc1)N(CC)C(=O)c1ccc(-c2nn[n-]n2)cc1C ZINC000825127835 607705645 /nfs/dbraw/zinc/70/56/45/607705645.db2.gz OUIZNXHPMRPBMS-GOSISDBHSA-N -1 3 363.465 3.659 20 0 FHADHM CC[C@H](Cc1ccccc1)N(CC)C(=O)c1ccc(-c2nnn[n-]2)cc1C ZINC000825127835 607705644 /nfs/dbraw/zinc/70/56/44/607705644.db2.gz OUIZNXHPMRPBMS-GOSISDBHSA-N -1 3 363.465 3.659 20 0 FHADHM C[C@@H](NCc1ccc(CCNC(=O)[O-])cc1)c1cnc2ccsc2c1 ZINC000825503945 604942393 /nfs/dbraw/zinc/94/23/93/604942393.db2.gz ZOBDVQWKGBPYPB-CYBMUJFWSA-N -1 3 355.463 3.957 20 0 FHADHM C[C@H](N[C@@H](C(=O)[O-])c1cccnc1)c1cccc(OCc2ccccn2)c1 ZINC000827716815 604994367 /nfs/dbraw/zinc/99/43/67/604994367.db2.gz BCXJAXGURPPVMA-MGPUTAFESA-N -1 3 363.417 3.532 20 0 FHADHM O=C(c1ccc(-c2nnn[n-]2)[nH]1)N1CCCCC[C@H]1c1ccc(Cl)cc1 ZINC000826471836 607741020 /nfs/dbraw/zinc/74/10/20/607741020.db2.gz OICVGZBKIYSWDP-INIZCTEOSA-N -1 3 370.844 3.606 20 0 FHADHM O=C(c1ccc(-c2nn[n-]n2)[nH]1)N1CCCCC[C@H]1c1ccc(Cl)cc1 ZINC000826471836 607741021 /nfs/dbraw/zinc/74/10/21/607741021.db2.gz OICVGZBKIYSWDP-INIZCTEOSA-N -1 3 370.844 3.606 20 0 FHADHM Cc1oc(-c2ccccc2)nc1CN1C[C@@H]2CCC[C@@H](NC(=O)[O-])[C@H]2C1 ZINC000833937387 605450313 /nfs/dbraw/zinc/45/03/13/605450313.db2.gz WFROTDUTQWDZED-YESZJQIVSA-N -1 3 355.438 3.518 20 0 FHADHM CCCN(Cc1ncc(-c2ccc(OC)cc2)o1)C1CCN(C(=O)[O-])CC1 ZINC000826916299 605469512 /nfs/dbraw/zinc/46/95/12/605469512.db2.gz IZPZKIBBOJXYDY-UHFFFAOYSA-N -1 3 373.453 3.705 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N1CC[C@H]1c1cccc(F)c1 ZINC000826452955 607765022 /nfs/dbraw/zinc/76/50/22/607765022.db2.gz PJIZIOVNAAMWPJ-HNNXBMFYSA-N -1 3 372.791 3.638 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N1CC[C@H]1c1cccc(F)c1 ZINC000826452955 607765023 /nfs/dbraw/zinc/76/50/23/607765023.db2.gz PJIZIOVNAAMWPJ-HNNXBMFYSA-N -1 3 372.791 3.638 20 0 FHADHM C[C@H](NC(=O)[O-])[C@@H]1CCCN(Cc2ccccc2OCc2ccccn2)C1 ZINC000833812043 605600548 /nfs/dbraw/zinc/60/05/48/605600548.db2.gz GRTQWKIDVZLETO-DLBZAZTESA-N -1 3 369.465 3.529 20 0 FHADHM CCOc1cc(CN[C@H]2CCc3cc(NC(=O)[O-])ccc32)ccc1OC ZINC000833862176 605611600 /nfs/dbraw/zinc/61/16/00/605611600.db2.gz RXEMFBVIEGLMPH-KRWDZBQOSA-N -1 3 356.422 3.961 20 0 FHADHM O=C([O-])NC[C@H](NCc1ccc2[nH]cnc2c1)c1ccc2ccccc2c1 ZINC000834205211 605632295 /nfs/dbraw/zinc/63/22/95/605632295.db2.gz FCTJRAMITYKMTH-FQEVSTJZSA-N -1 3 360.417 3.815 20 0 FHADHM O=C([O-])NC[C@H](NCc1ccc2nc[nH]c2c1)c1ccc2ccccc2c1 ZINC000834205211 605632299 /nfs/dbraw/zinc/63/22/99/605632299.db2.gz FCTJRAMITYKMTH-FQEVSTJZSA-N -1 3 360.417 3.815 20 0 FHADHM Cc1cc(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)ccc1NC(=O)[O-] ZINC000829940024 605637551 /nfs/dbraw/zinc/63/75/51/605637551.db2.gz JESGIQOTXDUQGR-YJBOKZPZSA-N -1 3 367.449 3.650 20 0 FHADHM CN(Cc1cccc(-c2nnn[n-]2)c1)C(=O)Nc1cccc2ccsc21 ZINC000825971388 607768179 /nfs/dbraw/zinc/76/81/79/607768179.db2.gz DRLSFPWETNFKIU-UHFFFAOYSA-N -1 3 364.434 3.745 20 0 FHADHM CN(Cc1cccc(-c2nn[n-]n2)c1)C(=O)Nc1cccc2ccsc21 ZINC000825971388 607768180 /nfs/dbraw/zinc/76/81/80/607768180.db2.gz DRLSFPWETNFKIU-UHFFFAOYSA-N -1 3 364.434 3.745 20 0 FHADHM Cc1ccc(C(=O)Nc2nc(-c3cccc(-c4nnn[n-]4)c3)cs2)s1 ZINC000826282393 607768821 /nfs/dbraw/zinc/76/88/21/607768821.db2.gz MSLAYHUBWVDPDA-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM Cc1ccc(C(=O)Nc2nc(-c3cccc(-c4nn[n-]n4)c3)cs2)s1 ZINC000826282393 607768822 /nfs/dbraw/zinc/76/88/22/607768822.db2.gz MSLAYHUBWVDPDA-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM O=C([O-])N[C@H]1C[C@@H](NCc2ccc(N3CCCCC3)nc2)c2ccccc21 ZINC000834159871 605792626 /nfs/dbraw/zinc/79/26/26/605792626.db2.gz ZDJFEGNICDSYIK-MOPGFXCFSA-N -1 3 366.465 3.615 20 0 FHADHM CCOc1cc(CN[C@@H]2C[C@H](NC(=O)[O-])c3ccccc32)ccc1OC ZINC000833861028 605799369 /nfs/dbraw/zinc/79/93/69/605799369.db2.gz DZLQKDWYOJFOTE-SJORKVTESA-N -1 3 356.422 3.637 20 0 FHADHM Cc1cc(C(=O)NC[C@@H](c2cccs2)N2CCCC2)ccc1NC(=O)[O-] ZINC000829945067 605873822 /nfs/dbraw/zinc/87/38/22/605873822.db2.gz HFGWBBKOICASDH-INIZCTEOSA-N -1 3 373.478 3.713 20 0 FHADHM CC[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2Cl)CC[C@H]1c1ccccc1 ZINC000820995457 606038817 /nfs/dbraw/zinc/03/88/17/606038817.db2.gz ROKAIUYJZLVQBL-CZUORRHYSA-N -1 3 368.872 3.935 20 0 FHADHM CC[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2Cl)CC[C@H]1c1ccccc1 ZINC000820995457 606038824 /nfs/dbraw/zinc/03/88/24/606038824.db2.gz ROKAIUYJZLVQBL-CZUORRHYSA-N -1 3 368.872 3.935 20 0 FHADHM C[C@H](CCNc1ccc(-c2nnn[n-]2)cn1)c1cccc(C(F)(F)F)c1 ZINC000820242733 606039487 /nfs/dbraw/zinc/03/94/87/606039487.db2.gz QFORLLLPXFUBFP-LLVKDONJSA-N -1 3 362.359 3.886 20 0 FHADHM C[C@H](CCNc1ccc(-c2nn[n-]n2)cn1)c1cccc(C(F)(F)F)c1 ZINC000820242733 606039493 /nfs/dbraw/zinc/03/94/93/606039493.db2.gz QFORLLLPXFUBFP-LLVKDONJSA-N -1 3 362.359 3.886 20 0 FHADHM CCS[C@@H]1CCCCN(c2nc3ccccc3cc2-c2nnn[n-]2)C1 ZINC000821455739 606082165 /nfs/dbraw/zinc/08/21/65/606082165.db2.gz LPKWCLYMKUOWLN-CQSZACIVSA-N -1 3 354.483 3.527 20 0 FHADHM CCS[C@@H]1CCCCN(c2nc3ccccc3cc2-c2nn[n-]n2)C1 ZINC000821455739 606082169 /nfs/dbraw/zinc/08/21/69/606082169.db2.gz LPKWCLYMKUOWLN-CQSZACIVSA-N -1 3 354.483 3.527 20 0 FHADHM CCS[C@@H]1CCCC[C@@H]1Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000821456846 606105703 /nfs/dbraw/zinc/10/57/03/606105703.db2.gz SBIKSVUKZYCZHO-WDEREUQCSA-N -1 3 372.420 3.757 20 0 FHADHM CCS[C@@H]1CCCC[C@@H]1Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000821456846 606105705 /nfs/dbraw/zinc/10/57/05/606105705.db2.gz SBIKSVUKZYCZHO-WDEREUQCSA-N -1 3 372.420 3.757 20 0 FHADHM Cc1cccnc1C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCCCC2 ZINC000822369915 606126545 /nfs/dbraw/zinc/12/65/45/606126545.db2.gz OYGVZENMCFIBAS-UHFFFAOYSA-N -1 3 368.466 3.543 20 0 FHADHM Cc1cccnc1C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCCCC2 ZINC000822369915 606126546 /nfs/dbraw/zinc/12/65/46/606126546.db2.gz OYGVZENMCFIBAS-UHFFFAOYSA-N -1 3 368.466 3.543 20 0 FHADHM C[C@@H](OC(=O)[C@@H](C)c1ccc(Cl)s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820480887 606127506 /nfs/dbraw/zinc/12/75/06/606127506.db2.gz QEEKDTWJKCCHSL-VHSXEESVSA-N -1 3 362.842 3.990 20 0 FHADHM C[C@@H](OC(=O)[C@@H](C)c1ccc(Cl)s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820480887 606127508 /nfs/dbraw/zinc/12/75/08/606127508.db2.gz QEEKDTWJKCCHSL-VHSXEESVSA-N -1 3 362.842 3.990 20 0 FHADHM COc1ccc([C@@H](C)CC(=O)O[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000821777120 606127819 /nfs/dbraw/zinc/12/78/19/606127819.db2.gz APMWEKKHVZYMTH-UONOGXRCSA-N -1 3 366.421 3.673 20 0 FHADHM COc1ccc([C@@H](C)CC(=O)O[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000821777120 606127820 /nfs/dbraw/zinc/12/78/20/606127820.db2.gz APMWEKKHVZYMTH-UONOGXRCSA-N -1 3 366.421 3.673 20 0 FHADHM CN(Cc1cc2ccccc2o1)c1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000821608517 606140569 /nfs/dbraw/zinc/14/05/69/606140569.db2.gz KRZDTBFMPARVQV-UHFFFAOYSA-N -1 3 374.326 3.663 20 0 FHADHM CN(Cc1cc2ccccc2o1)c1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000821608517 606140570 /nfs/dbraw/zinc/14/05/70/606140570.db2.gz KRZDTBFMPARVQV-UHFFFAOYSA-N -1 3 374.326 3.663 20 0 FHADHM C[C@H](C(=O)OCc1ccc(-c2nnn[n-]2)cc1F)c1ccc(Cl)s1 ZINC000819882933 606149859 /nfs/dbraw/zinc/14/98/59/606149859.db2.gz CZCYOTAVHPGJKM-QMMMGPOBSA-N -1 3 366.805 3.568 20 0 FHADHM C[C@H](C(=O)OCc1ccc(-c2nn[n-]n2)cc1F)c1ccc(Cl)s1 ZINC000819882933 606149862 /nfs/dbraw/zinc/14/98/62/606149862.db2.gz CZCYOTAVHPGJKM-QMMMGPOBSA-N -1 3 366.805 3.568 20 0 FHADHM Cc1ccc(C(C)(C)C)cc1[S@@](=O)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000822227476 606156520 /nfs/dbraw/zinc/15/65/20/606156520.db2.gz KHUSPEPCWRIRKP-VWLOTQADSA-N -1 3 354.479 3.780 20 0 FHADHM Cc1ccc(C(C)(C)C)cc1[S@@](=O)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000822227476 606156521 /nfs/dbraw/zinc/15/65/21/606156521.db2.gz KHUSPEPCWRIRKP-VWLOTQADSA-N -1 3 354.479 3.780 20 0 FHADHM O=C(C/C=C\c1ccc(F)cc1)Nc1sc2c(c1-c1nnn[n-]1)CCC2 ZINC000822945577 606175192 /nfs/dbraw/zinc/17/51/92/606175192.db2.gz KHYOJJDIEFAWIU-IWQZZHSRSA-N -1 3 369.425 3.598 20 0 FHADHM O=C(C/C=C\c1ccc(F)cc1)Nc1sc2c(c1-c1nn[n-]n1)CCC2 ZINC000822945577 606175194 /nfs/dbraw/zinc/17/51/94/606175194.db2.gz KHYOJJDIEFAWIU-IWQZZHSRSA-N -1 3 369.425 3.598 20 0 FHADHM CO[C@H](C)c1nc(CSCc2ccc(-c3nnn[n-]3)cc2F)cs1 ZINC000821675143 606179551 /nfs/dbraw/zinc/17/95/51/606179551.db2.gz DUWHAWJFGGPFRC-SECBINFHSA-N -1 3 365.459 3.603 20 0 FHADHM CO[C@H](C)c1nc(CSCc2ccc(-c3nn[n-]n3)cc2F)cs1 ZINC000821675143 606179552 /nfs/dbraw/zinc/17/95/52/606179552.db2.gz DUWHAWJFGGPFRC-SECBINFHSA-N -1 3 365.459 3.603 20 0 FHADHM Oc1ccc(C2CCN(c3c(-c4nnn[n-]4)cnc4ccccc43)CC2)cc1 ZINC000823727131 606214184 /nfs/dbraw/zinc/21/41/84/606214184.db2.gz PJCZPTRPUNYABR-UHFFFAOYSA-N -1 3 372.432 3.505 20 0 FHADHM Oc1ccc(C2CCN(c3c(-c4nn[n-]n4)cnc4ccccc43)CC2)cc1 ZINC000823727131 606214186 /nfs/dbraw/zinc/21/41/86/606214186.db2.gz PJCZPTRPUNYABR-UHFFFAOYSA-N -1 3 372.432 3.505 20 0 FHADHM Clc1cnc(NCc2cccc(-c3ccc(-c4nnn[n-]4)s3)c2)nc1 ZINC000822590714 606240592 /nfs/dbraw/zinc/24/05/92/606240592.db2.gz NJQWMBSYVCEXDH-UHFFFAOYSA-N -1 3 369.841 3.651 20 0 FHADHM CC[C@H](C)NC(=O)c1ccc(Sc2ccccc2-c2nnn[n-]2)cc1 ZINC000820876070 606244793 /nfs/dbraw/zinc/24/47/93/606244793.db2.gz LCOQGDGFNBPWCZ-LBPRGKRZSA-N -1 3 353.451 3.546 20 0 FHADHM CC[C@H](C)NC(=O)c1ccc(Sc2ccccc2-c2nn[n-]n2)cc1 ZINC000820876070 606244795 /nfs/dbraw/zinc/24/47/95/606244795.db2.gz LCOQGDGFNBPWCZ-LBPRGKRZSA-N -1 3 353.451 3.546 20 0 FHADHM FC(F)(F)c1cc(NCc2cccnc2Cl)ccc1-c1nnn[n-]1 ZINC000822723854 606250588 /nfs/dbraw/zinc/25/05/88/606250588.db2.gz RCOAFUWRNFRPHS-UHFFFAOYSA-N -1 3 354.723 3.546 20 0 FHADHM FC(F)(F)c1cc(NCc2cccnc2Cl)ccc1-c1nn[n-]n1 ZINC000822723854 606250589 /nfs/dbraw/zinc/25/05/89/606250589.db2.gz RCOAFUWRNFRPHS-UHFFFAOYSA-N -1 3 354.723 3.546 20 0 FHADHM Cc1cccc(OCCCCC(=O)Nc2ccc(F)cc2-c2nnn[n-]2)c1 ZINC000822327257 606263075 /nfs/dbraw/zinc/26/30/75/606263075.db2.gz DWXJTCYOANWZKN-UHFFFAOYSA-N -1 3 369.400 3.502 20 0 FHADHM Cc1cccc(OCCCCC(=O)Nc2ccc(F)cc2-c2nn[n-]n2)c1 ZINC000822327257 606263077 /nfs/dbraw/zinc/26/30/77/606263077.db2.gz DWXJTCYOANWZKN-UHFFFAOYSA-N -1 3 369.400 3.502 20 0 FHADHM CC(=CC(=O)Nc1ccc(F)cc1-c1nnn[n-]1)c1ccccc1Cl ZINC000819765310 606267847 /nfs/dbraw/zinc/26/78/47/606267847.db2.gz ODUJSNPXUJCIKM-NTMALXAHSA-N -1 3 357.776 3.701 20 0 FHADHM CC(=CC(=O)Nc1ccc(F)cc1-c1nn[n-]n1)c1ccccc1Cl ZINC000819765310 606267849 /nfs/dbraw/zinc/26/78/49/606267849.db2.gz ODUJSNPXUJCIKM-NTMALXAHSA-N -1 3 357.776 3.701 20 0 FHADHM CC(C)[C@@H](CC(=O)Nc1ccc(F)cc1-c1nnn[n-]1)c1ccccc1 ZINC000820020668 606272040 /nfs/dbraw/zinc/27/20/40/606272040.db2.gz JOSUHLJFLRGZCG-OAHLLOKOSA-N -1 3 353.401 3.774 20 0 FHADHM CC(C)[C@@H](CC(=O)Nc1ccc(F)cc1-c1nn[n-]n1)c1ccccc1 ZINC000820020668 606272043 /nfs/dbraw/zinc/27/20/43/606272043.db2.gz JOSUHLJFLRGZCG-OAHLLOKOSA-N -1 3 353.401 3.774 20 0 FHADHM O=C(Nc1ccc(-c2cc3ccccc3o2)cc1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC000823299157 606314339 /nfs/dbraw/zinc/31/43/39/606314339.db2.gz KJSGAIFLQKBUTD-UHFFFAOYSA-N -1 3 370.372 3.860 20 0 FHADHM O=C(Nc1ccc(-c2cc3ccccc3o2)cc1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC000823299157 606314340 /nfs/dbraw/zinc/31/43/40/606314340.db2.gz KJSGAIFLQKBUTD-UHFFFAOYSA-N -1 3 370.372 3.860 20 0 FHADHM CC[C@H](C)N(C)C(=O)c1ccc(Sc2ccccc2-c2nnn[n-]2)cc1 ZINC000820875960 606317969 /nfs/dbraw/zinc/31/79/69/606317969.db2.gz JGKHYTXWHRIDFR-ZDUSSCGKSA-N -1 3 367.478 3.888 20 0 FHADHM CC[C@H](C)N(C)C(=O)c1ccc(Sc2ccccc2-c2nn[n-]n2)cc1 ZINC000820875960 606317970 /nfs/dbraw/zinc/31/79/70/606317970.db2.gz JGKHYTXWHRIDFR-ZDUSSCGKSA-N -1 3 367.478 3.888 20 0 FHADHM O=C(Nc1cccc(Sc2ccccc2)c1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC000823367338 606320710 /nfs/dbraw/zinc/32/07/10/606320710.db2.gz JSRIKFHIUZDJCL-UHFFFAOYSA-N -1 3 362.418 3.598 20 0 FHADHM O=C(Nc1cccc(Sc2ccccc2)c1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC000823367338 606320711 /nfs/dbraw/zinc/32/07/11/606320711.db2.gz JSRIKFHIUZDJCL-UHFFFAOYSA-N -1 3 362.418 3.598 20 0 FHADHM CC1(C)CCN1C(=O)c1ccc(Sc2ccccc2-c2nnn[n-]2)cc1 ZINC000820601634 606322382 /nfs/dbraw/zinc/32/23/82/606322382.db2.gz QBYBANIMFRSMQU-UHFFFAOYSA-N -1 3 365.462 3.642 20 0 FHADHM CC1(C)CCN1C(=O)c1ccc(Sc2ccccc2-c2nn[n-]n2)cc1 ZINC000820601634 606322384 /nfs/dbraw/zinc/32/23/84/606322384.db2.gz QBYBANIMFRSMQU-UHFFFAOYSA-N -1 3 365.462 3.642 20 0 FHADHM Cc1cccc(C)c1NC(=O)[C@@H](C)Sc1cccc(-c2nnn[n-]2)c1 ZINC000822294370 606324742 /nfs/dbraw/zinc/32/47/42/606324742.db2.gz YGRMHUGZPQFPBT-CYBMUJFWSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1cccc(C)c1NC(=O)[C@@H](C)Sc1cccc(-c2nn[n-]n2)c1 ZINC000822294370 606324743 /nfs/dbraw/zinc/32/47/43/606324743.db2.gz YGRMHUGZPQFPBT-CYBMUJFWSA-N -1 3 353.451 3.603 20 0 FHADHM CC(C)c1cccc(NC(=O)CSc2cccc(-c3nnn[n-]3)c2)c1 ZINC000820196713 606328820 /nfs/dbraw/zinc/32/88/20/606328820.db2.gz AJIYMSJCQOMZSH-UHFFFAOYSA-N -1 3 353.451 3.721 20 0 FHADHM CC(C)c1cccc(NC(=O)CSc2cccc(-c3nn[n-]n3)c2)c1 ZINC000820196713 606328822 /nfs/dbraw/zinc/32/88/22/606328822.db2.gz AJIYMSJCQOMZSH-UHFFFAOYSA-N -1 3 353.451 3.721 20 0 FHADHM C[C@H](OC(=O)[C@@H]1C[C@@H]1c1c(F)cccc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000820487736 606342194 /nfs/dbraw/zinc/34/21/94/606342194.db2.gz IHCCIPJRVYCWNL-LEWSCRJBSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@@H]1C[C@@H]1c1c(F)cccc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000820487736 606342196 /nfs/dbraw/zinc/34/21/96/606342196.db2.gz IHCCIPJRVYCWNL-LEWSCRJBSA-N -1 3 370.359 3.553 20 0 FHADHM CC1(C)CN(C(=O)Nc2ccc(F)cc2-c2nnn[n-]2)[C@@H]1c1ccccc1 ZINC000820601714 606346868 /nfs/dbraw/zinc/34/68/68/606346868.db2.gz SKAPWJFWMRYWFF-MRXNPFEDSA-N -1 3 366.400 3.621 20 0 FHADHM CC1(C)CN(C(=O)Nc2ccc(F)cc2-c2nn[n-]n2)[C@@H]1c1ccccc1 ZINC000820601714 606346870 /nfs/dbraw/zinc/34/68/70/606346870.db2.gz SKAPWJFWMRYWFF-MRXNPFEDSA-N -1 3 366.400 3.621 20 0 FHADHM Cc1ccccc1[C@H](NC(=O)Nc1ccc(F)cc1-c1nnn[n-]1)C1CC1 ZINC000822350335 606347682 /nfs/dbraw/zinc/34/76/82/606347682.db2.gz CDDTUMQXRYZSQF-QGZVFWFLSA-N -1 3 366.400 3.587 20 0 FHADHM Cc1ccccc1[C@H](NC(=O)Nc1ccc(F)cc1-c1nn[n-]n1)C1CC1 ZINC000822350335 606347684 /nfs/dbraw/zinc/34/76/84/606347684.db2.gz CDDTUMQXRYZSQF-QGZVFWFLSA-N -1 3 366.400 3.587 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccc2ccccc2n1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488944 606349534 /nfs/dbraw/zinc/34/95/34/606349534.db2.gz XCDQPYRZCPIYPD-XTZCOPOCSA-N -1 3 371.400 3.733 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccc2ccccc2n1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488944 606349536 /nfs/dbraw/zinc/34/95/36/606349536.db2.gz XCDQPYRZCPIYPD-XTZCOPOCSA-N -1 3 371.400 3.733 20 0 FHADHM CC(C)c1ccccc1OCC(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820197587 606352283 /nfs/dbraw/zinc/35/22/83/606352283.db2.gz MFRNZKHTCWSNEE-CQSZACIVSA-N -1 3 366.421 3.673 20 0 FHADHM CC(C)c1ccccc1OCC(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820197587 606352285 /nfs/dbraw/zinc/35/22/85/606352285.db2.gz MFRNZKHTCWSNEE-CQSZACIVSA-N -1 3 366.421 3.673 20 0 FHADHM C[C@@H](CC(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccccc1F ZINC000820225479 606355851 /nfs/dbraw/zinc/35/58/51/606355851.db2.gz JORJMBMPLDOMBX-STQMWFEESA-N -1 3 354.385 3.804 20 0 FHADHM C[C@@H](CC(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccccc1F ZINC000820225479 606355853 /nfs/dbraw/zinc/35/58/53/606355853.db2.gz JORJMBMPLDOMBX-STQMWFEESA-N -1 3 354.385 3.804 20 0 FHADHM C[C@H](OC(=O)Cc1ccc(-n2cccc2)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820495953 606357690 /nfs/dbraw/zinc/35/76/90/606357690.db2.gz KPMDYGVXJQLKHQ-HNNXBMFYSA-N -1 3 373.416 3.504 20 0 FHADHM C[C@H](OC(=O)Cc1ccc(-n2cccc2)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820495953 606357692 /nfs/dbraw/zinc/35/76/92/606357692.db2.gz KPMDYGVXJQLKHQ-HNNXBMFYSA-N -1 3 373.416 3.504 20 0 FHADHM Cc1ccccc1SCC(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000822366379 606358822 /nfs/dbraw/zinc/35/88/22/606358822.db2.gz JBLBHWZTWLQGDQ-CYBMUJFWSA-N -1 3 354.435 3.572 20 0 FHADHM Cc1ccccc1SCC(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000822366379 606358823 /nfs/dbraw/zinc/35/88/23/606358823.db2.gz JBLBHWZTWLQGDQ-CYBMUJFWSA-N -1 3 354.435 3.572 20 0 FHADHM CCOc1ccc(CCC(=O)O[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000821416611 606360200 /nfs/dbraw/zinc/36/02/00/606360200.db2.gz BMBBVJIYVUWKPO-AWEZNQCLSA-N -1 3 366.421 3.502 20 0 FHADHM CCOc1ccc(CCC(=O)O[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000821416611 606360202 /nfs/dbraw/zinc/36/02/02/606360202.db2.gz BMBBVJIYVUWKPO-AWEZNQCLSA-N -1 3 366.421 3.502 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1)[C@H]1[C@@H]2CCC[C@@H]21 ZINC000823350393 606379772 /nfs/dbraw/zinc/37/97/72/606379772.db2.gz LLHUIAOBTCYECF-PIIMJCKOSA-N -1 3 361.405 3.644 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1)[C@H]1[C@@H]2CCC[C@@H]21 ZINC000823350393 606379774 /nfs/dbraw/zinc/37/97/74/606379774.db2.gz LLHUIAOBTCYECF-PIIMJCKOSA-N -1 3 361.405 3.644 20 0 FHADHM Cc1c(C(=O)O[C@H](C)c2cccc(-c3nnn[n-]3)c2)cnc2ccccc12 ZINC000822021406 606395748 /nfs/dbraw/zinc/39/57/48/606395748.db2.gz ZPDTWRIICGFTNY-CYBMUJFWSA-N -1 3 359.389 3.641 20 0 FHADHM Cc1c(C(=O)O[C@H](C)c2cccc(-c3nn[n-]n3)c2)cnc2ccccc12 ZINC000822021406 606395749 /nfs/dbraw/zinc/39/57/49/606395749.db2.gz ZPDTWRIICGFTNY-CYBMUJFWSA-N -1 3 359.389 3.641 20 0 FHADHM C[C@@H](OC(=O)c1[nH]c2ccccc2c1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000820499887 606396110 /nfs/dbraw/zinc/39/61/10/606396110.db2.gz AANNOHKJUHAXDK-SNVBAGLBSA-N -1 3 367.796 3.919 20 0 FHADHM C[C@@H](OC(=O)c1[nH]c2ccccc2c1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000820499887 606396111 /nfs/dbraw/zinc/39/61/11/606396111.db2.gz AANNOHKJUHAXDK-SNVBAGLBSA-N -1 3 367.796 3.919 20 0 FHADHM Fc1cc(Br)cc(CNc2ccc(F)c(-c3nnn[n-]3)c2)c1 ZINC000822748442 606405386 /nfs/dbraw/zinc/40/53/86/606405386.db2.gz YSEGCQWYAGWKMZ-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1cc(Br)cc(CNc2ccc(F)c(-c3nn[n-]n3)c2)c1 ZINC000822748442 606405387 /nfs/dbraw/zinc/40/53/87/606405387.db2.gz YSEGCQWYAGWKMZ-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM CC[C@@H](NCc1ccc(-c2nnn[n-]2)s1)c1nc(C(F)(F)F)cs1 ZINC000820927167 606425719 /nfs/dbraw/zinc/42/57/19/606425719.db2.gz ZZIKRXMJLNSOBG-MRVPVSSYSA-N -1 3 374.417 3.644 20 0 FHADHM CC[C@@H](NCc1ccc(-c2nn[n-]n2)s1)c1nc(C(F)(F)F)cs1 ZINC000820927167 606425721 /nfs/dbraw/zinc/42/57/21/606425721.db2.gz ZZIKRXMJLNSOBG-MRVPVSSYSA-N -1 3 374.417 3.644 20 0 FHADHM Fc1ccc(OCC(F)(F)F)c(NCc2cccc(-c3nnn[n-]3)c2)c1 ZINC000822783136 606444123 /nfs/dbraw/zinc/44/41/23/606444123.db2.gz WRQYRCOGXYROOI-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM Fc1ccc(OCC(F)(F)F)c(NCc2cccc(-c3nn[n-]n3)c2)c1 ZINC000822783136 606444125 /nfs/dbraw/zinc/44/41/25/606444125.db2.gz WRQYRCOGXYROOI-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM FC(F)(F)c1cc(N2CCC[C@@H]2c2cccnc2)ccc1-c1nnn[n-]1 ZINC000822723823 606445170 /nfs/dbraw/zinc/44/51/70/606445170.db2.gz QAAFKVUFVLBCIQ-OAHLLOKOSA-N -1 3 360.343 3.622 20 0 FHADHM FC(F)(F)c1cc(N2CCC[C@@H]2c2cccnc2)ccc1-c1nn[n-]n1 ZINC000822723823 606445171 /nfs/dbraw/zinc/44/51/71/606445171.db2.gz QAAFKVUFVLBCIQ-OAHLLOKOSA-N -1 3 360.343 3.622 20 0 FHADHM CC(C)(C)OC(=O)Nc1ccc(NCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000819946845 606456866 /nfs/dbraw/zinc/45/68/66/606456866.db2.gz TWZDGJQPVMVPED-UHFFFAOYSA-N -1 3 366.425 3.826 20 0 FHADHM CC(C)(C)OC(=O)Nc1ccc(NCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000819946845 606456867 /nfs/dbraw/zinc/45/68/67/606456867.db2.gz TWZDGJQPVMVPED-UHFFFAOYSA-N -1 3 366.425 3.826 20 0 FHADHM Cc1ccc(NCc2cccc(-c3nnn[n-]3)c2)cc1NC(=O)C(C)(C)C ZINC000822259260 606458764 /nfs/dbraw/zinc/45/87/64/606458764.db2.gz RIJZEUHCLHBNMJ-UHFFFAOYSA-N -1 3 364.453 3.772 20 0 FHADHM Cc1ccc(NCc2cccc(-c3nn[n-]n3)c2)cc1NC(=O)C(C)(C)C ZINC000822259260 606458765 /nfs/dbraw/zinc/45/87/65/606458765.db2.gz RIJZEUHCLHBNMJ-UHFFFAOYSA-N -1 3 364.453 3.772 20 0 FHADHM FC(F)(F)c1cc(-c2nn[n-]n2)ccc1N1CCC[C@@H]1c1ccccn1 ZINC000822718336 606459839 /nfs/dbraw/zinc/45/98/39/606459839.db2.gz IGYSMXBTWSCBQP-OAHLLOKOSA-N -1 3 360.343 3.622 20 0 FHADHM C[C@H](OC(=O)c1cc(-c2nnn[n-]2)cs1)c1ccccc1C(F)(F)F ZINC000820507999 606462657 /nfs/dbraw/zinc/46/26/57/606462657.db2.gz KYGNSFBVLZOGCG-QMMMGPOBSA-N -1 3 368.340 3.865 20 0 FHADHM C[C@H](OC(=O)c1cc(-c2nn[n-]n2)cs1)c1ccccc1C(F)(F)F ZINC000820507999 606462660 /nfs/dbraw/zinc/46/26/60/606462660.db2.gz KYGNSFBVLZOGCG-QMMMGPOBSA-N -1 3 368.340 3.865 20 0 FHADHM COc1ccc(F)cc1CNc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000821827868 606462886 /nfs/dbraw/zinc/46/28/86/606462886.db2.gz LHUPBRGNPHVCFP-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM COc1ccc(F)cc1CNc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000821827868 606462888 /nfs/dbraw/zinc/46/28/88/606462888.db2.gz LHUPBRGNPHVCFP-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM Fc1ccc(NCc2cc(-c3nnn[n-]3)ccc2F)cc1Br ZINC000822783188 606463183 /nfs/dbraw/zinc/46/31/83/606463183.db2.gz YXRISMUCQGGMFW-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1ccc(NCc2cc(-c3nn[n-]n3)ccc2F)cc1Br ZINC000822783188 606463184 /nfs/dbraw/zinc/46/31/84/606463184.db2.gz YXRISMUCQGGMFW-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM C[C@H](OC(=O)c1cc(-c2nnn[n-]2)cs1)c1ccc(F)cc1Cl ZINC000822000718 606464759 /nfs/dbraw/zinc/46/47/59/606464759.db2.gz VBWKVWPCXHYAIT-ZETCQYMHSA-N -1 3 352.778 3.639 20 0 FHADHM C[C@H](OC(=O)c1cc(-c2nn[n-]n2)cs1)c1ccc(F)cc1Cl ZINC000822000718 606464763 /nfs/dbraw/zinc/46/47/63/606464763.db2.gz VBWKVWPCXHYAIT-ZETCQYMHSA-N -1 3 352.778 3.639 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)O[C@H](C1CCCC1)C(F)(F)F ZINC000822936498 606470836 /nfs/dbraw/zinc/47/08/36/606470836.db2.gz VGBBCIKZKAFASL-FJVVXJACSA-N -1 3 366.343 3.544 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)O[C@H](C1CCCC1)C(F)(F)F ZINC000822936498 606470837 /nfs/dbraw/zinc/47/08/37/606470837.db2.gz VGBBCIKZKAFASL-FJVVXJACSA-N -1 3 366.343 3.544 20 0 FHADHM O=C(c1cc(-c2nnn[n-]2)cs1)N(CCc1ccccc1)C1CCCC1 ZINC000823466206 606492580 /nfs/dbraw/zinc/49/25/80/606492580.db2.gz GMTCVIVKGCKFGB-UHFFFAOYSA-N -1 3 367.478 3.556 20 0 FHADHM O=C(c1cc(-c2nn[n-]n2)cs1)N(CCc1ccccc1)C1CCCC1 ZINC000823466206 606492581 /nfs/dbraw/zinc/49/25/81/606492581.db2.gz GMTCVIVKGCKFGB-UHFFFAOYSA-N -1 3 367.478 3.556 20 0 FHADHM CC(C)Oc1ccc(NC(=O)c2cc(-c3nnn[n-]3)cs2)cc1Cl ZINC000820168780 606493308 /nfs/dbraw/zinc/49/33/08/606493308.db2.gz ADXHYCDLEHGZOP-UHFFFAOYSA-N -1 3 363.830 3.621 20 0 FHADHM CC(C)Oc1ccc(NC(=O)c2cc(-c3nn[n-]n3)cs2)cc1Cl ZINC000820168780 606493310 /nfs/dbraw/zinc/49/33/10/606493310.db2.gz ADXHYCDLEHGZOP-UHFFFAOYSA-N -1 3 363.830 3.621 20 0 FHADHM O=C(N[C@@H](c1ccc(F)cc1)C1CCCC1)c1cc(-c2nnn[n-]2)cs1 ZINC000823140360 606494849 /nfs/dbraw/zinc/49/48/49/606494849.db2.gz TXLFMSLNZPOPJP-MRXNPFEDSA-N -1 3 371.441 3.729 20 0 FHADHM O=C(N[C@@H](c1ccc(F)cc1)C1CCCC1)c1cc(-c2nn[n-]n2)cs1 ZINC000823140360 606494851 /nfs/dbraw/zinc/49/48/51/606494851.db2.gz TXLFMSLNZPOPJP-MRXNPFEDSA-N -1 3 371.441 3.729 20 0 FHADHM O=C(c1cc(-c2nnn[n-]2)cs1)N(c1ccccc1)C1CCCCC1 ZINC000823466381 606498593 /nfs/dbraw/zinc/49/85/93/606498593.db2.gz KTTDYAOHTFGNPC-UHFFFAOYSA-N -1 3 353.451 3.908 20 0 FHADHM O=C(c1cc(-c2nn[n-]n2)cs1)N(c1ccccc1)C1CCCCC1 ZINC000823466381 606498595 /nfs/dbraw/zinc/49/85/95/606498595.db2.gz KTTDYAOHTFGNPC-UHFFFAOYSA-N -1 3 353.451 3.908 20 0 FHADHM CCCCN(C(=O)Cc1cccc(-c2nnn[n-]2)c1)[C@@H](C)c1ccc(C)o1 ZINC000821061505 606506498 /nfs/dbraw/zinc/50/64/98/606506498.db2.gz ORRXUBZERMDBKD-HNNXBMFYSA-N -1 3 367.453 3.701 20 0 FHADHM CCCCN(C(=O)Cc1cccc(-c2nn[n-]n2)c1)[C@@H](C)c1ccc(C)o1 ZINC000821061505 606506499 /nfs/dbraw/zinc/50/64/99/606506499.db2.gz ORRXUBZERMDBKD-HNNXBMFYSA-N -1 3 367.453 3.701 20 0 FHADHM CCCC[C@H](NC(=O)c1cc(-c2nnn[n-]2)cs1)c1ccc(OC)cc1 ZINC000821042532 606507127 /nfs/dbraw/zinc/50/71/27/606507127.db2.gz DIWVKTQGIMEOFS-HNNXBMFYSA-N -1 3 371.466 3.598 20 0 FHADHM CCCC[C@H](NC(=O)c1cc(-c2nn[n-]n2)cs1)c1ccc(OC)cc1 ZINC000821042532 606507129 /nfs/dbraw/zinc/50/71/29/606507129.db2.gz DIWVKTQGIMEOFS-HNNXBMFYSA-N -1 3 371.466 3.598 20 0 FHADHM O=C(N[C@H](c1ccc(Cl)cc1)C1CCC1)c1cc(-c2nnn[n-]2)cs1 ZINC000823139502 606508034 /nfs/dbraw/zinc/50/80/34/606508034.db2.gz GNGXBDVSVINTNH-HNNXBMFYSA-N -1 3 373.869 3.853 20 0 FHADHM O=C(N[C@H](c1ccc(Cl)cc1)C1CCC1)c1cc(-c2nn[n-]n2)cs1 ZINC000823139502 606508036 /nfs/dbraw/zinc/50/80/36/606508036.db2.gz GNGXBDVSVINTNH-HNNXBMFYSA-N -1 3 373.869 3.853 20 0 FHADHM C[C@H](c1ccccc1)N(CC1CCC1)C(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000820571308 606515768 /nfs/dbraw/zinc/51/57/68/606515768.db2.gz XWTCIFUVHDATDF-CYBMUJFWSA-N -1 3 367.478 3.932 20 0 FHADHM C[C@H](c1ccccc1)N(CC1CCC1)C(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000820571308 606515769 /nfs/dbraw/zinc/51/57/69/606515769.db2.gz XWTCIFUVHDATDF-CYBMUJFWSA-N -1 3 367.478 3.932 20 0 FHADHM Cc1ccc([C@H]2[C@H](C)CCCN2C(=O)c2cc(-c3nnn[n-]3)cs2)cc1 ZINC000822231785 606516524 /nfs/dbraw/zinc/51/65/24/606516524.db2.gz HNGXNMBQEJBYDP-CXAGYDPISA-N -1 3 367.478 3.850 20 0 FHADHM Cc1ccc([C@H]2[C@H](C)CCCN2C(=O)c2cc(-c3nn[n-]n3)cs2)cc1 ZINC000822231785 606516525 /nfs/dbraw/zinc/51/65/25/606516525.db2.gz HNGXNMBQEJBYDP-CXAGYDPISA-N -1 3 367.478 3.850 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@@H](C)C1CCCC1 ZINC000820087435 606537336 /nfs/dbraw/zinc/53/73/36/606537336.db2.gz RTFIUDLZQFZKHN-HNNXBMFYSA-N -1 3 355.486 3.678 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@@H](C)C1CCCC1 ZINC000820087435 606537338 /nfs/dbraw/zinc/53/73/38/606537338.db2.gz RTFIUDLZQFZKHN-HNNXBMFYSA-N -1 3 355.486 3.678 20 0 FHADHM Cc1cccc([C@H]2CCCN2C(=O)c2cc(-c3nnn[n-]3)cs2)c1C ZINC000822299834 606543085 /nfs/dbraw/zinc/54/30/85/606543085.db2.gz WICNJNUXILNREJ-OAHLLOKOSA-N -1 3 353.451 3.522 20 0 FHADHM Cc1cccc([C@H]2CCCN2C(=O)c2cc(-c3nn[n-]n3)cs2)c1C ZINC000822299834 606543087 /nfs/dbraw/zinc/54/30/87/606543087.db2.gz WICNJNUXILNREJ-OAHLLOKOSA-N -1 3 353.451 3.522 20 0 FHADHM O=C(Nc1ccc(Nc2ccccc2)cc1)c1cc(-c2nnn[n-]2)cs1 ZINC000823350535 606554638 /nfs/dbraw/zinc/55/46/38/606554638.db2.gz QNEFZFRVGLXTDW-UHFFFAOYSA-N -1 3 362.418 3.924 20 0 FHADHM O=C(Nc1ccc(Nc2ccccc2)cc1)c1cc(-c2nn[n-]n2)cs1 ZINC000823350535 606554639 /nfs/dbraw/zinc/55/46/39/606554639.db2.gz QNEFZFRVGLXTDW-UHFFFAOYSA-N -1 3 362.418 3.924 20 0 FHADHM Cc1ccccc1[C@H](C(C)C)N(C)C(=O)Cc1cccc(-c2nnn[n-]2)c1 ZINC000822344841 606560643 /nfs/dbraw/zinc/56/06/43/606560643.db2.gz BJNALSUHJFYDOW-FQEVSTJZSA-N -1 3 363.465 3.573 20 0 FHADHM Cc1ccccc1[C@H](C(C)C)N(C)C(=O)Cc1cccc(-c2nn[n-]n2)c1 ZINC000822344841 606560645 /nfs/dbraw/zinc/56/06/45/606560645.db2.gz BJNALSUHJFYDOW-FQEVSTJZSA-N -1 3 363.465 3.573 20 0 FHADHM CC(C)[C@H](NC(=O)Cc1cccc(-c2nnn[n-]2)c1)c1ccccc1Cl ZINC000820025689 606562435 /nfs/dbraw/zinc/56/24/35/606562435.db2.gz BYUCWPIHTBMURD-SFHVURJKSA-N -1 3 369.856 3.576 20 0 FHADHM CC(C)[C@H](NC(=O)Cc1cccc(-c2nn[n-]n2)c1)c1ccccc1Cl ZINC000820025689 606562437 /nfs/dbraw/zinc/56/24/37/606562437.db2.gz BYUCWPIHTBMURD-SFHVURJKSA-N -1 3 369.856 3.576 20 0 FHADHM C[C@H]1CCCN1C(=O)Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000820709104 606574356 /nfs/dbraw/zinc/57/43/56/606574356.db2.gz DBWAIYXUNHNJDN-ZDUSSCGKSA-N -1 3 364.409 3.675 20 0 FHADHM C[C@H]1CCCN1C(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000820709104 606574358 /nfs/dbraw/zinc/57/43/58/606574358.db2.gz DBWAIYXUNHNJDN-ZDUSSCGKSA-N -1 3 364.409 3.675 20 0 FHADHM Cc1cc([C@@H](C)NC(=O)Nc2cc(-c3nnn[n-]3)ccc2C)ccc1F ZINC000822192042 606574596 /nfs/dbraw/zinc/57/45/96/606574596.db2.gz XJQGKKORJYJFJU-GFCCVEGCSA-N -1 3 354.389 3.505 20 0 FHADHM Cc1cc([C@@H](C)NC(=O)Nc2cc(-c3nn[n-]n3)ccc2C)ccc1F ZINC000822192042 606574597 /nfs/dbraw/zinc/57/45/97/606574597.db2.gz XJQGKKORJYJFJU-GFCCVEGCSA-N -1 3 354.389 3.505 20 0 FHADHM CCc1ccc(CC)c(NC(=O)N(C)Cc2cccc(-c3nnn[n-]3)c2)c1 ZINC000821481582 606577887 /nfs/dbraw/zinc/57/78/87/606577887.db2.gz LPAUQGRIONWNLI-UHFFFAOYSA-N -1 3 364.453 3.655 20 0 FHADHM CCc1ccc(CC)c(NC(=O)N(C)Cc2cccc(-c3nn[n-]n3)c2)c1 ZINC000821481582 606577889 /nfs/dbraw/zinc/57/78/89/606577889.db2.gz LPAUQGRIONWNLI-UHFFFAOYSA-N -1 3 364.453 3.655 20 0 FHADHM CC1CC(NC(=O)Nc2cccc(Oc3ccc(-c4nnn[n-]4)cc3)c2)C1 ZINC000820658004 606577893 /nfs/dbraw/zinc/57/78/93/606577893.db2.gz ODEZNGOABXIOCV-UHFFFAOYSA-N -1 3 364.409 3.579 20 0 FHADHM CC1CC(NC(=O)Nc2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)C1 ZINC000820658004 606577895 /nfs/dbraw/zinc/57/78/95/606577895.db2.gz ODEZNGOABXIOCV-UHFFFAOYSA-N -1 3 364.409 3.579 20 0 FHADHM Cc1cccc([C@H](NC(=O)Cc2cccc(-c3nnn[n-]3)c2)C(C)(C)C)c1 ZINC000822288935 606590667 /nfs/dbraw/zinc/59/06/67/606590667.db2.gz NQBVEESDSVSJQQ-IBGZPJMESA-N -1 3 363.465 3.621 20 0 FHADHM Cc1cccc([C@H](NC(=O)Cc2cccc(-c3nn[n-]n3)c2)C(C)(C)C)c1 ZINC000822288935 606590668 /nfs/dbraw/zinc/59/06/68/606590668.db2.gz NQBVEESDSVSJQQ-IBGZPJMESA-N -1 3 363.465 3.621 20 0 FHADHM Cc1noc(C)c1CSCc1ccc(-c2nnn[n-]2)cc1OC(F)F ZINC000822524026 606594941 /nfs/dbraw/zinc/59/49/41/606594941.db2.gz WSIQZFYYDHOXKY-UHFFFAOYSA-N -1 3 367.381 3.506 20 0 FHADHM Cc1noc(C)c1CSCc1ccc(-c2nn[n-]n2)cc1OC(F)F ZINC000822524026 606594944 /nfs/dbraw/zinc/59/49/44/606594944.db2.gz WSIQZFYYDHOXKY-UHFFFAOYSA-N -1 3 367.381 3.506 20 0 FHADHM Fc1ccc(NCc2ccc(-c3nnn[n-]3)cc2OC(F)F)c(Cl)c1 ZINC000822782776 606597684 /nfs/dbraw/zinc/59/76/84/606597684.db2.gz GLERVOGSAVTRNZ-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM Fc1ccc(NCc2ccc(-c3nn[n-]n3)cc2OC(F)F)c(Cl)c1 ZINC000822782776 606597685 /nfs/dbraw/zinc/59/76/85/606597685.db2.gz GLERVOGSAVTRNZ-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM c1sc(CCc2ccccc2)nc1COc1ccc(-c2nn[n-]n2)cc1 ZINC000823780962 606601349 /nfs/dbraw/zinc/60/13/49/606601349.db2.gz XIZNEYHUEYBICJ-UHFFFAOYSA-N -1 3 363.446 3.687 20 0 FHADHM CN(C(=O)c1cc2cccc(Cl)c2o1)c1cccc(-c2nnn[n-]2)c1 ZINC000821573274 606602574 /nfs/dbraw/zinc/60/25/74/606602574.db2.gz IWYUSZHHYIZLMQ-UHFFFAOYSA-N -1 3 353.769 3.543 20 0 FHADHM CN(C(=O)c1cc2cccc(Cl)c2o1)c1cccc(-c2nn[n-]n2)c1 ZINC000821573274 606602575 /nfs/dbraw/zinc/60/25/75/606602575.db2.gz IWYUSZHHYIZLMQ-UHFFFAOYSA-N -1 3 353.769 3.543 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)c1cc2cccc(Cl)c2o1 ZINC000821766136 606602755 /nfs/dbraw/zinc/60/27/55/606602755.db2.gz SCKOCMVNMOWBOQ-UHFFFAOYSA-N -1 3 369.768 3.527 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cc2cccc(Cl)c2o1 ZINC000821766136 606602756 /nfs/dbraw/zinc/60/27/56/606602756.db2.gz SCKOCMVNMOWBOQ-UHFFFAOYSA-N -1 3 369.768 3.527 20 0 FHADHM Cc1cc(Oc2ccc(-c3nnn[n-]3)cc2)ccc1NC(=O)C1CC(C)C1 ZINC000822211848 606619866 /nfs/dbraw/zinc/61/98/66/606619866.db2.gz QGDUZTQHUPXLEE-UHFFFAOYSA-N -1 3 363.421 3.952 20 0 FHADHM Cc1cc(Oc2ccc(-c3nn[n-]n3)cc2)ccc1NC(=O)C1CC(C)C1 ZINC000822211848 606619868 /nfs/dbraw/zinc/61/98/68/606619868.db2.gz QGDUZTQHUPXLEE-UHFFFAOYSA-N -1 3 363.421 3.952 20 0 FHADHM Cc1ccc(/C=C\CC(=O)Nc2sc3c(c2-c2nnn[n-]2)CCC3)cc1 ZINC000822233949 606621452 /nfs/dbraw/zinc/62/14/52/606621452.db2.gz YMGGRYBTCANQSB-RQOWECAXSA-N -1 3 365.462 3.767 20 0 FHADHM Cc1ccc(/C=C\CC(=O)Nc2sc3c(c2-c2nn[n-]n2)CCC3)cc1 ZINC000822233949 606621454 /nfs/dbraw/zinc/62/14/54/606621454.db2.gz YMGGRYBTCANQSB-RQOWECAXSA-N -1 3 365.462 3.767 20 0 FHADHM CCc1ccc(C(C)(C)C(=O)N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000821475809 606626695 /nfs/dbraw/zinc/62/66/95/606626695.db2.gz ABIHFAXUAFVXBB-AWEZNQCLSA-N -1 3 363.465 3.584 20 0 FHADHM CCc1ccc(C(C)(C)C(=O)N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000821475809 606626697 /nfs/dbraw/zinc/62/66/97/606626697.db2.gz ABIHFAXUAFVXBB-AWEZNQCLSA-N -1 3 363.465 3.584 20 0 FHADHM FC(F)(F)COCCCSc1ccc(Cl)cc1-c1nnn[n-]1 ZINC000822719059 606629532 /nfs/dbraw/zinc/62/95/32/606629532.db2.gz YLMYVUAVFINMQY-UHFFFAOYSA-N -1 3 352.769 3.581 20 0 FHADHM FC(F)(F)COCCCSc1ccc(Cl)cc1-c1nn[n-]n1 ZINC000822719059 606629533 /nfs/dbraw/zinc/62/95/33/606629533.db2.gz YLMYVUAVFINMQY-UHFFFAOYSA-N -1 3 352.769 3.581 20 0 FHADHM Clc1ccc(SCc2noc(-c3ccccc3)n2)c(-c2nnn[n-]2)c1 ZINC000822578968 606630880 /nfs/dbraw/zinc/63/08/80/606630880.db2.gz UGRDCWUHLHKJQG-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1ccc(SCc2noc(-c3ccccc3)n2)c(-c2nn[n-]n2)c1 ZINC000822578968 606630882 /nfs/dbraw/zinc/63/08/82/606630882.db2.gz UGRDCWUHLHKJQG-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Cc1cccc(-c2c[nH]c([C@H]3CCCN3c3ccc(-c4nn[n-]n4)cc3)n2)c1 ZINC000822284056 606643782 /nfs/dbraw/zinc/64/37/82/606643782.db2.gz HPSIANKTLISONY-LJQANCHMSA-N -1 3 371.448 3.907 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NCc1csc(C(C)C)n1 ZINC000820154969 606656168 /nfs/dbraw/zinc/65/61/68/606656168.db2.gz FKGNANADKLDPLC-UHFFFAOYSA-N -1 3 358.471 3.846 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NCc1csc(C(C)C)n1 ZINC000820154969 606656169 /nfs/dbraw/zinc/65/61/69/606656169.db2.gz FKGNANADKLDPLC-UHFFFAOYSA-N -1 3 358.471 3.846 20 0 FHADHM O=C(Oc1cccc2ccccc21)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000823454756 606664092 /nfs/dbraw/zinc/66/40/92/606664092.db2.gz SSYRCGZBIQMFMD-UHFFFAOYSA-N -1 3 352.300 3.517 20 0 FHADHM O=C(Oc1cccc2ccccc21)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000823454756 606664093 /nfs/dbraw/zinc/66/40/93/606664093.db2.gz SSYRCGZBIQMFMD-UHFFFAOYSA-N -1 3 352.300 3.517 20 0 FHADHM CC[C@@H](C)c1ccccc1OC(=O)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000820882527 606664974 /nfs/dbraw/zinc/66/49/74/606664974.db2.gz SKUUODNRKVXYKT-SNVBAGLBSA-N -1 3 358.348 3.878 20 0 FHADHM CC[C@@H](C)c1ccccc1OC(=O)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000820882527 606664975 /nfs/dbraw/zinc/66/49/75/606664975.db2.gz SKUUODNRKVXYKT-SNVBAGLBSA-N -1 3 358.348 3.878 20 0 FHADHM CC(C)(C)c1cccc(OC(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)c1 ZINC000819957498 606665183 /nfs/dbraw/zinc/66/51/83/606665183.db2.gz AACRYBCYRJWUAC-UHFFFAOYSA-N -1 3 358.348 3.662 20 0 FHADHM CC(C)(C)c1cccc(OC(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)c1 ZINC000819957498 606665184 /nfs/dbraw/zinc/66/51/84/606665184.db2.gz AACRYBCYRJWUAC-UHFFFAOYSA-N -1 3 358.348 3.662 20 0 FHADHM CC[C@@H](C)N(Cc1ccccc1)C(=O)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000820876241 606665833 /nfs/dbraw/zinc/66/58/33/606665833.db2.gz ONYFHTJINKIXBM-GFCCVEGCSA-N -1 3 371.391 3.586 20 0 FHADHM CC[C@@H](C)N(Cc1ccccc1)C(=O)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000820876241 606665834 /nfs/dbraw/zinc/66/58/34/606665834.db2.gz ONYFHTJINKIXBM-GFCCVEGCSA-N -1 3 371.391 3.586 20 0 FHADHM CCc1ccc(CC)c(NC(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)c1 ZINC000821482159 606684115 /nfs/dbraw/zinc/68/41/15/606684115.db2.gz QUJIDAYLJJIKAN-UHFFFAOYSA-N -1 3 357.364 3.522 20 0 FHADHM CCc1ccc(CC)c(NC(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)c1 ZINC000821482159 606684116 /nfs/dbraw/zinc/68/41/16/606684116.db2.gz QUJIDAYLJJIKAN-UHFFFAOYSA-N -1 3 357.364 3.522 20 0 FHADHM O=C(O[C@@H]1CCCc2cc(F)ccc21)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000823393454 606685509 /nfs/dbraw/zinc/68/55/09/606685509.db2.gz XVOHWWTZRONOLP-OAHLLOKOSA-N -1 3 374.322 3.518 20 0 FHADHM O=C(O[C@@H]1CCCc2cc(F)ccc21)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000823393454 606685510 /nfs/dbraw/zinc/68/55/10/606685510.db2.gz XVOHWWTZRONOLP-OAHLLOKOSA-N -1 3 374.322 3.518 20 0 FHADHM Fc1cccc([C@H](NCc2ccc(-c3nnn[n-]3)s2)c2ccccc2)c1 ZINC000822787080 606733832 /nfs/dbraw/zinc/73/38/32/606733832.db2.gz UUMKZHXSYAKNBT-GOSISDBHSA-N -1 3 365.437 3.947 20 0 FHADHM C[C@H](OC(=O)c1c(F)cc(-c2nnn[n-]2)cc1F)c1ccc(Cl)cc1 ZINC000820500848 606755053 /nfs/dbraw/zinc/75/50/53/606755053.db2.gz GYZICALFIGKHFY-QMMMGPOBSA-N -1 3 364.739 3.716 20 0 FHADHM C[C@H](OC(=O)c1c(F)cc(-c2nn[n-]n2)cc1F)c1ccc(Cl)cc1 ZINC000820500848 606755055 /nfs/dbraw/zinc/75/50/55/606755055.db2.gz GYZICALFIGKHFY-QMMMGPOBSA-N -1 3 364.739 3.716 20 0 FHADHM O=C(OCc1csc2ccccc12)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000823440094 606759608 /nfs/dbraw/zinc/75/96/08/606759608.db2.gz CAZCEAFUXNOARM-UHFFFAOYSA-N -1 3 372.356 3.717 20 0 FHADHM O=C(OCc1csc2ccccc12)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000823440094 606759609 /nfs/dbraw/zinc/75/96/09/606759609.db2.gz CAZCEAFUXNOARM-UHFFFAOYSA-N -1 3 372.356 3.717 20 0 FHADHM CC(C)C[C@@H](OC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1ccccn1 ZINC000820062166 606764111 /nfs/dbraw/zinc/76/41/11/606764111.db2.gz IMANUKQMIOJHJT-DOJUMQAQSA-N -1 3 363.421 3.606 20 0 FHADHM CC(C)C[C@@H](OC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1ccccn1 ZINC000820062166 606764113 /nfs/dbraw/zinc/76/41/13/606764113.db2.gz IMANUKQMIOJHJT-DOJUMQAQSA-N -1 3 363.421 3.606 20 0 FHADHM Cc1nnc(-c2cccc(-c3nnn[n-]3)c2)n1CC[C@@H]1CCC[C@@H](C)C1 ZINC000822505455 606770243 /nfs/dbraw/zinc/77/02/43/606770243.db2.gz LBDAVPBVMPDZGT-HIFRSBDPSA-N -1 3 351.458 3.650 20 0 FHADHM Cc1nnc(-c2cccc(-c3nn[n-]n3)c2)n1CC[C@@H]1CCC[C@@H](C)C1 ZINC000822505455 606770245 /nfs/dbraw/zinc/77/02/45/606770245.db2.gz LBDAVPBVMPDZGT-HIFRSBDPSA-N -1 3 351.458 3.650 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(OCc2cc(-c3cccs3)on2)c1 ZINC000822568840 606781379 /nfs/dbraw/zinc/78/13/79/606781379.db2.gz YVXPKQMVWNIHMJ-UHFFFAOYSA-N -1 3 359.798 3.816 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(OCc2cc(-c3cccs3)on2)c1 ZINC000822568840 606781381 /nfs/dbraw/zinc/78/13/81/606781381.db2.gz YVXPKQMVWNIHMJ-UHFFFAOYSA-N -1 3 359.798 3.816 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cccc(C(C)C)n2)c1-c1nnn[n-]1 ZINC000821466358 606810711 /nfs/dbraw/zinc/81/07/11/606810711.db2.gz WACKCIMPRFMPJI-UHFFFAOYSA-N -1 3 356.455 3.570 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cccc(C(C)C)n2)c1-c1nn[n-]n1 ZINC000821466358 606810713 /nfs/dbraw/zinc/81/07/13/606810713.db2.gz WACKCIMPRFMPJI-UHFFFAOYSA-N -1 3 356.455 3.570 20 0 FHADHM CC(C)CN(C(=O)Cc1cccc(-c2nnn[n-]2)c1)c1ccc(Cl)cc1 ZINC000820081883 606811910 /nfs/dbraw/zinc/81/19/10/606811910.db2.gz ZWOBPLVCVPLLDB-UHFFFAOYSA-N -1 3 369.856 3.752 20 0 FHADHM CC(C)CN(C(=O)Cc1cccc(-c2nn[n-]n2)c1)c1ccc(Cl)cc1 ZINC000820081883 606811912 /nfs/dbraw/zinc/81/19/12/606811912.db2.gz ZWOBPLVCVPLLDB-UHFFFAOYSA-N -1 3 369.856 3.752 20 0 FHADHM C[C@H](SCc1ccc(-c2nnn[n-]2)cc1)c1nc(-c2ccccc2)no1 ZINC000820549865 606827694 /nfs/dbraw/zinc/82/76/94/606827694.db2.gz SREHOIDTCKOVJQ-LBPRGKRZSA-N -1 3 364.434 3.911 20 0 FHADHM C[C@H](SCc1ccc(-c2nn[n-]n2)cc1)c1nc(-c2ccccc2)no1 ZINC000820549865 606827695 /nfs/dbraw/zinc/82/76/95/606827695.db2.gz SREHOIDTCKOVJQ-LBPRGKRZSA-N -1 3 364.434 3.911 20 0 FHADHM C[C@H](SCC(=O)N(C)[C@H]1CCCC[C@H]1C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820549115 606827821 /nfs/dbraw/zinc/82/78/21/606827821.db2.gz KLRVRXQCQQKKHF-KEYYUXOJSA-N -1 3 373.526 3.698 20 0 FHADHM C[C@H](SCC(=O)N(C)[C@H]1CCCC[C@H]1C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820549115 606827822 /nfs/dbraw/zinc/82/78/22/606827822.db2.gz KLRVRXQCQQKKHF-KEYYUXOJSA-N -1 3 373.526 3.698 20 0 FHADHM CC(C)(C)OCCCSCc1ccc(-c2nnn[n-]2)cc1OC(F)F ZINC000819951255 606849024 /nfs/dbraw/zinc/84/90/24/606849024.db2.gz QFMMEFCPMKCSNJ-UHFFFAOYSA-N -1 3 372.441 3.907 20 0 FHADHM CC(C)(C)OCCCSCc1ccc(-c2nn[n-]n2)cc1OC(F)F ZINC000819951255 606849025 /nfs/dbraw/zinc/84/90/25/606849025.db2.gz QFMMEFCPMKCSNJ-UHFFFAOYSA-N -1 3 372.441 3.907 20 0 FHADHM O=C(c1ccc(-c2nnn[n-]2)cc1)N(c1ccc(F)cc1)C1CCCC1 ZINC000823472600 606856248 /nfs/dbraw/zinc/85/62/48/606856248.db2.gz RWYDMUXVYPCFGM-UHFFFAOYSA-N -1 3 351.385 3.595 20 0 FHADHM O=C(c1ccc(-c2nn[n-]n2)cc1)N(c1ccc(F)cc1)C1CCCC1 ZINC000823472600 606856249 /nfs/dbraw/zinc/85/62/49/606856249.db2.gz RWYDMUXVYPCFGM-UHFFFAOYSA-N -1 3 351.385 3.595 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1N[C@@H]1CC2(CCC2)Oc2ccccc21 ZINC000822744032 606879776 /nfs/dbraw/zinc/87/97/76/606879776.db2.gz KGCXJUWJLSGTIT-MRXNPFEDSA-N -1 3 351.385 3.864 20 0 FHADHM Cc1ccc(-c2cncc(C(=O)OCc3ccc(-c4nnn[n-]4)cc3)c2)cc1 ZINC000822213909 606890168 /nfs/dbraw/zinc/89/01/68/606890168.db2.gz GPHCNHYCUUFXNO-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM Cc1ccc(-c2cncc(C(=O)OCc3ccc(-c4nn[n-]n4)cc3)c2)cc1 ZINC000822213909 606890169 /nfs/dbraw/zinc/89/01/69/606890169.db2.gz GPHCNHYCUUFXNO-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM CCN(C[C@H](O)c1ccc(-c2nnn[n-]2)cc1)c1cccc2ccccc21 ZINC000821169957 606918964 /nfs/dbraw/zinc/91/89/64/606918964.db2.gz JPKRYDCWRHMVCQ-FQEVSTJZSA-N -1 3 359.433 3.580 20 0 FHADHM CCN(C[C@H](O)c1ccc(-c2nn[n-]n2)cc1)c1cccc2ccccc21 ZINC000821169957 606918967 /nfs/dbraw/zinc/91/89/67/606918967.db2.gz JPKRYDCWRHMVCQ-FQEVSTJZSA-N -1 3 359.433 3.580 20 0 FHADHM Cc1cc(Br)ccc1NCc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000822159571 606926213 /nfs/dbraw/zinc/92/62/13/606926213.db2.gz BAPABTXFRCOPBP-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Cc1cc(Br)ccc1NCc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000822159571 606926214 /nfs/dbraw/zinc/92/62/14/606926214.db2.gz BAPABTXFRCOPBP-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Fc1ccc(CNc2ccc(OC(F)(F)F)cc2)cc1-c1nnn[n-]1 ZINC000822771755 606928327 /nfs/dbraw/zinc/92/83/27/606928327.db2.gz LRCKYOSNEUIWJY-UHFFFAOYSA-N -1 3 353.279 3.517 20 0 FHADHM Fc1ccc(CNc2ccc(OC(F)(F)F)cc2)cc1-c1nn[n-]n1 ZINC000822771755 606928329 /nfs/dbraw/zinc/92/83/29/606928329.db2.gz LRCKYOSNEUIWJY-UHFFFAOYSA-N -1 3 353.279 3.517 20 0 FHADHM O=C(c1ccccc1)c1cccc(NCc2ccc(F)c(-c3nnn[n-]3)c2)c1 ZINC000823493186 606929906 /nfs/dbraw/zinc/92/99/06/606929906.db2.gz HOHJSCMLSFKEPV-UHFFFAOYSA-N -1 3 373.391 3.849 20 0 FHADHM O=C(c1ccccc1)c1cccc(NCc2ccc(F)c(-c3nn[n-]n3)c2)c1 ZINC000823493186 606929907 /nfs/dbraw/zinc/92/99/07/606929907.db2.gz HOHJSCMLSFKEPV-UHFFFAOYSA-N -1 3 373.391 3.849 20 0 FHADHM Fc1ccc(NCc2ccc(F)c(-c3nnn[n-]3)c2)cc1Br ZINC000822782822 606931774 /nfs/dbraw/zinc/93/17/74/606931774.db2.gz IGCVXVXEUSJJMQ-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1ccc(NCc2ccc(F)c(-c3nn[n-]n3)c2)cc1Br ZINC000822782822 606931775 /nfs/dbraw/zinc/93/17/75/606931775.db2.gz IGCVXVXEUSJJMQ-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM CC(C)c1ccc(N(C)C(=O)CSc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000820192787 606936229 /nfs/dbraw/zinc/93/62/29/606936229.db2.gz ZLTXOQKDTVORFT-UHFFFAOYSA-N -1 3 367.478 3.745 20 0 FHADHM CC(C)c1ccc(N(C)C(=O)CSc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000820192787 606936230 /nfs/dbraw/zinc/93/62/30/606936230.db2.gz ZLTXOQKDTVORFT-UHFFFAOYSA-N -1 3 367.478 3.745 20 0 FHADHM CN(C(=O)[C@H]1C[C@H]1C1CCCCC1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821569527 606959139 /nfs/dbraw/zinc/95/91/39/606959139.db2.gz NDXKLGINPXKTDB-GJZGRUSLSA-N -1 3 359.861 3.699 20 0 FHADHM CN(C(=O)[C@H]1C[C@H]1C1CCCCC1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821569527 606959141 /nfs/dbraw/zinc/95/91/41/606959141.db2.gz NDXKLGINPXKTDB-GJZGRUSLSA-N -1 3 359.861 3.699 20 0 FHADHM CN(C(=O)c1coc2ccccc12)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821574477 606961692 /nfs/dbraw/zinc/96/16/92/606961692.db2.gz IGTAAWBLTPLGNR-UHFFFAOYSA-N -1 3 353.769 3.543 20 0 FHADHM CN(C(=O)c1coc2ccccc12)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821574477 606961693 /nfs/dbraw/zinc/96/16/93/606961693.db2.gz IGTAAWBLTPLGNR-UHFFFAOYSA-N -1 3 353.769 3.543 20 0 FHADHM CCc1ccccc1NC(=O)[C@@H](C)Sc1cccc(-c2nnn[n-]2)c1 ZINC000821497457 607015342 /nfs/dbraw/zinc/01/53/42/607015342.db2.gz STHNRUQOXSKZCX-GFCCVEGCSA-N -1 3 353.451 3.548 20 0 FHADHM CCc1ccccc1NC(=O)[C@@H](C)Sc1cccc(-c2nn[n-]n2)c1 ZINC000821497457 607015344 /nfs/dbraw/zinc/01/53/44/607015344.db2.gz STHNRUQOXSKZCX-GFCCVEGCSA-N -1 3 353.451 3.548 20 0 FHADHM C[C@H]1CC[C@H](CC(=O)N(Cc2ccco2)c2ccccc2-c2nnn[n-]2)C1 ZINC000820684169 607054703 /nfs/dbraw/zinc/05/47/03/607054703.db2.gz MSNVAQSFBRCQJX-GJZGRUSLSA-N -1 3 365.437 3.819 20 0 FHADHM C[C@H]1CC[C@H](CC(=O)N(Cc2ccco2)c2ccccc2-c2nn[n-]n2)C1 ZINC000820684169 607054706 /nfs/dbraw/zinc/05/47/06/607054706.db2.gz MSNVAQSFBRCQJX-GJZGRUSLSA-N -1 3 365.437 3.819 20 0 FHADHM C[C@@H]1CN(c2ccc(Cl)cc2-c2nnn[n-]2)C[C@H](c2ccsc2)O1 ZINC000820776445 607116627 /nfs/dbraw/zinc/11/66/27/607116627.db2.gz MASZWLIGYYBMBN-MEBBXXQBSA-N -1 3 361.858 3.548 20 0 FHADHM C[C@@H]1CN(c2ccc(Cl)cc2-c2nn[n-]n2)C[C@H](c2ccsc2)O1 ZINC000820776445 607116629 /nfs/dbraw/zinc/11/66/29/607116629.db2.gz MASZWLIGYYBMBN-MEBBXXQBSA-N -1 3 361.858 3.548 20 0 FHADHM O=C(Nc1ccc(Oc2ccccc2-c2nnn[n-]2)cc1)[C@H]1CC12CCC2 ZINC000823356003 607123482 /nfs/dbraw/zinc/12/34/82/607123482.db2.gz HWIKCCDQVWCERX-MRXNPFEDSA-N -1 3 361.405 3.788 20 0 FHADHM O=C(Nc1ccc(Oc2ccccc2-c2nn[n-]n2)cc1)[C@H]1CC12CCC2 ZINC000823356003 607123483 /nfs/dbraw/zinc/12/34/83/607123483.db2.gz HWIKCCDQVWCERX-MRXNPFEDSA-N -1 3 361.405 3.788 20 0 FHADHM Fc1cc(NC/C=C/Cl)ccc1OCc1cccc(-c2nnn[n-]2)c1 ZINC000822753067 607124162 /nfs/dbraw/zinc/12/41/62/607124162.db2.gz BLSRYKIURIRSME-FARCUNLSSA-N -1 3 359.792 3.749 20 0 FHADHM Fc1cc(NC/C=C/Cl)ccc1OCc1cccc(-c2nn[n-]n2)c1 ZINC000822753067 607124163 /nfs/dbraw/zinc/12/41/63/607124163.db2.gz BLSRYKIURIRSME-FARCUNLSSA-N -1 3 359.792 3.749 20 0 FHADHM Cc1sc2nc(C)nc(Oc3ccc(-c4nnn[n-]4)cc3F)c2c1C ZINC000822453186 607128835 /nfs/dbraw/zinc/12/88/35/607128835.db2.gz DVFXGEYVCQRGHV-UHFFFAOYSA-N -1 3 356.386 3.728 20 0 FHADHM Cc1sc2nc(C)nc(Oc3ccc(-c4nn[n-]n4)cc3F)c2c1C ZINC000822453186 607128836 /nfs/dbraw/zinc/12/88/36/607128836.db2.gz DVFXGEYVCQRGHV-UHFFFAOYSA-N -1 3 356.386 3.728 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1Oc1nc(C(F)F)nc2ccccc21 ZINC000822747964 607128958 /nfs/dbraw/zinc/12/89/58/607128958.db2.gz AGXIQHUVATWZBC-UHFFFAOYSA-N -1 3 358.283 3.679 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1Oc1nc(C(F)F)nc2ccccc21 ZINC000822747964 607128960 /nfs/dbraw/zinc/12/89/60/607128960.db2.gz AGXIQHUVATWZBC-UHFFFAOYSA-N -1 3 358.283 3.679 20 0 FHADHM CC(C)c1ccccc1NC(=O)[C@@H](C)Oc1ccc(-c2nnn[n-]2)cc1F ZINC000820536451 607134043 /nfs/dbraw/zinc/13/40/43/607134043.db2.gz UAVIEPBBDBSJOW-GFCCVEGCSA-N -1 3 369.400 3.535 20 0 FHADHM CC(C)c1ccccc1NC(=O)[C@@H](C)Oc1ccc(-c2nn[n-]n2)cc1F ZINC000820536451 607134044 /nfs/dbraw/zinc/13/40/44/607134044.db2.gz UAVIEPBBDBSJOW-GFCCVEGCSA-N -1 3 369.400 3.535 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1cc(CC)c(CC)o1 ZINC000821105003 607145303 /nfs/dbraw/zinc/14/53/03/607145303.db2.gz UVNFECRSUPJENT-UHFFFAOYSA-N -1 3 367.453 3.637 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1cc(CC)c(CC)o1 ZINC000821105003 607145304 /nfs/dbraw/zinc/14/53/04/607145304.db2.gz UVNFECRSUPJENT-UHFFFAOYSA-N -1 3 367.453 3.637 20 0 FHADHM CCC[C@H](C)[C@@H]1CCCN1C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821015453 607153201 /nfs/dbraw/zinc/15/32/01/607153201.db2.gz QEQVDOJRPPORJR-ZQIUZPCESA-N -1 3 356.474 3.538 20 0 FHADHM CCC[C@H](C)[C@@H]1CCCN1C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821015453 607153203 /nfs/dbraw/zinc/15/32/03/607153203.db2.gz QEQVDOJRPPORJR-ZQIUZPCESA-N -1 3 356.474 3.538 20 0 FHADHM CCc1oc(C(=O)N(CC)[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1C ZINC000821559010 607153850 /nfs/dbraw/zinc/15/38/50/607153850.db2.gz OYZIJRLUZPNTJC-CYBMUJFWSA-N -1 3 353.426 3.554 20 0 FHADHM CCc1oc(C(=O)N(CC)[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1C ZINC000821559010 607153851 /nfs/dbraw/zinc/15/38/51/607153851.db2.gz OYZIJRLUZPNTJC-CYBMUJFWSA-N -1 3 353.426 3.554 20 0 FHADHM CCc1cc(C(=O)N(CC)[C@H](C)c2ccc(-c3nnn[n-]3)cc2)oc1CC ZINC000821469335 607156319 /nfs/dbraw/zinc/15/63/19/607156319.db2.gz CUIJSRUDQHWPKD-CYBMUJFWSA-N -1 3 367.453 3.808 20 0 FHADHM CCc1cc(C(=O)N(CC)[C@H](C)c2ccc(-c3nn[n-]n3)cc2)oc1CC ZINC000821469335 607156321 /nfs/dbraw/zinc/15/63/21/607156321.db2.gz CUIJSRUDQHWPKD-CYBMUJFWSA-N -1 3 367.453 3.808 20 0 FHADHM Cc1ccccc1-c1nc(CSc2cccc(-c3nnn[n-]3)c2)no1 ZINC000822345588 607158982 /nfs/dbraw/zinc/15/89/82/607158982.db2.gz LLLGPFCTGCORFL-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM Cc1ccccc1-c1nc(CSc2cccc(-c3nn[n-]n3)c2)no1 ZINC000822345588 607158983 /nfs/dbraw/zinc/15/89/83/607158983.db2.gz LLLGPFCTGCORFL-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM C[C@H](Sc1ccc(-c2nnn[n-]2)cn1)c1cccc(Br)c1 ZINC000820550603 607161086 /nfs/dbraw/zinc/16/10/86/607161086.db2.gz XIYSXNVJABPFKK-VIFPVBQESA-N -1 3 362.256 3.878 20 0 FHADHM C[C@H](Sc1ccc(-c2nn[n-]n2)cn1)c1cccc(Br)c1 ZINC000820550603 607161087 /nfs/dbraw/zinc/16/10/87/607161087.db2.gz XIYSXNVJABPFKK-VIFPVBQESA-N -1 3 362.256 3.878 20 0 FHADHM CC(C)CC[C@H]1CCCN1C(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000820074013 607164437 /nfs/dbraw/zinc/16/44/37/607164437.db2.gz XWKZMLOGYGQADT-QGZVFWFLSA-N -1 3 373.526 3.527 20 0 FHADHM CC(C)CC[C@H]1CCCN1C(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000820074013 607164439 /nfs/dbraw/zinc/16/44/39/607164439.db2.gz XWKZMLOGYGQADT-QGZVFWFLSA-N -1 3 373.526 3.527 20 0 FHADHM CC1(C)[C@H](Nc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)[C@@H]2CCCO[C@H]21 ZINC000820586504 607173326 /nfs/dbraw/zinc/17/33/26/607173326.db2.gz WQVBBLVJSMOONR-ZLKJLUDKSA-N -1 3 367.375 3.501 20 0 FHADHM CC1(C)[C@H](Nc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)[C@@H]2CCCO[C@H]21 ZINC000820586504 607173327 /nfs/dbraw/zinc/17/33/27/607173327.db2.gz WQVBBLVJSMOONR-ZLKJLUDKSA-N -1 3 367.375 3.501 20 0 FHADHM O=C(CCSc1ccccc1)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822974525 607190151 /nfs/dbraw/zinc/19/01/51/607190151.db2.gz QJGBYVRBHBKYON-UHFFFAOYSA-N -1 3 359.842 3.641 20 0 FHADHM O=C(CCSc1ccccc1)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822974525 607190152 /nfs/dbraw/zinc/19/01/52/607190152.db2.gz QJGBYVRBHBKYON-UHFFFAOYSA-N -1 3 359.842 3.641 20 0 FHADHM O=C(Nc1cc(C(F)F)ccc1Cl)c1sccc1-c1nnn[n-]1 ZINC000823299486 607192055 /nfs/dbraw/zinc/19/20/55/607192055.db2.gz ZIRNKEYEXZGZPR-UHFFFAOYSA-N -1 3 355.757 3.772 20 0 FHADHM O=C(Nc1cc(C(F)F)ccc1Cl)c1sccc1-c1nn[n-]n1 ZINC000823299486 607192056 /nfs/dbraw/zinc/19/20/56/607192056.db2.gz ZIRNKEYEXZGZPR-UHFFFAOYSA-N -1 3 355.757 3.772 20 0 FHADHM Cc1cccc(C(C)(C)NC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)c1 ZINC000822289075 607196670 /nfs/dbraw/zinc/19/66/70/607196670.db2.gz QRVKBDDLRXYXFJ-UHFFFAOYSA-N -1 3 370.844 3.885 20 0 FHADHM Cc1cccc(C(C)(C)NC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)c1 ZINC000822289075 607196671 /nfs/dbraw/zinc/19/66/71/607196671.db2.gz QRVKBDDLRXYXFJ-UHFFFAOYSA-N -1 3 370.844 3.885 20 0 FHADHM CN(C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)C1CCC(C)(C)CC1 ZINC000821572138 607198143 /nfs/dbraw/zinc/19/81/43/607198143.db2.gz SSGMUBNUNKPYJL-UHFFFAOYSA-N -1 3 362.865 3.953 20 0 FHADHM CN(C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)C1CCC(C)(C)CC1 ZINC000821572138 607198144 /nfs/dbraw/zinc/19/81/44/607198144.db2.gz SSGMUBNUNKPYJL-UHFFFAOYSA-N -1 3 362.865 3.953 20 0 FHADHM CCC[C@@]1(C)CCCN(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)C1 ZINC000821026802 607199050 /nfs/dbraw/zinc/19/90/50/607199050.db2.gz CNEHHRYSZBOFTG-KRWDZBQOSA-N -1 3 362.865 3.954 20 0 FHADHM CCC[C@@]1(C)CCCN(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)C1 ZINC000821026802 607199051 /nfs/dbraw/zinc/19/90/51/607199051.db2.gz CNEHHRYSZBOFTG-KRWDZBQOSA-N -1 3 362.865 3.954 20 0 FHADHM CCC[C@H]1[C@@H](C)CCCN1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000821034805 607199056 /nfs/dbraw/zinc/19/90/56/607199056.db2.gz UIFOYZFAQWGTEP-NHYWBVRUSA-N -1 3 362.865 3.953 20 0 FHADHM CCC[C@H]1[C@@H](C)CCCN1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000821034805 607199057 /nfs/dbraw/zinc/19/90/57/607199057.db2.gz UIFOYZFAQWGTEP-NHYWBVRUSA-N -1 3 362.865 3.953 20 0 FHADHM CC(C)N(Cc1ccccc1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820121219 607203128 /nfs/dbraw/zinc/20/31/28/607203128.db2.gz NHEHMCQDJZIATH-UHFFFAOYSA-N -1 3 370.844 3.963 20 0 FHADHM CC(C)N(Cc1ccccc1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820121219 607203129 /nfs/dbraw/zinc/20/31/29/607203129.db2.gz NHEHMCQDJZIATH-UHFFFAOYSA-N -1 3 370.844 3.963 20 0 FHADHM O=C(c1sccc1-c1nnn[n-]1)N1CCC[C@@H]1CCC1CCCCC1 ZINC000823498027 607225526 /nfs/dbraw/zinc/22/55/26/607225526.db2.gz DYQJBWYFYQXFGS-CQSZACIVSA-N -1 3 359.499 3.893 20 0 FHADHM O=C(c1sccc1-c1nn[n-]n1)N1CCC[C@@H]1CCC1CCCCC1 ZINC000823498027 607225527 /nfs/dbraw/zinc/22/55/27/607225527.db2.gz DYQJBWYFYQXFGS-CQSZACIVSA-N -1 3 359.499 3.893 20 0 FHADHM O=C(C[C@@H]1CCc2ccccc2C1)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822945352 607241925 /nfs/dbraw/zinc/24/19/25/607241925.db2.gz BTCDZZWHZFEUTL-GFCCVEGCSA-N -1 3 367.840 3.654 20 0 FHADHM O=C(C[C@@H]1CCc2ccccc2C1)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822945352 607241926 /nfs/dbraw/zinc/24/19/26/607241926.db2.gz BTCDZZWHZFEUTL-GFCCVEGCSA-N -1 3 367.840 3.654 20 0 FHADHM Cc1cc(C)cc(C2(C(=O)Nc3ccc(-c4nnn[n-]4)cc3Cl)CC2)c1 ZINC000822196717 607243831 /nfs/dbraw/zinc/24/38/31/607243831.db2.gz UMNXNJWNCJOYES-UHFFFAOYSA-N -1 3 367.840 3.807 20 0 FHADHM Cc1cc(C)cc(C2(C(=O)Nc3ccc(-c4nn[n-]n4)cc3Cl)CC2)c1 ZINC000822196717 607243832 /nfs/dbraw/zinc/24/38/32/607243832.db2.gz UMNXNJWNCJOYES-UHFFFAOYSA-N -1 3 367.840 3.807 20 0 FHADHM Cc1cc(CCCC(=O)Oc2ccc(-c3nnn[n-]3)cc2F)c(C)s1 ZINC000822200112 607247953 /nfs/dbraw/zinc/24/79/53/607247953.db2.gz VAVQMYPQXFKXLC-UHFFFAOYSA-N -1 3 360.414 3.612 20 0 FHADHM Cc1cc(CCCC(=O)Oc2ccc(-c3nn[n-]n3)cc2F)c(C)s1 ZINC000822200112 607247954 /nfs/dbraw/zinc/24/79/54/607247954.db2.gz VAVQMYPQXFKXLC-UHFFFAOYSA-N -1 3 360.414 3.612 20 0 FHADHM CC1(C)C[C@@H](NC(=S)Nc2ccccc2-c2nnn[n-]2)c2ccccc21 ZINC000820589717 607251653 /nfs/dbraw/zinc/25/16/53/607251653.db2.gz LIOQMGMDXGMOFL-MRXNPFEDSA-N -1 3 364.478 3.576 20 0 FHADHM CC1(C)C[C@@H](NC(=S)Nc2ccccc2-c2nn[n-]n2)c2ccccc21 ZINC000820589717 607251654 /nfs/dbraw/zinc/25/16/54/607251654.db2.gz LIOQMGMDXGMOFL-MRXNPFEDSA-N -1 3 364.478 3.576 20 0 FHADHM C[C@H](CC(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(F)cc1F ZINC000824384530 607777243 /nfs/dbraw/zinc/77/72/43/607777243.db2.gz CZCQRKNXXNEPPL-NEPJUHHUSA-N -1 3 372.375 3.943 20 0 FHADHM C[C@H](CC(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(F)cc1F ZINC000824384530 607777244 /nfs/dbraw/zinc/77/72/44/607777244.db2.gz CZCQRKNXXNEPPL-NEPJUHHUSA-N -1 3 372.375 3.943 20 0 FHADHM C[C@@H](OC(=O)C[C@H](C)c1ccc(F)cc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000824385605 607778698 /nfs/dbraw/zinc/77/86/98/607778698.db2.gz XNKWHXQTKAOPOA-NWDGAFQWSA-N -1 3 372.375 3.943 20 0 FHADHM C[C@@H](OC(=O)C[C@H](C)c1ccc(F)cc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000824385605 607778699 /nfs/dbraw/zinc/77/86/99/607778699.db2.gz XNKWHXQTKAOPOA-NWDGAFQWSA-N -1 3 372.375 3.943 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@H](CC)c2ccccc2)cc1-c1nnn[n-]1 ZINC000825553784 607783950 /nfs/dbraw/zinc/78/39/50/607783950.db2.gz WFDZARYVPZWRBD-MRXNPFEDSA-N -1 3 366.425 3.998 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@H](CC)c2ccccc2)cc1-c1nn[n-]n1 ZINC000825553784 607783951 /nfs/dbraw/zinc/78/39/51/607783951.db2.gz WFDZARYVPZWRBD-MRXNPFEDSA-N -1 3 366.425 3.998 20 0 FHADHM CN(C(=O)c1ccc(-c2ccc(F)cc2)o1)c1ccccc1-c1nnn[n-]1 ZINC000825826100 607788481 /nfs/dbraw/zinc/78/84/81/607788481.db2.gz WMJAQFPKUWSLBG-UHFFFAOYSA-N -1 3 363.352 3.542 20 0 FHADHM CN(C(=O)c1ccc(-c2ccc(F)cc2)o1)c1ccccc1-c1nn[n-]n1 ZINC000825826100 607788482 /nfs/dbraw/zinc/78/84/82/607788482.db2.gz WMJAQFPKUWSLBG-UHFFFAOYSA-N -1 3 363.352 3.542 20 0 FHADHM CN(C(=O)c1cc(C2CC2)nc2ccccc21)c1ccccc1-c1nnn[n-]1 ZINC000825826017 607788574 /nfs/dbraw/zinc/78/85/74/607788574.db2.gz RXQAMCSMTDZSQP-UHFFFAOYSA-N -1 3 370.416 3.569 20 0 FHADHM CN(C(=O)c1cc(C2CC2)nc2ccccc21)c1ccccc1-c1nn[n-]n1 ZINC000825826017 607788575 /nfs/dbraw/zinc/78/85/75/607788575.db2.gz RXQAMCSMTDZSQP-UHFFFAOYSA-N -1 3 370.416 3.569 20 0 FHADHM Cc1cccc(-c2cncc(C(=O)N(C)c3ccccc3-c3nnn[n-]3)c2)c1 ZINC000826295831 607789225 /nfs/dbraw/zinc/78/92/25/607789225.db2.gz ZMRSHMSCIMEISI-UHFFFAOYSA-N -1 3 370.416 3.514 20 0 FHADHM Cc1cccc(-c2cncc(C(=O)N(C)c3ccccc3-c3nn[n-]n3)c2)c1 ZINC000826295831 607789226 /nfs/dbraw/zinc/78/92/26/607789226.db2.gz ZMRSHMSCIMEISI-UHFFFAOYSA-N -1 3 370.416 3.514 20 0 FHADHM Cc1cc(Oc2ccc(-c3nnn[n-]3)cc2)ccc1NC(=O)[C@H]1CC1(C)C ZINC000826272063 607793304 /nfs/dbraw/zinc/79/33/04/607793304.db2.gz SHNPBRPHJWRMAS-MRXNPFEDSA-N -1 3 363.421 3.952 20 0 FHADHM Cc1cc(Oc2ccc(-c3nn[n-]n3)cc2)ccc1NC(=O)[C@H]1CC1(C)C ZINC000826272063 607793305 /nfs/dbraw/zinc/79/33/05/607793305.db2.gz SHNPBRPHJWRMAS-MRXNPFEDSA-N -1 3 363.421 3.952 20 0 FHADHM CCN(C(=O)[C@H](C)CSc1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825362644 607799652 /nfs/dbraw/zinc/79/96/52/607799652.db2.gz QGZKSVGRDPMCLC-CQSZACIVSA-N -1 3 367.478 3.648 20 0 FHADHM CCN(C(=O)[C@H](C)CSc1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825362644 607799653 /nfs/dbraw/zinc/79/96/53/607799653.db2.gz QGZKSVGRDPMCLC-CQSZACIVSA-N -1 3 367.478 3.648 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@H](C)Cc1ccccc1Cl ZINC000826277431 607817947 /nfs/dbraw/zinc/81/79/47/607817947.db2.gz UPGHJXLJENKSQH-GFCCVEGCSA-N -1 3 355.829 3.646 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@H](C)Cc1ccccc1Cl ZINC000826277431 607817948 /nfs/dbraw/zinc/81/79/48/607817948.db2.gz UPGHJXLJENKSQH-GFCCVEGCSA-N -1 3 355.829 3.646 20 0 FHADHM Cc1cccc2c1ncc(-c1nnn[n-]1)c2N1CCC(c2ccccn2)CC1 ZINC000826304740 607820276 /nfs/dbraw/zinc/82/02/76/607820276.db2.gz WMRTZKWILHMQHG-UHFFFAOYSA-N -1 3 371.448 3.502 20 0 FHADHM Cc1cccc2c1ncc(-c1nn[n-]n1)c2N1CCC(c2ccccn2)CC1 ZINC000826304740 607820277 /nfs/dbraw/zinc/82/02/77/607820277.db2.gz WMRTZKWILHMQHG-UHFFFAOYSA-N -1 3 371.448 3.502 20 0 FHADHM CCN(C(=O)[C@H](C)Cc1ccccc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000825363344 607829767 /nfs/dbraw/zinc/82/97/67/607829767.db2.gz YRSPYKXRBJEZIG-CYBMUJFWSA-N -1 3 369.856 3.752 20 0 FHADHM CCN(C(=O)[C@H](C)Cc1ccccc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000825363344 607829768 /nfs/dbraw/zinc/82/97/68/607829768.db2.gz YRSPYKXRBJEZIG-CYBMUJFWSA-N -1 3 369.856 3.752 20 0 FHADHM CN(C(=O)CCCSC(C)(C)C)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000825817823 607830842 /nfs/dbraw/zinc/83/08/42/607830842.db2.gz PXBDLTAAUVWECI-UHFFFAOYSA-N -1 3 367.906 3.795 20 0 FHADHM CN(C(=O)CCCSC(C)(C)C)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000825817823 607830843 /nfs/dbraw/zinc/83/08/43/607830843.db2.gz PXBDLTAAUVWECI-UHFFFAOYSA-N -1 3 367.906 3.795 20 0 FHADHM Oc1ccc(C2CCN(c3ccc4cc(-c5nnn[n-]5)ccc4n3)CC2)cc1 ZINC000826510989 607840068 /nfs/dbraw/zinc/84/00/68/607840068.db2.gz WRSQPBKEJJDEPA-UHFFFAOYSA-N -1 3 372.432 3.505 20 0 FHADHM Oc1ccc(C2CCN(c3ccc4cc(-c5nn[n-]n5)ccc4n3)CC2)cc1 ZINC000826510989 607840069 /nfs/dbraw/zinc/84/00/69/607840069.db2.gz WRSQPBKEJJDEPA-UHFFFAOYSA-N -1 3 372.432 3.505 20 0 FHADHM Clc1cc(-c2nnn[n-]2)ccc1SCc1cccc2c1OCCO2 ZINC000826350545 607843956 /nfs/dbraw/zinc/84/39/56/607843956.db2.gz AYJDVULCXYZYCI-UHFFFAOYSA-N -1 3 360.826 3.584 20 0 FHADHM Clc1cc(-c2nn[n-]n2)ccc1SCc1cccc2c1OCCO2 ZINC000826350545 607843957 /nfs/dbraw/zinc/84/39/57/607843957.db2.gz AYJDVULCXYZYCI-UHFFFAOYSA-N -1 3 360.826 3.584 20 0 FHADHM CC(C)[C@H](C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccc(F)cc1 ZINC000824473020 607880982 /nfs/dbraw/zinc/88/09/82/607880982.db2.gz YPETWAAJZOPYAM-UGSOOPFHSA-N -1 3 367.428 3.623 20 0 FHADHM CC(C)[C@H](C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccc(F)cc1 ZINC000824473020 607880983 /nfs/dbraw/zinc/88/09/83/607880983.db2.gz YPETWAAJZOPYAM-UGSOOPFHSA-N -1 3 367.428 3.623 20 0 FHADHM FC(F)(F)c1ccccc1OCCCCn1ccc(-c2nnn[n-]2)c1 ZINC000826368799 607891960 /nfs/dbraw/zinc/89/19/60/607891960.db2.gz BPSJBSBEYJALCZ-UHFFFAOYSA-N -1 3 351.332 3.546 20 0 FHADHM FC(F)(F)c1ccccc1OCCCCn1ccc(-c2nn[n-]n2)c1 ZINC000826368799 607891961 /nfs/dbraw/zinc/89/19/61/607891961.db2.gz BPSJBSBEYJALCZ-UHFFFAOYSA-N -1 3 351.332 3.546 20 0 FHADHM CC1(C)CCC[C@H](CC(=O)NC2(c3cccc(-c4nnn[n-]4)c3)CC2)C1 ZINC000824802035 607909030 /nfs/dbraw/zinc/90/90/30/607909030.db2.gz KCFUCWNUMHWPOL-CQSZACIVSA-N -1 3 353.470 3.579 20 0 FHADHM CC1(C)CCC[C@H](CC(=O)NC2(c3cccc(-c4nn[n-]n4)c3)CC2)C1 ZINC000824802035 607909031 /nfs/dbraw/zinc/90/90/31/607909031.db2.gz KCFUCWNUMHWPOL-CQSZACIVSA-N -1 3 353.470 3.579 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)Nc1ccc(F)cc1-c1nnn[n-]1 ZINC000823943605 607927124 /nfs/dbraw/zinc/92/71/24/607927124.db2.gz QOCUYJVORADQNX-CSKARUKUSA-N -1 3 357.776 3.701 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)Nc1ccc(F)cc1-c1nn[n-]n1 ZINC000823943605 607927125 /nfs/dbraw/zinc/92/71/25/607927125.db2.gz QOCUYJVORADQNX-CSKARUKUSA-N -1 3 357.776 3.701 20 0 FHADHM CC(C)C[C@H](C(=O)N1CCc2ccc(-c3nnn[n-]3)cc21)c1ccccc1 ZINC000824229863 607950623 /nfs/dbraw/zinc/95/06/23/607950623.db2.gz WLOIQKYURMDEGS-SFHVURJKSA-N -1 3 361.449 3.586 20 0 FHADHM CC(C)C[C@H](C(=O)N1CCc2ccc(-c3nn[n-]n3)cc21)c1ccccc1 ZINC000824229863 607950624 /nfs/dbraw/zinc/95/06/24/607950624.db2.gz WLOIQKYURMDEGS-SFHVURJKSA-N -1 3 361.449 3.586 20 0 FHADHM CCC(=O)c1cc(C(=O)O[C@H](C)c2ccc(-c3nnn[n-]3)cc2)ccc1F ZINC000825034335 607962984 /nfs/dbraw/zinc/96/29/84/607962984.db2.gz HMJBSSIDBZRWTO-LLVKDONJSA-N -1 3 368.368 3.517 20 0 FHADHM CCC(=O)c1cc(C(=O)O[C@H](C)c2ccc(-c3nn[n-]n3)cc2)ccc1F ZINC000825034335 607962985 /nfs/dbraw/zinc/96/29/85/607962985.db2.gz HMJBSSIDBZRWTO-LLVKDONJSA-N -1 3 368.368 3.517 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)c1ccccc1CCC(F)(F)F ZINC000534648804 607964586 /nfs/dbraw/zinc/96/45/86/607964586.db2.gz CUOJWDXBFVDKGT-UHFFFAOYSA-N -1 3 361.327 3.614 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)c1ccccc1CCC(F)(F)F ZINC000534648804 607964587 /nfs/dbraw/zinc/96/45/87/607964587.db2.gz CUOJWDXBFVDKGT-UHFFFAOYSA-N -1 3 361.327 3.614 20 0 FHADHM O=Cc1cc(Cl)c(OCc2ccc(-c3nnn[n-]3)cc2F)cc1Cl ZINC000826483879 607974013 /nfs/dbraw/zinc/97/40/13/607974013.db2.gz DIBYQSFRXNNDSM-UHFFFAOYSA-N -1 3 367.167 3.704 20 0 FHADHM O=Cc1cc(Cl)c(OCc2ccc(-c3nn[n-]n3)cc2F)cc1Cl ZINC000826483879 607974014 /nfs/dbraw/zinc/97/40/14/607974014.db2.gz DIBYQSFRXNNDSM-UHFFFAOYSA-N -1 3 367.167 3.704 20 0 FHADHM CCn1c2ccc(-c3nnn[n-]3)cc2nc1-c1coc(-c2ccc(C)cc2)n1 ZINC000825782761 607975849 /nfs/dbraw/zinc/97/58/49/607975849.db2.gz OFBNDPCXUMYDDH-UHFFFAOYSA-N -1 3 371.404 3.867 20 0 FHADHM CCn1c2ccc(-c3nn[n-]n3)cc2nc1-c1coc(-c2ccc(C)cc2)n1 ZINC000825782761 607975850 /nfs/dbraw/zinc/97/58/50/607975850.db2.gz OFBNDPCXUMYDDH-UHFFFAOYSA-N -1 3 371.404 3.867 20 0 FHADHM CCn1c2ccc(-c3nnn[n-]3)cc2nc1-c1ccccc1OC(F)(F)F ZINC000825782502 607975858 /nfs/dbraw/zinc/97/58/58/607975858.db2.gz FVVNUWIVTLTQBJ-UHFFFAOYSA-N -1 3 374.326 3.802 20 0 FHADHM CCn1c2ccc(-c3nn[n-]n3)cc2nc1-c1ccccc1OC(F)(F)F ZINC000825782502 607975859 /nfs/dbraw/zinc/97/58/59/607975859.db2.gz FVVNUWIVTLTQBJ-UHFFFAOYSA-N -1 3 374.326 3.802 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)C(C)=Cc1ccc(Cl)cc1 ZINC000826185730 607981310 /nfs/dbraw/zinc/98/13/10/607981310.db2.gz RSDHRZRLJFVFAM-PKNBQFBNSA-N -1 3 369.812 3.571 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)C(C)=Cc1ccc(Cl)cc1 ZINC000826185730 607981311 /nfs/dbraw/zinc/98/13/11/607981311.db2.gz RSDHRZRLJFVFAM-PKNBQFBNSA-N -1 3 369.812 3.571 20 0 FHADHM c1sc(C2CC2)nc1CSCCCOc1ccc(-c2nn[n-]n2)cc1 ZINC000826513932 607984020 /nfs/dbraw/zinc/98/40/20/607984020.db2.gz AVYFIGBNKQPZEB-UHFFFAOYSA-N -1 3 373.507 3.903 20 0 FHADHM COc1ccc(CSCc2ncc(C(C)(C)C)o2)cc1-c1nnn[n-]1 ZINC000826207941 607984627 /nfs/dbraw/zinc/98/46/27/607984627.db2.gz LIGKFEOJVBQCDT-UHFFFAOYSA-N -1 3 359.455 3.594 20 0 FHADHM COc1ccc(CSCc2ncc(C(C)(C)C)o2)cc1-c1nn[n-]n1 ZINC000826207941 607984628 /nfs/dbraw/zinc/98/46/28/607984628.db2.gz LIGKFEOJVBQCDT-UHFFFAOYSA-N -1 3 359.455 3.594 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000823944018 607986095 /nfs/dbraw/zinc/98/60/95/607986095.db2.gz WXIQPJSOPRZNJS-RSKUSDAESA-N -1 3 367.840 3.801 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000823944018 607986096 /nfs/dbraw/zinc/98/60/96/607986096.db2.gz WXIQPJSOPRZNJS-RSKUSDAESA-N -1 3 367.840 3.801 20 0 FHADHM CC(C)(C)C1=CCN(C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)CC1 ZINC000824071025 608005988 /nfs/dbraw/zinc/00/59/88/608005988.db2.gz FOLHWPBTTZGGRG-UHFFFAOYSA-N -1 3 360.849 3.730 20 0 FHADHM CC(C)(C)C1=CCN(C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)CC1 ZINC000824071025 608005989 /nfs/dbraw/zinc/00/59/89/608005989.db2.gz FOLHWPBTTZGGRG-UHFFFAOYSA-N -1 3 360.849 3.730 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N1CCCC12CCCCC2 ZINC000826452879 608008134 /nfs/dbraw/zinc/00/81/34/608008134.db2.gz MPWDSSOJPMUVRV-UHFFFAOYSA-N -1 3 360.849 3.851 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N1CCCC12CCCCC2 ZINC000826452879 608008135 /nfs/dbraw/zinc/00/81/35/608008135.db2.gz MPWDSSOJPMUVRV-UHFFFAOYSA-N -1 3 360.849 3.851 20 0 FHADHM O=C(c1cc(-c2nnn[n-]2)cs1)N1CCCC[C@@H]1CCc1ccccc1 ZINC000826470344 608032281 /nfs/dbraw/zinc/03/22/81/608032281.db2.gz MRCFQVSHKDPGBU-MRXNPFEDSA-N -1 3 367.478 3.556 20 0 FHADHM O=C(c1cc(-c2nn[n-]n2)cs1)N1CCCC[C@@H]1CCc1ccccc1 ZINC000826470344 608032282 /nfs/dbraw/zinc/03/22/82/608032282.db2.gz MRCFQVSHKDPGBU-MRXNPFEDSA-N -1 3 367.478 3.556 20 0 FHADHM CC(C)N(C)C(=O)c1ccc(Oc2ccccc2-c2nnn[n-]2)c(Cl)c1 ZINC000824284142 608052953 /nfs/dbraw/zinc/05/29/53/608052953.db2.gz CJAITKFXEURSIA-UHFFFAOYSA-N -1 3 371.828 3.793 20 0 FHADHM CC(C)N(C)C(=O)c1ccc(Oc2ccccc2-c2nn[n-]n2)c(Cl)c1 ZINC000824284142 608052954 /nfs/dbraw/zinc/05/29/54/608052954.db2.gz CJAITKFXEURSIA-UHFFFAOYSA-N -1 3 371.828 3.793 20 0 FHADHM C[C@@H](c1cccc(Cl)c1)N1CCO[C@H](c2cccc(-c3nnn[n-]3)c2)C1 ZINC000824770486 608066228 /nfs/dbraw/zinc/06/62/28/608066228.db2.gz KZGIFQWYUYDXRE-UGSOOPFHSA-N -1 3 369.856 3.655 20 0 FHADHM C[C@@H](c1cccc(Cl)c1)N1CCO[C@H](c2cccc(-c3nn[n-]n3)c2)C1 ZINC000824770486 608066229 /nfs/dbraw/zinc/06/62/29/608066229.db2.gz KZGIFQWYUYDXRE-UGSOOPFHSA-N -1 3 369.856 3.655 20 0 FHADHM C[C@H](c1ccc(Cl)cc1)N1CCO[C@@H](c2cccc(-c3nnn[n-]3)c2)C1 ZINC000824763501 608071753 /nfs/dbraw/zinc/07/17/53/608071753.db2.gz MYKSRWKEQBOMMP-FZKQIMNGSA-N -1 3 369.856 3.655 20 0 FHADHM C[C@H](c1ccc(Cl)cc1)N1CCO[C@@H](c2cccc(-c3nn[n-]n3)c2)C1 ZINC000824763501 608071754 /nfs/dbraw/zinc/07/17/54/608071754.db2.gz MYKSRWKEQBOMMP-FZKQIMNGSA-N -1 3 369.856 3.655 20 0 FHADHM COc1ccccc1[C@@H]1CCCCN1c1ncc(-c2nnn[n-]2)cc1Cl ZINC000826218816 608124421 /nfs/dbraw/zinc/12/44/21/608124421.db2.gz LLADKPPEATZFRQ-HNNXBMFYSA-N -1 3 370.844 3.655 20 0 FHADHM COc1ccccc1[C@@H]1CCCCN1c1ncc(-c2nn[n-]n2)cc1Cl ZINC000826218816 608124422 /nfs/dbraw/zinc/12/44/22/608124422.db2.gz LLADKPPEATZFRQ-HNNXBMFYSA-N -1 3 370.844 3.655 20 0 FHADHM Cc1cc(C)cc([C@@H]2CCN(C(=O)C=Cc3ccccc3-c3nnn[n-]3)C2)c1 ZINC000826264427 608131821 /nfs/dbraw/zinc/13/18/21/608131821.db2.gz NZEXDIPUGDZQSM-LKGOPFMKSA-N -1 3 373.460 3.513 20 0 FHADHM Cc1cc(C)cc([C@@H]2CCN(C(=O)C=Cc3ccccc3-c3nn[n-]n3)C2)c1 ZINC000826264427 608131822 /nfs/dbraw/zinc/13/18/22/608131822.db2.gz NZEXDIPUGDZQSM-LKGOPFMKSA-N -1 3 373.460 3.513 20 0 FHADHM C[C@H]1CCc2c(sc(NC(=O)CCCC(F)(F)F)c2-c2nnn[n-]2)C1 ZINC000824966310 608148446 /nfs/dbraw/zinc/14/84/46/608148446.db2.gz AGVPOIPARLVOBY-QMMMGPOBSA-N -1 3 373.404 3.724 20 0 FHADHM C[C@H]1CCc2c(sc(NC(=O)CCCC(F)(F)F)c2-c2nn[n-]n2)C1 ZINC000824966310 608148447 /nfs/dbraw/zinc/14/84/47/608148447.db2.gz AGVPOIPARLVOBY-QMMMGPOBSA-N -1 3 373.404 3.724 20 0 FHADHM CCCC(=CC(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(F)F)CCC ZINC000825219659 608158482 /nfs/dbraw/zinc/15/84/82/608158482.db2.gz LGFLCFAZMNFJMS-UHFFFAOYSA-N -1 3 365.384 3.933 20 0 FHADHM CCCC(=CC(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(F)F)CCC ZINC000825219659 608158484 /nfs/dbraw/zinc/15/84/84/608158484.db2.gz LGFLCFAZMNFJMS-UHFFFAOYSA-N -1 3 365.384 3.933 20 0 FHADHM Cc1ccc(F)c([C@@H](C)OC(=O)CCc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000826288930 608164866 /nfs/dbraw/zinc/16/48/66/608164866.db2.gz CGKWXAIYSIOYDY-CYBMUJFWSA-N -1 3 354.385 3.551 20 0 FHADHM Cc1ccc(F)c([C@@H](C)OC(=O)CCc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000826288930 608164869 /nfs/dbraw/zinc/16/48/69/608164869.db2.gz CGKWXAIYSIOYDY-CYBMUJFWSA-N -1 3 354.385 3.551 20 0 FHADHM C[C@H](OC(=O)[C@H]1SCCc2sccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000824716606 608181546 /nfs/dbraw/zinc/18/15/46/608181546.db2.gz YUIZSWCGOFSIQH-BONVTDFDSA-N -1 3 372.475 3.563 20 0 FHADHM C[C@H](OC(=O)[C@H]1SCCc2sccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000824716606 608181548 /nfs/dbraw/zinc/18/15/48/608181548.db2.gz YUIZSWCGOFSIQH-BONVTDFDSA-N -1 3 372.475 3.563 20 0 FHADHM CC[C@@H](OC1CCCCC1)C(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000825154328 608184118 /nfs/dbraw/zinc/18/41/18/608184118.db2.gz NOVIHFRRJGRABE-SUMWQHHRSA-N -1 3 358.442 3.599 20 0 FHADHM CC[C@@H](OC1CCCCC1)C(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000825154328 608184120 /nfs/dbraw/zinc/18/41/20/608184120.db2.gz NOVIHFRRJGRABE-SUMWQHHRSA-N -1 3 358.442 3.599 20 0 FHADHM C[C@@H](OC(=O)c1cccn1Cc1ccccc1)c1cccc(-c2nnn[n-]2)c1 ZINC000824722906 608185247 /nfs/dbraw/zinc/18/52/47/608185247.db2.gz KEIVQOGBCFYQGT-OAHLLOKOSA-N -1 3 373.416 3.635 20 0 FHADHM C[C@@H](OC(=O)c1cccn1Cc1ccccc1)c1cccc(-c2nn[n-]n2)c1 ZINC000824722906 608185248 /nfs/dbraw/zinc/18/52/48/608185248.db2.gz KEIVQOGBCFYQGT-OAHLLOKOSA-N -1 3 373.416 3.635 20 0 FHADHM Cc1ccccc1NC(=O)CSc1cccc(Cl)c1-c1nnn[n-]1 ZINC000826307842 608206378 /nfs/dbraw/zinc/20/63/78/608206378.db2.gz YPQFOSNCFJOQIR-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1ccccc1NC(=O)CSc1cccc(Cl)c1-c1nn[n-]n1 ZINC000826307842 608206379 /nfs/dbraw/zinc/20/63/79/608206379.db2.gz YPQFOSNCFJOQIR-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1cccc(NC(=O)CSc2cccc(Cl)c2-c2nnn[n-]2)c1C ZINC000826299451 608207427 /nfs/dbraw/zinc/20/74/27/608207427.db2.gz GBZNTFSNXVRCNR-UHFFFAOYSA-N -1 3 373.869 3.868 20 0 FHADHM Cc1cccc(NC(=O)CSc2cccc(Cl)c2-c2nn[n-]n2)c1C ZINC000826299451 608207428 /nfs/dbraw/zinc/20/74/28/608207428.db2.gz GBZNTFSNXVRCNR-UHFFFAOYSA-N -1 3 373.869 3.868 20 0 FHADHM Cc1cccc2c1OCC[C@@H]2Nc1ccc2cc(-c3nnn[n-]3)ccc2n1 ZINC000826305160 608225678 /nfs/dbraw/zinc/22/56/78/608225678.db2.gz NABDHJNEYLTRMO-KRWDZBQOSA-N -1 3 358.405 3.659 20 0 FHADHM Cc1cccc2c1OCC[C@@H]2Nc1ccc2cc(-c3nn[n-]n3)ccc2n1 ZINC000826305160 608225679 /nfs/dbraw/zinc/22/56/79/608225679.db2.gz NABDHJNEYLTRMO-KRWDZBQOSA-N -1 3 358.405 3.659 20 0 FHADHM c1ccc([C@@H](Nc2ccc3cc(-c4nnn[n-]4)ccc3n2)[C@H]2CCCO2)cc1 ZINC000826521057 608226188 /nfs/dbraw/zinc/22/61/88/608226188.db2.gz YGTCFVDESOJLHJ-UYAOXDASSA-N -1 3 372.432 3.747 20 0 FHADHM c1ccc([C@@H](Nc2ccc3cc(-c4nn[n-]n4)ccc3n2)[C@H]2CCCO2)cc1 ZINC000826521057 608226189 /nfs/dbraw/zinc/22/61/89/608226189.db2.gz YGTCFVDESOJLHJ-UYAOXDASSA-N -1 3 372.432 3.747 20 0 FHADHM COc1ccc(CNc2ccc(F)cc2OC(C)(C)C)cc1-c1nnn[n-]1 ZINC000826203708 608227730 /nfs/dbraw/zinc/22/77/30/608227730.db2.gz CMKNZVARSAYXGL-UHFFFAOYSA-N -1 3 371.416 3.804 20 0 FHADHM COc1ccc(CNc2ccc(F)cc2OC(C)(C)C)cc1-c1nn[n-]n1 ZINC000826203708 608227732 /nfs/dbraw/zinc/22/77/32/608227732.db2.gz CMKNZVARSAYXGL-UHFFFAOYSA-N -1 3 371.416 3.804 20 0 FHADHM Cc1cccc([C@@H](Nc2ccc(-c3nn[n-]n3)cc2F)c2ccccn2)c1 ZINC000826297241 608230594 /nfs/dbraw/zinc/23/05/94/608230594.db2.gz ZLVGPBQKCJYRIH-LJQANCHMSA-N -1 3 360.396 3.911 20 0 FHADHM c1cc2nc(N3CCSC4(CCCCC4)C3)ccc2cc1-c1nnn[n-]1 ZINC000826518394 608232774 /nfs/dbraw/zinc/23/27/74/608232774.db2.gz LWMOIGBUFDQJSJ-UHFFFAOYSA-N -1 3 366.494 3.671 20 0 FHADHM c1cc2nc(N3CCSC4(CCCCC4)C3)ccc2cc1-c1nn[n-]n1 ZINC000826518394 608232775 /nfs/dbraw/zinc/23/27/75/608232775.db2.gz LWMOIGBUFDQJSJ-UHFFFAOYSA-N -1 3 366.494 3.671 20 0 FHADHM FC(F)Oc1cc(-c2nnn[n-]2)ccc1CNc1ccc(C2CC2)cc1 ZINC000826369557 608237051 /nfs/dbraw/zinc/23/70/51/608237051.db2.gz HXPMEGBWPGMKDT-UHFFFAOYSA-N -1 3 357.364 3.958 20 0 FHADHM FC(F)Oc1cc(-c2nn[n-]n2)ccc1CNc1ccc(C2CC2)cc1 ZINC000826369557 608237052 /nfs/dbraw/zinc/23/70/52/608237052.db2.gz HXPMEGBWPGMKDT-UHFFFAOYSA-N -1 3 357.364 3.958 20 0 FHADHM Cc1ccc(F)c(C(=O)N(CC(C)C)c2ccc(-c3nnn[n-]3)cc2)c1F ZINC000826289293 608269791 /nfs/dbraw/zinc/26/97/91/608269791.db2.gz UFADXTJKZVUNET-UHFFFAOYSA-N -1 3 371.391 3.756 20 0 FHADHM Cc1ccc(F)c(C(=O)N(CC(C)C)c2ccc(-c3nn[n-]n3)cc2)c1F ZINC000826289293 608269793 /nfs/dbraw/zinc/26/97/93/608269793.db2.gz UFADXTJKZVUNET-UHFFFAOYSA-N -1 3 371.391 3.756 20 0 FHADHM FC(F)(F)c1ccc(C2CCN(c3ncccc3-c3nnn[n-]3)CC2)cc1 ZINC000826368426 608298504 /nfs/dbraw/zinc/29/85/04/608298504.db2.gz PBHXYDAHIGHJCP-UHFFFAOYSA-N -1 3 374.370 3.665 20 0 FHADHM FC(F)(F)c1ccc(C2CCN(c3ncccc3-c3nn[n-]n3)CC2)cc1 ZINC000826368426 608298505 /nfs/dbraw/zinc/29/85/05/608298505.db2.gz PBHXYDAHIGHJCP-UHFFFAOYSA-N -1 3 374.370 3.665 20 0 FHADHM Cc1cccc(C)c1[C@@H](C)OC(=O)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000826296859 608315095 /nfs/dbraw/zinc/31/50/95/608315095.db2.gz LYEINAOLQDBKTL-LLVKDONJSA-N -1 3 358.348 3.680 20 0 FHADHM Cc1cccc(C)c1[C@@H](C)OC(=O)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000826296859 608315097 /nfs/dbraw/zinc/31/50/97/608315097.db2.gz LYEINAOLQDBKTL-LLVKDONJSA-N -1 3 358.348 3.680 20 0 FHADHM COc1ccc([C@H](OC(=O)c2sccc2-c2nnn[n-]2)C2CC2)c(C)c1 ZINC000826188746 608317057 /nfs/dbraw/zinc/31/70/57/608317057.db2.gz FLSFSXLWCGMNNL-OAHLLOKOSA-N -1 3 370.434 3.553 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CNc1ccc(OC(C)C)c(Cl)c1 ZINC000826170541 608319427 /nfs/dbraw/zinc/31/94/27/608319427.db2.gz DTVVSAWGAGYTDI-UHFFFAOYSA-N -1 3 373.844 3.928 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CNc1ccc(OC(C)C)c(Cl)c1 ZINC000826170541 608319428 /nfs/dbraw/zinc/31/94/28/608319428.db2.gz DTVVSAWGAGYTDI-UHFFFAOYSA-N -1 3 373.844 3.928 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CNc1ccccc1OCC(C)C ZINC000826170725 608319592 /nfs/dbraw/zinc/31/95/92/608319592.db2.gz MYPFNDSQGUAERF-UHFFFAOYSA-N -1 3 353.426 3.522 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CNc1ccccc1OCC(C)C ZINC000826170725 608319593 /nfs/dbraw/zinc/31/95/93/608319593.db2.gz MYPFNDSQGUAERF-UHFFFAOYSA-N -1 3 353.426 3.522 20 0 FHADHM CCc1cc(C(=O)N(CC)c2ccc(-c3nnn[n-]3)c(Cl)c2)oc1CC ZINC000825694126 608344157 /nfs/dbraw/zinc/34/41/57/608344157.db2.gz KZFSLKXHAHYJSH-UHFFFAOYSA-N -1 3 373.844 3.905 20 0 FHADHM CCc1cc(C(=O)N(CC)c2ccc(-c3nn[n-]n3)c(Cl)c2)oc1CC ZINC000825694126 608344159 /nfs/dbraw/zinc/34/41/59/608344159.db2.gz KZFSLKXHAHYJSH-UHFFFAOYSA-N -1 3 373.844 3.905 20 0 FHADHM CCc1ccc(NC(=S)Nc2ccccc2-c2nnn[n-]2)cc1CC ZINC000825718139 608386618 /nfs/dbraw/zinc/38/66/18/608386618.db2.gz XBOAZSHRYZQDTR-UHFFFAOYSA-N -1 3 352.467 3.800 20 0 FHADHM CCc1ccc(NC(=S)Nc2ccccc2-c2nn[n-]n2)cc1CC ZINC000825718139 608386620 /nfs/dbraw/zinc/38/66/20/608386620.db2.gz XBOAZSHRYZQDTR-UHFFFAOYSA-N -1 3 352.467 3.800 20 0 FHADHM CCC(=O)c1cc(Cl)ccc1OCc1cccc(-c2nnn[n-]2)c1F ZINC000825034567 608393480 /nfs/dbraw/zinc/39/34/80/608393480.db2.gz LTVREVYXFKLDAW-UHFFFAOYSA-N -1 3 360.776 3.831 20 0 FHADHM CCC(=O)c1cc(Cl)ccc1OCc1cccc(-c2nn[n-]n2)c1F ZINC000825034567 608393482 /nfs/dbraw/zinc/39/34/82/608393482.db2.gz LTVREVYXFKLDAW-UHFFFAOYSA-N -1 3 360.776 3.831 20 0 FHADHM Cc1cc2c(ncnc2SCc2cccc(-c3nnn[n-]3)c2F)s1 ZINC000826273254 608406889 /nfs/dbraw/zinc/40/68/89/608406889.db2.gz VSMVVMVEDJCXTD-UHFFFAOYSA-N -1 3 358.427 3.611 20 0 FHADHM Cc1cc2c(ncnc2SCc2cccc(-c3nn[n-]n3)c2F)s1 ZINC000826273254 608406890 /nfs/dbraw/zinc/40/68/90/608406890.db2.gz VSMVVMVEDJCXTD-UHFFFAOYSA-N -1 3 358.427 3.611 20 0 FHADHM C[C@@H](NCc1ccnc(-c2nnn[n-]2)c1)c1cc(F)c(Cl)cc1Cl ZINC000824627288 608425538 /nfs/dbraw/zinc/42/55/38/608425538.db2.gz WBDWKDYWNWYDDU-MRVPVSSYSA-N -1 3 367.215 3.558 20 0 FHADHM C[C@@H](NCc1ccnc(-c2nn[n-]n2)c1)c1cc(F)c(Cl)cc1Cl ZINC000824627288 608425540 /nfs/dbraw/zinc/42/55/40/608425540.db2.gz WBDWKDYWNWYDDU-MRVPVSSYSA-N -1 3 367.215 3.558 20 0 FHADHM FC(F)(F)c1ccc(N2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)nc1 ZINC000826368380 608442233 /nfs/dbraw/zinc/44/22/33/608442233.db2.gz NFVXGVWWKOJOKF-UHFFFAOYSA-N -1 3 372.354 3.574 20 0 FHADHM FC(F)(F)c1ccc(N2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)nc1 ZINC000826368380 608442234 /nfs/dbraw/zinc/44/22/34/608442234.db2.gz NFVXGVWWKOJOKF-UHFFFAOYSA-N -1 3 372.354 3.574 20 0 FHADHM Cc1ccccc1[C@@H](C)CC(=O)OCc1cccc(-c2nnn[n-]2)c1F ZINC000826305924 608448177 /nfs/dbraw/zinc/44/81/77/608448177.db2.gz LWZLGUZRSLRJCF-ZDUSSCGKSA-N -1 3 354.385 3.551 20 0 FHADHM Cc1ccccc1[C@@H](C)CC(=O)OCc1cccc(-c2nn[n-]n2)c1F ZINC000826305924 608448178 /nfs/dbraw/zinc/44/81/78/608448178.db2.gz LWZLGUZRSLRJCF-ZDUSSCGKSA-N -1 3 354.385 3.551 20 0 FHADHM Fc1c(CNc2ccc(OC(F)F)c(Cl)c2)cccc1-c1nnn[n-]1 ZINC000826370618 608479886 /nfs/dbraw/zinc/47/98/86/608479886.db2.gz AUHCLPXSEPAAPY-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM Fc1c(CNc2ccc(OC(F)F)c(Cl)c2)cccc1-c1nn[n-]n1 ZINC000826370618 608479887 /nfs/dbraw/zinc/47/98/87/608479887.db2.gz AUHCLPXSEPAAPY-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM CC(C)CCc1nc(CN[C@H](C)c2cccc(-c3nn[n-]n3)c2)cs1 ZINC000824248804 608490456 /nfs/dbraw/zinc/49/04/56/608490456.db2.gz CJCAWCBCTRUUFJ-CYBMUJFWSA-N -1 3 356.499 3.763 20 0 FHADHM CSc1cccc(NC(=O)Nc2cccc(-c3nnn[n-]3)c2C)c1C ZINC000826230764 608495648 /nfs/dbraw/zinc/49/56/48/608495648.db2.gz JHSLCCGLVXKNMK-UHFFFAOYSA-N -1 3 354.439 3.849 20 0 FHADHM CSc1cccc(NC(=O)Nc2cccc(-c3nn[n-]n3)c2C)c1C ZINC000826230764 608495650 /nfs/dbraw/zinc/49/56/50/608495650.db2.gz JHSLCCGLVXKNMK-UHFFFAOYSA-N -1 3 354.439 3.849 20 0 FHADHM CCc1ccc(NC(=O)N(C)Cc2cccc(-c3nnn[n-]3)c2)cc1CC ZINC000825712619 608507212 /nfs/dbraw/zinc/50/72/12/608507212.db2.gz SPXHZCMZNPDHLD-UHFFFAOYSA-N -1 3 364.453 3.655 20 0 FHADHM CCc1ccc(NC(=O)N(C)Cc2cccc(-c3nn[n-]n3)c2)cc1CC ZINC000825712619 608507215 /nfs/dbraw/zinc/50/72/15/608507215.db2.gz SPXHZCMZNPDHLD-UHFFFAOYSA-N -1 3 364.453 3.655 20 0 FHADHM FC(F)(F)c1ccc(CN(Cc2ccc(-c3nnn[n-]3)o2)C2CC2)cc1 ZINC000826368591 608520176 /nfs/dbraw/zinc/52/01/76/608520176.db2.gz VMPPKHTZZLYUPB-UHFFFAOYSA-N -1 3 363.343 3.643 20 0 FHADHM c1nc(C2CCC2)sc1CN(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000826513889 608520250 /nfs/dbraw/zinc/52/02/50/608520250.db2.gz ZGXOVHBQKCYXBS-UHFFFAOYSA-N -1 3 366.494 3.755 20 0 FHADHM C[C@H](c1ccc(Cl)c(Cl)c1)N(C)Cc1ccc(-c2nnn[n-]2)o1 ZINC000824761761 608541882 /nfs/dbraw/zinc/54/18/82/608541882.db2.gz CHSJLWAXMBUHBH-SECBINFHSA-N -1 3 352.225 3.960 20 0 FHADHM Cc1cc([C@@H](C)NC(=O)c2ccc(Cl)c(-c3nnn[n-]3)c2)c(C)s1 ZINC000826261931 608575776 /nfs/dbraw/zinc/57/57/76/608575776.db2.gz YMXHRFKUOLPWRR-SECBINFHSA-N -1 3 361.858 3.689 20 0 FHADHM Cc1cc([C@@H](C)NC(=O)c2ccc(Cl)c(-c3nn[n-]n3)c2)c(C)s1 ZINC000826261931 608575777 /nfs/dbraw/zinc/57/57/77/608575777.db2.gz YMXHRFKUOLPWRR-SECBINFHSA-N -1 3 361.858 3.689 20 0 FHADHM CCCOc1ccc(NC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000825338746 608614754 /nfs/dbraw/zinc/61/47/54/608614754.db2.gz HDNYDXYGYYARAO-ZDUSSCGKSA-N -1 3 366.425 3.538 20 0 FHADHM CCCOc1ccc(NC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000825338746 608614756 /nfs/dbraw/zinc/61/47/56/608614756.db2.gz HDNYDXYGYYARAO-ZDUSSCGKSA-N -1 3 366.425 3.538 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)Nc1cnc(-c2ccccc2)s1 ZINC000826402596 608637410 /nfs/dbraw/zinc/63/74/10/608637410.db2.gz XUZDRRAXTPDDJD-KHPPLWFESA-N -1 3 374.429 3.642 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)Nc1cnc(-c2ccccc2)s1 ZINC000826402596 608637413 /nfs/dbraw/zinc/63/74/13/608637413.db2.gz XUZDRRAXTPDDJD-KHPPLWFESA-N -1 3 374.429 3.642 20 0 FHADHM Clc1cc(Cl)c2ncnc(OCc3cccc(-c4nnn[n-]4)c3)c2c1 ZINC000826350807 608674836 /nfs/dbraw/zinc/67/48/36/608674836.db2.gz MBFZGDCZHKTDFC-UHFFFAOYSA-N -1 3 373.203 3.696 20 0 FHADHM Clc1cc(Cl)c2ncnc(OCc3cccc(-c4nn[n-]n4)c3)c2c1 ZINC000826350807 608674839 /nfs/dbraw/zinc/67/48/39/608674839.db2.gz MBFZGDCZHKTDFC-UHFFFAOYSA-N -1 3 373.203 3.696 20 0 FHADHM CN(Cc1ccc(-c2nnn[n-]2)s1)[C@H](c1ccccc1)C(F)(F)F ZINC000825961132 608677905 /nfs/dbraw/zinc/67/79/05/608677905.db2.gz BBDMEKYWQFNZMJ-CYBMUJFWSA-N -1 3 353.373 3.664 20 0 FHADHM Fc1cccc(F)c1CN(Cc1ccc(-c2nnn[n-]2)o1)C1CCCC1 ZINC000826377073 608684276 /nfs/dbraw/zinc/68/42/76/608684276.db2.gz CXPGDCJIEOQVHS-UHFFFAOYSA-N -1 3 359.380 3.683 20 0 FHADHM Fc1cccc(F)c1CN(Cc1ccc(-c2nn[n-]n2)o1)C1CCCC1 ZINC000826377073 608684279 /nfs/dbraw/zinc/68/42/79/608684279.db2.gz CXPGDCJIEOQVHS-UHFFFAOYSA-N -1 3 359.380 3.683 20 0 FHADHM Brc1ccccc1[C@H]1CCCN1Cc1ccc(-c2nnn[n-]2)o1 ZINC000823831984 608742331 /nfs/dbraw/zinc/74/23/31/608742331.db2.gz HTJYDSLHUDAADJ-CQSZACIVSA-N -1 3 374.242 3.559 20 0 FHADHM Brc1ccccc1[C@H]1CCCN1Cc1ccc(-c2nn[n-]n2)o1 ZINC000823831984 608742332 /nfs/dbraw/zinc/74/23/32/608742332.db2.gz HTJYDSLHUDAADJ-CQSZACIVSA-N -1 3 374.242 3.559 20 0 FHADHM FC(F)(F)c1cccc([C@H](Nc2ncccc2-c2nnn[n-]2)C2CC2)c1 ZINC000826369233 608800413 /nfs/dbraw/zinc/80/04/13/608800413.db2.gz STJULNANECAOMA-CQSZACIVSA-N -1 3 360.343 3.844 20 0 FHADHM FC(F)(F)c1cccc([C@H](Nc2ncccc2-c2nn[n-]n2)C2CC2)c1 ZINC000826369233 608800414 /nfs/dbraw/zinc/80/04/14/608800414.db2.gz STJULNANECAOMA-CQSZACIVSA-N -1 3 360.343 3.844 20 0 FHADHM Cc1cc(CN2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)cnc1Cl ZINC000826266127 608858248 /nfs/dbraw/zinc/85/82/48/608858248.db2.gz CPQCJNZQRCZVDU-UHFFFAOYSA-N -1 3 366.856 3.513 20 0 FHADHM Cc1cnc([C@H](C)Sc2nc(C)cc(C(F)(F)F)c2-c2nnn[n-]2)o1 ZINC000826262249 608885095 /nfs/dbraw/zinc/88/50/95/608885095.db2.gz JHHFKXPKWMMSSB-QMMMGPOBSA-N -1 3 370.360 3.739 20 0 FHADHM C[C@@H](N[C@H](c1ccccc1)c1ccncc1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824540199 609136456 /nfs/dbraw/zinc/13/64/56/609136456.db2.gz SYGOEOKSEOWLEN-JLTOFOAXSA-N -1 3 374.423 3.841 20 0 FHADHM C[C@@H](N[C@H](c1ccccc1)c1ccncc1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824540199 609136458 /nfs/dbraw/zinc/13/64/58/609136458.db2.gz SYGOEOKSEOWLEN-JLTOFOAXSA-N -1 3 374.423 3.841 20 0 FHADHM C[C@H](NCc1cc(-c2ccccc2)on1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824605841 609139428 /nfs/dbraw/zinc/13/94/28/609139428.db2.gz MFWOERFSXYDZPJ-LBPRGKRZSA-N -1 3 364.384 3.512 20 0 FHADHM C[C@H](NCc1cc(-c2ccccc2)on1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824605841 609139431 /nfs/dbraw/zinc/13/94/31/609139431.db2.gz MFWOERFSXYDZPJ-LBPRGKRZSA-N -1 3 364.384 3.512 20 0 FHADHM C[C@H](NCc1coc(-c2ccccc2)n1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824626664 609146436 /nfs/dbraw/zinc/14/64/36/609146436.db2.gz QSLYCARBYLSESS-LBPRGKRZSA-N -1 3 364.384 3.512 20 0 FHADHM C[C@H](NCc1coc(-c2ccccc2)n1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824626664 609146438 /nfs/dbraw/zinc/14/64/38/609146438.db2.gz QSLYCARBYLSESS-LBPRGKRZSA-N -1 3 364.384 3.512 20 0 FHADHM CC(C)C[C@@H]1C[C@H](Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)CCO1 ZINC000824243623 609170768 /nfs/dbraw/zinc/17/07/68/609170768.db2.gz KSHWWBSCVWTGAT-CHWSQXEVSA-N -1 3 369.391 3.891 20 0 FHADHM CC(C)C[C@@H]1C[C@H](Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)CCO1 ZINC000824243623 609170770 /nfs/dbraw/zinc/17/07/70/609170770.db2.gz KSHWWBSCVWTGAT-CHWSQXEVSA-N -1 3 369.391 3.891 20 0 FHADHM Cc1cc(C)cc(N(C)Cc2cn(C)nc2-c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000826264343 609173793 /nfs/dbraw/zinc/17/37/93/609173793.db2.gz KYFDVKXBIKWNOE-UHFFFAOYSA-N -1 3 373.464 3.520 20 0 FHADHM Cc1cc(C)cc(N(C)Cc2cn(C)nc2-c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000826264343 609173795 /nfs/dbraw/zinc/17/37/95/609173795.db2.gz KYFDVKXBIKWNOE-UHFFFAOYSA-N -1 3 373.464 3.520 20 0 FHADHM CCOCCOCc1cccc(N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000825599993 609175232 /nfs/dbraw/zinc/17/52/32/609175232.db2.gz VUAUCDVWLXVCCH-OAHLLOKOSA-N -1 3 367.453 3.593 20 0 FHADHM CCOCCOCc1cccc(N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000825599993 609175233 /nfs/dbraw/zinc/17/52/33/609175233.db2.gz VUAUCDVWLXVCCH-OAHLLOKOSA-N -1 3 367.453 3.593 20 0 FHADHM CC(C)(C)C[C@@H](NC(=O)c1c[nH]c(-c2nnn[n-]2)c1)c1ccc(Cl)cc1 ZINC000824087515 609216646 /nfs/dbraw/zinc/21/66/46/609216646.db2.gz WEOZZMTXSNIASZ-OAHLLOKOSA-N -1 3 372.860 3.756 20 0 FHADHM CC(C)(C)C[C@@H](NC(=O)c1c[nH]c(-c2nn[n-]n2)c1)c1ccc(Cl)cc1 ZINC000824087515 609216648 /nfs/dbraw/zinc/21/66/48/609216648.db2.gz WEOZZMTXSNIASZ-OAHLLOKOSA-N -1 3 372.860 3.756 20 0 FHADHM CC(C)c1ccc([C@@H]2CCCCN2C(=O)c2c[nH]c(-c3nnn[n-]3)c2)cc1 ZINC000824347585 609229237 /nfs/dbraw/zinc/22/92/37/609229237.db2.gz FNMVSQGNPISMAU-SFHVURJKSA-N -1 3 364.453 3.686 20 0 FHADHM CC(C)c1ccc([C@@H]2CCCCN2C(=O)c2c[nH]c(-c3nn[n-]n3)c2)cc1 ZINC000824347585 609229239 /nfs/dbraw/zinc/22/92/39/609229239.db2.gz FNMVSQGNPISMAU-SFHVURJKSA-N -1 3 364.453 3.686 20 0 FHADHM Cc1cc(C)cc(CCC(=O)N(C)c2cc(Cl)ccc2-c2nnn[n-]2)c1 ZINC000826264772 609234024 /nfs/dbraw/zinc/23/40/24/609234024.db2.gz ZWJBLJCFSQCTIO-UHFFFAOYSA-N -1 3 369.856 3.733 20 0 FHADHM Cc1cc(C)cc(CCC(=O)N(C)c2cc(Cl)ccc2-c2nn[n-]n2)c1 ZINC000826264772 609234025 /nfs/dbraw/zinc/23/40/25/609234025.db2.gz ZWJBLJCFSQCTIO-UHFFFAOYSA-N -1 3 369.856 3.733 20 0 FHADHM C[C@@H](Nc1ccc(OC[C@H]2CCCO2)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000824655554 609236415 /nfs/dbraw/zinc/23/64/15/609236415.db2.gz DQKQDPWKSSCGIR-AUUYWEPGSA-N -1 3 365.437 3.598 20 0 FHADHM C[C@@H](Nc1ccc(OC[C@H]2CCCO2)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000824655554 609236417 /nfs/dbraw/zinc/23/64/17/609236417.db2.gz DQKQDPWKSSCGIR-AUUYWEPGSA-N -1 3 365.437 3.598 20 0 FHADHM C[C@H](NC1(c2cccc(-c3nn[n-]n3)c2)CC1)c1nc2c(s1)CCCC2 ZINC000824539846 609248602 /nfs/dbraw/zinc/24/86/02/609248602.db2.gz QCETVTGJKBMWDR-LBPRGKRZSA-N -1 3 366.494 3.542 20 0 FHADHM C[C@@H](Nc1ccn(-c2ccccc2Cl)n1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824662744 609254756 /nfs/dbraw/zinc/25/47/56/609254756.db2.gz QVHJZLOOUAUPKK-GFCCVEGCSA-N -1 3 365.828 3.879 20 0 FHADHM C[C@@H](Nc1ccn(-c2ccccc2Cl)n1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824662744 609254758 /nfs/dbraw/zinc/25/47/58/609254758.db2.gz QVHJZLOOUAUPKK-GFCCVEGCSA-N -1 3 365.828 3.879 20 0 FHADHM C[C@@H](Nc1ccc2c(c1)CC(C)(C)O2)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824655353 609279609 /nfs/dbraw/zinc/27/96/09/609279609.db2.gz CICHYHSAWPLHFA-LLVKDONJSA-N -1 3 353.401 3.892 20 0 FHADHM C[C@@H](Nc1ccc2c(c1)CC(C)(C)O2)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824655353 609279611 /nfs/dbraw/zinc/27/96/11/609279611.db2.gz CICHYHSAWPLHFA-LLVKDONJSA-N -1 3 353.401 3.892 20 0 FHADHM Cc1cc(Cl)c(C(=O)NC2(c3cccc(-c4nnn[n-]4)c3)CC2)cc1C ZINC000826267581 609283316 /nfs/dbraw/zinc/28/33/16/609283316.db2.gz LVACLDILQYSWSF-UHFFFAOYSA-N -1 3 367.840 3.556 20 0 FHADHM Cc1cc(Cl)c(C(=O)NC2(c3cccc(-c4nn[n-]n4)c3)CC2)cc1C ZINC000826267581 609283318 /nfs/dbraw/zinc/28/33/18/609283318.db2.gz LVACLDILQYSWSF-UHFFFAOYSA-N -1 3 367.840 3.556 20 0 FHADHM Cc1cc(C)c(-c2nnn[n-]2)c(S[C@@H](C)c2nc3ccccc3o2)n1 ZINC000826262900 609305992 /nfs/dbraw/zinc/30/59/92/609305992.db2.gz CLLYWLPOLIURGC-NSHDSACASA-N -1 3 352.423 3.873 20 0 FHADHM Cc1cc(C)c(-c2nn[n-]n2)c(S[C@@H](C)c2nc3ccccc3o2)n1 ZINC000826262900 609305994 /nfs/dbraw/zinc/30/59/94/609305994.db2.gz CLLYWLPOLIURGC-NSHDSACASA-N -1 3 352.423 3.873 20 0 FHADHM Cc1cccc(NC(=O)c2ccccc2Oc2ccccc2-c2nnn[n-]2)n1 ZINC000826299366 609307894 /nfs/dbraw/zinc/30/78/94/609307894.db2.gz BALIBGWFSHQSLH-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1cccc(NC(=O)c2ccccc2Oc2ccccc2-c2nn[n-]n2)n1 ZINC000826299366 609307896 /nfs/dbraw/zinc/30/78/96/609307896.db2.gz BALIBGWFSHQSLH-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM COc1ccc(F)cc1[C@H](C)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1F ZINC000826209154 609328021 /nfs/dbraw/zinc/32/80/21/609328021.db2.gz PBVFSHAKWQUWCB-MNOVXSKESA-N -1 3 359.380 3.565 20 0 FHADHM COc1ccc(F)cc1[C@H](C)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000826209154 609328022 /nfs/dbraw/zinc/32/80/22/609328022.db2.gz PBVFSHAKWQUWCB-MNOVXSKESA-N -1 3 359.380 3.565 20 0 FHADHM C[C@@H](SCCOc1ccccc1-c1nnn[n-]1)c1nc2ccccc2o1 ZINC000824753930 609329089 /nfs/dbraw/zinc/32/90/89/609329089.db2.gz GAOULJDRBAIJNE-GFCCVEGCSA-N -1 3 367.434 3.881 20 0 FHADHM C[C@@H](SCCOc1ccccc1-c1nn[n-]n1)c1nc2ccccc2o1 ZINC000824753930 609329091 /nfs/dbraw/zinc/32/90/91/609329091.db2.gz GAOULJDRBAIJNE-GFCCVEGCSA-N -1 3 367.434 3.881 20 0 FHADHM C[C@H](NCc1coc(-c2cccs2)n1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824625362 609329360 /nfs/dbraw/zinc/32/93/60/609329360.db2.gz GRGLWXXUEFWNCF-JTQLQIEISA-N -1 3 370.413 3.573 20 0 FHADHM C[C@H](NCc1coc(-c2cccs2)n1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824625362 609329361 /nfs/dbraw/zinc/32/93/61/609329361.db2.gz GRGLWXXUEFWNCF-JTQLQIEISA-N -1 3 370.413 3.573 20 0 FHADHM COc1cccc(F)c1[C@H](C)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1F ZINC000826217141 609337842 /nfs/dbraw/zinc/33/78/42/609337842.db2.gz ZOWZLFAXTZDXEY-QWRGUYRKSA-N -1 3 359.380 3.565 20 0 FHADHM COc1cccc(F)c1[C@H](C)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000826217141 609337844 /nfs/dbraw/zinc/33/78/44/609337844.db2.gz ZOWZLFAXTZDXEY-QWRGUYRKSA-N -1 3 359.380 3.565 20 0 FHADHM COc1cccc(F)c1[C@@H](C)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1F ZINC000826217139 609337892 /nfs/dbraw/zinc/33/78/92/609337892.db2.gz ZOWZLFAXTZDXEY-GHMZBOCLSA-N -1 3 359.380 3.565 20 0 FHADHM COc1cccc(F)c1[C@@H](C)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000826217139 609337894 /nfs/dbraw/zinc/33/78/94/609337894.db2.gz ZOWZLFAXTZDXEY-GHMZBOCLSA-N -1 3 359.380 3.565 20 0 FHADHM CSc1ccc(F)cc1CN[C@@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000826230885 609339233 /nfs/dbraw/zinc/33/92/33/609339233.db2.gz NVKHDXFXYAKGLO-JTQLQIEISA-N -1 3 361.421 3.718 20 0 FHADHM FC(F)(F)[C@H](CCc1ccccc1)NCc1ccc(-c2nnn[n-]2)cc1 ZINC000826367343 609347111 /nfs/dbraw/zinc/34/71/11/609347111.db2.gz VQTWLBXEBNNZSQ-INIZCTEOSA-N -1 3 361.371 3.520 20 0 FHADHM FC(F)(F)[C@H](CCc1ccccc1)NCc1ccc(-c2nn[n-]n2)cc1 ZINC000826367343 609347112 /nfs/dbraw/zinc/34/71/12/609347112.db2.gz VQTWLBXEBNNZSQ-INIZCTEOSA-N -1 3 361.371 3.520 20 0 FHADHM C[C@@H](Nc1ccc2c(c1)OC(C)(C)O2)c1ccc(-c2nnn[n-]2)cc1F ZINC000824658325 609348800 /nfs/dbraw/zinc/34/88/00/609348800.db2.gz VZSUGGHWFMOVOT-SNVBAGLBSA-N -1 3 355.373 3.686 20 0 FHADHM C[C@@H](Nc1ccc2c(c1)OC(C)(C)O2)c1ccc(-c2nn[n-]n2)cc1F ZINC000824658325 609348802 /nfs/dbraw/zinc/34/88/02/609348802.db2.gz VZSUGGHWFMOVOT-SNVBAGLBSA-N -1 3 355.373 3.686 20 0 FHADHM CCn1ncc2ccc(N[C@@H](C)c3ccc(-c4nnn[n-]4)cc3F)cc21 ZINC000825807513 609349475 /nfs/dbraw/zinc/34/94/75/609349475.db2.gz RMAIQWUWGJGBSW-NSHDSACASA-N -1 3 351.389 3.549 20 0 FHADHM CCn1ncc2ccc(N[C@@H](C)c3ccc(-c4nn[n-]n4)cc3F)cc21 ZINC000825807513 609349477 /nfs/dbraw/zinc/34/94/77/609349477.db2.gz RMAIQWUWGJGBSW-NSHDSACASA-N -1 3 351.389 3.549 20 0 FHADHM C[C@H]1c2ccccc2CN1Cc1ccc(-c2nnn[n-]2)cc1Br ZINC000825029271 609363801 /nfs/dbraw/zinc/36/38/01/609363801.db2.gz QADIQJIATHPMQA-NSHDSACASA-N -1 3 370.254 3.706 20 0 FHADHM C[C@H]1c2ccccc2CN1Cc1ccc(-c2nn[n-]n2)cc1Br ZINC000825029271 609363802 /nfs/dbraw/zinc/36/38/02/609363802.db2.gz QADIQJIATHPMQA-NSHDSACASA-N -1 3 370.254 3.706 20 0 FHADHM CCCOCc1ccccc1CNc1cc(-c2nnn[n-]2)ccc1C(C)=O ZINC000825339294 609422052 /nfs/dbraw/zinc/42/20/52/609422052.db2.gz VSUGCBHZRMQVTG-UHFFFAOYSA-N -1 3 365.437 3.608 20 0 FHADHM CCCOCc1ccccc1CNc1cc(-c2nn[n-]n2)ccc1C(C)=O ZINC000825339294 609422053 /nfs/dbraw/zinc/42/20/53/609422053.db2.gz VSUGCBHZRMQVTG-UHFFFAOYSA-N -1 3 365.437 3.608 20 0 FHADHM O=C(Nc1ccc(-c2cc3ccccc3o2)cc1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC000826451553 609423148 /nfs/dbraw/zinc/42/31/48/609423148.db2.gz LLSBUCWKGJAYCT-UHFFFAOYSA-N -1 3 370.372 3.860 20 0 FHADHM O=C(Nc1ccc(-c2cc3ccccc3o2)cc1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC000826451553 609423151 /nfs/dbraw/zinc/42/31/51/609423151.db2.gz LLSBUCWKGJAYCT-UHFFFAOYSA-N -1 3 370.372 3.860 20 0 FHADHM CCc1csc([C@H]2CCCN(c3ccc(-c4nnn[n-]4)c(Cl)c3)C2)n1 ZINC000825739224 609425175 /nfs/dbraw/zinc/42/51/75/609425175.db2.gz BTBNIBAGZPCYMG-NSHDSACASA-N -1 3 374.901 3.923 20 0 FHADHM CCc1csc([C@H]2CCCN(c3ccc(-c4nn[n-]n4)c(Cl)c3)C2)n1 ZINC000825739224 609425177 /nfs/dbraw/zinc/42/51/77/609425177.db2.gz BTBNIBAGZPCYMG-NSHDSACASA-N -1 3 374.901 3.923 20 0 FHADHM CCCOc1ccc(CNc2cccc(-c3nnn[n-]3)c2)cc1OCC ZINC000825338754 609472073 /nfs/dbraw/zinc/47/20/73/609472073.db2.gz HFFDKQDYEGHMFT-UHFFFAOYSA-N -1 3 353.426 3.666 20 0 FHADHM CCCOc1ccc(CNc2cccc(-c3nn[n-]n3)c2)cc1OCC ZINC000825338754 609472075 /nfs/dbraw/zinc/47/20/75/609472075.db2.gz HFFDKQDYEGHMFT-UHFFFAOYSA-N -1 3 353.426 3.666 20 0 FHADHM CCCOc1c(CNc2cccc(-c3nnn[n-]3)c2)cccc1OCC ZINC000825338703 609473889 /nfs/dbraw/zinc/47/38/89/609473889.db2.gz FNFQNZBMUTWVBI-UHFFFAOYSA-N -1 3 353.426 3.666 20 0 FHADHM CCCOc1c(CNc2cccc(-c3nn[n-]n3)c2)cccc1OCC ZINC000825338703 609473890 /nfs/dbraw/zinc/47/38/90/609473890.db2.gz FNFQNZBMUTWVBI-UHFFFAOYSA-N -1 3 353.426 3.666 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NCc1csc(-c2ccccc2)n1 ZINC000826187094 609482301 /nfs/dbraw/zinc/48/23/01/609482301.db2.gz ZXITUENKFRHNAW-UHFFFAOYSA-N -1 3 364.434 3.611 20 0 FHADHM CCOC(=O)Nc1ccc(NCc2cccc(C)c2C)cc1-c1nnn[n-]1 ZINC000825553009 609487612 /nfs/dbraw/zinc/48/76/12/609487612.db2.gz HQNDYKKSZJZQQH-UHFFFAOYSA-N -1 3 366.425 3.664 20 0 FHADHM 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O=C([O-])C[C@@H](NCc1cccc(OCC(F)(F)F)c1)c1ccsc1 ZINC000276977420 934210078 /nfs/dbraw/zinc/21/00/78/934210078.db2.gz HWVIXDDZQMMPAW-CQSZACIVSA-N -1 3 359.369 3.995 20 0 FHADHM CCCOc1ccc(NC(=O)c2ccc(C(=O)OC)[n-]2)cc1OCCC ZINC000431244987 934246387 /nfs/dbraw/zinc/24/63/87/934246387.db2.gz DEQIUQMKSGBCBJ-UHFFFAOYSA-N -1 3 360.410 3.631 20 0 FHADHM CCc1cccc(C(=O)N2CCN(c3nc4ccccc4s3)CC2)c1[O-] ZINC000535720630 934316657 /nfs/dbraw/zinc/31/66/57/934316657.db2.gz XTGMTUNYORPNAD-UHFFFAOYSA-N -1 3 367.474 3.527 20 0 FHADHM COc1cc(C(=O)N2[C@H](C)C[C@H](c3ccccc3)[C@H]2C)cc(OC)c1[O-] ZINC000426974581 934334077 /nfs/dbraw/zinc/33/40/77/934334077.db2.gz XKSWODKJBJCLFO-CPUCHLNUSA-N -1 3 355.434 3.816 20 0 FHADHM COc1cc(C)c(S(=O)(=O)[N-]c2ccc(-c3ncco3)cc2)c(C)c1 ZINC000535744781 934334426 /nfs/dbraw/zinc/33/44/26/934334426.db2.gz KEEQHILDPNLVNQ-UHFFFAOYSA-N -1 3 358.419 3.768 20 0 FHADHM Cc1cccc([C@H](NCc2cnc3c(cnn3C(C)C)c2)C(=O)[O-])c1C ZINC000277121175 934518524 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CCOCCOCc1cccc(CNC(=O)c2cc([O-])ccc2Cl)c1 ZINC000278700894 938666947 /nfs/dbraw/zinc/66/69/47/938666947.db2.gz BEXHIANIUHDWSY-UHFFFAOYSA-N -1 3 363.841 3.529 20 0 FHADHM O=C([O-])[C@H]1Cc2c(Br)cccc2CN1C[C@H]1CCC(F)(F)C1 ZINC000584297298 938675986 /nfs/dbraw/zinc/67/59/86/938675986.db2.gz CVIVOCLQQZUROS-IINYFYTJSA-N -1 3 374.225 3.696 20 0 FHADHM Cc1ccc(OC[C@H](C)[N-]S(=O)(=O)c2cc(F)ccc2Cl)cc1 ZINC000728586497 938689803 /nfs/dbraw/zinc/68/98/03/938689803.db2.gz UMBUMYNXQXIFBR-LBPRGKRZSA-N -1 3 357.834 3.533 20 0 FHADHM C[C@H](NC(=O)NCc1ccc([O-])c(F)c1)c1nc(C(F)(F)F)cs1 ZINC000278728701 938693113 /nfs/dbraw/zinc/69/31/13/938693113.db2.gz QZBBSLXMPOZJSX-ZETCQYMHSA-N -1 3 363.336 3.567 20 0 FHADHM CC(C)C1([N-]S(=O)(=O)c2cccc(Cl)c2Br)CC1 ZINC000584364122 938708997 /nfs/dbraw/zinc/70/89/97/938708997.db2.gz PVBFALQUFMXBAQ-UHFFFAOYSA-N -1 3 352.681 3.569 20 0 FHADHM Cc1ccc2c(c1)N(Cc1nc3c4ccccc4oc3c(=O)[n-]1)C[C@H](C)O2 ZINC000081572696 938793306 /nfs/dbraw/zinc/79/33/06/938793306.db2.gz 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FHADHM Cc1nc(-c2ccc(NC(=O)N3CCS[C@@H](C)CC3)cc2)cc(=O)[n-]1 ZINC000515028970 943473330 /nfs/dbraw/zinc/47/33/30/943473330.db2.gz RNSGBOFXZTVYOS-LBPRGKRZSA-N -1 3 358.467 3.517 20 0 FHADHM COc1ccc([C@H](CN=c2[n-]nc(C(F)F)s2)N2CCCCC2)cc1 ZINC000515084730 943492538 /nfs/dbraw/zinc/49/25/38/943492538.db2.gz CDERKPIERHDCAY-AWEZNQCLSA-N -1 3 368.453 3.545 20 0 FHADHM C[C@@H]1[C@@H](C(=O)NCc2ccc([O-])c(Br)c2)[C@H]1c1ccccc1 ZINC000435763062 943596667 /nfs/dbraw/zinc/59/66/67/943596667.db2.gz KPPLJDNFUYUDIQ-YMRXKLBXSA-N -1 3 360.251 3.821 20 0 FHADHM Cc1cnccc1CNC(=O)NN=c1[n-]c(Cl)c(Cl)cc1Cl ZINC000188298371 943641010 /nfs/dbraw/zinc/64/10/10/943641010.db2.gz FCGKJOOYMHTZLQ-UHFFFAOYSA-N -1 3 360.632 3.572 20 0 FHADHM CCCc1csc(CNC[C@@H](Cc2cccc(Cl)c2)C(=O)[O-])n1 ZINC000417548456 943689949 /nfs/dbraw/zinc/68/99/49/943689949.db2.gz QTJZEOCFIYBENA-CYBMUJFWSA-N -1 3 352.887 3.782 20 0 FHADHM CC(C)[C@@H]1C[C@](NCc2cnn(C(C)(C)C)c2)(C(=O)[O-])c2ccccc21 ZINC000417562755 943694494 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CSc1cc2c(cc1CN[C@H]1C[C@@H](C(=O)[O-])c3ccccc31)OCCO2 ZINC000417623451 943760101 /nfs/dbraw/zinc/76/01/01/943760101.db2.gz JTNFAMYWIURJSI-CVEARBPZSA-N -1 3 371.458 3.583 20 0 FHADHM CCOC[C@H](NCc1ccccc1Oc1ccc(F)cc1Cl)C(=O)[O-] ZINC000417613181 943764436 /nfs/dbraw/zinc/76/44/36/943764436.db2.gz YUQRTWNHGQIWBT-HNNXBMFYSA-N -1 3 367.804 3.851 20 0 FHADHM O=C([O-])C[C@H](CNCc1cc(Cl)ccc1OC(F)F)C(F)(F)F ZINC000417631279 943769716 /nfs/dbraw/zinc/76/97/16/943769716.db2.gz RYYCFOIQVJENOF-MRVPVSSYSA-N -1 3 361.694 3.684 20 0 FHADHM CC(C)=CCSC[C@H](NCc1ccc(C)cc1Br)C(=O)[O-] ZINC000417632794 943769920 /nfs/dbraw/zinc/76/99/20/943769920.db2.gz XEMAIPKDDSWJHJ-HNNXBMFYSA-N -1 3 372.328 4.000 20 0 FHADHM O=C([O-])C[C@@H](CNCc1ccc(Cl)cc1Br)C(F)(F)F ZINC000417632488 943771172 /nfs/dbraw/zinc/77/11/72/943771172.db2.gz SVNRULWBYBFZPY-QMMMGPOBSA-N -1 3 374.584 3.845 20 0 FHADHM COc1ccc(CN[C@@H]2C[C@@H](C(=O)[O-])c3ccccc32)cc1OC(F)F ZINC000417627778 943777712 /nfs/dbraw/zinc/77/77/12/943777712.db2.gz 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ZINC000417673046 943815288 /nfs/dbraw/zinc/81/52/88/943815288.db2.gz VIKDIGLIWLJHAR-UHFFFAOYSA-N -1 3 353.340 3.924 20 0 FHADHM C[C@H]1CCCN(Cc2cc(Cl)ccc2OCc2cccnc2)[C@@H]1C(=O)[O-] ZINC000424270874 943828804 /nfs/dbraw/zinc/82/88/04/943828804.db2.gz OHQYIMJEKNBDLG-LIRRHRJNSA-N -1 3 374.868 3.999 20 0 FHADHM O=c1[n-]c(CN2CCc3c(F)ccc(F)c3C2)nc2c3ccccc3oc21 ZINC000437496682 943860802 /nfs/dbraw/zinc/86/08/02/943860802.db2.gz BTDVRPLEQLQIGR-UHFFFAOYSA-N -1 3 367.355 3.918 20 0 FHADHM CSc1cc(Br)ccc1CN1CCC[C@H](C)[C@H]1C(=O)[O-] ZINC000424423644 943899701 /nfs/dbraw/zinc/89/97/01/943899701.db2.gz VFJIWFIGSUUONE-HZMBPMFUSA-N -1 3 358.301 3.856 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N[C@@H]2C[C@H]2c2cccc3ccccc32)c1 ZINC000435979979 943903401 /nfs/dbraw/zinc/90/34/01/943903401.db2.gz RVFKHHKTXBSAPZ-AZUAARDMSA-N -1 3 360.413 3.790 20 0 FHADHM COc1cc(C(=O)N[C@]2(c3ccc(Cl)cc3)C[C@@H]2C)cc(OC)c1[O-] ZINC000505738338 943918048 /nfs/dbraw/zinc/91/80/48/943918048.db2.gz QFVRRJHIIRMNFS-JEOXALJRSA-N -1 3 361.825 3.728 20 0 FHADHM CC[C@@H](Cc1ccccc1C)C(=O)Nc1ccccc1[N-]S(C)(=O)=O ZINC000424553943 943969987 /nfs/dbraw/zinc/96/99/87/943969987.db2.gz AVKNTZYOANWPJX-HNNXBMFYSA-N -1 3 360.479 3.574 20 0 FHADHM Cc1noc(C)c1S(=O)(=O)[N-][C@@H](c1ccc(Cl)cc1)C1CCC1 ZINC000517085412 943979613 /nfs/dbraw/zinc/97/96/13/943979613.db2.gz YCLGBLOWNBYFKB-OAHLLOKOSA-N -1 3 354.859 3.765 20 0 FHADHM CCSCC[C@@H](C)[N-]S(=O)(=O)c1ccc(F)cc1C(F)(F)F ZINC000437696640 944039975 /nfs/dbraw/zinc/03/99/75/944039975.db2.gz FQNZVOUWOXROKY-SECBINFHSA-N -1 3 359.410 3.655 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NCC3(O)CCC(C)(C)CC3)nc2)n1 ZINC000664527603 944045064 /nfs/dbraw/zinc/04/50/64/944045064.db2.gz SADWABGDYCVBKT-UHFFFAOYSA-N -1 3 356.470 3.550 20 0 FHADHM O=S(=O)([N-]c1cc(F)c(F)cc1F)c1ccc(C(F)(F)F)cc1 ZINC000517156248 944059811 /nfs/dbraw/zinc/05/98/11/944059811.db2.gz IFFNAJFARVPCAU-UHFFFAOYSA-N -1 3 355.259 3.924 20 0 FHADHM Cc1nc(-c2ccccc2NC(=O)c2cc(F)cc3n[n-]nc32)cs1 ZINC000505142015 944071375 /nfs/dbraw/zinc/07/13/75/944071375.db2.gz ZTJOIEKZNIDNII-UHFFFAOYSA-N -1 3 353.382 3.781 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)N[C@H]3C[C@H]3Cc3ccccc3)cc2)cc(=O)[n-]1 ZINC000437756798 944087447 /nfs/dbraw/zinc/08/74/47/944087447.db2.gz ISVXKUHRMKMFCV-MJGOQNOKSA-N -1 3 374.444 3.910 20 0 FHADHM CC(C)OCc1nc([C@@H](C)[N-]C(=O)C(F)(F)c2cccc(Cl)c2)no1 ZINC000291247362 944190693 /nfs/dbraw/zinc/19/06/93/944190693.db2.gz MLZIDYMLOJTGTQ-SNVBAGLBSA-N -1 3 373.787 3.617 20 0 FHADHM COc1ccc(OC)c([C@@H]2CCCN2CCOc2ccccc2C(=O)[O-])c1 ZINC000364307694 944288286 /nfs/dbraw/zinc/28/82/86/944288286.db2.gz KIPRFUCAYDIYSD-SFHVURJKSA-N -1 3 371.433 3.618 20 0 FHADHM O=C(NCc1ccc([O-])c(F)c1)c1cnc(-c2ccc(F)c(F)c2)s1 ZINC000506482994 944333637 /nfs/dbraw/zinc/33/36/37/944333637.db2.gz AFTNHRKQYBVICY-UHFFFAOYSA-N -1 3 364.348 3.863 20 0 FHADHM O=S(=O)([N-]c1ccc(F)cc1Cl)c1cnc2ccc(F)cc2c1 ZINC000436477260 944358270 /nfs/dbraw/zinc/35/82/70/944358270.db2.gz IHIVVFGNFAQPMH-UHFFFAOYSA-N -1 3 354.765 3.967 20 0 FHADHM COc1cc(NC(=O)c2ccc3c(c2[O-])OC(C)(C)C3)c(C)c(OC)c1 ZINC000436484823 944368705 /nfs/dbraw/zinc/36/87/05/944368705.db2.gz FOKHCKRRVYILLU-UHFFFAOYSA-N -1 3 357.406 3.684 20 0 FHADHM Cc1ccccc1-c1cc(=NC(=O)[C@H]2C[C@H]2c2cc(F)ccc2F)[nH][n-]1 ZINC000439146898 944379413 /nfs/dbraw/zinc/37/94/13/944379413.db2.gz KNTISNMTPAAERX-HOCLYGCPSA-N -1 3 353.372 3.827 20 0 FHADHM COc1cccc([C@H](C)C(=O)Nc2ccc(Br)cc2[O-])c1 ZINC000518436097 944379815 /nfs/dbraw/zinc/37/98/15/944379815.db2.gz OAODXYKIQKQUQH-JTQLQIEISA-N -1 3 350.212 3.906 20 0 FHADHM COc1ccc(Cl)cc1-c1cc(=NC(=O)c2cc(C)cc(F)c2)[nH][n-]1 ZINC000439161958 944385600 /nfs/dbraw/zinc/38/56/00/944385600.db2.gz OMXJNIQCLKTYKO-UHFFFAOYSA-N -1 3 359.788 3.860 20 0 FHADHM CCCN(C(=O)c1ccc(OC)cc1[O-])[C@@H](C)CC(=O)Nc1ccccc1 ZINC000436519784 944388793 /nfs/dbraw/zinc/38/87/93/944388793.db2.gz YNRMCXHWZSYJJA-HNNXBMFYSA-N -1 3 370.449 3.670 20 0 FHADHM CC(C)Oc1cccc(C(=O)Nc2cc(Br)ccc2[O-])n1 ZINC000436520068 944389568 /nfs/dbraw/zinc/38/95/68/944389568.db2.gz CCGPRDSDGHWQQR-UHFFFAOYSA-N -1 3 351.200 3.589 20 0 FHADHM CN1CC[C@H](NC(=O)c2c([O-])cc(Cl)cc2Cl)[C@@H]1c1ccccc1 ZINC000436524052 944393177 /nfs/dbraw/zinc/39/31/77/944393177.db2.gz FFYAJVNKTXPQGZ-YOEHRIQHSA-N -1 3 365.260 3.874 20 0 FHADHM O=C(Nc1nc2c(s1)COCC2)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436526814 944394525 /nfs/dbraw/zinc/39/45/25/944394525.db2.gz FILMFNCIEYYWDB-UHFFFAOYSA-N -1 3 368.414 3.966 20 0 FHADHM C[C@@H]1C[C@H](C)N(C(=O)C[C@H](NC(=O)c2ccc([O-])cc2)c2ccccc2)C1 ZINC000436529022 944397681 /nfs/dbraw/zinc/39/76/81/944397681.db2.gz YYUFHHQRYSFZGX-GUXCAODWSA-N -1 3 366.461 3.510 20 0 FHADHM COc1ccc(C(=O)NCc2cc(Oc3ccc(F)cc3)ccn2)c([O-])c1 ZINC000436554158 944412755 /nfs/dbraw/zinc/41/27/55/944412755.db2.gz IPLJZLPMWIKVQS-UHFFFAOYSA-N -1 3 368.364 3.657 20 0 FHADHM C[S@](=O)c1cccc(NC(=O)c2cc(Cc3ccccc3)ccc2[O-])c1 ZINC000436555064 944413616 /nfs/dbraw/zinc/41/36/16/944413616.db2.gz MGJQCIVJISODBZ-SANMLTNESA-N -1 3 365.454 3.973 20 0 FHADHM CCCN(CC(=O)OCC)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436539873 944417155 /nfs/dbraw/zinc/41/71/55/944417155.db2.gz PTINXAXQOUSYKH-UHFFFAOYSA-N -1 3 357.406 3.600 20 0 FHADHM Cc1nc([C@@H](NC(=O)c2ccc(C(C)C)cc2[O-])c2ccccc2F)no1 ZINC000436542766 944420373 /nfs/dbraw/zinc/42/03/73/944420373.db2.gz BKSVBLZCFFPOLT-SFHVURJKSA-N -1 3 369.396 3.866 20 0 FHADHM Cc1ccc(C(=O)N[C@@H](C)c2nc(-c3ccc(C)c(F)c3)no2)c([O-])c1 ZINC000436575416 944424456 /nfs/dbraw/zinc/42/44/56/944424456.db2.gz MNWXLZRELXWFHQ-LBPRGKRZSA-N -1 3 355.369 3.689 20 0 FHADHM O=C(Nc1ccc(CN2CCCC2=O)cc1)c1cc2c(cc1[O-])CCCC2 ZINC000436561355 944427814 /nfs/dbraw/zinc/42/78/14/944427814.db2.gz GFUWYGZCGWBGOS-UHFFFAOYSA-N -1 3 364.445 3.646 20 0 FHADHM CC(C)OCc1ccc([N-]S(=O)(=O)c2ccc3c(c2)C[C@H](C)O3)cc1 ZINC000518492690 944438946 /nfs/dbraw/zinc/43/89/46/944438946.db2.gz KCRFRJLKCXPLIU-AWEZNQCLSA-N -1 3 361.463 3.736 20 0 FHADHM O=C(NCc1cn2ccsc2n1)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436598401 944442892 /nfs/dbraw/zinc/44/28/92/944442892.db2.gz TXEKKSONLYKCEB-UHFFFAOYSA-N -1 3 363.442 3.622 20 0 FHADHM CC[C@@H](c1ccc(F)cc1F)N1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436587393 944449872 /nfs/dbraw/zinc/44/98/72/944449872.db2.gz DWXKYUIBJHZPDE-SFHVURJKSA-N -1 3 360.404 3.580 20 0 FHADHM O=C(Nc1ccc2nc(-c3ccccc3)[nH]c2c1)C(=O)c1ccc([O-])cc1 ZINC000436606853 944456628 /nfs/dbraw/zinc/45/66/28/944456628.db2.gz NOTAXVIFMRJYMT-UHFFFAOYSA-N -1 3 357.369 3.757 20 0 FHADHM CC[C@@H]1CN(C(=O)c2cc(Oc3ccccc3)ccc2[O-])C[C@H](C)[S@]1=O ZINC000436624556 944465819 /nfs/dbraw/zinc/46/58/19/944465819.db2.gz JWIISJLFONWXEL-WZXMGIQQSA-N -1 3 373.474 3.556 20 0 FHADHM Cc1cccc(C(=O)Nc2ccc(NC(=O)CC(F)(F)F)cc2)c1[O-] ZINC000436624520 944466279 /nfs/dbraw/zinc/46/62/79/944466279.db2.gz CATSNRNBDVHUJS-UHFFFAOYSA-N -1 3 352.312 3.844 20 0 FHADHM O=C(c1ccc(O)cc1[O-])N1CCC[C@H]1c1nc2cc(Cl)ccc2[nH]1 ZINC000436626658 944467710 /nfs/dbraw/zinc/46/77/10/944467710.db2.gz PVXPSQSNKMPXOL-HNNXBMFYSA-N -1 3 357.797 3.605 20 0 FHADHM Cc1cccc(C(=O)N2CCN(C)c3cc(Br)ccc32)c1[O-] ZINC000436627422 944468525 /nfs/dbraw/zinc/46/85/25/944468525.db2.gz SWUJBQSWFIUPCU-UHFFFAOYSA-N -1 3 361.239 3.560 20 0 FHADHM O=C(NCCc1nccs1)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436627263 944468853 /nfs/dbraw/zinc/46/88/53/944468853.db2.gz VNECUKBNYAOPRO-UHFFFAOYSA-N -1 3 352.459 3.606 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(Cl)c(F)c2N2CCOCC2)c([O-])c1 ZINC000436631920 944471255 /nfs/dbraw/zinc/47/12/55/944471255.db2.gz UZFUARBGBVDFHM-UHFFFAOYSA-N -1 3 364.804 3.582 20 0 FHADHM CC(=O)c1ccc(C(=O)N[C@H](C)Cc2ccccc2C(F)(F)F)cc1[O-] ZINC000436671093 944504706 /nfs/dbraw/zinc/50/47/06/944504706.db2.gz JFONWFJPAUYVFH-LLVKDONJSA-N -1 3 365.351 3.975 20 0 FHADHM Cc1ccc(C(=O)NCc2ccc(N3CCc4ccccc4C3)nc2)c([O-])c1 ZINC000436671515 944506252 /nfs/dbraw/zinc/50/62/52/944506252.db2.gz KGROBUQINUMEPA-UHFFFAOYSA-N -1 3 373.456 3.588 20 0 FHADHM O=C(NCc1cccc(CO)c1)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436673902 944507037 /nfs/dbraw/zinc/50/70/37/944507037.db2.gz SSRKRKQJAXZQIJ-UHFFFAOYSA-N -1 3 361.441 3.600 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(C(=O)NC3CCCC3)cc2)c([O-])c1C ZINC000436676738 944514224 /nfs/dbraw/zinc/51/42/24/944514224.db2.gz SNPNKVHAAQOPIC-UHFFFAOYSA-N -1 3 352.434 3.934 20 0 FHADHM COc1cc(-c2nc(-c3ccc(OC(C)C)cc3)no2)cc(OC)c1[O-] ZINC000436686011 944524394 /nfs/dbraw/zinc/52/43/94/944524394.db2.gz DHGIGLMUTITAIW-UHFFFAOYSA-N -1 3 356.378 3.914 20 0 FHADHM COc1cc(-c2nc(-c3ccc(OC(F)F)cc3)no2)cc(OC)c1[O-] ZINC000436688248 944526892 /nfs/dbraw/zinc/52/68/92/944526892.db2.gz KICZEMPPFYGSEC-UHFFFAOYSA-N -1 3 364.304 3.728 20 0 FHADHM Cn1c(=O)oc2cc(NC(=O)c3cc(Cc4ccccc4)ccc3[O-])ccc21 ZINC000436714957 944553763 /nfs/dbraw/zinc/55/37/63/944553763.db2.gz HEEOJGCMOLFXBV-UHFFFAOYSA-N -1 3 374.396 3.680 20 0 FHADHM COc1ccc(C(=O)NC[C@@H]2CCN(c3cc(Cl)ccc3C)C2)c([O-])c1 ZINC000436725085 944563731 /nfs/dbraw/zinc/56/37/31/944563731.db2.gz PYSCHZNMEUJBSA-AWEZNQCLSA-N -1 3 374.868 3.619 20 0 FHADHM CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)c1ccc(C(C)C)cc1[O-] ZINC000436736178 944564488 /nfs/dbraw/zinc/56/44/88/944564488.db2.gz NMZRCSZEOMNAOK-UHFFFAOYSA-N -1 3 365.433 3.827 20 0 FHADHM C[C@@H]1C[C@@H](C(C)(C)C)CCN1C(=O)[C@@H]1CCCN1C(=O)c1ccccc1[O-] ZINC000436745867 944573979 /nfs/dbraw/zinc/57/39/79/944573979.db2.gz FCLXTZQBAOXIIO-RYRKJORJSA-N -1 3 372.509 3.670 20 0 FHADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N(CCO)Cc1ccccc1 ZINC000436762351 944584879 /nfs/dbraw/zinc/58/48/79/944584879.db2.gz QZDKBUJJNSOFBP-UHFFFAOYSA-N -1 3 361.441 3.618 20 0 FHADHM Cc1nc(C)c(CC(=O)N(Cc2ccc3ccccc3c2)C2CC2)c(=O)[n-]1 ZINC000516214271 944597043 /nfs/dbraw/zinc/59/70/43/944597043.db2.gz XXVWWDASSHSPGV-UHFFFAOYSA-N -1 3 361.445 3.686 20 0 FHADHM CC(C)c1ccc(C(=O)N[C@@H](c2nccn2C)c2cccc(F)c2)c([O-])c1 ZINC000436757206 944599153 /nfs/dbraw/zinc/59/91/53/944599153.db2.gz UATNPKWCDYHIBE-LJQANCHMSA-N -1 3 367.424 3.908 20 0 FHADHM CC(C)c1ccc(-c2nc(-c3cn(C)nc3C(F)(F)F)no2)c([O-])c1 ZINC000436772842 944601736 /nfs/dbraw/zinc/60/17/36/944601736.db2.gz GLZYAJOAYIEOFQ-UHFFFAOYSA-N -1 3 352.316 3.985 20 0 FHADHM CCOc1ccccc1[C@@H](CC)NC(=O)c1cc(OC)c([O-])c(OC)c1 ZINC000436778284 944609594 /nfs/dbraw/zinc/60/95/94/944609594.db2.gz QENFTLFIUDBUTB-OAHLLOKOSA-N -1 3 359.422 3.689 20 0 FHADHM CCCCOc1ccccc1CN1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436798455 944622476 /nfs/dbraw/zinc/62/24/76/944622476.db2.gz TZLUQTOONANPRE-UHFFFAOYSA-N -1 3 368.477 3.529 20 0 FHADHM CC(C)[C@H](CC1CCCC1)C(=O)N1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436799623 944624909 /nfs/dbraw/zinc/62/49/09/944624909.db2.gz QGHMLYZKHRGQAQ-IBGZPJMESA-N -1 3 372.509 3.529 20 0 FHADHM CC[C@@H](C)Oc1cc(C)ccc1CNC(=O)c1cc(NC(C)=O)ccc1[O-] ZINC000436788526 944637808 /nfs/dbraw/zinc/63/78/08/944637808.db2.gz GYIHPALJJVOSOF-CQSZACIVSA-N -1 3 370.449 3.766 20 0 FHADHM C[C@@H](O)C[C@@H]1CCCCN1C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436807323 944663503 /nfs/dbraw/zinc/66/35/03/944663503.db2.gz XNQADXWIJHJKDP-APWZRJJASA-N -1 3 353.462 3.749 20 0 FHADHM O=C(c1ccc([O-])cc1)N1CCN(c2ccc3c(Cl)cccc3n2)CC1 ZINC000436807425 944663660 /nfs/dbraw/zinc/66/36/60/944663660.db2.gz LAHWOEKAYSVBMF-UHFFFAOYSA-N -1 3 367.836 3.556 20 0 FHADHM O=C(c1ccc([O-])cc1)N1CCN(c2ccc3ccc(Cl)cc3n2)CC1 ZINC000436809197 944664802 /nfs/dbraw/zinc/66/48/02/944664802.db2.gz RTTGHZFBZPOFAI-UHFFFAOYSA-N -1 3 367.836 3.556 20 0 FHADHM COc1cccc(C(=O)Nc2nc(-c3ccc4c(c3)OCO4)cs2)c1[O-] ZINC000436809767 944666277 /nfs/dbraw/zinc/66/62/77/944666277.db2.gz UUYKJHHWURKRBH-UHFFFAOYSA-N -1 3 370.386 3.505 20 0 FHADHM CC(C)c1ccc(C(=O)N[C@H](c2ccn(C)n2)c2ccc(F)cc2)c([O-])c1 ZINC000436811829 944668696 /nfs/dbraw/zinc/66/86/96/944668696.db2.gz KNODLDMWVFONJK-FQEVSTJZSA-N -1 3 367.424 3.908 20 0 FHADHM CCc1ccc(C(=O)NCc2ccc(C(=O)N3CCCCC3)cc2)c([O-])c1 ZINC000436812794 944669638 /nfs/dbraw/zinc/66/96/38/944669638.db2.gz NAYCAOMVNJYGKL-UHFFFAOYSA-N -1 3 366.461 3.511 20 0 FHADHM C[C@@H](C(=O)Oc1ccc(-c2ccc(-c3nnn[n-]3)cc2)cc1)c1ccco1 ZINC000735572076 944672669 /nfs/dbraw/zinc/67/26/69/944672669.db2.gz QKKSROVDWXNZTO-CYBMUJFWSA-N -1 3 360.373 3.836 20 0 FHADHM C[C@@H](C(=O)Oc1ccc(-c2ccc(-c3nn[n-]n3)cc2)cc1)c1ccco1 ZINC000735572076 944672675 /nfs/dbraw/zinc/67/26/75/944672675.db2.gz QKKSROVDWXNZTO-CYBMUJFWSA-N -1 3 360.373 3.836 20 0 FHADHM CCc1ccc(C(=O)N2CCC[C@@H](C(=O)c3ccc(F)cc3)C2)c([O-])c1 ZINC000436835365 944683753 /nfs/dbraw/zinc/68/37/53/944683753.db2.gz VYANLVVMYFJACY-MRXNPFEDSA-N -1 3 355.409 3.829 20 0 FHADHM COc1ccc(-c2ccncc2)cc1CN[C@H](C(=O)[O-])c1ccc(C)cc1 ZINC000426684400 944683754 /nfs/dbraw/zinc/68/37/54/944683754.db2.gz ZKWUENJBFCQZBT-NRFANRHFSA-N -1 3 362.429 3.981 20 0 FHADHM CCc1ccc(C(=O)NCCc2nc3ccccc3n2C(F)F)c([O-])c1 ZINC000436819802 944688508 /nfs/dbraw/zinc/68/85/08/944688508.db2.gz KAEJAGZLNOLRGQ-UHFFFAOYSA-N -1 3 359.376 3.672 20 0 FHADHM O=C(N[C@H](CCO)c1ccco1)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436821299 944691975 /nfs/dbraw/zinc/69/19/75/944691975.db2.gz KSEPNQHNTOXKML-QGZVFWFLSA-N -1 3 353.374 3.631 20 0 FHADHM COc1ccc(C[C@H](C)NC(=O)c2ccc(C(C)C)cc2[O-])cc1OC ZINC000436839913 944704925 /nfs/dbraw/zinc/70/49/25/944704925.db2.gz RBZSQKGDOJZVQZ-AWEZNQCLSA-N -1 3 357.450 3.894 20 0 FHADHM CC(C)(CNC(=O)[C@@H]1CCCN1C(=O)c1ccccc1[O-])C1CCCCC1 ZINC000436841608 944707699 /nfs/dbraw/zinc/70/76/99/944707699.db2.gz VSKYBXRMBHUAOF-SFHVURJKSA-N -1 3 372.509 3.720 20 0 FHADHM CC(=O)c1ccc(C(=O)N(C)Cc2ccc(Br)cc2)cc1[O-] ZINC000436843709 944709927 /nfs/dbraw/zinc/70/99/27/944709927.db2.gz ADQLQGNQUTXERJ-UHFFFAOYSA-N -1 3 362.223 3.630 20 0 FHADHM CC(C)OC(=O)CSCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000735894071 944711043 /nfs/dbraw/zinc/71/10/43/944711043.db2.gz CKAHGINRCKJJFA-UHFFFAOYSA-N -1 3 368.462 3.719 20 0 FHADHM CC(C)OC(=O)CSCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000735894071 944711054 /nfs/dbraw/zinc/71/10/54/944711054.db2.gz CKAHGINRCKJJFA-UHFFFAOYSA-N -1 3 368.462 3.719 20 0 FHADHM CC(C)c1cccc(NC(=O)CSc2ccccc2-c2nnn[n-]2)c1 ZINC000735928677 944714378 /nfs/dbraw/zinc/71/43/78/944714378.db2.gz PNUNTAAOTDXCMX-UHFFFAOYSA-N -1 3 353.451 3.721 20 0 FHADHM CC(C)c1cccc(NC(=O)CSc2ccccc2-c2nn[n-]n2)c1 ZINC000735928677 944714381 /nfs/dbraw/zinc/71/43/81/944714381.db2.gz PNUNTAAOTDXCMX-UHFFFAOYSA-N -1 3 353.451 3.721 20 0 FHADHM CC[C@@H]1CN(C(=O)c2cc(CCc3ccccc3)ccc2[O-])C[C@H](C)O1 ZINC000436847801 944715089 /nfs/dbraw/zinc/71/50/89/944715089.db2.gz LSCKUWJLHQJBHL-QFBILLFUSA-N -1 3 353.462 3.817 20 0 FHADHM COc1ccc([C@H](CCC(=O)[O-])NCc2cc(-c3ccccc3)n[nH]2)cc1 ZINC000426715645 944716243 /nfs/dbraw/zinc/71/62/43/944716243.db2.gz JLLZNRTZQCNVSY-IBGZPJMESA-N -1 3 365.433 3.781 20 0 FHADHM CC(C)c1ccc(C(=O)N(Cc2ccc(C(N)=O)cc2F)C2CC2)c([O-])c1 ZINC000436848709 944717055 /nfs/dbraw/zinc/71/70/55/944717055.db2.gz XBKHPFBLFDEDIY-UHFFFAOYSA-N -1 3 370.424 3.558 20 0 FHADHM COc1cccc(-c2nc(-c3cc(OC(F)F)ccc3F)no2)c1[O-] ZINC000436853040 944721901 /nfs/dbraw/zinc/72/19/01/944721901.db2.gz JJRCPTDZZGZQHA-UHFFFAOYSA-N -1 3 352.268 3.858 20 0 FHADHM CSc1cc2c(cc1CN[C@H](c1ccccc1)[C@@H](C)C(=O)[O-])OCCO2 ZINC000426722912 944723639 /nfs/dbraw/zinc/72/36/39/944723639.db2.gz JJDDLVQPWLXEID-YJYMSZOUSA-N -1 3 373.474 3.731 20 0 FHADHM COc1ccccc1[C@H](CC(C)C)NC(=O)c1cc(OC)c([O-])c(OC)c1 ZINC000436869651 944735886 /nfs/dbraw/zinc/73/58/86/944735886.db2.gz NLZPXRAGVFZWLG-INIZCTEOSA-N -1 3 373.449 3.935 20 0 FHADHM CC(=O)c1ccc(C(=O)Nc2nc(CN3CCC[C@H](C)C3)cs2)cc1[O-] ZINC000436873134 944740184 /nfs/dbraw/zinc/74/01/84/944740184.db2.gz ZDISGEDOUMJDDW-LBPRGKRZSA-N -1 3 373.478 3.536 20 0 FHADHM O=C([O-])[C@@H](Cc1ccc(F)cc1)NCc1csc(-c2ccccc2)n1 ZINC000426732124 944740296 /nfs/dbraw/zinc/74/02/96/944740296.db2.gz RPCRRWNDQJOYCF-QGZVFWFLSA-N -1 3 356.422 3.735 20 0 FHADHM COc1ccc([O-])c(-c2nc(Cc3nc4ccccc4n3C(F)F)no2)c1 ZINC000436893601 944746341 /nfs/dbraw/zinc/74/63/41/944746341.db2.gz OFIGFVYLIPFGIX-UHFFFAOYSA-N -1 3 372.331 3.786 20 0 FHADHM CC(C)c1ccc(-c2nc(-c3ccc(NS(C)(=O)=O)cc3)no2)c([O-])c1 ZINC000436893499 944747675 /nfs/dbraw/zinc/74/76/75/944747675.db2.gz NPMGIWLWNYBOHX-UHFFFAOYSA-N -1 3 373.434 3.604 20 0 FHADHM Cc1cc(C)cc([C@H](NCc2ccc(OC(F)F)c(F)c2)C(=O)[O-])c1 ZINC000426745851 944760264 /nfs/dbraw/zinc/76/02/64/944760264.db2.gz ICCMKJUGXQJVDJ-INIZCTEOSA-N -1 3 353.340 3.959 20 0 FHADHM COc1ccc(CN[C@H](C(=O)[O-])c2cccc(F)c2)cc1OCC(C)C ZINC000426764725 944763332 /nfs/dbraw/zinc/76/33/32/944763332.db2.gz AKBMFCFVPVSQAU-IBGZPJMESA-N -1 3 361.413 3.785 20 0 FHADHM COc1ccc([O-])c(-c2nc(Cc3ccc(OC(F)(F)F)cc3)no2)c1 ZINC000436888531 944763524 /nfs/dbraw/zinc/76/35/24/944763524.db2.gz NPCRLCIKTKVQDJ-UHFFFAOYSA-N -1 3 366.295 3.940 20 0 FHADHM COc1ccc(CN[C@@H](C(=O)[O-])c2cccc(F)c2)cc1OCC(C)C ZINC000426764726 944763553 /nfs/dbraw/zinc/76/35/53/944763553.db2.gz AKBMFCFVPVSQAU-LJQANCHMSA-N -1 3 361.413 3.785 20 0 FHADHM COc1ccc([O-])c(-c2nc(-c3cccc(NC(=O)C4CCC4)c3)no2)c1 ZINC000436904458 944773728 /nfs/dbraw/zinc/77/37/28/944773728.db2.gz QMLONTRYHLZSBV-UHFFFAOYSA-N -1 3 365.389 3.856 20 0 FHADHM C[C@H]1CCC[C@@H](C(=O)Nc2nc(-c3ccc(-c4nnn[n-]4)cc3)cs2)C1 ZINC000736245759 944776483 /nfs/dbraw/zinc/77/64/83/944776483.db2.gz WEXYPKPAKLUMFN-SMDDNHRTSA-N -1 3 368.466 3.755 20 0 FHADHM C[C@H]1CCC[C@@H](C(=O)Nc2nc(-c3ccc(-c4nn[n-]n4)cc3)cs2)C1 ZINC000736245759 944776487 /nfs/dbraw/zinc/77/64/87/944776487.db2.gz WEXYPKPAKLUMFN-SMDDNHRTSA-N -1 3 368.466 3.755 20 0 FHADHM O=S(=O)([N-]CCc1cc(F)cc(F)c1)c1cc(Cl)ccc1Cl ZINC000500401908 944776740 /nfs/dbraw/zinc/77/67/40/944776740.db2.gz VYTMFAODNMIAFR-UHFFFAOYSA-N -1 3 366.216 3.793 20 0 FHADHM O=C(N[C@@H](CO)c1ccsc1)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436908504 944777512 /nfs/dbraw/zinc/77/75/12/944777512.db2.gz VQHRRGLVULQYBS-KRWDZBQOSA-N -1 3 355.415 3.709 20 0 FHADHM COC(=O)c1ccc(-c2nc(Cc3cccc4ccc(OC)cc43)no2)[n-]1 ZINC000426435573 944783628 /nfs/dbraw/zinc/78/36/28/944783628.db2.gz LVRUDPYLCHIMLC-UHFFFAOYSA-N -1 3 363.373 3.604 20 0 FHADHM O=c1[n-]c(-c2nc(-c3cccc(F)c3Br)no2)ccc1F ZINC001214085767 944784666 /nfs/dbraw/zinc/78/46/66/944784666.db2.gz XVTDLMPGRBYMIX-UHFFFAOYSA-N -1 3 354.110 3.545 20 0 FHADHM COc1ccc([C@H](CC(=O)[O-])NCc2cc3c(cccc3F)[nH]2)cc1OC ZINC000426773044 944790187 /nfs/dbraw/zinc/79/01/87/944790187.db2.gz HXUXMSSKUCMOMK-KRWDZBQOSA-N -1 3 372.396 3.630 20 0 FHADHM CCC(=CC(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1)c1ccc(C)cc1 ZINC000736302442 944792095 /nfs/dbraw/zinc/79/20/95/944792095.db2.gz FTESMJFJWPYYLK-GHRIWEEISA-N -1 3 361.449 3.627 20 0 FHADHM CCC(=CC(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1)c1ccc(C)cc1 ZINC000736302442 944792106 /nfs/dbraw/zinc/79/21/06/944792106.db2.gz FTESMJFJWPYYLK-GHRIWEEISA-N -1 3 361.449 3.627 20 0 FHADHM CC(C)(C)C[C@@H](NCc1cn(-c2ccc(Cl)cc2Cl)nn1)C(=O)[O-] ZINC000426776919 944795207 /nfs/dbraw/zinc/79/52/07/944795207.db2.gz IWZNINWILKKFFJ-CYBMUJFWSA-N -1 3 371.268 3.553 20 0 FHADHM COc1cc(C)c(CN[C@@H](C(=O)[O-])c2ccc(Cl)c(C)c2)cc1OC ZINC000426779540 944797192 /nfs/dbraw/zinc/79/71/92/944797192.db2.gz IWSWMVWZYAHIHP-GOSISDBHSA-N -1 3 363.841 3.890 20 0 FHADHM CCc1ccc(C(=O)NC2(Cc3ccc(F)cc3)CCOCC2)c([O-])c1 ZINC000436916686 944799622 /nfs/dbraw/zinc/79/96/22/944799622.db2.gz ATHNXLROIBCTQN-UHFFFAOYSA-N -1 3 357.425 3.615 20 0 FHADHM C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2cc(F)c([O-])c(Cl)c2)C1 ZINC000436922925 944807176 /nfs/dbraw/zinc/80/71/76/944807176.db2.gz ROYFNYFOLUJSIE-WFASDCNBSA-N -1 3 362.832 3.750 20 0 FHADHM CS[C@H]1C(=O)Nc2ccc(-c3noc(-c4ccc(C)cc4[O-])n3)cc21 ZINC000436923773 944808999 /nfs/dbraw/zinc/80/89/99/944808999.db2.gz AFQRITKKCMSGBF-OAHLLOKOSA-N -1 3 353.403 3.774 20 0 FHADHM CCC[C@@H](CC)NC(=O)C[C@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436930097 944816220 /nfs/dbraw/zinc/81/62/20/944816220.db2.gz FHRCWMIUSBGJSA-QUCCMNQESA-N -1 3 368.477 3.948 20 0 FHADHM O=C([O-])[C@@H](NCc1ccc(OCC(F)(F)F)c(F)c1)c1ccsc1 ZINC000426793534 944816780 /nfs/dbraw/zinc/81/67/80/944816780.db2.gz QRPNSRRHUCZMHY-ZDUSSCGKSA-N -1 3 363.332 3.744 20 0 FHADHM Cc1ccc(CN[C@H](C(=O)[O-])c2cccc(F)c2)cc1Br ZINC000426829494 944828016 /nfs/dbraw/zinc/82/80/16/944828016.db2.gz PMFHAOJWXMHRPL-HNNXBMFYSA-N -1 3 352.203 3.812 20 0 FHADHM Cc1cc(Br)ccc1CN[C@H](C(=O)[O-])c1cccc(F)c1 ZINC000426812209 944832970 /nfs/dbraw/zinc/83/29/70/944832970.db2.gz QBLQEBZYGYMYNN-HNNXBMFYSA-N -1 3 352.203 3.812 20 0 FHADHM [O-]c1ccccc1-c1nc(-c2cc(Cl)ccc2O[C@H]2CCOC2)no1 ZINC000436948845 944836563 /nfs/dbraw/zinc/83/65/63/944836563.db2.gz IETKWSPXDYABLQ-LBPRGKRZSA-N -1 3 358.781 3.930 20 0 FHADHM O=C(Nc1ccc(NC(=O)C2CC2)cc1)c1ccc2c(c1[O-])CCCC2 ZINC000436947747 944837052 /nfs/dbraw/zinc/83/70/52/944837052.db2.gz SBDNKZFJJJJVRC-UHFFFAOYSA-N -1 3 350.418 3.872 20 0 FHADHM CCCCOc1cc(CN[C@H](C(=O)[O-])c2ccc(F)cc2)ccc1OC ZINC000426816899 944837823 /nfs/dbraw/zinc/83/78/23/944837823.db2.gz MYDAKXAHABCUNS-IBGZPJMESA-N -1 3 361.413 3.929 20 0 FHADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CCOCC2(CCC2)C1 ZINC000436963582 944841769 /nfs/dbraw/zinc/84/17/69/944841769.db2.gz ZVVFNRQANCSXST-UHFFFAOYSA-N -1 3 351.446 3.626 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)NCCc2cc3ccccc3s2)c1 ZINC000506638387 944848006 /nfs/dbraw/zinc/84/80/06/944848006.db2.gz VOOWCOUPXWDEQO-UHFFFAOYSA-N -1 3 354.431 3.538 20 0 FHADHM O=C([O-])[C@H](NCc1ccc(OCc2ccncc2)cc1)c1ccsc1 ZINC000426828855 944853787 /nfs/dbraw/zinc/85/37/87/944853787.db2.gz MSBLWYASCHERJA-GOSISDBHSA-N -1 3 354.431 3.638 20 0 FHADHM CCc1nc(-c2ccccc2NC(=O)c2ccc3c(c2[O-])CCCC3)n[nH]1 ZINC000436974197 944861526 /nfs/dbraw/zinc/86/15/26/944861526.db2.gz WZEOPHXSOINMPX-UHFFFAOYSA-N -1 3 362.433 3.871 20 0 FHADHM CO[C@H](C)c1cccc([N-]S(=O)(=O)Cc2cc(C(C)(C)C)on2)c1 ZINC000506645672 944872019 /nfs/dbraw/zinc/87/20/19/944872019.db2.gz KJRGYMYJSBVIHG-GFCCVEGCSA-N -1 3 352.456 3.621 20 0 FHADHM CCCCOc1ccc(C(=O)N2CCO[C@H](c3ccccc3F)C2)c([O-])c1 ZINC000436970113 944876596 /nfs/dbraw/zinc/87/65/96/944876596.db2.gz CHAAWKPWNCBJLP-FQEVSTJZSA-N -1 3 373.424 3.924 20 0 FHADHM CCCCOc1ccc(C(=O)NCc2csc([C@H](C)OC)n2)c([O-])c1 ZINC000436990631 944886021 /nfs/dbraw/zinc/88/60/21/944886021.db2.gz VFDPVQFEHGKAHR-LBPRGKRZSA-N -1 3 364.467 3.665 20 0 FHADHM CN(Cc1ccc(-c2nnn[n-]2)cc1F)[C@@H](c1ccccc1)C(F)(F)F ZINC000736816642 944895766 /nfs/dbraw/zinc/89/57/66/944895766.db2.gz LUVCPUMDNROAOJ-HNNXBMFYSA-N -1 3 365.334 3.741 20 0 FHADHM CN(Cc1ccc(-c2nn[n-]n2)cc1F)[C@@H](c1ccccc1)C(F)(F)F ZINC000736816642 944895772 /nfs/dbraw/zinc/89/57/72/944895772.db2.gz LUVCPUMDNROAOJ-HNNXBMFYSA-N -1 3 365.334 3.741 20 0 FHADHM CCCCOc1ccc(C(=O)N[C@@H]2CCc3cn(C(C)C)nc3C2)c([O-])c1 ZINC000436985591 944897455 /nfs/dbraw/zinc/89/74/55/944897455.db2.gz HXLNNOIRWZCFGA-MRXNPFEDSA-N -1 3 371.481 3.636 20 0 FHADHM O=C(Nc1csc2ccccc12)[C@H]1CCCN1C(=O)c1ccccc1[O-] ZINC000437000508 944918562 /nfs/dbraw/zinc/91/85/62/944918562.db2.gz ULQCKYYTJASLKN-MRXNPFEDSA-N -1 3 366.442 3.850 20 0 FHADHM O=C(N[C@H]1C[C@@H]1c1ccccc1OC(F)F)c1cc([O-])ccc1Cl ZINC000511710700 944938061 /nfs/dbraw/zinc/93/80/61/944938061.db2.gz VWPHRWDJSRBAIE-RISCZKNCSA-N -1 3 353.752 3.933 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@@H]3CCCCCC(=O)C3)c2)n1 ZINC000518038744 944943400 /nfs/dbraw/zinc/94/34/00/944943400.db2.gz WKXBIFVQEQXWTK-OAHLLOKOSA-N -1 3 367.449 3.890 20 0 FHADHM Cc1csc([C@@H](C)[N-]S(=O)(=O)c2csc(-c3ccccc3)n2)n1 ZINC000500430528 944974852 /nfs/dbraw/zinc/97/48/52/944974852.db2.gz VWWRFCJBVIPCNJ-LLVKDONJSA-N -1 3 365.505 3.615 20 0 FHADHM COc1cc(C(=O)N2[C@H](C)C[C@@H](c3ccccc3)[C@@H]2C)cc(OC)c1[O-] ZINC000426974582 944975194 /nfs/dbraw/zinc/97/51/94/944975194.db2.gz XKSWODKJBJCLFO-JKIFEVAISA-N -1 3 355.434 3.816 20 0 FHADHM O=C(Nc1cc(Br)ccc1[O-])[C@H]1CCCN1c1ccccc1 ZINC000426996312 944986460 /nfs/dbraw/zinc/98/64/60/944986460.db2.gz ZGHCERLJBZYHPZ-OAHLLOKOSA-N -1 3 361.239 3.762 20 0 FHADHM O=C(N=c1cc([C@@H]2CCCO2)[n-][nH]1)c1csc(-c2ccc(Cl)cc2)n1 ZINC000473852601 945003265 /nfs/dbraw/zinc/00/32/65/945003265.db2.gz UZODGOACYDCMLY-AWEZNQCLSA-N -1 3 374.853 3.712 20 0 FHADHM CC(=O)c1ccc(C(=O)N(C)C[C@@H]2CCCO[C@@H]2c2ccccc2)cc1[O-] ZINC000664608280 945018434 /nfs/dbraw/zinc/01/84/34/945018434.db2.gz YSCFUKMGQNNJGB-GHTZIAJQSA-N -1 3 367.445 3.835 20 0 FHADHM C[C@@H](NC(=O)N1CCC[C@H]1CC(C)(C)C)c1cccc(-c2nnn[n-]2)c1 ZINC000820348896 945424122 /nfs/dbraw/zinc/42/41/22/945424122.db2.gz GSRBZTAAQOTGEW-CJNGLKHVSA-N -1 3 356.474 3.538 20 0 FHADHM C[C@@H](NC(=O)N1CCC[C@H]1CC(C)(C)C)c1cccc(-c2nn[n-]n2)c1 ZINC000820348896 945424128 /nfs/dbraw/zinc/42/41/28/945424128.db2.gz GSRBZTAAQOTGEW-CJNGLKHVSA-N -1 3 356.474 3.538 20 0 FHADHM O=C(NCc1ncccc1[O-])c1ccccc1NCc1ccccc1Cl ZINC000473863830 945428283 /nfs/dbraw/zinc/42/82/83/945428283.db2.gz QNZVZGAIYRLTGM-UHFFFAOYSA-N -1 3 367.836 3.983 20 0 FHADHM Cc1ccc(-c2nc(CN[C@H](Cc3ccc(O)cc3)C(=O)[O-])cs2)cc1 ZINC000426653527 945488997 /nfs/dbraw/zinc/48/89/97/945488997.db2.gz CPVADZWEHCVILO-GOSISDBHSA-N -1 3 368.458 3.610 20 0 FHADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)c3ccc(Cl)cc3C)cc2)n1 ZINC000164488907 945521552 /nfs/dbraw/zinc/52/15/52/945521552.db2.gz BFJVYMSOERTGCA-UHFFFAOYSA-N -1 3 353.809 3.959 20 0 FHADHM C[C@@H]1CCN(c2ncc(-c3nnn[n-]3)cc2Cl)[C@@H]1c1cccc(F)c1 ZINC000820726715 945537290 /nfs/dbraw/zinc/53/72/90/945537290.db2.gz BCKYPQRSCZRYAH-BMIGLBTASA-N -1 3 358.808 3.642 20 0 FHADHM C[C@@H]1CCN(c2ncc(-c3nn[n-]n3)cc2Cl)[C@@H]1c1cccc(F)c1 ZINC000820726715 945537292 /nfs/dbraw/zinc/53/72/92/945537292.db2.gz BCKYPQRSCZRYAH-BMIGLBTASA-N -1 3 358.808 3.642 20 0 FHADHM C[C@H]1CCN(c2ncc(-c3nnn[n-]3)cc2Cl)[C@H]1c1cccc(F)c1 ZINC000820726722 945539480 /nfs/dbraw/zinc/53/94/80/945539480.db2.gz BCKYPQRSCZRYAH-ZUZCIYMTSA-N -1 3 358.808 3.642 20 0 FHADHM C[C@H]1CCN(c2ncc(-c3nn[n-]n3)cc2Cl)[C@H]1c1cccc(F)c1 ZINC000820726722 945539484 /nfs/dbraw/zinc/53/94/84/945539484.db2.gz BCKYPQRSCZRYAH-ZUZCIYMTSA-N -1 3 358.808 3.642 20 0 FHADHM CCC/C(C)=C/C(=O)Nc1cc(C(F)(F)F)ccc1[N-]S(C)(=O)=O ZINC000729451380 945578124 /nfs/dbraw/zinc/57/81/24/945578124.db2.gz KZXAAORVAQULKC-CSKARUKUSA-N -1 3 364.389 3.762 20 0 FHADHM Cc1[n-][nH]c(=O)c1CCNC(=O)c1cc(-c2ccccc2C)ccc1Cl ZINC000519628427 945598820 /nfs/dbraw/zinc/59/88/20/945598820.db2.gz YGNBBFZVJSRSOD-INIZCTEOSA-N -1 3 369.852 3.557 20 0 FHADHM Cc1c(Cl)cccc1S(=O)(=O)[N-][C@@H](c1nccs1)C(F)(F)F ZINC000549525159 945601716 /nfs/dbraw/zinc/60/17/16/945601716.db2.gz ZMPOUJZTVPYRLX-JTQLQIEISA-N -1 3 370.805 3.687 20 0 FHADHM Cc1ccc(Br)cc1CNC(=O)NCc1ccc([O-])c(F)c1 ZINC000187789171 945610367 /nfs/dbraw/zinc/61/03/67/945610367.db2.gz FPSRBOGPNRNNHO-UHFFFAOYSA-N -1 3 367.218 3.602 20 0 FHADHM COc1ccc2oc([C@H](C)NC(=O)c3cc(=O)[n-]c(C4CC4)n3)c(C)c2c1 ZINC000519643683 945615783 /nfs/dbraw/zinc/61/57/83/945615783.db2.gz HHUFQWNELHQPMS-NSHDSACASA-N -1 3 367.405 3.614 20 0 FHADHM O=C([N-]c1nnc(C(F)(F)F)s1)c1ncccc1Oc1ccccc1 ZINC000440435183 945673378 /nfs/dbraw/zinc/67/33/78/945673378.db2.gz GLKJTVAGEZIHBZ-UHFFFAOYSA-N -1 3 366.324 3.997 20 0 FHADHM Cc1ccc(OCc2ccc(C(=O)NCc3ncccc3[O-])o2)c(C)c1 ZINC000473641455 945684861 /nfs/dbraw/zinc/68/48/61/945684861.db2.gz WKQGEDIVBJMTKA-UHFFFAOYSA-N -1 3 352.390 3.506 20 0 FHADHM CCOc1ccccc1Oc1ccccc1C(=O)NCc1ncccc1[O-] ZINC000473646194 945700093 /nfs/dbraw/zinc/70/00/93/945700093.db2.gz WJXBEGDBNZGDBU-UHFFFAOYSA-N -1 3 364.401 3.908 20 0 FHADHM O=C(NCc1ncccc1[O-])c1ccc(N2CCCc3ccccc32)cc1 ZINC000473644779 945706178 /nfs/dbraw/zinc/70/61/78/945706178.db2.gz VPPPYIIRONUWFJ-UHFFFAOYSA-N -1 3 359.429 3.802 20 0 FHADHM CSc1ccc(F)cc1C[N-]S(=O)(=O)c1ccccc1SC ZINC000444069237 945783423 /nfs/dbraw/zinc/78/34/23/945783423.db2.gz IRHVYLTXRVQHOA-UHFFFAOYSA-N -1 3 357.497 3.748 20 0 FHADHM Cc1ccc(CN(C)C)cc1[N-]S(=O)(=O)c1cccc2c1OC(C)(C)C2 ZINC000192625864 945793957 /nfs/dbraw/zinc/79/39/57/945793957.db2.gz YSFGWMXPVPERMT-UHFFFAOYSA-N -1 3 374.506 3.571 20 0 FHADHM COCc1ccc(SCCCOc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000821696077 945829480 /nfs/dbraw/zinc/82/94/80/945829480.db2.gz VMVIYIDVXGZFTN-UHFFFAOYSA-N -1 3 356.451 3.574 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)c3ccc4ccccc4n3)c2)n1 ZINC000049302992 945833058 /nfs/dbraw/zinc/83/30/58/945833058.db2.gz AYCVZWFOMQVIQJ-UHFFFAOYSA-N -1 3 370.412 3.800 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N[C@H]2CCC(C)(C)c3ccccc32)c1 ZINC000519899441 945850103 /nfs/dbraw/zinc/85/01/03/945850103.db2.gz FUUXDWLQMYRSPA-SFHVURJKSA-N -1 3 352.434 3.893 20 0 FHADHM COC(C)(C)C[C@@H](C)Oc1cccc([O-])c1I ZINC001227377398 945851501 /nfs/dbraw/zinc/85/15/01/945851501.db2.gz DRPBEGUIHGBXSH-SECBINFHSA-N -1 3 350.196 3.579 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)Nc3ccc4c(c3)ncn4C)cc2)cc(=O)[n-]1 ZINC000440740166 945853496 /nfs/dbraw/zinc/85/34/96/945853496.db2.gz DEKVIFKMPHOZLB-UHFFFAOYSA-N -1 3 374.404 3.688 20 0 FHADHM COc1ccc(CNc2ccc(CC(F)(F)F)cc2)cc1-c1nnn[n-]1 ZINC000821821248 945875707 /nfs/dbraw/zinc/87/57/07/945875707.db2.gz CMCPTSXRXBEAKV-UHFFFAOYSA-N -1 3 363.343 3.592 20 0 FHADHM COc1ccc(CNc2ccc(CC(F)(F)F)cc2)cc1-c1nn[n-]n1 ZINC000821821248 945875715 /nfs/dbraw/zinc/87/57/15/945875715.db2.gz CMCPTSXRXBEAKV-UHFFFAOYSA-N -1 3 363.343 3.592 20 0 FHADHM COc1cc(C(=O)N2C[C@@H](c3ccc(C)cc3)C[C@H]2C)cc(OC)c1[O-] ZINC000428327702 945885990 /nfs/dbraw/zinc/88/59/90/945885990.db2.gz UXBWUTCFPCIANL-PBHICJAKSA-N -1 3 355.434 3.736 20 0 FHADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(-n3ccnc3)c(F)c2)cc1Cl ZINC000522820090 945906665 /nfs/dbraw/zinc/90/66/65/945906665.db2.gz RJKAWYQTSDZHGH-UHFFFAOYSA-N -1 3 365.817 3.774 20 0 FHADHM COc1cccc(NC(=O)Nc2ccc(-c3cc(=O)[n-]c(C)n3)cc2)c1 ZINC000519946097 945919009 /nfs/dbraw/zinc/91/90/09/945919009.db2.gz VWJHIWKRTIWBFJ-UHFFFAOYSA-N -1 3 350.378 3.810 20 0 FHADHM C[C@H]1CCC[C@H](C)N1C(=O)c1c[n-]c2ccc(Br)cc2c1=O ZINC000444181076 946037909 /nfs/dbraw/zinc/03/79/09/946037909.db2.gz IXZPROCVCODCCP-QWRGUYRKSA-N -1 3 363.255 3.694 20 0 FHADHM C[C@@H](CO)[C@@H]1CCCCN1Cc1nc(=O)c2c(-c3ccco3)csc2[n-]1 ZINC000661447857 946113527 /nfs/dbraw/zinc/11/35/27/946113527.db2.gz ZONCPOMQAYSCIZ-JSGCOSHPSA-N -1 3 373.478 3.640 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N(C)C[C@@H](C)c3nccs3)nc2)n1 ZINC000302119956 946129780 /nfs/dbraw/zinc/12/97/80/946129780.db2.gz DESPCXJKPLSIGF-GFCCVEGCSA-N -1 3 355.467 3.503 20 0 FHADHM CN(Cc1nc2c3ccccc3oc2c(=O)[n-]1)[C@@H](CCO)c1ccccc1 ZINC000444248731 946135825 /nfs/dbraw/zinc/13/58/25/946135825.db2.gz WFMXYGHOKBDZRD-INIZCTEOSA-N -1 3 363.417 3.637 20 0 FHADHM CCCC[C@@H](COC)[N-]S(=O)(=O)c1c(Cl)ccc(C)c1Cl ZINC000522968050 946178128 /nfs/dbraw/zinc/17/81/28/946178128.db2.gz ZRGJCVVREGXHNB-NSHDSACASA-N -1 3 354.299 3.785 20 0 FHADHM C[C@@H]1CC[C@H](C)N(C(=O)c2c[n-]c3ccc(Br)cc3c2=O)C1 ZINC000444298402 946184112 /nfs/dbraw/zinc/18/41/12/946184112.db2.gz NJQKRHRLXNFRAY-MNOVXSKESA-N -1 3 363.255 3.551 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N3CCC[C@H]3c3csc(C)n3)nc2)n1 ZINC000302346193 946208475 /nfs/dbraw/zinc/20/84/75/946208475.db2.gz AXMNYHAJRXVLMV-INIZCTEOSA-N -1 3 367.478 3.913 20 0 FHADHM CC1(CNC(=O)C[C@H](NC(=O)c2ccc([O-])cc2)c2ccccc2)CCC1 ZINC000184141496 946228864 /nfs/dbraw/zinc/22/88/64/946228864.db2.gz FGIVPYIGGLQGAH-IBGZPJMESA-N -1 3 366.461 3.560 20 0 FHADHM O=C(CCCc1ccc(Cl)cc1)Nc1ccc(F)cc1-c1nnn[n-]1 ZINC000822958814 946234413 /nfs/dbraw/zinc/23/44/13/946234413.db2.gz IJWMJBKPPFEKMA-UHFFFAOYSA-N -1 3 359.792 3.621 20 0 FHADHM O=C(CCCc1ccc(Cl)cc1)Nc1ccc(F)cc1-c1nn[n-]n1 ZINC000822958814 946234419 /nfs/dbraw/zinc/23/44/19/946234419.db2.gz IJWMJBKPPFEKMA-UHFFFAOYSA-N -1 3 359.792 3.621 20 0 FHADHM Cc1nc(C)c(CCC(=O)N[C@H](C)c2ccc(SC(C)C)cc2)c(=O)[n-]1 ZINC000103404203 946290955 /nfs/dbraw/zinc/29/09/55/946290955.db2.gz PIYLXLMULMHBPC-CYBMUJFWSA-N -1 3 373.522 3.697 20 0 FHADHM Cc1noc([N-]C(=O)c2cc(-c3ccco3)n(-c3ccc(Cl)cc3)n2)n1 ZINC000042703784 946300763 /nfs/dbraw/zinc/30/07/63/946300763.db2.gz PEJGPHZARPFXFT-UHFFFAOYSA-N -1 3 369.768 3.729 20 0 FHADHM O=C(CCCc1ccc([O-])c(F)c1)Nc1cncc(Br)c1 ZINC000468893570 946302467 /nfs/dbraw/zinc/30/24/67/946302467.db2.gz ILXXTMWJVGHVEB-UHFFFAOYSA-N -1 3 353.191 3.650 20 0 FHADHM CCCc1nnc([N-]C(=O)c2cc(Br)c(F)cc2F)s1 ZINC000428350092 946312128 /nfs/dbraw/zinc/31/21/28/946312128.db2.gz XCTCIBZRJDITTB-UHFFFAOYSA-N -1 3 362.199 3.784 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N3CCC(c4ccncc4)CC3)nc2)n1 ZINC000302802221 946331462 /nfs/dbraw/zinc/33/14/62/946331462.db2.gz UPNUIKLDWDMGNI-UHFFFAOYSA-N -1 3 361.449 3.586 20 0 FHADHM COC(=O)c1ccc([N-]S(=O)(=O)c2ccc3ccccc3c2)c(F)c1 ZINC000103943539 946334558 /nfs/dbraw/zinc/33/45/58/946334558.db2.gz JNJQSZRRZQFILG-UHFFFAOYSA-N -1 3 359.378 3.566 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3C[C@H]3c3ccc(F)cc3)nc2)n1 ZINC000302853632 946351734 /nfs/dbraw/zinc/35/17/34/946351734.db2.gz JWWNSNQIDRUNJS-DLBZAZTESA-N -1 3 350.397 3.914 20 0 FHADHM COCc1nc(C(=O)[N-]c2ncn(C(C)(C)C)n2)c(-c2ccccc2)s1 ZINC000441281042 946376800 /nfs/dbraw/zinc/37/68/00/946376800.db2.gz WDWLXNDTPIRGJD-UHFFFAOYSA-N -1 3 371.466 3.555 20 0 FHADHM O=C(Nc1nnc(C(F)(F)F)[n-]1)c1ccc2nc(-c3ccccc3)oc2c1 ZINC000475118890 946416507 /nfs/dbraw/zinc/41/65/07/946416507.db2.gz MNNXNANXWVXKAY-UHFFFAOYSA-N -1 3 373.294 3.884 20 0 FHADHM O=C(Nc1nc(C(F)(F)F)n[n-]1)c1ccc2nc(-c3ccccc3)oc2c1 ZINC000475118890 946416513 /nfs/dbraw/zinc/41/65/13/946416513.db2.gz MNNXNANXWVXKAY-UHFFFAOYSA-N -1 3 373.294 3.884 20 0 FHADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(NC(=O)CC(C)(F)F)cc2)cc1 ZINC000428354681 946452070 /nfs/dbraw/zinc/45/20/70/946452070.db2.gz LKNRPLSITUCZQM-UHFFFAOYSA-N -1 3 368.405 3.780 20 0 FHADHM [O-]c1cc(F)cc(CN2CCO[C@@H](c3ccc(OC(F)F)cc3)C2)c1 ZINC000473138504 946453679 /nfs/dbraw/zinc/45/36/79/946453679.db2.gz FWUZCJBKCGRUCW-QGZVFWFLSA-N -1 3 353.340 3.706 20 0 FHADHM CC(C)(C)c1ccncc1CNCc1ncc(Br)cc1[O-] ZINC000894906707 946458075 /nfs/dbraw/zinc/45/80/75/946458075.db2.gz ANDATXHRACBCRS-UHFFFAOYSA-N -1 3 350.260 3.532 20 0 FHADHM COc1ccc(F)c(C(=O)N=c2cc(-c3cc(C)cc(C)c3)[n-][nH]2)c1OC ZINC000473139228 946492551 /nfs/dbraw/zinc/49/25/51/946492551.db2.gz ILBPIGOAUCFFAD-UHFFFAOYSA-N -1 3 369.396 3.524 20 0 FHADHM Cc1nc(C)c(CCC(=O)N[C@@H]2CC(C)(C)CCc3ccccc32)c(=O)[n-]1 ZINC000441403530 946578680 /nfs/dbraw/zinc/57/86/80/946578680.db2.gz GLHXHTIDRAILJL-LJQANCHMSA-N -1 3 367.493 3.952 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@H]2C(=O)Nc2ccc(Cc3nnn[n-]3)cc2)cc1 ZINC000473909353 946636172 /nfs/dbraw/zinc/63/61/72/946636172.db2.gz BQLMCYZEHDDMDV-RBUKOAKNSA-N -1 3 361.449 3.656 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@H]2C(=O)Nc2ccc(Cc3nn[n-]n3)cc2)cc1 ZINC000473909353 946636177 /nfs/dbraw/zinc/63/61/77/946636177.db2.gz BQLMCYZEHDDMDV-RBUKOAKNSA-N -1 3 361.449 3.656 20 0 FHADHM CC(C)COC[C@@H](N[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccco1 ZINC000824266453 946638148 /nfs/dbraw/zinc/63/81/48/946638148.db2.gz LZXFMOQGEUNFCT-RHSMWYFYSA-N -1 3 355.442 3.524 20 0 FHADHM Brc1ccc(-c2nnn[n-]2)c(N2CCC=C(c3ccco3)C2)c1 ZINC001573279677 946645869 /nfs/dbraw/zinc/64/58/69/946645869.db2.gz LPCIZDBHFZLDLG-UHFFFAOYSA-N -1 3 372.226 3.516 20 0 FHADHM Brc1ccc(-c2nn[n-]n2)c(N2CCC=C(c3ccco3)C2)c1 ZINC001573279677 946645873 /nfs/dbraw/zinc/64/58/73/946645873.db2.gz LPCIZDBHFZLDLG-UHFFFAOYSA-N -1 3 372.226 3.516 20 0 FHADHM CC(C)c1cc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCCC3)no1 ZINC000824342179 946663901 /nfs/dbraw/zinc/66/39/01/946663901.db2.gz MGDZZRLUSYMDJD-UHFFFAOYSA-N -1 3 372.454 3.561 20 0 FHADHM CC(C)c1cc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCCC3)no1 ZINC000824342179 946663911 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FHADHM O=c1[n-]c(CN2CCC[C@H]([C@@H]3CCCCO3)C2)nc2c3ccccc3oc21 ZINC000661876383 946825754 /nfs/dbraw/zinc/82/57/54/946825754.db2.gz RGAVENVHIPRCEK-HOCLYGCPSA-N -1 3 367.449 3.863 20 0 FHADHM CCc1nc2c(s1)[C@H](N(C)C(=O)c1cc(NC(C)=O)ccc1[O-])CCC2 ZINC000123432479 946869133 /nfs/dbraw/zinc/86/91/33/946869133.db2.gz PPWSUFFZDVCKNW-OAHLLOKOSA-N -1 3 373.478 3.519 20 0 FHADHM CC(=O)c1cc(-c2nnn[n-]2)ccc1NC(=O)c1ccccc1C(C)(C)C ZINC001573552850 946880526 /nfs/dbraw/zinc/88/05/26/946880526.db2.gz BLLMOFKSQJHRJD-UHFFFAOYSA-N -1 3 363.421 3.619 20 0 FHADHM CC(=O)c1cc(-c2nn[n-]n2)ccc1NC(=O)c1ccccc1C(C)(C)C ZINC001573552850 946880541 /nfs/dbraw/zinc/88/05/41/946880541.db2.gz BLLMOFKSQJHRJD-UHFFFAOYSA-N -1 3 363.421 3.619 20 0 FHADHM C[C@H](Nc1ccc(Br)cc1-c1nnn[n-]1)c1cccs1 ZINC000824654874 946885921 /nfs/dbraw/zinc/88/59/21/946885921.db2.gz ABCVYCFYQJAZIV-QMMMGPOBSA-N -1 3 350.245 3.864 20 0 FHADHM C[C@H](Nc1ccc(Br)cc1-c1nn[n-]n1)c1cccs1 ZINC000824654874 946885925 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CC(C)c1cccc(NC(=O)N2CCN(C(=O)c3ccccc3[O-])CC2)c1 ZINC000124438496 947060049 /nfs/dbraw/zinc/06/00/49/947060049.db2.gz SBTHTJUDOAPLMQ-UHFFFAOYSA-N -1 3 367.449 3.506 20 0 FHADHM CCC(CC)n1nc(C(=O)O[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1C ZINC000825113665 947079339 /nfs/dbraw/zinc/07/93/39/947079339.db2.gz DQDYEQDXHXUPFV-CYBMUJFWSA-N -1 3 368.441 3.651 20 0 FHADHM CCC(CC)n1nc(C(=O)O[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1C ZINC000825113665 947079350 /nfs/dbraw/zinc/07/93/50/947079350.db2.gz DQDYEQDXHXUPFV-CYBMUJFWSA-N -1 3 368.441 3.651 20 0 FHADHM COc1ccc(F)c([N-]S(=O)(=O)c2cc(C)cc(Br)c2)c1 ZINC000188470699 947147896 /nfs/dbraw/zinc/14/78/96/947147896.db2.gz IVJMVYGSYSHKBO-UHFFFAOYSA-N -1 3 374.231 3.706 20 0 FHADHM C[C@H]1CCCCN(C(=O)c2c[n-]c3ccc(Br)cc3c2=O)C1 ZINC000444362412 947180382 /nfs/dbraw/zinc/18/03/82/947180382.db2.gz HCMXYZJPZRLAQK-NSHDSACASA-N -1 3 363.255 3.553 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@@H](C)Cc2ccsc2)cc1-c1nnn[n-]1 ZINC000825545768 947217666 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Cc1cn2cc([N-]S(=O)(=O)c3ccc(OCCC(C)C)cc3)ccc2n1 ZINC000523458730 947281229 /nfs/dbraw/zinc/28/12/29/947281229.db2.gz XMNUKUJJOHVHSW-UHFFFAOYSA-N -1 3 373.478 3.868 20 0 FHADHM CC(=C([O-])Nc1nc(-c2ccccc2)ns1)c1cn(C)c2ccccc12 ZINC000475614361 947297678 /nfs/dbraw/zinc/29/76/78/947297678.db2.gz FUZWAZKUCSSIET-ZDUSSCGKSA-N -1 3 362.458 3.861 20 0 FHADHM CCO[C@@H]1C[C@H](Nc2ccc(-c3nc(CC)cc(=O)[n-]3)cn2)C12CCC2 ZINC000301346404 947298419 /nfs/dbraw/zinc/29/84/19/947298419.db2.gz KMOHYDFGLQKGAF-JKSUJKDBSA-N -1 3 354.454 3.566 20 0 FHADHM CCn1c2ccc(-c3nnn[n-]3)cc2nc1-c1cc(C)c2ncccc2c1 ZINC000825782600 947327945 /nfs/dbraw/zinc/32/79/45/947327945.db2.gz IPMULOPENBEKKU-UHFFFAOYSA-N -1 3 355.405 3.760 20 0 FHADHM CCn1c2ccc(-c3nn[n-]n3)cc2nc1-c1cc(C)c2ncccc2c1 ZINC000825782600 947327957 /nfs/dbraw/zinc/32/79/57/947327957.db2.gz IPMULOPENBEKKU-UHFFFAOYSA-N -1 3 355.405 3.760 20 0 FHADHM COc1ccccc1S(=O)(=O)[N-]c1ccc(OC(C)C)cc1Cl ZINC000188599715 947497432 /nfs/dbraw/zinc/49/74/32/947497432.db2.gz YDIZIGJIUCESSE-UHFFFAOYSA-N -1 3 355.843 3.937 20 0 FHADHM O=C([O-])[C@@H]1CN(Cc2cccc(F)c2OC(F)F)C[C@H]1c1ccccc1 ZINC000662213354 947583307 /nfs/dbraw/zinc/58/33/07/947583307.db2.gz VENZMFPIJHXTQP-LSDHHAIUSA-N -1 3 365.351 3.727 20 0 FHADHM CCOc1c(Cl)cccc1CNC[C@@H](CCC(=O)[O-])C(F)(F)F ZINC000663261539 947584547 /nfs/dbraw/zinc/58/45/47/947584547.db2.gz KOQITKDPOPBRGH-LLVKDONJSA-N -1 3 353.768 3.872 20 0 FHADHM CCCN(CC(=O)Nc1ccccc1C)C(=O)c1ccc(CC)cc1[O-] ZINC000189075347 947594505 /nfs/dbraw/zinc/59/45/05/947594505.db2.gz OKOWLUMFMMYTMQ-UHFFFAOYSA-N -1 3 354.450 3.754 20 0 FHADHM CC[C@@]1(C)Oc2ccc(NC(=O)c3c[n-]c4ccccc4c3=O)cc2O1 ZINC000189297365 947674412 /nfs/dbraw/zinc/67/44/12/947674412.db2.gz WKQUIHPSBCLWNZ-FQEVSTJZSA-N -1 3 350.374 3.678 20 0 FHADHM Cc1ccccc1-c1cc(=NC(=O)[C@H]2C[C@H]2c2c(F)cccc2F)[nH][n-]1 ZINC000523871181 947682375 /nfs/dbraw/zinc/68/23/75/947682375.db2.gz YPCOWYVAJLLTLS-KGLIPLIRSA-N -1 3 353.372 3.827 20 0 FHADHM Cc1c(Cl)cnc(N2CCS[C@@H](c3ccccc3)C2)c1-c1nnn[n-]1 ZINC000826238400 947702492 /nfs/dbraw/zinc/70/24/92/947702492.db2.gz FQZJIUNVTVTWPZ-CQSZACIVSA-N -1 3 372.885 3.518 20 0 FHADHM Cc1c(Cl)cnc(N2CCS[C@@H](c3ccccc3)C2)c1-c1nn[n-]n1 ZINC000826238400 947702501 /nfs/dbraw/zinc/70/25/01/947702501.db2.gz FQZJIUNVTVTWPZ-CQSZACIVSA-N -1 3 372.885 3.518 20 0 FHADHM CC(=CC(=O)NC1(c2ccc(-c3nnn[n-]3)cc2)CCC1)c1ccccc1C ZINC001573362807 947708033 /nfs/dbraw/zinc/70/80/33/947708033.db2.gz LRILMSOTHBKZGR-JQIJEIRASA-N -1 3 373.460 3.774 20 0 FHADHM CC(=CC(=O)NC1(c2ccc(-c3nn[n-]n3)cc2)CCC1)c1ccccc1C ZINC001573362807 947708041 /nfs/dbraw/zinc/70/80/41/947708041.db2.gz LRILMSOTHBKZGR-JQIJEIRASA-N -1 3 373.460 3.774 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1cc(C2CCCCCC2)[nH]n1 ZINC000826249851 947727306 /nfs/dbraw/zinc/72/73/06/947727306.db2.gz YDNXREAACOQANR-UHFFFAOYSA-N -1 3 365.441 3.588 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1cc(C2CCCCCC2)[nH]n1 ZINC000826249851 947727315 /nfs/dbraw/zinc/72/73/15/947727315.db2.gz YDNXREAACOQANR-UHFFFAOYSA-N -1 3 365.441 3.588 20 0 FHADHM O=C(Cc1noc(-c2ccccc2[O-])n1)Nc1cc(Cl)ccc1Cl ZINC000445329949 947730414 /nfs/dbraw/zinc/73/04/14/947730414.db2.gz GNIMRDNHHWLEPO-UHFFFAOYSA-N -1 3 364.188 3.930 20 0 FHADHM COCc1ccccc1NC(=O)Nc1ccc(-c2cc(=O)[n-]c(C)n2)cc1 ZINC000520468689 947769278 /nfs/dbraw/zinc/76/92/78/947769278.db2.gz IDXWSLQQHVOLFY-UHFFFAOYSA-N -1 3 364.405 3.948 20 0 FHADHM CCSc1ccc([C@@H](C)N/C=C2\C(=O)[N-]C(=O)c3ccccc32)cc1 ZINC000728853996 947778201 /nfs/dbraw/zinc/77/82/01/947778201.db2.gz FFJZQGIBWOKDBD-FDIDITGRSA-N -1 3 352.459 3.760 20 0 FHADHM Cc1ccc(C(=O)N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c(Cl)c1C ZINC000826281800 947810058 /nfs/dbraw/zinc/81/00/58/947810058.db2.gz KKFXCRPZQYVUEW-LBPRGKRZSA-N -1 3 355.829 3.628 20 0 FHADHM Cc1ccc(C(=O)N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c(Cl)c1C ZINC000826281800 947810065 /nfs/dbraw/zinc/81/00/65/947810065.db2.gz KKFXCRPZQYVUEW-LBPRGKRZSA-N -1 3 355.829 3.628 20 0 FHADHM O=S(=O)([N-]c1ccsc1Cl)c1cccc(Br)c1 ZINC000189738384 947830199 /nfs/dbraw/zinc/83/01/99/947830199.db2.gz GKWKURDZHQTSMJ-UHFFFAOYSA-N -1 3 352.662 3.965 20 0 FHADHM O=S(=O)([N-]c1ccsc1Cl)c1ccccc1Br ZINC000189744387 947830798 /nfs/dbraw/zinc/83/07/98/947830798.db2.gz LXNIEOPNGNLAAK-UHFFFAOYSA-N -1 3 352.662 3.965 20 0 FHADHM Cc1ccc(CN[C@H](c2cccc(-c3nnn[n-]3)c2)C(F)(F)F)c(C)c1 ZINC000826288569 947839615 /nfs/dbraw/zinc/83/96/15/947839615.db2.gz NHERCTNLSQUJSH-MRXNPFEDSA-N -1 3 361.371 3.877 20 0 FHADHM Cc1ccc(CN[C@H](c2cccc(-c3nn[n-]n3)c2)C(F)(F)F)c(C)c1 ZINC000826288569 947839618 /nfs/dbraw/zinc/83/96/18/947839618.db2.gz NHERCTNLSQUJSH-MRXNPFEDSA-N -1 3 361.371 3.877 20 0 FHADHM COCc1nc(C)c(C(=O)[N-]c2nnc(CC3CCCCC3)s2)s1 ZINC000129721039 947852301 /nfs/dbraw/zinc/85/23/01/947852301.db2.gz JNAGEDIMUQEGKB-UHFFFAOYSA-N -1 3 366.512 3.825 20 0 FHADHM Cc1ccnc(N[C@H](C)c2ccc(-c3cccnc3)cc2)c1-c1nnn[n-]1 ZINC000826311297 947898996 /nfs/dbraw/zinc/89/89/96/947898996.db2.gz AEDASSTWAANWNM-CQSZACIVSA-N -1 3 357.421 3.805 20 0 FHADHM Cc1ccnc(N[C@H](C)c2ccc(-c3cccnc3)cc2)c1-c1nn[n-]n1 ZINC000826311297 947899004 /nfs/dbraw/zinc/89/90/04/947899004.db2.gz AEDASSTWAANWNM-CQSZACIVSA-N -1 3 357.421 3.805 20 0 FHADHM Cc1ccnc(N[C@@H](C)c2nc(-c3ccccc3)cs2)c1-c1nnn[n-]1 ZINC000826311559 947902114 /nfs/dbraw/zinc/90/21/14/947902114.db2.gz HWLRTUFRSUKJDY-LBPRGKRZSA-N -1 3 363.450 3.867 20 0 FHADHM Cc1ccnc(N[C@@H](C)c2nc(-c3ccccc3)cs2)c1-c1nn[n-]n1 ZINC000826311559 947902120 /nfs/dbraw/zinc/90/21/20/947902120.db2.gz HWLRTUFRSUKJDY-LBPRGKRZSA-N -1 3 363.450 3.867 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)N(C)CCC(F)(F)F)cc2)cc(=O)[n-]1 ZINC000520489952 948066476 /nfs/dbraw/zinc/06/64/76/948066476.db2.gz MKRNKSRDPRTUNF-UHFFFAOYSA-N -1 3 354.332 3.574 20 0 FHADHM Cc1nc(C(C)(C)[N-]S(=O)(=O)c2c(F)cccc2Cl)sc1C ZINC000132728542 948071868 /nfs/dbraw/zinc/07/18/68/948071868.db2.gz BXOPLGDXAIANKZ-UHFFFAOYSA-N -1 3 362.879 3.766 20 0 FHADHM c1coc(CN=c2[n-]nc(S[C@H]3CCN(Cc4ccccc4)C3)s2)c1 ZINC000549619153 948095342 /nfs/dbraw/zinc/09/53/42/948095342.db2.gz WYYXBLSWTDMJBJ-INIZCTEOSA-N -1 3 372.519 3.532 20 0 FHADHM Clc1cc(-c2nnn[n-]2)ccc1Oc1ccnc(Cc2ccccc2)n1 ZINC000826351137 948098644 /nfs/dbraw/zinc/09/86/44/948098644.db2.gz YMWYVCYZXBYTSO-UHFFFAOYSA-N -1 3 364.796 3.693 20 0 FHADHM Clc1cc(-c2nn[n-]n2)ccc1Oc1ccnc(Cc2ccccc2)n1 ZINC000826351137 948098651 /nfs/dbraw/zinc/09/86/51/948098651.db2.gz YMWYVCYZXBYTSO-UHFFFAOYSA-N -1 3 364.796 3.693 20 0 FHADHM Clc1cccc(SCc2nnc(C3CC3)n2C2CC2)c1-c1nnn[n-]1 ZINC000826353257 948104818 /nfs/dbraw/zinc/10/48/18/948104818.db2.gz ICQMGGPZHBKWML-UHFFFAOYSA-N -1 3 373.873 3.616 20 0 FHADHM Clc1cccc(SCc2nnc(C3CC3)n2C2CC2)c1-c1nn[n-]n1 ZINC000826353257 948104822 /nfs/dbraw/zinc/10/48/22/948104822.db2.gz ICQMGGPZHBKWML-UHFFFAOYSA-N -1 3 373.873 3.616 20 0 FHADHM Fc1cc2nc(C(Cl)=Cc3ccccc3-c3nnn[n-]3)[nH]c2cc1F ZINC000826372644 948156580 /nfs/dbraw/zinc/15/65/80/948156580.db2.gz GMGRHJZEGXYXDH-BJMVGYQFSA-N -1 3 358.739 3.758 20 0 FHADHM Fc1cc2nc(C(Cl)=Cc3ccccc3-c3nn[n-]n3)[nH]c2cc1F ZINC000826372644 948156589 /nfs/dbraw/zinc/15/65/89/948156589.db2.gz GMGRHJZEGXYXDH-BJMVGYQFSA-N -1 3 358.739 3.758 20 0 FHADHM Fc1ccc(Oc2ccc(NCc3ccc(-c4nnn[n-]4)cc3)cn2)cc1 ZINC000826376089 948164748 /nfs/dbraw/zinc/16/47/48/948164748.db2.gz OHDFAPMVIDEHPZ-UHFFFAOYSA-N -1 3 362.368 3.805 20 0 FHADHM Fc1ccc(Oc2ccc(NCc3ccc(-c4nn[n-]n4)cc3)cn2)cc1 ZINC000826376089 948164755 /nfs/dbraw/zinc/16/47/55/948164755.db2.gz OHDFAPMVIDEHPZ-UHFFFAOYSA-N -1 3 362.368 3.805 20 0 FHADHM O=C(CC1CCC(C(F)(F)F)CC1)OCc1ccc(-c2nnn[n-]2)cc1 ZINC000826404085 948230915 /nfs/dbraw/zinc/23/09/15/948230915.db2.gz NTIHLOUYZWGBOS-UHFFFAOYSA-N -1 3 368.359 3.669 20 0 FHADHM O=C(CC1CCC(C(F)(F)F)CC1)OCc1ccc(-c2nn[n-]n2)cc1 ZINC000826404085 948230922 /nfs/dbraw/zinc/23/09/22/948230922.db2.gz NTIHLOUYZWGBOS-UHFFFAOYSA-N -1 3 368.359 3.669 20 0 FHADHM O=C(CSc1cccc(Cl)c1-c1nnn[n-]1)c1cc(F)ccc1F ZINC000826421011 948264618 /nfs/dbraw/zinc/26/46/18/948264618.db2.gz NMMWIWHZHMQYSZ-UHFFFAOYSA-N -1 3 366.780 3.773 20 0 FHADHM O=C(CSc1cccc(Cl)c1-c1nn[n-]n1)c1cc(F)ccc1F ZINC000826421011 948264626 /nfs/dbraw/zinc/26/46/26/948264626.db2.gz NMMWIWHZHMQYSZ-UHFFFAOYSA-N -1 3 366.780 3.773 20 0 FHADHM O=C(CSc1cccc(Cl)c1-c1nnn[n-]1)c1c[nH]c2ccccc21 ZINC000826420989 948264778 /nfs/dbraw/zinc/26/47/78/948264778.db2.gz MJTJIJUTUZPEHP-UHFFFAOYSA-N -1 3 369.837 3.976 20 0 FHADHM O=C(CSc1cccc(Cl)c1-c1nn[n-]n1)c1c[nH]c2ccccc21 ZINC000826420989 948264791 /nfs/dbraw/zinc/26/47/91/948264791.db2.gz MJTJIJUTUZPEHP-UHFFFAOYSA-N -1 3 369.837 3.976 20 0 FHADHM O=C(CSc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)c1ccccc1 ZINC000826420263 948265001 /nfs/dbraw/zinc/26/50/01/948265001.db2.gz FUJGDLRENOALOF-UHFFFAOYSA-N -1 3 364.352 3.861 20 0 FHADHM O=C(CSc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)c1ccccc1 ZINC000826420263 948265008 /nfs/dbraw/zinc/26/50/08/948265008.db2.gz FUJGDLRENOALOF-UHFFFAOYSA-N -1 3 364.352 3.861 20 0 FHADHM CCCOc1cc(CN[C@H]2C[C@@H](C(=O)[O-])c3ccccc32)ccc1OC ZINC000417628381 948361433 /nfs/dbraw/zinc/36/14/33/948361433.db2.gz WDBLTJQSLMYKSZ-MSOLQXFVSA-N -1 3 355.434 3.887 20 0 FHADHM Cc1cc(CNC[C@H](Oc2ccccc2)C(=O)[O-])c(OC(F)F)cc1C ZINC000417642043 948391252 /nfs/dbraw/zinc/39/12/52/948391252.db2.gz SXIDNWVYESFNOD-KRWDZBQOSA-N -1 3 365.376 3.527 20 0 FHADHM O=C([O-])[C@@H](CNCc1ccccc1OC1CCCC1)Oc1ccccc1 ZINC000417642724 948391735 /nfs/dbraw/zinc/39/17/35/948391735.db2.gz WVHZPOTYTNTSJM-HXUWFJFHSA-N -1 3 355.434 3.630 20 0 FHADHM O=C(Nc1ccc2c(c1)oc1ccccc12)c1ccc2c(c1)C(=O)[N-]C2=O ZINC000729521040 948509106 /nfs/dbraw/zinc/50/91/06/948509106.db2.gz RIHNBBVWXBLSRV-UHFFFAOYSA-N -1 3 356.337 3.722 20 0 FHADHM CCOC(=O)c1nc([C@H](CC(C)C)NCc2ccccc2Cl)n[n-]1 ZINC000895104826 948589233 /nfs/dbraw/zinc/58/92/33/948589233.db2.gz NLVBGTXSDXHONX-AWEZNQCLSA-N -1 3 350.850 3.512 20 0 FHADHM CCOC(=O)c1nnc([C@H](CC(C)C)NCc2ccccc2Cl)[n-]1 ZINC000895104826 948589240 /nfs/dbraw/zinc/58/92/40/948589240.db2.gz NLVBGTXSDXHONX-AWEZNQCLSA-N -1 3 350.850 3.512 20 0 FHADHM CCOC(=O)c1n[n-]c([C@H](CC(C)C)NCc2ccccc2Cl)n1 ZINC000895104826 948589248 /nfs/dbraw/zinc/58/92/48/948589248.db2.gz NLVBGTXSDXHONX-AWEZNQCLSA-N -1 3 350.850 3.512 20 0 FHADHM CCOC(=O)c1nc([C@@H](CC(C)C)NCc2ccccc2Cl)n[n-]1 ZINC000895104828 948589559 /nfs/dbraw/zinc/58/95/59/948589559.db2.gz NLVBGTXSDXHONX-CQSZACIVSA-N -1 3 350.850 3.512 20 0 FHADHM CCOC(=O)c1nnc([C@@H](CC(C)C)NCc2ccccc2Cl)[n-]1 ZINC000895104828 948589574 /nfs/dbraw/zinc/58/95/74/948589574.db2.gz NLVBGTXSDXHONX-CQSZACIVSA-N -1 3 350.850 3.512 20 0 FHADHM CCOC(=O)c1n[n-]c([C@@H](CC(C)C)NCc2ccccc2Cl)n1 ZINC000895104828 948589578 /nfs/dbraw/zinc/58/95/78/948589578.db2.gz NLVBGTXSDXHONX-CQSZACIVSA-N -1 3 350.850 3.512 20 0 FHADHM CCOC(=O)c1nnc([C@@H](CC(C)C)NCc2ccc(SC)s2)[n-]1 ZINC000895105714 948605115 /nfs/dbraw/zinc/60/51/15/948605115.db2.gz OJGHWKXVERVPNH-GFCCVEGCSA-N -1 3 368.528 3.642 20 0 FHADHM Cc1ccc(C[C@H]2CCCN(C(=O)c3cc(=O)c4ccccc4[n-]3)C2)cc1 ZINC000050768818 948700552 /nfs/dbraw/zinc/70/05/52/948700552.db2.gz VNTBXUHYONLUIR-GOSISDBHSA-N -1 3 360.457 3.931 20 0 FHADHM C[C@@H](C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C)c1ccc(Cl)cc1 ZINC001573755101 948753141 /nfs/dbraw/zinc/75/31/41/948753141.db2.gz AMYKRNNFWDFFRA-LLVKDONJSA-N -1 3 372.860 3.819 20 0 FHADHM C[C@@H](C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C)c1ccc(Cl)cc1 ZINC001573755101 948753148 /nfs/dbraw/zinc/75/31/48/948753148.db2.gz AMYKRNNFWDFFRA-LLVKDONJSA-N -1 3 372.860 3.819 20 0 FHADHM CCC(CC)c1nnc([N-]C(=O)c2nnn(-c3cccc(C)c3)c2C)s1 ZINC000054572366 948765044 /nfs/dbraw/zinc/76/50/44/948765044.db2.gz NJROMBHDHWEGFK-UHFFFAOYSA-N -1 3 370.482 3.892 20 0 FHADHM O=C(Cc1noc(-c2ccccc2[O-])n1)Nc1ccccc1C(F)(F)F ZINC000445423977 948784303 /nfs/dbraw/zinc/78/43/03/948784303.db2.gz ORGFVGRRVFSSRV-UHFFFAOYSA-N -1 3 363.295 3.642 20 0 FHADHM O=S(=O)([N-]C1CCCCC1)c1ccc(Br)cc1Cl ZINC000016089083 220177039 /nfs/dbraw/zinc/17/70/39/220177039.db2.gz VLAOQCHCZCOTEY-UHFFFAOYSA-N -1 3 352.681 3.714 20 0 FHADHM Cc1ccc(NC(=O)c2ccoc2)cc1S(=O)(=O)[N-]c1ccccc1F ZINC000022744150 220396076 /nfs/dbraw/zinc/39/60/76/220396076.db2.gz YFDPPEZSWRWCFZ-UHFFFAOYSA-N -1 3 374.393 3.780 20 0 FHADHM Cc1cc(S(=O)(=O)[N-]c2cccc(F)c2F)ccc1Br ZINC000040231534 220896621 /nfs/dbraw/zinc/89/66/21/220896621.db2.gz ZKQBPBRDKZUFHD-UHFFFAOYSA-N -1 3 362.195 3.837 20 0 FHADHM CCc1csc(-n2cc(C(=O)N=c3cc(-c4ccccc4)[n-][nH]3)cn2)n1 ZINC000477105737 515330762 /nfs/dbraw/zinc/33/07/62/515330762.db2.gz GSWPSKYRRYTDQU-UHFFFAOYSA-N -1 3 364.434 3.534 20 0 FHADHM Cn1[n-]c(=NC(=O)c2csc(-c3ccccc3F)n2)cc1OC(F)F ZINC000490977632 515348958 /nfs/dbraw/zinc/34/89/58/515348958.db2.gz UNQFYEMLAAOJAG-UHFFFAOYSA-N -1 3 368.340 3.536 20 0 FHADHM Cc1cc(C(=O)Nc2ccn(-c3ncccc3C(F)(F)F)n2)ccc1[O-] ZINC000500290693 515657298 /nfs/dbraw/zinc/65/72/98/515657298.db2.gz ULSTXXIBZMMSNI-UHFFFAOYSA-N -1 3 362.311 3.552 20 0 FHADHM O=C(N=c1cc([C@@H]2CCCO2)[n-][nH]1)c1cc(F)c(F)cc1Br ZINC000473846052 515772064 /nfs/dbraw/zinc/77/20/64/515772064.db2.gz HWLIJABIRZDILJ-LBPRGKRZSA-N -1 3 372.169 3.554 20 0 FHADHM Cn1[n-]c(=NC(=O)C[C@@H](c2cccs2)n2cccc2)cc1OC(F)F ZINC000506130357 515791433 /nfs/dbraw/zinc/79/14/33/515791433.db2.gz HUQRIAZISGGYKD-NSHDSACASA-N -1 3 366.393 3.503 20 0 FHADHM CCN=c1[n-]c(C(=O)N2CC[C@](F)(c3cc(F)cc(F)c3)C2)cs1 ZINC000511845834 516052686 /nfs/dbraw/zinc/05/26/86/516052686.db2.gz BSYCMNVYVAZSBE-MRXNPFEDSA-N -1 3 355.385 3.564 20 0 FHADHM COC(=O)[C@H](C)CC(=O)N=c1cc(-c2cc(Cl)cc(Cl)c2)[n-][nH]1 ZINC000474924394 516237520 /nfs/dbraw/zinc/23/75/20/516237520.db2.gz LECAYNNLKRDYRG-MRVPVSSYSA-N -1 3 356.209 3.521 20 0 FHADHM Cc1ccccc1-c1cc(=NC(=O)Cc2cc(F)cc3c2OCOC3)[nH][n-]1 ZINC000512327262 516240887 /nfs/dbraw/zinc/24/08/87/516240887.db2.gz XWBNNPGASFWSQI-UHFFFAOYSA-N -1 3 367.380 3.572 20 0 FHADHM Cc1cc(C)cc(-c2cc(=NC(=O)c3cccc(-n4cncn4)c3)[nH][n-]2)c1 ZINC000523756523 516570063 /nfs/dbraw/zinc/57/00/63/516570063.db2.gz WMLITGZJQOXNTF-UHFFFAOYSA-N -1 3 358.405 3.527 20 0 FHADHM O=C(N=c1cc2ccccn2[n-]1)NCc1cc(F)cc(Br)c1 ZINC000514961132 517144623 /nfs/dbraw/zinc/14/46/23/517144623.db2.gz VHYDNXLOLQMWBX-UHFFFAOYSA-N -1 3 363.190 3.558 20 0 FHADHM Cc1cccc(CC(=O)N=c2cc([C@@H]3CCCO3)[n-][nH]2)c1Br ZINC000529517656 517192677 /nfs/dbraw/zinc/19/26/77/517192677.db2.gz JUWMWPOFKMBUJS-ZDUSSCGKSA-N -1 3 364.243 3.513 20 0 FHADHM Cn1cc(C(=O)N=c2cc([C@H]3CCCO3)[n-][nH]2)c(-c2ccccc2Cl)n1 ZINC000526960260 517410370 /nfs/dbraw/zinc/41/03/70/517410370.db2.gz RNTXNANMBMQKMP-OAHLLOKOSA-N -1 3 371.828 3.567 20 0 FHADHM Cc1c(C(=O)N=c2cc(-c3cccnc3)[n-][nH]2)cnn1-c1cccc(C)c1 ZINC000533676126 517568487 /nfs/dbraw/zinc/56/84/87/517568487.db2.gz GWQZMDNYVQHYML-UHFFFAOYSA-N -1 3 358.405 3.527 20 0 FHADHM CCN=c1[n-]c(C(=O)N2CCC[C@@H]2Cn2c(C)nc3ccccc32)cs1 ZINC000533802627 517618580 /nfs/dbraw/zinc/61/85/80/517618580.db2.gz PLBQDMVJROPVSL-CQSZACIVSA-N -1 3 369.494 3.538 20 0 FHADHM Cc1[n-][nH]c(=NC(=O)C2CCN(C(=O)C(C)C)CC2)c1-c1ccc(C)cc1 ZINC000530271946 517670607 /nfs/dbraw/zinc/67/06/07/517670607.db2.gz MGWTVPZQABDPFI-UHFFFAOYSA-N -1 3 368.481 3.527 20 0 FHADHM CCCCc1n[n-]c(=NCc2ccccc2N2CCN(CCC)CC2)o1 ZINC000538593774 517683675 /nfs/dbraw/zinc/68/36/75/517683675.db2.gz IWNZXATUIJJNAO-UHFFFAOYSA-N -1 3 357.502 3.556 20 0 FHADHM CCN1CCCC[C@@H]1C(=O)N=c1cc(-c2cc(Cl)ccc2OC)[n-][nH]1 ZINC000522671195 518144075 /nfs/dbraw/zinc/14/40/75/518144075.db2.gz ZUCHOQFIKRBZOU-OAHLLOKOSA-N -1 3 362.861 3.552 20 0 FHADHM Cc1nn(C)c(C)c1CC(=O)N=c1cc(-c2cc(C)c(C)cc2C)[n-][nH]1 ZINC000617357554 520453556 /nfs/dbraw/zinc/45/35/56/520453556.db2.gz ZJEJOBNTXWFTHE-UHFFFAOYSA-N -1 3 351.454 3.534 20 0 FHADHM COc1cccc(-c2c(C)[n-][nH]c2=NC(=O)c2cnc3n2CCCCC3)c1 ZINC000629692866 522397645 /nfs/dbraw/zinc/39/76/45/522397645.db2.gz XMBZEGQUURVAJC-UHFFFAOYSA-N -1 3 365.437 3.569 20 0 FHADHM Cc1cccc([O-])c1C(=O)N1C[C@H](O)C[C@H]1c1cccc(C(F)(F)F)c1 ZINC000626251245 567975797 /nfs/dbraw/zinc/97/57/97/567975797.db2.gz VXGHIYFJRSFHPZ-CABCVRRESA-N -1 3 365.351 3.668 20 0 FHADHM COC(=O)c1cc(Cl)c(Cl)c([N-]C(=O)c2coc(C3CC3)n2)c1 ZINC000602422048 567978809 /nfs/dbraw/zinc/97/88/09/567978809.db2.gz PJWLWZHARUXKJX-UHFFFAOYSA-N -1 3 355.177 3.898 20 0 FHADHM CSc1cc(C(=O)Nc2cccc(-c3nc(C)cc(=O)[n-]3)c2)ccc1F ZINC000162250370 567996041 /nfs/dbraw/zinc/99/60/41/567996041.db2.gz LTNBGOWMQHHSPQ-UHFFFAOYSA-N -1 3 369.421 3.859 20 0 FHADHM CCC[C@H](C)N(C)C(=O)c1cc(=O)c2cc(Br)ccc2[n-]1 ZINC000602753392 568030562 /nfs/dbraw/zinc/03/05/62/568030562.db2.gz MBBCSROWYDMPDH-JTQLQIEISA-N -1 3 351.244 3.551 20 0 FHADHM CCc1ccc([O-])c(C(=O)N2CCC(C(=O)c3cc(F)ccc3F)CC2)c1 ZINC000522757089 568045032 /nfs/dbraw/zinc/04/50/32/568045032.db2.gz NJMMVZRBGBLISA-UHFFFAOYSA-N -1 3 373.399 3.968 20 0 FHADHM C[C@@H]1CO[C@H](c2cccc(C(F)(F)F)c2)CN1Cc1ncccc1[O-] ZINC000644836050 568060728 /nfs/dbraw/zinc/06/07/28/568060728.db2.gz BMTATDLBVKHOJQ-PXAZEXFGSA-N -1 3 352.356 3.768 20 0 FHADHM O=S(=O)([N-]C[C@H]1OCCc2ccccc21)c1cc(Cl)ccc1Cl ZINC000603506585 568109781 /nfs/dbraw/zinc/10/97/81/568109781.db2.gz UXVFMKYVQLKGHH-OAHLLOKOSA-N -1 3 372.273 3.586 20 0 FHADHM Cc1cc(OC(F)F)c(C(=O)[N-]c2ncn(Cc3ccccc3)n2)s1 ZINC000603829564 568145761 /nfs/dbraw/zinc/14/57/61/568145761.db2.gz MQZVGMMPECPRFU-UHFFFAOYSA-N -1 3 364.377 3.550 20 0 FHADHM CCOC(=O)C1CCC(Cc2nc(-c3ccc([O-])c(OCC)c3)no2)CC1 ZINC000563121898 568222844 /nfs/dbraw/zinc/22/28/44/568222844.db2.gz AJDAPPMVWFSRHH-UHFFFAOYSA-N -1 3 374.437 3.753 20 0 FHADHM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2ccc3c(c2)NC(=O)[C@H](C)O3)cc1 ZINC000007729298 568252131 /nfs/dbraw/zinc/25/21/31/568252131.db2.gz COKFAGCCEROVSZ-OLZOCXBDSA-N -1 3 374.462 3.720 20 0 FHADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(-n3cccn3)c(Cl)c2)cc1C ZINC000303231480 568261599 /nfs/dbraw/zinc/26/15/99/568261599.db2.gz YHEQAISHQZXOBZ-UHFFFAOYSA-N -1 3 361.854 3.943 20 0 FHADHM O=C(C[C@@H]1OCCc2ccccc21)N=c1cc(-c2cccc(Cl)c2)[n-][nH]1 ZINC000604601602 568323554 /nfs/dbraw/zinc/32/35/54/568323554.db2.gz WUSVYCWSTZOGIZ-SFHVURJKSA-N -1 3 367.836 3.795 20 0 FHADHM O=S(=O)([N-][C@@H]1C[C@@H]1c1c(F)cccc1F)c1ccc(F)cc1Cl ZINC000604772922 568363584 /nfs/dbraw/zinc/36/35/84/568363584.db2.gz WMMQDAOYAHHDBD-TVQRCGJNSA-N -1 3 361.772 3.592 20 0 FHADHM Cc1cccc(-n2ncc(NC([O-])=NOCc3cccnc3)c2C(C)C)c1 ZINC000365248600 568364274 /nfs/dbraw/zinc/36/42/74/568364274.db2.gz VSKNYXVUPCTCNS-UHFFFAOYSA-N -1 3 365.437 3.952 20 0 FHADHM Cc1cccc(-n2ncc(NC(=O)[N-]OCc3cccnc3)c2C(C)C)c1 ZINC000365248600 568364275 /nfs/dbraw/zinc/36/42/75/568364275.db2.gz VSKNYXVUPCTCNS-UHFFFAOYSA-N -1 3 365.437 3.952 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)C[C@H](C)n3cccc3)c2)n1 ZINC000604862203 568379481 /nfs/dbraw/zinc/37/94/81/568379481.db2.gz HSSNEJWSQOKHET-AWEZNQCLSA-N -1 3 350.422 3.803 20 0 FHADHM Cc1c(CC(=O)Nc2cc(Cl)cc(C)c2[O-])nnn1-c1ccc(C)cc1 ZINC000604901804 568385015 /nfs/dbraw/zinc/38/50/15/568385015.db2.gz PPENNEAPQVSZCW-UHFFFAOYSA-N -1 3 370.840 3.733 20 0 FHADHM CCCOc1cccnc1C(=O)Nc1cccc(-c2nc(C)cc(=O)[n-]2)c1 ZINC000365266916 568385969 /nfs/dbraw/zinc/38/59/69/568385969.db2.gz OZIHCERMKWOJQP-UHFFFAOYSA-N -1 3 364.405 3.594 20 0 FHADHM c1sc(Nc2ccccc2)nc1CSc1n[n-]c(-c2ccccn2)n1 ZINC000604932294 568395067 /nfs/dbraw/zinc/39/50/67/568395067.db2.gz CRZPMNQQPONKNT-UHFFFAOYSA-N -1 3 366.475 3.781 20 0 FHADHM Clc1cc(CSc2n[n-]c(-c3ccccn3)n2)cc2c1OCCO2 ZINC000604933166 568395464 /nfs/dbraw/zinc/39/54/64/568395464.db2.gz GXEKMMKSLOVNAC-UHFFFAOYSA-N -1 3 360.826 3.584 20 0 FHADHM CN(C(=O)c1csc(=O)[n-]1)[C@H](c1ccc(Cl)cc1)c1cccnc1 ZINC000365311065 568479745 /nfs/dbraw/zinc/47/97/45/568479745.db2.gz WCOQHJQZMHFCIT-OAHLLOKOSA-N -1 3 359.838 3.759 20 0 FHADHM CC(C)c1cccc(O[C@H](C)C(=O)[N-]c2nncn2Cc2ccccc2)c1 ZINC000605117812 568573259 /nfs/dbraw/zinc/57/32/59/568573259.db2.gz KXBYWMOWUIGTPF-MRXNPFEDSA-N -1 3 364.449 3.856 20 0 FHADHM COc1cccc(C(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)c1[O-] ZINC000365388617 568592028 /nfs/dbraw/zinc/59/20/28/568592028.db2.gz GCNCDUBZYDEZMT-AWEZNQCLSA-N -1 3 359.426 3.665 20 0 FHADHM Cc1ccc([N-]S(C)(=O)=O)c(NC(=O)C2[C@@H]3CCCCCC[C@@H]23)c1 ZINC000669204998 568649235 /nfs/dbraw/zinc/64/92/35/568649235.db2.gz MUESQZDWAVASKC-ZIAGYGMSSA-N -1 3 350.484 3.521 20 0 FHADHM Cc1nnc(-c2cccc(-c3nnn[n-]3)c2)n1Cc1ccc2ccccc2c1 ZINC000737525484 598826636 /nfs/dbraw/zinc/82/66/36/598826636.db2.gz RCDRKTHIQFLSEC-UHFFFAOYSA-N -1 3 367.416 3.635 20 0 FHADHM Cc1nnc(-c2cccc(-c3nn[n-]n3)c2)n1Cc1ccc2ccccc2c1 ZINC000737525484 598826638 /nfs/dbraw/zinc/82/66/38/598826638.db2.gz RCDRKTHIQFLSEC-UHFFFAOYSA-N -1 3 367.416 3.635 20 0 FHADHM Cc1csc(-c2cccc(C(=O)Nc3ccc(-c4nnn[n-]4)cc3)c2)n1 ZINC000151254437 598827105 /nfs/dbraw/zinc/82/71/05/598827105.db2.gz JSODLWKUQUXRFM-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1csc(-c2cccc(C(=O)Nc3ccc(-c4nn[n-]n4)cc3)c2)n1 ZINC000151254437 598827107 /nfs/dbraw/zinc/82/71/07/598827107.db2.gz JSODLWKUQUXRFM-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1cccc(NC(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(C)C)c1C ZINC000737400588 598851297 /nfs/dbraw/zinc/85/12/97/598851297.db2.gz WNEWFHBWRZZHJT-UHFFFAOYSA-N -1 3 366.425 3.915 20 0 FHADHM Cc1cccc(NC(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(C)C)c1C ZINC000737400588 598851299 /nfs/dbraw/zinc/85/12/99/598851299.db2.gz WNEWFHBWRZZHJT-UHFFFAOYSA-N -1 3 366.425 3.915 20 0 FHADHM Cc1cccc(NC(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(F)F)c1C ZINC000737399242 598852577 /nfs/dbraw/zinc/85/25/77/598852577.db2.gz JAKRXWYHYAAYIN-UHFFFAOYSA-N -1 3 374.351 3.729 20 0 FHADHM Cc1cccc(NC(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(F)F)c1C ZINC000737399242 598852578 /nfs/dbraw/zinc/85/25/78/598852578.db2.gz JAKRXWYHYAAYIN-UHFFFAOYSA-N -1 3 374.351 3.729 20 0 FHADHM CCc1cccc(NC(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(F)F)c1 ZINC000736697494 598852787 /nfs/dbraw/zinc/85/27/87/598852787.db2.gz GTLLKQPTGSZXEY-UHFFFAOYSA-N -1 3 374.351 3.675 20 0 FHADHM CCc1cccc(NC(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(F)F)c1 ZINC000736697494 598852789 /nfs/dbraw/zinc/85/27/89/598852789.db2.gz GTLLKQPTGSZXEY-UHFFFAOYSA-N -1 3 374.351 3.675 20 0 FHADHM C[C@H](Oc1ccc(-c2nn[n-]n2)cc1)c1nc(-c2ccccc2Cl)no1 ZINC000736170042 598859196 /nfs/dbraw/zinc/85/91/96/598859196.db2.gz QYEFOGPKULWFTR-JTQLQIEISA-N -1 3 368.784 3.710 20 0 FHADHM CCSc1nc(-c2ccc(C)o2)cc(C(F)(F)F)c1-c1nnn[n-]1 ZINC000736667262 598860960 /nfs/dbraw/zinc/86/09/60/598860960.db2.gz MTKPUPPUTCGRTH-UHFFFAOYSA-N -1 3 355.345 3.961 20 0 FHADHM CC(C)c1cc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCCC3)on1 ZINC000735922168 598862240 /nfs/dbraw/zinc/86/22/40/598862240.db2.gz HHOLVTWPTUILSM-UHFFFAOYSA-N -1 3 372.454 3.561 20 0 FHADHM CCCCc1ccc(N[C@H](C(=O)OC)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000736467062 598879473 /nfs/dbraw/zinc/87/94/73/598879473.db2.gz SIHRIQICFPTVCD-SFHVURJKSA-N -1 3 365.437 3.536 20 0 FHADHM CCCCc1ccc(N[C@H](C(=O)OC)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000736467062 598879474 /nfs/dbraw/zinc/87/94/74/598879474.db2.gz SIHRIQICFPTVCD-SFHVURJKSA-N -1 3 365.437 3.536 20 0 FHADHM CCC[C@@H](C)NC(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000736426155 598888905 /nfs/dbraw/zinc/88/89/05/598888905.db2.gz XVDZOFLOACFFRE-GFCCVEGCSA-N -1 3 370.482 3.583 20 0 FHADHM CC[C@H](CC1CCCCC1)C(=O)Nc1cc(-c2nnn[n-]2)ccc1OC ZINC000736351080 598904670 /nfs/dbraw/zinc/90/46/70/598904670.db2.gz QETAMAYOABDWCD-CQSZACIVSA-N -1 3 357.458 3.810 20 0 FHADHM CC[C@H](CC1CCCCC1)C(=O)Nc1cc(-c2nn[n-]n2)ccc1OC ZINC000736351080 598904672 /nfs/dbraw/zinc/90/46/72/598904672.db2.gz QETAMAYOABDWCD-CQSZACIVSA-N -1 3 357.458 3.810 20 0 FHADHM CC[C@@H](NC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1ccc(Cl)s1 ZINC000736353948 598907499 /nfs/dbraw/zinc/90/74/99/598907499.db2.gz CXGZTFFPWDYELD-PGJNLMOESA-N -1 3 373.869 3.862 20 0 FHADHM CC[C@@H](NC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1ccc(Cl)s1 ZINC000736353948 598907501 /nfs/dbraw/zinc/90/75/01/598907501.db2.gz CXGZTFFPWDYELD-PGJNLMOESA-N -1 3 373.869 3.862 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CCC[C@@]2(CC=CCC2)C1 ZINC000737290087 598923585 /nfs/dbraw/zinc/92/35/85/598923585.db2.gz BICVOIZOBZGDKV-IBGZPJMESA-N -1 3 352.442 3.529 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CCC[C@@]2(CC=CCC2)C1 ZINC000737290087 598923586 /nfs/dbraw/zinc/92/35/86/598923586.db2.gz BICVOIZOBZGDKV-IBGZPJMESA-N -1 3 352.442 3.529 20 0 FHADHM CC1CCC(=CC(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCC3)CC1 ZINC000736237559 598925888 /nfs/dbraw/zinc/92/58/88/598925888.db2.gz QWFCVSGTBOUCTO-UHFFFAOYSA-N -1 3 357.483 3.882 20 0 FHADHM CC1CCC(=CC(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCC3)CC1 ZINC000736237559 598925890 /nfs/dbraw/zinc/92/58/90/598925890.db2.gz QWFCVSGTBOUCTO-UHFFFAOYSA-N -1 3 357.483 3.882 20 0 FHADHM Nc1c(Cl)cc(Nc2ncc(-c3nnn[n-]3)cc2Cl)cc1Cl ZINC000737773858 598936623 /nfs/dbraw/zinc/93/66/23/598936623.db2.gz MAXVUAJCYWVABT-UHFFFAOYSA-N -1 3 356.604 3.548 20 0 FHADHM Nc1c(Cl)cc(Nc2ncc(-c3nn[n-]n3)cc2Cl)cc1Cl ZINC000737773858 598936624 /nfs/dbraw/zinc/93/66/24/598936624.db2.gz MAXVUAJCYWVABT-UHFFFAOYSA-N -1 3 356.604 3.548 20 0 FHADHM FC(F)(F)COc1cccc(Nc2ncc(-c3nnn[n-]3)cc2Cl)c1 ZINC000737627898 598937916 /nfs/dbraw/zinc/93/79/16/598937916.db2.gz RKAKVHSBUDGPPJ-UHFFFAOYSA-N -1 3 370.722 3.600 20 0 FHADHM FC(F)(F)COc1cccc(Nc2ncc(-c3nn[n-]n3)cc2Cl)c1 ZINC000737627898 598937917 /nfs/dbraw/zinc/93/79/17/598937917.db2.gz RKAKVHSBUDGPPJ-UHFFFAOYSA-N -1 3 370.722 3.600 20 0 FHADHM COc1cccc(CN(CC(C)C)c2ncc(-c3nnn[n-]3)cc2Cl)c1 ZINC000737130989 598939940 /nfs/dbraw/zinc/93/99/40/598939940.db2.gz LJFKZJMNJIZZTL-UHFFFAOYSA-N -1 3 372.860 3.586 20 0 FHADHM COc1cccc(CN(CC(C)C)c2ncc(-c3nn[n-]n3)cc2Cl)c1 ZINC000737130989 598939941 /nfs/dbraw/zinc/93/99/41/598939941.db2.gz LJFKZJMNJIZZTL-UHFFFAOYSA-N -1 3 372.860 3.586 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1Nc1ccc(Nc2ccccc2)nc1 ZINC000737557150 598940522 /nfs/dbraw/zinc/94/05/22/598940522.db2.gz CMNKWWFMBKWZOV-UHFFFAOYSA-N -1 3 364.800 3.797 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1Nc1ccc(Nc2ccccc2)nc1 ZINC000737557150 598940525 /nfs/dbraw/zinc/94/05/25/598940525.db2.gz CMNKWWFMBKWZOV-UHFFFAOYSA-N -1 3 364.800 3.797 20 0 FHADHM CC[C@@H]1CCC[C@H](NC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)C1 ZINC000736395070 598942255 /nfs/dbraw/zinc/94/22/55/598942255.db2.gz GTXKJYHEJYYADE-WBVHZDCISA-N -1 3 371.485 3.501 20 0 FHADHM CC[C@@H]1CCC[C@H](NC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)C1 ZINC000736395070 598942257 /nfs/dbraw/zinc/94/22/57/598942257.db2.gz GTXKJYHEJYYADE-WBVHZDCISA-N -1 3 371.485 3.501 20 0 FHADHM CC(C)C[C@H]1CCCCCN1C(=O)C=Cc1ccccc1-c1nnn[n-]1 ZINC000735796172 598943471 /nfs/dbraw/zinc/94/34/71/598943471.db2.gz VVQVNZANZMHXHF-WFTPILKQSA-N -1 3 353.470 3.697 20 0 FHADHM CC(C)C[C@H]1CCCCCN1C(=O)C=Cc1ccccc1-c1nn[n-]n1 ZINC000735796172 598943472 /nfs/dbraw/zinc/94/34/72/598943472.db2.gz VVQVNZANZMHXHF-WFTPILKQSA-N -1 3 353.470 3.697 20 0 FHADHM C[C@@H](c1ccccc1)N(CC1CCC1)C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000736204550 598944445 /nfs/dbraw/zinc/94/44/45/598944445.db2.gz RNDRAPCSGXMTOO-HNNXBMFYSA-N -1 3 361.449 3.870 20 0 FHADHM C[C@@H](c1ccccc1)N(CC1CCC1)C(=O)c1cccc(-c2nn[n-]n2)c1 ZINC000736204550 598944446 /nfs/dbraw/zinc/94/44/46/598944446.db2.gz RNDRAPCSGXMTOO-HNNXBMFYSA-N -1 3 361.449 3.870 20 0 FHADHM C[C@@H](CNC(=O)c1ccccc1-c1ccccc1-c1nnn[n-]1)C(C)(C)C ZINC000736025749 599006878 /nfs/dbraw/zinc/00/68/78/599006878.db2.gz JLNQDJGLQIGWTP-AWEZNQCLSA-N -1 3 363.465 3.946 20 0 FHADHM C[C@@H](CNC(=O)c1ccccc1-c1ccccc1-c1nn[n-]n1)C(C)(C)C ZINC000736025749 599006880 /nfs/dbraw/zinc/00/68/80/599006880.db2.gz JLNQDJGLQIGWTP-AWEZNQCLSA-N -1 3 363.465 3.946 20 0 FHADHM CC(C)[C@@H](NC(=O)Cc1ccc(-c2nnn[n-]2)cc1)c1ccccc1Cl ZINC000735722406 599007074 /nfs/dbraw/zinc/00/70/74/599007074.db2.gz RATMJLSSPLHGEB-GOSISDBHSA-N -1 3 369.856 3.576 20 0 FHADHM CC(C)[C@@H](NC(=O)Cc1ccc(-c2nn[n-]n2)cc1)c1ccccc1Cl ZINC000735722406 599007075 /nfs/dbraw/zinc/00/70/75/599007075.db2.gz RATMJLSSPLHGEB-GOSISDBHSA-N -1 3 369.856 3.576 20 0 FHADHM CCCCC[C@@H](NC(=O)CCc1ccc(-c2nnn[n-]2)cc1)C(C)(C)C ZINC000736441538 599008397 /nfs/dbraw/zinc/00/83/97/599008397.db2.gz RTHYGBVKOLQSGY-QGZVFWFLSA-N -1 3 357.502 3.911 20 0 FHADHM CCCCC[C@@H](NC(=O)CCc1ccc(-c2nn[n-]n2)cc1)C(C)(C)C ZINC000736441538 599008399 /nfs/dbraw/zinc/00/83/99/599008399.db2.gz RTHYGBVKOLQSGY-QGZVFWFLSA-N -1 3 357.502 3.911 20 0 FHADHM CCc1c(C)sc(NC(=O)C[C@H]2CCc3ccccc32)c1-c1nnn[n-]1 ZINC000736671287 599015409 /nfs/dbraw/zinc/01/54/09/599015409.db2.gz WGXRVEUDQKLBBD-CYBMUJFWSA-N -1 3 367.478 3.858 20 0 FHADHM CCc1c(C)sc(NC(=O)C[C@H]2CCc3ccccc32)c1-c1nn[n-]n1 ZINC000736671287 599015411 /nfs/dbraw/zinc/01/54/11/599015411.db2.gz WGXRVEUDQKLBBD-CYBMUJFWSA-N -1 3 367.478 3.858 20 0 FHADHM CCc1c(C)sc(NC(=O)C[C@@H]2CCc3ccccc32)c1-c1nnn[n-]1 ZINC000736671290 599015438 /nfs/dbraw/zinc/01/54/38/599015438.db2.gz WGXRVEUDQKLBBD-ZDUSSCGKSA-N -1 3 367.478 3.858 20 0 FHADHM CCc1c(C)sc(NC(=O)C[C@@H]2CCc3ccccc32)c1-c1nn[n-]n1 ZINC000736671290 599015440 /nfs/dbraw/zinc/01/54/40/599015440.db2.gz WGXRVEUDQKLBBD-ZDUSSCGKSA-N -1 3 367.478 3.858 20 0 FHADHM C[C@@H](S[C@H](C(N)=O)c1ccc(-c2nnn[n-]2)cc1)c1ccc(Cl)cc1 ZINC000736192490 599012469 /nfs/dbraw/zinc/01/24/69/599012469.db2.gz ZOUUQLNKKBWJRZ-BMIGLBTASA-N -1 3 373.869 3.541 20 0 FHADHM C[C@@H](S[C@H](C(N)=O)c1ccc(-c2nn[n-]n2)cc1)c1ccc(Cl)cc1 ZINC000736192490 599012471 /nfs/dbraw/zinc/01/24/71/599012471.db2.gz ZOUUQLNKKBWJRZ-BMIGLBTASA-N -1 3 373.869 3.541 20 0 FHADHM CC[C@@H](NC(=S)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1)c1cccs1 ZINC000736368341 599013669 /nfs/dbraw/zinc/01/36/69/599013669.db2.gz CJWOMNIVCXVXFP-BXUZGUMPSA-N -1 3 372.523 3.605 20 0 FHADHM CC[C@@H](NC(=S)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1)c1cccs1 ZINC000736368341 599013671 /nfs/dbraw/zinc/01/36/71/599013671.db2.gz CJWOMNIVCXVXFP-BXUZGUMPSA-N -1 3 372.523 3.605 20 0 FHADHM CC(C)C[C@H](C(=O)OCc1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000735757614 599019149 /nfs/dbraw/zinc/01/91/49/599019149.db2.gz UZRZJTJVVWQJOG-SFHVURJKSA-N -1 3 350.422 3.740 20 0 FHADHM CC(C)C[C@H](C(=O)OCc1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000735757614 599019150 /nfs/dbraw/zinc/01/91/50/599019150.db2.gz UZRZJTJVVWQJOG-SFHVURJKSA-N -1 3 350.422 3.740 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CCCCC[C@H]1CC(C)C ZINC000737063585 599021098 /nfs/dbraw/zinc/02/10/98/599021098.db2.gz QCBNNPRYZSMQFH-HNNXBMFYSA-N -1 3 372.473 3.698 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CCCCC[C@H]1CC(C)C ZINC000737063585 599021099 /nfs/dbraw/zinc/02/10/99/599021099.db2.gz QCBNNPRYZSMQFH-HNNXBMFYSA-N -1 3 372.473 3.698 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)Nc1ccccc1OCC1CC1 ZINC000737293994 599021520 /nfs/dbraw/zinc/02/15/20/599021520.db2.gz JEFVREMQNLZNDC-UHFFFAOYSA-N -1 3 364.409 3.608 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)Nc1ccccc1OCC1CC1 ZINC000737293994 599021522 /nfs/dbraw/zinc/02/15/22/599021522.db2.gz JEFVREMQNLZNDC-UHFFFAOYSA-N -1 3 364.409 3.608 20 0 FHADHM CCc1nc(C)c([C@@H](C)OC(=O)C=Cc2ccccc2-c2nnn[n-]2)s1 ZINC000736699522 599029784 /nfs/dbraw/zinc/02/97/84/599029784.db2.gz KYRXCMWIFFPMCJ-BZYZDCJZSA-N -1 3 369.450 3.512 20 0 FHADHM CCc1nc(C)c([C@@H](C)OC(=O)C=Cc2ccccc2-c2nn[n-]n2)s1 ZINC000736699522 599029786 /nfs/dbraw/zinc/02/97/86/599029786.db2.gz KYRXCMWIFFPMCJ-BZYZDCJZSA-N -1 3 369.450 3.512 20 0 FHADHM CCc1nc(C)c([C@H](C)OC(=O)C=Cc2ccccc2-c2nnn[n-]2)s1 ZINC000736699529 599029911 /nfs/dbraw/zinc/02/99/11/599029911.db2.gz KYRXCMWIFFPMCJ-VMPCVLLUSA-N -1 3 369.450 3.512 20 0 FHADHM CCc1nc(C)c([C@H](C)OC(=O)C=Cc2ccccc2-c2nn[n-]n2)s1 ZINC000736699529 599029913 /nfs/dbraw/zinc/02/99/13/599029913.db2.gz KYRXCMWIFFPMCJ-VMPCVLLUSA-N -1 3 369.450 3.512 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N2CCC[C@@H]2c2ccsc2)n1 ZINC000737631025 599044949 /nfs/dbraw/zinc/04/49/49/599044949.db2.gz BMFHSMRLWAUKEN-LLVKDONJSA-N -1 3 366.372 3.684 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N2CCC[C@@H]2c2ccsc2)n1 ZINC000737631025 599044952 /nfs/dbraw/zinc/04/49/52/599044952.db2.gz BMFHSMRLWAUKEN-LLVKDONJSA-N -1 3 366.372 3.684 20 0 FHADHM CO[C@H](CNc1c(Cl)cccc1-c1nnn[n-]1)c1ccc(Cl)cc1 ZINC000821676598 599045929 /nfs/dbraw/zinc/04/59/29/599045929.db2.gz BMSQMWAAXBHGJN-CQSZACIVSA-N -1 3 364.236 3.973 20 0 FHADHM CO[C@H](CNc1c(Cl)cccc1-c1nn[n-]n1)c1ccc(Cl)cc1 ZINC000821676598 599045932 /nfs/dbraw/zinc/04/59/32/599045932.db2.gz BMSQMWAAXBHGJN-CQSZACIVSA-N -1 3 364.236 3.973 20 0 FHADHM Cc1ccccc1[C@H]1CCCN1c1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000737420245 599046803 /nfs/dbraw/zinc/04/68/03/599046803.db2.gz DTWOJRSRZZVCRQ-CQSZACIVSA-N -1 3 374.370 3.930 20 0 FHADHM Cc1ccccc1[C@H]1CCCN1c1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000737420245 599046805 /nfs/dbraw/zinc/04/68/05/599046805.db2.gz DTWOJRSRZZVCRQ-CQSZACIVSA-N -1 3 374.370 3.930 20 0 FHADHM CC[C@H](Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1)c1nc(C)cs1 ZINC000736367820 599054017 /nfs/dbraw/zinc/05/40/17/599054017.db2.gz CTSSFVHEXREJBO-VIFPVBQESA-N -1 3 369.376 3.609 20 0 FHADHM CC[C@H](Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1)c1nc(C)cs1 ZINC000736367820 599054020 /nfs/dbraw/zinc/05/40/20/599054020.db2.gz CTSSFVHEXREJBO-VIFPVBQESA-N -1 3 369.376 3.609 20 0 FHADHM Cc1nnc(N[C@H](c2ccc(Cl)cc2)[C@@H]2C[C@H]2C)c(-c2nnn[n-]2)c1C ZINC000822510116 599055755 /nfs/dbraw/zinc/05/57/55/599055755.db2.gz JMSCHOIDRFFRSH-OYBNVQJLSA-N -1 3 369.860 3.736 20 0 FHADHM Cc1nnc(N[C@H](c2ccc(Cl)cc2)[C@@H]2C[C@H]2C)c(-c2nn[n-]n2)c1C ZINC000822510116 599055758 /nfs/dbraw/zinc/05/57/58/599055758.db2.gz JMSCHOIDRFFRSH-OYBNVQJLSA-N -1 3 369.860 3.736 20 0 FHADHM Fc1ccc(N2CCC(OCC3CCCCC3)CC2)c(-c2nnn[n-]2)c1 ZINC000822779524 599058280 /nfs/dbraw/zinc/05/82/80/599058280.db2.gz VPCWDWVENASLGG-UHFFFAOYSA-N -1 3 359.449 3.572 20 0 FHADHM Fc1ccc(N2CCC(OCC3CCCCC3)CC2)c(-c2nn[n-]n2)c1 ZINC000822779524 599058283 /nfs/dbraw/zinc/05/82/83/599058283.db2.gz VPCWDWVENASLGG-UHFFFAOYSA-N -1 3 359.449 3.572 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1Sc1ncnc2sc3c(c21)CCC3 ZINC000822747996 599058495 /nfs/dbraw/zinc/05/84/95/599058495.db2.gz BPVVBMGOCBHEJF-UHFFFAOYSA-N -1 3 370.438 3.650 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1Sc1ncnc2sc3c(c21)CCC3 ZINC000822747996 599058498 /nfs/dbraw/zinc/05/84/98/599058498.db2.gz BPVVBMGOCBHEJF-UHFFFAOYSA-N -1 3 370.438 3.650 20 0 FHADHM CC1(C)CCC(NC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)CC1 ZINC000736211187 599084533 /nfs/dbraw/zinc/08/45/33/599084533.db2.gz MGNABNIGRJIMOJ-UHFFFAOYSA-N -1 3 371.485 3.501 20 0 FHADHM CC1(C)CCC(NC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)CC1 ZINC000736211187 599084535 /nfs/dbraw/zinc/08/45/35/599084535.db2.gz MGNABNIGRJIMOJ-UHFFFAOYSA-N -1 3 371.485 3.501 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)cc1CSC[C@H]1OCCc2ccccc21 ZINC000737649995 599100379 /nfs/dbraw/zinc/10/03/79/599100379.db2.gz MMVJDIHLMCFZNF-QGZVFWFLSA-N -1 3 356.426 3.553 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CSC[C@H]1OCCc2ccccc21 ZINC000737649995 599100380 /nfs/dbraw/zinc/10/03/80/599100380.db2.gz MMVJDIHLMCFZNF-QGZVFWFLSA-N -1 3 356.426 3.553 20 0 FHADHM CC(C)CC[C@H](NC(=O)NCc1ccc(-c2nnn[n-]2)cc1)C(C)(C)C ZINC000735797176 599103157 /nfs/dbraw/zinc/10/31/57/599103157.db2.gz MBTJDYVNCZXOCG-INIZCTEOSA-N -1 3 358.490 3.517 20 0 FHADHM CC(C)CC[C@H](NC(=O)NCc1ccc(-c2nn[n-]n2)cc1)C(C)(C)C ZINC000735797176 599103159 /nfs/dbraw/zinc/10/31/59/599103159.db2.gz MBTJDYVNCZXOCG-INIZCTEOSA-N -1 3 358.490 3.517 20 0 FHADHM C[C@H](Sc1ccccc1-c1nnn[n-]1)c1nc(-c2ccccc2)no1 ZINC000736192909 599109062 /nfs/dbraw/zinc/10/90/62/599109062.db2.gz OQNFCHJBBBNVDK-NSHDSACASA-N -1 3 350.407 3.770 20 0 FHADHM C[C@H](Sc1ccccc1-c1nn[n-]n1)c1nc(-c2ccccc2)no1 ZINC000736192909 599109063 /nfs/dbraw/zinc/10/90/63/599109063.db2.gz OQNFCHJBBBNVDK-NSHDSACASA-N -1 3 350.407 3.770 20 0 FHADHM Fc1ccc(-c2cnc(CSc3ccccc3-c3nnn[n-]3)o2)cc1 ZINC000737650086 599110098 /nfs/dbraw/zinc/11/00/98/599110098.db2.gz FYKQQEXVPDXKOY-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM Fc1ccc(-c2cnc(CSc3ccccc3-c3nn[n-]n3)o2)cc1 ZINC000737650086 599110099 /nfs/dbraw/zinc/11/00/99/599110099.db2.gz FYKQQEXVPDXKOY-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM CCC[C@@]1(C)CCCN(c2nc(C(F)(F)F)ccc2-c2nnn[n-]2)C1 ZINC000821028435 599110556 /nfs/dbraw/zinc/11/05/56/599110556.db2.gz VTRNWARNYSQEIG-HNNXBMFYSA-N -1 3 354.380 3.687 20 0 FHADHM CCC[C@@]1(C)CCCN(c2nc(C(F)(F)F)ccc2-c2nn[n-]n2)C1 ZINC000821028435 599110558 /nfs/dbraw/zinc/11/05/58/599110558.db2.gz VTRNWARNYSQEIG-HNNXBMFYSA-N -1 3 354.380 3.687 20 0 FHADHM COC(=O)[C@@H](Sc1ccc(C(C)C)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736900932 599112405 /nfs/dbraw/zinc/11/24/05/599112405.db2.gz GYXZAOZAZDQKMR-KRWDZBQOSA-N -1 3 368.462 3.997 20 0 FHADHM COC(=O)[C@@H](Sc1ccc(C(C)C)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736900932 599112407 /nfs/dbraw/zinc/11/24/07/599112407.db2.gz GYXZAOZAZDQKMR-KRWDZBQOSA-N -1 3 368.462 3.997 20 0 FHADHM CCOC(=O)c1ccc(-c2nnn[n-]2)c(SCCC2CCCCC2)n1 ZINC000821343908 599123200 /nfs/dbraw/zinc/12/32/00/599123200.db2.gz YXQUSUHOVJUYOG-UHFFFAOYSA-N -1 3 361.471 3.501 20 0 FHADHM CCOC(=O)c1ccc(-c2nn[n-]n2)c(SCCC2CCCCC2)n1 ZINC000821343908 599123202 /nfs/dbraw/zinc/12/32/02/599123202.db2.gz YXQUSUHOVJUYOG-UHFFFAOYSA-N -1 3 361.471 3.501 20 0 FHADHM CSc1ccc(OCCSc2nc(C)cc(C)c2-c2nnn[n-]2)cc1 ZINC000821984020 599123378 /nfs/dbraw/zinc/12/33/78/599123378.db2.gz LIRRUPZDBXDZMO-UHFFFAOYSA-N -1 3 373.507 3.772 20 0 FHADHM CSc1ccc(OCCSc2nc(C)cc(C)c2-c2nn[n-]n2)cc1 ZINC000821984020 599123381 /nfs/dbraw/zinc/12/33/81/599123381.db2.gz LIRRUPZDBXDZMO-UHFFFAOYSA-N -1 3 373.507 3.772 20 0 FHADHM COc1ccccc1[C@@H](C)SCCOc1ccc(-c2nn[n-]n2)cc1 ZINC000821883385 599128026 /nfs/dbraw/zinc/12/80/26/599128026.db2.gz UZUJCPQFMVGFES-CYBMUJFWSA-N -1 3 356.451 3.749 20 0 FHADHM CC(C)[C@@H](C)S[C@@H](C)C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2 ZINC000820549098 599130678 /nfs/dbraw/zinc/13/06/78/599130678.db2.gz KDLZCSFWTVVWBR-ZJUUUORDSA-N -1 3 365.528 3.522 20 0 FHADHM CC(C)[C@@H](C)S[C@@H](C)C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2 ZINC000820549098 599130679 /nfs/dbraw/zinc/13/06/79/599130679.db2.gz KDLZCSFWTVVWBR-ZJUUUORDSA-N -1 3 365.528 3.522 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1OCc1ccccc1OCC(F)(F)F ZINC000822135487 599134004 /nfs/dbraw/zinc/13/40/04/599134004.db2.gz BSWFYZVQEFDLTG-UHFFFAOYSA-N -1 3 364.327 3.695 20 0 FHADHM Cc1cncc(C(=O)Nc2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)c1 ZINC000822400016 599152012 /nfs/dbraw/zinc/15/20/12/599152012.db2.gz STCJHRZPZKLVSR-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)C[C@H](C)c1cccc(F)c1 ZINC000736637155 599160375 /nfs/dbraw/zinc/16/03/75/599160375.db2.gz PEWAENWYPPURHG-LBPRGKRZSA-N -1 3 369.400 3.537 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)C[C@H](C)c1cccc(F)c1 ZINC000736637155 599160379 /nfs/dbraw/zinc/16/03/79/599160379.db2.gz PEWAENWYPPURHG-LBPRGKRZSA-N -1 3 369.400 3.537 20 0 FHADHM O=C(Nc1ccc(OC2CCCCC2)cc1)c1sccc1-c1nnn[n-]1 ZINC000738175252 599163617 /nfs/dbraw/zinc/16/36/17/599163617.db2.gz WGBJGXQQTMXZOK-UHFFFAOYSA-N -1 3 369.450 3.892 20 0 FHADHM O=C(Nc1ccc(OC2CCCCC2)cc1)c1sccc1-c1nn[n-]n1 ZINC000738175252 599163620 /nfs/dbraw/zinc/16/36/20/599163620.db2.gz WGBJGXQQTMXZOK-UHFFFAOYSA-N -1 3 369.450 3.892 20 0 FHADHM C[C@@H](SCc1nnc(-c2ccc(-c3nnn[n-]3)cc2)o1)c1cccs1 ZINC000736192160 599166593 /nfs/dbraw/zinc/16/65/93/599166593.db2.gz LDWRANCDEOQNDV-SNVBAGLBSA-N -1 3 370.463 3.973 20 0 FHADHM C[C@@H](SCc1nnc(-c2ccc(-c3nn[n-]n3)cc2)o1)c1cccs1 ZINC000736192160 599166595 /nfs/dbraw/zinc/16/65/95/599166595.db2.gz LDWRANCDEOQNDV-SNVBAGLBSA-N -1 3 370.463 3.973 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N2CCCC[C@H]2c2ccco2)n1 ZINC000737633978 599173457 /nfs/dbraw/zinc/17/34/57/599173457.db2.gz XBKNBGTUXMIMBL-NSHDSACASA-N -1 3 364.331 3.605 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N2CCCC[C@H]2c2ccco2)n1 ZINC000737633978 599173459 /nfs/dbraw/zinc/17/34/59/599173459.db2.gz XBKNBGTUXMIMBL-NSHDSACASA-N -1 3 364.331 3.605 20 0 FHADHM Cc1cc(C)c(NC(=O)CSc2ccc(-c3nnn[n-]3)cc2F)c(C)c1 ZINC000737249317 599173982 /nfs/dbraw/zinc/17/39/82/599173982.db2.gz WEMGTMWQVHHAAB-UHFFFAOYSA-N -1 3 371.441 3.662 20 0 FHADHM Cc1cc(C)c(NC(=O)CSc2ccc(-c3nn[n-]n3)cc2F)c(C)c1 ZINC000737249317 599173983 /nfs/dbraw/zinc/17/39/83/599173983.db2.gz WEMGTMWQVHHAAB-UHFFFAOYSA-N -1 3 371.441 3.662 20 0 FHADHM Cc1sc(NC(=O)c2cc3cccc(F)c3o2)c(-c2nnn[n-]2)c1C ZINC000737563638 599178423 /nfs/dbraw/zinc/17/84/23/599178423.db2.gz OBIASXSDYNSBLI-UHFFFAOYSA-N -1 3 357.370 3.683 20 0 FHADHM Cc1sc(NC(=O)c2cc3cccc(F)c3o2)c(-c2nn[n-]n2)c1C ZINC000737563638 599178425 /nfs/dbraw/zinc/17/84/25/599178425.db2.gz OBIASXSDYNSBLI-UHFFFAOYSA-N -1 3 357.370 3.683 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1 ZINC000460694867 599177229 /nfs/dbraw/zinc/17/72/29/599177229.db2.gz PPAQZTGXTHVQSY-LSDHHAIUSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1 ZINC000460694867 599177231 /nfs/dbraw/zinc/17/72/31/599177231.db2.gz PPAQZTGXTHVQSY-LSDHHAIUSA-N -1 3 374.231 3.916 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CCC[C@@H](C(C)(C)C)CC1 ZINC000737062745 599188132 /nfs/dbraw/zinc/18/81/32/599188132.db2.gz MAURXGULLHREMX-CQSZACIVSA-N -1 3 372.473 3.555 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CCC[C@@H](C(C)(C)C)CC1 ZINC000737062745 599188135 /nfs/dbraw/zinc/18/81/35/599188135.db2.gz MAURXGULLHREMX-CQSZACIVSA-N -1 3 372.473 3.555 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cnc3ccsc3c2)c1-c1nnn[n-]1 ZINC000736677066 599186324 /nfs/dbraw/zinc/18/63/24/599186324.db2.gz YYFQIEMLCFOSSS-UHFFFAOYSA-N -1 3 370.463 3.661 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cnc3ccsc3c2)c1-c1nn[n-]n1 ZINC000736677066 599186326 /nfs/dbraw/zinc/18/63/26/599186326.db2.gz YYFQIEMLCFOSSS-UHFFFAOYSA-N -1 3 370.463 3.661 20 0 FHADHM CCSCc1ccc(OCc2cccc(-c3nnn[n-]3)c2)c(OC)c1 ZINC000736666671 599210347 /nfs/dbraw/zinc/21/03/47/599210347.db2.gz MHZNWINNXLEYAV-UHFFFAOYSA-N -1 3 356.451 3.707 20 0 FHADHM CCSCc1ccc(OCc2cccc(-c3nn[n-]n3)c2)c(OC)c1 ZINC000736666671 599210348 /nfs/dbraw/zinc/21/03/48/599210348.db2.gz MHZNWINNXLEYAV-UHFFFAOYSA-N -1 3 356.451 3.707 20 0 FHADHM O=C(CC1CC1)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1 ZINC000822941368 599219475 /nfs/dbraw/zinc/21/94/75/599219475.db2.gz WLELVHDCZVABFP-UHFFFAOYSA-N -1 3 353.357 3.537 20 0 FHADHM O=C(CC1CC1)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1 ZINC000822941368 599219477 /nfs/dbraw/zinc/21/94/77/599219477.db2.gz WLELVHDCZVABFP-UHFFFAOYSA-N -1 3 353.357 3.537 20 0 FHADHM CC[C@@H](Cc1ccc(C)cc1)N(CC)C(=O)c1sccc1-c1nnn[n-]1 ZINC000736351269 599233101 /nfs/dbraw/zinc/23/31/01/599233101.db2.gz FCBTYBQFIKQROZ-HNNXBMFYSA-N -1 3 369.494 3.720 20 0 FHADHM CC[C@@H](Cc1ccc(C)cc1)N(CC)C(=O)c1sccc1-c1nn[n-]n1 ZINC000736351269 599233103 /nfs/dbraw/zinc/23/31/03/599233103.db2.gz FCBTYBQFIKQROZ-HNNXBMFYSA-N -1 3 369.494 3.720 20 0 FHADHM Cc1c(NC(=O)[C@H](C)CCc2cccc(F)c2)cccc1-c1nnn[n-]1 ZINC000822060449 607266412 /nfs/dbraw/zinc/26/64/12/607266412.db2.gz HNPAXFYZWOZRHJ-GFCCVEGCSA-N -1 3 353.401 3.522 20 0 FHADHM Cc1c(NC(=O)[C@H](C)CCc2cccc(F)c2)cccc1-c1nn[n-]n1 ZINC000822060449 607266413 /nfs/dbraw/zinc/26/64/13/607266413.db2.gz HNPAXFYZWOZRHJ-GFCCVEGCSA-N -1 3 353.401 3.522 20 0 FHADHM CC[C@@H](NC(=S)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1cccs1 ZINC000820920311 599238514 /nfs/dbraw/zinc/23/85/14/599238514.db2.gz OWYZWJAGLGDPSE-BXUZGUMPSA-N -1 3 372.523 3.605 20 0 FHADHM CC[C@@H](NC(=S)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1cccs1 ZINC000820920311 599238516 /nfs/dbraw/zinc/23/85/16/599238516.db2.gz OWYZWJAGLGDPSE-BXUZGUMPSA-N -1 3 372.523 3.605 20 0 FHADHM CC(C)=CCOc1cccc(C(=O)Nc2cccc(-c3nnn[n-]3)c2C)c1 ZINC000820005514 607270336 /nfs/dbraw/zinc/27/03/36/607270336.db2.gz SORJLWCPOYVEMM-UHFFFAOYSA-N -1 3 363.421 3.772 20 0 FHADHM CC(C)=CCOc1cccc(C(=O)Nc2cccc(-c3nn[n-]n3)c2C)c1 ZINC000820005514 607270337 /nfs/dbraw/zinc/27/03/37/607270337.db2.gz SORJLWCPOYVEMM-UHFFFAOYSA-N -1 3 363.421 3.772 20 0 FHADHM Cc1c(NC(=O)CCOc2ccc3ccccc3c2)cccc1-c1nnn[n-]1 ZINC000822067876 607268916 /nfs/dbraw/zinc/26/89/16/607268916.db2.gz LJEDATHPRZKGEP-UHFFFAOYSA-N -1 3 373.416 3.736 20 0 FHADHM Cc1c(NC(=O)CCOc2ccc3ccccc3c2)cccc1-c1nn[n-]n1 ZINC000822067876 607268917 /nfs/dbraw/zinc/26/89/17/607268917.db2.gz LJEDATHPRZKGEP-UHFFFAOYSA-N -1 3 373.416 3.736 20 0 FHADHM O=C(Nc1ccccc1-c1nnn[n-]1)c1ccc(OC2CCCCC2)cc1 ZINC000738192472 599247013 /nfs/dbraw/zinc/24/70/13/599247013.db2.gz QWHKTSIMAQMHRD-UHFFFAOYSA-N -1 3 363.421 3.831 20 0 FHADHM O=C(Nc1ccccc1-c1nn[n-]n1)c1ccc(OC2CCCCC2)cc1 ZINC000738192472 599247014 /nfs/dbraw/zinc/24/70/14/599247014.db2.gz QWHKTSIMAQMHRD-UHFFFAOYSA-N -1 3 363.421 3.831 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)N1CCC2(C1)CCCCC2 ZINC000823302910 599250757 /nfs/dbraw/zinc/25/07/57/599250757.db2.gz ALLHFYPQMIRUQN-UHFFFAOYSA-N -1 3 360.849 3.708 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)N1CCC2(C1)CCCCC2 ZINC000823302910 599250760 /nfs/dbraw/zinc/25/07/60/599250760.db2.gz ALLHFYPQMIRUQN-UHFFFAOYSA-N -1 3 360.849 3.708 20 0 FHADHM COc1cc([C@H](C)NCc2ccc(C(=O)[O-])cc2)ccc1OC(F)F ZINC000818558010 597245153 /nfs/dbraw/zinc/24/51/53/597245153.db2.gz OGTVHWRLTJPNMX-NSHDSACASA-N -1 3 351.349 3.846 20 0 FHADHM CC(C)Oc1ccccc1NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820178596 599253951 /nfs/dbraw/zinc/25/39/51/599253951.db2.gz VKSBACNMXWFZKN-ZDUSSCGKSA-N -1 3 366.425 3.537 20 0 FHADHM CC(C)Oc1ccccc1NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820178596 599253953 /nfs/dbraw/zinc/25/39/53/599253953.db2.gz VKSBACNMXWFZKN-ZDUSSCGKSA-N -1 3 366.425 3.537 20 0 FHADHM Cc1c(NC(=O)NC2(c3ccc(Cl)cc3)CC2)cccc1-c1nnn[n-]1 ZINC000822089699 607283092 /nfs/dbraw/zinc/28/30/92/607283092.db2.gz GCSGRZJEJAAHPW-UHFFFAOYSA-N -1 3 368.828 3.639 20 0 FHADHM Cc1c(NC(=O)NC2(c3ccc(Cl)cc3)CC2)cccc1-c1nn[n-]n1 ZINC000822089699 607283093 /nfs/dbraw/zinc/28/30/93/607283093.db2.gz GCSGRZJEJAAHPW-UHFFFAOYSA-N -1 3 368.828 3.639 20 0 FHADHM CN(Cc1c(F)cccc1Cl)c1c(-c2nnn[n-]2)cnc2ccccc21 ZINC000736814432 599254682 /nfs/dbraw/zinc/25/46/82/599254682.db2.gz JHRRMAJEMKGNGN-UHFFFAOYSA-N -1 3 368.803 3.844 20 0 FHADHM CN(Cc1c(F)cccc1Cl)c1c(-c2nn[n-]n2)cnc2ccccc21 ZINC000736814432 599254683 /nfs/dbraw/zinc/25/46/83/599254683.db2.gz JHRRMAJEMKGNGN-UHFFFAOYSA-N -1 3 368.803 3.844 20 0 FHADHM Cc1c(NC(=O)N2CCCC3(CCCCC3)C2)cccc1-c1nnn[n-]1 ZINC000822084792 607288261 /nfs/dbraw/zinc/28/82/61/607288261.db2.gz PHSHITJSEHYGSK-UHFFFAOYSA-N -1 3 354.458 3.753 20 0 FHADHM Cc1c(NC(=O)N2CCCC3(CCCCC3)C2)cccc1-c1nn[n-]n1 ZINC000822084792 607288262 /nfs/dbraw/zinc/28/82/62/607288262.db2.gz PHSHITJSEHYGSK-UHFFFAOYSA-N -1 3 354.458 3.753 20 0 FHADHM Cc1c(NC(=O)Nc2cccc(COC(C)C)c2)cccc1-c1nnn[n-]1 ZINC000822105644 607288592 /nfs/dbraw/zinc/28/85/92/607288592.db2.gz WCJDRFPJNJMIQY-UHFFFAOYSA-N -1 3 366.425 3.744 20 0 FHADHM Cc1c(NC(=O)Nc2cccc(COC(C)C)c2)cccc1-c1nn[n-]n1 ZINC000822105644 607288593 /nfs/dbraw/zinc/28/85/93/607288593.db2.gz WCJDRFPJNJMIQY-UHFFFAOYSA-N -1 3 366.425 3.744 20 0 FHADHM Cc1ccc(C2=CCN(C(=O)Nc3cccc(-c4nnn[n-]4)c3C)CC2)cc1 ZINC000822231757 607283588 /nfs/dbraw/zinc/28/35/88/607283588.db2.gz GKHYWHXDKHEFLU-UHFFFAOYSA-N -1 3 374.448 3.805 20 0 FHADHM Cc1ccc(C2=CCN(C(=O)Nc3cccc(-c4nn[n-]n4)c3C)CC2)cc1 ZINC000822231757 607283589 /nfs/dbraw/zinc/28/35/89/607283589.db2.gz GKHYWHXDKHEFLU-UHFFFAOYSA-N -1 3 374.448 3.805 20 0 FHADHM C[C@@H](NC(=O)NCCCCC1CCCC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820368283 599259159 /nfs/dbraw/zinc/25/91/59/599259159.db2.gz ZIDUUTIXBXRTHX-CQSZACIVSA-N -1 3 356.474 3.587 20 0 FHADHM C[C@@H](NC(=O)NCCCCC1CCCC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820368283 599259161 /nfs/dbraw/zinc/25/91/61/599259161.db2.gz ZIDUUTIXBXRTHX-CQSZACIVSA-N -1 3 356.474 3.587 20 0 FHADHM CCC[C@@]1(C)CCCN(C(=O)N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)C1 ZINC000821027694 599259966 /nfs/dbraw/zinc/25/99/66/599259966.db2.gz QQJVAMSRUSRBTR-LIRRHRJNSA-N -1 3 356.474 3.540 20 0 FHADHM CCC[C@@]1(C)CCCN(C(=O)N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)C1 ZINC000821027694 599259967 /nfs/dbraw/zinc/25/99/67/599259967.db2.gz QQJVAMSRUSRBTR-LIRRHRJNSA-N -1 3 356.474 3.540 20 0 FHADHM O[C@H]1CCCC[C@H]1CCCNc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000823706935 607306531 /nfs/dbraw/zinc/30/65/31/607306531.db2.gz RVUDSWQYUJCNLA-NHYWBVRUSA-N -1 3 369.391 3.629 20 0 FHADHM O[C@H]1CCCC[C@H]1CCCNc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000823706935 607306532 /nfs/dbraw/zinc/30/65/32/607306532.db2.gz RVUDSWQYUJCNLA-NHYWBVRUSA-N -1 3 369.391 3.629 20 0 FHADHM CCOc1ccc(C(F)(F)F)cc1NCc1cc(-c2nnn[n-]2)cs1 ZINC000821417295 607314006 /nfs/dbraw/zinc/31/40/06/607314006.db2.gz KQRZUDJSGAIQTC-UHFFFAOYSA-N -1 3 369.372 3.958 20 0 FHADHM CCOc1ccc(C(F)(F)F)cc1NCc1cc(-c2nn[n-]n2)cs1 ZINC000821417295 607314007 /nfs/dbraw/zinc/31/40/07/607314007.db2.gz KQRZUDJSGAIQTC-UHFFFAOYSA-N -1 3 369.372 3.958 20 0 FHADHM CC(C)CCc1ccc(NCc2cnc3ccc(-c4nnn[n-]4)cn23)cc1 ZINC000820081455 607314098 /nfs/dbraw/zinc/31/40/98/607314098.db2.gz GZTRLVBVBKPLRB-UHFFFAOYSA-N -1 3 361.453 3.715 20 0 FHADHM CC(C)CCc1ccc(NCc2cnc3ccc(-c4nn[n-]n4)cn23)cc1 ZINC000820081455 607314099 /nfs/dbraw/zinc/31/40/99/607314099.db2.gz GZTRLVBVBKPLRB-UHFFFAOYSA-N -1 3 361.453 3.715 20 0 FHADHM FC(F)(F)c1nc2cc(NCc3ccc(-c4nnn[n-]4)s3)ccc2o1 ZINC000822728280 607314588 /nfs/dbraw/zinc/31/45/88/607314588.db2.gz FLMLFJQDZULXCF-UHFFFAOYSA-N -1 3 366.328 3.700 20 0 FHADHM Cc1nc(-c2ccc(NCc3cc(-c4nnn[n-]4)cs3)cc2)oc1C ZINC000822420028 607314706 /nfs/dbraw/zinc/31/47/06/607314706.db2.gz YSECXSBORVXMSP-UHFFFAOYSA-N -1 3 352.423 3.812 20 0 FHADHM Cc1nc(-c2ccc(NCc3cc(-c4nn[n-]n4)cs3)cc2)oc1C ZINC000822420028 607314707 /nfs/dbraw/zinc/31/47/07/607314707.db2.gz YSECXSBORVXMSP-UHFFFAOYSA-N -1 3 352.423 3.812 20 0 FHADHM FC(F)Oc1ccc(NCc2ccc(-c3nnn[n-]3)cc2)c2cccnc12 ZINC000822733322 607314799 /nfs/dbraw/zinc/31/47/99/607314799.db2.gz XRXVMTYDZJTYHG-UHFFFAOYSA-N -1 3 368.347 3.628 20 0 FHADHM FC(F)Oc1ccc(NCc2ccc(-c3nn[n-]n3)cc2)c2cccnc12 ZINC000822733322 607314800 /nfs/dbraw/zinc/31/48/00/607314800.db2.gz XRXVMTYDZJTYHG-UHFFFAOYSA-N -1 3 368.347 3.628 20 0 FHADHM COc1c(Cl)cc(NCc2cc(-c3nnn[n-]3)cs2)cc1Cl ZINC000821698512 607316078 /nfs/dbraw/zinc/31/60/78/607316078.db2.gz NDYFRWMPTXZSBI-UHFFFAOYSA-N -1 3 356.238 3.856 20 0 FHADHM COc1c(Cl)cc(NCc2cc(-c3nn[n-]n3)cs2)cc1Cl ZINC000821698512 607316079 /nfs/dbraw/zinc/31/60/79/607316079.db2.gz NDYFRWMPTXZSBI-UHFFFAOYSA-N -1 3 356.238 3.856 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1ccc(Cl)cc1F ZINC000736487571 599275406 /nfs/dbraw/zinc/27/54/06/599275406.db2.gz IETULBHIKBGGMR-UHFFFAOYSA-N -1 3 374.807 3.733 20 0 FHADHM COc1ccc(CNc2ccc(OC3CCC3)c(F)c2)cc1-c1nnn[n-]1 ZINC000821821661 607318259 /nfs/dbraw/zinc/31/82/59/607318259.db2.gz PVMXAAXVYGIJLL-UHFFFAOYSA-N -1 3 369.400 3.558 20 0 FHADHM COc1ccc(CNc2ccc(OC3CCC3)c(F)c2)cc1-c1nn[n-]n1 ZINC000821821661 607318260 /nfs/dbraw/zinc/31/82/60/607318260.db2.gz PVMXAAXVYGIJLL-UHFFFAOYSA-N -1 3 369.400 3.558 20 0 FHADHM CN(C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1)C1CCC1 ZINC000821571793 599281324 /nfs/dbraw/zinc/28/13/24/599281324.db2.gz FPFIPDNXLZLOLC-UHFFFAOYSA-N -1 3 364.409 3.675 20 0 FHADHM CN(C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1)C1CCC1 ZINC000821571793 599281325 /nfs/dbraw/zinc/28/13/25/599281325.db2.gz FPFIPDNXLZLOLC-UHFFFAOYSA-N -1 3 364.409 3.675 20 0 FHADHM C[C@@H](Sc1nnc(-c2ccccc2)n1C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736190326 599286845 /nfs/dbraw/zinc/28/68/45/599286845.db2.gz CYZDBXBSNXRCJM-GFCCVEGCSA-N -1 3 363.450 3.516 20 0 FHADHM C[C@@H](Sc1nnc(-c2ccccc2)n1C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736190326 599286846 /nfs/dbraw/zinc/28/68/46/599286846.db2.gz CYZDBXBSNXRCJM-GFCCVEGCSA-N -1 3 363.450 3.516 20 0 FHADHM O=C(NCCC1CCCC1)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000823188113 599287397 /nfs/dbraw/zinc/28/73/97/599287397.db2.gz VEYBWZIGEUXXKK-UHFFFAOYSA-N -1 3 368.363 3.587 20 0 FHADHM O=C(NCCC1CCCC1)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000823188113 599287399 /nfs/dbraw/zinc/28/73/99/599287399.db2.gz VEYBWZIGEUXXKK-UHFFFAOYSA-N -1 3 368.363 3.587 20 0 FHADHM O=C(Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)c1ccsc1 ZINC000738182260 598231483 /nfs/dbraw/zinc/23/14/83/598231483.db2.gz AMWNYUFORLKLEZ-UHFFFAOYSA-N -1 3 363.402 3.973 20 0 FHADHM O=C(Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)c1ccsc1 ZINC000738182260 598231485 /nfs/dbraw/zinc/23/14/85/598231485.db2.gz AMWNYUFORLKLEZ-UHFFFAOYSA-N -1 3 363.402 3.973 20 0 FHADHM CCn1c2ccccc2nc1[C@H](C)Nc1cccc(F)c1-c1nnn[n-]1 ZINC000736719406 598243153 /nfs/dbraw/zinc/24/31/53/598243153.db2.gz DCYXAHWQETXAJV-NSHDSACASA-N -1 3 351.389 3.549 20 0 FHADHM CCn1c2ccccc2nc1[C@H](C)Nc1cccc(F)c1-c1nn[n-]n1 ZINC000736719406 598243155 /nfs/dbraw/zinc/24/31/55/598243155.db2.gz DCYXAHWQETXAJV-NSHDSACASA-N -1 3 351.389 3.549 20 0 FHADHM O=C(c1ccccc1)c1cccc(NCc2ccccc2-c2nnn[n-]2)c1 ZINC000738278803 598250527 /nfs/dbraw/zinc/25/05/27/598250527.db2.gz NSWHUMHOXULLQN-UHFFFAOYSA-N -1 3 355.401 3.710 20 0 FHADHM O=C(c1ccccc1)c1cccc(NCc2ccccc2-c2nn[n-]n2)c1 ZINC000738278803 598250528 /nfs/dbraw/zinc/25/05/28/598250528.db2.gz NSWHUMHOXULLQN-UHFFFAOYSA-N -1 3 355.401 3.710 20 0 FHADHM CC(C)[C@H](C)NC(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000735706789 598266459 /nfs/dbraw/zinc/26/64/59/598266459.db2.gz DHBKCIOFPZAGFG-ZDUSSCGKSA-N -1 3 366.425 3.825 20 0 FHADHM CC(C)[C@H](C)NC(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735706789 598266461 /nfs/dbraw/zinc/26/64/61/598266461.db2.gz DHBKCIOFPZAGFG-ZDUSSCGKSA-N -1 3 366.425 3.825 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)Nc2cc(-c3nnn[n-]3)cn2C(C)(C)C)cc1 ZINC000737322359 598280132 /nfs/dbraw/zinc/28/01/32/598280132.db2.gz YXADFESOHORUBL-ZDUSSCGKSA-N -1 3 367.457 3.614 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)Nc2cc(-c3nn[n-]n3)cn2C(C)(C)C)cc1 ZINC000737322359 598280134 /nfs/dbraw/zinc/28/01/34/598280134.db2.gz YXADFESOHORUBL-ZDUSSCGKSA-N -1 3 367.457 3.614 20 0 FHADHM CC[C@@H](C)Oc1ccccc1C=CC(=O)Nc1sccc1-c1nnn[n-]1 ZINC000736328079 598297178 /nfs/dbraw/zinc/29/71/78/598297178.db2.gz NRYGZQDPUOAHOQ-JLVNDZCYSA-N -1 3 369.450 3.757 20 0 FHADHM CC[C@@H](C)Oc1ccccc1C=CC(=O)Nc1sccc1-c1nn[n-]n1 ZINC000736328079 598297180 /nfs/dbraw/zinc/29/71/80/598297180.db2.gz NRYGZQDPUOAHOQ-JLVNDZCYSA-N -1 3 369.450 3.757 20 0 FHADHM CN(C(=O)c1cc(Cl)ccc1Cl)c1ccc(-c2nnn[n-]2)cc1F ZINC000736749801 598311839 /nfs/dbraw/zinc/31/18/39/598311839.db2.gz RVYCOOKPQMREJO-UHFFFAOYSA-N -1 3 366.183 3.589 20 0 FHADHM CN(C(=O)c1cc(Cl)ccc1Cl)c1ccc(-c2nn[n-]n2)cc1F ZINC000736749801 598311840 /nfs/dbraw/zinc/31/18/40/598311840.db2.gz RVYCOOKPQMREJO-UHFFFAOYSA-N -1 3 366.183 3.589 20 0 FHADHM Fc1c(F)c(F)c(CSCc2cccc(-c3nnn[n-]3)c2)c(F)c1F ZINC000737638921 598314054 /nfs/dbraw/zinc/31/40/54/598314054.db2.gz KOWDWTOHWQIBHO-UHFFFAOYSA-N -1 3 372.322 3.996 20 0 FHADHM Fc1c(F)c(F)c(CSCc2cccc(-c3nn[n-]n3)c2)c(F)c1F ZINC000737638921 598314056 /nfs/dbraw/zinc/31/40/56/598314056.db2.gz KOWDWTOHWQIBHO-UHFFFAOYSA-N -1 3 372.322 3.996 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1CNCc1c(Cl)cccc1Cl ZINC000737637648 598316075 /nfs/dbraw/zinc/31/60/75/598316075.db2.gz AWUBWZKXIPFEIY-UHFFFAOYSA-N -1 3 352.200 3.602 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CNCc1c(Cl)cccc1Cl ZINC000737637648 598316077 /nfs/dbraw/zinc/31/60/77/598316077.db2.gz AWUBWZKXIPFEIY-UHFFFAOYSA-N -1 3 352.200 3.602 20 0 FHADHM S=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)NC1CCCCCC1 ZINC000738406196 598318113 /nfs/dbraw/zinc/31/81/13/598318113.db2.gz BKOYKHIDULOLSP-UHFFFAOYSA-N -1 3 350.879 3.529 20 0 FHADHM S=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)NC1CCCCCC1 ZINC000738406196 598318115 /nfs/dbraw/zinc/31/81/15/598318115.db2.gz BKOYKHIDULOLSP-UHFFFAOYSA-N -1 3 350.879 3.529 20 0 FHADHM CC(C)C[C@H]1CCCN1C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000735796033 598323455 /nfs/dbraw/zinc/32/34/55/598323455.db2.gz QWHVUVULBUNRKA-GFCCVEGCSA-N -1 3 364.906 3.727 20 0 FHADHM CC(C)C[C@H]1CCCN1C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000735796033 598323457 /nfs/dbraw/zinc/32/34/57/598323457.db2.gz QWHVUVULBUNRKA-GFCCVEGCSA-N -1 3 364.906 3.727 20 0 FHADHM Cc1ccc(N(C)C(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1 ZINC000737347098 598324499 /nfs/dbraw/zinc/32/44/99/598324499.db2.gz MDOLRRCGTXIDQH-UHFFFAOYSA-N -1 3 358.858 3.662 20 0 FHADHM Cc1ccc(N(C)C(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1 ZINC000737347098 598324501 /nfs/dbraw/zinc/32/45/01/598324501.db2.gz MDOLRRCGTXIDQH-UHFFFAOYSA-N -1 3 358.858 3.662 20 0 FHADHM Cc1sc(NC(=O)[C@H]2CCCc3sccc32)c(-c2nnn[n-]2)c1C ZINC000822558066 607350450 /nfs/dbraw/zinc/35/04/50/607350450.db2.gz LYZJAOHYSDKMPX-NSHDSACASA-N -1 3 359.480 3.665 20 0 FHADHM Cc1sc(NC(=O)[C@H]2CCCc3sccc32)c(-c2nn[n-]n2)c1C ZINC000822558066 607350452 /nfs/dbraw/zinc/35/04/52/607350452.db2.gz LYZJAOHYSDKMPX-NSHDSACASA-N -1 3 359.480 3.665 20 0 FHADHM Brc1cccc([C@@H]2C[C@H]2Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735369819 598353520 /nfs/dbraw/zinc/35/35/20/598353520.db2.gz XKILONNHEYAXFE-LSDHHAIUSA-N -1 3 356.227 3.597 20 0 FHADHM CC(C)c1nnc(COc2ccc(-c3ccc(-c4nnn[n-]4)cc3)cc2)o1 ZINC000735952616 598378110 /nfs/dbraw/zinc/37/81/10/598378110.db2.gz IOGGEVFBEZPNLJ-UHFFFAOYSA-N -1 3 362.393 3.619 20 0 FHADHM CC(C)c1nnc(COc2ccc(-c3ccc(-c4nn[n-]n4)cc3)cc2)o1 ZINC000735952616 598378111 /nfs/dbraw/zinc/37/81/11/598378111.db2.gz IOGGEVFBEZPNLJ-UHFFFAOYSA-N -1 3 362.393 3.619 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)[C@H](OC1CCCC1)c1ccccc1 ZINC000726933454 598379188 /nfs/dbraw/zinc/37/91/88/598379188.db2.gz MJWLIQJOBYTXQI-GOSISDBHSA-N -1 3 363.421 3.506 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)[C@H](OC1CCCC1)c1ccccc1 ZINC000726933454 598379191 /nfs/dbraw/zinc/37/91/91/598379191.db2.gz MJWLIQJOBYTXQI-GOSISDBHSA-N -1 3 363.421 3.506 20 0 FHADHM CC(C)(C)c1ccc(C=C2N=C(c3ccc(-c4nnn[n-]4)cc3)OC2=O)cc1 ZINC000735649950 598379312 /nfs/dbraw/zinc/37/93/12/598379312.db2.gz MMEAQWCPOMZPIF-SFQUDFHCSA-N -1 3 373.416 3.509 20 0 FHADHM CC(C)(C)c1ccc(C=C2N=C(c3ccc(-c4nn[n-]n4)cc3)OC2=O)cc1 ZINC000735649950 598379313 /nfs/dbraw/zinc/37/93/13/598379313.db2.gz MMEAQWCPOMZPIF-SFQUDFHCSA-N -1 3 373.416 3.509 20 0 FHADHM c1coc(CN(Cc2cccs2)Cc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000738449016 598383490 /nfs/dbraw/zinc/38/34/90/598383490.db2.gz RKQKYUZVFJLTNX-UHFFFAOYSA-N -1 3 351.435 3.724 20 0 FHADHM Cc1ccc(Oc2ccccc2CNc2ncccc2-c2nnn[n-]2)cc1 ZINC000737366504 598386662 /nfs/dbraw/zinc/38/66/62/598386662.db2.gz RQXLJXMSNSLCSD-UHFFFAOYSA-N -1 3 358.405 3.975 20 0 FHADHM Cc1ccc(Oc2ccccc2CNc2ncccc2-c2nn[n-]n2)cc1 ZINC000737366504 598386664 /nfs/dbraw/zinc/38/66/64/598386664.db2.gz RQXLJXMSNSLCSD-UHFFFAOYSA-N -1 3 358.405 3.975 20 0 FHADHM Cc1ccccc1C1CCN(C(=O)Nc2cccc(-c3nnn[n-]3)c2)CC1 ZINC000737422646 598389704 /nfs/dbraw/zinc/38/97/04/598389704.db2.gz NDVKGKUBMJVCJG-UHFFFAOYSA-N -1 3 362.437 3.587 20 0 FHADHM Cc1ccccc1C1CCN(C(=O)Nc2cccc(-c3nn[n-]n3)c2)CC1 ZINC000737422646 598389706 /nfs/dbraw/zinc/38/97/06/598389706.db2.gz NDVKGKUBMJVCJG-UHFFFAOYSA-N -1 3 362.437 3.587 20 0 FHADHM COc1ccc(-c2nc(CNc3ccccc3-c3nnn[n-]3)cs2)cc1 ZINC000737055251 598417938 /nfs/dbraw/zinc/41/79/38/598417938.db2.gz BRQIAPCAGBGWID-UHFFFAOYSA-N -1 3 364.434 3.611 20 0 FHADHM COc1ccc(-c2nc(CNc3ccccc3-c3nn[n-]n3)cs2)cc1 ZINC000737055251 598417939 /nfs/dbraw/zinc/41/79/39/598417939.db2.gz BRQIAPCAGBGWID-UHFFFAOYSA-N -1 3 364.434 3.611 20 0 FHADHM CCc1c(C)sc(NC(=O)c2sccc2SC)c1-c1nnn[n-]1 ZINC000736679005 598420637 /nfs/dbraw/zinc/42/06/37/598420637.db2.gz IKWBWIQBYLCUMM-UHFFFAOYSA-N -1 3 365.509 3.835 20 0 FHADHM CCc1c(C)sc(NC(=O)c2sccc2SC)c1-c1nn[n-]n1 ZINC000736679005 598420639 /nfs/dbraw/zinc/42/06/39/598420639.db2.gz IKWBWIQBYLCUMM-UHFFFAOYSA-N -1 3 365.509 3.835 20 0 FHADHM O=C(Nc1sccc1-c1nnn[n-]1)[C@@H]1C[C@H]1c1cccc2ccccc21 ZINC000738208310 598437866 /nfs/dbraw/zinc/43/78/66/598437866.db2.gz LIMMSVFEQWVMMS-JKSUJKDBSA-N -1 3 361.430 3.824 20 0 FHADHM O=C(Nc1sccc1-c1nn[n-]n1)[C@@H]1C[C@H]1c1cccc2ccccc21 ZINC000738208310 598437867 /nfs/dbraw/zinc/43/78/67/598437867.db2.gz LIMMSVFEQWVMMS-JKSUJKDBSA-N -1 3 361.430 3.824 20 0 FHADHM COc1ccc(CCCCCC(=O)Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000737089690 598440942 /nfs/dbraw/zinc/44/09/42/598440942.db2.gz VHBWGBVCSBYJEW-UHFFFAOYSA-N -1 3 366.421 3.584 20 0 FHADHM COc1ccc(CCCCCC(=O)Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000737089690 598440943 /nfs/dbraw/zinc/44/09/43/598440943.db2.gz VHBWGBVCSBYJEW-UHFFFAOYSA-N -1 3 366.421 3.584 20 0 FHADHM C[C@@H]1C[C@H](CC(=O)N(C)Cc2ccc(-c3nnn[n-]3)cc2)CC(C)(C)C1 ZINC000736227964 598442140 /nfs/dbraw/zinc/44/21/40/598442140.db2.gz MOLCXWHZMLAVOO-GDBMZVCRSA-N -1 3 355.486 3.678 20 0 FHADHM C[C@@H]1C[C@H](CC(=O)N(C)Cc2ccc(-c3nn[n-]n3)cc2)CC(C)(C)C1 ZINC000736227964 598442141 /nfs/dbraw/zinc/44/21/41/598442141.db2.gz MOLCXWHZMLAVOO-GDBMZVCRSA-N -1 3 355.486 3.678 20 0 FHADHM C[C@@H](NC(=O)C[C@H]1C[C@@H](C)CC(C)(C)C1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736229483 598442198 /nfs/dbraw/zinc/44/21/98/598442198.db2.gz QZDUASJHZMOFHW-RBSFLKMASA-N -1 3 355.486 3.896 20 0 FHADHM C[C@@H](NC(=O)C[C@H]1C[C@@H](C)CC(C)(C)C1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736229483 598442199 /nfs/dbraw/zinc/44/21/99/598442199.db2.gz QZDUASJHZMOFHW-RBSFLKMASA-N -1 3 355.486 3.896 20 0 FHADHM COc1ccccc1C(C)=CC(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000737141966 598442738 /nfs/dbraw/zinc/44/27/38/598442738.db2.gz LFGTWUMTBRLHMG-LUAWRHEFSA-N -1 3 369.812 3.571 20 0 FHADHM COc1ccccc1C(C)=CC(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000737141966 598442739 /nfs/dbraw/zinc/44/27/39/598442739.db2.gz LFGTWUMTBRLHMG-LUAWRHEFSA-N -1 3 369.812 3.571 20 0 FHADHM C[C@@H](c1ccccc1)N(C(=O)c1ccc(-c2nnn[n-]2)cn1)c1ccccc1 ZINC000736204052 598446571 /nfs/dbraw/zinc/44/65/71/598446571.db2.gz PPMICAHKRVKFQR-HNNXBMFYSA-N -1 3 370.416 3.670 20 0 FHADHM C[C@@H](c1ccccc1)N(C(=O)c1ccc(-c2nn[n-]n2)cn1)c1ccccc1 ZINC000736204052 598446573 /nfs/dbraw/zinc/44/65/73/598446573.db2.gz PPMICAHKRVKFQR-HNNXBMFYSA-N -1 3 370.416 3.670 20 0 FHADHM Clc1ccc(Br)cc1NCc1ccccc1-c1nnn[n-]1 ZINC000737570321 598459215 /nfs/dbraw/zinc/45/92/15/598459215.db2.gz DZBRAJHKKKHXKF-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM Clc1ccc(Br)cc1NCc1ccccc1-c1nn[n-]n1 ZINC000737570321 598459216 /nfs/dbraw/zinc/45/92/16/598459216.db2.gz DZBRAJHKKKHXKF-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM Cc1cccc(C2(NC(=O)Nc3cccc(-c4nnn[n-]4)c3)CCCC2)c1 ZINC000737389148 598468132 /nfs/dbraw/zinc/46/81/32/598468132.db2.gz JBWSUAWUIRAPRG-UHFFFAOYSA-N -1 3 362.437 3.766 20 0 FHADHM Cc1cccc(C2(NC(=O)Nc3cccc(-c4nn[n-]n4)c3)CCCC2)c1 ZINC000737389148 598468134 /nfs/dbraw/zinc/46/81/34/598468134.db2.gz JBWSUAWUIRAPRG-UHFFFAOYSA-N -1 3 362.437 3.766 20 0 FHADHM CC(=CC(=O)OCc1ccccc1-c1nnn[n-]1)c1ccccc1Cl ZINC000735449468 598473955 /nfs/dbraw/zinc/47/39/55/598473955.db2.gz YYBFYIKXRADZBK-ZRDIBKRKSA-N -1 3 354.797 3.667 20 0 FHADHM CC(=CC(=O)OCc1ccccc1-c1nn[n-]n1)c1ccccc1Cl ZINC000735449468 598473957 /nfs/dbraw/zinc/47/39/57/598473957.db2.gz YYBFYIKXRADZBK-ZRDIBKRKSA-N -1 3 354.797 3.667 20 0 FHADHM C[C@@H](Oc1cccc(Cl)c1)C(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000736180421 598491819 /nfs/dbraw/zinc/49/18/19/598491819.db2.gz ILEPSSISNIGYIT-NWDGAFQWSA-N -1 3 372.812 3.592 20 0 FHADHM C[C@@H](Oc1cccc(Cl)c1)C(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000736180421 598491820 /nfs/dbraw/zinc/49/18/20/598491820.db2.gz ILEPSSISNIGYIT-NWDGAFQWSA-N -1 3 372.812 3.592 20 0 FHADHM Cc1ccccc1SCC(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000737432449 598492371 /nfs/dbraw/zinc/49/23/71/598492371.db2.gz YVPLIKKKSRDORQ-ZDUSSCGKSA-N -1 3 354.435 3.572 20 0 FHADHM Cc1ccccc1SCC(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000737432449 598492372 /nfs/dbraw/zinc/49/23/72/598492372.db2.gz YVPLIKKKSRDORQ-ZDUSSCGKSA-N -1 3 354.435 3.572 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@@H](C)c2ccc(CC)cc2)s1 ZINC000736685578 598498052 /nfs/dbraw/zinc/49/80/52/598498052.db2.gz GXVRZESJAGZCPT-NSHDSACASA-N -1 3 355.467 3.795 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@@H](C)c2ccc(CC)cc2)s1 ZINC000736685578 598498054 /nfs/dbraw/zinc/49/80/54/598498054.db2.gz GXVRZESJAGZCPT-NSHDSACASA-N -1 3 355.467 3.795 20 0 FHADHM Clc1ccc(N2CCC(COc3ccccc3)CC2)c(-c2nnn[n-]2)c1 ZINC000737573753 598508505 /nfs/dbraw/zinc/50/85/05/598508505.db2.gz BGTGTAACJKVQPW-UHFFFAOYSA-N -1 3 369.856 3.816 20 0 FHADHM Clc1ccc(N2CCC(COc3ccccc3)CC2)c(-c2nn[n-]n2)c1 ZINC000737573753 598508506 /nfs/dbraw/zinc/50/85/06/598508506.db2.gz BGTGTAACJKVQPW-UHFFFAOYSA-N -1 3 369.856 3.816 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000590030800 598513414 /nfs/dbraw/zinc/51/34/14/598513414.db2.gz GLEGLUSXJXMQFQ-QWHCGFSZSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000590030800 598513416 /nfs/dbraw/zinc/51/34/16/598513416.db2.gz GLEGLUSXJXMQFQ-QWHCGFSZSA-N -1 3 374.231 3.916 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccc(F)cc2Cl)c1-c1nnn[n-]1 ZINC000736676403 598517295 /nfs/dbraw/zinc/51/72/95/598517295.db2.gz UHFRHOUVDCPRNA-UHFFFAOYSA-N -1 3 365.821 3.844 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccc(F)cc2Cl)c1-c1nn[n-]n1 ZINC000736676403 598517296 /nfs/dbraw/zinc/51/72/96/598517296.db2.gz UHFRHOUVDCPRNA-UHFFFAOYSA-N -1 3 365.821 3.844 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@H]1NC(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000735796847 598527875 /nfs/dbraw/zinc/52/78/75/598527875.db2.gz IUVLXDNZKBUTTO-FUHWJXTLSA-N -1 3 370.501 3.613 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@H]1NC(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000735796847 598527877 /nfs/dbraw/zinc/52/78/77/598527877.db2.gz IUVLXDNZKBUTTO-FUHWJXTLSA-N -1 3 370.501 3.613 20 0 FHADHM CCCCC[C@H](NC(=O)c1sccc1-c1nnn[n-]1)c1ccccc1 ZINC000736441481 598543675 /nfs/dbraw/zinc/54/36/75/598543675.db2.gz QSDUMBWFFKOWBK-HNNXBMFYSA-N -1 3 355.467 3.980 20 0 FHADHM CCCCC[C@H](NC(=O)c1sccc1-c1nn[n-]n1)c1ccccc1 ZINC000736441481 598543676 /nfs/dbraw/zinc/54/36/76/598543676.db2.gz QSDUMBWFFKOWBK-HNNXBMFYSA-N -1 3 355.467 3.980 20 0 FHADHM O=C(OCc1ccccc1-c1nnn[n-]1)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000738235802 598544394 /nfs/dbraw/zinc/54/43/94/598544394.db2.gz WUTQCYHBPNAUDD-WOJBJXKFSA-N -1 3 370.412 3.867 20 0 FHADHM O=C(OCc1ccccc1-c1nn[n-]n1)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000738235802 598544395 /nfs/dbraw/zinc/54/43/95/598544395.db2.gz WUTQCYHBPNAUDD-WOJBJXKFSA-N -1 3 370.412 3.867 20 0 FHADHM O=C(OCc1ccccc1-c1nnn[n-]1)[C@@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000738235798 598544568 /nfs/dbraw/zinc/54/45/68/598544568.db2.gz WUTQCYHBPNAUDD-VQTJNVASSA-N -1 3 370.412 3.867 20 0 FHADHM O=C(OCc1ccccc1-c1nn[n-]n1)[C@@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000738235798 598544570 /nfs/dbraw/zinc/54/45/70/598544570.db2.gz WUTQCYHBPNAUDD-VQTJNVASSA-N -1 3 370.412 3.867 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCC2)c1ccccc1F ZINC000735570957 598551655 /nfs/dbraw/zinc/55/16/55/598551655.db2.gz QMMNJQLJGMTATF-JTQLQIEISA-N -1 3 371.441 3.688 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCC2)c1ccccc1F ZINC000735570957 598551656 /nfs/dbraw/zinc/55/16/56/598551656.db2.gz QMMNJQLJGMTATF-JTQLQIEISA-N -1 3 371.441 3.688 20 0 FHADHM Fc1cc(OCCOc2ccc3ccccc3c2)ccc1-c1nnn[n-]1 ZINC000737650387 598552094 /nfs/dbraw/zinc/55/20/94/598552094.db2.gz HYHJTVKODCLDPN-UHFFFAOYSA-N -1 3 350.353 3.617 20 0 FHADHM Fc1cc(OCCOc2ccc3ccccc3c2)ccc1-c1nn[n-]n1 ZINC000737650387 598552096 /nfs/dbraw/zinc/55/20/96/598552096.db2.gz HYHJTVKODCLDPN-UHFFFAOYSA-N -1 3 350.353 3.617 20 0 FHADHM CCCCC[C@H](C)NC(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(F)F ZINC000736440527 598560492 /nfs/dbraw/zinc/56/04/92/598560492.db2.gz CTQRDZYWWUUABR-JTQLQIEISA-N -1 3 368.388 3.558 20 0 FHADHM CCCCC[C@H](C)NC(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(F)F ZINC000736440527 598560493 /nfs/dbraw/zinc/56/04/93/598560493.db2.gz CTQRDZYWWUUABR-JTQLQIEISA-N -1 3 368.388 3.558 20 0 FHADHM C[C@@H](Cc1cccs1)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000736066855 598572390 /nfs/dbraw/zinc/57/23/90/598572390.db2.gz QXYRVSGCXKGBID-VIFPVBQESA-N -1 3 353.373 3.990 20 0 FHADHM C[C@@H](Cc1cccs1)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000736066855 598572392 /nfs/dbraw/zinc/57/23/92/598572392.db2.gz QXYRVSGCXKGBID-VIFPVBQESA-N -1 3 353.373 3.990 20 0 FHADHM Fc1ccc(NC(=S)Nc2ccc3ccccc3c2)cc1-c1nnn[n-]1 ZINC000737661421 598582682 /nfs/dbraw/zinc/58/26/82/598582682.db2.gz VULLJOQHTNFEIM-UHFFFAOYSA-N -1 3 364.409 3.968 20 0 FHADHM Fc1ccc(NC(=S)Nc2ccc3ccccc3c2)cc1-c1nn[n-]n1 ZINC000737661421 598582684 /nfs/dbraw/zinc/58/26/84/598582684.db2.gz VULLJOQHTNFEIM-UHFFFAOYSA-N -1 3 364.409 3.968 20 0 FHADHM CC[C@@H](C)[C@H](C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccccc1 ZINC000736335673 598590578 /nfs/dbraw/zinc/59/05/78/598590578.db2.gz ZKPPYQNMVPFDOU-PXAZEXFGSA-N -1 3 353.401 3.774 20 0 FHADHM CC[C@@H](C)[C@H](C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccccc1 ZINC000736335673 598590579 /nfs/dbraw/zinc/59/05/79/598590579.db2.gz ZKPPYQNMVPFDOU-PXAZEXFGSA-N -1 3 353.401 3.774 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)C(c1ccccc1)c1ccccc1 ZINC000738163255 598592643 /nfs/dbraw/zinc/59/26/43/598592643.db2.gz QPTUESCKYULOKX-UHFFFAOYSA-N -1 3 373.391 3.776 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)C(c1ccccc1)c1ccccc1 ZINC000738163255 598592645 /nfs/dbraw/zinc/59/26/45/598592645.db2.gz QPTUESCKYULOKX-UHFFFAOYSA-N -1 3 373.391 3.776 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)c3ccc(-c4nnn[n-]4)cc3)cc2)cs1 ZINC000737462964 598601038 /nfs/dbraw/zinc/60/10/38/598601038.db2.gz BSLYYLPVVFUNBB-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)c3ccc(-c4nn[n-]n4)cc3)cc2)cs1 ZINC000737462964 598601039 /nfs/dbraw/zinc/60/10/39/598601039.db2.gz BSLYYLPVVFUNBB-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM CCC[C@@H](NC(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1)C1CCCCC1 ZINC000736431559 598607527 /nfs/dbraw/zinc/60/75/27/598607527.db2.gz MVBSRCODNQEZKG-GOSISDBHSA-N -1 3 370.501 3.757 20 0 FHADHM CCC[C@@H](NC(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1)C1CCCCC1 ZINC000736431559 598607530 /nfs/dbraw/zinc/60/75/30/598607530.db2.gz MVBSRCODNQEZKG-GOSISDBHSA-N -1 3 370.501 3.757 20 0 FHADHM Cc1cc(C(F)(F)F)c(-c2nnn[n-]2)c(S[C@H](C)c2ccncc2)n1 ZINC000737245224 598614276 /nfs/dbraw/zinc/61/42/76/598614276.db2.gz LPCSFJBLBJBHRV-SECBINFHSA-N -1 3 366.372 3.837 20 0 FHADHM C[C@@H]1CCCN(c2ccccc2OCc2ccc(-c3nnn[n-]3)cc2F)C1 ZINC000736276483 598616756 /nfs/dbraw/zinc/61/67/56/598616756.db2.gz IIHVDVXSIFYVAH-CQSZACIVSA-N -1 3 367.428 3.821 20 0 FHADHM C[C@@H]1CCCN(c2ccccc2OCc2ccc(-c3nn[n-]n3)cc2F)C1 ZINC000736276483 598616758 /nfs/dbraw/zinc/61/67/58/598616758.db2.gz IIHVDVXSIFYVAH-CQSZACIVSA-N -1 3 367.428 3.821 20 0 FHADHM O=C(NCc1csc2ccccc12)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000738123445 598627895 /nfs/dbraw/zinc/62/78/95/598627895.db2.gz DIVMMRXOWZDELC-UHFFFAOYSA-N -1 3 368.397 3.542 20 0 FHADHM O=C(NCc1csc2ccccc12)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000738123445 598627896 /nfs/dbraw/zinc/62/78/96/598627896.db2.gz DIVMMRXOWZDELC-UHFFFAOYSA-N -1 3 368.397 3.542 20 0 FHADHM FC(F)Oc1ccc(CNc2c(Cl)cccc2-c2nnn[n-]2)cc1 ZINC000737639316 598630374 /nfs/dbraw/zinc/63/03/74/598630374.db2.gz QXSOBVPSDLESLI-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM FC(F)Oc1ccc(CNc2c(Cl)cccc2-c2nn[n-]n2)cc1 ZINC000737639316 598630376 /nfs/dbraw/zinc/63/03/76/598630376.db2.gz QXSOBVPSDLESLI-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM Cc1ccc([C@@H]2CCCN2C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)cc1 ZINC000737333060 598631335 /nfs/dbraw/zinc/63/13/35/598631335.db2.gz RHDUASOJGGNNJE-KRWDZBQOSA-N -1 3 366.400 3.683 20 0 FHADHM Cc1ccc([C@@H]2CCCN2C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)cc1 ZINC000737333060 598631337 /nfs/dbraw/zinc/63/13/37/598631337.db2.gz RHDUASOJGGNNJE-KRWDZBQOSA-N -1 3 366.400 3.683 20 0 FHADHM CN(C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)[C@H]1CCCc2ccccc21 ZINC000736750233 598634021 /nfs/dbraw/zinc/63/40/21/598634021.db2.gz XKZPTXHLEGXVLY-KRWDZBQOSA-N -1 3 366.400 3.547 20 0 FHADHM CN(C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)[C@H]1CCCc2ccccc21 ZINC000736750233 598634023 /nfs/dbraw/zinc/63/40/23/598634023.db2.gz XKZPTXHLEGXVLY-KRWDZBQOSA-N -1 3 366.400 3.547 20 0 FHADHM Cc1ccc(OC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)cc1C ZINC000737365410 598644761 /nfs/dbraw/zinc/64/47/61/598644761.db2.gz RCIMIRPVPDSPOK-UHFFFAOYSA-N -1 3 366.421 3.638 20 0 FHADHM Cc1ccc(OC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)cc1C ZINC000737365410 598644763 /nfs/dbraw/zinc/64/47/63/598644763.db2.gz RCIMIRPVPDSPOK-UHFFFAOYSA-N -1 3 366.421 3.638 20 0 FHADHM CC(C)CCN(C)C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000735803761 598653089 /nfs/dbraw/zinc/65/30/89/598653089.db2.gz KIRNZFVJAKGFJD-UHFFFAOYSA-N -1 3 365.437 3.777 20 0 FHADHM CC(C)CCN(C)C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735803761 598653090 /nfs/dbraw/zinc/65/30/90/598653090.db2.gz KIRNZFVJAKGFJD-UHFFFAOYSA-N -1 3 365.437 3.777 20 0 FHADHM Cc1ccc(C(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(C)C)cc1Cl ZINC000737315607 598655348 /nfs/dbraw/zinc/65/53/48/598655348.db2.gz PCJNMUILTGZQLH-UHFFFAOYSA-N -1 3 371.828 3.868 20 0 FHADHM Cc1ccc(C(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(C)C)cc1Cl ZINC000737315607 598655349 /nfs/dbraw/zinc/65/53/49/598655349.db2.gz PCJNMUILTGZQLH-UHFFFAOYSA-N -1 3 371.828 3.868 20 0 FHADHM CCC(CC)(C(=O)Nc1ccc(-c2nnn[n-]2)cn1)c1ccc(Cl)cc1 ZINC000736335070 598658676 /nfs/dbraw/zinc/65/86/76/598658676.db2.gz PBSMSXWVGOYTSZ-UHFFFAOYSA-N -1 3 370.844 3.612 20 0 FHADHM CCC(CC)(C(=O)Nc1ccc(-c2nn[n-]n2)cn1)c1ccc(Cl)cc1 ZINC000736335070 598658677 /nfs/dbraw/zinc/65/86/77/598658677.db2.gz PBSMSXWVGOYTSZ-UHFFFAOYSA-N -1 3 370.844 3.612 20 0 FHADHM O=C(CC1CCC(c2ccccc2)CC1)Nc1ccc(-c2nnn[n-]2)cn1 ZINC000737813144 598659308 /nfs/dbraw/zinc/65/93/08/598659308.db2.gz HWRQRCFPGUAFAZ-UHFFFAOYSA-N -1 3 362.437 3.564 20 0 FHADHM O=C(CC1CCC(c2ccccc2)CC1)Nc1ccc(-c2nn[n-]n2)cn1 ZINC000737813144 598659309 /nfs/dbraw/zinc/65/93/09/598659309.db2.gz HWRQRCFPGUAFAZ-UHFFFAOYSA-N -1 3 362.437 3.564 20 0 FHADHM Clc1cc(N2CCC(OC3CCCCC3)CC2)ccc1-c1nnn[n-]1 ZINC000737565740 598668459 /nfs/dbraw/zinc/66/84/59/598668459.db2.gz PVEVYULMJVINBQ-UHFFFAOYSA-N -1 3 361.877 3.838 20 0 FHADHM Clc1cc(N2CCC(OC3CCCCC3)CC2)ccc1-c1nn[n-]n1 ZINC000737565740 598668461 /nfs/dbraw/zinc/66/84/61/598668461.db2.gz PVEVYULMJVINBQ-UHFFFAOYSA-N -1 3 361.877 3.838 20 0 FHADHM Clc1ccc([C@H]2CCN(c3ncc(-c4nnn[n-]4)cc3Cl)C2)cc1 ZINC000737571123 598680287 /nfs/dbraw/zinc/68/02/87/598680287.db2.gz SPSCMAVBYYATKT-NSHDSACASA-N -1 3 361.236 3.562 20 0 FHADHM Clc1ccc([C@H]2CCN(c3ncc(-c4nn[n-]n4)cc3Cl)C2)cc1 ZINC000737571123 598680288 /nfs/dbraw/zinc/68/02/88/598680288.db2.gz SPSCMAVBYYATKT-NSHDSACASA-N -1 3 361.236 3.562 20 0 FHADHM Cc1ccccc1NC(=O)[C@H](C)SCc1ccc(F)cc1-c1nnn[n-]1 ZINC000737436314 598696994 /nfs/dbraw/zinc/69/69/94/598696994.db2.gz RNNXESGRYAJUKV-LBPRGKRZSA-N -1 3 371.441 3.575 20 0 FHADHM Cc1ccccc1NC(=O)[C@H](C)SCc1ccc(F)cc1-c1nn[n-]n1 ZINC000737436314 598696995 /nfs/dbraw/zinc/69/69/95/598696995.db2.gz RNNXESGRYAJUKV-LBPRGKRZSA-N -1 3 371.441 3.575 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nnn[n-]1)c1cccc(Cl)c1Cl ZINC000738235631 598704085 /nfs/dbraw/zinc/70/40/85/598704085.db2.gz OOJHWYIFIMFWLR-UHFFFAOYSA-N -1 3 367.167 3.670 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nn[n-]n1)c1cccc(Cl)c1Cl ZINC000738235631 598704087 /nfs/dbraw/zinc/70/40/87/598704087.db2.gz OOJHWYIFIMFWLR-UHFFFAOYSA-N -1 3 367.167 3.670 20 0 FHADHM CC(C)(C)c1nc(Cn2ccc(-c3ccc(-c4nnn[n-]4)cc3)n2)cs1 ZINC000735657895 598721841 /nfs/dbraw/zinc/72/18/41/598721841.db2.gz WVZRRAQCHLVGHQ-UHFFFAOYSA-N -1 3 365.466 3.533 20 0 FHADHM CC(C)(C)c1nc(Cn2ccc(-c3ccc(-c4nn[n-]n4)cc3)n2)cs1 ZINC000735657895 598721843 /nfs/dbraw/zinc/72/18/43/598721843.db2.gz WVZRRAQCHLVGHQ-UHFFFAOYSA-N -1 3 365.466 3.533 20 0 FHADHM CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)C(F)(F)F)c2-c2nnn[n-]2)C1 ZINC000735598010 598728680 /nfs/dbraw/zinc/72/86/80/598728680.db2.gz WKWHHIWMBLUAJA-SSDOTTSWSA-N -1 3 373.404 3.580 20 0 FHADHM CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)C(F)(F)F)c2-c2nn[n-]n2)C1 ZINC000735598010 598728682 /nfs/dbraw/zinc/72/86/82/598728682.db2.gz WKWHHIWMBLUAJA-SSDOTTSWSA-N -1 3 373.404 3.580 20 0 FHADHM CCN(C(=O)c1ccc(F)c(C)c1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736508336 598736181 /nfs/dbraw/zinc/73/61/81/598736181.db2.gz KANJREBKPYYUDT-ZDUSSCGKSA-N -1 3 353.401 3.538 20 0 FHADHM CCN(C(=O)c1ccc(F)c(C)c1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736508336 598736182 /nfs/dbraw/zinc/73/61/82/598736182.db2.gz KANJREBKPYYUDT-ZDUSSCGKSA-N -1 3 353.401 3.538 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)C=C(CC)c1ccccc1 ZINC000736633792 598736425 /nfs/dbraw/zinc/73/64/25/598736425.db2.gz CWRHRXNTTJFJGW-YPKPFQOOSA-N -1 3 363.421 3.698 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)C=C(CC)c1ccccc1 ZINC000736633792 598736427 /nfs/dbraw/zinc/73/64/27/598736427.db2.gz CWRHRXNTTJFJGW-YPKPFQOOSA-N -1 3 363.421 3.698 20 0 FHADHM CC(C)(C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccccc1Cl ZINC000735580361 598737017 /nfs/dbraw/zinc/73/70/17/598737017.db2.gz CQJJCHJQMQHABU-UHFFFAOYSA-N -1 3 359.792 3.576 20 0 FHADHM CC(C)(C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccccc1Cl ZINC000735580361 598737019 /nfs/dbraw/zinc/73/70/19/598737019.db2.gz CQJJCHJQMQHABU-UHFFFAOYSA-N -1 3 359.792 3.576 20 0 FHADHM CC(C)CN(C(=O)[C@H](C)Cc1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000735819606 598741265 /nfs/dbraw/zinc/74/12/65/598741265.db2.gz ZIWRJHSFIPAEMU-MRXNPFEDSA-N -1 3 363.465 3.735 20 0 FHADHM CC(C)CN(C(=O)[C@H](C)Cc1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000735819606 598741266 /nfs/dbraw/zinc/74/12/66/598741266.db2.gz ZIWRJHSFIPAEMU-MRXNPFEDSA-N -1 3 363.465 3.735 20 0 FHADHM Clc1cc(NCc2cc(-c3ccccc3)no2)ccc1-c1nnn[n-]1 ZINC000737565746 598744775 /nfs/dbraw/zinc/74/47/75/598744775.db2.gz PWWWWRODIRBEFW-UHFFFAOYSA-N -1 3 352.785 3.787 20 0 FHADHM Clc1cc(NCc2cc(-c3ccccc3)no2)ccc1-c1nn[n-]n1 ZINC000737565746 598744777 /nfs/dbraw/zinc/74/47/77/598744777.db2.gz PWWWWRODIRBEFW-UHFFFAOYSA-N -1 3 352.785 3.787 20 0 FHADHM C[C@@H](SC1CCCC1)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736190524 598762991 /nfs/dbraw/zinc/76/29/91/598762991.db2.gz SZBAPNBUWZJMFG-SECBINFHSA-N -1 3 351.863 3.523 20 0 FHADHM C[C@@H](SC1CCCC1)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736190524 598762992 /nfs/dbraw/zinc/76/29/92/598762992.db2.gz SZBAPNBUWZJMFG-SECBINFHSA-N -1 3 351.863 3.523 20 0 FHADHM CC[C@H](Cc1ccccc1)C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000736351188 598763050 /nfs/dbraw/zinc/76/30/50/598763050.db2.gz PGXXCFKVZWZNMH-CYBMUJFWSA-N -1 3 355.829 3.728 20 0 FHADHM CC[C@H](Cc1ccccc1)C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000736351188 598763052 /nfs/dbraw/zinc/76/30/52/598763052.db2.gz PGXXCFKVZWZNMH-CYBMUJFWSA-N -1 3 355.829 3.728 20 0 FHADHM Cc1ccccc1[C@@H](C(C)C)N(C)C(=O)c1sccc1-c1nnn[n-]1 ZINC000737414932 598764846 /nfs/dbraw/zinc/76/48/46/598764846.db2.gz HKMBHLXZGMKMLF-OAHLLOKOSA-N -1 3 355.467 3.706 20 0 FHADHM Cc1ccccc1[C@@H](C(C)C)N(C)C(=O)c1sccc1-c1nn[n-]n1 ZINC000737414932 598764848 /nfs/dbraw/zinc/76/48/48/598764848.db2.gz HKMBHLXZGMKMLF-OAHLLOKOSA-N -1 3 355.467 3.706 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1cccc(C(F)F)c1 ZINC000736480955 598790144 /nfs/dbraw/zinc/79/01/44/598790144.db2.gz PXQURDAKLUOZEP-UHFFFAOYSA-N -1 3 371.391 3.857 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1cccc(C(F)F)c1 ZINC000736480955 598790145 /nfs/dbraw/zinc/79/01/45/598790145.db2.gz PXQURDAKLUOZEP-UHFFFAOYSA-N -1 3 371.391 3.857 20 0 FHADHM Clc1ccc(NCc2ccc(OC3CCCC3)nc2)c(-c2nnn[n-]2)c1 ZINC000737576160 598793863 /nfs/dbraw/zinc/79/38/63/598793863.db2.gz WRYZNRRMJATVAJ-UHFFFAOYSA-N -1 3 370.844 3.849 20 0 FHADHM Clc1ccc(NCc2ccc(OC3CCCC3)nc2)c(-c2nn[n-]n2)c1 ZINC000737576160 598793864 /nfs/dbraw/zinc/79/38/64/598793864.db2.gz WRYZNRRMJATVAJ-UHFFFAOYSA-N -1 3 370.844 3.849 20 0 FHADHM CC(C)[C@@H](c1ccccc1)N(C)C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000735733952 598797732 /nfs/dbraw/zinc/79/77/32/598797732.db2.gz DGJVDNVZSQSNRB-KRWDZBQOSA-N -1 3 350.426 3.728 20 0 FHADHM CC(C)[C@@H](c1ccccc1)N(C)C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000735733952 598797733 /nfs/dbraw/zinc/79/77/33/598797733.db2.gz DGJVDNVZSQSNRB-KRWDZBQOSA-N -1 3 350.426 3.728 20 0 FHADHM CC(C)[C@H](C)C(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000735702673 598804760 /nfs/dbraw/zinc/80/47/60/598804760.db2.gz QKOHLFIBSUMXGU-AWEZNQCLSA-N -1 3 365.437 3.676 20 0 FHADHM CC(C)[C@H](C)C(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000735702673 598804761 /nfs/dbraw/zinc/80/47/61/598804761.db2.gz QKOHLFIBSUMXGU-AWEZNQCLSA-N -1 3 365.437 3.676 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)N(C1CC1)[C@H]1CCCc2ccccc21 ZINC000738152472 598812958 /nfs/dbraw/zinc/81/29/58/598812958.db2.gz UYWOXZNLEAVKHA-IBGZPJMESA-N -1 3 374.448 3.941 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)N(C1CC1)[C@H]1CCCc2ccccc21 ZINC000738152472 598812960 /nfs/dbraw/zinc/81/29/60/598812960.db2.gz UYWOXZNLEAVKHA-IBGZPJMESA-N -1 3 374.448 3.941 20 0 FHADHM CCC[C@H](CC1CCCC1)C(=O)Oc1ccc(-c2nnn[n-]2)cc1OC ZINC000736422196 598821369 /nfs/dbraw/zinc/82/13/69/598821369.db2.gz IXDJVAKHOVKQSN-OAHLLOKOSA-N -1 3 358.442 3.777 20 0 FHADHM CCC[C@H](CC1CCCC1)C(=O)Oc1ccc(-c2nn[n-]n2)cc1OC ZINC000736422196 598821371 /nfs/dbraw/zinc/82/13/71/598821371.db2.gz IXDJVAKHOVKQSN-OAHLLOKOSA-N -1 3 358.442 3.777 20 0 FHADHM CCN(C(=O)CCc1ccc(Cl)s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736506185 599309952 /nfs/dbraw/zinc/30/99/52/599309952.db2.gz XKWLTALHSGUDDW-UHFFFAOYSA-N -1 3 361.858 3.567 20 0 FHADHM CCN(C(=O)CCc1ccc(Cl)s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736506185 599309955 /nfs/dbraw/zinc/30/99/55/599309955.db2.gz XKWLTALHSGUDDW-UHFFFAOYSA-N -1 3 361.858 3.567 20 0 FHADHM CCn1c(C)cc(C(=O)CS[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1C ZINC000736719979 599328558 /nfs/dbraw/zinc/32/85/58/599328558.db2.gz HZXHHMXXZPQLIV-AWEZNQCLSA-N -1 3 369.494 3.982 20 0 FHADHM CCn1c(C)cc(C(=O)CS[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1C ZINC000736719979 599328562 /nfs/dbraw/zinc/32/85/62/599328562.db2.gz HZXHHMXXZPQLIV-AWEZNQCLSA-N -1 3 369.494 3.982 20 0 FHADHM CCN(C(=O)CS[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)C1CCCCC1 ZINC000736504457 599331387 /nfs/dbraw/zinc/33/13/87/599331387.db2.gz DSXAULSSOVCXAG-AWEZNQCLSA-N -1 3 373.526 3.842 20 0 FHADHM CCN(C(=O)CS[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)C1CCCCC1 ZINC000736504457 599331390 /nfs/dbraw/zinc/33/13/90/599331390.db2.gz DSXAULSSOVCXAG-AWEZNQCLSA-N -1 3 373.526 3.842 20 0 FHADHM Cc1cccc(NC(=O)[C@@H](C)Sc2ccccc2-c2nnn[n-]2)c1C ZINC000822324254 599342593 /nfs/dbraw/zinc/34/25/93/599342593.db2.gz YHPLXKIMPPAMQA-CYBMUJFWSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1cccc(NC(=O)[C@@H](C)Sc2ccccc2-c2nn[n-]n2)c1C ZINC000822324254 599342595 /nfs/dbraw/zinc/34/25/95/599342595.db2.gz YHPLXKIMPPAMQA-CYBMUJFWSA-N -1 3 353.451 3.603 20 0 FHADHM O=C(Nc1ccsc1)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000738199046 599345015 /nfs/dbraw/zinc/34/50/15/599345015.db2.gz ROTOKXNWEQVFPL-UHFFFAOYSA-N -1 3 363.402 3.973 20 0 FHADHM O=C(Nc1ccsc1)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000738199046 599345017 /nfs/dbraw/zinc/34/50/17/599345017.db2.gz ROTOKXNWEQVFPL-UHFFFAOYSA-N -1 3 363.402 3.973 20 0 FHADHM CCN(C(=O)Nc1cc(F)cc(F)c1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736505726 599351974 /nfs/dbraw/zinc/35/19/74/599351974.db2.gz LIICGZVEQMUYMS-LLVKDONJSA-N -1 3 372.379 3.760 20 0 FHADHM CCN(C(=O)Nc1cc(F)cc(F)c1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736505726 599351977 /nfs/dbraw/zinc/35/19/77/599351977.db2.gz LIICGZVEQMUYMS-LLVKDONJSA-N -1 3 372.379 3.760 20 0 FHADHM Clc1cccc(CNc2ccc(Br)cc2-c2nnn[n-]2)c1 ZINC000737576120 599362475 /nfs/dbraw/zinc/36/24/75/599362475.db2.gz VVJUNLWEPVYLKN-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM Clc1cccc(CNc2ccc(Br)cc2-c2nn[n-]n2)c1 ZINC000737576120 599362477 /nfs/dbraw/zinc/36/24/77/599362477.db2.gz VVJUNLWEPVYLKN-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM C[C@@H](Nc1ccc(OCC(F)(F)F)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820455770 599365110 /nfs/dbraw/zinc/36/51/10/599365110.db2.gz NDJOXJTZIZVQJY-LLVKDONJSA-N -1 3 363.343 3.981 20 0 FHADHM C[C@@H](Nc1ccc(OCC(F)(F)F)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820455770 599365113 /nfs/dbraw/zinc/36/51/13/599365113.db2.gz NDJOXJTZIZVQJY-LLVKDONJSA-N -1 3 363.343 3.981 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CNc1ccc(C(=O)C(C)(C)C)cc1 ZINC000821736798 607371535 /nfs/dbraw/zinc/37/15/35/607371535.db2.gz OOCIPEXHEPTMPK-UHFFFAOYSA-N -1 3 365.437 3.716 20 0 FHADHM C[C@H](Nc1ccc(OC2CCCC2)nc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820455336 599373057 /nfs/dbraw/zinc/37/30/57/599373057.db2.gz HGSGGONYCLXBRJ-ZDUSSCGKSA-N -1 3 350.426 3.756 20 0 FHADHM C[C@H](Nc1ccc(OC2CCCC2)nc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820455336 599373060 /nfs/dbraw/zinc/37/30/60/599373060.db2.gz HGSGGONYCLXBRJ-ZDUSSCGKSA-N -1 3 350.426 3.756 20 0 FHADHM CSCCCC(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737180024 599374501 /nfs/dbraw/zinc/37/45/01/599374501.db2.gz AMSGXAQSZRBVNR-UHFFFAOYSA-N -1 3 369.450 3.741 20 0 FHADHM CSCCCC(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737180024 599374504 /nfs/dbraw/zinc/37/45/04/599374504.db2.gz AMSGXAQSZRBVNR-UHFFFAOYSA-N -1 3 369.450 3.741 20 0 FHADHM C[C@@H](Nc1ccc(Br)c(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820456135 599382228 /nfs/dbraw/zinc/38/22/28/599382228.db2.gz QIGFQIVYEFGUOV-SECBINFHSA-N -1 3 362.206 3.941 20 0 FHADHM C[C@@H](Nc1ccc(Br)c(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820456135 599382231 /nfs/dbraw/zinc/38/22/31/599382231.db2.gz QIGFQIVYEFGUOV-SECBINFHSA-N -1 3 362.206 3.941 20 0 FHADHM Cc1nc2ccccc2n1CCCNc1cc(Cl)ccc1-c1nnn[n-]1 ZINC000737490771 599397424 /nfs/dbraw/zinc/39/74/24/599397424.db2.gz WTBPNVMNYSHGAV-UHFFFAOYSA-N -1 3 367.844 3.680 20 0 FHADHM Cc1nc2ccccc2n1CCCNc1cc(Cl)ccc1-c1nn[n-]n1 ZINC000737490771 599397426 /nfs/dbraw/zinc/39/74/26/599397426.db2.gz WTBPNVMNYSHGAV-UHFFFAOYSA-N -1 3 367.844 3.680 20 0 FHADHM C[C@@H](NC(=O)N[C@@H](C)c1cccc(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820352311 599398708 /nfs/dbraw/zinc/39/87/08/599398708.db2.gz UFGPSGDAUXYXGQ-NEPJUHHUSA-N -1 3 370.844 3.642 20 0 FHADHM C[C@@H](NC(=O)N[C@@H](C)c1cccc(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820352311 599398711 /nfs/dbraw/zinc/39/87/11/599398711.db2.gz UFGPSGDAUXYXGQ-NEPJUHHUSA-N -1 3 370.844 3.642 20 0 FHADHM CC(C)Oc1ccc(CNc2cc(-c3nnn[n-]3)c3ccccc3n2)cc1 ZINC000735915609 599403605 /nfs/dbraw/zinc/40/36/05/599403605.db2.gz QULKWZCDHZFEGD-UHFFFAOYSA-N -1 3 360.421 3.814 20 0 FHADHM CC(C)Oc1ccc(CNc2cc(-c3nn[n-]n3)c3ccccc3n2)cc1 ZINC000735915609 599403608 /nfs/dbraw/zinc/40/36/08/599403608.db2.gz QULKWZCDHZFEGD-UHFFFAOYSA-N -1 3 360.421 3.814 20 0 FHADHM C[C@H](NC(=O)NCCCC1CCCCC1)c1cccc(-c2nnn[n-]2)c1 ZINC000820366907 599416255 /nfs/dbraw/zinc/41/62/55/599416255.db2.gz PMHLYKYRMKFZOT-AWEZNQCLSA-N -1 3 356.474 3.587 20 0 FHADHM C[C@H](NC(=O)NCCCC1CCCCC1)c1cccc(-c2nn[n-]n2)c1 ZINC000820366907 599416257 /nfs/dbraw/zinc/41/62/57/599416257.db2.gz PMHLYKYRMKFZOT-AWEZNQCLSA-N -1 3 356.474 3.587 20 0 FHADHM Fc1cccc(Cl)c1CNc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000737662693 599421116 /nfs/dbraw/zinc/42/11/16/599421116.db2.gz YEIXZBMNISELJL-UHFFFAOYSA-N -1 3 354.776 3.820 20 0 FHADHM Fc1cccc(Cl)c1CNc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000737662693 599421118 /nfs/dbraw/zinc/42/11/18/599421118.db2.gz YEIXZBMNISELJL-UHFFFAOYSA-N -1 3 354.776 3.820 20 0 FHADHM c1ccc([C@H](Nc2cc(-c3nnn[n-]3)c3ccccc3n2)[C@@H]2CCCO2)cc1 ZINC000738426568 599426153 /nfs/dbraw/zinc/42/61/53/599426153.db2.gz FLNTUFWLTJBVJV-ICSRJNTNSA-N -1 3 372.432 3.747 20 0 FHADHM c1ccc([C@H](Nc2cc(-c3nn[n-]n3)c3ccccc3n2)[C@@H]2CCCO2)cc1 ZINC000738426568 599426155 /nfs/dbraw/zinc/42/61/55/599426155.db2.gz FLNTUFWLTJBVJV-ICSRJNTNSA-N -1 3 372.432 3.747 20 0 FHADHM CN(Cc1ccc(F)cc1Cl)c1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000736820537 599431781 /nfs/dbraw/zinc/43/17/81/599431781.db2.gz XLDNTMCZAJGBHW-UHFFFAOYSA-N -1 3 368.803 3.844 20 0 FHADHM CN(Cc1ccc(F)cc1Cl)c1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000736820537 599431783 /nfs/dbraw/zinc/43/17/83/599431783.db2.gz XLDNTMCZAJGBHW-UHFFFAOYSA-N -1 3 368.803 3.844 20 0 FHADHM c1ccc(C[C@@H]2CCCN(c3cc(-c4nnn[n-]4)c4ccccc4n3)C2)cc1 ZINC000738426666 599432853 /nfs/dbraw/zinc/43/28/53/599432853.db2.gz FZEBDLXFESTZAX-KRWDZBQOSA-N -1 3 370.460 3.874 20 0 FHADHM c1ccc(C[C@@H]2CCCN(c3cc(-c4nn[n-]n4)c4ccccc4n3)C2)cc1 ZINC000738426666 599432855 /nfs/dbraw/zinc/43/28/55/599432855.db2.gz FZEBDLXFESTZAX-KRWDZBQOSA-N -1 3 370.460 3.874 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)N1CCCCC[C@@H]1c1ccco1 ZINC000737801814 599468842 /nfs/dbraw/zinc/46/88/42/599468842.db2.gz UPJAOQKIPIFFAA-WFTPILKQSA-N -1 3 363.421 3.617 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)N1CCCCC[C@@H]1c1ccco1 ZINC000737801814 599468845 /nfs/dbraw/zinc/46/88/45/599468845.db2.gz UPJAOQKIPIFFAA-WFTPILKQSA-N -1 3 363.421 3.617 20 0 FHADHM CCCC(=O)Nc1cccc(CNc2c(Cl)cccc2-c2nnn[n-]2)c1 ZINC000821008812 599480196 /nfs/dbraw/zinc/48/01/96/599480196.db2.gz LWFZZBRCCDUTQO-UHFFFAOYSA-N -1 3 370.844 3.871 20 0 FHADHM CCCC(=O)Nc1cccc(CNc2c(Cl)cccc2-c2nn[n-]n2)c1 ZINC000821008812 599480197 /nfs/dbraw/zinc/48/01/97/599480197.db2.gz LWFZZBRCCDUTQO-UHFFFAOYSA-N -1 3 370.844 3.871 20 0 FHADHM CCO[C@H](C)c1nc(CSCc2cccc(-c3nnn[n-]3)c2)cs1 ZINC000736612603 599480735 /nfs/dbraw/zinc/48/07/35/599480735.db2.gz ANZFEZHTPODEOY-LLVKDONJSA-N -1 3 361.496 3.854 20 0 FHADHM CCO[C@H](C)c1nc(CSCc2cccc(-c3nn[n-]n3)c2)cs1 ZINC000736612603 599480738 /nfs/dbraw/zinc/48/07/38/599480738.db2.gz ANZFEZHTPODEOY-LLVKDONJSA-N -1 3 361.496 3.854 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1NCc1ccnc(N2CCCCC2)c1 ZINC000822585598 599483718 /nfs/dbraw/zinc/48/37/18/599483718.db2.gz GOXHRNZKQZXIIW-UHFFFAOYSA-N -1 3 369.860 3.518 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1NCc1ccnc(N2CCCCC2)c1 ZINC000822585598 599483719 /nfs/dbraw/zinc/48/37/19/599483719.db2.gz GOXHRNZKQZXIIW-UHFFFAOYSA-N -1 3 369.860 3.518 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)N1CCCCC[C@H]1c1ccco1 ZINC000738151933 599493445 /nfs/dbraw/zinc/49/34/45/599493445.db2.gz KZUHZBGLFCJANA-HNNXBMFYSA-N -1 3 352.398 3.609 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)N1CCCCC[C@H]1c1ccco1 ZINC000738151933 599493447 /nfs/dbraw/zinc/49/34/47/599493447.db2.gz KZUHZBGLFCJANA-HNNXBMFYSA-N -1 3 352.398 3.609 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1NCc1cccc(Br)c1 ZINC000822586066 599504806 /nfs/dbraw/zinc/50/48/06/599504806.db2.gz RQYXIMFKXIXTMK-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1NCc1cccc(Br)c1 ZINC000822586066 599504807 /nfs/dbraw/zinc/50/48/07/599504807.db2.gz RQYXIMFKXIXTMK-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM COc1cc2ccccc2cc1C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821728375 599507747 /nfs/dbraw/zinc/50/77/47/599507747.db2.gz VLXQHEUZTHPVIE-CYBMUJFWSA-N -1 3 373.416 3.520 20 0 FHADHM COc1cc2ccccc2cc1C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821728375 599507748 /nfs/dbraw/zinc/50/77/48/599507748.db2.gz VLXQHEUZTHPVIE-CYBMUJFWSA-N -1 3 373.416 3.520 20 0 FHADHM CN(C[C@H]1CCCO[C@@H]1c1ccccc1)c1ccc(F)cc1-c1nnn[n-]1 ZINC000821596805 599508172 /nfs/dbraw/zinc/50/81/72/599508172.db2.gz VRKVLYHBIOAXPY-DNVCBOLYSA-N -1 3 367.428 3.610 20 0 FHADHM CN(C[C@H]1CCCO[C@@H]1c1ccccc1)c1ccc(F)cc1-c1nn[n-]n1 ZINC000821596805 599508174 /nfs/dbraw/zinc/50/81/74/599508174.db2.gz VRKVLYHBIOAXPY-DNVCBOLYSA-N -1 3 367.428 3.610 20 0 FHADHM CC(C)[C@@H](CC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000820323789 599508646 /nfs/dbraw/zinc/50/86/46/599508646.db2.gz ZBOZAYGOBYUCTH-HNAYVOBHSA-N -1 3 363.465 3.874 20 0 FHADHM CC(C)[C@@H](CC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000820323789 599508648 /nfs/dbraw/zinc/50/86/48/599508648.db2.gz ZBOZAYGOBYUCTH-HNAYVOBHSA-N -1 3 363.465 3.874 20 0 FHADHM Cc1nc([C@@H]2CCCN(c3ccc(-c4nnn[n-]4)c(Cl)c3)C2)sc1C ZINC000822436798 599509514 /nfs/dbraw/zinc/50/95/14/599509514.db2.gz RCXJFUWOKGAHJP-GFCCVEGCSA-N -1 3 374.901 3.977 20 0 FHADHM Cc1nc([C@@H]2CCCN(c3ccc(-c4nn[n-]n4)c(Cl)c3)C2)sc1C ZINC000822436798 599509516 /nfs/dbraw/zinc/50/95/16/599509516.db2.gz RCXJFUWOKGAHJP-GFCCVEGCSA-N -1 3 374.901 3.977 20 0 FHADHM COCc1ccc(CNc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)cc1 ZINC000737018663 599520838 /nfs/dbraw/zinc/52/08/38/599520838.db2.gz ZKUCFCKHNZIPQQ-UHFFFAOYSA-N -1 3 363.343 3.644 20 0 FHADHM Fc1cccc(OCCNc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)c1 ZINC000737666589 599522084 /nfs/dbraw/zinc/52/20/84/599522084.db2.gz ZYTOHQWFBAFFOM-UHFFFAOYSA-N -1 3 367.306 3.516 20 0 FHADHM CC[C@H](C)[C@H](C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000820860855 599532056 /nfs/dbraw/zinc/53/20/56/599532056.db2.gz KVQSAUYFIIDDMR-DOXZYTNZSA-N -1 3 363.465 3.874 20 0 FHADHM CC[C@H](C)[C@H](C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000820860855 599532059 /nfs/dbraw/zinc/53/20/59/599532059.db2.gz KVQSAUYFIIDDMR-DOXZYTNZSA-N -1 3 363.465 3.874 20 0 FHADHM CC[C@H](C)[C@@H](C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000820860861 599532588 /nfs/dbraw/zinc/53/25/88/599532588.db2.gz KVQSAUYFIIDDMR-QMTMVMCOSA-N -1 3 363.465 3.874 20 0 FHADHM CC[C@H](C)[C@@H](C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000820860861 599532590 /nfs/dbraw/zinc/53/25/90/599532590.db2.gz KVQSAUYFIIDDMR-QMTMVMCOSA-N -1 3 363.465 3.874 20 0 FHADHM Cc1cc2cc(C(=O)N[C@@H](C)c3cccc(-c4nnn[n-]4)c3)oc2cc1C ZINC000822212722 599535199 /nfs/dbraw/zinc/53/51/99/599535199.db2.gz DXTSFJHHKVQUMX-ZDUSSCGKSA-N -1 3 361.405 3.721 20 0 FHADHM Cc1cc2cc(C(=O)N[C@@H](C)c3cccc(-c4nn[n-]n4)c3)oc2cc1C ZINC000822212722 599535202 /nfs/dbraw/zinc/53/52/02/599535202.db2.gz DXTSFJHHKVQUMX-ZDUSSCGKSA-N -1 3 361.405 3.721 20 0 FHADHM Fc1cc(F)c2ncc(-c3nnn[n-]3)c(N3CCC4(CCCC4)CC3)c2c1 ZINC000737644757 599537065 /nfs/dbraw/zinc/53/70/65/599537065.db2.gz LPJFHUILPDDTHW-UHFFFAOYSA-N -1 3 370.407 3.854 20 0 FHADHM Fc1cc(F)c2ncc(-c3nn[n-]n3)c(N3CCC4(CCCC4)CC3)c2c1 ZINC000737644757 599537068 /nfs/dbraw/zinc/53/70/68/599537068.db2.gz LPJFHUILPDDTHW-UHFFFAOYSA-N -1 3 370.407 3.854 20 0 FHADHM Cc1ccc(CCC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1Cl ZINC000822235221 599538247 /nfs/dbraw/zinc/53/82/47/599538247.db2.gz XPWZQRAXKOEPGJ-ZDUSSCGKSA-N -1 3 369.856 3.639 20 0 FHADHM Cc1ccc(CCC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1Cl ZINC000822235221 599538250 /nfs/dbraw/zinc/53/82/50/599538250.db2.gz XPWZQRAXKOEPGJ-ZDUSSCGKSA-N -1 3 369.856 3.639 20 0 FHADHM CCc1ccc([C@H](C)CC(=O)Oc2ccc(-c3nnn[n-]3)cc2OC)cc1 ZINC000736685933 599540402 /nfs/dbraw/zinc/54/04/02/599540402.db2.gz MYBQMTJDRBBCQN-CYBMUJFWSA-N -1 3 366.421 3.537 20 0 FHADHM CCc1ccc([C@H](C)CC(=O)Oc2ccc(-c3nn[n-]n3)cc2OC)cc1 ZINC000736685933 599540403 /nfs/dbraw/zinc/54/04/03/599540403.db2.gz MYBQMTJDRBBCQN-CYBMUJFWSA-N -1 3 366.421 3.537 20 0 FHADHM CC(C)CN(C(=O)[C@@H](C)c1ccsc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000735818608 599541415 /nfs/dbraw/zinc/54/14/15/599541415.db2.gz OKDVJWTYRFPOHU-ZDUSSCGKSA-N -1 3 355.467 3.721 20 0 FHADHM CC(C)CN(C(=O)[C@@H](C)c1ccsc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000735818608 599541417 /nfs/dbraw/zinc/54/14/17/599541417.db2.gz OKDVJWTYRFPOHU-ZDUSSCGKSA-N -1 3 355.467 3.721 20 0 FHADHM CC[C@@H](CC(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccc(C)cc1 ZINC000736331293 599542099 /nfs/dbraw/zinc/54/20/99/599542099.db2.gz IWAUMVCHTQJMCO-CVEARBPZSA-N -1 3 363.465 3.936 20 0 FHADHM CC[C@@H](CC(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccc(C)cc1 ZINC000736331293 599542101 /nfs/dbraw/zinc/54/21/01/599542101.db2.gz IWAUMVCHTQJMCO-CVEARBPZSA-N -1 3 363.465 3.936 20 0 FHADHM CCc1ccc([C@H](C)CC(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)cc1 ZINC000736692161 599545298 /nfs/dbraw/zinc/54/52/98/599545298.db2.gz ZOBWRXSATOVNTQ-GFCCVEGCSA-N -1 3 353.401 3.701 20 0 FHADHM CCc1ccc([C@H](C)CC(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)cc1 ZINC000736692161 599545301 /nfs/dbraw/zinc/54/53/01/599545301.db2.gz ZOBWRXSATOVNTQ-GFCCVEGCSA-N -1 3 353.401 3.701 20 0 FHADHM Cc1cc(C)c2ncc(-c3nnn[n-]3)c(N3CC[C@H](c4ccco4)C3)c2c1 ZINC000822195554 599547242 /nfs/dbraw/zinc/54/72/42/599547242.db2.gz WCSDGVKBNWOEMQ-AWEZNQCLSA-N -1 3 360.421 3.619 20 0 FHADHM Cc1cc(C)c2ncc(-c3nn[n-]n3)c(N3CC[C@H](c4ccco4)C3)c2c1 ZINC000822195554 599547244 /nfs/dbraw/zinc/54/72/44/599547244.db2.gz WCSDGVKBNWOEMQ-AWEZNQCLSA-N -1 3 360.421 3.619 20 0 FHADHM Cc1cc(C)c2ncc(-c3nnn[n-]3)c(N3CC[C@@H](c4ccco4)C3)c2c1 ZINC000822195555 599547683 /nfs/dbraw/zinc/54/76/83/599547683.db2.gz WCSDGVKBNWOEMQ-CQSZACIVSA-N -1 3 360.421 3.619 20 0 FHADHM Cc1cc(C)c2ncc(-c3nn[n-]n3)c(N3CC[C@@H](c4ccco4)C3)c2c1 ZINC000822195555 599547685 /nfs/dbraw/zinc/54/76/85/599547685.db2.gz WCSDGVKBNWOEMQ-CQSZACIVSA-N -1 3 360.421 3.619 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1N[C@H]1CCCN(c2ccccc2)C1 ZINC000822581144 599560558 /nfs/dbraw/zinc/56/05/58/599560558.db2.gz BYJRQVUTNMOBIG-ZDUSSCGKSA-N -1 3 354.845 3.601 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1N[C@H]1CCCN(c2ccccc2)C1 ZINC000822581144 599560560 /nfs/dbraw/zinc/56/05/60/599560560.db2.gz BYJRQVUTNMOBIG-ZDUSSCGKSA-N -1 3 354.845 3.601 20 0 FHADHM Cc1cccc(NC2CCN(c3c(Cl)cccc3-c3nnn[n-]3)CC2)c1 ZINC000822323694 599571947 /nfs/dbraw/zinc/57/19/47/599571947.db2.gz MTMYTFYPXBBYJU-UHFFFAOYSA-N -1 3 368.872 3.909 20 0 FHADHM Cc1cccc(NC2CCN(c3c(Cl)cccc3-c3nn[n-]n3)CC2)c1 ZINC000822323694 599571948 /nfs/dbraw/zinc/57/19/48/599571948.db2.gz MTMYTFYPXBBYJU-UHFFFAOYSA-N -1 3 368.872 3.909 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1NCc1coc(-c2ccccc2)n1 ZINC000822585903 599585973 /nfs/dbraw/zinc/58/59/73/599585973.db2.gz OIPRSKFDVXYBNW-UHFFFAOYSA-N -1 3 352.785 3.787 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1NCc1coc(-c2ccccc2)n1 ZINC000822585903 599585975 /nfs/dbraw/zinc/58/59/75/599585975.db2.gz OIPRSKFDVXYBNW-UHFFFAOYSA-N -1 3 352.785 3.787 20 0 FHADHM CC[C@@H](C)[C@H]1CCCCN1C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000736330634 599599518 /nfs/dbraw/zinc/59/95/18/599599518.db2.gz NBXDFPDCTGRMAA-UKRRQHHQSA-N -1 3 373.505 3.856 20 0 FHADHM CC[C@@H](C)[C@H]1CCCCN1C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000736330634 599599519 /nfs/dbraw/zinc/59/95/19/599599519.db2.gz NBXDFPDCTGRMAA-UKRRQHHQSA-N -1 3 373.505 3.856 20 0 FHADHM O=C(OCc1ccccc1-c1nnn[n-]1)C1(c2cccs2)CCCCC1 ZINC000738235891 599606159 /nfs/dbraw/zinc/60/61/59/599606159.db2.gz YDIYTCMRTIKYLO-UHFFFAOYSA-N -1 3 368.462 3.874 20 0 FHADHM O=C(OCc1ccccc1-c1nn[n-]n1)C1(c2cccs2)CCCCC1 ZINC000738235891 599606162 /nfs/dbraw/zinc/60/61/62/599606162.db2.gz YDIYTCMRTIKYLO-UHFFFAOYSA-N -1 3 368.462 3.874 20 0 FHADHM O=C(OCc1cccc(-c2nnn[n-]2)c1)C1(c2cccs2)CCCCC1 ZINC000738233204 599606525 /nfs/dbraw/zinc/60/65/25/599606525.db2.gz RATVSWFFEWWCCJ-UHFFFAOYSA-N -1 3 368.462 3.874 20 0 FHADHM O=C(OCc1cccc(-c2nn[n-]n2)c1)C1(c2cccs2)CCCCC1 ZINC000738233204 599606526 /nfs/dbraw/zinc/60/65/26/599606526.db2.gz RATVSWFFEWWCCJ-UHFFFAOYSA-N -1 3 368.462 3.874 20 0 FHADHM CC[C@@H](C)[C@H]1CCCCN1C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736333242 599608605 /nfs/dbraw/zinc/60/86/05/599608605.db2.gz URPAMKSQLPTWSK-IAQYHMDHSA-N -1 3 362.865 3.953 20 0 FHADHM CC[C@@H](C)[C@H]1CCCCN1C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736333242 599608606 /nfs/dbraw/zinc/60/86/06/599608606.db2.gz URPAMKSQLPTWSK-IAQYHMDHSA-N -1 3 362.865 3.953 20 0 FHADHM CC(C)(NC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1cccc(Cl)c1 ZINC000735671708 599611459 /nfs/dbraw/zinc/61/14/59/599611459.db2.gz BXJFOEFAPPHUTB-UHFFFAOYSA-N -1 3 374.807 3.716 20 0 FHADHM CC(C)(NC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1cccc(Cl)c1 ZINC000735671708 599611462 /nfs/dbraw/zinc/61/14/62/599611462.db2.gz BXJFOEFAPPHUTB-UHFFFAOYSA-N -1 3 374.807 3.716 20 0 FHADHM Cc1nc(C2CCCC2)sc1C(=O)Oc1ccc(-c2nnn[n-]2)cc1 ZINC000822432158 599620866 /nfs/dbraw/zinc/62/08/66/599620866.db2.gz ZILKVRRQTRZEQS-UHFFFAOYSA-N -1 3 355.423 3.508 20 0 FHADHM Cc1nc(C2CCCC2)sc1C(=O)Oc1ccc(-c2nn[n-]n2)cc1 ZINC000822432158 599620867 /nfs/dbraw/zinc/62/08/67/599620867.db2.gz ZILKVRRQTRZEQS-UHFFFAOYSA-N -1 3 355.423 3.508 20 0 FHADHM COc1ccc(OC(=O)C=Cc2ccccc2-c2nnn[n-]2)c2ccccc12 ZINC000821838095 599627350 /nfs/dbraw/zinc/62/73/50/599627350.db2.gz KGUQCXZVKLXHRH-RAXLEYEMSA-N -1 3 372.384 3.647 20 0 FHADHM COc1ccc(OC(=O)C=Cc2ccccc2-c2nn[n-]n2)c2ccccc12 ZINC000821838095 599627351 /nfs/dbraw/zinc/62/73/51/599627351.db2.gz KGUQCXZVKLXHRH-RAXLEYEMSA-N -1 3 372.384 3.647 20 0 FHADHM COc1ccc(OC(=O)CCc2ccc(-c3nnn[n-]3)cc2)c2ccccc12 ZINC000821838951 599627391 /nfs/dbraw/zinc/62/73/91/599627391.db2.gz RLHADFTWNXHXPY-UHFFFAOYSA-N -1 3 374.400 3.567 20 0 FHADHM COc1ccc(OC(=O)CCc2ccc(-c3nn[n-]n3)cc2)c2ccccc12 ZINC000821838951 599627392 /nfs/dbraw/zinc/62/73/92/599627392.db2.gz RLHADFTWNXHXPY-UHFFFAOYSA-N -1 3 374.400 3.567 20 0 FHADHM CC(=CC(=O)Nc1ccccc1-c1nnn[n-]1)c1cccc(C(F)(F)F)c1 ZINC000819765384 599627670 /nfs/dbraw/zinc/62/76/70/599627670.db2.gz PFDXJKQCFTVPLZ-LUAWRHEFSA-N -1 3 373.338 3.928 20 0 FHADHM CC(=CC(=O)Nc1ccccc1-c1nn[n-]n1)c1cccc(C(F)(F)F)c1 ZINC000819765384 599627671 /nfs/dbraw/zinc/62/76/71/599627671.db2.gz PFDXJKQCFTVPLZ-LUAWRHEFSA-N -1 3 373.338 3.928 20 0 FHADHM CCC(C)(C)COC(=O)c1ccc(Oc2ccc(-c3nnn[n-]3)cn2)cc1 ZINC000820847956 599627818 /nfs/dbraw/zinc/62/78/18/599627818.db2.gz NUKWZLVNVIONLZ-UHFFFAOYSA-N -1 3 367.409 3.647 20 0 FHADHM CCC(C)(C)COC(=O)c1ccc(Oc2ccc(-c3nn[n-]n3)cn2)cc1 ZINC000820847956 599627819 /nfs/dbraw/zinc/62/78/19/599627819.db2.gz NUKWZLVNVIONLZ-UHFFFAOYSA-N -1 3 367.409 3.647 20 0 FHADHM Cc1ccc([C@@H](C)C(=O)Nc2sc3c(c2-c2nnn[n-]2)CC[C@@H](C)C3)o1 ZINC000822227637 599628679 /nfs/dbraw/zinc/62/86/79/599628679.db2.gz QDWHPRTVMDPHOJ-MWLCHTKSSA-N -1 3 371.466 3.697 20 0 FHADHM Cc1ccc([C@@H](C)C(=O)Nc2sc3c(c2-c2nn[n-]n2)CC[C@@H](C)C3)o1 ZINC000822227637 599628680 /nfs/dbraw/zinc/62/86/80/599628680.db2.gz QDWHPRTVMDPHOJ-MWLCHTKSSA-N -1 3 371.466 3.697 20 0 FHADHM Cc1cccc(C)c1C(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)CC(C)C ZINC000822293540 599630044 /nfs/dbraw/zinc/63/00/44/599630044.db2.gz BJIZCDHUTUWBIR-UHFFFAOYSA-N -1 3 363.465 3.782 20 0 FHADHM Cc1cccc(C)c1C(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)CC(C)C ZINC000822293540 599630045 /nfs/dbraw/zinc/63/00/45/599630045.db2.gz BJIZCDHUTUWBIR-UHFFFAOYSA-N -1 3 363.465 3.782 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)c2cccc(F)c2Cl)s1 ZINC000821466705 599630457 /nfs/dbraw/zinc/63/04/57/599630457.db2.gz YZFZBPCVQAADCQ-UHFFFAOYSA-N -1 3 351.794 3.535 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)c2cccc(F)c2Cl)s1 ZINC000821466705 599630458 /nfs/dbraw/zinc/63/04/58/599630458.db2.gz YZFZBPCVQAADCQ-UHFFFAOYSA-N -1 3 351.794 3.535 20 0 FHADHM Cc1ccsc1C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000822378898 599633175 /nfs/dbraw/zinc/63/31/75/599633175.db2.gz HEXUVCLOKCGKKT-UHFFFAOYSA-N -1 3 353.329 3.508 20 0 FHADHM Cc1ccsc1C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000822378898 599633176 /nfs/dbraw/zinc/63/31/76/599633176.db2.gz HEXUVCLOKCGKKT-UHFFFAOYSA-N -1 3 353.329 3.508 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)c1coc2ccccc12 ZINC000823303471 599633961 /nfs/dbraw/zinc/63/39/61/599633961.db2.gz JLCXLLVQCROGDP-UHFFFAOYSA-N -1 3 373.294 3.884 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)c1coc2ccccc12 ZINC000823303471 599633962 /nfs/dbraw/zinc/63/39/62/599633962.db2.gz JLCXLLVQCROGDP-UHFFFAOYSA-N -1 3 373.294 3.884 20 0 FHADHM Cc1ccc(F)cc1C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000822240892 599634848 /nfs/dbraw/zinc/63/48/48/599634848.db2.gz CZJZHVNQYDOVSK-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM Cc1ccc(F)cc1C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000822240892 599634849 /nfs/dbraw/zinc/63/48/49/599634849.db2.gz CZJZHVNQYDOVSK-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM CCC(=CC(=O)NCc1ccc(-c2nnn[n-]2)cc1)c1cccc(Cl)c1 ZINC000820833458 599647732 /nfs/dbraw/zinc/64/77/32/599647732.db2.gz XRNFFBWPGRKRKK-KAMYIIQDSA-N -1 3 367.840 3.630 20 0 FHADHM CCC(=CC(=O)NCc1ccc(-c2nn[n-]n2)cc1)c1cccc(Cl)c1 ZINC000820833458 599647733 /nfs/dbraw/zinc/64/77/33/599647733.db2.gz XRNFFBWPGRKRKK-KAMYIIQDSA-N -1 3 367.840 3.630 20 0 FHADHM C[C@@H](C(=O)OCc1ccc(-c2nnn[n-]2)cc1F)c1cccc(Cl)c1 ZINC000819884759 599665039 /nfs/dbraw/zinc/66/50/39/599665039.db2.gz ZCVNQSBJNLQHGL-SNVBAGLBSA-N -1 3 360.776 3.506 20 0 FHADHM C[C@@H](C(=O)OCc1ccc(-c2nn[n-]n2)cc1F)c1cccc(Cl)c1 ZINC000819884759 599665040 /nfs/dbraw/zinc/66/50/40/599665040.db2.gz ZCVNQSBJNLQHGL-SNVBAGLBSA-N -1 3 360.776 3.506 20 0 FHADHM C[C@@H](C(=O)OCc1cc(-c2nnn[n-]2)ccc1F)c1cccc(Cl)c1 ZINC000819884213 599665518 /nfs/dbraw/zinc/66/55/18/599665518.db2.gz UMHBLBVTJSWRKA-SNVBAGLBSA-N -1 3 360.776 3.506 20 0 FHADHM C[C@@H](C(=O)OCc1cc(-c2nn[n-]n2)ccc1F)c1cccc(Cl)c1 ZINC000819884213 599665519 /nfs/dbraw/zinc/66/55/19/599665519.db2.gz UMHBLBVTJSWRKA-SNVBAGLBSA-N -1 3 360.776 3.506 20 0 FHADHM C[C@H](NC(=O)N[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1cccc(-c2nnn[n-]2)c1 ZINC000820356686 599666992 /nfs/dbraw/zinc/66/69/92/599666992.db2.gz ASXSHRLTHOBHLN-KJGCVMFHSA-N -1 3 368.485 3.586 20 0 FHADHM C[C@H](NC(=O)N[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1cccc(-c2nn[n-]n2)c1 ZINC000820356686 599666993 /nfs/dbraw/zinc/66/69/93/599666993.db2.gz ASXSHRLTHOBHLN-KJGCVMFHSA-N -1 3 368.485 3.586 20 0 FHADHM C[C@H](Nc1c(F)cc(-c2nnn[n-]2)cc1F)c1cccc(-n2cccn2)c1 ZINC000820450997 599687152 /nfs/dbraw/zinc/68/71/52/599687152.db2.gz QQAOQCCCIUQQJQ-NSHDSACASA-N -1 3 367.363 3.504 20 0 FHADHM C[C@H](Nc1c(F)cc(-c2nn[n-]n2)cc1F)c1cccc(-n2cccn2)c1 ZINC000820450997 599687153 /nfs/dbraw/zinc/68/71/53/599687153.db2.gz QQAOQCCCIUQQJQ-NSHDSACASA-N -1 3 367.363 3.504 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)c1ccc2c(c1)-c1ccccc1C2 ZINC000729356449 599693377 /nfs/dbraw/zinc/69/33/77/599693377.db2.gz BHLQENZAUJOVTM-UHFFFAOYSA-N -1 3 353.385 3.690 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)c1ccc2c(c1)-c1ccccc1C2 ZINC000729356449 599693378 /nfs/dbraw/zinc/69/33/78/599693378.db2.gz BHLQENZAUJOVTM-UHFFFAOYSA-N -1 3 353.385 3.690 20 0 FHADHM Cc1cccc(NC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1Cl ZINC000822324107 599694038 /nfs/dbraw/zinc/69/40/38/599694038.db2.gz VRJOWVIMVSUKPL-LLVKDONJSA-N -1 3 356.817 3.711 20 0 FHADHM Cc1cccc(NC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1Cl ZINC000822324107 599694039 /nfs/dbraw/zinc/69/40/39/599694039.db2.gz VRJOWVIMVSUKPL-LLVKDONJSA-N -1 3 356.817 3.711 20 0 FHADHM O=C([O-])[C@H](c1ccc(F)cc1)N1CCC(Oc2ccc(F)cc2F)CC1 ZINC000570975873 599710177 /nfs/dbraw/zinc/71/01/77/599710177.db2.gz KXXWFSSDCJIVBA-SFHVURJKSA-N -1 3 365.351 3.773 20 0 FHADHM Cc1ccc(C(=O)[O-])cc1NC(=O)CN[C@H](c1ccccc1)C1CCC1 ZINC000738533954 599793113 /nfs/dbraw/zinc/79/31/13/599793113.db2.gz WVJGHLPZSIYEDP-HXUWFJFHSA-N -1 3 352.434 3.763 20 0 FHADHM CCCN(Cc1cc(C)c(C(=O)[O-])o1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000737019780 599793743 /nfs/dbraw/zinc/79/37/43/599793743.db2.gz NGXUSPDUJGKNSP-AWEZNQCLSA-N -1 3 366.458 3.508 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)ccc1OC(=O)CCCc1sccc1C ZINC000825609519 607399094 /nfs/dbraw/zinc/39/90/94/607399094.db2.gz OKKWWIVFOULBEZ-UHFFFAOYSA-N -1 3 372.450 3.564 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)ccc1OC(=O)CCCc1sccc1C ZINC000825609519 607399097 /nfs/dbraw/zinc/39/90/97/607399097.db2.gz OKKWWIVFOULBEZ-UHFFFAOYSA-N -1 3 372.450 3.564 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)O[C@@H](c1ccccc1)c1ccccn1 ZINC000826251094 607399617 /nfs/dbraw/zinc/39/96/17/607399617.db2.gz FDVJNAGYCRTGHM-IBGZPJMESA-N -1 3 371.400 3.517 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)O[C@@H](c1ccccc1)c1ccccn1 ZINC000826251094 607399619 /nfs/dbraw/zinc/39/96/19/607399619.db2.gz FDVJNAGYCRTGHM-IBGZPJMESA-N -1 3 371.400 3.517 20 0 FHADHM CC(C)CN(CCC(=O)[O-])Cc1nnc(-c2c(Cl)cccc2Cl)o1 ZINC000736432692 599848982 /nfs/dbraw/zinc/84/89/82/599848982.db2.gz SXNOCXJEVSNQIA-UHFFFAOYSA-N -1 3 372.252 3.976 20 0 FHADHM O=C([O-])N1CCC[C@H](NCc2ccc(-c3nc4ccccc4s3)o2)C1 ZINC000739928597 599860623 /nfs/dbraw/zinc/86/06/23/599860623.db2.gz VAZWDAAUIAESNU-LBPRGKRZSA-N -1 3 357.435 3.788 20 0 FHADHM O=C([O-])c1cc(F)ccc1CN1CCC([C@H](O)c2ccc(F)cc2)CC1 ZINC000740079289 599867776 /nfs/dbraw/zinc/86/77/76/599867776.db2.gz OLTCOOBTZMXCOJ-LJQANCHMSA-N -1 3 361.388 3.609 20 0 FHADHM CC(C)Oc1ccc(NC(=O)c2cc3ccccc3o2)cc1-c1nnn[n-]1 ZINC000820169091 607403310 /nfs/dbraw/zinc/40/33/10/607403310.db2.gz DZGCONNKTSWHOD-UHFFFAOYSA-N -1 3 363.377 3.652 20 0 FHADHM CC(C)Oc1ccc(NC(=O)c2cc3ccccc3o2)cc1-c1nn[n-]n1 ZINC000820169091 607403312 /nfs/dbraw/zinc/40/33/12/607403312.db2.gz DZGCONNKTSWHOD-UHFFFAOYSA-N -1 3 363.377 3.652 20 0 FHADHM Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@H]1N2C(=O)c1cccc(NC(=O)[O-])c1 ZINC000738669819 599899028 /nfs/dbraw/zinc/89/90/28/599899028.db2.gz IUDKDHLHCFDKGK-PKOBYXMFSA-N -1 3 365.433 3.533 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1COC(=O)C[C@H](C)c1ccccc1F ZINC000826253709 607406765 /nfs/dbraw/zinc/40/67/65/607406765.db2.gz ZQNLLMXVCQRPHV-ZDUSSCGKSA-N -1 3 354.385 3.551 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1COC(=O)C[C@H](C)c1ccccc1F ZINC000826253709 607406767 /nfs/dbraw/zinc/40/67/67/607406767.db2.gz ZQNLLMXVCQRPHV-ZDUSSCGKSA-N -1 3 354.385 3.551 20 0 FHADHM CC(C)(NCc1csc(-c2cccc(Br)c2)n1)C(=O)[O-] ZINC000563674637 599925504 /nfs/dbraw/zinc/92/55/04/599925504.db2.gz ZFIBBTXZGKVOLF-UHFFFAOYSA-N -1 3 355.257 3.525 20 0 FHADHM Cc1ccc([C@H](CNC(=O)c2cccc(NC(=O)[O-])c2)N2CCCC2)cc1 ZINC000738566223 599934880 /nfs/dbraw/zinc/93/48/80/599934880.db2.gz AWZQQTWGMOWUBO-IBGZPJMESA-N -1 3 367.449 3.652 20 0 FHADHM Cc1cc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)ccc1C(=O)[O-] ZINC000738443762 600018145 /nfs/dbraw/zinc/01/81/45/600018145.db2.gz XZPKSEKDDBPPFV-INIZCTEOSA-N -1 3 373.478 3.713 20 0 FHADHM CC(=O)N1CCCCC[C@H]1C1CCN([C@H](C)c2ccc(C(=O)[O-])o2)CC1 ZINC000736136194 600077263 /nfs/dbraw/zinc/07/72/63/600077263.db2.gz VFWSDBYUOXGBQO-PBHICJAKSA-N -1 3 362.470 3.542 20 0 FHADHM CCCCc1ccc([C@H](NCC(=O)N2CCC(C(=O)[O-])CC2)C(C)C)cc1 ZINC000737000843 600096905 /nfs/dbraw/zinc/09/69/05/600096905.db2.gz DSCUZERKCHGZOX-OAQYLSRUSA-N -1 3 374.525 3.639 20 0 FHADHM CCCc1cc(C(=O)NC2(c3cccc(-c4nnn[n-]4)c3)CC2)sc1C ZINC000825348458 607422473 /nfs/dbraw/zinc/42/24/73/607422473.db2.gz LMXMUYVBGZNLTE-UHFFFAOYSA-N -1 3 367.478 3.608 20 0 FHADHM CCCc1cc(C(=O)NC2(c3cccc(-c4nn[n-]n4)c3)CC2)sc1C ZINC000825348458 607422475 /nfs/dbraw/zinc/42/24/75/607422475.db2.gz LMXMUYVBGZNLTE-UHFFFAOYSA-N -1 3 367.478 3.608 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H]2C[C@@H]2c2sccc2C)c1-c1nnn[n-]1 ZINC000825688256 607431360 /nfs/dbraw/zinc/43/13/60/607431360.db2.gz VPOZMCOKIBQDSN-RYUDHWBXSA-N -1 3 373.507 3.911 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H]2C[C@@H]2c2sccc2C)c1-c1nn[n-]n1 ZINC000825688256 607431361 /nfs/dbraw/zinc/43/13/61/607431361.db2.gz VPOZMCOKIBQDSN-RYUDHWBXSA-N -1 3 373.507 3.911 20 0 FHADHM CCC[C@@H]1CCCN(C(=O)Nc2ccc(OC(C)C)c(-c3nnn[n-]3)c2)C1 ZINC000821040115 607431566 /nfs/dbraw/zinc/43/15/66/607431566.db2.gz IPTQJGRKEIOPHV-CQSZACIVSA-N -1 3 372.473 3.698 20 0 FHADHM CCC[C@@H]1CCCN(C(=O)Nc2ccc(OC(C)C)c(-c3nn[n-]n3)c2)C1 ZINC000821040115 607431568 /nfs/dbraw/zinc/43/15/68/607431568.db2.gz IPTQJGRKEIOPHV-CQSZACIVSA-N -1 3 372.473 3.698 20 0 FHADHM O=C([O-])c1ccc2c(cnn2CN(CCc2ccc(F)cc2)C2CC2)c1 ZINC000740202283 600260258 /nfs/dbraw/zinc/26/02/58/600260258.db2.gz GVZWKZPPFZVKBY-UHFFFAOYSA-N -1 3 353.397 3.538 20 0 FHADHM C[C@H](C(=O)N(C)c1ccc(-c2nnn[n-]2)cc1)c1ccc2ccccc2c1 ZINC000824041208 607432610 /nfs/dbraw/zinc/43/26/10/607432610.db2.gz ZIEHLKKIIIAQEG-AWEZNQCLSA-N -1 3 357.417 3.786 20 0 FHADHM C[C@H](C(=O)N(C)c1ccc(-c2nn[n-]n2)cc1)c1ccc2ccccc2c1 ZINC000824041208 607432612 /nfs/dbraw/zinc/43/26/12/607432612.db2.gz ZIEHLKKIIIAQEG-AWEZNQCLSA-N -1 3 357.417 3.786 20 0 FHADHM O=C([O-])c1ccc2c(cnn2CN2CC[C@@H](c3ccc(Cl)cc3)C2)c1 ZINC000740203306 600282130 /nfs/dbraw/zinc/28/21/30/600282130.db2.gz OPEXKGIHDUWBOX-OAHLLOKOSA-N -1 3 355.825 3.835 20 0 FHADHM O=C([O-])[C@@H]1CC12CCN(Cc1cccc(C(=O)Nc3ccccc3)c1)CC2 ZINC000739489945 600291516 /nfs/dbraw/zinc/29/15/16/600291516.db2.gz VVLYHEQSHZUQFC-IBGZPJMESA-N -1 3 364.445 3.626 20 0 FHADHM Cc1nn(Cc2ccccc2)c(Cl)c1CN1CCC2(C[C@H]2C(=O)[O-])CC1 ZINC000738927283 600291578 /nfs/dbraw/zinc/29/15/78/600291578.db2.gz JNAOWJAZXRZFEQ-KRWDZBQOSA-N -1 3 373.884 3.580 20 0 FHADHM CN(C(=O)[C@@H]1C[C@@H]1c1cccc2ccccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000825811740 607436666 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362.393 3.692 20 0 FHADHM CCCOc1ccc(Cl)cc1NC(=O)c1ccc(-c2nnn[n-]2)cc1C ZINC000825339244 607666289 /nfs/dbraw/zinc/66/62/89/607666289.db2.gz TVLFZQZNNHCWAM-UHFFFAOYSA-N -1 3 371.828 3.870 20 0 FHADHM CCCOc1ccc(Cl)cc1NC(=O)c1ccc(-c2nn[n-]n2)cc1C ZINC000825339244 607666291 /nfs/dbraw/zinc/66/62/91/607666291.db2.gz TVLFZQZNNHCWAM-UHFFFAOYSA-N -1 3 371.828 3.870 20 0 FHADHM CN(C[C@H]1CCCN1Cc1ccc(C(=O)Nc2ccccc2)cc1)C(=O)[O-] ZINC000828230135 604102370 /nfs/dbraw/zinc/10/23/70/604102370.db2.gz MSRVSVUGTWDOJK-LJQANCHMSA-N -1 3 367.449 3.513 20 0 FHADHM CCn1c2ccccc2c2cc(NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)ccc21 ZINC000825797044 607687268 /nfs/dbraw/zinc/68/72/68/607687268.db2.gz UPNRHZNWFWHEQG-UHFFFAOYSA-N -1 3 371.404 3.575 20 0 FHADHM CCn1c2ccccc2c2cc(NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)ccc21 ZINC000825797044 607687269 /nfs/dbraw/zinc/68/72/69/607687269.db2.gz UPNRHZNWFWHEQG-UHFFFAOYSA-N -1 3 371.404 3.575 20 0 FHADHM Cc1ccccc1C1CCN(C(=O)c2ccc(-c3nnn[n-]3)cc2C)CC1 ZINC000826245485 607686594 /nfs/dbraw/zinc/68/65/94/607686594.db2.gz ZICWTEFKWQRCPQ-UHFFFAOYSA-N -1 3 361.449 3.503 20 0 FHADHM Cc1ccccc1C1CCN(C(=O)c2ccc(-c3nn[n-]n3)cc2C)CC1 ZINC000826245485 607686595 /nfs/dbraw/zinc/68/65/95/607686595.db2.gz ZICWTEFKWQRCPQ-UHFFFAOYSA-N -1 3 361.449 3.503 20 0 FHADHM Cc1ccc([C@H]2C[C@@H](C)CCN2C(=O)c2ccc(-c3nnn[n-]3)cc2C)o1 ZINC000826285438 607699670 /nfs/dbraw/zinc/69/96/70/607699670.db2.gz ZUIFKIMFCKFVNH-YVEFUNNKSA-N -1 3 365.437 3.690 20 0 FHADHM Cc1ccc([C@H]2C[C@@H](C)CCN2C(=O)c2ccc(-c3nn[n-]n3)cc2C)o1 ZINC000826285438 607699671 /nfs/dbraw/zinc/69/96/71/607699671.db2.gz ZUIFKIMFCKFVNH-YVEFUNNKSA-N -1 3 365.437 3.690 20 0 FHADHM O=C([O-])N1CCC(CN[C@H](c2cccc(Cl)c2)c2ccccn2)CC1 ZINC000831878680 604526775 /nfs/dbraw/zinc/52/67/75/604526775.db2.gz MOQOSZGCSZJLEF-GOSISDBHSA-N -1 3 359.857 3.804 20 0 FHADHM Cc1cc([C@@H](C)OC(=O)[C@@H]2CCCN(Cc3ccccc3)C2)oc1C(=O)[O-] ZINC000832873253 604585601 /nfs/dbraw/zinc/58/56/01/604585601.db2.gz FRRLVDGOZWJCIL-NVXWUHKLSA-N -1 3 371.433 3.803 20 0 FHADHM C[C@H](Oc1ccc(CN2CCC(N(C)c3ccccc3)CC2)cc1)C(=O)[O-] ZINC000833541780 604620627 /nfs/dbraw/zinc/62/06/27/604620627.db2.gz NOKJBURMNOSEHP-KRWDZBQOSA-N -1 3 368.477 3.639 20 0 FHADHM C[C@H](Oc1ccc(CN2CCC[C@H]2c2ccc3c(c2)OCO3)cc1)C(=O)[O-] ZINC000833538493 604630487 /nfs/dbraw/zinc/63/04/87/604630487.db2.gz CVACENGMLAAPIE-KSSFIOAISA-N -1 3 369.417 3.604 20 0 FHADHM FC(F)(F)CCCCSc1nc2c(cc1-c1nnn[n-]1)CCCC2 ZINC000826367862 607712643 /nfs/dbraw/zinc/71/26/43/607712643.db2.gz REDJZNSJXUYJGS-UHFFFAOYSA-N -1 3 357.405 3.965 20 0 FHADHM FC(F)(F)CCCCSc1nc2c(cc1-c1nn[n-]n1)CCCC2 ZINC000826367862 607712645 /nfs/dbraw/zinc/71/26/45/607712645.db2.gz REDJZNSJXUYJGS-UHFFFAOYSA-N -1 3 357.405 3.965 20 0 FHADHM CC[C@H](CC(=O)OCc1cccc(-c2nnn[n-]2)c1)c1ccc(OC)cc1 ZINC000825083190 607714587 /nfs/dbraw/zinc/71/45/87/607714587.db2.gz YGEMFRQFRWBFIU-OAHLLOKOSA-N -1 3 366.421 3.502 20 0 FHADHM CC[C@H](CC(=O)OCc1cccc(-c2nn[n-]n2)c1)c1ccc(OC)cc1 ZINC000825083190 607714589 /nfs/dbraw/zinc/71/45/89/607714589.db2.gz YGEMFRQFRWBFIU-OAHLLOKOSA-N -1 3 366.421 3.502 20 0 FHADHM CN(c1nc(Cl)c(C(=O)[O-])s1)C1CCN(Cc2ccccc2)CC1 ZINC000380138922 604827009 /nfs/dbraw/zinc/82/70/09/604827009.db2.gz FWVATMBDNLICOW-UHFFFAOYSA-N -1 3 365.886 3.596 20 0 FHADHM CN(C(=O)Nc1ccc(NC(=O)[O-])cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000827810404 604860122 /nfs/dbraw/zinc/86/01/22/604860122.db2.gz QLJNCMYHPHWQFS-SFHVURJKSA-N -1 3 368.437 3.515 20 0 FHADHM CC(C)(C(=O)[O-])[C@H]1CCCN(Cc2cc(Cl)c3c(c2)OCCCO3)C1 ZINC000326983830 604944544 /nfs/dbraw/zinc/94/45/44/604944544.db2.gz QQTHHRHUZJYAPE-AWEZNQCLSA-N -1 3 367.873 3.824 20 0 FHADHM c1ccc([C@@H]2CN(c3cc(-c4nnn[n-]4)c4ccccc4n3)CCS2)cc1 ZINC000826520121 607729320 /nfs/dbraw/zinc/72/93/20/607729320.db2.gz AXNPKLUHBZYXFC-SFHVURJKSA-N -1 3 374.473 3.709 20 0 FHADHM c1ccc([C@@H]2CN(c3cc(-c4nn[n-]n4)c4ccccc4n3)CCS2)cc1 ZINC000826520121 607729323 /nfs/dbraw/zinc/72/93/23/607729323.db2.gz AXNPKLUHBZYXFC-SFHVURJKSA-N -1 3 374.473 3.709 20 0 FHADHM COc1ccc([C@@H]2CCCN2Cc2ccccc2CC(=O)[O-])cc1OC ZINC000833732188 605063568 /nfs/dbraw/zinc/06/35/68/605063568.db2.gz HXZKFAHCNAHIBX-SFHVURJKSA-N -1 3 355.434 3.668 20 0 FHADHM C[C@]1(NCc2coc(-c3ccc(F)c(F)c3)n2)CCCC[C@H]1C(=O)[O-] ZINC000833570948 605069658 /nfs/dbraw/zinc/06/96/58/605069658.db2.gz WXUFWCAXYITTSE-UGSOOPFHSA-N -1 3 350.365 3.743 20 0 FHADHM C[C@H](Oc1ccc(CN[C@H]2CC(C)(C)Oc3ccccc32)cc1)C(=O)[O-] ZINC000833541614 605117488 /nfs/dbraw/zinc/11/74/88/605117488.db2.gz RVHUEFMIXVMQLB-KSSFIOAISA-N -1 3 355.434 3.931 20 0 FHADHM C[C@@H]1CC(C)(C)C[C@@](CO)(NCc2coc(-c3ccc(C(=O)[O-])cc3)n2)C1 ZINC000833588677 605215149 /nfs/dbraw/zinc/21/51/49/605215149.db2.gz ITTHVPHXURKRNB-SZNDQCEHSA-N -1 3 372.465 3.707 20 0 FHADHM C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC000824764927 607743996 /nfs/dbraw/zinc/74/39/96/607743996.db2.gz ZYWKUMFSYZODIS-AWEZNQCLSA-N -1 3 372.432 3.695 20 0 FHADHM C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC000824764927 607743997 /nfs/dbraw/zinc/74/39/97/607743997.db2.gz ZYWKUMFSYZODIS-AWEZNQCLSA-N -1 3 372.432 3.695 20 0 FHADHM CC(C)COC1CCN([C@H](C(=O)[O-])c2ccccc2C(F)(F)F)CC1 ZINC000582425870 605262547 /nfs/dbraw/zinc/26/25/47/605262547.db2.gz SEJRWVVHNZKNCA-INIZCTEOSA-N -1 3 359.388 3.968 20 0 FHADHM Cc1[nH]c2ccc(Cl)cc2c1C(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000826233893 607755620 /nfs/dbraw/zinc/75/56/20/607755620.db2.gz ZAJXOACPJYOFLF-UHFFFAOYSA-N -1 3 366.812 3.871 20 0 FHADHM Cc1[nH]c2ccc(Cl)cc2c1C(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000826233893 607755621 /nfs/dbraw/zinc/75/56/21/607755621.db2.gz ZAJXOACPJYOFLF-UHFFFAOYSA-N -1 3 366.812 3.871 20 0 FHADHM CCc1oc(C(=O)[O-])cc1CN1CCC(n2ccc(C(F)(F)F)n2)CC1 ZINC000652434908 605473593 /nfs/dbraw/zinc/47/35/93/605473593.db2.gz HLAVPCMJWSFWHO-UHFFFAOYSA-N -1 3 371.359 3.593 20 0 FHADHM CC(C)N1CC[C@@H](NCc2ccc(C(=O)[O-])o2)[C@@H]1c1ccc(F)c(F)c1 ZINC000833500056 605490080 /nfs/dbraw/zinc/49/00/80/605490080.db2.gz OBHLTEIHNSJZIT-AEFFLSMTSA-N -1 3 364.392 3.570 20 0 FHADHM O=C([O-])N1CCC[C@H]1C1CCN(Cc2cnc(-c3ccncc3)s2)CC1 ZINC000834104619 605495422 /nfs/dbraw/zinc/49/54/22/605495422.db2.gz DMPUEUADHRQUAM-KRWDZBQOSA-N -1 3 372.494 3.560 20 0 FHADHM CCCC[C@H](CC)C(=O)Nc1ccc(NC(=O)OCC)c(-c2nnn[n-]2)c1 ZINC000825261125 607759893 /nfs/dbraw/zinc/75/98/93/607759893.db2.gz UYUOYEDWFQTXAF-LBPRGKRZSA-N -1 3 374.445 3.590 20 0 FHADHM CCCC[C@H](CC)C(=O)Nc1ccc(NC(=O)OCC)c(-c2nn[n-]n2)c1 ZINC000825261125 607759894 /nfs/dbraw/zinc/75/98/94/607759894.db2.gz UYUOYEDWFQTXAF-LBPRGKRZSA-N -1 3 374.445 3.590 20 0 FHADHM O=C([O-])N1CCC[C@H]1[C@H]1CCCCN1Cc1cnc(-c2ccncc2)s1 ZINC000834111130 605562130 /nfs/dbraw/zinc/56/21/30/605562130.db2.gz ZOSLJKJFNKIODC-SJORKVTESA-N -1 3 372.494 3.702 20 0 FHADHM O=C([O-])Nc1ccc2c(c1)CC[C@@H]2NCc1cc(Cl)c2c(c1)OCCO2 ZINC000834263525 605592647 /nfs/dbraw/zinc/59/26/47/605592647.db2.gz TWMILPMLKHRZGT-INIZCTEOSA-N -1 3 374.824 3.978 20 0 FHADHM Cc1cscc1C(=O)Nc1nc(-c2cccc(-c3nnn[n-]3)c2)cs1 ZINC000826320689 607770581 /nfs/dbraw/zinc/77/05/81/607770581.db2.gz ABNPMROEZKLZPT-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM Cc1cscc1C(=O)Nc1nc(-c2cccc(-c3nn[n-]n3)c2)cs1 ZINC000826320689 607770582 /nfs/dbraw/zinc/77/05/82/607770582.db2.gz ABNPMROEZKLZPT-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM Cc1nn(CCC(=O)[O-])c(C)c1CN1CC=C(c2cccc(C)c2)CC1 ZINC000833752370 605729088 /nfs/dbraw/zinc/72/90/88/605729088.db2.gz IDQPEBPFBUTKCL-UHFFFAOYSA-N -1 3 353.466 3.572 20 0 FHADHM O=C([O-])N[C@@H]1C[C@H](N[C@@H](c2ccccc2)[C@H]2CCCO2)c2ccccc21 ZINC000834158243 605797587 /nfs/dbraw/zinc/79/75/87/605797587.db2.gz KRKDGLKBXHHBTI-NMLBUPMWSA-N -1 3 352.434 3.950 20 0 FHADHM C[C@H](Nc1ccc(-c2nnn[n-]2)nc1)c1cc(F)c(Cl)cc1Cl ZINC000820455530 606025572 /nfs/dbraw/zinc/02/55/72/606025572.db2.gz JESWQIODMVVIMI-ZETCQYMHSA-N -1 3 353.188 3.881 20 0 FHADHM C[C@H](Nc1ccc(-c2nn[n-]n2)nc1)c1cc(F)c(Cl)cc1Cl ZINC000820455530 606025577 /nfs/dbraw/zinc/02/55/77/606025577.db2.gz JESWQIODMVVIMI-ZETCQYMHSA-N -1 3 353.188 3.881 20 0 FHADHM CC[C@@H]1CN(C(=O)c2cccc(-c3nnn[n-]3)c2)CC[C@@H]1c1ccccc1 ZINC000820988638 606029702 /nfs/dbraw/zinc/02/97/02/606029702.db2.gz GWURUWFWOMXIEI-BEFAXECRSA-N -1 3 361.449 3.523 20 0 FHADHM CC[C@@H]1CN(C(=O)c2cccc(-c3nn[n-]n3)c2)CC[C@@H]1c1ccccc1 ZINC000820988638 606029705 /nfs/dbraw/zinc/02/97/05/606029705.db2.gz GWURUWFWOMXIEI-BEFAXECRSA-N -1 3 361.449 3.523 20 0 FHADHM CN(Cc1nc2ccccc2s1)c1nc2ccccc2cc1-c1nnn[n-]1 ZINC000821617925 606029857 /nfs/dbraw/zinc/02/98/57/606029857.db2.gz IMQLYIZWPQGFDD-UHFFFAOYSA-N -1 3 373.445 3.661 20 0 FHADHM CN(Cc1nc2ccccc2s1)c1nc2ccccc2cc1-c1nn[n-]n1 ZINC000821617925 606029858 /nfs/dbraw/zinc/02/98/58/606029858.db2.gz IMQLYIZWPQGFDD-UHFFFAOYSA-N -1 3 373.445 3.661 20 0 FHADHM c1ccc(COCc2ccccc2CNc2ccc(-c3nnn[n-]3)nc2)cc1 ZINC000823788313 606044595 /nfs/dbraw/zinc/04/45/95/606044595.db2.gz YLJVDOJUOLVHSN-UHFFFAOYSA-N -1 3 372.432 3.591 20 0 FHADHM c1ccc(COCc2ccccc2CNc2ccc(-c3nn[n-]n3)nc2)cc1 ZINC000823788313 606044599 /nfs/dbraw/zinc/04/45/99/606044599.db2.gz YLJVDOJUOLVHSN-UHFFFAOYSA-N -1 3 372.432 3.591 20 0 FHADHM CN(Cc1nc(C(F)(F)F)cs1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821616896 606045086 /nfs/dbraw/zinc/04/50/86/606045086.db2.gz MNPGXVZIXHOQSJ-UHFFFAOYSA-N -1 3 374.779 3.632 20 0 FHADHM CN(Cc1nc(C(F)(F)F)cs1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821616896 606045091 /nfs/dbraw/zinc/04/50/91/606045091.db2.gz MNPGXVZIXHOQSJ-UHFFFAOYSA-N -1 3 374.779 3.632 20 0 FHADHM CC(C)Oc1cccc(CNc2nc3ccccc3cc2-c2nnn[n-]2)c1 ZINC000820177864 606048538 /nfs/dbraw/zinc/04/85/38/606048538.db2.gz BTOLLRRKTPBAMF-UHFFFAOYSA-N -1 3 360.421 3.814 20 0 FHADHM CC(C)Oc1cccc(CNc2nc3ccccc3cc2-c2nn[n-]n2)c1 ZINC000820177864 606048544 /nfs/dbraw/zinc/04/85/44/606048544.db2.gz BTOLLRRKTPBAMF-UHFFFAOYSA-N -1 3 360.421 3.814 20 0 FHADHM Cc1ccc2nc(C3CC3)cc(C(=O)Nc3ccc(-c4nnn[n-]4)cc3)c2c1 ZINC000473737567 606121238 /nfs/dbraw/zinc/12/12/38/606121238.db2.gz RXRZRZJTZWZVKU-UHFFFAOYSA-N -1 3 370.416 3.853 20 0 FHADHM Cc1ccc2nc(C3CC3)cc(C(=O)Nc3ccc(-c4nn[n-]n4)cc3)c2c1 ZINC000473737567 606121241 /nfs/dbraw/zinc/12/12/41/606121241.db2.gz RXRZRZJTZWZVKU-UHFFFAOYSA-N -1 3 370.416 3.853 20 0 FHADHM C[C@@H](C(=O)N(Cc1ccco1)c1ccccc1-c1nnn[n-]1)C1CCCC1 ZINC000819856312 606125844 /nfs/dbraw/zinc/12/58/44/606125844.db2.gz HSTSBYQZTXSBMO-CQSZACIVSA-N -1 3 365.437 3.819 20 0 FHADHM C[C@@H](C(=O)N(Cc1ccco1)c1ccccc1-c1nn[n-]n1)C1CCCC1 ZINC000819856312 606125846 /nfs/dbraw/zinc/12/58/46/606125846.db2.gz HSTSBYQZTXSBMO-CQSZACIVSA-N -1 3 365.437 3.819 20 0 FHADHM O=C([C@@H]1CC12CCCC2)N(Cc1ccccc1)c1ccccc1-c1nnn[n-]1 ZINC000822918022 606148875 /nfs/dbraw/zinc/14/88/75/606148875.db2.gz XWMHOLHOWWUCQD-SFHVURJKSA-N -1 3 373.460 3.980 20 0 FHADHM O=C([C@@H]1CC12CCCC2)N(Cc1ccccc1)c1ccccc1-c1nn[n-]n1 ZINC000822918022 606148877 /nfs/dbraw/zinc/14/88/77/606148877.db2.gz XWMHOLHOWWUCQD-SFHVURJKSA-N -1 3 373.460 3.980 20 0 FHADHM O=C([C@@H]1CC12CCCC2)N(Cc1ccco1)c1ccccc1-c1nnn[n-]1 ZINC000822917101 606148927 /nfs/dbraw/zinc/14/89/27/606148927.db2.gz NLKYTLZLXOTLJQ-INIZCTEOSA-N -1 3 363.421 3.573 20 0 FHADHM O=C([C@@H]1CC12CCCC2)N(Cc1ccco1)c1ccccc1-c1nn[n-]n1 ZINC000822917101 606148929 /nfs/dbraw/zinc/14/89/29/606148929.db2.gz NLKYTLZLXOTLJQ-INIZCTEOSA-N -1 3 363.421 3.573 20 0 FHADHM C[C@@H](C(=O)OCc1ccc(F)cc1-c1nnn[n-]1)c1ccc(Cl)s1 ZINC000819884639 606150021 /nfs/dbraw/zinc/15/00/21/606150021.db2.gz YEBRPIMDSHEFIU-MRVPVSSYSA-N -1 3 366.805 3.568 20 0 FHADHM C[C@@H](C(=O)OCc1ccc(F)cc1-c1nn[n-]n1)c1ccc(Cl)s1 ZINC000819884639 606150023 /nfs/dbraw/zinc/15/00/23/606150023.db2.gz YEBRPIMDSHEFIU-MRVPVSSYSA-N -1 3 366.805 3.568 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)c1c(Cl)cccc1Cl ZINC000823338061 606152781 /nfs/dbraw/zinc/15/27/81/606152781.db2.gz XLUNHUOWQXZHMI-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)c1c(Cl)cccc1Cl ZINC000823338061 606152782 /nfs/dbraw/zinc/15/27/82/606152782.db2.gz XLUNHUOWQXZHMI-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(C/C=C\c1ccc(F)cc1)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000822945357 606156128 /nfs/dbraw/zinc/15/61/28/606156128.db2.gz BUDZVAAMHFKWQH-UPHRSURJSA-N -1 3 357.776 3.701 20 0 FHADHM O=C(C/C=C\c1ccc(F)cc1)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000822945357 606156130 /nfs/dbraw/zinc/15/61/30/606156130.db2.gz BUDZVAAMHFKWQH-UPHRSURJSA-N -1 3 357.776 3.701 20 0 FHADHM COc1ccc([C@@H](C)CC(=O)O[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000821778242 606177628 /nfs/dbraw/zinc/17/76/28/606177628.db2.gz XCRSAYUKZRIDKL-UONOGXRCSA-N -1 3 366.421 3.673 20 0 FHADHM COc1ccc([C@@H](C)CC(=O)O[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000821778242 606177630 /nfs/dbraw/zinc/17/76/30/606177630.db2.gz XCRSAYUKZRIDKL-UONOGXRCSA-N -1 3 366.421 3.673 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)Nc1ccc2nc(C3CC3)oc2c1 ZINC000822935753 606190426 /nfs/dbraw/zinc/19/04/26/606190426.db2.gz MYVLSAYAJRRORR-YFHOEESVSA-N -1 3 372.388 3.537 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)Nc1ccc2nc(C3CC3)oc2c1 ZINC000822935753 606190428 /nfs/dbraw/zinc/19/04/28/606190428.db2.gz MYVLSAYAJRRORR-YFHOEESVSA-N -1 3 372.388 3.537 20 0 FHADHM Cc1nc(-c2ccc([C@H](C)Nc3ccc(-c4nnn[n-]4)nc3)cc2)cs1 ZINC000822419387 606213657 /nfs/dbraw/zinc/21/36/57/606213657.db2.gz QLIUUUYTNVOSOG-NSHDSACASA-N -1 3 363.450 3.867 20 0 FHADHM Cc1nc(-c2ccc([C@H](C)Nc3ccc(-c4nn[n-]n4)nc3)cc2)cs1 ZINC000822419387 606213658 /nfs/dbraw/zinc/21/36/58/606213658.db2.gz QLIUUUYTNVOSOG-NSHDSACASA-N -1 3 363.450 3.867 20 0 FHADHM Oc1ccc(C2CCN(c3c(Cl)cccc3-c3nnn[n-]3)CC2)cc1 ZINC000823726922 606213972 /nfs/dbraw/zinc/21/39/72/606213972.db2.gz IUOUEPCHXGFODA-UHFFFAOYSA-N -1 3 355.829 3.610 20 0 FHADHM Oc1ccc(C2CCN(c3c(Cl)cccc3-c3nn[n-]n3)CC2)cc1 ZINC000823726922 606213973 /nfs/dbraw/zinc/21/39/73/606213973.db2.gz IUOUEPCHXGFODA-UHFFFAOYSA-N -1 3 355.829 3.610 20 0 FHADHM CCc1ccc([C@@H](C)CC(=O)Nc2ccc(F)cc2-c2nnn[n-]2)cc1 ZINC000821476120 606263299 /nfs/dbraw/zinc/26/32/99/606263299.db2.gz ILQCJUMSACNONK-LBPRGKRZSA-N -1 3 353.401 3.701 20 0 FHADHM CCc1ccc([C@@H](C)CC(=O)Nc2ccc(F)cc2-c2nn[n-]n2)cc1 ZINC000821476120 606263301 /nfs/dbraw/zinc/26/33/01/606263301.db2.gz ILQCJUMSACNONK-LBPRGKRZSA-N -1 3 353.401 3.701 20 0 FHADHM Cc1cc2cc(C(=O)Nc3ccc(F)cc3-c3nnn[n-]3)oc2cc1C ZINC000822213218 606264772 /nfs/dbraw/zinc/26/47/72/606264772.db2.gz ZKCWKKLAHJNPMZ-UHFFFAOYSA-N -1 3 351.341 3.621 20 0 FHADHM Cc1cc2cc(C(=O)Nc3ccc(F)cc3-c3nn[n-]n3)oc2cc1C ZINC000822213218 606264773 /nfs/dbraw/zinc/26/47/73/606264773.db2.gz ZKCWKKLAHJNPMZ-UHFFFAOYSA-N -1 3 351.341 3.621 20 0 FHADHM Cc1ccc(C)c(NC(=O)[C@@H](C)Sc2cccc(-c3nnn[n-]3)c2)c1 ZINC000822231949 606326206 /nfs/dbraw/zinc/32/62/06/606326206.db2.gz NWAYRKPNSRNOKX-CYBMUJFWSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1ccc(C)c(NC(=O)[C@@H](C)Sc2cccc(-c3nn[n-]n3)c2)c1 ZINC000822231949 606326208 /nfs/dbraw/zinc/32/62/08/606326208.db2.gz NWAYRKPNSRNOKX-CYBMUJFWSA-N -1 3 353.451 3.603 20 0 FHADHM C[C@@H](OC(=O)COc1cccc2ccccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000820497129 606340348 /nfs/dbraw/zinc/34/03/48/606340348.db2.gz PYGVZDAQKOUYHS-CQSZACIVSA-N -1 3 374.400 3.703 20 0 FHADHM C[C@@H](OC(=O)COc1cccc2ccccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000820497129 606340349 /nfs/dbraw/zinc/34/03/49/606340349.db2.gz PYGVZDAQKOUYHS-CQSZACIVSA-N -1 3 374.400 3.703 20 0 FHADHM Cc1ccccc1C(C)(C)C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000822345721 606341502 /nfs/dbraw/zinc/34/15/02/606341502.db2.gz PXUKOEUQBXSBCX-AWEZNQCLSA-N -1 3 350.422 3.757 20 0 FHADHM Cc1ccccc1C(C)(C)C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000822345721 606341504 /nfs/dbraw/zinc/34/15/04/606341504.db2.gz PXUKOEUQBXSBCX-AWEZNQCLSA-N -1 3 350.422 3.757 20 0 FHADHM C[C@H](OC(=O)CCc1ccc(Cl)s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820494827 606344271 /nfs/dbraw/zinc/34/42/71/606344271.db2.gz CCAYLCOWXLRPOU-JTQLQIEISA-N -1 3 362.842 3.819 20 0 FHADHM C[C@H](OC(=O)CCc1ccc(Cl)s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820494827 606344273 /nfs/dbraw/zinc/34/42/73/606344273.db2.gz CCAYLCOWXLRPOU-JTQLQIEISA-N -1 3 362.842 3.819 20 0 FHADHM C[C@H](OC(=O)[C@H]1CCSc2ccccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488466 606345582 /nfs/dbraw/zinc/34/55/82/606345582.db2.gz OKGDRZPNRCUYFX-LRDDRELGSA-N -1 3 366.446 3.751 20 0 FHADHM C[C@H](OC(=O)[C@H]1CCSc2ccccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488466 606345583 /nfs/dbraw/zinc/34/55/83/606345583.db2.gz OKGDRZPNRCUYFX-LRDDRELGSA-N -1 3 366.446 3.751 20 0 FHADHM C[C@@H](Oc1cccc(Cl)c1)C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820533327 606346453 /nfs/dbraw/zinc/34/64/53/606346453.db2.gz DNGCGWGPSRQJNK-NWDGAFQWSA-N -1 3 372.812 3.592 20 0 FHADHM C[C@@H](Oc1cccc(Cl)c1)C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820533327 606346455 /nfs/dbraw/zinc/34/64/55/606346455.db2.gz DNGCGWGPSRQJNK-NWDGAFQWSA-N -1 3 372.812 3.592 20 0 FHADHM C[C@H](OC(=O)CCSc1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820496618 606350428 /nfs/dbraw/zinc/35/04/28/606350428.db2.gz NFRNNLYRHUGLOM-ZDUSSCGKSA-N -1 3 354.435 3.653 20 0 FHADHM C[C@H](OC(=O)CCSc1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820496618 606350429 /nfs/dbraw/zinc/35/04/29/606350429.db2.gz NFRNNLYRHUGLOM-ZDUSSCGKSA-N -1 3 354.435 3.653 20 0 FHADHM C[C@H](OC(=O)Cc1csc2ccccc12)c1ccc(-c2nnn[n-]2)cc1 ZINC000820502809 606352982 /nfs/dbraw/zinc/35/29/82/606352982.db2.gz WBHZBUPJYLBGBD-LBPRGKRZSA-N -1 3 364.430 3.928 20 0 FHADHM C[C@H](OC(=O)Cc1csc2ccccc12)c1ccc(-c2nn[n-]n2)cc1 ZINC000820502809 606352983 /nfs/dbraw/zinc/35/29/83/606352983.db2.gz WBHZBUPJYLBGBD-LBPRGKRZSA-N -1 3 364.430 3.928 20 0 FHADHM C[C@@H](OC(=O)CCc1cc(Cl)cs1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820495301 606355880 /nfs/dbraw/zinc/35/58/80/606355880.db2.gz GYAUEIUPMLZZDZ-SNVBAGLBSA-N -1 3 362.842 3.819 20 0 FHADHM C[C@@H](OC(=O)CCc1cc(Cl)cs1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820495301 606355881 /nfs/dbraw/zinc/35/58/81/606355881.db2.gz GYAUEIUPMLZZDZ-SNVBAGLBSA-N -1 3 362.842 3.819 20 0 FHADHM C[C@H](OC(=O)[C@H]1C[C@H]1c1ccc(F)c(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488998 606359499 /nfs/dbraw/zinc/35/94/99/606359499.db2.gz XTLNRPFUAKFZJT-LKTVYLICSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@H]1C[C@H]1c1ccc(F)c(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488998 606359501 /nfs/dbraw/zinc/35/95/01/606359501.db2.gz XTLNRPFUAKFZJT-LKTVYLICSA-N -1 3 370.359 3.553 20 0 FHADHM Cc1ccncc1C(=O)Oc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000822379536 606361003 /nfs/dbraw/zinc/36/10/03/606361003.db2.gz PEJAKCPNXFVDOZ-UHFFFAOYSA-N -1 3 373.372 3.582 20 0 FHADHM Cc1ccncc1C(=O)Oc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000822379536 606361005 /nfs/dbraw/zinc/36/10/05/606361005.db2.gz PEJAKCPNXFVDOZ-UHFFFAOYSA-N -1 3 373.372 3.582 20 0 FHADHM Cc1c(C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)cnc2ccccc12 ZINC000822020419 606372490 /nfs/dbraw/zinc/37/24/90/606372490.db2.gz CJGCHPXEUZYDJF-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1c(C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)cnc2ccccc12 ZINC000822020419 606372493 /nfs/dbraw/zinc/37/24/93/606372493.db2.gz CJGCHPXEUZYDJF-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM O=C(Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)[C@H]1[C@@H]2CCC[C@@H]21 ZINC000823367237 606379648 /nfs/dbraw/zinc/37/96/48/606379648.db2.gz GZEBDGBMJYGJAY-PIIMJCKOSA-N -1 3 361.405 3.644 20 0 FHADHM O=C(Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)[C@H]1[C@@H]2CCC[C@@H]21 ZINC000823367237 606379649 /nfs/dbraw/zinc/37/96/49/606379649.db2.gz GZEBDGBMJYGJAY-PIIMJCKOSA-N -1 3 361.405 3.644 20 0 FHADHM CCS[C@H]1CCC[C@H](Nc2nc(C(F)(F)F)ccc2-c2nnn[n-]2)C1 ZINC000821455364 606400838 /nfs/dbraw/zinc/40/08/38/606400838.db2.gz JUFQMKLIUGLXQI-UWVGGRQHSA-N -1 3 372.420 3.757 20 0 FHADHM CCS[C@H]1CCC[C@H](Nc2nc(C(F)(F)F)ccc2-c2nn[n-]n2)C1 ZINC000821455364 606400840 /nfs/dbraw/zinc/40/08/40/606400840.db2.gz JUFQMKLIUGLXQI-UWVGGRQHSA-N -1 3 372.420 3.757 20 0 FHADHM CN(C(=O)[C@@H]1CCCc2ccccc21)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821569641 606412048 /nfs/dbraw/zinc/41/20/48/606412048.db2.gz QMNDSUJOVCXGAI-OAHLLOKOSA-N -1 3 367.840 3.603 20 0 FHADHM CN(C(=O)[C@@H]1CCCc2ccccc21)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821569641 606412050 /nfs/dbraw/zinc/41/20/50/606412050.db2.gz QMNDSUJOVCXGAI-OAHLLOKOSA-N -1 3 367.840 3.603 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)cc1CNc1ccc(OC(F)(F)F)cc1 ZINC000822761945 606443933 /nfs/dbraw/zinc/44/39/33/606443933.db2.gz WSVQTQJOHMMCCU-UHFFFAOYSA-N -1 3 353.279 3.517 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CNc1ccc(OC(F)(F)F)cc1 ZINC000822761945 606443934 /nfs/dbraw/zinc/44/39/34/606443934.db2.gz WSVQTQJOHMMCCU-UHFFFAOYSA-N -1 3 353.279 3.517 20 0 FHADHM FC(F)(F)c1cc(-c2nn[n-]n2)ccc1N1CCC[C@@H]1c1cccnc1 ZINC000822718289 606445242 /nfs/dbraw/zinc/44/52/42/606445242.db2.gz GTLYOBAHWRJSCJ-CQSZACIVSA-N -1 3 360.343 3.622 20 0 FHADHM CCOc1ccc(Br)cc1NCc1cccc(-c2nnn[n-]2)c1 ZINC000821417546 606456914 /nfs/dbraw/zinc/45/69/14/606456914.db2.gz OHRPUMIDOLSYIP-UHFFFAOYSA-N -1 3 374.242 3.640 20 0 FHADHM CCOc1ccc(Br)cc1NCc1cccc(-c2nn[n-]n2)c1 ZINC000821417546 606456915 /nfs/dbraw/zinc/45/69/15/606456915.db2.gz OHRPUMIDOLSYIP-UHFFFAOYSA-N -1 3 374.242 3.640 20 0 FHADHM C[C@H](NC(=O)c1cc(-c2nnn[n-]2)cs1)c1cc2ccccc2s1 ZINC000820390192 606509071 /nfs/dbraw/zinc/50/90/71/606509071.db2.gz FXAFESGDDKETGU-VIFPVBQESA-N -1 3 355.448 3.634 20 0 FHADHM C[C@H](NC(=O)c1cc(-c2nn[n-]n2)cs1)c1cc2ccccc2s1 ZINC000820390192 606509072 /nfs/dbraw/zinc/50/90/72/606509072.db2.gz FXAFESGDDKETGU-VIFPVBQESA-N -1 3 355.448 3.634 20 0 FHADHM O=C(NCC1(c2cccs2)CCCCC1)c1cc(-c2nnn[n-]2)cs1 ZINC000823171640 606516716 /nfs/dbraw/zinc/51/67/16/606516716.db2.gz YSZKQTAIAMBZKA-UHFFFAOYSA-N -1 3 373.507 3.622 20 0 FHADHM O=C(NCC1(c2cccs2)CCCCC1)c1cc(-c2nn[n-]n2)cs1 ZINC000823171640 606516718 /nfs/dbraw/zinc/51/67/18/606516718.db2.gz YSZKQTAIAMBZKA-UHFFFAOYSA-N -1 3 373.507 3.622 20 0 FHADHM O=C(c1cc(-c2nnn[n-]2)cs1)N(c1ccccc1F)C1CCCC1 ZINC000823466237 606519644 /nfs/dbraw/zinc/51/96/44/606519644.db2.gz HRTXRDGFSINKQZ-UHFFFAOYSA-N -1 3 357.414 3.657 20 0 FHADHM O=C(c1cc(-c2nn[n-]n2)cs1)N(c1ccccc1F)C1CCCC1 ZINC000823466237 606519646 /nfs/dbraw/zinc/51/96/46/606519646.db2.gz HRTXRDGFSINKQZ-UHFFFAOYSA-N -1 3 357.414 3.657 20 0 FHADHM CCc1ccc([C@H]2C[C@@H](C)CCN2C(=O)c2cc(-c3nnn[n-]3)cs2)o1 ZINC000821480850 606520257 /nfs/dbraw/zinc/52/02/57/606520257.db2.gz FLUQDBGTVWXJQG-SMDDNHRTSA-N -1 3 371.466 3.697 20 0 FHADHM CCc1ccc([C@H]2C[C@@H](C)CCN2C(=O)c2cc(-c3nn[n-]n3)cs2)o1 ZINC000821480850 606520259 /nfs/dbraw/zinc/52/02/59/606520259.db2.gz FLUQDBGTVWXJQG-SMDDNHRTSA-N -1 3 371.466 3.697 20 0 FHADHM CC[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)cs2)CC[C@H]1c1ccccc1 ZINC000820989260 606523966 /nfs/dbraw/zinc/52/39/66/606523966.db2.gz PJBJTZYRTDSCCY-CZUORRHYSA-N -1 3 367.478 3.584 20 0 FHADHM CC[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)cs2)CC[C@H]1c1ccccc1 ZINC000820989260 606523968 /nfs/dbraw/zinc/52/39/68/606523968.db2.gz PJBJTZYRTDSCCY-CZUORRHYSA-N -1 3 367.478 3.584 20 0 FHADHM CC(C)(C)c1nc2cc(NC(=O)c3cc(-c4nnn[n-]4)cs3)ccc2o1 ZINC000819966014 606553514 /nfs/dbraw/zinc/55/35/14/606553514.db2.gz SFTMXSVRZLSKAV-UHFFFAOYSA-N -1 3 368.422 3.619 20 0 FHADHM CC(C)(C)c1nc2cc(NC(=O)c3cc(-c4nn[n-]n4)cs3)ccc2o1 ZINC000819966014 606553516 /nfs/dbraw/zinc/55/35/16/606553516.db2.gz SFTMXSVRZLSKAV-UHFFFAOYSA-N -1 3 368.422 3.619 20 0 FHADHM C[C@@H]1CCCN1C(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000820710907 606577753 /nfs/dbraw/zinc/57/77/53/606577753.db2.gz SNGDJUHLRVUOKF-CYBMUJFWSA-N -1 3 364.409 3.675 20 0 FHADHM C[C@@H]1CCCN1C(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000820710907 606577754 /nfs/dbraw/zinc/57/77/54/606577754.db2.gz SNGDJUHLRVUOKF-CYBMUJFWSA-N -1 3 364.409 3.675 20 0 FHADHM CC1(CNC(=O)Nc2ccc(Oc3cccc(-c4nnn[n-]4)c3)cc2)CC1 ZINC000820618565 606577876 /nfs/dbraw/zinc/57/78/76/606577876.db2.gz IJYSQHQEZWWQTI-UHFFFAOYSA-N -1 3 364.409 3.581 20 0 FHADHM CC1(CNC(=O)Nc2ccc(Oc3cccc(-c4nn[n-]n4)c3)cc2)CC1 ZINC000820618565 606577877 /nfs/dbraw/zinc/57/78/77/606577877.db2.gz IJYSQHQEZWWQTI-UHFFFAOYSA-N -1 3 364.409 3.581 20 0 FHADHM C[C@@H](C(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1)c1ccc2ccccc2c1 ZINC000819856662 606601790 /nfs/dbraw/zinc/60/17/90/606601790.db2.gz KBVONPKLLVVXAW-OAHLLOKOSA-N -1 3 371.444 3.782 20 0 FHADHM C[C@@H](C(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1)c1ccc2ccccc2c1 ZINC000819856662 606601791 /nfs/dbraw/zinc/60/17/91/606601791.db2.gz KBVONPKLLVVXAW-OAHLLOKOSA-N -1 3 371.444 3.782 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1OC(=O)[C@H](C)c1ccc2ccccc2c1 ZINC000821699342 606602662 /nfs/dbraw/zinc/60/26/62/606602662.db2.gz MQVWHPIATPBWJN-CYBMUJFWSA-N -1 3 374.400 3.738 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1OC(=O)[C@H](C)c1ccc2ccccc2c1 ZINC000821699342 606602664 /nfs/dbraw/zinc/60/26/64/606602664.db2.gz MQVWHPIATPBWJN-CYBMUJFWSA-N -1 3 374.400 3.738 20 0 FHADHM C[C@H](C(=O)Nc1ccc(F)cc1-c1nnn[n-]1)c1ccc2ccccc2c1 ZINC000819866221 606603117 /nfs/dbraw/zinc/60/31/17/606603117.db2.gz KXYVIRAXMXVKRM-LBPRGKRZSA-N -1 3 361.380 3.901 20 0 FHADHM C[C@H](C(=O)Nc1ccc(F)cc1-c1nn[n-]n1)c1ccc2ccccc2c1 ZINC000819866221 606603118 /nfs/dbraw/zinc/60/31/18/606603118.db2.gz KXYVIRAXMXVKRM-LBPRGKRZSA-N -1 3 361.380 3.901 20 0 FHADHM O=C(Nc1ccc(CCC(F)(F)F)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000823323522 606605666 /nfs/dbraw/zinc/60/56/66/606605666.db2.gz RHXVABCSMSKDEZ-UHFFFAOYSA-N -1 3 361.327 3.614 20 0 FHADHM O=C(Nc1ccc(CCC(F)(F)F)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000823323522 606605667 /nfs/dbraw/zinc/60/56/67/606605667.db2.gz RHXVABCSMSKDEZ-UHFFFAOYSA-N -1 3 361.327 3.614 20 0 FHADHM c1csc(Oc2ccc(OCc3ccc(-c4nnn[n-]4)cc3)cc2)n1 ZINC000823816733 606617597 /nfs/dbraw/zinc/61/75/97/606617597.db2.gz WTKSWONFRJGASR-UHFFFAOYSA-N -1 3 351.391 3.695 20 0 FHADHM c1csc(Oc2ccc(OCc3ccc(-c4nn[n-]n4)cc3)cc2)n1 ZINC000823816733 606617599 /nfs/dbraw/zinc/61/75/99/606617599.db2.gz WTKSWONFRJGASR-UHFFFAOYSA-N -1 3 351.391 3.695 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)/C=C1/CC[C@@H](C)C1 ZINC000820087736 606618775 /nfs/dbraw/zinc/61/87/75/606618775.db2.gz YPSVPSYWJZFGPB-QJISPJEISA-N -1 3 353.470 3.598 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)/C=C1/CC[C@@H](C)C1 ZINC000820087736 606618777 /nfs/dbraw/zinc/61/87/77/606618777.db2.gz YPSVPSYWJZFGPB-QJISPJEISA-N -1 3 353.470 3.598 20 0 FHADHM Clc1cccc(Cl)c1-c1noc(Cc2cccc(-c3nnn[n-]3)c2)n1 ZINC000822585971 606620499 /nfs/dbraw/zinc/62/04/99/606620499.db2.gz PMCZDBICBYNSKA-UHFFFAOYSA-N -1 3 373.203 3.814 20 0 FHADHM Clc1cccc(Cl)c1-c1noc(Cc2cccc(-c3nn[n-]n3)c2)n1 ZINC000822585971 606620500 /nfs/dbraw/zinc/62/05/00/606620500.db2.gz PMCZDBICBYNSKA-UHFFFAOYSA-N -1 3 373.203 3.814 20 0 FHADHM CC1CC(C(=O)Oc2ccc(Oc3ccc(-c4nnn[n-]4)cc3)cc2)C1 ZINC000820648656 606621950 /nfs/dbraw/zinc/62/19/50/606621950.db2.gz DWKDRVDDIIVNPR-UHFFFAOYSA-N -1 3 350.378 3.611 20 0 FHADHM CC1CC(C(=O)Oc2ccc(Oc3ccc(-c4nn[n-]n4)cc3)cc2)C1 ZINC000820648656 606621952 /nfs/dbraw/zinc/62/19/52/606621952.db2.gz DWKDRVDDIIVNPR-UHFFFAOYSA-N -1 3 350.378 3.611 20 0 FHADHM O=C(Nc1cccc(CCC(F)(F)F)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000823363828 606623635 /nfs/dbraw/zinc/62/36/35/606623635.db2.gz PCSGXUKHEAYTDU-UHFFFAOYSA-N -1 3 361.327 3.614 20 0 FHADHM O=C(Nc1cccc(CCC(F)(F)F)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000823363828 606623638 /nfs/dbraw/zinc/62/36/38/606623638.db2.gz PCSGXUKHEAYTDU-UHFFFAOYSA-N -1 3 361.327 3.614 20 0 FHADHM O=C(Nc1cccc(CCC(F)(F)F)c1)c1sccc1-c1nnn[n-]1 ZINC000823363873 606623740 /nfs/dbraw/zinc/62/37/40/606623740.db2.gz PTWONTLFNANFCL-UHFFFAOYSA-N -1 3 367.356 3.675 20 0 FHADHM O=C(Nc1cccc(CCC(F)(F)F)c1)c1sccc1-c1nn[n-]n1 ZINC000823363873 606623742 /nfs/dbraw/zinc/62/37/42/606623742.db2.gz PTWONTLFNANFCL-UHFFFAOYSA-N -1 3 367.356 3.675 20 0 FHADHM C[C@@H](NC(=O)[C@@H](C)c1ccc(Cl)s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820315581 606625843 /nfs/dbraw/zinc/62/58/43/606625843.db2.gz OMKCREZDWKVRDM-VHSXEESVSA-N -1 3 361.858 3.563 20 0 FHADHM C[C@@H](NC(=O)[C@@H](C)c1ccc(Cl)s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820315581 606625845 /nfs/dbraw/zinc/62/58/45/606625845.db2.gz OMKCREZDWKVRDM-VHSXEESVSA-N -1 3 361.858 3.563 20 0 FHADHM CCCCc1nc(CSc2ccc(Cl)cc2-c2nnn[n-]2)no1 ZINC000821077662 606630495 /nfs/dbraw/zinc/63/04/95/606630495.db2.gz PGEPGNRHZPYFJD-UHFFFAOYSA-N -1 3 350.835 3.538 20 0 FHADHM CCCCc1nc(CSc2ccc(Cl)cc2-c2nn[n-]n2)no1 ZINC000821077662 606630497 /nfs/dbraw/zinc/63/04/97/606630497.db2.gz PGEPGNRHZPYFJD-UHFFFAOYSA-N -1 3 350.835 3.538 20 0 FHADHM Cc1cccc(-c2c[nH]c([C@@H]3CCCN3c3ccc(-c4nn[n-]n4)cc3)n2)c1 ZINC000822284055 606643710 /nfs/dbraw/zinc/64/37/10/606643710.db2.gz HPSIANKTLISONY-IBGZPJMESA-N -1 3 371.448 3.907 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H]2C[C@H]2Cc2ccccc2)c1-c1nnn[n-]1 ZINC000821465750 606677059 /nfs/dbraw/zinc/67/70/59/606677059.db2.gz NTFQBURRYHYBEZ-HIFRSBDPSA-N -1 3 367.478 3.616 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H]2C[C@H]2Cc2ccccc2)c1-c1nn[n-]n1 ZINC000821465750 606677060 /nfs/dbraw/zinc/67/70/60/606677060.db2.gz NTFQBURRYHYBEZ-HIFRSBDPSA-N -1 3 367.478 3.616 20 0 FHADHM Cc1ccccc1[C@@H](NC(=O)c1c(F)cc(-c2nnn[n-]2)cc1F)C(C)C ZINC000822350137 606679284 /nfs/dbraw/zinc/67/92/84/606679284.db2.gz AWEPVCAFADGNSY-KRWDZBQOSA-N -1 3 371.391 3.580 20 0 FHADHM Cc1ccccc1[C@@H](NC(=O)c1c(F)cc(-c2nn[n-]n2)cc1F)C(C)C ZINC000822350137 606679285 /nfs/dbraw/zinc/67/92/85/606679285.db2.gz AWEPVCAFADGNSY-KRWDZBQOSA-N -1 3 371.391 3.580 20 0 FHADHM O=C(NCCC1CCC1)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000823188067 606690136 /nfs/dbraw/zinc/69/01/36/606690136.db2.gz UGCBADLKNHBDDP-UHFFFAOYSA-N -1 3 363.421 3.579 20 0 FHADHM O=C(NCCC1CCC1)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000823188067 606690137 /nfs/dbraw/zinc/69/01/37/606690137.db2.gz UGCBADLKNHBDDP-UHFFFAOYSA-N -1 3 363.421 3.579 20 0 FHADHM Cc1cc(C)cc(CSCCC(=O)Nc2ccccc2-c2nnn[n-]2)c1 ZINC000822196326 606706590 /nfs/dbraw/zinc/70/65/90/606706590.db2.gz FDVYKEBKSHFFCX-UHFFFAOYSA-N -1 3 367.478 3.746 20 0 FHADHM Cc1cc(C)cc(CSCCC(=O)Nc2ccccc2-c2nn[n-]n2)c1 ZINC000822196326 606706591 /nfs/dbraw/zinc/70/65/91/606706591.db2.gz FDVYKEBKSHFFCX-UHFFFAOYSA-N -1 3 367.478 3.746 20 0 FHADHM Cc1nc(CNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)sc1C ZINC000822444101 606707746 /nfs/dbraw/zinc/70/77/46/606707746.db2.gz AQDQHBMWQQEGGQ-UHFFFAOYSA-N -1 3 354.361 3.571 20 0 FHADHM Cc1nc(CNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)sc1C ZINC000822444101 606707748 /nfs/dbraw/zinc/70/77/48/606707748.db2.gz AQDQHBMWQQEGGQ-UHFFFAOYSA-N -1 3 354.361 3.571 20 0 FHADHM Cc1ccc(CNCc2ccc(-c3nnn[n-]3)o2)c(Oc2ccccc2)c1 ZINC000822238736 606727920 /nfs/dbraw/zinc/72/79/20/606727920.db2.gz SDBSZLVYAGSSCY-UHFFFAOYSA-N -1 3 361.405 3.850 20 0 FHADHM Cc1ccc(CNCc2ccc(-c3nn[n-]n3)o2)c(Oc2ccccc2)c1 ZINC000822238736 606727922 /nfs/dbraw/zinc/72/79/22/606727922.db2.gz SDBSZLVYAGSSCY-UHFFFAOYSA-N -1 3 361.405 3.850 20 0 FHADHM CC[C@H](OC1CCCCC1)C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820937917 606736220 /nfs/dbraw/zinc/73/62/20/606736220.db2.gz FHCVMPPQIDYVEA-GUYCJALGSA-N -1 3 358.442 3.599 20 0 FHADHM CC[C@H](OC1CCCCC1)C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820937917 606736222 /nfs/dbraw/zinc/73/62/22/606736222.db2.gz FHCVMPPQIDYVEA-GUYCJALGSA-N -1 3 358.442 3.599 20 0 FHADHM CC(C)Sc1ccccc1NC(=O)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000820184140 606744653 /nfs/dbraw/zinc/74/46/53/606744653.db2.gz SZZUKPQKOYDZBL-UHFFFAOYSA-N -1 3 353.451 3.548 20 0 FHADHM CC(C)Sc1ccccc1NC(=O)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000820184140 606744655 /nfs/dbraw/zinc/74/46/55/606744655.db2.gz SZZUKPQKOYDZBL-UHFFFAOYSA-N -1 3 353.451 3.548 20 0 FHADHM C[C@H](OC(=O)c1c(F)cc(-c2nnn[n-]2)cc1F)c1cccc(Cl)c1 ZINC000820500684 606747881 /nfs/dbraw/zinc/74/78/81/606747881.db2.gz FYLQKWQCRSSDKE-QMMMGPOBSA-N -1 3 364.739 3.716 20 0 FHADHM C[C@H](OC(=O)c1c(F)cc(-c2nn[n-]n2)cc1F)c1cccc(Cl)c1 ZINC000820500684 606747883 /nfs/dbraw/zinc/74/78/83/606747883.db2.gz FYLQKWQCRSSDKE-QMMMGPOBSA-N -1 3 364.739 3.716 20 0 FHADHM CC(C)CC[C@H]1CCCCN1C(=O)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000820072699 606748150 /nfs/dbraw/zinc/74/81/50/606748150.db2.gz KYMCHYGQUUMIPD-CYBMUJFWSA-N -1 3 363.412 3.576 20 0 FHADHM CC(C)CC[C@H]1CCCCN1C(=O)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000820072699 606748152 /nfs/dbraw/zinc/74/81/52/606748152.db2.gz KYMCHYGQUUMIPD-CYBMUJFWSA-N -1 3 363.412 3.576 20 0 FHADHM CC(C)c1cc(C(=O)Nc2ccccc2-c2nnn[n-]2)c2ccccc2n1 ZINC000820187463 606761316 /nfs/dbraw/zinc/76/13/16/606761316.db2.gz CBUCUFOTFRMSIL-UHFFFAOYSA-N -1 3 358.405 3.791 20 0 FHADHM CC(C)c1cc(C(=O)Nc2ccccc2-c2nn[n-]n2)c2ccccc2n1 ZINC000820187463 606761317 /nfs/dbraw/zinc/76/13/17/606761317.db2.gz CBUCUFOTFRMSIL-UHFFFAOYSA-N -1 3 358.405 3.791 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(OCc2cc(-c3ccccc3)on2)c1 ZINC000822568216 606782940 /nfs/dbraw/zinc/78/29/40/606782940.db2.gz NMXULGGTGMWKPU-UHFFFAOYSA-N -1 3 353.769 3.754 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(OCc2cc(-c3ccccc3)on2)c1 ZINC000822568216 606782941 /nfs/dbraw/zinc/78/29/41/606782941.db2.gz NMXULGGTGMWKPU-UHFFFAOYSA-N -1 3 353.769 3.754 20 0 FHADHM Cc1ccc2c(COc3cc(Cl)ccc3-c3nnn[n-]3)cc(=O)oc2c1 ZINC000822274874 606787150 /nfs/dbraw/zinc/78/71/50/606787150.db2.gz KZBPYAJOEUNYER-UHFFFAOYSA-N -1 3 368.780 3.514 20 0 FHADHM Cc1ccc2c(COc3cc(Cl)ccc3-c3nn[n-]n3)cc(=O)oc2c1 ZINC000822274874 606787152 /nfs/dbraw/zinc/78/71/52/606787152.db2.gz KZBPYAJOEUNYER-UHFFFAOYSA-N -1 3 368.780 3.514 20 0 FHADHM CCN(C(=O)c1cc(F)cc(Cl)c1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821160045 606787364 /nfs/dbraw/zinc/78/73/64/606787364.db2.gz GHFADZVQKIPHPR-LLVKDONJSA-N -1 3 373.819 3.883 20 0 FHADHM CCN(C(=O)c1cc(F)cc(Cl)c1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821160045 606787366 /nfs/dbraw/zinc/78/73/66/606787366.db2.gz GHFADZVQKIPHPR-LLVKDONJSA-N -1 3 373.819 3.883 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1Oc1ccc(C(=O)N2CCC2(C)C)cc1 ZINC000822138045 606792823 /nfs/dbraw/zinc/79/28/23/606792823.db2.gz ZDJNWIUDMGEMPL-UHFFFAOYSA-N -1 3 363.421 3.592 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1Oc1ccc(C(=O)N2CCC2(C)C)cc1 ZINC000822138045 606792826 /nfs/dbraw/zinc/79/28/26/606792826.db2.gz ZDJNWIUDMGEMPL-UHFFFAOYSA-N -1 3 363.421 3.592 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1CSCc1ccn(C2CCCC2)n1 ZINC000822743911 606841631 /nfs/dbraw/zinc/84/16/31/606841631.db2.gz IOGGAPCAOCDNLS-UHFFFAOYSA-N -1 3 358.446 3.751 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CSCc1ccn(C2CCCC2)n1 ZINC000822743911 606841633 /nfs/dbraw/zinc/84/16/33/606841633.db2.gz IOGGAPCAOCDNLS-UHFFFAOYSA-N -1 3 358.446 3.751 20 0 FHADHM COC(=O)c1ccc([C@H](C)Sc2ccc(-c3nnn[n-]3)cc2Cl)o1 ZINC000821668644 606853534 /nfs/dbraw/zinc/85/35/34/606853534.db2.gz BVYWJLNMJSJHEW-QMMMGPOBSA-N -1 3 364.814 3.753 20 0 FHADHM COC(=O)c1ccc([C@H](C)Sc2ccc(-c3nn[n-]n3)cc2Cl)o1 ZINC000821668644 606853536 /nfs/dbraw/zinc/85/35/36/606853536.db2.gz BVYWJLNMJSJHEW-QMMMGPOBSA-N -1 3 364.814 3.753 20 0 FHADHM O=C(c1sccc1-c1nnn[n-]1)N(c1ccc(F)cc1)C1CCCC1 ZINC000823497957 606856267 /nfs/dbraw/zinc/85/62/67/606856267.db2.gz BUXMMEFSNKWDCT-UHFFFAOYSA-N -1 3 357.414 3.657 20 0 FHADHM O=C(c1sccc1-c1nn[n-]n1)N(c1ccc(F)cc1)C1CCCC1 ZINC000823497957 606856268 /nfs/dbraw/zinc/85/62/68/606856268.db2.gz BUXMMEFSNKWDCT-UHFFFAOYSA-N -1 3 357.414 3.657 20 0 FHADHM Cl/C=C(\Cl)CNc1ccccc1Oc1ncccc1-c1nnn[n-]1 ZINC000822563711 606864348 /nfs/dbraw/zinc/86/43/48/606864348.db2.gz MDQAETHJXOPXGU-NTMALXAHSA-N -1 3 363.208 3.785 20 0 FHADHM Cc1cc(Cl)cc(C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)c1 ZINC000822201303 606872373 /nfs/dbraw/zinc/87/23/73/606872373.db2.gz ZUYZCCSWRCBXPK-UHFFFAOYSA-N -1 3 369.856 3.879 20 0 FHADHM Cc1cc(Cl)cc(C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)c1 ZINC000822201303 606872375 /nfs/dbraw/zinc/87/23/75/606872375.db2.gz ZUYZCCSWRCBXPK-UHFFFAOYSA-N -1 3 369.856 3.879 20 0 FHADHM FC(F)(F)c1ccc(N2CCC[C@H]2c2cccnc2)c(-c2nnn[n-]2)c1 ZINC000822723454 606918354 /nfs/dbraw/zinc/91/83/54/606918354.db2.gz FNYVOYTUDFJMOV-AWEZNQCLSA-N -1 3 360.343 3.622 20 0 FHADHM FC(F)(F)c1ccc(N2CCC[C@H]2c2cccnc2)c(-c2nn[n-]n2)c1 ZINC000822723454 606918357 /nfs/dbraw/zinc/91/83/57/606918357.db2.gz FNYVOYTUDFJMOV-AWEZNQCLSA-N -1 3 360.343 3.622 20 0 FHADHM CN(C(=O)[C@H]1C[C@@H]1C1CCCCC1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821569526 606959019 /nfs/dbraw/zinc/95/90/19/606959019.db2.gz NDXKLGINPXKTDB-CABCVRRESA-N -1 3 359.861 3.699 20 0 FHADHM CN(C(=O)[C@H]1C[C@@H]1C1CCCCC1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821569526 606959021 /nfs/dbraw/zinc/95/90/21/606959021.db2.gz NDXKLGINPXKTDB-CABCVRRESA-N -1 3 359.861 3.699 20 0 FHADHM Cc1cccc([C@H](C)C(=O)N(C)c2cc(Cl)ccc2-c2nnn[n-]2)c1 ZINC000822289184 606965362 /nfs/dbraw/zinc/96/53/62/606965362.db2.gz UDWZBICVUXFODO-LBPRGKRZSA-N -1 3 355.829 3.595 20 0 FHADHM Cc1cccc([C@H](C)C(=O)N(C)c2cc(Cl)ccc2-c2nn[n-]n2)c1 ZINC000822289184 606965364 /nfs/dbraw/zinc/96/53/64/606965364.db2.gz UDWZBICVUXFODO-LBPRGKRZSA-N -1 3 355.829 3.595 20 0 FHADHM CSc1ccc(Cl)c(C(=O)N(C)c2ccccc2-c2nnn[n-]2)c1 ZINC000821984341 606971712 /nfs/dbraw/zinc/97/17/12/606971712.db2.gz NIFYYXIUALDPBC-UHFFFAOYSA-N -1 3 359.842 3.519 20 0 FHADHM CSc1ccc(Cl)c(C(=O)N(C)c2ccccc2-c2nn[n-]n2)c1 ZINC000821984341 606971714 /nfs/dbraw/zinc/97/17/14/606971714.db2.gz NIFYYXIUALDPBC-UHFFFAOYSA-N -1 3 359.842 3.519 20 0 FHADHM O=C(Cc1csc2ccccc12)OCc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000823118899 606995663 /nfs/dbraw/zinc/99/56/63/606995663.db2.gz UQAZVHBBFJITLU-UHFFFAOYSA-N -1 3 368.393 3.506 20 0 FHADHM O=C(Cc1csc2ccccc12)OCc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000823118899 606995665 /nfs/dbraw/zinc/99/56/65/606995665.db2.gz UQAZVHBBFJITLU-UHFFFAOYSA-N -1 3 368.393 3.506 20 0 FHADHM O=C(OCc1ccc(F)c(-c2nnn[n-]2)c1)[C@@H]1C[C@@H]1c1cccc(Cl)c1 ZINC000823422400 606997973 /nfs/dbraw/zinc/99/79/73/606997973.db2.gz UAIFBXCJZCSOGR-ZIAGYGMSSA-N -1 3 372.787 3.506 20 0 FHADHM O=C(OCc1ccc(F)c(-c2nn[n-]n2)c1)[C@@H]1C[C@@H]1c1cccc(Cl)c1 ZINC000823422400 606997974 /nfs/dbraw/zinc/99/79/74/606997974.db2.gz UAIFBXCJZCSOGR-ZIAGYGMSSA-N -1 3 372.787 3.506 20 0 FHADHM O=C(CSc1cccc(-c2nnn[n-]2)c1)Nc1ccc2ccccc2c1 ZINC000823071016 607011201 /nfs/dbraw/zinc/01/12/01/607011201.db2.gz XPVMSJVTFHLDDP-UHFFFAOYSA-N -1 3 361.430 3.751 20 0 FHADHM O=C(CSc1cccc(-c2nn[n-]n2)c1)Nc1ccc2ccccc2c1 ZINC000823071016 607011202 /nfs/dbraw/zinc/01/12/02/607011202.db2.gz XPVMSJVTFHLDDP-UHFFFAOYSA-N -1 3 361.430 3.751 20 0 FHADHM CCc1ccc2c(CSc3cccc(-c4nnn[n-]4)c3)cc(=O)oc2c1 ZINC000821486359 607011704 /nfs/dbraw/zinc/01/17/04/607011704.db2.gz DFLWOIIGPKFXMT-UHFFFAOYSA-N -1 3 364.430 3.828 20 0 FHADHM CCc1ccc2c(CSc3cccc(-c4nn[n-]n4)c3)cc(=O)oc2c1 ZINC000821486359 607011705 /nfs/dbraw/zinc/01/17/05/607011705.db2.gz DFLWOIIGPKFXMT-UHFFFAOYSA-N -1 3 364.430 3.828 20 0 FHADHM CN(C)C(=O)Sc1cccc(CSc2cccc(-c3nnn[n-]3)c2)c1 ZINC000821578139 607013365 /nfs/dbraw/zinc/01/33/65/607013365.db2.gz PENJVFZRLVMASD-UHFFFAOYSA-N -1 3 371.491 3.933 20 0 FHADHM CN(C)C(=O)Sc1cccc(CSc2cccc(-c3nn[n-]n3)c2)c1 ZINC000821578139 607013367 /nfs/dbraw/zinc/01/33/67/607013367.db2.gz PENJVFZRLVMASD-UHFFFAOYSA-N -1 3 371.491 3.933 20 0 FHADHM COc1ccc(Cl)cc1[C@H](C)NCc1ccc(-c2nnn[n-]2)cc1F ZINC000821824137 607059172 /nfs/dbraw/zinc/05/91/72/607059172.db2.gz HXCOGXJBFPJQCF-JTQLQIEISA-N -1 3 361.808 3.519 20 0 FHADHM COc1ccc(Cl)cc1[C@H](C)NCc1ccc(-c2nn[n-]n2)cc1F ZINC000821824137 607059173 /nfs/dbraw/zinc/05/91/73/607059173.db2.gz HXCOGXJBFPJQCF-JTQLQIEISA-N -1 3 361.808 3.519 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)N(C1CC1)C1CCCCC1 ZINC000821407567 607065752 /nfs/dbraw/zinc/06/57/52/607065752.db2.gz UHADHUXDKYGPEA-UHFFFAOYSA-N -1 3 370.457 3.594 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)N(C1CC1)C1CCCCC1 ZINC000821407567 607065753 /nfs/dbraw/zinc/06/57/53/607065753.db2.gz UHADHUXDKYGPEA-UHFFFAOYSA-N -1 3 370.457 3.594 20 0 FHADHM CCC(CC)(CC)CNC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000820882422 607097153 /nfs/dbraw/zinc/09/71/53/607097153.db2.gz RGQFOYKRWHEPKW-UHFFFAOYSA-N -1 3 370.501 3.757 20 0 FHADHM CCC(CC)(CC)CNC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000820882422 607097155 /nfs/dbraw/zinc/09/71/55/607097155.db2.gz RGQFOYKRWHEPKW-UHFFFAOYSA-N -1 3 370.501 3.757 20 0 FHADHM C[C@H]1CN(c2ccc(Cl)cc2-c2nnn[n-]2)C[C@H](c2ccsc2)O1 ZINC000820776448 607116376 /nfs/dbraw/zinc/11/63/76/607116376.db2.gz MASZWLIGYYBMBN-ZUZCIYMTSA-N -1 3 361.858 3.548 20 0 FHADHM C[C@H]1CN(c2ccc(Cl)cc2-c2nn[n-]n2)C[C@H](c2ccsc2)O1 ZINC000820776448 607116377 /nfs/dbraw/zinc/11/63/77/607116377.db2.gz MASZWLIGYYBMBN-ZUZCIYMTSA-N -1 3 361.858 3.548 20 0 FHADHM Cc1coc(-c2ccc(C)c(NCc3ccc(-c4nnn[n-]4)cc3F)c2)n1 ZINC000822403721 607125625 /nfs/dbraw/zinc/12/56/25/607125625.db2.gz SMEZYDONWFRELZ-UHFFFAOYSA-N -1 3 364.384 3.890 20 0 FHADHM Cc1coc(-c2ccc(C)c(NCc3ccc(-c4nn[n-]n4)cc3F)c2)n1 ZINC000822403721 607125627 /nfs/dbraw/zinc/12/56/27/607125627.db2.gz SMEZYDONWFRELZ-UHFFFAOYSA-N -1 3 364.384 3.890 20 0 FHADHM Cc1ccn(-c2ccccc2CNc2ccc(Cl)cc2-c2nnn[n-]2)n1 ZINC000822369881 607126251 /nfs/dbraw/zinc/12/62/51/607126251.db2.gz OBOUADJXZOXYLM-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM Cc1ccn(-c2ccccc2CNc2ccc(Cl)cc2-c2nn[n-]n2)n1 ZINC000822369881 607126252 /nfs/dbraw/zinc/12/62/52/607126252.db2.gz OBOUADJXZOXYLM-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM CCCC1(CNC(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)CC1 ZINC000821034889 607137669 /nfs/dbraw/zinc/13/76/69/607137669.db2.gz WAHZPNFXXDICHO-UHFFFAOYSA-N -1 3 361.449 3.844 20 0 FHADHM CCCC1(CNC(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)CC1 ZINC000821034889 607137671 /nfs/dbraw/zinc/13/76/71/607137671.db2.gz WAHZPNFXXDICHO-UHFFFAOYSA-N -1 3 361.449 3.844 20 0 FHADHM CCC[C@H](C)[C@H]1CCCN1C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821014204 607152711 /nfs/dbraw/zinc/15/27/11/607152711.db2.gz BTHPAJHDVGHHAA-JJRVBVJISA-N -1 3 356.474 3.538 20 0 FHADHM CCC[C@H](C)[C@H]1CCCN1C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821014204 607152713 /nfs/dbraw/zinc/15/27/13/607152713.db2.gz BTHPAJHDVGHHAA-JJRVBVJISA-N -1 3 356.474 3.538 20 0 FHADHM CCc1cc(C)c(C(=O)N(CC)[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)o1 ZINC000821471201 607156684 /nfs/dbraw/zinc/15/66/84/607156684.db2.gz WXHBEVDRQAHSTE-ZDUSSCGKSA-N -1 3 353.426 3.554 20 0 FHADHM CCc1cc(C)c(C(=O)N(CC)[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)o1 ZINC000821471201 607156685 /nfs/dbraw/zinc/15/66/85/607156685.db2.gz WXHBEVDRQAHSTE-ZDUSSCGKSA-N -1 3 353.426 3.554 20 0 FHADHM Cc1nc([C@H](C)Nc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)cs1 ZINC000822427108 607174082 /nfs/dbraw/zinc/17/40/82/607174082.db2.gz CQZYCDGWGCDBBN-ZETCQYMHSA-N -1 3 354.361 3.824 20 0 FHADHM Cc1nc([C@H](C)Nc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)cs1 ZINC000822427108 607174081 /nfs/dbraw/zinc/17/40/81/607174081.db2.gz CQZYCDGWGCDBBN-ZETCQYMHSA-N -1 3 354.361 3.824 20 0 FHADHM Cc1cc(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)c2ccccc2n1 ZINC000822176016 607189334 /nfs/dbraw/zinc/18/93/34/607189334.db2.gz DPWJTZDWWDPVQV-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1cc(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)c2ccccc2n1 ZINC000822176016 607189335 /nfs/dbraw/zinc/18/93/35/607189335.db2.gz DPWJTZDWWDPVQV-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM O=C(CCc1ccc(Cl)cc1)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822978618 607189357 /nfs/dbraw/zinc/18/93/57/607189357.db2.gz OBJVABMKXIKKCW-UHFFFAOYSA-N -1 3 362.220 3.745 20 0 FHADHM O=C(CCc1ccc(Cl)cc1)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822978618 607189358 /nfs/dbraw/zinc/18/93/58/607189358.db2.gz OBJVABMKXIKKCW-UHFFFAOYSA-N -1 3 362.220 3.745 20 0 FHADHM O=C(C/C=C/c1ccc(F)cc1)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822945932 607190235 /nfs/dbraw/zinc/19/02/35/607190235.db2.gz UIDFNOWTUWILSQ-OWOJBTEDSA-N -1 3 357.776 3.701 20 0 FHADHM O=C(C/C=C/c1ccc(F)cc1)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822945932 607190236 /nfs/dbraw/zinc/19/02/36/607190236.db2.gz UIDFNOWTUWILSQ-OWOJBTEDSA-N -1 3 357.776 3.701 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000823315628 607190282 /nfs/dbraw/zinc/19/02/82/607190282.db2.gz ZUEXTIDWIUKPDP-ZJUUUORDSA-N -1 3 373.766 3.827 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000823315628 607190283 /nfs/dbraw/zinc/19/02/83/607190283.db2.gz ZUEXTIDWIUKPDP-ZJUUUORDSA-N -1 3 373.766 3.827 20 0 FHADHM C[C@H](CC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1cccc(F)c1 ZINC000820225971 607191708 /nfs/dbraw/zinc/19/17/08/607191708.db2.gz QYTYBNIHVYNYGL-SNVBAGLBSA-N -1 3 359.792 3.792 20 0 FHADHM C[C@H](CC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1cccc(F)c1 ZINC000820225971 607191709 /nfs/dbraw/zinc/19/17/09/607191709.db2.gz QYTYBNIHVYNYGL-SNVBAGLBSA-N -1 3 359.792 3.792 20 0 FHADHM C[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820675217 607196438 /nfs/dbraw/zinc/19/64/38/607196438.db2.gz ILFMIEVKTBFXJG-JRPNMDOOSA-N -1 3 360.849 3.705 20 0 FHADHM C[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820675217 607196439 /nfs/dbraw/zinc/19/64/39/607196439.db2.gz ILFMIEVKTBFXJG-JRPNMDOOSA-N -1 3 360.849 3.705 20 0 FHADHM Cc1ccc(CC[C@@H](C)NC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)o1 ZINC000822235242 607196748 /nfs/dbraw/zinc/19/67/48/607196748.db2.gz YRRGIKIFFHPDBJ-SNVBAGLBSA-N -1 3 374.832 3.564 20 0 FHADHM Cc1ccc(CC[C@@H](C)NC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)o1 ZINC000822235242 607196749 /nfs/dbraw/zinc/19/67/49/607196749.db2.gz YRRGIKIFFHPDBJ-SNVBAGLBSA-N -1 3 374.832 3.564 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N[C@H]1CCCc2ccccc21 ZINC000823319730 607201613 /nfs/dbraw/zinc/20/16/13/607201613.db2.gz YAWIUIVBMJAUGH-HNNXBMFYSA-N -1 3 368.828 3.719 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N[C@H]1CCCc2ccccc21 ZINC000823319730 607201614 /nfs/dbraw/zinc/20/16/14/607201614.db2.gz YAWIUIVBMJAUGH-HNNXBMFYSA-N -1 3 368.828 3.719 20 0 FHADHM O=C(NCCCCc1ccccc1)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000823188033 607202803 /nfs/dbraw/zinc/20/28/03/607202803.db2.gz SXYIOINOLRHDTC-UHFFFAOYSA-N -1 3 370.844 3.665 20 0 FHADHM O=C(NCCCCc1ccccc1)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000823188033 607202804 /nfs/dbraw/zinc/20/28/04/607202804.db2.gz SXYIOINOLRHDTC-UHFFFAOYSA-N -1 3 370.844 3.665 20 0 FHADHM O=C(NCc1cc2ccccc2o1)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000823246420 607203683 /nfs/dbraw/zinc/20/36/83/607203683.db2.gz ORDKCXCNNJHRAG-UHFFFAOYSA-N -1 3 368.784 3.588 20 0 FHADHM O=C(NCc1cc2ccccc2o1)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000823246420 607203684 /nfs/dbraw/zinc/20/36/84/607203684.db2.gz ORDKCXCNNJHRAG-UHFFFAOYSA-N -1 3 368.784 3.588 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N1CCC(C2CCCC2)CC1 ZINC000823313885 607204793 /nfs/dbraw/zinc/20/47/93/607204793.db2.gz KZFZYARFKAWQSO-UHFFFAOYSA-N -1 3 374.876 3.954 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N1CCC(C2CCCC2)CC1 ZINC000823313885 607204794 /nfs/dbraw/zinc/20/47/94/607204794.db2.gz KZFZYARFKAWQSO-UHFFFAOYSA-N -1 3 374.876 3.954 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)c2ccc(F)c(Cl)c2)s1 ZINC000821465286 607237526 /nfs/dbraw/zinc/23/75/26/607237526.db2.gz DWICDGGBBPLGOR-UHFFFAOYSA-N -1 3 351.794 3.535 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)c2ccc(F)c(Cl)c2)s1 ZINC000821465286 607237527 /nfs/dbraw/zinc/23/75/27/607237527.db2.gz DWICDGGBBPLGOR-UHFFFAOYSA-N -1 3 351.794 3.535 20 0 FHADHM C[C@@H](OC(=O)Cc1ccc(F)cc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000820496054 607238992 /nfs/dbraw/zinc/23/89/92/607238992.db2.gz LEFVSGDJYITBIS-SNVBAGLBSA-N -1 3 360.776 3.506 20 0 FHADHM C[C@@H](OC(=O)Cc1ccc(F)cc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000820496054 607238993 /nfs/dbraw/zinc/23/89/93/607238993.db2.gz LEFVSGDJYITBIS-SNVBAGLBSA-N -1 3 360.776 3.506 20 0 FHADHM O=C(C/C=C/c1cccc(F)c1)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822946418 607240935 /nfs/dbraw/zinc/24/09/35/607240935.db2.gz XJRJKDHCFYREJV-DUXPYHPUSA-N -1 3 357.776 3.701 20 0 FHADHM O=C(C/C=C/c1cccc(F)c1)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822946418 607240936 /nfs/dbraw/zinc/24/09/36/607240936.db2.gz XJRJKDHCFYREJV-DUXPYHPUSA-N -1 3 357.776 3.701 20 0 FHADHM CC[C@H](Oc1ccccc1C)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820939540 607243611 /nfs/dbraw/zinc/24/36/11/607243611.db2.gz WCZGQTIBAZYWHK-HNNXBMFYSA-N -1 3 371.828 3.625 20 0 FHADHM CC[C@H](Oc1ccccc1C)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820939540 607243612 /nfs/dbraw/zinc/24/36/12/607243612.db2.gz WCZGQTIBAZYWHK-HNNXBMFYSA-N -1 3 371.828 3.625 20 0 FHADHM COc1ccc(NC(=S)Nc2cccc(-c3nnn[n-]3)c2C)cc1Cl ZINC000821835974 607252052 /nfs/dbraw/zinc/25/20/52/607252052.db2.gz VXOBMCQOWITKMY-UHFFFAOYSA-N -1 3 374.857 3.646 20 0 FHADHM COc1ccc(NC(=S)Nc2cccc(-c3nn[n-]n3)c2C)cc1Cl ZINC000821835974 607252053 /nfs/dbraw/zinc/25/20/53/607252053.db2.gz VXOBMCQOWITKMY-UHFFFAOYSA-N -1 3 374.857 3.646 20 0 FHADHM O=C(CSc1ccc(-c2nnn[n-]2)cc1)Nc1cccc2ccsc21 ZINC000826421139 607772651 /nfs/dbraw/zinc/77/26/51/607772651.db2.gz UDLFMUFMKAWEEV-UHFFFAOYSA-N -1 3 367.459 3.812 20 0 FHADHM O=C(CSc1ccc(-c2nn[n-]n2)cc1)Nc1cccc2ccsc21 ZINC000826421139 607772652 /nfs/dbraw/zinc/77/26/52/607772652.db2.gz UDLFMUFMKAWEEV-UHFFFAOYSA-N -1 3 367.459 3.812 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@H](C)c2cccc(F)c2)cc1-c1nnn[n-]1 ZINC000825552728 607783982 /nfs/dbraw/zinc/78/39/82/607783982.db2.gz DCZCDRYJVJPGBY-LLVKDONJSA-N -1 3 370.388 3.747 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@H](C)c2cccc(F)c2)cc1-c1nn[n-]n1 ZINC000825552728 607783983 /nfs/dbraw/zinc/78/39/83/607783983.db2.gz DCZCDRYJVJPGBY-LLVKDONJSA-N -1 3 370.388 3.747 20 0 FHADHM C[C@H](SCc1nc(C2CCCC2)no1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824755313 607784482 /nfs/dbraw/zinc/78/44/82/607784482.db2.gz LDDUSADZPUZIAM-NSHDSACASA-N -1 3 356.455 3.902 20 0 FHADHM C[C@H](SCc1nc(C2CCCC2)no1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824755313 607784483 /nfs/dbraw/zinc/78/44/83/607784483.db2.gz LDDUSADZPUZIAM-NSHDSACASA-N -1 3 356.455 3.902 20 0 FHADHM COc1cccc(OCCS[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000826217730 607785068 /nfs/dbraw/zinc/78/50/68/607785068.db2.gz ZTXADKAXDZBWIA-CYBMUJFWSA-N -1 3 356.451 3.749 20 0 FHADHM COc1cccc(OCCS[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000826217730 607785069 /nfs/dbraw/zinc/78/50/69/607785069.db2.gz ZTXADKAXDZBWIA-CYBMUJFWSA-N -1 3 356.451 3.749 20 0 FHADHM CN(C(=O)CCc1ccc(C(C)(C)C)cc1)c1ccccc1-c1nnn[n-]1 ZINC000825817599 607787211 /nfs/dbraw/zinc/78/72/11/607787211.db2.gz LUTBKRJRLJAMIE-UHFFFAOYSA-N -1 3 363.465 3.760 20 0 FHADHM CN(C(=O)CCc1ccc(C(C)(C)C)cc1)c1ccccc1-c1nn[n-]n1 ZINC000825817599 607787212 /nfs/dbraw/zinc/78/72/12/607787212.db2.gz LUTBKRJRLJAMIE-UHFFFAOYSA-N -1 3 363.465 3.760 20 0 FHADHM CC(C)CCOc1ccc(C(=O)N(C)c2ccccc2-c2nnn[n-]2)cc1 ZINC000824249352 607787988 /nfs/dbraw/zinc/78/79/88/607787988.db2.gz MIOZNQIGCUARJX-UHFFFAOYSA-N -1 3 365.437 3.568 20 0 FHADHM CC(C)CCOc1ccc(C(=O)N(C)c2ccccc2-c2nn[n-]n2)cc1 ZINC000824249352 607787989 /nfs/dbraw/zinc/78/79/89/607787989.db2.gz MIOZNQIGCUARJX-UHFFFAOYSA-N -1 3 365.437 3.568 20 0 FHADHM C[C@@H](Sc1ccccc1Cl)C(=O)N(C)c1ccccc1-c1nnn[n-]1 ZINC000824763272 607790509 /nfs/dbraw/zinc/79/05/09/607790509.db2.gz MMSRPUOQUSKZOH-LLVKDONJSA-N -1 3 373.869 3.664 20 0 FHADHM C[C@@H](Sc1ccccc1Cl)C(=O)N(C)c1ccccc1-c1nn[n-]n1 ZINC000824763272 607790510 /nfs/dbraw/zinc/79/05/10/607790510.db2.gz MMSRPUOQUSKZOH-LLVKDONJSA-N -1 3 373.869 3.664 20 0 FHADHM CC[C@H](C)Oc1ccc(C(=O)N(CC)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000825074375 607796880 /nfs/dbraw/zinc/79/68/80/607796880.db2.gz HJVJMWGCGBCSIE-AWEZNQCLSA-N -1 3 365.437 3.711 20 0 FHADHM CC[C@H](C)Oc1ccc(C(=O)N(CC)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000825074375 607796881 /nfs/dbraw/zinc/79/68/81/607796881.db2.gz HJVJMWGCGBCSIE-AWEZNQCLSA-N -1 3 365.437 3.711 20 0 FHADHM CCN(C(=O)CCCc1sccc1C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825371160 607799010 /nfs/dbraw/zinc/79/90/10/607799010.db2.gz CRZXMWSZEWZGPZ-UHFFFAOYSA-N -1 3 355.467 3.612 20 0 FHADHM CCN(C(=O)CCCc1sccc1C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825371160 607799011 /nfs/dbraw/zinc/79/90/11/607799011.db2.gz CRZXMWSZEWZGPZ-UHFFFAOYSA-N -1 3 355.467 3.612 20 0 FHADHM CCN(C(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825367321 607799077 /nfs/dbraw/zinc/79/90/77/607799077.db2.gz NGWHJFCKQTVDEB-IAGOWNOFSA-N -1 3 367.840 3.677 20 0 FHADHM CCN(C(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825367321 607799078 /nfs/dbraw/zinc/79/90/78/607799078.db2.gz NGWHJFCKQTVDEB-IAGOWNOFSA-N -1 3 367.840 3.677 20 0 FHADHM CCN(C(=O)[C@H]1C[C@@]12CCCc1ccccc12)c1ccc(-c2nnn[n-]2)cc1 ZINC000825367360 607799971 /nfs/dbraw/zinc/79/99/71/607799971.db2.gz OEHZDUMEAAGOMG-DENIHFKCSA-N -1 3 373.460 3.514 20 0 FHADHM CCN(C(=O)[C@H]1C[C@@]12CCCc1ccccc12)c1ccc(-c2nn[n-]n2)cc1 ZINC000825367360 607799972 /nfs/dbraw/zinc/79/99/72/607799972.db2.gz OEHZDUMEAAGOMG-DENIHFKCSA-N -1 3 373.460 3.514 20 0 FHADHM C[C@H](OC(=O)c1cc(-c2nnn[n-]2)cs1)c1ccc(C(F)(F)F)cc1 ZINC000820508599 607801142 /nfs/dbraw/zinc/80/11/42/607801142.db2.gz SNRHRQZTTGRBJV-QMMMGPOBSA-N -1 3 368.340 3.865 20 0 FHADHM C[C@H](OC(=O)c1cc(-c2nn[n-]n2)cs1)c1ccc(C(F)(F)F)cc1 ZINC000820508599 607801143 /nfs/dbraw/zinc/80/11/43/607801143.db2.gz SNRHRQZTTGRBJV-QMMMGPOBSA-N -1 3 368.340 3.865 20 0 FHADHM C[C@H](Cc1ccccc1Cl)C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000824456903 607815996 /nfs/dbraw/zinc/81/59/96/607815996.db2.gz AHWCKRAIXHJDDY-CHWSQXEVSA-N -1 3 369.856 3.576 20 0 FHADHM C[C@H](Cc1ccccc1Cl)C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000824456903 607815997 /nfs/dbraw/zinc/81/59/97/607815997.db2.gz AHWCKRAIXHJDDY-CHWSQXEVSA-N -1 3 369.856 3.576 20 0 FHADHM O=C(c1c(Cl)cc(-c2nnn[n-]2)cc1Cl)N1CCCCCCC1 ZINC000826469116 607833677 /nfs/dbraw/zinc/83/36/77/607833677.db2.gz VGEVRWKSAFISLV-UHFFFAOYSA-N -1 3 354.241 3.580 20 0 FHADHM O=C(c1c(Cl)cc(-c2nn[n-]n2)cc1Cl)N1CCCCCCC1 ZINC000826469116 607833678 /nfs/dbraw/zinc/83/36/78/607833678.db2.gz VGEVRWKSAFISLV-UHFFFAOYSA-N -1 3 354.241 3.580 20 0 FHADHM Cc1cccc(N(C)C(=O)c2c(Cl)cc(-c3nnn[n-]3)cc2Cl)c1 ZINC000826298904 607834197 /nfs/dbraw/zinc/83/41/97/607834197.db2.gz KJERZPIWXMUCMD-UHFFFAOYSA-N -1 3 362.220 3.759 20 0 FHADHM Cc1cccc(N(C)C(=O)c2c(Cl)cc(-c3nn[n-]n3)cc2Cl)c1 ZINC000826298904 607834198 /nfs/dbraw/zinc/83/41/98/607834198.db2.gz KJERZPIWXMUCMD-UHFFFAOYSA-N -1 3 362.220 3.759 20 0 FHADHM O[C@@H](CSc1ccc(-c2nnn[n-]2)cc1Cl)c1cc(F)ccc1F ZINC000826505101 607843270 /nfs/dbraw/zinc/84/32/70/607843270.db2.gz MMEJFYYKUSGECG-ZDUSSCGKSA-N -1 3 368.796 3.624 20 0 FHADHM O[C@@H](CSc1ccc(-c2nn[n-]n2)cc1Cl)c1cc(F)ccc1F ZINC000826505101 607843271 /nfs/dbraw/zinc/84/32/71/607843271.db2.gz MMEJFYYKUSGECG-ZDUSSCGKSA-N -1 3 368.796 3.624 20 0 FHADHM FC(F)(F)Cn1ccnc1CSc1ccc(-c2nnn[n-]2)cc1Cl ZINC000826368461 607843863 /nfs/dbraw/zinc/84/38/63/607843863.db2.gz QITUWMBRACRMCB-UHFFFAOYSA-N -1 3 374.779 3.571 20 0 FHADHM FC(F)(F)Cn1ccnc1CSc1ccc(-c2nn[n-]n2)cc1Cl ZINC000826368461 607843864 /nfs/dbraw/zinc/84/38/64/607843864.db2.gz QITUWMBRACRMCB-UHFFFAOYSA-N -1 3 374.779 3.571 20 0 FHADHM COC(=O)[C@@H](Sc1ccc(-c2nnn[n-]2)cc1Cl)c1ccccc1 ZINC000826118173 607844348 /nfs/dbraw/zinc/84/43/48/607844348.db2.gz YECNMDNNJRZYAH-AWEZNQCLSA-N -1 3 360.826 3.527 20 0 FHADHM COC(=O)[C@@H](Sc1ccc(-c2nn[n-]n2)cc1Cl)c1ccccc1 ZINC000826118173 607844349 /nfs/dbraw/zinc/84/43/49/607844349.db2.gz YECNMDNNJRZYAH-AWEZNQCLSA-N -1 3 360.826 3.527 20 0 FHADHM C[C@@H](Sc1ccc(-c2nnn[n-]2)cc1Cl)C(=O)Nc1ccccc1 ZINC000824754659 607844531 /nfs/dbraw/zinc/84/45/31/607844531.db2.gz JAKDEJSQFQSNPI-SNVBAGLBSA-N -1 3 359.842 3.639 20 0 FHADHM C[C@@H](Sc1ccc(-c2nn[n-]n2)cc1Cl)C(=O)Nc1ccccc1 ZINC000824754659 607844532 /nfs/dbraw/zinc/84/45/32/607844532.db2.gz JAKDEJSQFQSNPI-SNVBAGLBSA-N -1 3 359.842 3.639 20 0 FHADHM C[C@@H](Sc1ccc(-c2nnn[n-]2)cc1Cl)C(=O)N(C)c1ccccc1 ZINC000824757407 607844943 /nfs/dbraw/zinc/84/49/43/607844943.db2.gz WDOLWUKBSXQUED-LLVKDONJSA-N -1 3 373.869 3.664 20 0 FHADHM C[C@@H](Sc1ccc(-c2nn[n-]n2)cc1Cl)C(=O)N(C)c1ccccc1 ZINC000824757407 607844944 /nfs/dbraw/zinc/84/49/44/607844944.db2.gz WDOLWUKBSXQUED-LLVKDONJSA-N -1 3 373.869 3.664 20 0 FHADHM C[C@H](Sc1ccc(-c2nnn[n-]2)cc1Cl)C(=O)N(C)c1ccccc1 ZINC000824757409 607845154 /nfs/dbraw/zinc/84/51/54/607845154.db2.gz WDOLWUKBSXQUED-NSHDSACASA-N -1 3 373.869 3.664 20 0 FHADHM C[C@H](Sc1ccc(-c2nn[n-]n2)cc1Cl)C(=O)N(C)c1ccccc1 ZINC000824757409 607845155 /nfs/dbraw/zinc/84/51/55/607845155.db2.gz WDOLWUKBSXQUED-NSHDSACASA-N -1 3 373.869 3.664 20 0 FHADHM Cc1c(NC(=O)c2cccc(-c3ccccn3)c2C)cccc1-c1nnn[n-]1 ZINC000826242547 607861569 /nfs/dbraw/zinc/86/15/69/607861569.db2.gz TZJBKSJHJPTQAD-UHFFFAOYSA-N -1 3 370.416 3.798 20 0 FHADHM Cc1c(NC(=O)c2cccc(-c3ccccn3)c2C)cccc1-c1nn[n-]n1 ZINC000826242547 607861570 /nfs/dbraw/zinc/86/15/70/607861570.db2.gz TZJBKSJHJPTQAD-UHFFFAOYSA-N -1 3 370.416 3.798 20 0 FHADHM O[C@@H](COc1ccc(Oc2ccccc2)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000826505196 607869647 /nfs/dbraw/zinc/86/96/47/607869647.db2.gz PFFNGSGPOHIJNR-FQEVSTJZSA-N -1 3 374.400 3.771 20 0 FHADHM O[C@@H](COc1ccc(Oc2ccccc2)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000826505196 607869648 /nfs/dbraw/zinc/86/96/48/607869648.db2.gz PFFNGSGPOHIJNR-FQEVSTJZSA-N -1 3 374.400 3.771 20 0 FHADHM CCN(C(=O)c1ccc(C)c(C)c1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825380863 607879100 /nfs/dbraw/zinc/87/91/00/607879100.db2.gz WDCZGLAZXAITHR-UHFFFAOYSA-N -1 3 355.829 3.804 20 0 FHADHM CCN(C(=O)c1ccc(C)c(C)c1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825380863 607879101 /nfs/dbraw/zinc/87/91/01/607879101.db2.gz WDCZGLAZXAITHR-UHFFFAOYSA-N -1 3 355.829 3.804 20 0 FHADHM CCN(C(=O)c1ccc(Cl)cc1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825386124 607879142 /nfs/dbraw/zinc/87/91/42/607879142.db2.gz YFQBIJGZQUMMGQ-UHFFFAOYSA-N -1 3 362.220 3.840 20 0 FHADHM CCN(C(=O)c1ccc(Cl)cc1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825386124 607879143 /nfs/dbraw/zinc/87/91/43/607879143.db2.gz YFQBIJGZQUMMGQ-UHFFFAOYSA-N -1 3 362.220 3.840 20 0 FHADHM CS[C@H](C)CC(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)cc1 ZINC000826224506 607934182 /nfs/dbraw/zinc/93/41/82/607934182.db2.gz GSAYWULNXKYOQH-GFCCVEGCSA-N -1 3 369.450 3.739 20 0 FHADHM CS[C@H](C)CC(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)cc1 ZINC000826224506 607934183 /nfs/dbraw/zinc/93/41/83/607934183.db2.gz GSAYWULNXKYOQH-GFCCVEGCSA-N -1 3 369.450 3.739 20 0 FHADHM CS[C@@H](C)CC(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000826225151 607939192 /nfs/dbraw/zinc/93/91/92/607939192.db2.gz VAPCTQZTKJQNHL-LBPRGKRZSA-N -1 3 369.450 3.739 20 0 FHADHM CS[C@@H](C)CC(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000826225151 607939193 /nfs/dbraw/zinc/93/91/93/607939193.db2.gz VAPCTQZTKJQNHL-LBPRGKRZSA-N -1 3 369.450 3.739 20 0 FHADHM CC(C)Sc1ccccc1C(=O)N1CCc2ccc(-c3nnn[n-]3)cc21 ZINC000824337579 607953044 /nfs/dbraw/zinc/95/30/44/607953044.db2.gz BDVCZUGUAOYKNS-UHFFFAOYSA-N -1 3 365.462 3.570 20 0 FHADHM CC(C)Sc1ccccc1C(=O)N1CCc2ccc(-c3nn[n-]n3)cc21 ZINC000824337579 607953045 /nfs/dbraw/zinc/95/30/45/607953045.db2.gz BDVCZUGUAOYKNS-UHFFFAOYSA-N -1 3 365.462 3.570 20 0 FHADHM Cc1nnc(SCc2cccc(-c3nnn[n-]3)c2)n1[C@@H]1CCC[C@@H](C)C1 ZINC000826337723 607966191 /nfs/dbraw/zinc/96/61/91/607966191.db2.gz YWYRBVFRFZANRP-MLGOLLRUSA-N -1 3 369.498 3.810 20 0 FHADHM Cc1nnc(SCc2cccc(-c3nn[n-]n3)c2)n1[C@@H]1CCC[C@@H](C)C1 ZINC000826337723 607966192 /nfs/dbraw/zinc/96/61/92/607966192.db2.gz YWYRBVFRFZANRP-MLGOLLRUSA-N -1 3 369.498 3.810 20 0 FHADHM O=C(Nc1sccc1-c1nnn[n-]1)c1ccccc1CCC(F)(F)F ZINC000826461292 608000336 /nfs/dbraw/zinc/00/03/36/608000336.db2.gz OCQPJWCALCVKTL-UHFFFAOYSA-N -1 3 367.356 3.675 20 0 FHADHM O=C(Nc1sccc1-c1nn[n-]n1)c1ccccc1CCC(F)(F)F ZINC000826461292 608000337 /nfs/dbraw/zinc/00/03/37/608000337.db2.gz OCQPJWCALCVKTL-UHFFFAOYSA-N -1 3 367.356 3.675 20 0 FHADHM c1nc(COc2ccc(-c3ccc(-c4nnn[n-]4)cc3)cc2)oc1C1CC1 ZINC000826512647 608019142 /nfs/dbraw/zinc/01/91/42/608019142.db2.gz IQUCASOHPUFXOW-UHFFFAOYSA-N -1 3 359.389 3.978 20 0 FHADHM c1nc(COc2ccc(-c3ccc(-c4nn[n-]n4)cc3)cc2)oc1C1CC1 ZINC000826512647 608019143 /nfs/dbraw/zinc/01/91/43/608019143.db2.gz IQUCASOHPUFXOW-UHFFFAOYSA-N -1 3 359.389 3.978 20 0 FHADHM C[C@H](NC(=O)c1cccc(-c2ccoc2)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824523155 608023359 /nfs/dbraw/zinc/02/33/59/608023359.db2.gz YEGMNGKMDYVZDE-ZDUSSCGKSA-N -1 3 359.389 3.618 20 0 FHADHM C[C@H](NC(=O)c1cccc(-c2ccoc2)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824523155 608023360 /nfs/dbraw/zinc/02/33/60/608023360.db2.gz YEGMNGKMDYVZDE-ZDUSSCGKSA-N -1 3 359.389 3.618 20 0 FHADHM CCN(C(=O)c1cccc(-c2ccoc2)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825385522 608028947 /nfs/dbraw/zinc/02/89/47/608028947.db2.gz JGYRTLMCPWDQPH-UHFFFAOYSA-N -1 3 359.389 3.793 20 0 FHADHM CCN(C(=O)c1cccc(-c2ccoc2)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825385522 608028948 /nfs/dbraw/zinc/02/89/48/608028948.db2.gz JGYRTLMCPWDQPH-UHFFFAOYSA-N -1 3 359.389 3.793 20 0 FHADHM C[C@@H](Nc1ccc(-c2nn[n-]n2)cc1Br)c1cccc(O)c1 ZINC000824648715 608048618 /nfs/dbraw/zinc/04/86/18/608048618.db2.gz JDSALUPTONBBRD-SECBINFHSA-N -1 3 360.215 3.508 20 0 FHADHM C[C@H](OC(=O)CCCc1cc(F)ccc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000824715308 608067107 /nfs/dbraw/zinc/06/71/07/608067107.db2.gz RDCRXDXKXBMNOM-LBPRGKRZSA-N -1 3 372.375 3.772 20 0 FHADHM C[C@H](OC(=O)CCCc1cc(F)ccc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000824715308 608067108 /nfs/dbraw/zinc/06/71/08/608067108.db2.gz RDCRXDXKXBMNOM-LBPRGKRZSA-N -1 3 372.375 3.772 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nnn[n-]2)c1)c1cc(F)c(Cl)cc1F ZINC000826453650 608114430 /nfs/dbraw/zinc/11/44/30/608114430.db2.gz UJHWNPXHRZFMOK-UHFFFAOYSA-N -1 3 370.146 3.704 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nn[n-]n2)c1)c1cc(F)c(Cl)cc1F ZINC000826453650 608114431 /nfs/dbraw/zinc/11/44/31/608114431.db2.gz UJHWNPXHRZFMOK-UHFFFAOYSA-N -1 3 370.146 3.704 20 0 FHADHM Cc1cc([C@@H]2CN(c3c(Cl)cccc3-c3nnn[n-]3)CCO2)ccc1F ZINC000826266712 608151511 /nfs/dbraw/zinc/15/15/11/608151511.db2.gz YQGRBZRPJQABHK-INIZCTEOSA-N -1 3 373.819 3.546 20 0 FHADHM Cc1cc([C@@H]2CN(c3c(Cl)cccc3-c3nn[n-]n3)CCO2)ccc1F ZINC000826266712 608151512 /nfs/dbraw/zinc/15/15/12/608151512.db2.gz YQGRBZRPJQABHK-INIZCTEOSA-N -1 3 373.819 3.546 20 0 FHADHM C[C@@H](OC(=O)[C@@H](C)c1c(F)cccc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000824707105 608159044 /nfs/dbraw/zinc/15/90/44/608159044.db2.gz NMFYVQRXQZNSIN-WDEREUQCSA-N -1 3 358.348 3.553 20 0 FHADHM C[C@@H](OC(=O)[C@@H](C)c1c(F)cccc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000824707105 608159046 /nfs/dbraw/zinc/15/90/46/608159046.db2.gz NMFYVQRXQZNSIN-WDEREUQCSA-N -1 3 358.348 3.553 20 0 FHADHM Cc1ccc(F)c([C@H](C)OC(=O)CCc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000826288931 608164856 /nfs/dbraw/zinc/16/48/56/608164856.db2.gz CGKWXAIYSIOYDY-ZDUSSCGKSA-N -1 3 354.385 3.551 20 0 FHADHM Cc1ccc(F)c([C@H](C)OC(=O)CCc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000826288931 608164858 /nfs/dbraw/zinc/16/48/58/608164858.db2.gz CGKWXAIYSIOYDY-ZDUSSCGKSA-N -1 3 354.385 3.551 20 0 FHADHM C[C@H](OC(=O)C(C)(C)c1ccccc1F)c1cccc(-c2nnn[n-]2)c1 ZINC000824705768 608181209 /nfs/dbraw/zinc/18/12/09/608181209.db2.gz DHUYPKMTVQHGGZ-LBPRGKRZSA-N -1 3 354.385 3.588 20 0 FHADHM C[C@H](OC(=O)C(C)(C)c1ccccc1F)c1cccc(-c2nn[n-]n2)c1 ZINC000824705768 608181211 /nfs/dbraw/zinc/18/12/11/608181211.db2.gz DHUYPKMTVQHGGZ-LBPRGKRZSA-N -1 3 354.385 3.588 20 0 FHADHM C[C@@H](OC(=O)C(C)(C)c1ccccc1F)c1cccc(-c2nnn[n-]2)c1 ZINC000824705767 608181397 /nfs/dbraw/zinc/18/13/97/608181397.db2.gz DHUYPKMTVQHGGZ-GFCCVEGCSA-N -1 3 354.385 3.588 20 0 FHADHM C[C@@H](OC(=O)C(C)(C)c1ccccc1F)c1cccc(-c2nn[n-]n2)c1 ZINC000824705767 608181398 /nfs/dbraw/zinc/18/13/98/608181398.db2.gz DHUYPKMTVQHGGZ-GFCCVEGCSA-N -1 3 354.385 3.588 20 0 FHADHM C[C@H](OC(=O)[C@H]1SCCc2ccccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000824716660 608181721 /nfs/dbraw/zinc/18/17/21/608181721.db2.gz ZWJPTLYZKUATET-SJCJKPOMSA-N -1 3 366.446 3.502 20 0 FHADHM C[C@H](OC(=O)[C@H]1SCCc2ccccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000824716660 608181722 /nfs/dbraw/zinc/18/17/22/608181722.db2.gz ZWJPTLYZKUATET-SJCJKPOMSA-N -1 3 366.446 3.502 20 0 FHADHM C[C@H](OC(=O)C1(c2cccc(Cl)c2)CC1)c1cccc(-c2nnn[n-]2)c1 ZINC000824713368 608181734 /nfs/dbraw/zinc/18/17/34/608181734.db2.gz HSLYYKGYXWKLSS-LBPRGKRZSA-N -1 3 368.824 3.856 20 0 FHADHM C[C@H](OC(=O)C1(c2cccc(Cl)c2)CC1)c1cccc(-c2nn[n-]n2)c1 ZINC000824713368 608181736 /nfs/dbraw/zinc/18/17/36/608181736.db2.gz HSLYYKGYXWKLSS-LBPRGKRZSA-N -1 3 368.824 3.856 20 0 FHADHM Cc1nsc(Nc2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)n1 ZINC000826340410 608182335 /nfs/dbraw/zinc/18/23/35/608182335.db2.gz XMWMKXHBKFKHBJ-UHFFFAOYSA-N -1 3 351.395 3.563 20 0 FHADHM C[C@@H](C(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1c(F)cccc1F ZINC000824705494 608182808 /nfs/dbraw/zinc/18/28/08/608182808.db2.gz BXJOOLQYGNRSMD-MNOVXSKESA-N -1 3 358.348 3.553 20 0 FHADHM C[C@@H](C(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1c(F)cccc1F ZINC000824705494 608182809 /nfs/dbraw/zinc/18/28/09/608182809.db2.gz BXJOOLQYGNRSMD-MNOVXSKESA-N -1 3 358.348 3.553 20 0 FHADHM Cc1nsc(Nc2ccc(Oc3ccccc3-c3nnn[n-]3)c(F)c2)n1 ZINC000826340437 608188258 /nfs/dbraw/zinc/18/82/58/608188258.db2.gz YKVUOAXGBBXYAN-UHFFFAOYSA-N -1 3 369.385 3.702 20 0 FHADHM Cc1nsc(Nc2ccc(Oc3ccccc3-c3nn[n-]n3)c(F)c2)n1 ZINC000826340437 608188260 /nfs/dbraw/zinc/18/82/60/608188260.db2.gz YKVUOAXGBBXYAN-UHFFFAOYSA-N -1 3 369.385 3.702 20 0 FHADHM C[C@H]1CCN(C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)CC12CCC2 ZINC000824945814 608203956 /nfs/dbraw/zinc/20/39/56/608203956.db2.gz GGLMMGSCLUSDCW-NSHDSACASA-N -1 3 360.849 3.564 20 0 FHADHM C[C@H]1CCN(C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)CC12CCC2 ZINC000824945814 608203958 /nfs/dbraw/zinc/20/39/58/608203958.db2.gz GGLMMGSCLUSDCW-NSHDSACASA-N -1 3 360.849 3.564 20 0 FHADHM C[C@H]1CCN(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)CC12CCC2 ZINC000824946853 608209214 /nfs/dbraw/zinc/20/92/14/608209214.db2.gz LERCVFAYNYYPJW-NSHDSACASA-N -1 3 360.849 3.564 20 0 FHADHM C[C@H]1CCN(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)CC12CCC2 ZINC000824946853 608209216 /nfs/dbraw/zinc/20/92/16/608209216.db2.gz LERCVFAYNYYPJW-NSHDSACASA-N -1 3 360.849 3.564 20 0 FHADHM C[C@H](Nc1ccc2cc(-c3nnn[n-]3)ccc2n1)c1ccc(F)cc1F ZINC000824658654 608231638 /nfs/dbraw/zinc/23/16/38/608231638.db2.gz ZSGIPVQUJATUQS-JTQLQIEISA-N -1 3 352.348 3.866 20 0 FHADHM C[C@H](Nc1ccc2cc(-c3nn[n-]n3)ccc2n1)c1ccc(F)cc1F ZINC000824658654 608231640 /nfs/dbraw/zinc/23/16/40/608231640.db2.gz ZSGIPVQUJATUQS-JTQLQIEISA-N -1 3 352.348 3.866 20 0 FHADHM CC(C)[C@@H]1C[C@@H](Nc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)CCO1 ZINC000824215009 608242413 /nfs/dbraw/zinc/24/24/13/608242413.db2.gz JITUFMHQFKXHJX-FZMZJTMJSA-N -1 3 355.364 3.501 20 0 FHADHM CC(C)[C@@H]1C[C@@H](Nc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)CCO1 ZINC000824215009 608242414 /nfs/dbraw/zinc/24/24/14/608242414.db2.gz JITUFMHQFKXHJX-FZMZJTMJSA-N -1 3 355.364 3.501 20 0 FHADHM C[C@H]1CCC[C@@H](OCCCCCC(=O)Nc2cccc(-c3nnn[n-]3)c2)C1 ZINC000160668912 608261711 /nfs/dbraw/zinc/26/17/11/608261711.db2.gz YFOIJXMWRCUGKV-MAUKXSAKSA-N -1 3 371.485 3.961 20 0 FHADHM C[C@H]1CCC[C@@H](OCCCCCC(=O)Nc2cccc(-c3nn[n-]n3)c2)C1 ZINC000160668912 608261713 /nfs/dbraw/zinc/26/17/13/608261713.db2.gz YFOIJXMWRCUGKV-MAUKXSAKSA-N -1 3 371.485 3.961 20 0 FHADHM CC(=O)CCCCCCC(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(C)C ZINC000823967879 608273686 /nfs/dbraw/zinc/27/36/86/608273686.db2.gz RPTSUTDHDXUXTI-UHFFFAOYSA-N -1 3 373.457 3.522 20 0 FHADHM CC(=O)CCCCCCC(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(C)C ZINC000823967879 608273688 /nfs/dbraw/zinc/27/36/88/608273688.db2.gz RPTSUTDHDXUXTI-UHFFFAOYSA-N -1 3 373.457 3.522 20 0 FHADHM c1cc([C@H]2CCCN2c2nc3c(cc2-c2nnn[n-]2)CCCC3)cs1 ZINC000826514792 608275265 /nfs/dbraw/zinc/27/52/65/608275265.db2.gz CYJUPDSFAMTTKF-MRXNPFEDSA-N -1 3 352.467 3.544 20 0 FHADHM c1cc([C@H]2CCCN2c2nc3c(cc2-c2nn[n-]n2)CCCC3)cs1 ZINC000826514792 608275266 /nfs/dbraw/zinc/27/52/66/608275266.db2.gz CYJUPDSFAMTTKF-MRXNPFEDSA-N -1 3 352.467 3.544 20 0 FHADHM Cc1c(NC(=O)N[C@@H]2CCCc3cc(F)ccc32)cccc1-c1nnn[n-]1 ZINC000826241654 608308271 /nfs/dbraw/zinc/30/82/71/608308271.db2.gz KPZNWPAKIIJDDP-QGZVFWFLSA-N -1 3 366.400 3.513 20 0 FHADHM Cc1c(NC(=O)N[C@@H]2CCCc3cc(F)ccc32)cccc1-c1nn[n-]n1 ZINC000826241654 608308272 /nfs/dbraw/zinc/30/82/72/608308272.db2.gz KPZNWPAKIIJDDP-QGZVFWFLSA-N -1 3 366.400 3.513 20 0 FHADHM COc1ccc([C@H](OC(=O)c2cc(-c3nnn[n-]3)cs2)C2CC2)c(C)c1 ZINC000826188857 608316864 /nfs/dbraw/zinc/31/68/64/608316864.db2.gz IWZIHZBPIPQYBJ-MRXNPFEDSA-N -1 3 370.434 3.553 20 0 FHADHM COc1ccc([C@H](OC(=O)c2cc(-c3nn[n-]n3)cs2)C2CC2)c(C)c1 ZINC000826188857 608316866 /nfs/dbraw/zinc/31/68/66/608316866.db2.gz IWZIHZBPIPQYBJ-MRXNPFEDSA-N -1 3 370.434 3.553 20 0 FHADHM CCCCc1noc([C@@H](C)SCc2ccc(-c3nnn[n-]3)cc2OC)n1 ZINC000825296536 608322195 /nfs/dbraw/zinc/32/21/95/608322195.db2.gz NKQKSLHHDWDWAP-LLVKDONJSA-N -1 3 374.470 3.595 20 0 FHADHM CCCCc1noc([C@@H](C)SCc2ccc(-c3nn[n-]n3)cc2OC)n1 ZINC000825296536 608322198 /nfs/dbraw/zinc/32/21/98/608322198.db2.gz NKQKSLHHDWDWAP-LLVKDONJSA-N -1 3 374.470 3.595 20 0 FHADHM O=C(C=C1CCCC1)NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000826400460 608329923 /nfs/dbraw/zinc/32/99/23/608329923.db2.gz ZMRLTBLURQOKEO-UHFFFAOYSA-N -1 3 359.433 3.650 20 0 FHADHM O=C(C=C1CCCC1)NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000826400460 608329925 /nfs/dbraw/zinc/32/99/25/608329925.db2.gz ZMRLTBLURQOKEO-UHFFFAOYSA-N -1 3 359.433 3.650 20 0 FHADHM CCN(C(=O)c1ccccc1SC)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825385982 608342432 /nfs/dbraw/zinc/34/24/32/608342432.db2.gz XKKULGCBUYNYKT-UHFFFAOYSA-N -1 3 373.869 3.909 20 0 FHADHM CCN(C(=O)c1ccccc1SC)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825385982 608342433 /nfs/dbraw/zinc/34/24/33/608342433.db2.gz XKKULGCBUYNYKT-UHFFFAOYSA-N -1 3 373.869 3.909 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CN(C)[C@H](C)c1ccccc1Cl ZINC000826167486 608354542 /nfs/dbraw/zinc/35/45/42/608354542.db2.gz GJOLQHZZDJTCIN-GFCCVEGCSA-N -1 3 357.845 3.722 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CN(C)[C@H](C)c1ccccc1Cl ZINC000826167486 608354544 /nfs/dbraw/zinc/35/45/44/608354544.db2.gz GJOLQHZZDJTCIN-GFCCVEGCSA-N -1 3 357.845 3.722 20 0 FHADHM CSc1cccc(NC(=S)Nc2ccccc2-c2nnn[n-]2)c1C ZINC000826230640 608389389 /nfs/dbraw/zinc/38/93/89/608389389.db2.gz CLEMDCVRKIEZAN-UHFFFAOYSA-N -1 3 356.480 3.706 20 0 FHADHM CSc1cccc(NC(=S)Nc2ccccc2-c2nn[n-]n2)c1C ZINC000826230640 608389390 /nfs/dbraw/zinc/38/93/90/608389390.db2.gz CLEMDCVRKIEZAN-UHFFFAOYSA-N -1 3 356.480 3.706 20 0 FHADHM Fc1ccc([C@@H]2CCCN2Cc2cccc(-c3nnn[n-]3)c2F)cc1F ZINC000826373850 608394432 /nfs/dbraw/zinc/39/44/32/608394432.db2.gz BUZYRXPMTWXLFN-INIZCTEOSA-N -1 3 359.355 3.621 20 0 FHADHM Fc1ccc([C@@H]2CCCN2Cc2cccc(-c3nn[n-]n3)c2F)cc1F ZINC000826373850 608394434 /nfs/dbraw/zinc/39/44/34/608394434.db2.gz BUZYRXPMTWXLFN-INIZCTEOSA-N -1 3 359.355 3.621 20 0 FHADHM Fc1c(CSCc2ccn(C3CCCC3)n2)cccc1-c1nnn[n-]1 ZINC000826371027 608404742 /nfs/dbraw/zinc/40/47/42/608404742.db2.gz PSTMIUXGEHGGDX-UHFFFAOYSA-N -1 3 358.446 3.751 20 0 FHADHM Fc1c(CSCc2ccn(C3CCCC3)n2)cccc1-c1nn[n-]n1 ZINC000826371027 608404743 /nfs/dbraw/zinc/40/47/43/608404743.db2.gz PSTMIUXGEHGGDX-UHFFFAOYSA-N -1 3 358.446 3.751 20 0 FHADHM CCCCCn1cc(CNc2ccc(Cl)cc2-c2nnn[n-]2)c(C)n1 ZINC000825281647 608444521 /nfs/dbraw/zinc/44/45/21/608444521.db2.gz INJHQLJUBLCXTH-UHFFFAOYSA-N -1 3 359.865 3.827 20 0 FHADHM CCCCCn1cc(CNc2ccc(Cl)cc2-c2nn[n-]n2)c(C)n1 ZINC000825281647 608444524 /nfs/dbraw/zinc/44/45/24/608444524.db2.gz INJHQLJUBLCXTH-UHFFFAOYSA-N -1 3 359.865 3.827 20 0 FHADHM Cc1cc(C)cc(NC(=O)N2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)c1 ZINC000826264686 608469390 /nfs/dbraw/zinc/46/93/90/608469390.db2.gz WTIQDIURWZRZPS-UHFFFAOYSA-N -1 3 374.448 3.805 20 0 FHADHM Cc1cc(C)cc(NC(=O)N2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)c1 ZINC000826264686 608469391 /nfs/dbraw/zinc/46/93/91/608469391.db2.gz WTIQDIURWZRZPS-UHFFFAOYSA-N -1 3 374.448 3.805 20 0 FHADHM CCC[C@H](C(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1)C(C)C ZINC000825224827 608477861 /nfs/dbraw/zinc/47/78/61/608477861.db2.gz CRZRWWVFLKBEFB-SFHVURJKSA-N -1 3 353.470 3.555 20 0 FHADHM CCC[C@H](C(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1)C(C)C ZINC000825224827 608477863 /nfs/dbraw/zinc/47/78/63/608477863.db2.gz CRZRWWVFLKBEFB-SFHVURJKSA-N -1 3 353.470 3.555 20 0 FHADHM O=C(CCC1CCCCC1)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000826405402 608480547 /nfs/dbraw/zinc/48/05/47/608480547.db2.gz DPKBUAZSLKQGMM-UHFFFAOYSA-N -1 3 365.481 3.843 20 0 FHADHM O=C(CCC1CCCCC1)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000826405402 608480548 /nfs/dbraw/zinc/48/05/48/608480548.db2.gz DPKBUAZSLKQGMM-UHFFFAOYSA-N -1 3 365.481 3.843 20 0 FHADHM CC(C)(C)c1nc(CN[C@@H]2CCCc3cc(-c4nn[n-]n4)ccc32)cs1 ZINC000824142062 608506626 /nfs/dbraw/zinc/50/66/26/608506626.db2.gz RRZBXZZMABZSAM-MRXNPFEDSA-N -1 3 368.510 3.788 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)nc1N[C@@H](C)c1ccccc1Br ZINC000826280407 608542125 /nfs/dbraw/zinc/54/21/25/608542125.db2.gz APYWWMSJAVZYGR-JTQLQIEISA-N -1 3 359.231 3.506 20 0 FHADHM Brc1cccc([C@@H]2CCCN2Cc2ccc(-c3nnn[n-]3)o2)c1 ZINC000823831706 608543219 /nfs/dbraw/zinc/54/32/19/608543219.db2.gz AEVDGSPBBLNEFA-AWEZNQCLSA-N -1 3 374.242 3.559 20 0 FHADHM Brc1cccc([C@@H]2CCCN2Cc2ccc(-c3nn[n-]n3)o2)c1 ZINC000823831706 608543220 /nfs/dbraw/zinc/54/32/20/608543220.db2.gz AEVDGSPBBLNEFA-AWEZNQCLSA-N -1 3 374.242 3.559 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)c(N2CC=C(c3ccccc3Cl)CC2)n1 ZINC000826274282 608556634 /nfs/dbraw/zinc/55/66/34/608556634.db2.gz MBNNQWHWSBGSFH-UHFFFAOYSA-N -1 3 352.829 3.517 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)c(N2CC=C(c3ccccc3Cl)CC2)n1 ZINC000826274282 608556636 /nfs/dbraw/zinc/55/66/36/608556636.db2.gz MBNNQWHWSBGSFH-UHFFFAOYSA-N -1 3 352.829 3.517 20 0 FHADHM C[C@@H](NC(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1)c1cccc(Cl)c1 ZINC000824522108 608573135 /nfs/dbraw/zinc/57/31/35/608573135.db2.gz QFQRQVGLJVJEJJ-SECBINFHSA-N -1 3 362.220 3.665 20 0 FHADHM C[C@@H](NC(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1)c1cccc(Cl)c1 ZINC000824522108 608573136 /nfs/dbraw/zinc/57/31/36/608573136.db2.gz QFQRQVGLJVJEJJ-SECBINFHSA-N -1 3 362.220 3.665 20 0 FHADHM Cc1cc([C@H](C)NC(=O)c2ccc(Cl)c(-c3nnn[n-]3)c2)c(C)s1 ZINC000826261932 608575596 /nfs/dbraw/zinc/57/55/96/608575596.db2.gz YMXHRFKUOLPWRR-VIFPVBQESA-N -1 3 361.858 3.689 20 0 FHADHM Cc1cc([C@H](C)NC(=O)c2ccc(Cl)c(-c3nn[n-]n3)c2)c(C)s1 ZINC000826261932 608575598 /nfs/dbraw/zinc/57/55/98/608575598.db2.gz YMXHRFKUOLPWRR-VIFPVBQESA-N -1 3 361.858 3.689 20 0 FHADHM C[C@H]1CCN(C(=O)c2ccc(Cl)c(-c3nnn[n-]3)c2)[C@H](c2ccco2)C1 ZINC000824947778 608577068 /nfs/dbraw/zinc/57/70/68/608577068.db2.gz QVJYOKHBCWHKOH-NHYWBVRUSA-N -1 3 371.828 3.727 20 0 FHADHM C[C@H]1CCN(C(=O)c2ccc(Cl)c(-c3nn[n-]n3)c2)[C@H](c2ccco2)C1 ZINC000824947778 608577069 /nfs/dbraw/zinc/57/70/69/608577069.db2.gz QVJYOKHBCWHKOH-NHYWBVRUSA-N -1 3 371.828 3.727 20 0 FHADHM CC1(C)CC[C@@H](NC(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)C1 ZINC000824803013 608600468 /nfs/dbraw/zinc/60/04/68/608600468.db2.gz REWBXEJHIROPEB-CQSZACIVSA-N -1 3 361.449 3.842 20 0 FHADHM CC1(C)CC[C@@H](NC(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)C1 ZINC000824803013 608600470 /nfs/dbraw/zinc/60/04/70/608600470.db2.gz REWBXEJHIROPEB-CQSZACIVSA-N -1 3 361.449 3.842 20 0 FHADHM CN(Cc1ccc(C(F)(F)F)cc1)Cc1cccc(-c2nnn[n-]2)c1F ZINC000825965957 608645261 /nfs/dbraw/zinc/64/52/61/608645261.db2.gz ISFLYPZVGONKOY-UHFFFAOYSA-N -1 3 365.334 3.657 20 0 FHADHM Cc1nc(SCc2cccc(-c3nnn[n-]3)c2F)n(CC(C)C)c1C ZINC000826327674 608669633 /nfs/dbraw/zinc/66/96/33/608669633.db2.gz PTFNZVGXPPKORQ-UHFFFAOYSA-N -1 3 360.462 3.767 20 0 FHADHM Cc1nc(SCc2cccc(-c3nn[n-]n3)c2F)n(CC(C)C)c1C ZINC000826327674 608669634 /nfs/dbraw/zinc/66/96/34/608669634.db2.gz PTFNZVGXPPKORQ-UHFFFAOYSA-N -1 3 360.462 3.767 20 0 FHADHM C[C@H](Nc1cnccc1-c1nnn[n-]1)c1c(Cl)ccc(F)c1Cl ZINC000824662210 608776593 /nfs/dbraw/zinc/77/65/93/608776593.db2.gz FTWLBDAOJCUPHL-ZETCQYMHSA-N -1 3 353.188 3.881 20 0 FHADHM C[C@H](Nc1cnccc1-c1nn[n-]n1)c1c(Cl)ccc(F)c1Cl ZINC000824662210 608776596 /nfs/dbraw/zinc/77/65/96/608776596.db2.gz FTWLBDAOJCUPHL-ZETCQYMHSA-N -1 3 353.188 3.881 20 0 FHADHM COc1ccccc1Oc1ccc(CNc2cnccc2-c2nnn[n-]2)cc1 ZINC000826220994 608784671 /nfs/dbraw/zinc/78/46/71/608784671.db2.gz KCFJDZCSYLBHMA-UHFFFAOYSA-N -1 3 374.404 3.675 20 0 FHADHM COc1ccccc1Oc1ccc(CNc2cnccc2-c2nn[n-]n2)cc1 ZINC000826220994 608784672 /nfs/dbraw/zinc/78/46/72/608784672.db2.gz KCFJDZCSYLBHMA-UHFFFAOYSA-N -1 3 374.404 3.675 20 0 FHADHM FC(F)Oc1ccc(CNc2ccc(-c3nn[n-]n3)cc2)cc1Cl ZINC000826369922 608866390 /nfs/dbraw/zinc/86/63/90/608866390.db2.gz VQMRHBIGDVQOSR-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM Cn1cc(CNc2cccc(-c3nnn[n-]3)c2)c(-c2cc3ccccc3o2)n1 ZINC000826361836 608868750 /nfs/dbraw/zinc/86/87/50/608868750.db2.gz REWCZGYBRXSVAL-UHFFFAOYSA-N -1 3 371.404 3.626 20 0 FHADHM Cn1cc(CNc2cccc(-c3nn[n-]n3)c2)c(-c2cc3ccccc3o2)n1 ZINC000826361836 608868752 /nfs/dbraw/zinc/86/87/52/608868752.db2.gz REWCZGYBRXSVAL-UHFFFAOYSA-N -1 3 371.404 3.626 20 0 FHADHM C[C@H](N[C@H](c1ccccc1)c1ccncc1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824540200 609136494 /nfs/dbraw/zinc/13/64/94/609136494.db2.gz SYGOEOKSEOWLEN-VBKZILBWSA-N -1 3 374.423 3.841 20 0 FHADHM C[C@H](N[C@H](c1ccccc1)c1ccncc1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824540200 609136495 /nfs/dbraw/zinc/13/64/95/609136495.db2.gz SYGOEOKSEOWLEN-VBKZILBWSA-N -1 3 374.423 3.841 20 0 FHADHM C[C@@H](N[C@@H]1CCOc2c(Cl)cccc21)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824553540 609137942 /nfs/dbraw/zinc/13/79/42/609137942.db2.gz CKNPJNHICLAOPS-QLJPJBMISA-N -1 3 373.819 3.834 20 0 FHADHM CC(C)COC[C@@H](N[C@@H](C)c1ccc(-c2nnn[n-]2)c(F)c1)c1ccco1 ZINC000824266073 609138984 /nfs/dbraw/zinc/13/89/84/609138984.db2.gz FAHVCVOMNNIHCI-SUMWQHHRSA-N -1 3 373.432 3.663 20 0 FHADHM CC(C)COC[C@@H](N[C@@H](C)c1ccc(-c2nn[n-]n2)c(F)c1)c1ccco1 ZINC000824266073 609138985 /nfs/dbraw/zinc/13/89/85/609138985.db2.gz FAHVCVOMNNIHCI-SUMWQHHRSA-N -1 3 373.432 3.663 20 0 FHADHM C[C@H](N[C@@H](c1ccccc1)c1cccnc1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824537423 609140839 /nfs/dbraw/zinc/14/08/39/609140839.db2.gz DXKYXNQJWFUKPR-XOBRGWDASA-N -1 3 374.423 3.841 20 0 FHADHM C[C@H](N[C@@H](c1ccccc1)c1cccnc1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824537423 609140840 /nfs/dbraw/zinc/14/08/40/609140840.db2.gz DXKYXNQJWFUKPR-XOBRGWDASA-N -1 3 374.423 3.841 20 0 FHADHM COc1cccc(F)c1[C@@H](C)N[C@H](C)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000826216483 609146607 /nfs/dbraw/zinc/14/66/07/609146607.db2.gz ASJNQAHIQNTGIF-GHMZBOCLSA-N -1 3 359.380 3.565 20 0 FHADHM COc1cccc(F)c1[C@@H](C)N[C@H](C)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000826216483 609146609 /nfs/dbraw/zinc/14/66/09/609146609.db2.gz ASJNQAHIQNTGIF-GHMZBOCLSA-N -1 3 359.380 3.565 20 0 FHADHM COc1cc(OC)c(N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1Cl ZINC000826181079 609158245 /nfs/dbraw/zinc/15/82/45/609158245.db2.gz KEIBOTNVVALMKI-SNVBAGLBSA-N -1 3 359.817 3.710 20 0 FHADHM COc1cc(OC)c(N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1Cl ZINC000826181079 609158246 /nfs/dbraw/zinc/15/82/46/609158246.db2.gz KEIBOTNVVALMKI-SNVBAGLBSA-N -1 3 359.817 3.710 20 0 FHADHM CC(C)C(=O)Nc1ccc(N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824184844 609161841 /nfs/dbraw/zinc/16/18/41/609161841.db2.gz MEDLMLCBLCHVAX-ZDUSSCGKSA-N -1 3 350.426 3.634 20 0 FHADHM CC(C)C(=O)Nc1ccc(N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824184844 609161843 /nfs/dbraw/zinc/16/18/43/609161843.db2.gz MEDLMLCBLCHVAX-ZDUSSCGKSA-N -1 3 350.426 3.634 20 0 FHADHM CC(C)C(=O)Nc1cccc(N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000824185336 609163996 /nfs/dbraw/zinc/16/39/96/609163996.db2.gz WIGASIIUVHMCOW-ZDUSSCGKSA-N -1 3 350.426 3.634 20 0 FHADHM CC(C)C(=O)Nc1cccc(N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000824185336 609163997 /nfs/dbraw/zinc/16/39/97/609163997.db2.gz WIGASIIUVHMCOW-ZDUSSCGKSA-N -1 3 350.426 3.634 20 0 FHADHM CCCCc1nc(CNc2cc(-c3nn[n-]n3)ccc2NCC)cs1 ZINC000825296307 609177249 /nfs/dbraw/zinc/17/72/49/609177249.db2.gz CTBHUZULUDDILR-UHFFFAOYSA-N -1 3 357.487 3.710 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NCc1ccc(Br)cc1 ZINC000825480841 609179242 /nfs/dbraw/zinc/17/92/42/609179242.db2.gz NCXFSOGVZADICH-UHFFFAOYSA-N -1 3 373.258 3.673 20 0 FHADHM COc1c(F)cc(N[C@@H]2CCCc3cc(-c4nnn[n-]4)ccc32)cc1F ZINC000826167347 609180458 /nfs/dbraw/zinc/18/04/58/609180458.db2.gz ZMZHATXCRJBYJM-MRXNPFEDSA-N -1 3 357.364 3.643 20 0 FHADHM COc1c(F)cc(N[C@@H]2CCCc3cc(-c4nn[n-]n4)ccc32)cc1F ZINC000826167347 609180459 /nfs/dbraw/zinc/18/04/59/609180459.db2.gz ZMZHATXCRJBYJM-MRXNPFEDSA-N -1 3 357.364 3.643 20 0 FHADHM Cc1csc(C2(N[C@H](C)c3ccc(-c4nnn[n-]4)c(F)c3)CCC2)n1 ZINC000826320605 609187018 /nfs/dbraw/zinc/18/70/18/609187018.db2.gz XEBVSWRSTFULOD-LLVKDONJSA-N -1 3 358.446 3.501 20 0 FHADHM Cc1csc(C2(N[C@H](C)c3ccc(-c4nn[n-]n4)c(F)c3)CCC2)n1 ZINC000826320605 609187019 /nfs/dbraw/zinc/18/70/19/609187019.db2.gz XEBVSWRSTFULOD-LLVKDONJSA-N -1 3 358.446 3.501 20 0 FHADHM Cc1nn(-c2ccccc2)cc1CNc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000826333006 609199799 /nfs/dbraw/zinc/19/97/99/609199799.db2.gz QFVGFCXGMWSWFD-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM Cc1nn(-c2ccccc2)cc1CNc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000826333006 609199801 /nfs/dbraw/zinc/19/98/01/609199801.db2.gz QFVGFCXGMWSWFD-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM O=C(N[C@H](c1cccc(Cl)c1)C1CCCC1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC000826427538 609226577 /nfs/dbraw/zinc/22/65/77/609226577.db2.gz TUZVUWYDCHTMTK-INIZCTEOSA-N -1 3 370.844 3.510 20 0 FHADHM O=C(N[C@H](c1cccc(Cl)c1)C1CCCC1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC000826427538 609226579 /nfs/dbraw/zinc/22/65/79/609226579.db2.gz TUZVUWYDCHTMTK-INIZCTEOSA-N -1 3 370.844 3.510 20 0 FHADHM C[C@@H](NC1(c2cccc(-c3nn[n-]n3)c2)CC1)c1nc2c(s1)CCCC2 ZINC000824539844 609248784 /nfs/dbraw/zinc/24/87/84/609248784.db2.gz QCETVTGJKBMWDR-GFCCVEGCSA-N -1 3 366.494 3.542 20 0 FHADHM Brc1cncc(N[C@@H]2CCCc3cc(-c4nnn[n-]4)ccc32)c1 ZINC000823832425 609252563 /nfs/dbraw/zinc/25/25/63/609252563.db2.gz NUUJTGWARVKFHV-OAHLLOKOSA-N -1 3 371.242 3.514 20 0 FHADHM Brc1cncc(N[C@@H]2CCCc3cc(-c4nn[n-]n4)ccc32)c1 ZINC000823832425 609252565 /nfs/dbraw/zinc/25/25/65/609252565.db2.gz NUUJTGWARVKFHV-OAHLLOKOSA-N -1 3 371.242 3.514 20 0 FHADHM C[C@H](Nc1ccn(-c2ccccc2Cl)n1)c1cccc(-c2nnn[n-]2)c1 ZINC000824662146 609254419 /nfs/dbraw/zinc/25/44/19/609254419.db2.gz DNIBPWYWRSZBRK-LBPRGKRZSA-N -1 3 365.828 3.879 20 0 FHADHM C[C@H](Nc1ccn(-c2ccccc2Cl)n1)c1cccc(-c2nn[n-]n2)c1 ZINC000824662146 609254421 /nfs/dbraw/zinc/25/44/21/609254421.db2.gz DNIBPWYWRSZBRK-LBPRGKRZSA-N -1 3 365.828 3.879 20 0 FHADHM Cc1c(N[C@@H]2CCCc3cc(-c4nnn[n-]4)ccc32)cnn1CC(C)C ZINC000826242201 609254902 /nfs/dbraw/zinc/25/49/02/609254902.db2.gz FAHFKVLZZFSYIY-QGZVFWFLSA-N -1 3 351.458 3.517 20 0 FHADHM Cc1c(N[C@@H]2CCCc3cc(-c4nn[n-]n4)ccc32)cnn1CC(C)C ZINC000826242201 609254904 /nfs/dbraw/zinc/25/49/04/609254904.db2.gz FAHFKVLZZFSYIY-QGZVFWFLSA-N -1 3 351.458 3.517 20 0 FHADHM Clc1cc2c(cc1N[C@H]1CCCc3cc(-c4nnn[n-]4)ccc31)OCO2 ZINC000826351251 609255131 /nfs/dbraw/zinc/25/51/31/609255131.db2.gz FMHQQURIPHSVTH-AWEZNQCLSA-N -1 3 369.812 3.738 20 0 FHADHM Clc1cc2c(cc1N[C@H]1CCCc3cc(-c4nn[n-]n4)ccc31)OCO2 ZINC000826351251 609255132 /nfs/dbraw/zinc/25/51/32/609255132.db2.gz FMHQQURIPHSVTH-AWEZNQCLSA-N -1 3 369.812 3.738 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000825553005 609267041 /nfs/dbraw/zinc/26/70/41/609267041.db2.gz HPMVKOPANQAQBN-GFCCVEGCSA-N -1 3 352.398 3.608 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000825553005 609267043 /nfs/dbraw/zinc/26/70/43/609267043.db2.gz HPMVKOPANQAQBN-GFCCVEGCSA-N -1 3 352.398 3.608 20 0 FHADHM CCOc1ccc(N[C@@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)cc1OC ZINC000825643816 609270951 /nfs/dbraw/zinc/27/09/51/609270951.db2.gz WHZKNALTBPTLMF-NSHDSACASA-N -1 3 357.389 3.586 20 0 FHADHM CCOc1ccc(N[C@@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)cc1OC ZINC000825643816 609270952 /nfs/dbraw/zinc/27/09/52/609270952.db2.gz WHZKNALTBPTLMF-NSHDSACASA-N -1 3 357.389 3.586 20 0 FHADHM CCOc1cc2c(cc1N[C@H](C)c1cccc(-c3nnn[n-]3)c1)O[C@H](C)C2 ZINC000825621680 609273785 /nfs/dbraw/zinc/27/37/85/609273785.db2.gz XESWPKYJLVHQFC-CHWSQXEVSA-N -1 3 365.437 3.762 20 0 FHADHM CCOc1cc2c(cc1N[C@H](C)c1cccc(-c3nn[n-]n3)c1)O[C@H](C)C2 ZINC000825621680 609273787 /nfs/dbraw/zinc/27/37/87/609273787.db2.gz XESWPKYJLVHQFC-CHWSQXEVSA-N -1 3 365.437 3.762 20 0 FHADHM C[C@H](Nc1ccc(N(C)C)c(Cl)c1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824656482 609276161 /nfs/dbraw/zinc/27/61/61/609276161.db2.gz KLNWBXYXEYFWMB-JTQLQIEISA-N -1 3 360.824 3.898 20 0 FHADHM C[C@H](Nc1ccc(N(C)C)c(Cl)c1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824656482 609276162 /nfs/dbraw/zinc/27/61/62/609276162.db2.gz KLNWBXYXEYFWMB-JTQLQIEISA-N -1 3 360.824 3.898 20 0 FHADHM CN(C(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1)C1CCCC1 ZINC000825833568 609314603 /nfs/dbraw/zinc/31/46/03/609314603.db2.gz IJOQKDHAAPRXPQ-UHFFFAOYSA-N -1 3 363.421 3.674 20 0 FHADHM CN(C(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1)C1CCCC1 ZINC000825833568 609314604 /nfs/dbraw/zinc/31/46/04/609314604.db2.gz IJOQKDHAAPRXPQ-UHFFFAOYSA-N -1 3 363.421 3.674 20 0 FHADHM Fc1cc(-c2nnn[n-]2)cc(F)c1NCc1ccccc1N1CCCCC1 ZINC000826371802 609321017 /nfs/dbraw/zinc/32/10/17/609321017.db2.gz UWZCIJQVDSBSRK-UHFFFAOYSA-N -1 3 370.407 3.747 20 0 FHADHM Fc1cc(-c2nn[n-]n2)cc(F)c1NCc1ccccc1N1CCCCC1 ZINC000826371802 609321019 /nfs/dbraw/zinc/32/10/19/609321019.db2.gz UWZCIJQVDSBSRK-UHFFFAOYSA-N -1 3 370.407 3.747 20 0 FHADHM CC[C@@H]1CCN(C(=O)c2ccccc2Oc2ccccc2-c2nnn[n-]2)C1 ZINC000825203704 609326882 /nfs/dbraw/zinc/32/68/82/609326882.db2.gz OKZFAQAFKNAEFL-CQSZACIVSA-N -1 3 363.421 3.531 20 0 FHADHM CC[C@@H]1CCN(C(=O)c2ccccc2Oc2ccccc2-c2nn[n-]n2)C1 ZINC000825203704 609326884 /nfs/dbraw/zinc/32/68/84/609326884.db2.gz OKZFAQAFKNAEFL-CQSZACIVSA-N -1 3 363.421 3.531 20 0 FHADHM Brc1cc(-c2nnn[n-]2)ccc1CSCc1nccs1 ZINC000823820232 609328578 /nfs/dbraw/zinc/32/85/78/609328578.db2.gz CDRQFLAXXVXMEL-UHFFFAOYSA-N -1 3 368.285 3.519 20 0 FHADHM Brc1cc(-c2nn[n-]n2)ccc1CSCc1nccs1 ZINC000823820232 609328580 /nfs/dbraw/zinc/32/85/80/609328580.db2.gz CDRQFLAXXVXMEL-UHFFFAOYSA-N -1 3 368.285 3.519 20 0 FHADHM C[C@H](SCCOc1ccc(-c2nn[n-]n2)cc1)c1nc2ccccc2o1 ZINC000824757466 609328999 /nfs/dbraw/zinc/32/89/99/609328999.db2.gz XOHNFWBWFHNMEY-LBPRGKRZSA-N -1 3 367.434 3.881 20 0 FHADHM C[C@@H](N[C@@H](c1ccccc1)c1ccncc1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824540171 609330198 /nfs/dbraw/zinc/33/01/98/609330198.db2.gz SJDOXSVDEZDBQQ-VLIAUNLRSA-N -1 3 374.423 3.841 20 0 FHADHM C[C@@H](N[C@@H](c1ccccc1)c1ccncc1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824540171 609330200 /nfs/dbraw/zinc/33/02/00/609330200.db2.gz SJDOXSVDEZDBQQ-VLIAUNLRSA-N -1 3 374.423 3.841 20 0 FHADHM CC(C)COC[C@H](N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1F)c1ccco1 ZINC000824266790 609331537 /nfs/dbraw/zinc/33/15/37/609331537.db2.gz QIJNBZPKWLNGLX-GUYCJALGSA-N -1 3 373.432 3.663 20 0 FHADHM CC(C)COC[C@H](N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1F)c1ccco1 ZINC000824266790 609331539 /nfs/dbraw/zinc/33/15/39/609331539.db2.gz QIJNBZPKWLNGLX-GUYCJALGSA-N -1 3 373.432 3.663 20 0 FHADHM C[C@@H](NCc1ccccc1OCC1CC1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824624541 609336207 /nfs/dbraw/zinc/33/62/07/609336207.db2.gz ABKMUJMDJIEPFH-CYBMUJFWSA-N -1 3 367.428 3.645 20 0 FHADHM C[C@H](NCc1ccccc1OCC1CC1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824624545 609336504 /nfs/dbraw/zinc/33/65/04/609336504.db2.gz ABKMUJMDJIEPFH-ZDUSSCGKSA-N -1 3 367.428 3.645 20 0 FHADHM C[C@@H](NCc1ccccc1OC1CCC1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824626406 609342647 /nfs/dbraw/zinc/34/26/47/609342647.db2.gz OAFNLPIADNKXMF-CYBMUJFWSA-N -1 3 367.428 3.788 20 0 FHADHM COCCOc1cc(C)ccc1N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1F ZINC000826161108 609346276 /nfs/dbraw/zinc/34/62/76/609346276.db2.gz UKALITMDOURAFQ-ZDUSSCGKSA-N -1 3 371.416 3.513 20 0 FHADHM COCCOc1cc(C)ccc1N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000826161108 609346279 /nfs/dbraw/zinc/34/62/79/609346279.db2.gz UKALITMDOURAFQ-ZDUSSCGKSA-N -1 3 371.416 3.513 20 0 FHADHM C[C@@H](Nc1ccc2c(cnn2C(F)F)c1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824656159 609349094 /nfs/dbraw/zinc/34/90/94/609349094.db2.gz IGVHFMVICZHWFF-SECBINFHSA-N -1 3 373.342 3.924 20 0 FHADHM C[C@@H](Nc1ccc2c(cnn2C(F)F)c1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824656159 609349095 /nfs/dbraw/zinc/34/90/95/609349095.db2.gz IGVHFMVICZHWFF-SECBINFHSA-N -1 3 373.342 3.924 20 0 FHADHM C[C@H](Nc1ccc(Br)cc1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824657552 609349206 /nfs/dbraw/zinc/34/92/06/609349206.db2.gz QWXNONWJUZHZCT-VIFPVBQESA-N -1 3 362.206 3.941 20 0 FHADHM C[C@H](Nc1ccc(Br)cc1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824657552 609349207 /nfs/dbraw/zinc/34/92/07/609349207.db2.gz QWXNONWJUZHZCT-VIFPVBQESA-N -1 3 362.206 3.941 20 0 FHADHM C[C@@H](c1ccccc1)N(C)Cc1ccc(-c2nn[n-]n2)cc1Br ZINC000824770169 609355491 /nfs/dbraw/zinc/35/54/91/609355491.db2.gz FWBDCYVFANZMBJ-LBPRGKRZSA-N -1 3 372.270 3.822 20 0 FHADHM Brc1cc(-c2nn[n-]n2)ccc1CN1CC[C@H]1c1ccccc1 ZINC000823821717 609363081 /nfs/dbraw/zinc/36/30/81/609363081.db2.gz YELARGUZXOACEZ-INIZCTEOSA-N -1 3 370.254 3.576 20 0 FHADHM CCC[C@@H]1C[C@@H]1NC(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000825251574 609385264 /nfs/dbraw/zinc/38/52/64/609385264.db2.gz CNOZBZSUMSLCHJ-CJNGLKHVSA-N -1 3 363.421 3.577 20 0 FHADHM CCC[C@@H]1C[C@@H]1NC(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000825251574 609385266 /nfs/dbraw/zinc/38/52/66/609385266.db2.gz CNOZBZSUMSLCHJ-CJNGLKHVSA-N -1 3 363.421 3.577 20 0 FHADHM CC1(C)CCN(C(=O)c2ccccc2Oc2ccccc2-c2nnn[n-]2)C1 ZINC000824807660 609385885 /nfs/dbraw/zinc/38/58/85/609385885.db2.gz KWRCRJKAJFIGNV-UHFFFAOYSA-N -1 3 363.421 3.531 20 0 FHADHM CC1(C)CCN(C(=O)c2ccccc2Oc2ccccc2-c2nn[n-]n2)C1 ZINC000824807660 609385886 /nfs/dbraw/zinc/38/58/86/609385886.db2.gz KWRCRJKAJFIGNV-UHFFFAOYSA-N -1 3 363.421 3.531 20 0 FHADHM CC(=O)c1ccc(-c2nnn[n-]2)cc1NCCCO[C@@H](C)c1ccccc1 ZINC000824019808 609420706 /nfs/dbraw/zinc/42/07/06/609420706.db2.gz PDTSIOLMPVRLKE-HNNXBMFYSA-N -1 3 365.437 3.649 20 0 FHADHM CC(=O)c1ccc(-c2nn[n-]n2)cc1NCCCO[C@@H](C)c1ccccc1 ZINC000824019808 609420708 /nfs/dbraw/zinc/42/07/08/609420708.db2.gz PDTSIOLMPVRLKE-HNNXBMFYSA-N -1 3 365.437 3.649 20 0 FHADHM C[C@H](CSc1cccc(-c2nnn[n-]2)c1)C(=O)c1ccc(F)c(F)c1 ZINC000824450152 609434101 /nfs/dbraw/zinc/43/41/01/609434101.db2.gz SOOQRPLEWCVXPV-SNVBAGLBSA-N -1 3 360.389 3.756 20 0 FHADHM C[C@H](CSc1cccc(-c2nn[n-]n2)c1)C(=O)c1ccc(F)c(F)c1 ZINC000824450152 609434102 /nfs/dbraw/zinc/43/41/02/609434102.db2.gz SOOQRPLEWCVXPV-SNVBAGLBSA-N -1 3 360.389 3.756 20 0 FHADHM Cn1nc(C(F)(F)F)c(CSc2ccccc2-c2nnn[n-]2)c1Cl ZINC000826366078 609449307 /nfs/dbraw/zinc/44/93/07/609449307.db2.gz RITCKSYMGJZFQR-UHFFFAOYSA-N -1 3 374.779 3.565 20 0 FHADHM Cn1nc(C(F)(F)F)c(CSc2ccccc2-c2nn[n-]n2)c1Cl ZINC000826366078 609449309 /nfs/dbraw/zinc/44/93/09/609449309.db2.gz RITCKSYMGJZFQR-UHFFFAOYSA-N -1 3 374.779 3.565 20 0 FHADHM C[C@H](Sc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)C(=O)OC(C)(C)C ZINC000824757432 609452022 /nfs/dbraw/zinc/45/20/22/609452022.db2.gz WNUYSJPFTKXFHV-QMMMGPOBSA-N -1 3 374.388 3.708 20 0 FHADHM C[C@H](Sc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)C(=O)OC(C)(C)C ZINC000824757432 609452024 /nfs/dbraw/zinc/45/20/24/609452024.db2.gz WNUYSJPFTKXFHV-QMMMGPOBSA-N -1 3 374.388 3.708 20 0 FHADHM Cc1ccc(CSc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)nc1 ZINC000826288811 609452588 /nfs/dbraw/zinc/45/25/88/609452588.db2.gz XPCLABKMWGTXFQ-UHFFFAOYSA-N -1 3 351.357 3.881 20 0 FHADHM Cc1ccc(CSc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)nc1 ZINC000826288811 609452589 /nfs/dbraw/zinc/45/25/89/609452589.db2.gz XPCLABKMWGTXFQ-UHFFFAOYSA-N -1 3 351.357 3.881 20 0 FHADHM O=C1CCCCC[C@@H]1Sc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000826480268 609453840 /nfs/dbraw/zinc/45/38/40/609453840.db2.gz WJRCYCASWAKFRI-ZDUSSCGKSA-N -1 3 356.373 3.879 20 0 FHADHM O=C1CCCCC[C@@H]1Sc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000826480268 609453841 /nfs/dbraw/zinc/45/38/41/609453841.db2.gz WJRCYCASWAKFRI-ZDUSSCGKSA-N -1 3 356.373 3.879 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NCc1cccc(-c2cccnc2)c1 ZINC000825631643 609476759 /nfs/dbraw/zinc/47/67/59/609476759.db2.gz FJUUHRPNIMUKCR-UHFFFAOYSA-N -1 3 372.432 3.940 20 0 FHADHM CCOC(=O)Nc1ccc(NCc2ccc(C)cc2C)cc1-c1nnn[n-]1 ZINC000825552956 609490715 /nfs/dbraw/zinc/49/07/15/609490715.db2.gz GMBOSTCJNJKAEY-UHFFFAOYSA-N -1 3 366.425 3.664 20 0 FHADHM CCOC(=O)Nc1ccc(NCc2ccc(C)cc2C)cc1-c1nn[n-]n1 ZINC000825552956 609490717 /nfs/dbraw/zinc/49/07/17/609490717.db2.gz GMBOSTCJNJKAEY-UHFFFAOYSA-N -1 3 366.425 3.664 20 0 FHADHM CC(C)c1nc([C@@H]2CCCCCN2c2cccc(F)c2-c2nnn[n-]2)no1 ZINC000824358185 609494090 /nfs/dbraw/zinc/49/40/90/609494090.db2.gz BEQSQCIDEPQLGU-AWEZNQCLSA-N -1 3 371.420 3.634 20 0 FHADHM CC(C)c1nc([C@@H]2CCCCCN2c2cccc(F)c2-c2nn[n-]n2)no1 ZINC000824358185 609494092 /nfs/dbraw/zinc/49/40/92/609494092.db2.gz BEQSQCIDEPQLGU-AWEZNQCLSA-N -1 3 371.420 3.634 20 0 FHADHM Cc1cc(C)cc([C@H]2CCN(C(=O)Nc3ccc(-c4nnn[n-]4)cc3)C2)c1 ZINC000826264577 609497738 /nfs/dbraw/zinc/49/77/38/609497738.db2.gz SUEBELDFFYEXRJ-INIZCTEOSA-N -1 3 362.437 3.505 20 0 FHADHM Cc1cc(C)cc([C@H]2CCN(C(=O)Nc3ccc(-c4nn[n-]n4)cc3)C2)c1 ZINC000826264577 609497740 /nfs/dbraw/zinc/49/77/40/609497740.db2.gz SUEBELDFFYEXRJ-INIZCTEOSA-N -1 3 362.437 3.505 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)c1ccccc1 ZINC000826231844 609502614 /nfs/dbraw/zinc/50/26/14/609502614.db2.gz FPRRIUCTRKZFQU-SNVBAGLBSA-N -1 3 361.327 3.628 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)c1ccccc1 ZINC000826231844 609502616 /nfs/dbraw/zinc/50/26/16/609502616.db2.gz FPRRIUCTRKZFQU-SNVBAGLBSA-N -1 3 361.327 3.628 20 0 FHADHM C[C@@H]1CCC[C@@H]1C(=O)NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000824929481 609512132 /nfs/dbraw/zinc/51/21/32/609512132.db2.gz XWQASRQZZARIAK-PBHICJAKSA-N -1 3 361.449 3.586 20 0 FHADHM C[C@@H]1CCC[C@@H]1C(=O)NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000824929481 609512133 /nfs/dbraw/zinc/51/21/33/609512133.db2.gz XWQASRQZZARIAK-PBHICJAKSA-N -1 3 361.449 3.586 20 0 FHADHM CSc1c(F)cc(NC(=O)C=Cc2ccccc2-c2nnn[n-]2)cc1F ZINC000826229345 609516973 /nfs/dbraw/zinc/51/69/73/609516973.db2.gz APVYOJWOSRLXMX-VOTSOKGWSA-N -1 3 373.388 3.519 20 0 FHADHM CSc1c(F)cc(NC(=O)C=Cc2ccccc2-c2nn[n-]n2)cc1F ZINC000826229345 609516974 /nfs/dbraw/zinc/51/69/74/609516974.db2.gz APVYOJWOSRLXMX-VOTSOKGWSA-N -1 3 373.388 3.519 20 0 FHADHM CC[C@@H](C)[C@@H](C)C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)nc1 ZINC000825051821 609527602 /nfs/dbraw/zinc/52/76/02/609527602.db2.gz SMCHPYRDXVICRP-CHWSQXEVSA-N -1 3 366.425 3.675 20 0 FHADHM CC[C@@H](C)[C@@H](C)C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)nc1 ZINC000825051821 609527603 /nfs/dbraw/zinc/52/76/03/609527603.db2.gz SMCHPYRDXVICRP-CHWSQXEVSA-N -1 3 366.425 3.675 20 0 FHADHM CC[C@@H](Nc1nccc(C)c1-c1nnn[n-]1)c1ccccc1OC(F)F ZINC000825147554 609532321 /nfs/dbraw/zinc/53/23/21/609532321.db2.gz JEHCGTINRKCAOB-GFCCVEGCSA-N -1 3 360.368 3.735 20 0 FHADHM CC[C@@H](Nc1nccc(C)c1-c1nn[n-]n1)c1ccccc1OC(F)F ZINC000825147554 609532323 /nfs/dbraw/zinc/53/23/23/609532323.db2.gz JEHCGTINRKCAOB-GFCCVEGCSA-N -1 3 360.368 3.735 20 0 FHADHM COc1ccccc1[C@@H](Nc1nccc(C)c1-c1nnn[n-]1)c1ccccc1 ZINC000826219099 609549342 /nfs/dbraw/zinc/54/93/42/609549342.db2.gz SXAXBIWIUBHWGN-IBGZPJMESA-N -1 3 372.432 3.780 20 0 FHADHM COc1ccccc1[C@@H](Nc1nccc(C)c1-c1nn[n-]n1)c1ccccc1 ZINC000826219099 609549344 /nfs/dbraw/zinc/54/93/44/609549344.db2.gz SXAXBIWIUBHWGN-IBGZPJMESA-N -1 3 372.432 3.780 20 0 FHADHM Cc1cnc([C@H](Nc2ncc(Cl)c(C)c2-c2nnn[n-]2)C2CC2)s1 ZINC000826317752 609560163 /nfs/dbraw/zinc/56/01/63/609560163.db2.gz MOIURYTZZPKKFE-GFCCVEGCSA-N -1 3 361.862 3.552 20 0 FHADHM Cc1cnc([C@H](Nc2ncc(Cl)c(C)c2-c2nn[n-]n2)C2CC2)s1 ZINC000826317752 609560165 /nfs/dbraw/zinc/56/01/65/609560165.db2.gz MOIURYTZZPKKFE-GFCCVEGCSA-N -1 3 361.862 3.552 20 0 FHADHM Cc1ccnc(N[C@@H](C)c2ccc(-c3ccncc3)cc2)c1-c1nnn[n-]1 ZINC000826311671 609568058 /nfs/dbraw/zinc/56/80/58/609568058.db2.gz KRNYVEJJZAEAJP-AWEZNQCLSA-N -1 3 357.421 3.805 20 0 FHADHM Cc1ccnc(N[C@@H](C)c2ccc(-c3ccncc3)cc2)c1-c1nn[n-]n1 ZINC000826311671 609568060 /nfs/dbraw/zinc/56/80/60/609568060.db2.gz KRNYVEJJZAEAJP-AWEZNQCLSA-N -1 3 357.421 3.805 20 0 FHADHM COCC[C@@H](Nc1ccc(C(F)(F)F)cc1-c1nnn[n-]1)c1ccco1 ZINC000826155495 609571687 /nfs/dbraw/zinc/57/16/87/609571687.db2.gz RUMCWPFCXRHVGX-CYBMUJFWSA-N -1 3 367.331 3.668 20 0 FHADHM COCC[C@@H](Nc1ccc(C(F)(F)F)cc1-c1nn[n-]n1)c1ccco1 ZINC000826155495 609571690 /nfs/dbraw/zinc/57/16/90/609571690.db2.gz RUMCWPFCXRHVGX-CYBMUJFWSA-N -1 3 367.331 3.668 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1N1CCC[C@H]1/C=C\c1ccccc1 ZINC000826350951 609580104 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CO[C@@H](C)c1cccc(NC(=O)c2c[n-]c3c(C)cc(F)cc3c2=O)c1 ZINC000130849673 933033658 /nfs/dbraw/zinc/03/36/58/933033658.db2.gz QPUGLMQOBPAAGD-LBPRGKRZSA-N -1 3 354.381 3.935 20 0 FHADHM Cc1ccc(C(C)C)cc1O[C@H](C)C(=O)N=c1cc(-c2ccncc2)[n-][nH]1 ZINC000588926441 933061212 /nfs/dbraw/zinc/06/12/12/933061212.db2.gz JGCXFGKNFNDCFX-OAHLLOKOSA-N -1 3 364.449 3.731 20 0 FHADHM Cc1ccc(Oc2ccccc2CNC(=O)NCc2ncccc2[O-])cc1 ZINC000471836813 933086487 /nfs/dbraw/zinc/08/64/87/933086487.db2.gz SMJZFVPYRYGQIP-UHFFFAOYSA-N -1 3 363.417 3.887 20 0 FHADHM C[C@H]1C(=O)CC[C@@H](C(=O)Nc2ccc(Br)cc2[O-])C1(C)C ZINC000548361641 933096464 /nfs/dbraw/zinc/09/64/64/933096464.db2.gz SQKCBFZRLVSJCW-ONGXEEELSA-N -1 3 354.244 3.735 20 0 FHADHM C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)c1cc(=O)[n-]c(C2CC2)n1 ZINC000518560120 933569045 /nfs/dbraw/zinc/56/90/45/933569045.db2.gz RIZNTRAIFWVLEW-JTQLQIEISA-N -1 3 365.355 3.912 20 0 FHADHM O=C(Nc1cccc([O-])c1F)C1=Cc2cc(Br)ccc2OC1 ZINC000535658189 933645900 /nfs/dbraw/zinc/64/59/00/933645900.db2.gz MUXMFJUTWYAHSN-UHFFFAOYSA-N -1 3 364.170 3.708 20 0 FHADHM Cc1noc(C)c1[C@@H](C)CC(=O)Nc1n[n-]c(-c2cc3ccccc3o2)n1 ZINC000276844327 933774355 /nfs/dbraw/zinc/77/43/55/933774355.db2.gz YXMKKWGVBPBKDL-JTQLQIEISA-N -1 3 365.393 3.955 20 0 FHADHM O=C(NCc1ccc([O-])c(Br)c1)Nc1ccc2c(c1)COC2 ZINC000092168366 933971610 /nfs/dbraw/zinc/97/16/10/933971610.db2.gz PMCLNHAPCULBFH-UHFFFAOYSA-N -1 3 363.211 3.507 20 0 FHADHM CC[C@H]1[C@H](C)CCN1C(=O)c1cc(=O)c2cc(Br)ccc2[n-]1 ZINC000548475519 934071008 /nfs/dbraw/zinc/07/10/08/934071008.db2.gz QLADPTCCEYQKFG-BMIGLBTASA-N -1 3 363.255 3.551 20 0 FHADHM CC(C)CN(C(=O)c1csc(=NC2CC2)[n-]1)[C@@H]1CCCc2cccnc21 ZINC000548475685 934077734 /nfs/dbraw/zinc/07/77/34/934077734.db2.gz BHTIHISLGWGBGB-QGZVFWFLSA-N -1 3 370.522 3.710 20 0 FHADHM CCc1oc(C(=O)Nc2cc(I)ccc2[O-])cc1C ZINC000610765751 934130662 /nfs/dbraw/zinc/13/06/62/934130662.db2.gz YSSOSOOJPDMUOC-UHFFFAOYSA-N -1 3 371.174 3.713 20 0 FHADHM CC[C@@H](C)n1ncc(NC(=O)c2c[n-]c3ccccc3c2=O)c1C1CC1 ZINC000535695808 934290716 /nfs/dbraw/zinc/29/07/16/934290716.db2.gz GVNSVHAKRNMZMB-GFCCVEGCSA-N -1 3 350.422 3.825 20 0 FHADHM Cc1ccc([C@H](C)[C@@H](O)C(=O)Nc2ccc(Br)cc2[O-])cc1 ZINC000535727489 934314301 /nfs/dbraw/zinc/31/43/01/934314301.db2.gz YTFPTFBRFSGEHK-MEDUHNTESA-N -1 3 364.239 3.566 20 0 FHADHM O=C(c1c[n-]c2c(Cl)cc(Br)cc2c1=O)N1CCCCC1 ZINC000535749029 934339107 /nfs/dbraw/zinc/33/91/07/934339107.db2.gz UGPNMFNNNCUBJB-UHFFFAOYSA-N -1 3 369.646 3.570 20 0 FHADHM COc1cccc(C(F)(F)C(=O)[N-][C@@H](Cc2ccccc2)c2ncco2)c1 ZINC001143417931 934451016 /nfs/dbraw/zinc/45/10/16/934451016.db2.gz FKLSNFDNWKYOKR-KRWDZBQOSA-N -1 3 372.371 3.875 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]CC[C@]2(C)CC2(F)F)c(Cl)c1Cl ZINC000657160383 934560248 /nfs/dbraw/zinc/56/02/48/934560248.db2.gz QKSZRWDXXVSWJF-GFCCVEGCSA-N -1 3 374.236 3.716 20 0 FHADHM O=C(NCc1ncccc1[O-])NC[C@H](Cc1ccccc1)c1ccccc1 ZINC000471989337 934662614 /nfs/dbraw/zinc/66/26/14/934662614.db2.gz ADHNJLMOHONIRM-IBGZPJMESA-N -1 3 361.445 3.613 20 0 FHADHM CCOc1ccccc1[C@H](CC(C)C)NC(=O)NCc1ncccc1[O-] ZINC000471992706 934736709 /nfs/dbraw/zinc/73/67/09/934736709.db2.gz POPQHLBDOUQQRG-INIZCTEOSA-N -1 3 357.454 3.773 20 0 FHADHM O=c1[n-]nc(SCCOCc2ccccc2)n1CCc1ccccc1 ZINC000657233926 934786193 /nfs/dbraw/zinc/78/61/93/934786193.db2.gz GKZOJHZEGCXKSS-UHFFFAOYSA-N -1 3 355.463 3.535 20 0 FHADHM O=C(/C=C\c1ccnc(Cl)c1)Nc1cc(Br)ccc1[O-] ZINC000255439150 934859025 /nfs/dbraw/zinc/85/90/25/934859025.db2.gz GFTLEXVRTBEGCK-RJRFIUFISA-N -1 3 353.603 3.855 20 0 FHADHM Cc1ccc(CNC(=O)NCc2ncccc2[O-])c(Oc2ccccc2)c1 ZINC000472071887 934945585 /nfs/dbraw/zinc/94/55/85/934945585.db2.gz BXLGLZZZMGPJTJ-UHFFFAOYSA-N -1 3 363.417 3.887 20 0 FHADHM Cc1noc(C)c1S(=O)(=O)[N-][C@H](CC(C)(C)C)c1ccc(F)cc1 ZINC000511046312 935055903 /nfs/dbraw/zinc/05/59/03/935055903.db2.gz MFUGJVYVOPFEDW-OAHLLOKOSA-N -1 3 354.447 3.886 20 0 FHADHM CC(=O)N(C)c1ccc([N-]S(=O)(=O)c2c(C)c(C)cc(C)c2C)cc1 ZINC000014257267 935077669 /nfs/dbraw/zinc/07/76/69/935077669.db2.gz NKQFDVOJILGHEI-UHFFFAOYSA-N -1 3 360.479 3.704 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2F)c2cccnc12 ZINC000047251811 945076140 /nfs/dbraw/zinc/07/61/40/945076140.db2.gz ONYCQKXEZKEXRR-UHFFFAOYSA-N -1 3 366.801 3.837 20 0 FHADHM CC1(C)CC[C@H]2C[C@@H](NC(=O)NCc3ncccc3[O-])c3cccc1c32 ZINC000472127742 935102639 /nfs/dbraw/zinc/10/26/39/935102639.db2.gz IGENOXODUDLPGP-XJKSGUPXSA-N -1 3 351.450 3.886 20 0 FHADHM COC(=O)c1ccc(C(=O)Nc2nc(-c3ccc(C)cc3)c(C)s2)[n-]1 ZINC000431348827 935221815 /nfs/dbraw/zinc/22/18/15/935221815.db2.gz GRUJHNXHHBRCMC-UHFFFAOYSA-N -1 3 355.419 3.794 20 0 FHADHM CCc1cccc(C(=O)N2CCC[C@H](Cn3cnc4ccccc43)C2)c1[O-] ZINC000684756531 935280972 /nfs/dbraw/zinc/28/09/72/935280972.db2.gz WWYSJTZYGJCZOU-INIZCTEOSA-N -1 3 363.461 3.857 20 0 FHADHM Cc1cc(C)c(NC(=O)CN(C)C(=O)c2cc([O-])ccc2Cl)c(C)c1 ZINC000277494035 935330600 /nfs/dbraw/zinc/33/06/00/935330600.db2.gz RLIPBBRSLQLJBX-UHFFFAOYSA-N -1 3 360.841 3.682 20 0 FHADHM O=C(c1c([O-])cccc1O)N1CCC(CCc2ccc(F)cc2F)CC1 ZINC000655407660 935604859 /nfs/dbraw/zinc/60/48/59/935604859.db2.gz FKJYDVPSRZBONY-UHFFFAOYSA-N -1 3 361.388 3.861 20 0 FHADHM [O-]C(=NO[C@H]1CCCCO1)Nc1ccc(N2CCc3sccc3C2)cc1 ZINC000158927216 935764599 /nfs/dbraw/zinc/76/45/99/935764599.db2.gz GBBNGXLVIZIFGR-SFHVURJKSA-N -1 3 373.478 3.891 20 0 FHADHM O=C([N-]O[C@H]1CCCCO1)Nc1ccc(N2CCc3sccc3C2)cc1 ZINC000158927216 935764600 /nfs/dbraw/zinc/76/46/00/935764600.db2.gz GBBNGXLVIZIFGR-SFHVURJKSA-N -1 3 373.478 3.891 20 0 FHADHM C[C@H](C1CC1)n1cc([N-]S(=O)(=O)/C=C\c2cccc(Cl)c2)cn1 ZINC000588524320 935772563 /nfs/dbraw/zinc/77/25/63/935772563.db2.gz QGUXRTVUKVTMBL-QDZRJHCZSA-N -1 3 351.859 3.920 20 0 FHADHM CCN(Cc1nc(=O)c2c(-c3ccco3)csc2[n-]1)CC(F)(F)F ZINC000112344145 935774431 /nfs/dbraw/zinc/77/44/31/935774431.db2.gz APXSBRYONCECCG-UHFFFAOYSA-N -1 3 357.357 3.629 20 0 FHADHM COc1cc(C)c(S(=O)(=O)[N-]c2cccc(-c3cnco3)c2)c(C)c1 ZINC000516678232 945124614 /nfs/dbraw/zinc/12/46/14/945124614.db2.gz ODQUEPFKDQIIHT-UHFFFAOYSA-N -1 3 358.419 3.768 20 0 FHADHM O=S(=O)([N-][C@H]1CCC(F)(F)C1)c1ccc(Cl)cc1Br ZINC000684913884 935825809 /nfs/dbraw/zinc/82/58/09/935825809.db2.gz SSBOVUIXXQSPEU-QMMMGPOBSA-N -1 3 374.634 3.569 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N(C)C[C@H]3CCc4ccccc43)nc2)n1 ZINC000664615962 945140401 /nfs/dbraw/zinc/14/04/01/945140401.db2.gz IPDDDFCXLLQJIB-QGZVFWFLSA-N -1 3 360.461 3.973 20 0 FHADHM CCCCc1ccc([N-]S(=O)(=O)c2ccc3oc(=O)ccc3c2)cc1 ZINC000023015363 936048184 /nfs/dbraw/zinc/04/81/84/936048184.db2.gz SDGVJZKGMXHZGH-UHFFFAOYSA-N -1 3 357.431 3.936 20 0 FHADHM Cc1ccc(C[C@H](NC(=O)N=c2cc3ccccn3[n-]2)c2ccccn2)cc1 ZINC000548763222 936070660 /nfs/dbraw/zinc/07/06/60/936070660.db2.gz HOHALYDHOMTPMO-FQEVSTJZSA-N -1 3 371.444 3.565 20 0 FHADHM O=S(=O)([N-]C[C@H](Cc1ccccc1)C(F)(F)F)c1ccccc1F ZINC000582755369 936079316 /nfs/dbraw/zinc/07/93/16/936079316.db2.gz QOEHBAPHMAOCCI-ZDUSSCGKSA-N -1 3 361.360 3.525 20 0 FHADHM Cc1sc2[n-]c([C@@H](C)OC(=O)Cc3ccccc3C)nc(=O)c2c1C ZINC000023048469 936110271 /nfs/dbraw/zinc/11/02/71/936110271.db2.gz WBRUJONVBDSBFL-GFCCVEGCSA-N -1 3 356.447 3.757 20 0 FHADHM CC[C@H](NC(=O)Cc1noc(-c2ccc(C)cc2[O-])n1)c1ccccc1 ZINC000277901875 936125917 /nfs/dbraw/zinc/12/59/17/936125917.db2.gz IACHBLNPESWLTK-INIZCTEOSA-N -1 3 351.406 3.561 20 0 FHADHM C[C@@H]1C[C@@H](NC(=O)c2cc(=O)[n-]c(C3CC3)n2)C[C@@H](c2ccccc2)C1 ZINC000582796691 936134178 /nfs/dbraw/zinc/13/41/78/936134178.db2.gz WFXPODXFUSVSIA-RRQGHBQHSA-N -1 3 351.450 3.762 20 0 FHADHM CSc1ccc([O-])c(C(=O)N2C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C2)c1 ZINC000611722774 936155322 /nfs/dbraw/zinc/15/53/22/936155322.db2.gz XTAZXMWNHDCZJY-AOOOYVTPSA-N -1 3 373.318 3.927 20 0 FHADHM CCc1ccc(CC[N-]S(=O)(=O)c2ccc(Br)s2)cc1 ZINC000033618985 936183757 /nfs/dbraw/zinc/18/37/57/936183757.db2.gz XIOLMSADYXDKGG-UHFFFAOYSA-N -1 3 374.325 3.594 20 0 FHADHM CCc1ccc([C@H](CN=c2nc([C@H](C)OC)[n-]s2)N(CC)CC)cc1 ZINC000431504617 936268224 /nfs/dbraw/zinc/26/82/24/936268224.db2.gz GKCJLWRLUSNTHC-YOEHRIQHSA-N -1 3 362.543 3.725 20 0 FHADHM Cc1ccc([C@@H](c2noc(Cc3c(C)nc(C)[n-]c3=O)n2)C(C)C)cc1 ZINC000582930805 936298347 /nfs/dbraw/zinc/29/83/47/936298347.db2.gz FECQJJKDSPLCSE-SFHVURJKSA-N -1 3 352.438 3.869 20 0 FHADHM O=S(=O)([N-]C[C@@H](O)c1ccc2ccccc2c1)c1ccc(Cl)s1 ZINC000158775395 938268940 /nfs/dbraw/zinc/26/89/40/938268940.db2.gz BECWRVGYSJYLJH-CQSZACIVSA-N -1 3 367.879 3.567 20 0 FHADHM Cc1ccc(NC(=O)[C@H]2C[C@H]2C)cc1S(=O)(=O)[N-]c1ccccc1F ZINC000022743923 938276214 /nfs/dbraw/zinc/27/62/14/938276214.db2.gz RJSNSQRIASXQNZ-OCCSQVGLSA-N -1 3 362.426 3.529 20 0 FHADHM COC[C@@]1(C(=O)[O-])CCN(Cc2csc(-c3ccc(C(C)C)cc3)n2)C1 ZINC000583505143 938281223 /nfs/dbraw/zinc/28/12/23/938281223.db2.gz UFPHVRRLKXBWHW-HXUWFJFHSA-N -1 3 374.506 3.857 20 0 FHADHM COc1ccc([O-])c(C(=O)Nc2ccc(C)cc2OC[C@H]2CCCO2)c1 ZINC000536074370 938308529 /nfs/dbraw/zinc/30/85/29/938308529.db2.gz YPTMYOGDOKPYEM-OAHLLOKOSA-N -1 3 357.406 3.519 20 0 FHADHM O=C(Nc1cc(F)c(F)cc1N1CCCCC1)c1cc(=O)[n-]c(C2CC2)n1 ZINC000583703198 938366838 /nfs/dbraw/zinc/36/68/38/938366838.db2.gz PZJRTCJXVYNFGL-UHFFFAOYSA-N -1 3 374.391 3.580 20 0 FHADHM COc1ccc(C(F)(F)C(=O)[N-][C@H](c2nc(C3CC3)no2)C(C)C)cc1 ZINC000129654300 938369883 /nfs/dbraw/zinc/36/98/83/938369883.db2.gz HKBLEGGTMLYIRQ-AWEZNQCLSA-N -1 3 365.380 3.561 20 0 FHADHM CCc1ccc([O-])c(C(=O)N2C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C2)c1 ZINC000075547497 938457988 /nfs/dbraw/zinc/45/79/88/938457988.db2.gz SQGSJOWARJIXMU-PHIMTYICSA-N -1 3 355.278 3.767 20 0 FHADHM O=C(c1cc(=O)[n-]c(C2CC2)n1)N(Cc1cc(F)ccc1F)C1CCCC1 ZINC000583943296 938496812 /nfs/dbraw/zinc/49/68/12/938496812.db2.gz FMSARONZMPIMHF-UHFFFAOYSA-N -1 3 373.403 3.923 20 0 FHADHM CCCOc1ccc(C(=O)CCC(=O)NCc2ccc([O-])c(F)c2)cc1 ZINC000132725637 938537900 /nfs/dbraw/zinc/53/79/00/938537900.db2.gz WNEAQXQLSNOXTR-UHFFFAOYSA-N -1 3 359.397 3.599 20 0 FHADHM O=C(Nc1ccc(C(=O)NCc2ccc([O-])c(F)c2)cc1)c1cccs1 ZINC000133229725 938567611 /nfs/dbraw/zinc/56/76/11/938567611.db2.gz NJKSLAUYJAQHTR-UHFFFAOYSA-N -1 3 370.405 3.775 20 0 FHADHM Cc1cccc(O[C@@H](C)C(=O)NCc2ccc([O-])c(Br)c2)c1 ZINC000151531599 938569333 /nfs/dbraw/zinc/56/93/33/938569333.db2.gz YPENLHCOTQPNBU-LBPRGKRZSA-N -1 3 364.239 3.547 20 0 FHADHM O=C(NCc1ccc([O-])c(Br)c1)[C@H]1C[C@@H]1c1ccc(F)cc1 ZINC000151535448 938569621 /nfs/dbraw/zinc/56/96/21/938569621.db2.gz KLFLPVCVWNOADY-KGLIPLIRSA-N -1 3 364.214 3.714 20 0 FHADHM O=C(NCc1ccc([O-])c(Br)c1)[C@H]1C[C@H]1c1ccc(F)cc1 ZINC000151535390 938569715 /nfs/dbraw/zinc/56/97/15/938569715.db2.gz KLFLPVCVWNOADY-KBPBESRZSA-N -1 3 364.214 3.714 20 0 FHADHM C[C@H](Cc1cccc(F)c1)C(=O)NCc1ccc([O-])c(Br)c1 ZINC000151556345 938574494 /nfs/dbraw/zinc/57/44/94/938574494.db2.gz CIOPOYHJZNBZSV-LLVKDONJSA-N -1 3 366.230 3.789 20 0 FHADHM CC[C@@H](OC1CCCCC1)C(=O)NCc1ccc([O-])c(Br)c1 ZINC000151597062 938595527 /nfs/dbraw/zinc/59/55/27/938595527.db2.gz ZXVICSXOUMHRFS-MRXNPFEDSA-N -1 3 370.287 3.899 20 0 FHADHM CC(=O)c1cccc(NC(=O)c2cccc(Cn3nc(C)cc3C)c2)c1[O-] ZINC000584223143 938648892 /nfs/dbraw/zinc/64/88/92/938648892.db2.gz PEJRWBXELHZUQW-UHFFFAOYSA-N -1 3 363.417 3.709 20 0 FHADHM O=C([O-])[C@@H]1C[C@H]2CCCC[C@@H]2N1Cc1cn2cc(Cl)cc(Cl)c2n1 ZINC000248561818 938655286 /nfs/dbraw/zinc/65/52/86/938655286.db2.gz NSRPOPZHAXBUCM-ONERCXAPSA-N -1 3 368.264 3.859 20 0 FHADHM [O-]C(=NO[C@H]1CCCCO1)Nc1ccc(Oc2cccc(F)c2F)nc1 ZINC000278713992 938676861 /nfs/dbraw/zinc/67/68/61/938676861.db2.gz REMRXUZCOUNLQI-HNNXBMFYSA-N -1 3 365.336 3.732 20 0 FHADHM O=C([N-]O[C@H]1CCCCO1)Nc1ccc(Oc2cccc(F)c2F)nc1 ZINC000278713992 938676864 /nfs/dbraw/zinc/67/68/64/938676864.db2.gz REMRXUZCOUNLQI-HNNXBMFYSA-N -1 3 365.336 3.732 20 0 FHADHM O=C(NCCCSc1ccc(F)cc1)c1c[n-]c2ccccc2c1=O ZINC000032991491 938705887 /nfs/dbraw/zinc/70/58/87/938705887.db2.gz GDVIILJIDVVAEY-UHFFFAOYSA-N -1 3 356.422 3.579 20 0 FHADHM CCc1cccc(C(=O)Nc2ccc(Cl)c(C[S@@](C)=O)c2)c1[O-] ZINC000081781703 938802344 /nfs/dbraw/zinc/80/23/44/938802344.db2.gz NFZJPZCKVMIUJH-QHCPKHFHSA-N -1 3 351.855 3.739 20 0 FHADHM O=C(CCCc1ccc([O-])c(F)c1)N[C@H](CCO)c1ccc(Cl)cc1 ZINC000584430905 938860980 /nfs/dbraw/zinc/86/09/80/938860980.db2.gz OKAWWRSCZKUJIG-QGZVFWFLSA-N -1 3 365.832 3.747 20 0 FHADHM CCc1cccc(C(=O)N2CCC(OCc3ccccc3OC)CC2)c1[O-] ZINC000091818649 938907607 /nfs/dbraw/zinc/90/76/07/938907607.db2.gz YROWIHRBCVWXSC-UHFFFAOYSA-N -1 3 369.461 3.785 20 0 FHADHM CCc1cccc(C(=O)N2CCC[C@H]2c2ccc(OC)c(OC)c2)c1[O-] ZINC000093910914 938931911 /nfs/dbraw/zinc/93/19/11/938931911.db2.gz CSDLTHSJYHRZJE-KRWDZBQOSA-N -1 3 355.434 3.949 20 0 FHADHM CCc1cccc(C(=O)Nc2ccccc2NC(=O)N2CCCC2)c1[O-] ZINC000094015812 938932672 /nfs/dbraw/zinc/93/26/72/938932672.db2.gz RYHTVNKHLOMEFQ-UHFFFAOYSA-N -1 3 353.422 3.835 20 0 FHADHM CCc1cccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2C)c1[O-] ZINC000094072869 938934674 /nfs/dbraw/zinc/93/46/74/938934674.db2.gz SIVHHPUDPQEWCS-UHFFFAOYSA-N -1 3 352.434 3.751 20 0 FHADHM COc1ccc(C(=O)NCc2ccc(Oc3cccnc3)c(F)c2)c([O-])c1 ZINC000144645363 938951726 /nfs/dbraw/zinc/95/17/26/938951726.db2.gz MKIUUHNBACKWLN-UHFFFAOYSA-N -1 3 368.364 3.657 20 0 FHADHM O=S(=O)([N-][C@@H]1CC[C@H]2C[C@H]2C1)c1c(Cl)cccc1Br ZINC000403324810 938986197 /nfs/dbraw/zinc/98/61/97/938986197.db2.gz NORBZJQFEGVYKD-LPEHRKFASA-N -1 3 364.692 3.569 20 0 FHADHM Cc1cc(C(=O)N=c2cc3ccc(Br)cn3[n-]2)cc(C)c1F ZINC000511317050 939010407 /nfs/dbraw/zinc/01/04/07/939010407.db2.gz XDYLRKFDKPWGIH-UHFFFAOYSA-N -1 3 362.202 3.527 20 0 FHADHM CC(C)[C@@H](C[N-]S(=O)(=O)c1ccc(Cl)nc1Cl)c1cccnc1 ZINC000177023256 939051107 /nfs/dbraw/zinc/05/11/07/939051107.db2.gz CIEMMQFVRFIAOO-GFCCVEGCSA-N -1 3 374.293 3.502 20 0 FHADHM Cc1nc2ccc(C(=O)NCc3ccc([O-])c(Br)c3)cc2o1 ZINC000472359698 939062079 /nfs/dbraw/zinc/06/20/79/939062079.db2.gz MMZQXIGLLNBRTE-UHFFFAOYSA-N -1 3 361.195 3.534 20 0 FHADHM C[C@H](Sc1nc2c(cnn2C)c(=O)[n-]1)c1cccc(C(F)(F)F)c1 ZINC000664621941 945226744 /nfs/dbraw/zinc/22/67/44/945226744.db2.gz NQQYHAKHHZLZSA-QMMMGPOBSA-N -1 3 354.357 3.941 20 0 FHADHM Cc1cn2c(nc(C)c2-c2noc(-c3cc(-c4ccco4)[n-]n3)n2)s1 ZINC000426568559 945231555 /nfs/dbraw/zinc/23/15/55/945231555.db2.gz RFSBJSINRSZIFO-UHFFFAOYSA-N -1 3 352.379 3.713 20 0 FHADHM C[C@H](CC(=O)NC1CCN(C(=O)c2ccccc2[O-])CC1)C1CCCCC1 ZINC000586757960 939185711 /nfs/dbraw/zinc/18/57/11/939185711.db2.gz NMRQISRYCKZFBJ-MRXNPFEDSA-N -1 3 372.509 3.720 20 0 FHADHM CNC(=O)COc1ccc(N[C@H](C)c2cc(Cl)c(Cl)cc2[O-])cc1 ZINC000193259689 939223500 /nfs/dbraw/zinc/22/35/00/939223500.db2.gz BVQIIQUJPOEAKU-SNVBAGLBSA-N -1 3 369.248 3.997 20 0 FHADHM Cc1cc(S(=O)(=O)[N-]Cc2cccc(-c3ccccn3)c2)c(F)cc1F ZINC000438949270 945256631 /nfs/dbraw/zinc/25/66/31/945256631.db2.gz QGELQNMVSPPOKT-UHFFFAOYSA-N -1 3 374.412 3.814 20 0 FHADHM OC1(CNc2ccc(Oc3ccccc3-c3nnn[n-]3)cc2)CCCCC1 ZINC000738390200 945263863 /nfs/dbraw/zinc/26/38/63/945263863.db2.gz QGWKSEOMKYBBKY-UHFFFAOYSA-N -1 3 365.437 3.766 20 0 FHADHM OC1(CNc2ccc(Oc3ccccc3-c3nn[n-]n3)cc2)CCCCC1 ZINC000738390200 945263874 /nfs/dbraw/zinc/26/38/74/945263874.db2.gz QGWKSEOMKYBBKY-UHFFFAOYSA-N -1 3 365.437 3.766 20 0 FHADHM Cc1cc(C(=O)NCc2ccc([O-])c(F)c2)c(C)cc1Br ZINC000507489857 945277231 /nfs/dbraw/zinc/27/72/31/945277231.db2.gz ZTLZCNYSJHTSSL-UHFFFAOYSA-N -1 3 352.203 3.841 20 0 FHADHM COc1ccc(-n2ccnc2S[C@H](C)c2nc(C)cc(=O)[n-]2)c(C)c1 ZINC000544078037 939875753 /nfs/dbraw/zinc/87/57/53/939875753.db2.gz WGFVBUCFGFPKLN-CYBMUJFWSA-N -1 3 356.451 3.847 20 0 FHADHM CC(C)c1ccc(C(=O)N2CCC(C(=O)N3CCC(C)CC3)CC2)c([O-])c1 ZINC000299029323 939907819 /nfs/dbraw/zinc/90/78/19/939907819.db2.gz SJSJJNFDGGVSEX-UHFFFAOYSA-N -1 3 372.509 3.626 20 0 FHADHM CCCC(=O)Nc1ccc(C)c(S(=O)(=O)[N-]c2ccccc2F)c1 ZINC000023988287 939954348 /nfs/dbraw/zinc/95/43/48/939954348.db2.gz JVIADOQMBDRBOK-UHFFFAOYSA-N -1 3 350.415 3.674 20 0 FHADHM Cc1nc(C)c(CCC(=O)N2CC3(CCCC3)c3cccc(F)c32)c(=O)[n-]1 ZINC000278795726 940055236 /nfs/dbraw/zinc/05/52/36/940055236.db2.gz YXJSRGMMKMOHED-UHFFFAOYSA-N -1 3 369.440 3.729 20 0 FHADHM O=C(Nc1ccc(Cl)cc1[O-])c1c[nH]c2ncc(Br)cc12 ZINC000472438509 940121066 /nfs/dbraw/zinc/12/10/66/940121066.db2.gz HJJGTINOAYWTFS-UHFFFAOYSA-N -1 3 366.602 3.937 20 0 FHADHM COC(=O)c1ccc(C(=O)Nc2ccc(OC)c(Cc3ccccc3)c2)[n-]1 ZINC000431661293 940163263 /nfs/dbraw/zinc/16/32/63/940163263.db2.gz MLVNTSCIBZGPAJ-UHFFFAOYSA-N -1 3 364.401 3.653 20 0 FHADHM CCc1cc(=O)[n-]c(CN(Cc2ccc(OC)cc2OC)[C@@H](C)C2CC2)n1 ZINC000548944946 940171720 /nfs/dbraw/zinc/17/17/20/940171720.db2.gz UEKHWWQFZQFINW-AWEZNQCLSA-N -1 3 371.481 3.563 20 0 FHADHM CC(=O)c1ccc(C(=O)N2CCC[C@H]2CC(=O)c2ccc(F)cc2)cc1[O-] ZINC000612722807 940240932 /nfs/dbraw/zinc/24/09/32/940240932.db2.gz LFWYVXFWQHYICI-KRWDZBQOSA-N -1 3 369.392 3.612 20 0 FHADHM COc1cccc([C@H](C)CCCC(=O)NC(C)(C)c2nc(C)cc(=O)[n-]2)c1 ZINC000636110442 940254454 /nfs/dbraw/zinc/25/44/54/940254454.db2.gz LIEPMYHXHUEESC-CQSZACIVSA-N -1 3 371.481 3.825 20 0 FHADHM O=C(Nc1cc(Cl)ccc1[O-])c1c(C(F)(F)F)nc2n1CCCC2 ZINC000612754907 940259122 /nfs/dbraw/zinc/25/91/22/940259122.db2.gz VIAMHVKPYSBLEZ-UHFFFAOYSA-N -1 3 359.735 3.850 20 0 FHADHM [O-]c1ccccc1-c1nc(-c2cccc(I)c2)no1 ZINC000612887551 940324519 /nfs/dbraw/zinc/32/45/19/940324519.db2.gz DEZSWOSMGKOPEV-UHFFFAOYSA-N -1 3 364.142 3.714 20 0 FHADHM CSc1nc(NC(=O)c2ccc(O[C@H](C)c3ccccc3)cc2)n[n-]1 ZINC000472471164 940330516 /nfs/dbraw/zinc/33/05/16/940330516.db2.gz PGBXXDZKQWLXOC-GFCCVEGCSA-N -1 3 354.435 3.919 20 0 FHADHM CC(C)(C)c1cnc(CCC(=O)N=c2cc(-c3cc(F)cc(F)c3)[n-][nH]2)o1 ZINC000548964702 940338518 /nfs/dbraw/zinc/33/85/18/940338518.db2.gz MLKAQLJVIQVQSS-UHFFFAOYSA-N -1 3 374.391 3.634 20 0 FHADHM C[C@H](OC(=O)c1cc(-c2ccco2)[n-]n1)c1nnc(-c2ccc(F)cc2)o1 ZINC000782671241 940378169 /nfs/dbraw/zinc/37/81/69/940378169.db2.gz DGWWHQXWEAHHFZ-JTQLQIEISA-N -1 3 368.324 3.777 20 0 FHADHM C[C@H](OC(=O)c1cc(-c2ccco2)n[n-]1)c1nnc(-c2ccc(F)cc2)o1 ZINC000782671241 940378172 /nfs/dbraw/zinc/37/81/72/940378172.db2.gz DGWWHQXWEAHHFZ-JTQLQIEISA-N -1 3 368.324 3.777 20 0 FHADHM Cc1sc2[n-]c([C@@H](C)OC(=O)c3cc(C)c(C)cn3)nc(=O)c2c1C ZINC000923782764 940440796 /nfs/dbraw/zinc/44/07/96/940440796.db2.gz AXUJBJAAXOIXPS-LLVKDONJSA-N -1 3 357.435 3.944 20 0 FHADHM COC(=O)c1c(C)cccc1S(=O)(=O)[N-]c1c(C)cccc1Cl ZINC000613112237 940456394 /nfs/dbraw/zinc/45/63/94/940456394.db2.gz HJENWGBIYIYPTR-UHFFFAOYSA-N -1 3 353.827 3.544 20 0 FHADHM CCCOc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(C(=O)OC)[n-]1 ZINC000431754246 940472710 /nfs/dbraw/zinc/47/27/10/940472710.db2.gz XTIPDERIGCIINZ-UHFFFAOYSA-N -1 3 370.327 3.861 20 0 FHADHM CCN1C[C@@H](CN(C)C(=O)c2ccc(C(C)C)cc2[O-])Oc2ccccc21 ZINC000613228379 940487606 /nfs/dbraw/zinc/48/76/06/940487606.db2.gz DGRFPWKUDRPNFA-QGZVFWFLSA-N -1 3 368.477 3.875 20 0 FHADHM CCc1ccc([C@@H](O)CNc2ccc(-c3nc(CC)cc(=O)[n-]3)cn2)cc1 ZINC000376241384 940509023 /nfs/dbraw/zinc/50/90/23/940509023.db2.gz JNEJPBUIZFLIIL-SFHVURJKSA-N -1 3 364.449 3.515 20 0 FHADHM CCOC(=O)c1ncc(NC(=O)Cc2cc3c(ccc4ccccc34)o2)[n-]1 ZINC000617873531 940657522 /nfs/dbraw/zinc/65/75/22/940657522.db2.gz AYKOSYYINAWPSQ-UHFFFAOYSA-N -1 3 363.373 3.667 20 0 FHADHM CCOC(=O)c1nc(NC(=O)Cc2cc3c(ccc4ccccc34)o2)c[n-]1 ZINC000617873531 940657526 /nfs/dbraw/zinc/65/75/26/940657526.db2.gz AYKOSYYINAWPSQ-UHFFFAOYSA-N -1 3 363.373 3.667 20 0 FHADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)c3cccc(F)c3Cl)cc2)n1 ZINC000173826743 940678644 /nfs/dbraw/zinc/67/86/44/940678644.db2.gz PCVIYLWFZYBCCY-UHFFFAOYSA-N -1 3 357.772 3.790 20 0 FHADHM Cc1noc(C2CC2)c1[N-]C(=O)c1nn(C(C)(C)C)cc1Br ZINC000613430998 940702181 /nfs/dbraw/zinc/70/21/81/940702181.db2.gz SSMZYVNXFGAFHL-UHFFFAOYSA-N -1 3 367.247 3.827 20 0 FHADHM Cc1ccc(CC(=O)[N-]O[C@@H](C)C(=O)N[C@H](C)c2ccc(Cl)cc2)cc1 ZINC000178160657 940730459 /nfs/dbraw/zinc/73/04/59/940730459.db2.gz RDFWOGFVMJXUNZ-CABCVRRESA-N -1 3 374.868 3.505 20 0 FHADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)c1cc2c([nH]c1=O)CCCCC2 ZINC000134082277 940739515 /nfs/dbraw/zinc/73/95/15/940739515.db2.gz XHZQJUCOGFACBJ-UHFFFAOYSA-N -1 3 366.339 3.621 20 0 FHADHM CSc1ccc([O-])c(C(=O)N2CCO[C@H](CCc3ccccc3)C2)c1 ZINC000613487722 940765867 /nfs/dbraw/zinc/76/58/67/940765867.db2.gz KPULUNFQABGKIQ-MRXNPFEDSA-N -1 3 357.475 3.588 20 0 FHADHM COC(=O)[C@H](NC(=O)c1cc([O-])c2ccccc2c1)c1cc(C)cc(C)c1 ZINC000472563581 940824371 /nfs/dbraw/zinc/82/43/71/940824371.db2.gz LCBRHWOYQRRNGE-HXUWFJFHSA-N -1 3 363.413 3.806 20 0 FHADHM CC(C)NC(=O)Nc1ccc([N-]S(=O)(=O)c2ccc3c(c2)CCC3)cc1 ZINC000024427650 940826514 /nfs/dbraw/zinc/82/65/14/940826514.db2.gz GIBKIEGLQZYTIR-UHFFFAOYSA-N -1 3 373.478 3.506 20 0 FHADHM Cc1cnc([C@@H](C)[N-]S(=O)(=O)c2cccc(Cl)c2Cl)s1 ZINC000175625637 940896039 /nfs/dbraw/zinc/89/60/39/940896039.db2.gz GFDSBYGPIBORSR-MRVPVSSYSA-N -1 3 351.280 3.798 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@@H]3CC(=O)c4ccccc43)c2)n1 ZINC000376402978 940925122 /nfs/dbraw/zinc/92/51/22/940925122.db2.gz WWTHPAYSBXSFQR-GOSISDBHSA-N -1 3 373.412 3.720 20 0 FHADHM CCCCOc1ccc(C(=O)Nc2cc(C(=O)OCC)n[n-]2)c(Cl)c1 ZINC000186321736 940982539 /nfs/dbraw/zinc/98/25/39/940982539.db2.gz KMLGDQZXLOAVPP-UHFFFAOYSA-N -1 3 365.817 3.671 20 0 FHADHM CCCCOc1ccc(C(=O)Nc2cc(C(=O)OCC)[n-]n2)c(Cl)c1 ZINC000186321736 940982542 /nfs/dbraw/zinc/98/25/42/940982542.db2.gz KMLGDQZXLOAVPP-UHFFFAOYSA-N -1 3 365.817 3.671 20 0 FHADHM Cc1csc([C@H](C)C[N-]S(=O)(=O)c2c(Cl)cccc2Cl)n1 ZINC000186472836 941007378 /nfs/dbraw/zinc/00/73/78/941007378.db2.gz ANKSUAYRVVFODB-MRVPVSSYSA-N -1 3 365.307 3.840 20 0 FHADHM CC(=O)Nc1cc(C(=O)Nc2ccc(Br)cc2[O-])ccc1F ZINC000053500707 941078969 /nfs/dbraw/zinc/07/89/69/941078969.db2.gz REZQQTMXVGVJCB-UHFFFAOYSA-N -1 3 367.174 3.505 20 0 FHADHM Cc1ccc(C(=O)N(Cc2cccc(C)n2)Cc2cccc(C)n2)c([O-])c1 ZINC000177665979 941144653 /nfs/dbraw/zinc/14/46/53/941144653.db2.gz JDIJDVHXAWQNRS-UHFFFAOYSA-N -1 3 361.445 3.950 20 0 FHADHM O=S(=O)([N-][C@H]1CCC(F)(F)C1)c1ccc(Br)cc1Cl ZINC000311703226 941297904 /nfs/dbraw/zinc/29/79/04/941297904.db2.gz MJZQNCIDIZOPTK-QMMMGPOBSA-N -1 3 374.634 3.569 20 0 FHADHM Cc1ccc(C(=O)N2CCO[C@H](c3ccc(C(F)(F)F)cc3)C2)c([O-])c1 ZINC000180715359 941357975 /nfs/dbraw/zinc/35/79/75/941357975.db2.gz 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3.934 20 0 FHADHM C[C@@H](CCCc1cccnc1)[N-]S(=O)(=O)c1cc(F)ccc1Cl ZINC000416531509 942920245 /nfs/dbraw/zinc/92/02/45/942920245.db2.gz FBHFZXVKDFZAOB-LBPRGKRZSA-N -1 3 356.850 3.564 20 0 FHADHM COc1ccc(C(=O)N(C)[C@H]2CCO[C@H](c3ccc(F)cc3)C2)c([O-])c1 ZINC000273351329 942938057 /nfs/dbraw/zinc/93/80/57/942938057.db2.gz YRPCSRPKRWMSQO-KXBFYZLASA-N -1 3 359.397 3.532 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N2CC[C@H](c3ccccc3)C2(C)C)c1 ZINC000422058575 942969208 /nfs/dbraw/zinc/96/92/08/942969208.db2.gz ATPNTZXWTOLWSE-GOSISDBHSA-N -1 3 352.434 3.759 20 0 FHADHM Cc1cc(C(=O)N[N-]C(=O)c2cc(Cl)ccc2Cl)c2ccccc2n1 ZINC000006982929 943089458 /nfs/dbraw/zinc/08/94/58/943089458.db2.gz SCFHRZVUEFMHPH-UHFFFAOYSA-N -1 3 374.227 3.925 20 0 FHADHM O=C(CSc1nnc([N-]c2ccccc2F)s1)Nc1nccs1 ZINC000028417923 943092424 /nfs/dbraw/zinc/09/24/24/943092424.db2.gz NZNSHCAOWPKAAS-UHFFFAOYSA-N -1 3 367.456 3.608 20 0 FHADHM CCN(Cc1cccc(F)c1)C(=O)COC(=O)c1cc(Cl)c(Cl)[n-]1 ZINC000028486064 943119009 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ZINC000436599433 944450455 /nfs/dbraw/zinc/45/04/55/944450455.db2.gz XVPXMEXWMHROPQ-UHFFFAOYSA-N -1 3 357.406 3.549 20 0 FHADHM O=C(NCc1ccc(C(=O)Nc2ccc(F)cc2)cc1)c1ccccc1[O-] ZINC000436590516 944451094 /nfs/dbraw/zinc/45/10/94/944451094.db2.gz ZKAIDVMRLVWZJT-UHFFFAOYSA-N -1 3 364.376 3.714 20 0 FHADHM CCC(=O)c1ccc([O-])c(NC(=O)c2cccc(CN3CCCC3)c2)c1 ZINC000436652685 944483352 /nfs/dbraw/zinc/48/33/52/944483352.db2.gz PUBQYUPATGZZFV-UHFFFAOYSA-N -1 3 352.434 3.833 20 0 FHADHM Cc1nc([C@@H]2CCCCN2C(=O)c2cc(Cl)c3ccccc3c2[O-])n[nH]1 ZINC000436653369 944485020 /nfs/dbraw/zinc/48/50/20/944485020.db2.gz DJZAJCPMVNPXCM-INIZCTEOSA-N -1 3 370.840 3.993 20 0 FHADHM CC(C)c1ccc(C(=O)N2CCO[C@@]3(CCc4ccccc43)C2)c([O-])c1 ZINC000436642028 944490166 /nfs/dbraw/zinc/49/01/66/944490166.db2.gz YXWOIWBXLNYHNY-QFIPXVFZSA-N -1 3 351.446 3.830 20 0 FHADHM O=C(c1cc(=O)c2ccccc2[n-]1)N(Cc1ccco1)CC(F)(F)F ZINC000067184576 944494281 /nfs/dbraw/zinc/49/42/81/944494281.db2.gz YZBIVOKTSNRPFT-UHFFFAOYSA-N -1 3 350.296 3.738 20 0 FHADHM CCCCOc1ccc([C@@H](C)NC(=O)c2c([O-])cccc2O)cc1OC ZINC000436647277 944496111 /nfs/dbraw/zinc/49/61/11/944496111.db2.gz LFHSRMFXAFAULQ-CYBMUJFWSA-N -1 3 359.422 3.776 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N2C[C@@H](C)CC[C@H]2c2ccccc2)c1 ZINC000436661649 944512498 /nfs/dbraw/zinc/51/24/98/944512498.db2.gz ZHVFMXITPFXPAC-LIRRHRJNSA-N -1 3 352.434 3.964 20 0 FHADHM Cn1cc2c(n1)CCC[C@H]2NC(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436679336 944518253 /nfs/dbraw/zinc/51/82/53/944518253.db2.gz GIEJWZCGMNCISE-GOSISDBHSA-N -1 3 363.417 3.725 20 0 FHADHM COC(=O)c1cccc2[n-]c(NC(=O)[C@H](C)SCc3ccccc3)nc21 ZINC000438353017 944541651 /nfs/dbraw/zinc/54/16/51/944541651.db2.gz JDZDZNXDQQRSAO-LBPRGKRZSA-N -1 3 369.446 3.610 20 0 FHADHM COC(=O)c1ccc2c(c1)CN(C(=O)c1ccc(C(C)C)cc1[O-])CC2 ZINC000436704625 944544454 /nfs/dbraw/zinc/54/44/54/944544454.db2.gz HPLVAUWMICZFGG-UHFFFAOYSA-N -1 3 353.418 3.501 20 0 FHADHM O=C(Cc1cncnc1)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000436709868 944546743 /nfs/dbraw/zinc/54/67/43/944546743.db2.gz WXQDGWGALHCBQV-UHFFFAOYSA-N -1 3 362.414 3.640 20 0 FHADHM CCOc1ccccc1[C@H](CC)NC(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000505870676 944557505 /nfs/dbraw/zinc/55/75/05/944557505.db2.gz AFWFTWROTQDTLY-INIZCTEOSA-N -1 3 350.418 3.808 20 0 FHADHM C[C@H]1CCN(c2cc(C(=O)Nc3ccc([O-])c(C(F)(F)F)c3)ccn2)C1 ZINC000436721325 944561251 /nfs/dbraw/zinc/56/12/51/944561251.db2.gz IZTBFCCJUHWVJM-NSHDSACASA-N -1 3 365.355 3.905 20 0 FHADHM O=C(NC1CCN(Cc2ccc(F)cc2)CC1)c1ccc(Cl)cc1[O-] ZINC000436723818 944563154 /nfs/dbraw/zinc/56/31/54/944563154.db2.gz WGZKNIRIHKLHQL-UHFFFAOYSA-N -1 3 362.832 3.579 20 0 FHADHM CCn1c(CCNC(=O)c2ccc(C(C)C)cc2[O-])nc2ccccc21 ZINC000436742815 944571388 /nfs/dbraw/zinc/57/13/88/944571388.db2.gz WXFNWUUCBFAVKU-UHFFFAOYSA-N -1 3 351.450 3.858 20 0 FHADHM CC(C)c1ccc(C(=O)NCc2cccnc2OCC(F)(F)F)c([O-])c1 ZINC000436760584 944583514 /nfs/dbraw/zinc/58/35/14/944583514.db2.gz DBNRWSPMRGMDMO-UHFFFAOYSA-N -1 3 368.355 3.782 20 0 FHADHM O=C(NCC1(c2cccc(C(F)(F)F)c2)CC1)c1ccc(O)cc1[O-] ZINC000436751009 944590141 /nfs/dbraw/zinc/59/01/41/944590141.db2.gz YZIKFUVLIMRHRO-UHFFFAOYSA-N -1 3 351.324 3.578 20 0 FHADHM NC(=O)Nc1cccc(NC(=O)c2cc(Oc3ccccc3)ccc2[O-])c1 ZINC000436754108 944594440 /nfs/dbraw/zinc/59/44/40/944594440.db2.gz HIJIHTRPBYSCNV-UHFFFAOYSA-N -1 3 363.373 3.927 20 0 FHADHM O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)c1ccc(F)cc1[O-] ZINC000436753605 944595061 /nfs/dbraw/zinc/59/50/61/944595061.db2.gz DZMBCZIRFXUNJY-UHFFFAOYSA-N -1 3 362.832 3.579 20 0 FHADHM CC(C)c1ccc(C(=O)N[C@@H](c2nccn2C)c2ccc(F)cc2)c([O-])c1 ZINC000436753867 944595120 /nfs/dbraw/zinc/59/51/20/944595120.db2.gz FPFAWMQEWMBHDH-LJQANCHMSA-N -1 3 367.424 3.908 20 0 FHADHM CC[C@@H](Cc1ccc(Cl)cc1)NC(=O)c1cc(OC)c([O-])c(OC)c1 ZINC000436781011 944611975 /nfs/dbraw/zinc/61/19/75/944611975.db2.gz AKKIHBDYTPTYFK-HNNXBMFYSA-N -1 3 363.841 3.814 20 0 FHADHM CCc1nc(C(=O)Nc2cc(Cl)ccc2[O-])nn1-c1ccccc1F ZINC000436782423 944627107 /nfs/dbraw/zinc/62/71/07/944627107.db2.gz BWLXEGFVXCYDQJ-UHFFFAOYSA-N -1 3 360.776 3.580 20 0 FHADHM CCCN(C(=O)c1cc(NC(C)=O)ccc1[O-])[C@@H](C)c1ccccc1OC ZINC000436785188 944629274 /nfs/dbraw/zinc/62/92/74/944629274.db2.gz DHSRLBINOOTBCR-AWEZNQCLSA-N -1 3 370.449 3.973 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N[C@@H]2c3cccc(F)c3CC[C@@H]2C)c1 ZINC000436785879 944631469 /nfs/dbraw/zinc/63/14/69/944631469.db2.gz HBUHIGTXMVCMIY-WLRWDXFRSA-N -1 3 356.397 3.543 20 0 FHADHM COc1ccc2c(c1)CCC[C@H]2N(C)C(=O)c1cc(NC(C)=O)ccc1[O-] ZINC000436788247 944634930 /nfs/dbraw/zinc/63/49/30/944634930.db2.gz VSRVKEXUWZSHKT-LJQANCHMSA-N -1 3 368.433 3.509 20 0 FHADHM CC[C@@H](C)N(CC(=O)Nc1cccc(C)c1C)C(=O)c1ccccc1[O-] ZINC000436794972 944647051 /nfs/dbraw/zinc/64/70/51/944647051.db2.gz DGYZXRXFUHCNMC-OAHLLOKOSA-N -1 3 354.450 3.888 20 0 FHADHM CCc1ccc(C(=O)NCC2(c3ccc(F)cc3)CCOCC2)c([O-])c1 ZINC000436804317 944660174 /nfs/dbraw/zinc/66/01/74/944660174.db2.gz AEQDDSQTLINAIM-UHFFFAOYSA-N -1 3 357.425 3.572 20 0 FHADHM Cc1ccc([C@@H](C)[N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])s1 ZINC000053689238 944665331 /nfs/dbraw/zinc/66/53/31/944665331.db2.gz VDICTTCMEVQIHB-SECBINFHSA-N -1 3 360.844 3.658 20 0 FHADHM CCc1ccc(C(=O)N[C@@H]2c3ccccc3CC23CCOCC3)c([O-])c1 ZINC000436812385 944669660 /nfs/dbraw/zinc/66/96/60/944669660.db2.gz WXXFHVDJADFDBM-HXUWFJFHSA-N -1 3 351.446 3.779 20 0 FHADHM CCc1ccc(C(=O)N(Cc2ccc(F)cc2)C2CCOCC2)c([O-])c1 ZINC000436813976 944671190 /nfs/dbraw/zinc/67/11/90/944671190.db2.gz JNLRDNXPUUGFRC-UHFFFAOYSA-N -1 3 357.425 3.915 20 0 FHADHM O=C(CCCc1cccc(C(F)(F)F)c1)N=c1cc([C@H]2CCCO2)[n-][nH]1 ZINC000473847095 944672441 /nfs/dbraw/zinc/67/24/41/944672441.db2.gz BFSQENOUNOQAIB-OAHLLOKOSA-N -1 3 367.371 3.663 20 0 FHADHM CCc1ccc(C(=O)Nc2cc(F)ccc2OC[C@H]2CCCO2)c([O-])c1 ZINC000436827646 944673041 /nfs/dbraw/zinc/67/30/41/944673041.db2.gz VDFITFGHQGSJBX-OAHLLOKOSA-N -1 3 359.397 3.904 20 0 FHADHM CN(C(=O)C[C@@H](NC(=O)c1ccc([O-])cc1)c1ccccc1)[C@@H]1CC1(C)C ZINC000436815932 944673197 /nfs/dbraw/zinc/67/31/97/944673197.db2.gz QJFHWNNVYVIYFQ-RTBURBONSA-N -1 3 366.461 3.510 20 0 FHADHM CCc1ccc(C(=O)N[C@@H](C)c2nc(-c3cccc(OC)c3)no2)c([O-])c1 ZINC000436835193 944681285 /nfs/dbraw/zinc/68/12/85/944681285.db2.gz UQFCDWZWYFMJNC-LBPRGKRZSA-N -1 3 367.405 3.504 20 0 FHADHM CCCCc1ccc(C(=O)CCC(=O)N=c2cc([C@H]3CCCO3)[n-][nH]2)cc1 ZINC000473847380 944692155 /nfs/dbraw/zinc/69/21/55/944692155.db2.gz CCGTVVPTESIFEG-LJQANCHMSA-N -1 3 369.465 3.627 20 0 FHADHM CCc1ccc(C(=O)N2CCN([C@H](C)c3cccc(F)c3)CC2)c([O-])c1 ZINC000436823289 944692773 /nfs/dbraw/zinc/69/27/73/944692773.db2.gz ZZLITCOPEQQZHB-OAHLLOKOSA-N -1 3 356.441 3.613 20 0 FHADHM COc1ccc(-c2ccncc2)cc1CNCc1ccccc1CC(=O)[O-] ZINC000426679363 944693681 /nfs/dbraw/zinc/69/36/81/944693681.db2.gz HPEUKXMULUVWQH-UHFFFAOYSA-N -1 3 362.429 3.674 20 0 FHADHM CC(C)[C@H](CC(=O)N(C)c1ccc(-c2nnn[n-]2)cc1F)c1ccccc1 ZINC000735708701 944695089 /nfs/dbraw/zinc/69/50/89/944695089.db2.gz NSEIEVRVOIUTOR-INIZCTEOSA-N -1 3 367.428 3.799 20 0 FHADHM CC(C)[C@H](CC(=O)N(C)c1ccc(-c2nn[n-]n2)cc1F)c1ccccc1 ZINC000735708701 944695091 /nfs/dbraw/zinc/69/50/91/944695091.db2.gz NSEIEVRVOIUTOR-INIZCTEOSA-N -1 3 367.428 3.799 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N[C@H]2CCc3ccc(C(C)C)cc32)c1 ZINC000436839716 944706113 /nfs/dbraw/zinc/70/61/13/944706113.db2.gz VBUOPABRYGDOKP-IBGZPJMESA-N -1 3 352.434 3.891 20 0 FHADHM O=C(c1ccccc1[O-])N1CCN(CCc2ccc3ccccc3c2)CC1 ZINC000436841377 944707532 /nfs/dbraw/zinc/70/75/32/944707532.db2.gz AGQAVELZVZGPFQ-UHFFFAOYSA-N -1 3 360.457 3.546 20 0 FHADHM CN(C(=O)c1cc(CCc2ccccc2)ccc1[O-])[C@@H]1CCCC[C@H]1O ZINC000436841723 944707604 /nfs/dbraw/zinc/70/76/04/944707604.db2.gz ZKUXCHGMCDDEDU-TZIWHRDSSA-N -1 3 353.462 3.553 20 0 FHADHM C[C@H](c1ccc(F)c(Cl)c1)N1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436846486 944714822 /nfs/dbraw/zinc/71/48/22/944714822.db2.gz XQSZPQPSFSXILE-CYBMUJFWSA-N -1 3 362.832 3.704 20 0 FHADHM COc1cccc([C@H]2C[C@@H](C)CN2C(=O)c2cc(OC)c([O-])c(OC)c2)c1 ZINC000436848299 944715020 /nfs/dbraw/zinc/71/50/20/944715020.db2.gz UPWXWFWRNGRWFW-CXAGYDPISA-N -1 3 371.433 3.641 20 0 FHADHM Cc1cccc([C@H](NCc2cc(Cl)c3c(c2)OCCO3)C(=O)[O-])c1C ZINC000426721722 944722520 /nfs/dbraw/zinc/72/25/20/944722520.db2.gz DCXFMXFZNQEYDI-KRWDZBQOSA-N -1 3 361.825 3.644 20 0 FHADHM CCN(CC)[C@H](CNC(=O)c1ccc([O-])cc1F)c1ccccc1Cl ZINC000436859751 944724124 /nfs/dbraw/zinc/72/41/24/944724124.db2.gz CUZQDNBQSYGNBN-GOSISDBHSA-N -1 3 364.848 3.998 20 0 FHADHM O=C([O-])[C@H](CSCCc1ccccc1)NCc1cc(Cl)ccc1F ZINC000426725950 944727615 /nfs/dbraw/zinc/72/76/15/944727615.db2.gz GELRRJUUVKNYSM-KRWDZBQOSA-N -1 3 367.873 3.998 20 0 FHADHM CCc1ccc(-c2nc([C@H](C)CNC(=O)c3ccccc3)no2)c([O-])c1 ZINC000436864145 944728801 /nfs/dbraw/zinc/72/88/01/944728801.db2.gz LGHIGZDPGDJGKF-CYBMUJFWSA-N -1 3 351.406 3.538 20 0 FHADHM C[C@H](NC(=O)[C@@H]1CCCN1C(=O)c1ccccc1[O-])[C@@H](C)C1CCCCC1 ZINC000436868661 944734593 /nfs/dbraw/zinc/73/45/93/944734593.db2.gz HUONPICKSULINZ-GJYPPUQNSA-N -1 3 372.509 3.718 20 0 FHADHM Cc1ccc([C@H](NCc2ccc(F)c(Br)c2)C(=O)[O-])cc1 ZINC000426712967 944736038 /nfs/dbraw/zinc/73/60/38/944736038.db2.gz ZTWUKQSWFVNNPB-HNNXBMFYSA-N -1 3 352.203 3.812 20 0 FHADHM CCOc1ccc(NC(=O)Cc2noc(-c3ccc(CC)cc3[O-])n2)cc1 ZINC000436871396 944738634 /nfs/dbraw/zinc/73/86/34/944738634.db2.gz SIGGFOVZAMJFSS-UHFFFAOYSA-N -1 3 367.405 3.585 20 0 FHADHM CC(C)n1ncc2cc(CN[C@@H](C(=O)[O-])c3cccc(Cl)c3)cnc21 ZINC000426730488 944740479 /nfs/dbraw/zinc/74/04/79/944740479.db2.gz ABEGAUYQABDSAA-MRXNPFEDSA-N -1 3 358.829 3.581 20 0 FHADHM CC(C)c1ccc(C(=O)NCCCC(=O)N2CCc3ccccc32)c([O-])c1 ZINC000436857483 944746546 /nfs/dbraw/zinc/74/65/46/944746546.db2.gz CSDAIAQTKAUBHT-UHFFFAOYSA-N -1 3 366.461 3.615 20 0 FHADHM O=C([O-])C[C@@H](NCc1cccc2cccnc21)c1cnn(-c2ccccc2)c1 ZINC000426736902 944748749 /nfs/dbraw/zinc/74/87/49/944748749.db2.gz ZEPGMSXMXUIZMN-HXUWFJFHSA-N -1 3 372.428 3.726 20 0 FHADHM CCc1ccc(-c2nc(CC(=O)N(CC)c3ccccc3)no2)c([O-])c1 ZINC000436877598 944749580 /nfs/dbraw/zinc/74/95/80/944749580.db2.gz BDVRZHJLDXMYIM-UHFFFAOYSA-N -1 3 351.406 3.600 20 0 FHADHM CCc1ccc(-c2nc(C(C)(C)NC(=O)c3ccccc3)no2)c([O-])c1 ZINC000436879678 944751781 /nfs/dbraw/zinc/75/17/81/944751781.db2.gz HCGGPXCGTWYXBD-UHFFFAOYSA-N -1 3 351.406 3.670 20 0 FHADHM Cc1ccc(OCc2nc(CN[C@@H]3CCC[C@]3(C)C(=O)[O-])cs2)cc1 ZINC000426744438 944758529 /nfs/dbraw/zinc/75/85/29/944758529.db2.gz QXMGGYHTCDUEQS-APWZRJJASA-N -1 3 360.479 3.764 20 0 FHADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1C[C@@H](CO)c2ccccc21 ZINC000436884398 944758853 /nfs/dbraw/zinc/75/88/53/944758853.db2.gz BVHSBSXFQFOWAS-SFHVURJKSA-N -1 3 359.425 3.719 20 0 FHADHM CC1(C)[C@H](NC(=O)c2cc(Cc3ccccc3)ccc2[O-])[C@H]2CCO[C@@H]21 ZINC000436903866 944771760 /nfs/dbraw/zinc/77/17/60/944771760.db2.gz XKQJMPURFPXLPK-AHRSYUTCSA-N -1 3 351.446 3.526 20 0 FHADHM CC(C)(C)OCc1cc(C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)no1 ZINC000436907631 944776035 /nfs/dbraw/zinc/77/60/35/944776035.db2.gz GEIKZTGSDOXRKI-UHFFFAOYSA-N -1 3 358.316 3.966 20 0 FHADHM C[C@@H]1CCC[C@H](C)CN1C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736245126 944776692 /nfs/dbraw/zinc/77/66/92/944776692.db2.gz QTCLZANGJYCYRL-WDEREUQCSA-N -1 3 364.906 3.727 20 0 FHADHM C[C@@H]1CCC[C@H](C)CN1C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736245126 944776695 /nfs/dbraw/zinc/77/66/95/944776695.db2.gz QTCLZANGJYCYRL-WDEREUQCSA-N -1 3 364.906 3.727 20 0 FHADHM O=C([O-])C[C@H](NC/C=C\c1ccc(F)cc1)c1cnn(-c2ccccc2)c1 ZINC000426758481 944780770 /nfs/dbraw/zinc/78/07/70/944780770.db2.gz IGFPXBBGLHSHLA-FBQMEGEOSA-N -1 3 365.408 3.830 20 0 FHADHM COc1cccc(C(=O)Nc2ccc(C)cc2OC[C@@H]2CCCO2)c1[O-] ZINC000436913134 944782495 /nfs/dbraw/zinc/78/24/95/944782495.db2.gz ZCKXNXDJIWYSJM-AWEZNQCLSA-N -1 3 357.406 3.519 20 0 FHADHM COc1ccc([O-])c(-c2nc(-c3ccc(OC(F)F)c(OC)c3)no2)c1 ZINC000436898126 944786742 /nfs/dbraw/zinc/78/67/42/944786742.db2.gz WOVXJXTWDCUKJA-UHFFFAOYSA-N -1 3 364.304 3.728 20 0 FHADHM CC(=O)Nc1ncccc1NC(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436900793 944789921 /nfs/dbraw/zinc/78/99/21/944789921.db2.gz OTDMTNKXHNDNIA-UHFFFAOYSA-N -1 3 363.373 3.790 20 0 FHADHM CC(C)c1nc(C(=O)Nc2nc(-c3ccc([O-])c(Cl)c3)n[nH]2)cs1 ZINC000436915008 944796794 /nfs/dbraw/zinc/79/67/94/944796794.db2.gz MLPCFZZFHPKVDA-UHFFFAOYSA-N -1 3 363.830 3.663 20 0 FHADHM CCc1c(NC(=O)c2c[n-]c3c(C)cccc3c2=O)onc1C(F)(F)F ZINC000505901392 944799477 /nfs/dbraw/zinc/79/94/77/944799477.db2.gz QJVFUTFRYYHJBP-UHFFFAOYSA-N -1 3 365.311 3.658 20 0 FHADHM O=C([O-])[C@H](NCc1cccc(OCc2ccccc2)c1)c1ccc(O)cc1 ZINC000426765677 944802895 /nfs/dbraw/zinc/80/28/95/944802895.db2.gz RDFGXHRAJZAJAY-OAQYLSRUSA-N -1 3 363.413 3.887 20 0 FHADHM CCN(C(=O)CCNC(=O)c1ccc(C)cc1[O-])[C@H](C)c1ccc(F)cc1 ZINC000436951370 944817961 /nfs/dbraw/zinc/81/79/61/944817961.db2.gz RLLDTLIBNAPJQM-OAHLLOKOSA-N -1 3 372.440 3.569 20 0 FHADHM O=C([O-])C[C@H](NCc1ccc(F)cc1)c1cccc(Br)c1 ZINC000426798718 944820894 /nfs/dbraw/zinc/82/08/94/944820894.db2.gz JFCYMNRXZFZEIW-HNNXBMFYSA-N -1 3 352.203 3.894 20 0 FHADHM Cc1cccc(C(=O)Nc2cccc(CN3C[C@@H](C)O[C@@H](C)C3)c2)c1[O-] ZINC000436941872 944827891 /nfs/dbraw/zinc/82/78/91/944827891.db2.gz GOEVDKXAJDRCAQ-IYBDPMFKSA-N -1 3 354.450 3.562 20 0 FHADHM O=C(c1ccccc1[O-])N1CCN(Cc2csc(Cl)c2Cl)CC1 ZINC000436962070 944838052 /nfs/dbraw/zinc/83/80/52/944838052.db2.gz LNPAMHNOYKPVLB-UHFFFAOYSA-N -1 3 371.289 3.719 20 0 FHADHM CCN(C)c1ccc(CSc2nc(C)cc(C)c2-c2nnn[n-]2)cc1 ZINC000736509764 944839099 /nfs/dbraw/zinc/83/90/99/944839099.db2.gz LLXDUFBXZAZCJW-UHFFFAOYSA-N -1 3 354.483 3.627 20 0 FHADHM CCN(C)c1ccc(CSc2nc(C)cc(C)c2-c2nn[n-]n2)cc1 ZINC000736509764 944839106 /nfs/dbraw/zinc/83/91/06/944839106.db2.gz LLXDUFBXZAZCJW-UHFFFAOYSA-N -1 3 354.483 3.627 20 0 FHADHM COc1ccc([C@@H](NCc2cccc(-c3ccccn3)c2)C(=O)[O-])cc1F ZINC000426822035 944844410 /nfs/dbraw/zinc/84/44/10/944844410.db2.gz ZFCIPQUWWQBGAH-HXUWFJFHSA-N -1 3 366.392 3.812 20 0 FHADHM CS(=O)(=O)[N-]c1ccccc1NC(=O)c1cc2sccc2s1 ZINC000516435312 944845180 /nfs/dbraw/zinc/84/51/80/944845180.db2.gz SWJKUKQWTWNYIR-UHFFFAOYSA-N -1 3 352.462 3.587 20 0 FHADHM COc1ccc([C@@H](NCc2cccc(-c3cccnc3)c2)C(=O)[O-])cc1F ZINC000426826601 944851313 /nfs/dbraw/zinc/85/13/13/944851313.db2.gz TWMCKJZHTICGDH-HXUWFJFHSA-N -1 3 366.392 3.812 20 0 FHADHM O=C(Nc1ccccc1O[C@H]1CCOC1)c1ccc2c(c1[O-])CCCC2 ZINC000436975325 944862621 /nfs/dbraw/zinc/86/26/21/944862621.db2.gz JLOCJLWXQSPLMC-HNNXBMFYSA-N -1 3 353.418 3.691 20 0 FHADHM CCC(CC)(CC)CNC(=O)c1cc(NC(=O)c2cnoc2C)ccc1[O-] ZINC000436977819 944868267 /nfs/dbraw/zinc/86/82/67/944868267.db2.gz SVRTZTVJCREPMR-UHFFFAOYSA-N -1 3 373.453 3.887 20 0 FHADHM COc1ccc([C@H](NCc2cc3c(cc(C)cc3C)[nH]2)C(=O)[O-])cc1F ZINC000426831578 944870328 /nfs/dbraw/zinc/87/03/28/944870328.db2.gz FKDAVNMCOBTJBU-IBGZPJMESA-N -1 3 356.397 3.848 20 0 FHADHM CCCCOc1ccc(C(=O)N2CCN(c3ccccc3)CC2)c([O-])c1 ZINC000436981946 944872532 /nfs/dbraw/zinc/87/25/32/944872532.db2.gz WCGRMKWTVBKQRO-UHFFFAOYSA-N -1 3 354.450 3.534 20 0 FHADHM O=c1[nH]c2ccccc2n1C1CCN(Cc2c(F)ccc([O-])c2F)CC1 ZINC000507033556 944880344 /nfs/dbraw/zinc/88/03/44/944880344.db2.gz CIKBQTUJCUODFS-UHFFFAOYSA-N -1 3 359.376 3.563 20 0 FHADHM O=C([O-])[C@H]1Cc2ccccc2CN1Cc1cccc(OC(F)(F)F)c1 ZINC000140701808 944880411 /nfs/dbraw/zinc/88/04/11/944880411.db2.gz UKPMBYALGFGQKA-MRXNPFEDSA-N -1 3 351.324 3.597 20 0 FHADHM CN(Cc1ccc(-c2nnn[n-]2)cc1F)c1cccc(OC(F)(F)F)c1 ZINC000736817186 944895411 /nfs/dbraw/zinc/89/54/11/944895411.db2.gz UHQJJNJPAAQNON-UHFFFAOYSA-N -1 3 367.306 3.541 20 0 FHADHM CN(Cc1ccc(-c2nn[n-]n2)cc1F)c1cccc(OC(F)(F)F)c1 ZINC000736817186 944895421 /nfs/dbraw/zinc/89/54/21/944895421.db2.gz UHQJJNJPAAQNON-UHFFFAOYSA-N -1 3 367.306 3.541 20 0 FHADHM C[C@@H]1CN(C(=O)c2cc(Cc3ccccc3)ccc2[O-])C[C@@H](C2CC2)O1 ZINC000437002596 944900651 /nfs/dbraw/zinc/90/06/51/944900651.db2.gz TYLFUKHNGCHUPI-VFNWGFHPSA-N -1 3 351.446 3.623 20 0 FHADHM CCCOc1ccc(-c2noc(-c3cccc(OC)c3[O-])n2)cc1OC ZINC000437005443 944902388 /nfs/dbraw/zinc/90/23/88/944902388.db2.gz YFSXAORFFJTCTH-UHFFFAOYSA-N -1 3 356.378 3.915 20 0 FHADHM CC(C)c1ccc(-c2nc(-c3cccc(NS(C)(=O)=O)c3)no2)c([O-])c1 ZINC000436999263 944914609 /nfs/dbraw/zinc/91/46/09/944914609.db2.gz QPSCRDPDJOCRTJ-UHFFFAOYSA-N -1 3 373.434 3.604 20 0 FHADHM Cc1c([O-])ccc2c(CN3C[C@H](c4ccccc4)OC[C@@H]3C)cc(=O)oc12 ZINC000066852716 944916277 /nfs/dbraw/zinc/91/62/77/944916277.db2.gz YIHDMCDPNYVAIQ-VBKZILBWSA-N -1 3 365.429 3.769 20 0 FHADHM COc1cc(C)c([N-]S(=O)(=O)c2ccc3c(c2)CCCO3)c(C)c1C ZINC000517995756 944916630 /nfs/dbraw/zinc/91/66/30/944916630.db2.gz BEVXCDVYFKXDLR-UHFFFAOYSA-N -1 3 361.463 3.746 20 0 FHADHM COC(=O)[C@@H](C)N(C(=O)c1cc(Cc2ccccc2)ccc1[O-])C1CCC1 ZINC000437001198 944918112 /nfs/dbraw/zinc/91/81/12/944918112.db2.gz KCMOOFYBYSTACG-OAHLLOKOSA-N -1 3 367.445 3.539 20 0 FHADHM CC1(C)C[C@H](O)CCN(C(=O)c2cc(Cc3ccccc3)ccc2[O-])C1 ZINC000518917599 944937267 /nfs/dbraw/zinc/93/72/67/944937267.db2.gz VYPBUMPLDFRNRV-GOSISDBHSA-N -1 3 353.462 3.606 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@H]3CCCCCC(=O)C3)c2)n1 ZINC000518038743 944943416 /nfs/dbraw/zinc/94/34/16/944943416.db2.gz WKXBIFVQEQXWTK-HNNXBMFYSA-N -1 3 367.449 3.890 20 0 FHADHM COc1ccc([C@H]2CCCN2c2c(-c3nnn[n-]3)cnc3ccccc32)cc1 ZINC000737073861 944944766 /nfs/dbraw/zinc/94/47/66/944944766.db2.gz COVHOAKUPOGBNV-LJQANCHMSA-N -1 3 372.432 3.765 20 0 FHADHM COc1ccc([C@H]2CCCN2c2c(-c3nn[n-]n3)cnc3ccccc32)cc1 ZINC000737073861 944944772 /nfs/dbraw/zinc/94/47/72/944944772.db2.gz COVHOAKUPOGBNV-LJQANCHMSA-N -1 3 372.432 3.765 20 0 FHADHM CC(=O)c1ccc(C(=O)N(C)C[C@H]2CCCO[C@H]2c2ccccc2)cc1[O-] ZINC000664608281 945008371 /nfs/dbraw/zinc/00/83/71/945008371.db2.gz YSCFUKMGQNNJGB-NQIIRXRSSA-N -1 3 367.445 3.835 20 0 FHADHM COc1ccccc1[C@H](CC(C)C)NC(=O)c1cc(=O)[n-]c(C2CC2)n1 ZINC000518997065 945012066 /nfs/dbraw/zinc/01/20/66/945012066.db2.gz LVKRYXSRNRKLHR-HNNXBMFYSA-N -1 3 355.438 3.585 20 0 FHADHM O=C(CCCC(=O)c1ccc(Br)cc1)Nc1ncccc1[O-] ZINC000438791114 945018724 /nfs/dbraw/zinc/01/87/24/945018724.db2.gz MLIHGQHNKNZDTM-UHFFFAOYSA-N -1 3 363.211 3.541 20 0 FHADHM COc1cccc(C(=O)Nc2cnn(-c3cc(C)ccc3C)c2C)c1[O-] ZINC000437084714 945021621 /nfs/dbraw/zinc/02/16/21/945021621.db2.gz XOKLJRWDGHQQME-UHFFFAOYSA-N -1 3 351.406 3.764 20 0 FHADHM Cc1ccc(Cl)cc1NC(=O)[C@@H](C)Sc1ccccc1-c1nnn[n-]1 ZINC000737343364 945045096 /nfs/dbraw/zinc/04/50/96/945045096.db2.gz NYRIQLUYNKLXDT-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM Cc1ccc(Cl)cc1NC(=O)[C@@H](C)Sc1ccccc1-c1nn[n-]n1 ZINC000737343364 945045104 /nfs/dbraw/zinc/04/51/04/945045104.db2.gz NYRIQLUYNKLXDT-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM Cc1ccc(F)c(C(=O)NCc2ccc([O-])c(F)c2)c1Br ZINC000427063180 945050437 /nfs/dbraw/zinc/05/04/37/945050437.db2.gz WEHNEJTXROHCFF-UHFFFAOYSA-N -1 3 356.166 3.671 20 0 FHADHM CC(C)Oc1ccccc1[C@@H](C)NC(=O)c1c[n-]c2ccccc2c1=O ZINC000516594216 945056005 /nfs/dbraw/zinc/05/60/05/945056005.db2.gz RQUWUJUFNDNHAI-CQSZACIVSA-N -1 3 350.418 3.806 20 0 FHADHM C[C@]12CC3CC(C(=O)Nc4ccc(Cc5nnn[n-]5)cc4)(C1)C[C@@](C)(C3)C2 ZINC000427078312 945061761 /nfs/dbraw/zinc/06/17/61/945061761.db2.gz DCPUREUQFAIYNG-LVBDODCMSA-N -1 3 365.481 3.726 20 0 FHADHM C[C@]12CC3CC(C(=O)Nc4ccc(Cc5nn[n-]n5)cc4)(C1)C[C@@](C)(C3)C2 ZINC000427078312 945061769 /nfs/dbraw/zinc/06/17/69/945061769.db2.gz DCPUREUQFAIYNG-LVBDODCMSA-N -1 3 365.481 3.726 20 0 FHADHM Cc1cc(S(=O)(=O)[N-]c2ccccc2Br)c(F)cc1F ZINC000440296901 945385776 /nfs/dbraw/zinc/38/57/76/945385776.db2.gz ZIOUBPUGIZCDAC-UHFFFAOYSA-N -1 3 362.195 3.837 20 0 FHADHM CCCCCn1cc(C(=O)NCc2cnc(C)[n-]c2=O)c2ccccc21 ZINC000519471669 945449098 /nfs/dbraw/zinc/44/90/98/945449098.db2.gz RAQIUIZOBXPZMT-UHFFFAOYSA-N -1 3 352.438 3.566 20 0 FHADHM Cc1cc(=O)[n-]c(C(C)(C)NCc2ncc(-c3cccc(Cl)c3)o2)n1 ZINC000660748194 945453922 /nfs/dbraw/zinc/45/39/22/945453922.db2.gz VZIVJXRJJNUDNK-UHFFFAOYSA-N -1 3 358.829 3.824 20 0 FHADHM Cc1cc(=O)[n-]c(C(C)(C)NCc2csc(Cc3ccccc3)n2)n1 ZINC000660747996 945455421 /nfs/dbraw/zinc/45/54/21/945455421.db2.gz XEGCKCCSWJYKRJ-UHFFFAOYSA-N -1 3 354.479 3.563 20 0 FHADHM Cc1cc(=O)[n-]c(C(C)(C)NCc2ccc(Br)cc2C)n1 ZINC000660751929 945466594 /nfs/dbraw/zinc/46/65/94/945466594.db2.gz PWJHHFWAWGJISK-UHFFFAOYSA-N -1 3 350.260 3.586 20 0 FHADHM CCc1cccc(Cl)c1CNC[C@@H](Oc1ccc(F)cc1)C(=O)[O-] ZINC000426645974 945466819 /nfs/dbraw/zinc/46/68/19/945466819.db2.gz JLEVUJJHSZNAIE-QGZVFWFLSA-N -1 3 351.805 3.663 20 0 FHADHM O=C([O-])[C@@H](CNCc1ccc(-c2ccccc2)o1)Oc1ccc(F)cc1 ZINC000426652619 945486176 /nfs/dbraw/zinc/48/61/76/945486176.db2.gz VTYBMHHQFHFMLQ-LJQANCHMSA-N -1 3 355.365 3.708 20 0 FHADHM Cc1ccc(-c2nc(CN[C@@H](Cc3ccc(O)cc3)C(=O)[O-])cs2)cc1 ZINC000426653528 945488501 /nfs/dbraw/zinc/48/85/01/945488501.db2.gz CPVADZWEHCVILO-SFHVURJKSA-N -1 3 368.458 3.610 20 0 FHADHM C[C@H]1CCN(C(=O)Nc2cccc(-c3nnn[n-]3)c2)[C@H]1c1cccc(F)c1 ZINC000820717210 945535911 /nfs/dbraw/zinc/53/59/11/945535911.db2.gz OWZKQVILSGUFIL-YVEFUNNKSA-N -1 3 366.400 3.621 20 0 FHADHM C[C@H]1CCN(C(=O)Nc2cccc(-c3nn[n-]n3)c2)[C@H]1c1cccc(F)c1 ZINC000820717210 945535922 /nfs/dbraw/zinc/53/59/22/945535922.db2.gz OWZKQVILSGUFIL-YVEFUNNKSA-N -1 3 366.400 3.621 20 0 FHADHM Cc1ccc(Cc2nnc([N-]C(=O)c3nncc4ccccc43)s2)cc1 ZINC001126000072 945550552 /nfs/dbraw/zinc/55/05/52/945550552.db2.gz GVAGZDLTJUEGJR-UHFFFAOYSA-N -1 3 361.430 3.633 20 0 FHADHM CCC(C)(C)NC(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000820848519 945570655 /nfs/dbraw/zinc/57/06/55/945570655.db2.gz YAVXYCCGYWEBIR-UHFFFAOYSA-N -1 3 366.425 3.969 20 0 FHADHM CCC(C)(C)NC(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000820848519 945570656 /nfs/dbraw/zinc/57/06/56/945570656.db2.gz YAVXYCCGYWEBIR-UHFFFAOYSA-N -1 3 366.425 3.969 20 0 FHADHM O=C(NCc1ncccc1[O-])c1cc(Br)cc2ccccc21 ZINC000473633447 945634427 /nfs/dbraw/zinc/63/44/27/945634427.db2.gz IOLMWTBKFRPBSZ-UHFFFAOYSA-N -1 3 357.207 3.633 20 0 FHADHM O=C(NCc1ncccc1[O-])c1csc(-c2cccc3ccccc32)n1 ZINC000473637568 945659679 /nfs/dbraw/zinc/65/96/79/945659679.db2.gz WBZYBAMJPMEYPB-UHFFFAOYSA-N -1 3 361.426 3.994 20 0 FHADHM Cc1ccc(Oc2ccc(OCC(=O)NCc3ncccc3[O-])cc2)cc1 ZINC000473642021 945665229 /nfs/dbraw/zinc/66/52/29/945665229.db2.gz XTCVFTDLTGXAOH-UHFFFAOYSA-N -1 3 364.401 3.583 20 0 FHADHM Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)NCc1ncccc1[O-] ZINC000473639831 945667220 /nfs/dbraw/zinc/66/72/20/945667220.db2.gz PYGHLAWHSZGHGQ-UHFFFAOYSA-N -1 3 359.838 3.803 20 0 FHADHM O=C(NCc1ncccc1[O-])c1ccc2cc(Br)ccc2c1 ZINC000473639854 945667421 /nfs/dbraw/zinc/66/74/21/945667421.db2.gz JOVJMOFJCLVRBJ-UHFFFAOYSA-N -1 3 357.207 3.633 20 0 FHADHM Cc1noc(C)c1CSc1ccccc1C(=O)NCc1ncccc1[O-] ZINC000473642937 945685852 /nfs/dbraw/zinc/68/58/52/945685852.db2.gz MWSFONZZTAUNPB-UHFFFAOYSA-N -1 3 369.446 3.614 20 0 FHADHM CCSc1ccc(Cl)cc1[N-]C(=O)c1ccc(C(N)=O)c(Cl)n1 ZINC001126027763 945699115 /nfs/dbraw/zinc/69/91/15/945699115.db2.gz GRFHYXPWZPOYOF-UHFFFAOYSA-N -1 3 370.261 3.852 20 0 FHADHM CCc1c(C)sc(NC(=O)C/C=C/c2ccc(F)cc2)c1-c1nnn[n-]1 ZINC000821466393 945702498 /nfs/dbraw/zinc/70/24/98/945702498.db2.gz WDZDLFBPYGGYGS-SNAWJCMRSA-N -1 3 371.441 3.980 20 0 FHADHM CCc1c(C)sc(NC(=O)C/C=C/c2ccc(F)cc2)c1-c1nn[n-]n1 ZINC000821466393 945702502 /nfs/dbraw/zinc/70/25/02/945702502.db2.gz WDZDLFBPYGGYGS-SNAWJCMRSA-N -1 3 371.441 3.980 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)C/C=C\c2ccc(F)cc2)s1 ZINC000821466500 945703369 /nfs/dbraw/zinc/70/33/69/945703369.db2.gz YFXWIDFDNLWFQN-ARJAWSKDSA-N -1 3 357.414 3.672 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)C/C=C\c2ccc(F)cc2)s1 ZINC000821466500 945703377 /nfs/dbraw/zinc/70/33/77/945703377.db2.gz YFXWIDFDNLWFQN-ARJAWSKDSA-N -1 3 357.414 3.672 20 0 FHADHM CC(C)(c1ccccc1)C1([N-]S(=O)(=O)c2cc(F)c(F)c(F)c2)CC1 ZINC001211850437 945719635 /nfs/dbraw/zinc/71/96/35/945719635.db2.gz SRCSFCAFCZDPSO-UHFFFAOYSA-N -1 3 369.408 3.893 20 0 FHADHM O=S(=O)([N-]c1cccc(CN2CCCCC2)c1)c1cc(F)cc(F)c1 ZINC000444059815 945761710 /nfs/dbraw/zinc/76/17/10/945761710.db2.gz WOSXIIYTLPUSGT-UHFFFAOYSA-N -1 3 366.433 3.752 20 0 FHADHM CSc1ccc([O-])c(C(=O)N2CCN[C@H](c3ccccc3Cl)C2)c1 ZINC000614522120 945810695 /nfs/dbraw/zinc/81/06/95/945810695.db2.gz DVWSLGAOAFYRBZ-INIZCTEOSA-N -1 3 362.882 3.554 20 0 FHADHM CSc1ccc([O-])c(C(=O)N2CCN[C@@H](c3ccccc3Cl)C2)c1 ZINC000614522121 945811067 /nfs/dbraw/zinc/81/10/67/945811067.db2.gz DVWSLGAOAFYRBZ-MRXNPFEDSA-N -1 3 362.882 3.554 20 0 FHADHM CC[C@@H](F)CN(C)Cc1cccc([N-]S(=O)(=O)c2ccccc2)c1 ZINC000440701150 945816352 /nfs/dbraw/zinc/81/63/52/945816352.db2.gz JFDMCJFOXYQENW-MRXNPFEDSA-N -1 3 350.459 3.667 20 0 FHADHM C[C@H](Cc1ccsc1)[N-]S(=O)(=O)c1cc(Cl)ccc1Cl ZINC000048840970 945820384 /nfs/dbraw/zinc/82/03/84/945820384.db2.gz SPPDODDDPXWAAC-SECBINFHSA-N -1 3 350.292 3.964 20 0 FHADHM C[C@@H](Cc1ccsc1)[N-]S(=O)(=O)c1cccc(Cl)c1Cl ZINC000048841015 945821352 /nfs/dbraw/zinc/82/13/52/945821352.db2.gz BNWBSINICBZKMB-VIFPVBQESA-N -1 3 350.292 3.964 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)CCc3ccc(F)cc3)c2)n1 ZINC000049302062 945824388 /nfs/dbraw/zinc/82/43/88/945824388.db2.gz QYXIJZFWRMRZPS-UHFFFAOYSA-N -1 3 365.408 3.710 20 0 FHADHM CC[C@H]([N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1F)c1nccs1 ZINC000444082694 945828598 /nfs/dbraw/zinc/82/85/98/945828598.db2.gz ITMYUWMVJBBOCS-JTQLQIEISA-N -1 3 368.377 3.731 20 0 FHADHM COCc1ccc(SCc2cn3ccccc3c2-c2nnn[n-]2)cc1 ZINC000821696000 945829915 /nfs/dbraw/zinc/82/99/15/945829915.db2.gz RAJXESWWQODKNI-UHFFFAOYSA-N -1 3 351.435 3.558 20 0 FHADHM COCc1ccc(SCc2cn3ccccc3c2-c2nn[n-]n2)cc1 ZINC000821696000 945829926 /nfs/dbraw/zinc/82/99/26/945829926.db2.gz RAJXESWWQODKNI-UHFFFAOYSA-N -1 3 351.435 3.558 20 0 FHADHM COC(C)(C)C[C@H](C)Oc1cccc([O-])c1I ZINC001227377399 945852196 /nfs/dbraw/zinc/85/21/96/945852196.db2.gz DRPBEGUIHGBXSH-VIFPVBQESA-N -1 3 350.196 3.579 20 0 FHADHM COc1ccc(-c2csc(CNc3ncccc3-c3nnn[n-]3)c2)cc1 ZINC000821731860 945852394 /nfs/dbraw/zinc/85/23/94/945852394.db2.gz HQULBNUIKGKGEJ-UHFFFAOYSA-N -1 3 364.434 3.611 20 0 FHADHM COc1ccc(-c2csc(CNc3ncccc3-c3nn[n-]n3)c2)cc1 ZINC000821731860 945852405 /nfs/dbraw/zinc/85/24/05/945852405.db2.gz HQULBNUIKGKGEJ-UHFFFAOYSA-N -1 3 364.434 3.611 20 0 FHADHM CSc1ccc(NC(=O)Nc2ccc3c(c2)C(=O)[N-]C3=O)cc1Cl ZINC000475055750 945967820 /nfs/dbraw/zinc/96/78/20/945967820.db2.gz ZTAJMXGFUKVUBE-UHFFFAOYSA-N -1 3 361.810 3.590 20 0 FHADHM Cc1ccc(Cl)c2ccc(NCCNC(=O)c3ccc([O-])cc3)nc12 ZINC000301979156 946063445 /nfs/dbraw/zinc/06/34/45/946063445.db2.gz FQGYLESBGRAPEI-UHFFFAOYSA-N -1 3 355.825 3.744 20 0 FHADHM C[C@@H](C(=O)Nc1ccc([O-])c(C(F)(F)F)c1)N1CCc2ccccc2C1 ZINC000440974412 946086175 /nfs/dbraw/zinc/08/61/75/946086175.db2.gz BMXGYWASCFQYPA-LBPRGKRZSA-N -1 3 364.367 3.796 20 0 FHADHM CCOC(=O)c1c(C)[nH]c(C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)c1C ZINC000441015426 946117603 /nfs/dbraw/zinc/11/76/03/946117603.db2.gz YSKOLLPCBYUCIK-UHFFFAOYSA-N -1 3 370.327 3.785 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@@H](C)c3ncc(C)s3)nc2)n1 ZINC000302124531 946132943 /nfs/dbraw/zinc/13/29/43/946132943.db2.gz HUOPBPWMCSCFGF-LLVKDONJSA-N -1 3 355.467 3.787 20 0 FHADHM C[C@@H]1[C@@H](C)CCCN1C(=O)c1c[n-]c2ccc(Br)cc2c1=O ZINC000444257416 946139699 /nfs/dbraw/zinc/13/96/99/946139699.db2.gz PKQQNFYFPULUHB-WDEREUQCSA-N -1 3 363.255 3.551 20 0 FHADHM C[C@H]1COC2(CCC2)CN1Cc1nc(=O)c2c(-c3ccco3)csc2[n-]1 ZINC000661464449 946153273 /nfs/dbraw/zinc/15/32/73/946153273.db2.gz FEHLORFUXHOGJZ-LBPRGKRZSA-N -1 3 371.462 3.800 20 0 FHADHM Fc1ccc(Br)c(NCc2cc(-c3nnn[n-]3)ccc2F)c1 ZINC000822761734 946170123 /nfs/dbraw/zinc/17/01/23/946170123.db2.gz RSYFJHLXRXJSMB-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1ccc(Br)c(NCc2cc(-c3nn[n-]n3)ccc2F)c1 ZINC000822761734 946170129 /nfs/dbraw/zinc/17/01/29/946170129.db2.gz RSYFJHLXRXJSMB-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM CC[C@]1(C)CCN(C(=O)c2c[n-]c3ccc(Br)cc3c2=O)C1 ZINC000444313684 946209056 /nfs/dbraw/zinc/20/90/56/946209056.db2.gz VREHTWDTHHKHBL-QGZVFWFLSA-N -1 3 363.255 3.553 20 0 FHADHM Cc1cccc(CN(CC(C)C)C(=O)Nc2ccc3c(c2)C(=O)[N-]C3=O)c1 ZINC000520153532 946219079 /nfs/dbraw/zinc/21/90/79/946219079.db2.gz MBYIBHKWMQBGPS-UHFFFAOYSA-N -1 3 365.433 3.569 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NCc3ccc(C(C)(C)O)cc3)nc2)n1 ZINC000302408937 946220162 /nfs/dbraw/zinc/22/01/62/946220162.db2.gz MHSGLUARXZWIME-UHFFFAOYSA-N -1 3 364.449 3.646 20 0 FHADHM Cc1oc(-c2ccccc2)nc1C(=O)[N-]c1n[nH]c(-c2ccccc2F)n1 ZINC000520272878 946329478 /nfs/dbraw/zinc/32/94/78/946329478.db2.gz NYPZVIKSWGTRGW-UHFFFAOYSA-N -1 3 363.352 3.827 20 0 FHADHM O=C(Nc1ccc(CNc2ccccc2)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000823323245 946410199 /nfs/dbraw/zinc/41/01/99/946410199.db2.gz HVSACSSMESSHBN-UHFFFAOYSA-N -1 3 370.416 3.731 20 0 FHADHM O=C(Nc1ccc(CNc2ccccc2)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000823323245 946410210 /nfs/dbraw/zinc/41/02/10/946410210.db2.gz HVSACSSMESSHBN-UHFFFAOYSA-N -1 3 370.416 3.731 20 0 FHADHM CC(C)c1nnc([N-]C(=O)c2cc(F)c(F)cc2Br)s1 ZINC000441318666 946430718 /nfs/dbraw/zinc/43/07/18/946430718.db2.gz QXKNZXJYWBURAM-UHFFFAOYSA-N -1 3 362.199 3.955 20 0 FHADHM c1ccc2c(c1)cccc2NCc1nnc(-c2ccc(-c3nnn[n-]3)cc2)o1 ZINC000823796998 946482365 /nfs/dbraw/zinc/48/23/65/946482365.db2.gz KMIVGDLCDKWDMX-UHFFFAOYSA-N -1 3 369.388 3.682 20 0 FHADHM c1ccc2c(c1)cccc2NCc1nnc(-c2ccc(-c3nn[n-]n3)cc2)o1 ZINC000823796998 946482367 /nfs/dbraw/zinc/48/23/67/946482367.db2.gz KMIVGDLCDKWDMX-UHFFFAOYSA-N -1 3 369.388 3.682 20 0 FHADHM CC(=O)c1ccc(-c2nnn[n-]2)c(NCc2cccc(C(F)(F)F)c2)c1 ZINC000824015177 946553251 /nfs/dbraw/zinc/55/32/51/946553251.db2.gz ROJFIDXTCWEKOX-UHFFFAOYSA-N -1 3 361.327 3.700 20 0 FHADHM CC(=O)c1ccc(-c2nn[n-]n2)c(NCc2cccc(C(F)(F)F)c2)c1 ZINC000824015177 946553261 /nfs/dbraw/zinc/55/32/61/946553261.db2.gz ROJFIDXTCWEKOX-UHFFFAOYSA-N -1 3 361.327 3.700 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1c(F)cccc1F ZINC000824046665 946566235 /nfs/dbraw/zinc/56/62/35/946566235.db2.gz UVNUEXWHCGYYHJ-MRVPVSSYSA-N -1 3 363.755 3.541 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1c(F)cccc1F ZINC000824046665 946566247 /nfs/dbraw/zinc/56/62/47/946566247.db2.gz UVNUEXWHCGYYHJ-MRVPVSSYSA-N -1 3 363.755 3.541 20 0 FHADHM CNC(=O)c1cccc([N-]S(=O)(=O)c2c(C)cc(C(C)(C)C)cc2C)c1 ZINC000024102389 946569752 /nfs/dbraw/zinc/56/97/52/946569752.db2.gz JUYBTAUSPPVBDS-UHFFFAOYSA-N -1 3 374.506 3.761 20 0 FHADHM CC(C)(C)Sc1cc(C(=O)OCc2ccc(-c3nnn[n-]3)cc2)ccn1 ZINC000824124204 946600273 /nfs/dbraw/zinc/60/02/73/946600273.db2.gz QIKZBYOTWFYBMA-UHFFFAOYSA-N -1 3 369.450 3.509 20 0 FHADHM CC(C)(C)Sc1cc(C(=O)OCc2ccc(-c3nn[n-]n3)cc2)ccn1 ZINC000824124204 946600282 /nfs/dbraw/zinc/60/02/82/946600282.db2.gz QIKZBYOTWFYBMA-UHFFFAOYSA-N -1 3 369.450 3.509 20 0 FHADHM CC(C)COC[C@@H](N[C@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccco1 ZINC000824266459 946638649 /nfs/dbraw/zinc/63/86/49/946638649.db2.gz MBZIJYIGUODYOG-RHSMWYFYSA-N -1 3 355.442 3.524 20 0 FHADHM CC(C)COC[C@H](N[C@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccco1 ZINC000824266457 946639213 /nfs/dbraw/zinc/63/92/13/946639213.db2.gz MBZIJYIGUODYOG-PBHICJAKSA-N -1 3 355.442 3.524 20 0 FHADHM CC(C)Cn1ncc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1C(F)F ZINC000824285144 946644414 /nfs/dbraw/zinc/64/44/14/946644414.db2.gz YVCOVZZNCKHFOW-NSHDSACASA-N -1 3 361.400 3.830 20 0 FHADHM CC(C)Cn1ncc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1C(F)F ZINC000824285144 946644425 /nfs/dbraw/zinc/64/44/25/946644425.db2.gz YVCOVZZNCKHFOW-NSHDSACASA-N -1 3 361.400 3.830 20 0 FHADHM CC(C)N(Cc1nc2c(s1)CCCC2)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000824293433 946647177 /nfs/dbraw/zinc/64/71/77/946647177.db2.gz LPIMMOJABMHPFQ-UHFFFAOYSA-N -1 3 368.510 3.613 20 0 FHADHM CC(C)c1ccc([C@H]2CCCCN2C(=O)c2cc(-c3nnn[n-]3)c[nH]2)cc1 ZINC000824347984 946665117 /nfs/dbraw/zinc/66/51/17/946665117.db2.gz VPDCHNNHLWUTCW-GOSISDBHSA-N -1 3 364.453 3.686 20 0 FHADHM CC(C)c1ccc([C@H]2CCCCN2C(=O)c2cc(-c3nn[n-]n3)c[nH]2)cc1 ZINC000824347984 946665122 /nfs/dbraw/zinc/66/51/22/946665122.db2.gz VPDCHNNHLWUTCW-GOSISDBHSA-N -1 3 364.453 3.686 20 0 FHADHM Brc1ccc(OCCCc2ccsc2)cc1-c1nnn[n-]1 ZINC001573280734 946668594 /nfs/dbraw/zinc/66/85/94/946668594.db2.gz ZNNXWNOCIPJDLL-UHFFFAOYSA-N -1 3 365.256 3.702 20 0 FHADHM Brc1ccc(OCCCc2ccsc2)cc1-c1nn[n-]n1 ZINC001573280734 946668600 /nfs/dbraw/zinc/66/86/00/946668600.db2.gz ZNNXWNOCIPJDLL-UHFFFAOYSA-N -1 3 365.256 3.702 20 0 FHADHM Cc1c([O-])ccc2c(CN(Cc3ccco3)C[C@H]3CCCO3)cc(=O)oc12 ZINC000108969877 946691031 /nfs/dbraw/zinc/69/10/31/946691031.db2.gz RGGDJYWXRRCWAH-QGZVFWFLSA-N -1 3 369.417 3.581 20 0 FHADHM COc1cc(Br)ccc1[C@@H](C)N[C@H](C)c1nc(C)cc(=O)[n-]1 ZINC000192808862 946698042 /nfs/dbraw/zinc/69/80/42/946698042.db2.gz IIHJEGGWDADVMU-GHMZBOCLSA-N -1 3 366.259 3.674 20 0 FHADHM C[C@H](NC(=O)[C@@H]1CC12CCC2)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824471768 946724638 /nfs/dbraw/zinc/72/46/38/946724638.db2.gz SIBQEXFWIJUNFZ-LIRRHRJNSA-N -1 3 373.460 3.901 20 0 FHADHM C[C@H](NC(=O)[C@@H]1CC12CCC2)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824471768 946724647 /nfs/dbraw/zinc/72/46/47/946724647.db2.gz SIBQEXFWIJUNFZ-LIRRHRJNSA-N -1 3 373.460 3.901 20 0 FHADHM CC[C@H]([N-]S(=O)(=O)c1ccccc1C(F)(F)F)c1nc(C)cs1 ZINC000104759368 946755167 /nfs/dbraw/zinc/75/51/67/946755167.db2.gz PHIVYSUGISLCFN-NSHDSACASA-N -1 3 364.414 3.900 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NCc3nc(C(C)(C)C)co3)nc2)n1 ZINC000897175433 946830589 /nfs/dbraw/zinc/83/05/89/946830589.db2.gz CPFKFBFSSNZKOT-UHFFFAOYSA-N -1 3 353.426 3.704 20 0 FHADHM CSc1ccc([O-])c(C(=O)N2CCCN(Cc3ccc(F)cc3)CC2)c1 ZINC000665872189 946873377 /nfs/dbraw/zinc/87/33/77/946873377.db2.gz VYIWLTPXMBRNHF-UHFFFAOYSA-N -1 3 374.481 3.601 20 0 FHADHM C[C@@H](SCc1nnc(C2CC2)n1C1CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824757171 946928153 /nfs/dbraw/zinc/92/81/53/946928153.db2.gz TYEXMZOSGCUIIC-LLVKDONJSA-N -1 3 367.482 3.665 20 0 FHADHM C[C@@H](SCc1nnc(C2CC2)n1C1CC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824757171 946928162 /nfs/dbraw/zinc/92/81/62/946928162.db2.gz TYEXMZOSGCUIIC-LLVKDONJSA-N -1 3 367.482 3.665 20 0 FHADHM Cc1n[nH]cc1-c1nnc([N-]C(=O)c2occc2-c2ccccc2)s1 ZINC000444485711 946952313 /nfs/dbraw/zinc/95/23/13/946952313.db2.gz UYSKXOJCIIQWMQ-UHFFFAOYSA-N -1 3 351.391 3.749 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CC[C@H](C)C2)c1ccccc1 ZINC000824966631 947008628 /nfs/dbraw/zinc/00/86/28/947008628.db2.gz CTKBUPGFEIVXIO-NWDGAFQWSA-N -1 3 367.478 3.795 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CC[C@H](C)C2)c1ccccc1 ZINC000824966631 947008638 /nfs/dbraw/zinc/00/86/38/947008638.db2.gz CTKBUPGFEIVXIO-NWDGAFQWSA-N -1 3 367.478 3.795 20 0 FHADHM C[C@H]1c2ccccc2CN1C(=O)c1c(Cl)cc(-c2nnn[n-]2)cc1Cl ZINC000825028775 947049111 /nfs/dbraw/zinc/04/91/11/947049111.db2.gz KGXIUVIWSQBVNG-VIFPVBQESA-N -1 3 374.231 3.891 20 0 FHADHM C[C@H]1c2ccccc2CN1C(=O)c1c(Cl)cc(-c2nn[n-]n2)cc1Cl ZINC000825028775 947049121 /nfs/dbraw/zinc/04/91/21/947049121.db2.gz KGXIUVIWSQBVNG-VIFPVBQESA-N -1 3 374.231 3.891 20 0 FHADHM CCC[C@]1(C(=O)OCC)CCCN1C(=O)CCCc1ccc([O-])c(F)c1 ZINC000444619353 947052174 /nfs/dbraw/zinc/05/21/74/947052174.db2.gz WVDQZHZDOKFDEX-HXUWFJFHSA-N -1 3 365.445 3.578 20 0 FHADHM O=S(=O)([N-][C@@H]1CCCC12CCOCC2)c1cc(Cl)ccc1Cl ZINC000328839015 947058385 /nfs/dbraw/zinc/05/83/85/947058385.db2.gz UDDAUNRQRUVDIT-CQSZACIVSA-N -1 3 364.294 3.621 20 0 FHADHM Cn1ncc2c1ncc(C(=O)N1CCCC[C@H]1c1cccc(Cl)c1)c2[O-] ZINC000444658474 947077665 /nfs/dbraw/zinc/07/76/65/947077665.db2.gz GCGNXVGGDKCIAK-INIZCTEOSA-N -1 3 370.840 3.695 20 0 FHADHM CCC(CC)n1nc(C)cc1C(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825113554 947080232 /nfs/dbraw/zinc/08/02/32/947080232.db2.gz AYRVGAVNWATABT-CYBMUJFWSA-N -1 3 368.441 3.651 20 0 FHADHM CCC(CC)n1nc(C)cc1C(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825113554 947080239 /nfs/dbraw/zinc/08/02/39/947080239.db2.gz AYRVGAVNWATABT-CYBMUJFWSA-N -1 3 368.441 3.651 20 0 FHADHM CCCN(C)C(=O)N[C@@H](C)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000825300671 947145853 /nfs/dbraw/zinc/14/58/53/947145853.db2.gz CLZBDVHLDRFPSA-AWEZNQCLSA-N -1 3 364.453 3.646 20 0 FHADHM CCCN(C)C(=O)N[C@@H](C)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000825300671 947145859 /nfs/dbraw/zinc/14/58/59/947145859.db2.gz CLZBDVHLDRFPSA-AWEZNQCLSA-N -1 3 364.453 3.646 20 0 FHADHM CCCc1sc(C(=O)N2CCc3ccc(-c4nnn[n-]4)cc32)cc1CC ZINC000825352811 947164237 /nfs/dbraw/zinc/16/42/37/947164237.db2.gz QSIUXLXRSQBUHN-UHFFFAOYSA-N -1 3 367.478 3.646 20 0 FHADHM CCCc1sc(C(=O)N2CCc3ccc(-c4nn[n-]n4)cc32)cc1CC ZINC000825352811 947164243 /nfs/dbraw/zinc/16/42/43/947164243.db2.gz QSIUXLXRSQBUHN-UHFFFAOYSA-N -1 3 367.478 3.646 20 0 FHADHM CCCc1noc(CSc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)n1 ZINC000825351385 947164600 /nfs/dbraw/zinc/16/46/00/947164600.db2.gz CJESEVFPGZDZBE-UHFFFAOYSA-N -1 3 370.360 3.513 20 0 FHADHM CCCc1noc(CSc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)n1 ZINC000825351385 947164604 /nfs/dbraw/zinc/16/46/04/947164604.db2.gz CJESEVFPGZDZBE-UHFFFAOYSA-N -1 3 370.360 3.513 20 0 FHADHM O=C([O-])[C@H]1CN(Cc2cccc(OCC(F)(F)F)c2)Cc2ccccc21 ZINC000652470772 947185527 /nfs/dbraw/zinc/18/55/27/947185527.db2.gz JFAVLNHMDKATKN-KRWDZBQOSA-N -1 3 365.351 3.812 20 0 FHADHM Cc1cc(OCCCC(=O)NCc2ccc([O-])c(F)c2)ccc1Cl ZINC000523424232 947254908 /nfs/dbraw/zinc/25/49/08/947254908.db2.gz GAFAZIRYDBONTD-UHFFFAOYSA-N -1 3 351.805 3.969 20 0 FHADHM O=c1cc(CN2CC[C@@H]2c2ccc(Br)cc2)nc(C2CC2)[n-]1 ZINC000662094633 947254944 /nfs/dbraw/zinc/25/49/44/947254944.db2.gz CHNIMQODKVRBKK-OAHLLOKOSA-N -1 3 360.255 3.769 20 0 FHADHM CC(C)[C@@H]1C[C@@H](CC(=O)Nc2cc(Br)ccc2[O-])CCO1 ZINC000330805728 947277981 /nfs/dbraw/zinc/27/79/81/947277981.db2.gz JRMKRNOZMKPNDD-NHYWBVRUSA-N -1 3 356.260 3.935 20 0 FHADHM CCOc1ccccc1[C@H](C)Nc1ncc(Cl)c(C)c1-c1nnn[n-]1 ZINC000825653700 947278527 /nfs/dbraw/zinc/27/85/27/947278527.db2.gz IHOCXTULQZMUCP-NSHDSACASA-N -1 3 358.833 3.795 20 0 FHADHM CCOc1ccccc1[C@H](C)Nc1ncc(Cl)c(C)c1-c1nn[n-]n1 ZINC000825653700 947278539 /nfs/dbraw/zinc/27/85/39/947278539.db2.gz IHOCXTULQZMUCP-NSHDSACASA-N -1 3 358.833 3.795 20 0 FHADHM O=C(NCc1nc2cc(Cl)ccc2s1)NCc1ccc([O-])c(F)c1 ZINC000523463290 947284801 /nfs/dbraw/zinc/28/48/01/947284801.db2.gz HAFCXKDIMDODLF-UHFFFAOYSA-N -1 3 365.817 3.794 20 0 FHADHM CCO[C@H]1C[C@@H](Nc2ccc(-c3nc(CC)cc(=O)[n-]3)cn2)C12CCC2 ZINC000301346397 947298886 /nfs/dbraw/zinc/29/88/86/947298886.db2.gz KMOHYDFGLQKGAF-CVEARBPZSA-N -1 3 354.454 3.566 20 0 FHADHM O=S(=O)([N-][C@H](c1ccccc1)c1ccc2c(c1)CCCO2)c1ccco1 ZINC000188677363 947482860 /nfs/dbraw/zinc/48/28/60/947482860.db2.gz CINIDBOMHMETQZ-HXUWFJFHSA-N -1 3 369.442 3.673 20 0 FHADHM CCc1ccc(C(=O)N2CCC(C(=O)c3ccc(OC)cc3)CC2)c([O-])c1 ZINC000188867499 947554727 /nfs/dbraw/zinc/55/47/27/947554727.db2.gz WOAMXUXPGUQECZ-UHFFFAOYSA-N -1 3 367.445 3.698 20 0 FHADHM C[C@@H]1C[C@@H](C(=O)[O-])CN(Cc2oc3ccccc3c2Br)C1 ZINC000662215320 947596939 /nfs/dbraw/zinc/59/69/39/947596939.db2.gz MGHYACZUYDKMAU-GHMZBOCLSA-N -1 3 352.228 3.738 20 0 FHADHM COc1ccc(CNc2ccc3cc(-c4nnn[n-]4)ccc3n2)cc1Cl ZINC000826203860 947603243 /nfs/dbraw/zinc/60/32/43/947603243.db2.gz JJEUZQWQPPIQTP-UHFFFAOYSA-N -1 3 366.812 3.689 20 0 FHADHM COc1ccc(CNc2ccc3cc(-c4nn[n-]n4)ccc3n2)cc1Cl ZINC000826203860 947603248 /nfs/dbraw/zinc/60/32/48/947603248.db2.gz JJEUZQWQPPIQTP-UHFFFAOYSA-N -1 3 366.812 3.689 20 0 FHADHM COc1ccc(CNc2nc3cc(Cl)ccc3s2)cc1-c1nnn[n-]1 ZINC000826204348 947604985 /nfs/dbraw/zinc/60/49/85/947604985.db2.gz HWZHTUFOTINAGE-UHFFFAOYSA-N -1 3 372.841 3.751 20 0 FHADHM COc1ccc(CNc2nc3cc(Cl)ccc3s2)cc1-c1nn[n-]n1 ZINC000826204348 947604990 /nfs/dbraw/zinc/60/49/90/947604990.db2.gz HWZHTUFOTINAGE-UHFFFAOYSA-N -1 3 372.841 3.751 20 0 FHADHM CS/C=C\C(=O)N[C@H](C)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000826226975 947667826 /nfs/dbraw/zinc/66/78/26/947667826.db2.gz JMJGAISYMXODFK-BSYHEUMXSA-N -1 3 365.462 3.588 20 0 FHADHM CS/C=C\C(=O)N[C@H](C)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000826226975 947667834 /nfs/dbraw/zinc/66/78/34/947667834.db2.gz JMJGAISYMXODFK-BSYHEUMXSA-N -1 3 365.462 3.588 20 0 FHADHM Cc1c(Cl)cnc(N[C@H]2CCCOc3c(F)cccc32)c1-c1nnn[n-]1 ZINC000826238527 947703893 /nfs/dbraw/zinc/70/38/93/947703893.db2.gz ITOWBCSVLMQNAJ-ZDUSSCGKSA-N -1 3 374.807 3.688 20 0 FHADHM Cc1c(Cl)cnc(N[C@H]2CCCOc3c(F)cccc32)c1-c1nn[n-]n1 ZINC000826238527 947703901 /nfs/dbraw/zinc/70/39/01/947703901.db2.gz ITOWBCSVLMQNAJ-ZDUSSCGKSA-N -1 3 374.807 3.688 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)Oc1ccc(-c2nnn[n-]2)cc1F ZINC001573364095 947717329 /nfs/dbraw/zinc/71/73/29/947717329.db2.gz FXYWAIRVWHTSQU-CSKARUKUSA-N -1 3 358.760 3.668 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)Oc1ccc(-c2nn[n-]n2)cc1F ZINC001573364095 947717340 /nfs/dbraw/zinc/71/73/40/947717340.db2.gz FXYWAIRVWHTSQU-CSKARUKUSA-N -1 3 358.760 3.668 20 0 FHADHM Cc1c(NC(=O)c2ccnc(SC(C)(C)C)c2)cccc1-c1nnn[n-]1 ZINC000826242627 947720892 /nfs/dbraw/zinc/72/08/92/947720892.db2.gz YCJVDJYGDIKZHB-UHFFFAOYSA-N -1 3 368.466 3.713 20 0 FHADHM Cc1c(NC(=O)c2ccnc(SC(C)(C)C)c2)cccc1-c1nn[n-]n1 ZINC000826242627 947720900 /nfs/dbraw/zinc/72/09/00/947720900.db2.gz YCJVDJYGDIKZHB-UHFFFAOYSA-N -1 3 368.466 3.713 20 0 FHADHM O=C(CCSc1ccc(Br)cc1)[N-]OCCC(F)(F)F ZINC000162906522 947799883 /nfs/dbraw/zinc/79/98/83/947799883.db2.gz FUQNBQMBRGZMHS-UHFFFAOYSA-N -1 3 372.206 3.932 20 0 FHADHM Cc1ccc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCC3)c(Cl)c1C ZINC000826282287 947811158 /nfs/dbraw/zinc/81/11/58/947811158.db2.gz HBOXTBLJNIWAPO-UHFFFAOYSA-N -1 3 373.869 3.939 20 0 FHADHM Cc1ccc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCC3)c(Cl)c1C ZINC000826282287 947811164 /nfs/dbraw/zinc/81/11/64/947811164.db2.gz HBOXTBLJNIWAPO-UHFFFAOYSA-N -1 3 373.869 3.939 20 0 FHADHM CCc1ccc(C(=O)Nc2ccccc2NC(=O)N2CCCC2)c([O-])c1 ZINC000189812490 947841153 /nfs/dbraw/zinc/84/11/53/947841153.db2.gz SWTMZDOHJGXNIR-UHFFFAOYSA-N -1 3 353.422 3.835 20 0 FHADHM CCOC(=O)CC1(Nc2ccc3c(c2)[N-]C(=S)C3)Cc2ccccc2C1 ZINC001167802256 947856699 /nfs/dbraw/zinc/85/66/99/947856699.db2.gz MFTKYLUZXUBUDF-UHFFFAOYSA-N -1 3 366.486 3.885 20 0 FHADHM Cc1ccccc1[C@H](OC(=O)c1c[nH]c(-c2nnn[n-]2)c1)c1cccs1 ZINC000826305799 947877596 /nfs/dbraw/zinc/87/75/96/947877596.db2.gz IWGJOEWHWVMHSX-INIZCTEOSA-N -1 3 365.418 3.511 20 0 FHADHM Cc1ccccc1[C@H](OC(=O)c1c[nH]c(-c2nn[n-]n2)c1)c1cccs1 ZINC000826305799 947877601 /nfs/dbraw/zinc/87/76/01/947877601.db2.gz IWGJOEWHWVMHSX-INIZCTEOSA-N -1 3 365.418 3.511 20 0 FHADHM Cc1ccsc1CNc1ccn(-c2ccc(-c3nn[n-]n3)cc2Cl)n1 ZINC000826316078 947923489 /nfs/dbraw/zinc/92/34/89/947923489.db2.gz CKDUSWZCIQSTRO-UHFFFAOYSA-N -1 3 371.857 3.688 20 0 FHADHM Cc1cnc(N[C@@H](C)c2ccc(-c3cccc(-c4nnn[n-]4)c3)cc2)nc1 ZINC000826318939 947932564 /nfs/dbraw/zinc/93/25/64/947932564.db2.gz GULPDIMMPCITAF-AWEZNQCLSA-N -1 3 357.421 3.805 20 0 FHADHM Cc1cnc(N[C@@H](C)c2ccc(-c3cccc(-c4nn[n-]n4)c3)cc2)nc1 ZINC000826318939 947932569 /nfs/dbraw/zinc/93/25/69/947932569.db2.gz GULPDIMMPCITAF-AWEZNQCLSA-N -1 3 357.421 3.805 20 0 FHADHM Cc1nsc(N[C@@H](C)c2ccc(-c3cccc(-c4nnn[n-]4)c3)cc2)n1 ZINC000826340469 947977202 /nfs/dbraw/zinc/97/72/02/947977202.db2.gz ZSRSKDZMOOHQSC-NSHDSACASA-N -1 3 363.450 3.867 20 0 FHADHM Cc1nsc(N[C@@H](C)c2ccc(-c3cccc(-c4nn[n-]n4)c3)cc2)n1 ZINC000826340469 947977208 /nfs/dbraw/zinc/97/72/08/947977208.db2.gz ZSRSKDZMOOHQSC-NSHDSACASA-N -1 3 363.450 3.867 20 0 FHADHM NC(=O)CCSc1ccccc1[N-]C(=O)c1cc(-c2ccccc2)on1 ZINC000520495858 948114285 /nfs/dbraw/zinc/11/42/85/948114285.db2.gz HTWFSHAQTGTFJX-UHFFFAOYSA-N -1 3 367.430 3.561 20 0 FHADHM CC(C)(C)OC1CC(CC[N-]S(=O)(=O)c2cccc(Cl)c2F)C1 ZINC000432334474 948140808 /nfs/dbraw/zinc/14/08/08/948140808.db2.gz JFYWCUWWLRHFAQ-UHFFFAOYSA-N -1 3 363.882 3.741 20 0 FHADHM O=C([O-])[C@H](CNCc1csc(C2CC2)n1)Cc1cccc(Cl)c1 ZINC000417545924 948166975 /nfs/dbraw/zinc/16/69/75/948166975.db2.gz KWQODDDBGUIHMG-ZDUSSCGKSA-N -1 3 350.871 3.707 20 0 FHADHM Fc1cccc(N[C@@H]2CCCc3cn(C4CCCC4)nc32)c1-c1nnn[n-]1 ZINC000826377178 948168149 /nfs/dbraw/zinc/16/81/49/948168149.db2.gz HYPNOHGDDRGLHT-MRXNPFEDSA-N -1 3 367.432 3.807 20 0 FHADHM Fc1cccc(N[C@@H]2CCCc3cn(C4CCCC4)nc32)c1-c1nn[n-]n1 ZINC000826377178 948168156 /nfs/dbraw/zinc/16/81/56/948168156.db2.gz HYPNOHGDDRGLHT-MRXNPFEDSA-N -1 3 367.432 3.807 20 0 FHADHM CCC(=O)c1cccc(S(=O)(=O)[N-][C@H](C2CCCC2)C(F)(F)F)c1 ZINC000544664129 948300093 /nfs/dbraw/zinc/30/00/93/948300093.db2.gz CMFPFIXHQVWAQA-OAHLLOKOSA-N -1 3 363.401 3.679 20 0 FHADHM COc1c(Cl)cc(Cl)cc1CNC[C@H](CC(=O)[O-])C(F)(F)F ZINC000417624076 948365349 /nfs/dbraw/zinc/36/53/49/948365349.db2.gz KJHYDHXWUGAQCP-QMMMGPOBSA-N -1 3 360.159 3.745 20 0 FHADHM Cc1nc(C)c(CC(=O)N[C@@H](c2ccc(Cl)cc2F)C(C)C)c(=O)[n-]1 ZINC000543833179 948391504 /nfs/dbraw/zinc/39/15/04/948391504.db2.gz JQDUFBZSKGREHN-QGZVFWFLSA-N -1 3 365.836 3.648 20 0 FHADHM O=C([N-]c1nnc(/C=C/c2ccco2)s1)c1cc(F)c(F)c(F)c1 ZINC000152375032 948438277 /nfs/dbraw/zinc/43/82/77/948438277.db2.gz YGJIHEKKUTXFKU-ONEGZZNKSA-N -1 3 351.309 3.971 20 0 FHADHM CCc1ccc(C(=O)Nc2cccc(CN3CCCCC3=O)c2)c([O-])c1 ZINC000190690878 948481285 /nfs/dbraw/zinc/48/12/85/948481285.db2.gz HDCQDLXCLVAIPX-UHFFFAOYSA-N -1 3 352.434 3.719 20 0 FHADHM CC(C)[C@@H](CCc1ccccc1)C(=O)Nc1cc(-c2nnn[n-]2)ccc1F ZINC001460788454 948525771 /nfs/dbraw/zinc/52/57/71/948525771.db2.gz SXSXADRWNIFAFG-MRXNPFEDSA-N -1 3 367.428 3.849 20 0 FHADHM CC(C)[C@@H](CCc1ccccc1)C(=O)Nc1cc(-c2nn[n-]n2)ccc1F ZINC001460788454 948525774 /nfs/dbraw/zinc/52/57/74/948525774.db2.gz SXSXADRWNIFAFG-MRXNPFEDSA-N -1 3 367.428 3.849 20 0 FHADHM O=C(Nc1cc(-c2nnn[n-]2)ccc1F)C1(Cc2cccc(Cl)c2)CC1 ZINC001525059040 948537075 /nfs/dbraw/zinc/53/70/75/948537075.db2.gz ANXZKYCLERNZHL-UHFFFAOYSA-N -1 3 371.803 3.621 20 0 FHADHM O=C(Nc1cc(-c2nn[n-]n2)ccc1F)C1(Cc2cccc(Cl)c2)CC1 ZINC001525059040 948537079 /nfs/dbraw/zinc/53/70/79/948537079.db2.gz ANXZKYCLERNZHL-UHFFFAOYSA-N -1 3 371.803 3.621 20 0 FHADHM CC(C)c1ccc(S(=O)(=O)[N-]c2cccc3c2OCC[C@@H]3N(C)C)cc1 ZINC000432478891 948541176 /nfs/dbraw/zinc/54/11/76/948541176.db2.gz OQNAEWXASHDNBX-IBGZPJMESA-N -1 3 374.506 3.996 20 0 FHADHM Cn1ncc2c1ncc(C(=O)N1CCC[C@H]1CCC1CCCCC1)c2[O-] ZINC000512174364 948642968 /nfs/dbraw/zinc/64/29/68/948642968.db2.gz HGZFFKMEBTWEJG-HNNXBMFYSA-N -1 3 356.470 3.639 20 0 FHADHM Cc1nc(-c2ccc(CNC(=O)NCc3ccc([O-])c(F)c3)cc2)cs1 ZINC000606663406 948745622 /nfs/dbraw/zinc/74/56/22/948745622.db2.gz UIJJMRPFYHCRNY-UHFFFAOYSA-N -1 3 371.437 3.963 20 0 FHADHM CC(C)c1ccc(N(CCCO)Cc2ccc(F)cc2-c2nnn[n-]2)cc1 ZINC001574416695 948755041 /nfs/dbraw/zinc/75/50/41/948755041.db2.gz DOXYHDVFKPXMJX-UHFFFAOYSA-N -1 3 369.444 3.518 20 0 FHADHM CC(C)c1ccc(N(CCCO)Cc2ccc(F)cc2-c2nn[n-]n2)cc1 ZINC001574416695 948755047 /nfs/dbraw/zinc/75/50/47/948755047.db2.gz DOXYHDVFKPXMJX-UHFFFAOYSA-N -1 3 369.444 3.518 20 0 FHADHM O=S(=O)([N-]CCc1ccc(C(F)(F)F)cc1)c1ccc(F)cc1F ZINC000022458248 220386925 /nfs/dbraw/zinc/38/69/25/220386925.db2.gz MVTQEKPBCJLCNV-UHFFFAOYSA-N -1 3 365.323 3.505 20 0 FHADHM Cc1cc(C)c(NC(=O)CNC(=O)c2ccc(C(C)C)cc2[O-])c(C)c1 ZINC000048370517 221011483 /nfs/dbraw/zinc/01/14/83/221011483.db2.gz LIMIXYZMYMIQNV-UHFFFAOYSA-N -1 3 354.450 3.809 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N[C@@H](C)c2cccc(C(F)(F)F)c2)c1 ZINC000055109725 221058942 /nfs/dbraw/zinc/05/89/42/221058942.db2.gz GOYYDHXIJSHBLS-JTQLQIEISA-N -1 3 366.339 3.860 20 0 FHADHM Cc1c(Cl)cccc1S(=O)(=O)[N-]c1cc2c(cc1Cl)OCCO2 ZINC000055576904 221072120 /nfs/dbraw/zinc/07/21/20/221072120.db2.gz SRAMMGAMELXQRH-UHFFFAOYSA-N -1 3 374.245 3.874 20 0 FHADHM Cc1noc2nc(C(C)C)cc(C(=O)[N-]c3nnc(C(F)(F)F)s3)c12 ZINC000097251265 222170428 /nfs/dbraw/zinc/17/04/28/222170428.db2.gz RZIFIGWTLUIZPX-UHFFFAOYSA-N -1 3 371.344 3.777 20 0 FHADHM CCCc1c(C(=O)N=c2cc(OC(F)F)n(C)[n-]2)cnn1C1CCCC1 ZINC000491001568 515354702 /nfs/dbraw/zinc/35/47/02/515354702.db2.gz HYBGYGFBVMUNLU-UHFFFAOYSA-N -1 3 367.400 3.538 20 0 FHADHM O=C(N=c1cc2ccc(Br)cn2[n-]1)N1Cc2ccccc2CO1 ZINC000482080111 515568227 /nfs/dbraw/zinc/56/82/27/515568227.db2.gz HYYFGDNWUKNTMY-UHFFFAOYSA-N -1 3 373.210 3.576 20 0 FHADHM Cc1ccn2ncc(C(=O)N=c3cc(-c4cc(F)cc(F)c4)[n-][nH]3)c2c1 ZINC000501144582 515998881 /nfs/dbraw/zinc/99/88/81/515998881.db2.gz ISTUESLROXCQKK-UHFFFAOYSA-N -1 3 353.332 3.563 20 0 FHADHM O=C(N=c1[n-]nc(-c2cc3ccccc3o2)s1)NCCN1CCCCC1 ZINC000470506334 516273801 /nfs/dbraw/zinc/27/38/01/516273801.db2.gz 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Cc1cc(C)c(-c2cc(=NC(=O)[C@H](C)OC[C@@H]3CCCO3)[nH][n-]2)cc1C ZINC000520607449 517454771 /nfs/dbraw/zinc/45/47/71/517454771.db2.gz LOHQXJBWCVTNBO-HOTGVXAUSA-N -1 3 357.454 3.525 20 0 FHADHM Cc1[nH]c(-c2cccc(C)c2)nc1C(=O)N=c1cc([C@H]2CCCO2)[n-][nH]1 ZINC000527208567 517562101 /nfs/dbraw/zinc/56/21/01/517562101.db2.gz QDQCUZUMWKVTAB-OAHLLOKOSA-N -1 3 351.410 3.520 20 0 FHADHM O=C(N=c1cc([C@H]2CCCO2)[n-][nH]1)c1ccccc1OCc1cscn1 ZINC000527209150 517562773 /nfs/dbraw/zinc/56/27/73/517562773.db2.gz BYDSXXSWXDIHRC-MRXNPFEDSA-N -1 3 370.434 3.549 20 0 FHADHM Cc1[n-][nH]c(=NC(=O)[C@@H]2CCN(CC(F)(F)F)C2)c1-c1ccc(C)cc1 ZINC000530272543 517670694 /nfs/dbraw/zinc/67/06/94/517670694.db2.gz LFLMAYNJEFZQMC-CQSZACIVSA-N -1 3 366.387 3.516 20 0 FHADHM Cc1ccccc1C1(CNC(=O)N=c2cc3ccccn3[n-]2)CCOCC1 ZINC000521293283 517682554 /nfs/dbraw/zinc/68/25/54/517682554.db2.gz ZWBSYJDABZNHPZ-UHFFFAOYSA-N -1 3 364.449 3.513 20 0 FHADHM Cc1nn(C)c(C)c1C[C@H](C)C(=O)N=c1cc(-c2ccccc2C)[n-][nH]1 ZINC000608359514 519947523 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COC(=O)c1cc(Cl)c(Cl)c([N-]C(=O)c2ocnc2C2CC2)c1 ZINC000602420033 567978559 /nfs/dbraw/zinc/97/85/59/567978559.db2.gz DOZMJOPXFNJTEY-UHFFFAOYSA-N -1 3 355.177 3.898 20 0 FHADHM CN(CCCNC(=O)c1cc([O-])ccc1C(F)(F)F)c1ccccc1 ZINC000188798008 567985016 /nfs/dbraw/zinc/98/50/16/567985016.db2.gz RFFFLBWBAPMFHE-UHFFFAOYSA-N -1 3 352.356 3.667 20 0 FHADHM Cc1cc([N-]C(=O)[C@@H](C)Nc2cc(C)n(-c3ccccc3Cl)n2)on1 ZINC000188619660 568000298 /nfs/dbraw/zinc/00/02/98/568000298.db2.gz COFULZQSVZPIJO-GFCCVEGCSA-N -1 3 359.817 3.570 20 0 FHADHM Cc1cc([N-]C(=O)[C@H](C)Nc2cc(C)n(-c3ccccc3Cl)n2)on1 ZINC000188619683 568000330 /nfs/dbraw/zinc/00/03/30/568000330.db2.gz COFULZQSVZPIJO-LBPRGKRZSA-N -1 3 359.817 3.570 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)CO[C@@H]3CCC[C@H](C)C3)c2)n1 ZINC000602660877 568012293 /nfs/dbraw/zinc/01/22/93/568012293.db2.gz KTKNHJMSXRDGFR-KBXCAEBGSA-N -1 3 369.465 3.945 20 0 FHADHM C[C@H](SCCc1nnn[n-]1)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 ZINC000603338474 568089694 /nfs/dbraw/zinc/08/96/94/568089694.db2.gz LCNGLXXTPYGPBE-ZETCQYMHSA-N -1 3 371.253 3.593 20 0 FHADHM C[C@H](SCCc1nn[n-]n1)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 ZINC000603338474 568089695 /nfs/dbraw/zinc/08/96/95/568089695.db2.gz LCNGLXXTPYGPBE-ZETCQYMHSA-N -1 3 371.253 3.593 20 0 FHADHM CC(C)Oc1ncc(C(=O)[N-]c2nnc(-c3ccco3)s2)cc1Cl ZINC000054516832 568141834 /nfs/dbraw/zinc/14/18/34/568141834.db2.gz PYIMKQSBKPHHNG-UHFFFAOYSA-N -1 3 364.814 3.886 20 0 FHADHM CCC(CC)c1cc(C[N-]S(=O)(=O)c2cc3ccccc3n2C)on1 ZINC000655524968 568164924 /nfs/dbraw/zinc/16/49/24/568164924.db2.gz DTVSKCINNQLLLG-UHFFFAOYSA-N -1 3 361.467 3.548 20 0 FHADHM CC[C@@H](CC1CCCC1)C(=O)NC1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000603901355 568180027 /nfs/dbraw/zinc/18/00/27/568180027.db2.gz RUOUQNDWVBXGEO-KRWDZBQOSA-N -1 3 372.509 3.720 20 0 FHADHM COC(=O)c1ccc(S(=O)(=O)[N-][C@H](CC(C)C)c2cccs2)s1 ZINC000604126503 568214193 /nfs/dbraw/zinc/21/41/93/568214193.db2.gz DHBBEIOWRKDGTP-LLVKDONJSA-N -1 3 373.521 3.662 20 0 FHADHM Cc1noc2nc(C)cc(C(=O)[N-]c3nc(-c4ccccc4)ns3)c12 ZINC000120397394 568301132 /nfs/dbraw/zinc/30/11/32/568301132.db2.gz UWALKWLMQCNYTH-UHFFFAOYSA-N -1 3 351.391 3.610 20 0 FHADHM COC(=O)c1c(C)cccc1S(=O)(=O)[N-]c1ccc(C)cc1Cl ZINC000604513485 568306708 /nfs/dbraw/zinc/30/67/08/568306708.db2.gz LSBMTLQYRZYYJI-UHFFFAOYSA-N -1 3 353.827 3.544 20 0 FHADHM COc1ccccc1-c1cc(=NC(=O)C[C@H](C)c2cccc(F)c2)[nH][n-]1 ZINC000604787996 568366981 /nfs/dbraw/zinc/36/69/81/568366981.db2.gz AGJDFOFXLKNZSY-ZDUSSCGKSA-N -1 3 353.397 3.779 20 0 FHADHM O=S(=O)([N-]CC1Cc2ccccc2C1)c1c(Cl)cccc1Cl ZINC000605004980 568519243 /nfs/dbraw/zinc/51/92/43/568519243.db2.gz XEMFVIUXVIIVDU-UHFFFAOYSA-N -1 3 356.274 3.687 20 0 FHADHM CC(C)[C@H]1CC[C@@H](C)C[C@H]1OCC(=O)[N-]c1nncn1Cc1ccccc1 ZINC000605117166 568573085 /nfs/dbraw/zinc/57/30/85/568573085.db2.gz NNUCWEZTDBUYQT-BHIYHBOVSA-N -1 3 370.497 3.742 20 0 FHADHM CCc1cccc(CC)c1S(=O)(=O)[N-]c1ccc(C)cc1CN(C)C ZINC000606145209 568670358 /nfs/dbraw/zinc/67/03/58/568670358.db2.gz KOKLGYYXBWYZCV-UHFFFAOYSA-N -1 3 360.523 3.982 20 0 FHADHM CC[C@H](OC(=O)CCc1ccc(-c2nnn[n-]2)cc1)c1ccc(F)cc1F ZINC000736384655 598823409 /nfs/dbraw/zinc/82/34/09/598823409.db2.gz YBMFIKHGCICYAQ-KRWDZBQOSA-N -1 3 372.375 3.772 20 0 FHADHM CC[C@H](OC(=O)CCc1ccc(-c2nn[n-]n2)cc1)c1ccc(F)cc1F ZINC000736384655 598823411 /nfs/dbraw/zinc/82/34/11/598823411.db2.gz YBMFIKHGCICYAQ-KRWDZBQOSA-N -1 3 372.375 3.772 20 0 FHADHM CSCCCCC(=O)Nc1sc2c(c1-c1nnn[n-]1)CC[C@@H](C)C2 ZINC000737180728 598829877 /nfs/dbraw/zinc/82/98/77/598829877.db2.gz CHVHMBBBYSQJJB-SNVBAGLBSA-N -1 3 365.528 3.525 20 0 FHADHM CSCCCCC(=O)Nc1sc2c(c1-c1nn[n-]n1)CC[C@@H](C)C2 ZINC000737180728 598829879 /nfs/dbraw/zinc/82/98/79/598829879.db2.gz CHVHMBBBYSQJJB-SNVBAGLBSA-N -1 3 365.528 3.525 20 0 FHADHM CCCCSCCC(=O)N(CC(C)C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736463096 598830272 /nfs/dbraw/zinc/83/02/72/598830272.db2.gz MRJMBKXKRZXVDR-UHFFFAOYSA-N -1 3 361.515 3.779 20 0 FHADHM CCCCSCCC(=O)N(CC(C)C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736463096 598830274 /nfs/dbraw/zinc/83/02/74/598830274.db2.gz MRJMBKXKRZXVDR-UHFFFAOYSA-N -1 3 361.515 3.779 20 0 FHADHM Cc1cccc([C@@H](C)C(=O)N(CC(C)C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737386619 598831818 /nfs/dbraw/zinc/83/18/18/598831818.db2.gz YASHCBOLYJWSQN-MRXNPFEDSA-N -1 3 363.465 3.968 20 0 FHADHM Cc1cccc([C@@H](C)C(=O)N(CC(C)C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737386619 598831820 /nfs/dbraw/zinc/83/18/20/598831820.db2.gz YASHCBOLYJWSQN-MRXNPFEDSA-N -1 3 363.465 3.968 20 0 FHADHM CC(C)(C)/C=C/C(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000735594481 598833452 /nfs/dbraw/zinc/83/34/52/598833452.db2.gz RWNDVLGHWCKKKR-MDZDMXLPSA-N -1 3 367.478 3.814 20 0 FHADHM O=C(Nc1ccc(COC2CCCC2)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000738157730 598839573 /nfs/dbraw/zinc/83/95/73/598839573.db2.gz AMLKHWKQCFGSSY-UHFFFAOYSA-N -1 3 363.421 3.578 20 0 FHADHM O=C(Nc1ccc(COC2CCCC2)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000738157730 598839574 /nfs/dbraw/zinc/83/95/74/598839574.db2.gz AMLKHWKQCFGSSY-UHFFFAOYSA-N -1 3 363.421 3.578 20 0 FHADHM Clc1ccc(NCc2ccccc2OCC2CC2)c(-c2nnn[n-]2)c1 ZINC000737574833 598856020 /nfs/dbraw/zinc/85/60/20/598856020.db2.gz QNYNVKBZTHSJBI-UHFFFAOYSA-N -1 3 355.829 3.921 20 0 FHADHM Clc1ccc(NCc2ccccc2OCC2CC2)c(-c2nn[n-]n2)c1 ZINC000737574833 598856021 /nfs/dbraw/zinc/85/60/21/598856021.db2.gz QNYNVKBZTHSJBI-UHFFFAOYSA-N -1 3 355.829 3.921 20 0 FHADHM C[C@@H](Sc1ccc(-c2nnn[n-]2)cc1)c1nc(Cc2ccccc2)no1 ZINC000736189864 598857939 /nfs/dbraw/zinc/85/79/39/598857939.db2.gz CSIKRGYLCPSZGI-GFCCVEGCSA-N -1 3 364.434 3.694 20 0 FHADHM C[C@@H](Sc1ccc(-c2nn[n-]n2)cc1)c1nc(Cc2ccccc2)no1 ZINC000736189864 598857940 /nfs/dbraw/zinc/85/79/40/598857940.db2.gz CSIKRGYLCPSZGI-GFCCVEGCSA-N -1 3 364.434 3.694 20 0 FHADHM CCCCc1ccc(N[C@@H](C(=O)OC)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000736467061 598879377 /nfs/dbraw/zinc/87/93/77/598879377.db2.gz SIHRIQICFPTVCD-GOSISDBHSA-N -1 3 365.437 3.536 20 0 FHADHM CCCCc1ccc(N[C@@H](C(=O)OC)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000736467061 598879379 /nfs/dbraw/zinc/87/93/79/598879379.db2.gz SIHRIQICFPTVCD-GOSISDBHSA-N -1 3 365.437 3.536 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@H](CC)CC1CCCC1 ZINC000736636785 598904758 /nfs/dbraw/zinc/90/47/58/598904758.db2.gz SERWSXVCKRRBRI-CQSZACIVSA-N -1 3 357.458 3.810 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@H](CC)CC1CCCC1 ZINC000736636785 598904760 /nfs/dbraw/zinc/90/47/60/598904760.db2.gz SERWSXVCKRRBRI-CQSZACIVSA-N -1 3 357.458 3.810 20 0 FHADHM CC[C@@H](NC(=O)c1sccc1-c1nnn[n-]1)c1ccc(Cl)s1 ZINC000736372254 598907183 /nfs/dbraw/zinc/90/71/83/598907183.db2.gz VNJJPNMNEACDHK-MRVPVSSYSA-N -1 3 353.860 3.524 20 0 FHADHM CC[C@@H](NC(=O)c1sccc1-c1nn[n-]n1)c1ccc(Cl)s1 ZINC000736372254 598907184 /nfs/dbraw/zinc/90/71/84/598907184.db2.gz VNJJPNMNEACDHK-MRVPVSSYSA-N -1 3 353.860 3.524 20 0 FHADHM CC[C@@H](NC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1ccc(Cl)s1 ZINC000736353955 598907615 /nfs/dbraw/zinc/90/76/15/598907615.db2.gz CXGZTFFPWDYELD-UTSBKAFOSA-N -1 3 373.869 3.862 20 0 FHADHM CC[C@@H](NC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1ccc(Cl)s1 ZINC000736353955 598907618 /nfs/dbraw/zinc/90/76/18/598907618.db2.gz CXGZTFFPWDYELD-UTSBKAFOSA-N -1 3 373.869 3.862 20 0 FHADHM CN(Cc1ccc(-c2nn[n-]n2)cc1)c1ccnc2ccc(Cl)cc21 ZINC000736816631 598937759 /nfs/dbraw/zinc/93/77/59/598937759.db2.gz LCJMQEIHWNGGGY-UHFFFAOYSA-N -1 3 350.813 3.705 20 0 FHADHM CC(C)C[C@@H]1CCCCCN1C(=S)Nc1ccccc1-c1nnn[n-]1 ZINC000735795526 598939196 /nfs/dbraw/zinc/93/91/96/598939196.db2.gz NUOHUEIMRBLONY-AWEZNQCLSA-N -1 3 358.515 3.854 20 0 FHADHM CC(C)C[C@@H]1CCCCCN1C(=S)Nc1ccccc1-c1nn[n-]n1 ZINC000735795526 598939198 /nfs/dbraw/zinc/93/91/98/598939198.db2.gz NUOHUEIMRBLONY-AWEZNQCLSA-N -1 3 358.515 3.854 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1OCCSCCCc1ccccc1 ZINC000737031696 598939320 /nfs/dbraw/zinc/93/93/20/598939320.db2.gz DSJDAHRDRDYWHP-UHFFFAOYSA-N -1 3 370.478 3.620 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1OCCSCCCc1ccccc1 ZINC000737031696 598939322 /nfs/dbraw/zinc/93/93/22/598939322.db2.gz DSJDAHRDRDYWHP-UHFFFAOYSA-N -1 3 370.478 3.620 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1OCCS[C@@H](C)c1cccs1 ZINC000737032847 598939915 /nfs/dbraw/zinc/93/99/15/598939915.db2.gz PMMXOUSVFJQCON-NSHDSACASA-N -1 3 362.480 3.810 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1OCCS[C@@H](C)c1cccs1 ZINC000737032847 598939917 /nfs/dbraw/zinc/93/99/17/598939917.db2.gz PMMXOUSVFJQCON-NSHDSACASA-N -1 3 362.480 3.810 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1OCCS[C@H](C)c1ccccc1F ZINC000737032760 598940211 /nfs/dbraw/zinc/94/02/11/598940211.db2.gz OCYGXJGGMGNMIG-GFCCVEGCSA-N -1 3 374.441 3.888 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1OCCS[C@H](C)c1ccccc1F ZINC000737032760 598940212 /nfs/dbraw/zinc/94/02/12/598940212.db2.gz OCYGXJGGMGNMIG-GFCCVEGCSA-N -1 3 374.441 3.888 20 0 FHADHM C[C@@H]1C[C@H](C)N(C(=O)c2cccc(Oc3ccc(-c4nnn[n-]4)cc3)c2)C1 ZINC000736228595 598951622 /nfs/dbraw/zinc/95/16/22/598951622.db2.gz OITBXSIGUYELLH-KGLIPLIRSA-N -1 3 363.421 3.530 20 0 FHADHM C[C@@H]1C[C@H](C)N(C(=O)c2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)C1 ZINC000736228595 598951624 /nfs/dbraw/zinc/95/16/24/598951624.db2.gz OITBXSIGUYELLH-KGLIPLIRSA-N -1 3 363.421 3.530 20 0 FHADHM CCN(c1ccc(Nc2c3ccccc3nnc2-c2nnn[n-]2)cc1)C(C)C ZINC000736564197 598954688 /nfs/dbraw/zinc/95/46/88/598954688.db2.gz AGCHIGGZAKVSMF-UHFFFAOYSA-N -1 3 374.452 3.788 20 0 FHADHM CCN(c1ccc(Nc2c3ccccc3nnc2-c2nn[n-]n2)cc1)C(C)C ZINC000736564197 598954690 /nfs/dbraw/zinc/95/46/90/598954690.db2.gz AGCHIGGZAKVSMF-UHFFFAOYSA-N -1 3 374.452 3.788 20 0 FHADHM Cc1cccc(NC2CCN(c3ccc(Cl)cc3-c3nnn[n-]3)CC2)c1 ZINC000737400274 598975754 /nfs/dbraw/zinc/97/57/54/598975754.db2.gz RXRLNDFBVUNBOO-UHFFFAOYSA-N -1 3 368.872 3.909 20 0 FHADHM Cc1cccc(NC2CCN(c3ccc(Cl)cc3-c3nn[n-]n3)CC2)c1 ZINC000737400274 598975757 /nfs/dbraw/zinc/97/57/57/598975757.db2.gz RXRLNDFBVUNBOO-UHFFFAOYSA-N -1 3 368.872 3.909 20 0 FHADHM c1ccc(COC[C@@H](Nc2ccc(-c3nnn[n-]3)cn2)c2ccccc2)cc1 ZINC000738433877 598976095 /nfs/dbraw/zinc/97/60/95/598976095.db2.gz XQJCXELXRRNMIK-LJQANCHMSA-N -1 3 372.432 3.632 20 0 FHADHM c1ccc(COC[C@@H](Nc2ccc(-c3nn[n-]n3)cn2)c2ccccc2)cc1 ZINC000738433877 598976096 /nfs/dbraw/zinc/97/60/96/598976096.db2.gz XQJCXELXRRNMIK-LJQANCHMSA-N -1 3 372.432 3.632 20 0 FHADHM CC(C)[C@H](NC(=O)c1cccc(-c2nnn[n-]2)c1)c1ccccc1Cl ZINC000735725205 599006917 /nfs/dbraw/zinc/00/69/17/599006917.db2.gz UZQTUZQGALLTBJ-INIZCTEOSA-N -1 3 355.829 3.647 20 0 FHADHM CC(C)[C@H](NC(=O)c1cccc(-c2nn[n-]n2)c1)c1ccccc1Cl ZINC000735725205 599006919 /nfs/dbraw/zinc/00/69/19/599006919.db2.gz UZQTUZQGALLTBJ-INIZCTEOSA-N -1 3 355.829 3.647 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1OCCS[C@H](C)c1ccccc1 ZINC000737032831 599009496 /nfs/dbraw/zinc/00/94/96/599009496.db2.gz PGZDNQNTTRNWNP-CYBMUJFWSA-N -1 3 356.451 3.749 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1OCCS[C@H](C)c1ccccc1 ZINC000737032831 599009498 /nfs/dbraw/zinc/00/94/98/599009498.db2.gz PGZDNQNTTRNWNP-CYBMUJFWSA-N -1 3 356.451 3.749 20 0 FHADHM Fc1cccc(F)c1-c1ccc(C=Cc2ccc(-c3nnn[n-]3)cn2)o1 ZINC000737659229 599012405 /nfs/dbraw/zinc/01/24/05/599012405.db2.gz BEUXKDZALJRSPB-VOTSOKGWSA-N -1 3 351.316 3.970 20 0 FHADHM Fc1cccc(F)c1-c1ccc(C=Cc2ccc(-c3nn[n-]n3)cn2)o1 ZINC000737659229 599012407 /nfs/dbraw/zinc/01/24/07/599012407.db2.gz BEUXKDZALJRSPB-VOTSOKGWSA-N -1 3 351.316 3.970 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@H]2C(=O)OCc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000735924052 599016409 /nfs/dbraw/zinc/01/64/09/599016409.db2.gz ORQKAXDIUPLRHP-RTBURBONSA-N -1 3 362.433 3.837 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@H]2C(=O)OCc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000735924052 599016410 /nfs/dbraw/zinc/01/64/10/599016410.db2.gz ORQKAXDIUPLRHP-RTBURBONSA-N -1 3 362.433 3.837 20 0 FHADHM CC(C)C[C@H]1CCCCCN1C(=O)NCc1ccc(-c2nnn[n-]2)cc1F ZINC000735795127 599023311 /nfs/dbraw/zinc/02/33/11/599023311.db2.gz LEGBGWZAEVNNFV-MRXNPFEDSA-N -1 3 374.464 3.506 20 0 FHADHM CC(C)C[C@H]1CCCCCN1C(=O)NCc1ccc(-c2nn[n-]n2)cc1F ZINC000735795127 599023312 /nfs/dbraw/zinc/02/33/12/599023312.db2.gz LEGBGWZAEVNNFV-MRXNPFEDSA-N -1 3 374.464 3.506 20 0 FHADHM Cc1ccc2cccc(C(=O)Nc3ccc(Cl)c(-c4nnn[n-]4)c3)c2n1 ZINC000737378536 599035258 /nfs/dbraw/zinc/03/52/58/599035258.db2.gz UBXAFFLWXRFUHI-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1ccc2cccc(C(=O)Nc3ccc(Cl)c(-c4nn[n-]n4)c3)c2n1 ZINC000737378536 599035261 /nfs/dbraw/zinc/03/52/61/599035261.db2.gz UBXAFFLWXRFUHI-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM C[C@H]1CN(c2ccc(-c3nnn[n-]3)c(Cl)c2)C[C@@H](c2ccc(F)cc2)O1 ZINC000820767345 599038835 /nfs/dbraw/zinc/03/88/35/599038835.db2.gz IGZRNFZCPIRMJZ-GTNSWQLSSA-N -1 3 373.819 3.626 20 0 FHADHM C[C@H]1CN(c2ccc(-c3nn[n-]n3)c(Cl)c2)C[C@@H](c2ccc(F)cc2)O1 ZINC000820767345 599038838 /nfs/dbraw/zinc/03/88/38/599038838.db2.gz IGZRNFZCPIRMJZ-GTNSWQLSSA-N -1 3 373.819 3.626 20 0 FHADHM C[C@@H]1CN(c2ccc(Cl)cc2-c2nnn[n-]2)C[C@H](c2ccc(F)cc2)O1 ZINC000820778455 599039798 /nfs/dbraw/zinc/03/97/98/599039798.db2.gz WYVOVYJEBQTLDO-PIGZYNQJSA-N -1 3 373.819 3.626 20 0 FHADHM C[C@@H]1CN(c2ccc(Cl)cc2-c2nn[n-]n2)C[C@H](c2ccc(F)cc2)O1 ZINC000820778455 599039801 /nfs/dbraw/zinc/03/98/01/599039801.db2.gz WYVOVYJEBQTLDO-PIGZYNQJSA-N -1 3 373.819 3.626 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N(Cc2cccs2)C2CC2)n1 ZINC000737633836 599042337 /nfs/dbraw/zinc/04/23/37/599042337.db2.gz WQYQTMPUJTXSJT-UHFFFAOYSA-N -1 3 366.372 3.511 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N(Cc2cccs2)C2CC2)n1 ZINC000737633836 599042340 /nfs/dbraw/zinc/04/23/40/599042340.db2.gz WQYQTMPUJTXSJT-UHFFFAOYSA-N -1 3 366.372 3.511 20 0 FHADHM C[C@H](c1ccccc1F)N(C)c1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000736202581 599045377 /nfs/dbraw/zinc/04/53/77/599045377.db2.gz JUXKCZHYTQZMSL-SECBINFHSA-N -1 3 366.322 3.617 20 0 FHADHM C[C@H](c1ccccc1F)N(C)c1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000736202581 599045379 /nfs/dbraw/zinc/04/53/79/599045379.db2.gz JUXKCZHYTQZMSL-SECBINFHSA-N -1 3 366.322 3.617 20 0 FHADHM C[C@@H](c1ccccc1F)N(C)c1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000736202583 599045751 /nfs/dbraw/zinc/04/57/51/599045751.db2.gz JUXKCZHYTQZMSL-VIFPVBQESA-N -1 3 366.322 3.617 20 0 FHADHM C[C@@H](c1ccccc1F)N(C)c1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000736202583 599045754 /nfs/dbraw/zinc/04/57/54/599045754.db2.gz JUXKCZHYTQZMSL-VIFPVBQESA-N -1 3 366.322 3.617 20 0 FHADHM Clc1nc(NCCOc2ccc(-c3nn[n-]n3)cc2)cc2ccccc21 ZINC000822589850 599048013 /nfs/dbraw/zinc/04/80/13/599048013.db2.gz AZEZQGNPUKNGIF-UHFFFAOYSA-N -1 3 366.812 3.559 20 0 FHADHM CCc1ccc(NC(=O)[C@@H](C)Sc2ccc(-c3nnn[n-]3)cc2F)cc1 ZINC000736690266 599066073 /nfs/dbraw/zinc/06/60/73/599066073.db2.gz IHOQTSKEOWTHFO-LLVKDONJSA-N -1 3 371.441 3.688 20 0 FHADHM CCc1ccc(NC(=O)[C@@H](C)Sc2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000736690266 599066076 /nfs/dbraw/zinc/06/60/76/599066076.db2.gz IHOQTSKEOWTHFO-LLVKDONJSA-N -1 3 371.441 3.688 20 0 FHADHM Cc1ccc(N2CCC[C@H](Nc3c(F)cc(-c4nnn[n-]4)cc3F)C2)cc1 ZINC000822242813 599066112 /nfs/dbraw/zinc/06/61/12/599066112.db2.gz YOWJZAIILUAGFZ-AWEZNQCLSA-N -1 3 370.407 3.534 20 0 FHADHM Cc1ccc(N2CCC[C@H](Nc3c(F)cc(-c4nn[n-]n4)cc3F)C2)cc1 ZINC000822242813 599066115 /nfs/dbraw/zinc/06/61/15/599066115.db2.gz YOWJZAIILUAGFZ-AWEZNQCLSA-N -1 3 370.407 3.534 20 0 FHADHM Fc1cccc(NCCc2c[nH]c3ccc(Cl)cc23)c1-c1nnn[n-]1 ZINC000822791517 599066560 /nfs/dbraw/zinc/06/65/60/599066560.db2.gz IZSJODRLKTWAPN-UHFFFAOYSA-N -1 3 356.792 3.795 20 0 FHADHM Fc1cccc(NCCc2c[nH]c3ccc(Cl)cc23)c1-c1nn[n-]n1 ZINC000822791517 599066563 /nfs/dbraw/zinc/06/65/63/599066563.db2.gz IZSJODRLKTWAPN-UHFFFAOYSA-N -1 3 356.792 3.795 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@H]1C[C@@H]1C1CCCCC1 ZINC000735903955 599070833 /nfs/dbraw/zinc/07/08/33/599070833.db2.gz JKFUQIHSVNFWPF-CVEARBPZSA-N -1 3 369.469 3.809 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@H]1C[C@@H]1C1CCCCC1 ZINC000735903955 599070836 /nfs/dbraw/zinc/07/08/36/599070836.db2.gz JKFUQIHSVNFWPF-CVEARBPZSA-N -1 3 369.469 3.809 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@@H]1C[C@@H]1C1CCCCC1 ZINC000735873556 599070896 /nfs/dbraw/zinc/07/08/96/599070896.db2.gz CBEYIWIILHXUMS-RTBURBONSA-N -1 3 367.497 3.820 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@@H]1C[C@@H]1C1CCCCC1 ZINC000735873556 599070897 /nfs/dbraw/zinc/07/08/97/599070897.db2.gz CBEYIWIILHXUMS-RTBURBONSA-N -1 3 367.497 3.820 20 0 FHADHM CCC(=CC(=O)Nc1cc(-c2nnn[n-]2)ccc1OC)c1ccc(C)cc1 ZINC000736304940 599072204 /nfs/dbraw/zinc/07/22/04/599072204.db2.gz SFGMYYXSLVTPEP-WYMLVPIESA-N -1 3 363.421 3.616 20 0 FHADHM CCC(=CC(=O)Nc1cc(-c2nn[n-]n2)ccc1OC)c1ccc(C)cc1 ZINC000736304940 599072207 /nfs/dbraw/zinc/07/22/07/599072207.db2.gz SFGMYYXSLVTPEP-WYMLVPIESA-N -1 3 363.421 3.616 20 0 FHADHM Cc1cc(C)c2ncc(-c3nnn[n-]3)c(N3CCS[C@@H](C(C)C)C3)c2c1 ZINC000822195613 599099355 /nfs/dbraw/zinc/09/93/55/599099355.db2.gz YJIZRUNBEXQIFI-MRXNPFEDSA-N -1 3 368.510 3.610 20 0 FHADHM Cc1cc(C)c2ncc(-c3nn[n-]n3)c(N3CCS[C@@H](C(C)C)C3)c2c1 ZINC000822195613 599099356 /nfs/dbraw/zinc/09/93/56/599099356.db2.gz YJIZRUNBEXQIFI-MRXNPFEDSA-N -1 3 368.510 3.610 20 0 FHADHM FC(F)(F)c1csc(CCNc2ccc(-c3nnn[n-]3)c(Cl)c2)n1 ZINC000822728979 599105657 /nfs/dbraw/zinc/10/56/57/599105657.db2.gz PMWHSXMVUMSICD-UHFFFAOYSA-N -1 3 374.779 3.650 20 0 FHADHM FC(F)(F)c1csc(CCNc2ccc(-c3nn[n-]n3)c(Cl)c2)n1 ZINC000822728979 599105659 /nfs/dbraw/zinc/10/56/59/599105659.db2.gz PMWHSXMVUMSICD-UHFFFAOYSA-N -1 3 374.779 3.650 20 0 FHADHM Clc1ccc(Br)c(C=Cc2ccc(-c3nnn[n-]3)cn2)c1 ZINC000822573542 599111555 /nfs/dbraw/zinc/11/15/55/599111555.db2.gz ABANNFYOIGSABB-DAFODLJHSA-N -1 3 362.618 3.848 20 0 FHADHM Clc1ccc(Br)c(C=Cc2ccc(-c3nn[n-]n3)cn2)c1 ZINC000822573542 599111557 /nfs/dbraw/zinc/11/15/57/599111557.db2.gz ABANNFYOIGSABB-DAFODLJHSA-N -1 3 362.618 3.848 20 0 FHADHM Cc1c(Cl)cccc1NC(=O)[C@H](C)Sc1ccccc1-c1nnn[n-]1 ZINC000737216537 599111737 /nfs/dbraw/zinc/11/17/37/599111737.db2.gz SQOVGNWUXSWTDS-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM Cc1c(Cl)cccc1NC(=O)[C@H](C)Sc1ccccc1-c1nn[n-]n1 ZINC000737216537 599111738 /nfs/dbraw/zinc/11/17/38/599111738.db2.gz SQOVGNWUXSWTDS-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM Cc1ccc2c(CSc3ccccc3-c3nnn[n-]3)cc(=O)oc2c1C ZINC000737371945 599112162 /nfs/dbraw/zinc/11/21/62/599112162.db2.gz QXWMOBHUSUJEOH-UHFFFAOYSA-N -1 3 364.430 3.882 20 0 FHADHM Cc1ccc2c(CSc3ccccc3-c3nn[n-]n3)cc(=O)oc2c1C ZINC000737371945 599112163 /nfs/dbraw/zinc/11/21/63/599112163.db2.gz QXWMOBHUSUJEOH-UHFFFAOYSA-N -1 3 364.430 3.882 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N[C@H]2C[C@@H]2C2CCCCC2)n1 ZINC000737632203 599120772 /nfs/dbraw/zinc/12/07/72/599120772.db2.gz LHKDPTQCZFURID-NEPJUHHUSA-N -1 3 352.364 3.661 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N[C@H]2C[C@@H]2C2CCCCC2)n1 ZINC000737632203 599120774 /nfs/dbraw/zinc/12/07/74/599120774.db2.gz LHKDPTQCZFURID-NEPJUHHUSA-N -1 3 352.364 3.661 20 0 FHADHM Cc1ccccc1CN(Cc1ccccn1)c1cccc(F)c1-c1nnn[n-]1 ZINC000737428226 599120883 /nfs/dbraw/zinc/12/08/83/599120883.db2.gz NMMLMCCKSOJHCP-UHFFFAOYSA-N -1 3 374.423 3.916 20 0 FHADHM Cc1ccccc1CN(Cc1ccccn1)c1cccc(F)c1-c1nn[n-]n1 ZINC000737428226 599120885 /nfs/dbraw/zinc/12/08/85/599120885.db2.gz NMMLMCCKSOJHCP-UHFFFAOYSA-N -1 3 374.423 3.916 20 0 FHADHM Cc1ccc(-c2cnc(CSc3ccc(-c4nnn[n-]4)cn3)o2)cc1 ZINC000822214013 599125862 /nfs/dbraw/zinc/12/58/62/599125862.db2.gz LOFUMZFBCIBBQC-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM Cc1ccc(-c2cnc(CSc3ccc(-c4nn[n-]n4)cn3)o2)cc1 ZINC000822214013 599125865 /nfs/dbraw/zinc/12/58/65/599125865.db2.gz LOFUMZFBCIBBQC-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM CCc1cnc(CSc2nc(-c3ccccc3)ccc2-c2nnn[n-]2)o1 ZINC000821499937 599127594 /nfs/dbraw/zinc/12/75/94/599127594.db2.gz XERIWCGGECDKNP-UHFFFAOYSA-N -1 3 364.434 3.771 20 0 FHADHM CCc1cnc(CSc2nc(-c3ccccc3)ccc2-c2nn[n-]n2)o1 ZINC000821499937 599127595 /nfs/dbraw/zinc/12/75/95/599127595.db2.gz XERIWCGGECDKNP-UHFFFAOYSA-N -1 3 364.434 3.771 20 0 FHADHM Fc1cccc(CN(Cc2ccc(-c3nn[n-]n3)cc2)Cc2ccccn2)c1 ZINC000737662598 599132516 /nfs/dbraw/zinc/13/25/16/599132516.db2.gz WNWJFPLORMQSRP-UHFFFAOYSA-N -1 3 374.423 3.603 20 0 FHADHM O=C(CCCC1CCCC1)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000822954938 599138134 /nfs/dbraw/zinc/13/81/34/599138134.db2.gz GBLPUQGTEQJLIT-UHFFFAOYSA-N -1 3 353.470 3.718 20 0 FHADHM O=C(CCCC1CCCC1)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000822954938 599138137 /nfs/dbraw/zinc/13/81/37/599138137.db2.gz GBLPUQGTEQJLIT-UHFFFAOYSA-N -1 3 353.470 3.718 20 0 FHADHM Cc1ccc([C@H](C)C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)CC(C)C)o1 ZINC000822227277 599147614 /nfs/dbraw/zinc/14/76/14/599147614.db2.gz BRFMDIOCYUOXME-HNNXBMFYSA-N -1 3 367.453 3.556 20 0 FHADHM Cc1ccc([C@H](C)C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)CC(C)C)o1 ZINC000822227277 599147617 /nfs/dbraw/zinc/14/76/17/599147617.db2.gz BRFMDIOCYUOXME-HNNXBMFYSA-N -1 3 367.453 3.556 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@H](C)CCc1ccccc1F ZINC000822215972 599148457 /nfs/dbraw/zinc/14/84/57/599148457.db2.gz ARGGRUUVPWMFSI-CYBMUJFWSA-N -1 3 353.401 3.522 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@H](C)CCc1ccccc1F ZINC000822215972 599148459 /nfs/dbraw/zinc/14/84/59/599148459.db2.gz ARGGRUUVPWMFSI-CYBMUJFWSA-N -1 3 353.401 3.522 20 0 FHADHM C[C@@H](CC(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2)c1cccc(F)c1 ZINC000735977746 599157738 /nfs/dbraw/zinc/15/77/38/599157738.db2.gz RHEPEBKIRHMDAK-JTQLQIEISA-N -1 3 371.441 3.688 20 0 FHADHM C[C@@H](CC(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2)c1cccc(F)c1 ZINC000735977746 599157740 /nfs/dbraw/zinc/15/77/40/599157740.db2.gz RHEPEBKIRHMDAK-JTQLQIEISA-N -1 3 371.441 3.688 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)C[C@@H](C)c2cccc(F)c2)s1 ZINC000736678270 599160480 /nfs/dbraw/zinc/16/04/80/599160480.db2.gz BCAMJGNEQRBBGP-SNVBAGLBSA-N -1 3 359.430 3.762 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)C[C@@H](C)c2cccc(F)c2)s1 ZINC000736678270 599160481 /nfs/dbraw/zinc/16/04/81/599160481.db2.gz BCAMJGNEQRBBGP-SNVBAGLBSA-N -1 3 359.430 3.762 20 0 FHADHM Cc1ccc([C@@H]2CCC[C@H]2N(C)C(=O)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000822233028 599162241 /nfs/dbraw/zinc/16/22/41/599162241.db2.gz GMHFPGFLOKURAD-RBUKOAKNSA-N -1 3 361.449 3.583 20 0 FHADHM Cc1ccc([C@@H]2CCC[C@H]2N(C)C(=O)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000822233028 599162243 /nfs/dbraw/zinc/16/22/43/599162243.db2.gz GMHFPGFLOKURAD-RBUKOAKNSA-N -1 3 361.449 3.583 20 0 FHADHM Cc1ccccc1-c1cnc(CSc2cc(-c3nnn[n-]3)ccn2)o1 ZINC000737419482 599165105 /nfs/dbraw/zinc/16/51/05/599165105.db2.gz XUSMXAVXGQYCBK-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM Cc1ccccc1-c1cnc(CSc2cc(-c3nn[n-]n3)ccn2)o1 ZINC000737419482 599165107 /nfs/dbraw/zinc/16/51/07/599165107.db2.gz XUSMXAVXGQYCBK-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM CC(C)c1ccc(C(=O)[C@@H](C)Sc2cc(-c3nnn[n-]3)ccn2)cc1 ZINC000736192696 599163570 /nfs/dbraw/zinc/16/35/70/599163570.db2.gz LWNNPQCAGKQMQW-GFCCVEGCSA-N -1 3 353.451 3.749 20 0 FHADHM CC(C)c1ccc(C(=O)[C@@H](C)Sc2cc(-c3nn[n-]n3)ccn2)cc1 ZINC000736192696 599163571 /nfs/dbraw/zinc/16/35/71/599163571.db2.gz LWNNPQCAGKQMQW-GFCCVEGCSA-N -1 3 353.451 3.749 20 0 FHADHM O=C(Nc1ccccc1-c1nnn[n-]1)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1 ZINC000738190318 599177930 /nfs/dbraw/zinc/17/79/30/599177930.db2.gz CSUOFBDOTWXAMF-KBPBESRZSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1ccccc1-c1nn[n-]n1)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1 ZINC000738190318 599177932 /nfs/dbraw/zinc/17/79/32/599177932.db2.gz CSUOFBDOTWXAMF-KBPBESRZSA-N -1 3 374.231 3.916 20 0 FHADHM CC[C@@H](CC1CCCCC1)C(=O)NCc1cc(-c2nnn[n-]2)ccc1F ZINC000820902778 599180631 /nfs/dbraw/zinc/18/06/31/599180631.db2.gz NNSPXXSVBGEWHU-AWEZNQCLSA-N -1 3 359.449 3.619 20 0 FHADHM CC[C@@H](CC1CCCCC1)C(=O)NCc1cc(-c2nn[n-]n2)ccc1F ZINC000820902778 599180632 /nfs/dbraw/zinc/18/06/32/599180632.db2.gz NNSPXXSVBGEWHU-AWEZNQCLSA-N -1 3 359.449 3.619 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CCC[C@H](C(C)(C)C)CC1 ZINC000737062744 599188202 /nfs/dbraw/zinc/18/82/02/599188202.db2.gz MAURXGULLHREMX-AWEZNQCLSA-N -1 3 372.473 3.555 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CCC[C@H](C(C)(C)C)CC1 ZINC000737062744 599188205 /nfs/dbraw/zinc/18/82/05/599188205.db2.gz MAURXGULLHREMX-AWEZNQCLSA-N -1 3 372.473 3.555 20 0 FHADHM Cc1ccccc1[C@H](C)CC(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000737420352 599191255 /nfs/dbraw/zinc/19/12/55/599191255.db2.gz IGZIQDFAQAKIKG-HUUCEWRRSA-N -1 3 350.422 3.973 20 0 FHADHM Cc1ccccc1[C@H](C)CC(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000737420352 599191258 /nfs/dbraw/zinc/19/12/58/599191258.db2.gz IGZIQDFAQAKIKG-HUUCEWRRSA-N -1 3 350.422 3.973 20 0 FHADHM CCC[C@H]1[C@@H](C)CCCN1C(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000821034313 599192633 /nfs/dbraw/zinc/19/26/33/599192633.db2.gz KKVYNOGGCCDBBL-YOEHRIQHSA-N -1 3 373.526 3.527 20 0 FHADHM CCC[C@H]1[C@@H](C)CCCN1C(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000821034313 599192636 /nfs/dbraw/zinc/19/26/36/599192636.db2.gz KKVYNOGGCCDBBL-YOEHRIQHSA-N -1 3 373.526 3.527 20 0 FHADHM CC(=O)N(Cc1ccc(Nc2cccc(F)c2-c2nnn[n-]2)cc1)C(C)C ZINC000735460338 599205573 /nfs/dbraw/zinc/20/55/73/599205573.db2.gz GZDKTYJFVUJPCY-UHFFFAOYSA-N -1 3 368.416 3.506 20 0 FHADHM CC(=O)N(Cc1ccc(Nc2cccc(F)c2-c2nn[n-]n2)cc1)C(C)C ZINC000735460338 599205576 /nfs/dbraw/zinc/20/55/76/599205576.db2.gz GZDKTYJFVUJPCY-UHFFFAOYSA-N -1 3 368.416 3.506 20 0 FHADHM Cc1cccc([C@H]2CCCCN2C(=O)c2cccc(-c3nnn[n-]3)c2)c1C ZINC000822299473 599203015 /nfs/dbraw/zinc/20/30/15/599203015.db2.gz KBHKOMSOUMNAEY-LJQANCHMSA-N -1 3 361.449 3.851 20 0 FHADHM Cc1cccc([C@H]2CCCCN2C(=O)c2cccc(-c3nn[n-]n3)c2)c1C ZINC000822299473 599203017 /nfs/dbraw/zinc/20/30/17/599203017.db2.gz KBHKOMSOUMNAEY-LJQANCHMSA-N -1 3 361.449 3.851 20 0 FHADHM Cc1cc(C)cc(CSCCC(=O)Nc2cccc(-c3nnn[n-]3)c2)c1 ZINC000822196221 599223945 /nfs/dbraw/zinc/22/39/45/599223945.db2.gz AIBSHSXQKRRTLI-UHFFFAOYSA-N -1 3 367.478 3.746 20 0 FHADHM Cc1cc(C)cc(CSCCC(=O)Nc2cccc(-c3nn[n-]n3)c2)c1 ZINC000822196221 599223947 /nfs/dbraw/zinc/22/39/47/599223947.db2.gz AIBSHSXQKRRTLI-UHFFFAOYSA-N -1 3 367.478 3.746 20 0 FHADHM CCCC[C@@H](CC)CC(=O)Nc1ccnn1-c1ccc(-c2nn[n-]n2)cc1 ZINC000736439197 599224898 /nfs/dbraw/zinc/22/48/98/599224898.db2.gz SBIXIIUYOGXFDY-CQSZACIVSA-N -1 3 367.457 3.597 20 0 FHADHM C[C@H](SCc1nnc(-c2ccccc2)o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820548684 599225207 /nfs/dbraw/zinc/22/52/07/599225207.db2.gz FIDBXUOHARFDRJ-LBPRGKRZSA-N -1 3 364.434 3.911 20 0 FHADHM C[C@H](SCc1nnc(-c2ccccc2)o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820548684 599225210 /nfs/dbraw/zinc/22/52/10/599225210.db2.gz FIDBXUOHARFDRJ-LBPRGKRZSA-N -1 3 364.434 3.911 20 0 FHADHM Cc1ccc(NCc2cccc(OCc3cccc(-c4nnn[n-]4)c3)c2)cn1 ZINC000822259241 607260008 /nfs/dbraw/zinc/26/00/08/607260008.db2.gz QIFDUDSDFSLTLR-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM Cc1ccc(NCc2cccc(OCc3cccc(-c4nn[n-]n4)c3)c2)cn1 ZINC000822259241 607260009 /nfs/dbraw/zinc/26/00/09/607260009.db2.gz QIFDUDSDFSLTLR-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM CCOc1ccccc1OCCSCc1cc(-c2nnn[n-]2)ccc1F ZINC000821436866 599226022 /nfs/dbraw/zinc/22/60/22/599226022.db2.gz GUODYBIBOWGTQC-UHFFFAOYSA-N -1 3 374.441 3.717 20 0 FHADHM CCOc1ccccc1OCCSCc1cc(-c2nn[n-]n2)ccc1F ZINC000821436866 599226026 /nfs/dbraw/zinc/22/60/26/599226026.db2.gz GUODYBIBOWGTQC-UHFFFAOYSA-N -1 3 374.441 3.717 20 0 FHADHM O=C(NCCC1=CCCCC1)c1c(Cl)cc(-c2nnn[n-]2)cc1Cl ZINC000826436349 607833798 /nfs/dbraw/zinc/83/37/98/607833798.db2.gz QNCRFAZSUXOHME-UHFFFAOYSA-N -1 3 366.252 3.794 20 0 FHADHM O=C(NCCC1=CCCCC1)c1c(Cl)cc(-c2nn[n-]n2)cc1Cl ZINC000826436349 607833799 /nfs/dbraw/zinc/83/37/99/607833799.db2.gz QNCRFAZSUXOHME-UHFFFAOYSA-N -1 3 366.252 3.794 20 0 FHADHM CS[C@H]1CC[C@@H](n2c(C)csc2=Nc2ccccc2-c2nnn[n-]2)C1 ZINC000821951091 599235765 /nfs/dbraw/zinc/23/57/65/599235765.db2.gz UKNAQGWDEFICNA-OLZOCXBDSA-N -1 3 372.523 3.727 20 0 FHADHM CS[C@H]1CC[C@@H](n2c(C)csc2=Nc2ccccc2-c2nn[n-]n2)C1 ZINC000821951091 599235767 /nfs/dbraw/zinc/23/57/67/599235767.db2.gz UKNAQGWDEFICNA-OLZOCXBDSA-N -1 3 372.523 3.727 20 0 FHADHM Cc1c(NC(=O)c2cccc(C(F)(F)F)c2F)cccc1-c1nnn[n-]1 ZINC000822110171 607268036 /nfs/dbraw/zinc/26/80/36/607268036.db2.gz YPDCVUCLHXGGHN-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM Cc1c(NC(=O)c2cccc(C(F)(F)F)c2F)cccc1-c1nn[n-]n1 ZINC000822110171 607268037 /nfs/dbraw/zinc/26/80/37/607268037.db2.gz YPDCVUCLHXGGHN-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM C[C@H]1C[C@@H](c2ccccc2F)N(C(=O)Nc2ccc(-c3nnn[n-]3)cc2)C1 ZINC000820666588 599240299 /nfs/dbraw/zinc/24/02/99/599240299.db2.gz JALMHLUJGJIADM-SJCJKPOMSA-N -1 3 366.400 3.621 20 0 FHADHM C[C@H]1C[C@@H](c2ccccc2F)N(C(=O)Nc2ccc(-c3nn[n-]n3)cc2)C1 ZINC000820666588 599240301 /nfs/dbraw/zinc/24/03/01/599240301.db2.gz JALMHLUJGJIADM-SJCJKPOMSA-N -1 3 366.400 3.621 20 0 FHADHM CC[C@@H](Cc1ccc(C)cc1)N(C)C(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000820912966 599240413 /nfs/dbraw/zinc/24/04/13/599240413.db2.gz ARYWFLFKJAQDJT-SFHVURJKSA-N -1 3 364.453 3.660 20 0 FHADHM CC[C@@H](Cc1ccc(C)cc1)N(C)C(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000820912966 599240415 /nfs/dbraw/zinc/24/04/15/599240415.db2.gz ARYWFLFKJAQDJT-SFHVURJKSA-N -1 3 364.453 3.660 20 0 FHADHM C[C@@H]1C[C@@H](c2ccccc2F)N(C(=O)Nc2ccc(-c3nnn[n-]3)cc2)C1 ZINC000820666587 599240449 /nfs/dbraw/zinc/24/04/49/599240449.db2.gz JALMHLUJGJIADM-PXAZEXFGSA-N -1 3 366.400 3.621 20 0 FHADHM C[C@@H]1C[C@@H](c2ccccc2F)N(C(=O)Nc2ccc(-c3nn[n-]n3)cc2)C1 ZINC000820666587 599240451 /nfs/dbraw/zinc/24/04/51/599240451.db2.gz JALMHLUJGJIADM-PXAZEXFGSA-N -1 3 366.400 3.621 20 0 FHADHM Cc1c(NC(=O)Cc2c(Cl)cccc2Cl)cccc1-c1nnn[n-]1 ZINC000822077479 607270737 /nfs/dbraw/zinc/27/07/37/607270737.db2.gz VOKGOJDZGOWAPO-UHFFFAOYSA-N -1 3 362.220 3.663 20 0 FHADHM Cc1c(NC(=O)Cc2c(Cl)cccc2Cl)cccc1-c1nn[n-]n1 ZINC000822077479 607270738 /nfs/dbraw/zinc/27/07/38/607270738.db2.gz VOKGOJDZGOWAPO-UHFFFAOYSA-N -1 3 362.220 3.663 20 0 FHADHM Cc1c(NC(=O)c2ccc(-c3ccc(F)cc3)o2)cccc1-c1nnn[n-]1 ZINC000822110161 607270967 /nfs/dbraw/zinc/27/09/67/607270967.db2.gz XYZPDPYRWVDEBP-UHFFFAOYSA-N -1 3 363.352 3.827 20 0 FHADHM Cc1c(NC(=O)c2ccc(-c3ccc(F)cc3)o2)cccc1-c1nn[n-]n1 ZINC000822110161 607270968 /nfs/dbraw/zinc/27/09/68/607270968.db2.gz XYZPDPYRWVDEBP-UHFFFAOYSA-N -1 3 363.352 3.827 20 0 FHADHM Cc1c(NC(=O)c2csc(-c3ccccc3)n2)cccc1-c1nnn[n-]1 ZINC000822115980 607270997 /nfs/dbraw/zinc/27/09/97/607270997.db2.gz JUFWKMFAASMASK-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1c(NC(=O)c2csc(-c3ccccc3)n2)cccc1-c1nn[n-]n1 ZINC000822115980 607270998 /nfs/dbraw/zinc/27/09/98/607270998.db2.gz JUFWKMFAASMASK-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1cc(O[C@H](C)C(=O)Nc2cccc(-c3nnn[n-]3)c2C)ccc1Cl ZINC000822210973 607269281 /nfs/dbraw/zinc/26/92/81/607269281.db2.gz ZEFVOUVUTDWTHO-GFCCVEGCSA-N -1 3 371.828 3.543 20 0 FHADHM Cc1cc(O[C@H](C)C(=O)Nc2cccc(-c3nn[n-]n3)c2C)ccc1Cl ZINC000822210973 607269282 /nfs/dbraw/zinc/26/92/82/607269282.db2.gz ZEFVOUVUTDWTHO-GFCCVEGCSA-N -1 3 371.828 3.543 20 0 FHADHM COC(=O)[C@@H](Sc1ccc(-c2nnn[n-]2)cc1)c1cccc(Cl)c1 ZINC000736903296 599245023 /nfs/dbraw/zinc/24/50/23/599245023.db2.gz ZFVYHEZUFLKDJE-AWEZNQCLSA-N -1 3 360.826 3.527 20 0 FHADHM COC(=O)[C@@H](Sc1ccc(-c2nn[n-]n2)cc1)c1cccc(Cl)c1 ZINC000736903296 599245024 /nfs/dbraw/zinc/24/50/24/599245024.db2.gz ZFVYHEZUFLKDJE-AWEZNQCLSA-N -1 3 360.826 3.527 20 0 FHADHM O=C(Nc1sccc1-c1nnn[n-]1)c1ccc(OC2CCCCC2)cc1 ZINC000738206993 599246756 /nfs/dbraw/zinc/24/67/56/599246756.db2.gz IKOADJTVQKOOBI-UHFFFAOYSA-N -1 3 369.450 3.892 20 0 FHADHM O=C(Nc1sccc1-c1nn[n-]n1)c1ccc(OC2CCCCC2)cc1 ZINC000738206993 599246758 /nfs/dbraw/zinc/24/67/58/599246758.db2.gz IKOADJTVQKOOBI-UHFFFAOYSA-N -1 3 369.450 3.892 20 0 FHADHM CCc1cccc(CC)c1NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821492343 599247257 /nfs/dbraw/zinc/24/72/57/599247257.db2.gz MITUQDWVOVIDSH-CYBMUJFWSA-N -1 3 364.453 3.874 20 0 FHADHM CCc1cccc(CC)c1NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821492343 599247259 /nfs/dbraw/zinc/24/72/59/599247259.db2.gz MITUQDWVOVIDSH-CYBMUJFWSA-N -1 3 364.453 3.874 20 0 FHADHM C[C@@H]1C[C@@H](c2cccc(F)c2)N(C(=O)Nc2cccc(-c3nnn[n-]3)c2)C1 ZINC000820668584 599247416 /nfs/dbraw/zinc/24/74/16/599247416.db2.gz VBIUGGQLZMXCDS-PXAZEXFGSA-N -1 3 366.400 3.621 20 0 FHADHM C[C@@H]1C[C@@H](c2cccc(F)c2)N(C(=O)Nc2cccc(-c3nn[n-]n3)c2)C1 ZINC000820668584 599247418 /nfs/dbraw/zinc/24/74/18/599247418.db2.gz VBIUGGQLZMXCDS-PXAZEXFGSA-N -1 3 366.400 3.621 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)/C=C/C1CCCCC1 ZINC000735830850 599248250 /nfs/dbraw/zinc/24/82/50/599248250.db2.gz KCKVFJITUGLGAG-JLHYYAGUSA-N -1 3 367.497 3.988 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)/C=C/C1CCCCC1 ZINC000735830850 599248253 /nfs/dbraw/zinc/24/82/53/599248253.db2.gz KCKVFJITUGLGAG-JLHYYAGUSA-N -1 3 367.497 3.988 20 0 FHADHM Cc1c(NC(=O)N(Cc2cccc(F)c2)C(C)C)cccc1-c1nnn[n-]1 ZINC000822084922 607282944 /nfs/dbraw/zinc/28/29/44/607282944.db2.gz SNTONHVRDMMGOD-UHFFFAOYSA-N -1 3 368.416 3.757 20 0 FHADHM Cc1c(NC(=O)N(Cc2cccc(F)c2)C(C)C)cccc1-c1nn[n-]n1 ZINC000822084922 607282945 /nfs/dbraw/zinc/28/29/45/607282945.db2.gz SNTONHVRDMMGOD-UHFFFAOYSA-N -1 3 368.416 3.757 20 0 FHADHM CCSCC[C@H](C)N(C)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000821457391 599249874 /nfs/dbraw/zinc/24/98/74/599249874.db2.gz WBWXBFNQPWSUOE-JTQLQIEISA-N -1 3 368.894 3.516 20 0 FHADHM CCSCC[C@H](C)N(C)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000821457391 599249876 /nfs/dbraw/zinc/24/98/76/599249876.db2.gz WBWXBFNQPWSUOE-JTQLQIEISA-N -1 3 368.894 3.516 20 0 FHADHM Cc1c(NC(=O)N[C@H](C)c2ccc(Cl)cc2)cccc1-c1nnn[n-]1 ZINC000822091049 607280015 /nfs/dbraw/zinc/28/00/15/607280015.db2.gz NEVGNUOYSBYSRN-LLVKDONJSA-N -1 3 356.817 3.711 20 0 FHADHM Cc1c(NC(=O)N[C@H](C)c2ccc(Cl)cc2)cccc1-c1nn[n-]n1 ZINC000822091049 607280016 /nfs/dbraw/zinc/28/00/16/607280016.db2.gz NEVGNUOYSBYSRN-LLVKDONJSA-N -1 3 356.817 3.711 20 0 FHADHM CCCc1ccccc1NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821142660 599252251 /nfs/dbraw/zinc/25/22/51/599252251.db2.gz KNWVHAMZHFBINA-ZDUSSCGKSA-N -1 3 350.426 3.702 20 0 FHADHM CCCc1ccccc1NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821142660 599252254 /nfs/dbraw/zinc/25/22/54/599252254.db2.gz KNWVHAMZHFBINA-ZDUSSCGKSA-N -1 3 350.426 3.702 20 0 FHADHM Cc1c(NC(=O)NC(C)(C)c2ccc(F)c(F)c2)cccc1-c1nnn[n-]1 ZINC000822089515 607282408 /nfs/dbraw/zinc/28/24/08/607282408.db2.gz DDFLOPJQGWTRNH-UHFFFAOYSA-N -1 3 372.379 3.510 20 0 FHADHM Cc1c(NC(=O)NC(C)(C)c2ccc(F)c(F)c2)cccc1-c1nn[n-]n1 ZINC000822089515 607282409 /nfs/dbraw/zinc/28/24/09/607282409.db2.gz DDFLOPJQGWTRNH-UHFFFAOYSA-N -1 3 372.379 3.510 20 0 FHADHM CCCN(Cc1ccc(C)cc1)C(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000821109322 607283585 /nfs/dbraw/zinc/28/35/85/607283585.db2.gz HILBJVDYUVCDRX-UHFFFAOYSA-N -1 3 364.453 3.928 20 0 FHADHM CCCN(Cc1ccc(C)cc1)C(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000821109322 607283586 /nfs/dbraw/zinc/28/35/86/607283586.db2.gz HILBJVDYUVCDRX-UHFFFAOYSA-N -1 3 364.453 3.928 20 0 FHADHM Cc1ccccc1[C@@H]1CCN(C(=O)Nc2cccc(-c3nnn[n-]3)c2C)C1 ZINC000822351590 607289288 /nfs/dbraw/zinc/28/92/88/607289288.db2.gz OWFGWRBIHDELCG-OAHLLOKOSA-N -1 3 362.437 3.505 20 0 FHADHM Cc1ccccc1[C@@H]1CCN(C(=O)Nc2cccc(-c3nn[n-]n3)c2C)C1 ZINC000822351590 607289289 /nfs/dbraw/zinc/28/92/89/607289289.db2.gz OWFGWRBIHDELCG-OAHLLOKOSA-N -1 3 362.437 3.505 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)C=C(C)c1ccccc1 ZINC000736487410 599276785 /nfs/dbraw/zinc/27/67/85/599276785.db2.gz GJGKWLFIFANEAA-WYMLVPIESA-N -1 3 362.437 3.731 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)CCCc1ccccc1 ZINC000736489424 599278180 /nfs/dbraw/zinc/27/81/80/599278180.db2.gz ZNKKBPVCQVNNSO-UHFFFAOYSA-N -1 3 364.453 3.650 20 0 FHADHM Cc1ccccc1-n1cnnc1S[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000737416040 599286102 /nfs/dbraw/zinc/28/61/02/599286102.db2.gz VZRDLMBHIBRKSH-ZDUSSCGKSA-N -1 3 363.450 3.609 20 0 FHADHM Cc1ccccc1-n1cnnc1S[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000737416040 599286103 /nfs/dbraw/zinc/28/61/03/599286103.db2.gz VZRDLMBHIBRKSH-ZDUSSCGKSA-N -1 3 363.450 3.609 20 0 FHADHM C[C@H]1CCCC[C@H]1NC(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000820704674 599286684 /nfs/dbraw/zinc/28/66/84/599286684.db2.gz PHJZKGPYXVTDBS-TVQRCGJNSA-N -1 3 368.363 3.586 20 0 FHADHM C[C@H]1CCCC[C@H]1NC(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000820704674 599286686 /nfs/dbraw/zinc/28/66/86/599286686.db2.gz PHJZKGPYXVTDBS-TVQRCGJNSA-N -1 3 368.363 3.586 20 0 FHADHM C[C@@H](Sc1nnc(C2CC2)n1C1CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736193872 599287491 /nfs/dbraw/zinc/28/74/91/599287491.db2.gz VESZJGOKTXEDIG-SNVBAGLBSA-N -1 3 353.455 3.524 20 0 FHADHM C[C@@H](Sc1nnc(C2CC2)n1C1CC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736193872 599287492 /nfs/dbraw/zinc/28/74/92/599287492.db2.gz VESZJGOKTXEDIG-SNVBAGLBSA-N -1 3 353.455 3.524 20 0 FHADHM CCC(CC)n1ccc(CSCc2cc(-c3nnn[n-]3)ccc2F)n1 ZINC000820897884 607325829 /nfs/dbraw/zinc/32/58/29/607325829.db2.gz PSZXQTVRVCYJDJ-UHFFFAOYSA-N -1 3 360.462 3.997 20 0 FHADHM CCC(CC)n1ccc(CSCc2cc(-c3nn[n-]n3)ccc2F)n1 ZINC000820897884 607325830 /nfs/dbraw/zinc/32/58/30/607325830.db2.gz PSZXQTVRVCYJDJ-UHFFFAOYSA-N -1 3 360.462 3.997 20 0 FHADHM Cc1cn(Cc2nc(C)c(-c3ccc(Cl)cc3)o2)cc1-c1nnn[n-]1 ZINC000822389510 607329856 /nfs/dbraw/zinc/32/98/56/607329856.db2.gz ZEOXDCLPWUDILV-UHFFFAOYSA-N -1 3 354.801 3.642 20 0 FHADHM Cc1cn(Cc2nc(C)c(-c3ccc(Cl)cc3)o2)cc1-c1nn[n-]n1 ZINC000822389510 607329857 /nfs/dbraw/zinc/32/98/57/607329857.db2.gz ZEOXDCLPWUDILV-UHFFFAOYSA-N -1 3 354.801 3.642 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1NCc1cccc(OCC(F)(F)F)c1 ZINC000737643924 598238180 /nfs/dbraw/zinc/23/81/80/598238180.db2.gz HXFBBRNIVFDFDZ-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM Fc1cccc(Nc2cccc(OCc3ccccn3)c2)c1-c1nnn[n-]1 ZINC000737663064 598239087 /nfs/dbraw/zinc/23/90/87/598239087.db2.gz DYMFOUYEXCUORQ-UHFFFAOYSA-N -1 3 362.368 3.723 20 0 FHADHM Fc1cccc(Nc2cccc(OCc3ccccn3)c2)c1-c1nn[n-]n1 ZINC000737663064 598239088 /nfs/dbraw/zinc/23/90/88/598239088.db2.gz DYMFOUYEXCUORQ-UHFFFAOYSA-N -1 3 362.368 3.723 20 0 FHADHM CC(C)OCCOCc1cccc(Nc2cccc(F)c2-c2nnn[n-]2)c1 ZINC000735904624 598242581 /nfs/dbraw/zinc/24/25/81/598242581.db2.gz STIAWPAQZPZOIW-UHFFFAOYSA-N -1 3 371.416 3.691 20 0 FHADHM CC(C)OCCOCc1cccc(Nc2cccc(F)c2-c2nn[n-]n2)c1 ZINC000735904624 598242582 /nfs/dbraw/zinc/24/25/82/598242582.db2.gz STIAWPAQZPZOIW-UHFFFAOYSA-N -1 3 371.416 3.691 20 0 FHADHM C[C@H]1CCC[C@H]1NC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736263796 598242668 /nfs/dbraw/zinc/24/26/68/598242668.db2.gz SKRLKKYPSPZIPP-SCLBCKFNSA-N -1 3 363.421 3.577 20 0 FHADHM C[C@H]1CCC[C@H]1NC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736263796 598242669 /nfs/dbraw/zinc/24/26/69/598242669.db2.gz SKRLKKYPSPZIPP-SCLBCKFNSA-N -1 3 363.421 3.577 20 0 FHADHM CC(C)CCOc1ccc([C@@H](C)Nc2ccc(-c3nnn[n-]3)cn2)cc1 ZINC000735819784 598243313 /nfs/dbraw/zinc/24/33/13/598243313.db2.gz LHECTXGVMGQCBG-CQSZACIVSA-N -1 3 352.442 3.860 20 0 FHADHM CC(C)CCOc1ccc([C@@H](C)Nc2ccc(-c3nn[n-]n3)cn2)cc1 ZINC000735819784 598243314 /nfs/dbraw/zinc/24/33/14/598243314.db2.gz LHECTXGVMGQCBG-CQSZACIVSA-N -1 3 352.442 3.860 20 0 FHADHM CC(C)CCOc1ccc([C@@H](C)Nc2ncccc2-c2nnn[n-]2)cc1 ZINC000735820476 598243470 /nfs/dbraw/zinc/24/34/70/598243470.db2.gz TVDMWUBNDLSSSM-CQSZACIVSA-N -1 3 352.442 3.860 20 0 FHADHM CC(C)CCOc1ccc([C@@H](C)Nc2ncccc2-c2nn[n-]n2)cc1 ZINC000735820476 598243472 /nfs/dbraw/zinc/24/34/72/598243472.db2.gz TVDMWUBNDLSSSM-CQSZACIVSA-N -1 3 352.442 3.860 20 0 FHADHM CCC1(C)CCN(C(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(C)C)CC1 ZINC000736395837 598263899 /nfs/dbraw/zinc/26/38/99/598263899.db2.gz JDSZNJMBUXMKRL-UHFFFAOYSA-N -1 3 372.473 3.698 20 0 FHADHM CCC1(C)CCN(C(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(C)C)CC1 ZINC000736395837 598263901 /nfs/dbraw/zinc/26/39/01/598263901.db2.gz JDSZNJMBUXMKRL-UHFFFAOYSA-N -1 3 372.473 3.698 20 0 FHADHM COCc1ccc(CNc2ccc(C(F)(F)F)c(-c3nnn[n-]3)c2)cc1 ZINC000821695322 607346383 /nfs/dbraw/zinc/34/63/83/607346383.db2.gz SCWGERIGTATPBP-UHFFFAOYSA-N -1 3 363.343 3.644 20 0 FHADHM COCc1ccc(CNc2ccc(C(F)(F)F)c(-c3nn[n-]n3)c2)cc1 ZINC000821695322 607346384 /nfs/dbraw/zinc/34/63/84/607346384.db2.gz SCWGERIGTATPBP-UHFFFAOYSA-N -1 3 363.343 3.644 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)ccc1OCc1cc(Cl)ccc1OC ZINC000736627623 598273014 /nfs/dbraw/zinc/27/30/14/598273014.db2.gz OGEUXFZOZUOFOU-UHFFFAOYSA-N -1 3 360.801 3.506 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)ccc1OCc1cc(Cl)ccc1OC ZINC000736627623 598273016 /nfs/dbraw/zinc/27/30/16/598273016.db2.gz OGEUXFZOZUOFOU-UHFFFAOYSA-N -1 3 360.801 3.506 20 0 FHADHM CC[C@@H](CC(=O)Oc1c(Cl)cc(-c2nnn[n-]2)cc1OC)C(C)C ZINC000736333541 598277395 /nfs/dbraw/zinc/27/73/95/598277395.db2.gz AOANOKWJWLKRNQ-JTQLQIEISA-N -1 3 352.822 3.506 20 0 FHADHM CC[C@@H](CC(=O)Oc1c(Cl)cc(-c2nn[n-]n2)cc1OC)C(C)C ZINC000736333541 598277397 /nfs/dbraw/zinc/27/73/97/598277397.db2.gz AOANOKWJWLKRNQ-JTQLQIEISA-N -1 3 352.822 3.506 20 0 FHADHM CC(C)CN(C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C)C1CCCC1 ZINC000735819506 598280344 /nfs/dbraw/zinc/28/03/44/598280344.db2.gz WVMZMGJQQFOBJN-UHFFFAOYSA-N -1 3 373.505 3.856 20 0 FHADHM CC(C)CN(C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C)C1CCCC1 ZINC000735819506 598280346 /nfs/dbraw/zinc/28/03/46/598280346.db2.gz WVMZMGJQQFOBJN-UHFFFAOYSA-N -1 3 373.505 3.856 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)C1CCCCCC1 ZINC000735830166 598295239 /nfs/dbraw/zinc/29/52/39/598295239.db2.gz SQWARIQFAGNKNT-UHFFFAOYSA-N -1 3 355.486 3.822 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)C1CCCCCC1 ZINC000735830166 598295240 /nfs/dbraw/zinc/29/52/40/598295240.db2.gz SQWARIQFAGNKNT-UHFFFAOYSA-N -1 3 355.486 3.822 20 0 FHADHM CC[C@@H](C)Oc1ccccc1C=CC(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000729833915 598296863 /nfs/dbraw/zinc/29/68/63/598296863.db2.gz NZVIKAYDFKVYIH-GCZGRYASSA-N -1 3 363.421 3.696 20 0 FHADHM CC[C@@H](C)Oc1ccccc1C=CC(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000729833915 598296864 /nfs/dbraw/zinc/29/68/64/598296864.db2.gz NZVIKAYDFKVYIH-GCZGRYASSA-N -1 3 363.421 3.696 20 0 FHADHM CN(C(=O)c1cc(Cl)sc1Cl)c1ccc(-c2nnn[n-]2)cc1F ZINC000736750141 598309938 /nfs/dbraw/zinc/30/99/38/598309938.db2.gz TYLYHICJSHGBDQ-UHFFFAOYSA-N -1 3 372.212 3.651 20 0 FHADHM CN(C(=O)c1cc(Cl)sc1Cl)c1ccc(-c2nn[n-]n2)cc1F ZINC000736750141 598309940 /nfs/dbraw/zinc/30/99/40/598309940.db2.gz TYLYHICJSHGBDQ-UHFFFAOYSA-N -1 3 372.212 3.651 20 0 FHADHM Fc1cccc(-n2ccc(CSCc3cccc(-c4nnn[n-]4)c3)n2)c1 ZINC000737664700 598315529 /nfs/dbraw/zinc/31/55/29/598315529.db2.gz DHALZTUDVVRDBQ-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM Fc1cccc(-n2ccc(CSCc3cccc(-c4nn[n-]n4)c3)n2)c1 ZINC000737664700 598315531 /nfs/dbraw/zinc/31/55/31/598315531.db2.gz DHALZTUDVVRDBQ-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM CC[C@@H]1CCCC[C@H]1NC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736400694 598320239 /nfs/dbraw/zinc/32/02/39/598320239.db2.gz RKSNXBFCLURBND-QMTHXVAHSA-N -1 3 364.906 3.775 20 0 FHADHM CC[C@@H]1CCCC[C@H]1NC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736400694 598320242 /nfs/dbraw/zinc/32/02/42/598320242.db2.gz RKSNXBFCLURBND-QMTHXVAHSA-N -1 3 364.906 3.775 20 0 FHADHM O=C(Nc1sc2c(c1-c1nnn[n-]1)CCC2)[C@@H]1CCCc2sccc21 ZINC000823383698 607349994 /nfs/dbraw/zinc/34/99/94/607349994.db2.gz XWSTUECUOPHMFZ-SNVBAGLBSA-N -1 3 371.491 3.537 20 0 FHADHM O=C(Nc1sc2c(c1-c1nn[n-]n1)CCC2)[C@@H]1CCCc2sccc21 ZINC000823383698 607349996 /nfs/dbraw/zinc/34/99/96/607349996.db2.gz XWSTUECUOPHMFZ-SNVBAGLBSA-N -1 3 371.491 3.537 20 0 FHADHM CC(C)(C)c1nc(C(=O)Nc2ccc(Cl)c(-c3nnn[n-]3)c2)cs1 ZINC000735657107 598325299 /nfs/dbraw/zinc/32/52/99/598325299.db2.gz OTWQMYACZQIAEF-UHFFFAOYSA-N -1 3 362.846 3.526 20 0 FHADHM CC(C)(C)c1nc(C(=O)Nc2ccc(Cl)c(-c3nn[n-]n3)c2)cs1 ZINC000735657107 598325301 /nfs/dbraw/zinc/32/53/01/598325301.db2.gz OTWQMYACZQIAEF-UHFFFAOYSA-N -1 3 362.846 3.526 20 0 FHADHM O=C(Nc1sc2c(c1-c1nnn[n-]1)CCC2)c1ccc(C(F)F)cc1 ZINC000738211703 598326073 /nfs/dbraw/zinc/32/60/73/598326073.db2.gz SPFUZAJUKKCTNF-UHFFFAOYSA-N -1 3 361.377 3.607 20 0 FHADHM O=C(Nc1sc2c(c1-c1nn[n-]n1)CCC2)c1ccc(C(F)F)cc1 ZINC000738211703 598326074 /nfs/dbraw/zinc/32/60/74/598326074.db2.gz SPFUZAJUKKCTNF-UHFFFAOYSA-N -1 3 361.377 3.607 20 0 FHADHM O=C(Nc1sc2c(c1-c1nnn[n-]1)CCC2)[C@H]1CCCc2sccc21 ZINC000823383690 607350378 /nfs/dbraw/zinc/35/03/78/607350378.db2.gz XWSTUECUOPHMFZ-JTQLQIEISA-N -1 3 371.491 3.537 20 0 FHADHM O=C(Nc1sc2c(c1-c1nn[n-]n1)CCC2)[C@H]1CCCc2sccc21 ZINC000823383690 607350380 /nfs/dbraw/zinc/35/03/80/607350380.db2.gz XWSTUECUOPHMFZ-JTQLQIEISA-N -1 3 371.491 3.537 20 0 FHADHM CCN(C(=O)c1ccc(F)cc1C)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821160193 607350924 /nfs/dbraw/zinc/35/09/24/607350924.db2.gz GSBRFEKWFIPQDW-CYBMUJFWSA-N -1 3 353.401 3.538 20 0 FHADHM CCN(C(=O)c1ccc(F)cc1C)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821160193 607350926 /nfs/dbraw/zinc/35/09/26/607350926.db2.gz GSBRFEKWFIPQDW-CYBMUJFWSA-N -1 3 353.401 3.538 20 0 FHADHM CC[C@H](Oc1ccccc1C(C)C)C(=O)Nc1sccc1-c1nnn[n-]1 ZINC000736392778 598358698 /nfs/dbraw/zinc/35/86/98/598358698.db2.gz SAJLBTPBUDURTM-AWEZNQCLSA-N -1 3 371.466 3.848 20 0 FHADHM CC[C@H](Oc1ccccc1C(C)C)C(=O)Nc1sccc1-c1nn[n-]n1 ZINC000736392778 598358699 /nfs/dbraw/zinc/35/86/99/598358699.db2.gz SAJLBTPBUDURTM-AWEZNQCLSA-N -1 3 371.466 3.848 20 0 FHADHM C[C@@H](Nc1ncc(-c2nnn[n-]2)cc1Cl)c1ccc2c(c1)CCCC2 ZINC000736138181 598386239 /nfs/dbraw/zinc/38/62/39/598386239.db2.gz OSAJKQNHDNPPIM-LLVKDONJSA-N -1 3 354.845 3.967 20 0 FHADHM C[C@@H](Nc1ncc(-c2nn[n-]n2)cc1Cl)c1ccc2c(c1)CCCC2 ZINC000736138181 598386240 /nfs/dbraw/zinc/38/62/40/598386240.db2.gz OSAJKQNHDNPPIM-LLVKDONJSA-N -1 3 354.845 3.967 20 0 FHADHM Cc1cccc(Oc2ccccc2CNc2ccc(-c3nnn[n-]3)cn2)c1 ZINC000737411728 598386519 /nfs/dbraw/zinc/38/65/19/598386519.db2.gz ODBAMHTYOCTFSM-UHFFFAOYSA-N -1 3 358.405 3.975 20 0 FHADHM Cc1cccc(Oc2ccccc2CNc2ccc(-c3nn[n-]n3)cn2)c1 ZINC000737411728 598386520 /nfs/dbraw/zinc/38/65/20/598386520.db2.gz ODBAMHTYOCTFSM-UHFFFAOYSA-N -1 3 358.405 3.975 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1NCCOc1ccccc1C(F)(F)F ZINC000737641299 598387151 /nfs/dbraw/zinc/38/71/51/598387151.db2.gz WDZKKRCGAIQODE-UHFFFAOYSA-N -1 3 367.306 3.516 20 0 FHADHM Clc1cccc2c1OCC[C@@H]2Nc1ncc(-c2nnn[n-]2)cc1Cl ZINC000737558582 598391195 /nfs/dbraw/zinc/39/11/95/598391195.db2.gz NZBUYDHDNIOFDC-LBPRGKRZSA-N -1 3 363.208 3.504 20 0 FHADHM Clc1cccc2c1OCC[C@@H]2Nc1ncc(-c2nn[n-]n2)cc1Cl ZINC000737558582 598391197 /nfs/dbraw/zinc/39/11/97/598391197.db2.gz NZBUYDHDNIOFDC-LBPRGKRZSA-N -1 3 363.208 3.504 20 0 FHADHM Cc1ccsc1-c1nnc(SCc2cccc(-c3nnn[n-]3)c2)o1 ZINC000737443009 598394615 /nfs/dbraw/zinc/39/46/15/598394615.db2.gz SQINXMBXUNMWPX-UHFFFAOYSA-N -1 3 356.436 3.579 20 0 FHADHM Cc1ccsc1-c1nnc(SCc2cccc(-c3nn[n-]n3)c2)o1 ZINC000737443009 598394616 /nfs/dbraw/zinc/39/46/16/598394616.db2.gz SQINXMBXUNMWPX-UHFFFAOYSA-N -1 3 356.436 3.579 20 0 FHADHM Cc1ccc(F)c(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCC3)c1 ZINC000737345139 598414812 /nfs/dbraw/zinc/41/48/12/598414812.db2.gz OMPMUQHATVYNQG-UHFFFAOYSA-N -1 3 357.414 3.507 20 0 FHADHM Cc1ccc(F)c(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCC3)c1 ZINC000737345139 598414813 /nfs/dbraw/zinc/41/48/13/598414813.db2.gz OMPMUQHATVYNQG-UHFFFAOYSA-N -1 3 357.414 3.507 20 0 FHADHM Cc1ccc(F)c(C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)CC(C)C)c1 ZINC000737343079 598417501 /nfs/dbraw/zinc/41/75/01/598417501.db2.gz MIWMPMGPJCUNGL-UHFFFAOYSA-N -1 3 367.428 3.613 20 0 FHADHM Cc1ccc(F)c(C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)CC(C)C)c1 ZINC000737343079 598417502 /nfs/dbraw/zinc/41/75/02/598417502.db2.gz MIWMPMGPJCUNGL-UHFFFAOYSA-N -1 3 367.428 3.613 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)Nc1c(F)cccc1F ZINC000735873162 598425290 /nfs/dbraw/zinc/42/52/90/598425290.db2.gz AJMIBKWTYRLCOG-UHFFFAOYSA-N -1 3 372.379 3.587 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)Nc1c(F)cccc1F ZINC000735873162 598425292 /nfs/dbraw/zinc/42/52/92/598425292.db2.gz AJMIBKWTYRLCOG-UHFFFAOYSA-N -1 3 372.379 3.587 20 0 FHADHM Cc1ccc(F)c(NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)c1 ZINC000737345681 598426722 /nfs/dbraw/zinc/42/67/22/598426722.db2.gz VGMRBWDOBRAOBB-UHFFFAOYSA-N -1 3 368.416 3.757 20 0 FHADHM Cc1ccc(F)c(NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)c1 ZINC000737345681 598426723 /nfs/dbraw/zinc/42/67/23/598426723.db2.gz VGMRBWDOBRAOBB-UHFFFAOYSA-N -1 3 368.416 3.757 20 0 FHADHM CC(C)c1cccc(C(C)C)c1NC(=O)c1ccc(-c2nnn[n-]2)cn1 ZINC000735928666 598435246 /nfs/dbraw/zinc/43/52/46/598435246.db2.gz OUEDCILALSXJPJ-UHFFFAOYSA-N -1 3 350.426 3.761 20 0 FHADHM CC(C)c1cccc(C(C)C)c1NC(=O)c1ccc(-c2nn[n-]n2)cn1 ZINC000735928666 598435248 /nfs/dbraw/zinc/43/52/48/598435248.db2.gz OUEDCILALSXJPJ-UHFFFAOYSA-N -1 3 350.426 3.761 20 0 FHADHM Cc1ccc(-c2nnc(SCc3ccc(-c4nnn[n-]4)cc3)o2)c(C)c1 ZINC000737288551 598440050 /nfs/dbraw/zinc/44/00/50/598440050.db2.gz LIPOWFGNVSYTPV-UHFFFAOYSA-N -1 3 364.434 3.826 20 0 FHADHM Cc1ccc(-c2nnc(SCc3ccc(-c4nn[n-]n4)cc3)o2)c(C)c1 ZINC000737288551 598440051 /nfs/dbraw/zinc/44/00/51/598440051.db2.gz LIPOWFGNVSYTPV-UHFFFAOYSA-N -1 3 364.434 3.826 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)C1(c2cccc(C(F)(F)F)c2)CC1 ZINC000066603780 598440405 /nfs/dbraw/zinc/44/04/05/598440405.db2.gz MZXPWGNYOBTNRA-UHFFFAOYSA-N -1 3 373.338 3.556 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)C1(c2cccc(C(F)(F)F)c2)CC1 ZINC000066603780 598440406 /nfs/dbraw/zinc/44/04/06/598440406.db2.gz MZXPWGNYOBTNRA-UHFFFAOYSA-N -1 3 373.338 3.556 20 0 FHADHM COc1ccccc1C(C)=CC(=O)Nc1sc(C)c(C)c1-c1nnn[n-]1 ZINC000737141123 598440972 /nfs/dbraw/zinc/44/09/72/598440972.db2.gz HCCRLKATXOSIQH-KTKRTIGZSA-N -1 3 369.450 3.596 20 0 FHADHM COc1ccccc1C(C)=CC(=O)Nc1sc(C)c(C)c1-c1nn[n-]n1 ZINC000737141123 598440973 /nfs/dbraw/zinc/44/09/73/598440973.db2.gz HCCRLKATXOSIQH-KTKRTIGZSA-N -1 3 369.450 3.596 20 0 FHADHM CCS[C@@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCC2)C(C)C ZINC000736664089 598441111 /nfs/dbraw/zinc/44/11/11/598441111.db2.gz IMWJUNMXKCIDGN-CYBMUJFWSA-N -1 3 365.528 3.523 20 0 FHADHM CCS[C@@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCC2)C(C)C ZINC000736664089 598441112 /nfs/dbraw/zinc/44/11/12/598441112.db2.gz IMWJUNMXKCIDGN-CYBMUJFWSA-N -1 3 365.528 3.523 20 0 FHADHM O=C(Nc1ccccc1Sc1ccccc1)c1ccc(-c2nnn[n-]2)cn1 ZINC000738196937 598441444 /nfs/dbraw/zinc/44/14/44/598441444.db2.gz PODZBCIHOWMUNW-UHFFFAOYSA-N -1 3 374.429 3.665 20 0 FHADHM O=C(Nc1ccccc1Sc1ccccc1)c1ccc(-c2nn[n-]n2)cn1 ZINC000738196937 598441445 /nfs/dbraw/zinc/44/14/45/598441445.db2.gz PODZBCIHOWMUNW-UHFFFAOYSA-N -1 3 374.429 3.665 20 0 FHADHM CC(=CC(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1)c1ccccc1Cl ZINC000735449386 598442300 /nfs/dbraw/zinc/44/23/00/598442300.db2.gz PQSRKEFSLSZHIW-QBFSEMIESA-N -1 3 367.840 3.582 20 0 FHADHM CC(=CC(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1)c1ccccc1Cl ZINC000735449386 598442302 /nfs/dbraw/zinc/44/23/02/598442302.db2.gz PQSRKEFSLSZHIW-QBFSEMIESA-N -1 3 367.840 3.582 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)C=C(C)c1ccccc1Cl ZINC000737058440 598444756 /nfs/dbraw/zinc/44/47/56/598444756.db2.gz LRWCGTLQKAQJSG-LUAWRHEFSA-N -1 3 369.812 3.571 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)C=C(C)c1ccccc1Cl ZINC000737058440 598444758 /nfs/dbraw/zinc/44/47/58/598444758.db2.gz LRWCGTLQKAQJSG-LUAWRHEFSA-N -1 3 369.812 3.571 20 0 FHADHM CC(=CC(=O)OCc1ccc(-c2nnn[n-]2)cc1)c1ccccc1Cl ZINC000735449466 598473703 /nfs/dbraw/zinc/47/37/03/598473703.db2.gz YXJDHAWEVPAVLZ-ZRDIBKRKSA-N -1 3 354.797 3.667 20 0 FHADHM CC(=CC(=O)OCc1ccc(-c2nn[n-]n2)cc1)c1ccccc1Cl ZINC000735449466 598473705 /nfs/dbraw/zinc/47/37/05/598473705.db2.gz YXJDHAWEVPAVLZ-ZRDIBKRKSA-N -1 3 354.797 3.667 20 0 FHADHM CCc1ccc(NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)cc1 ZINC000736690281 598474710 /nfs/dbraw/zinc/47/47/10/598474710.db2.gz IJJMHXUVHWFJOB-UHFFFAOYSA-N -1 3 362.437 3.626 20 0 FHADHM CCc1ccc(NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)cc1 ZINC000736690281 598474712 /nfs/dbraw/zinc/47/47/12/598474712.db2.gz IJJMHXUVHWFJOB-UHFFFAOYSA-N -1 3 362.437 3.626 20 0 FHADHM O=C(OCc1ccccc1-c1nnn[n-]1)[C@@H]1C[C@H]1c1cccc2ccccc21 ZINC000738235317 598476076 /nfs/dbraw/zinc/47/60/76/598476076.db2.gz QOGXVIJJEPQFPG-VQTJNVASSA-N -1 3 370.412 3.867 20 0 FHADHM O=C(OCc1ccccc1-c1nn[n-]n1)[C@@H]1C[C@H]1c1cccc2ccccc21 ZINC000738235317 598476078 /nfs/dbraw/zinc/47/60/78/598476078.db2.gz QOGXVIJJEPQFPG-VQTJNVASSA-N -1 3 370.412 3.867 20 0 FHADHM C[C@H](OC(=O)c1cnc(C(C)(C)C)s1)c1cccc(-c2nnn[n-]2)c1 ZINC000736163584 598481108 /nfs/dbraw/zinc/48/11/08/598481108.db2.gz PMOCJAJPXBAWBS-JTQLQIEISA-N -1 3 357.439 3.539 20 0 FHADHM C[C@H](OC(=O)c1cnc(C(C)(C)C)s1)c1cccc(-c2nn[n-]n2)c1 ZINC000736163584 598481110 /nfs/dbraw/zinc/48/11/10/598481110.db2.gz PMOCJAJPXBAWBS-JTQLQIEISA-N -1 3 357.439 3.539 20 0 FHADHM C[C@@H](CC(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1F ZINC000735975450 598482210 /nfs/dbraw/zinc/48/22/10/598482210.db2.gz GUBXPDAFBTUVJC-STQMWFEESA-N -1 3 354.385 3.804 20 0 FHADHM C[C@@H](CC(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1F ZINC000735975450 598482211 /nfs/dbraw/zinc/48/22/11/598482211.db2.gz GUBXPDAFBTUVJC-STQMWFEESA-N -1 3 354.385 3.804 20 0 FHADHM C[C@H](OC(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1)c1cccc(-c2nnn[n-]2)c1 ZINC000736151170 598484371 /nfs/dbraw/zinc/48/43/71/598484371.db2.gz LDAFMERHAMLEHD-LEWSCRJBSA-N -1 3 368.359 3.840 20 0 FHADHM C[C@H](OC(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1)c1cccc(-c2nn[n-]n2)c1 ZINC000736151170 598484373 /nfs/dbraw/zinc/48/43/73/598484373.db2.gz LDAFMERHAMLEHD-LEWSCRJBSA-N -1 3 368.359 3.840 20 0 FHADHM C[C@H](OC(=O)c1[nH]c2ccccc2c1Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000736157899 598484427 /nfs/dbraw/zinc/48/44/27/598484427.db2.gz DYYKKQZLXOSLRK-JTQLQIEISA-N -1 3 367.796 3.919 20 0 FHADHM C[C@H](OC(=O)c1[nH]c2ccccc2c1Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000736157899 598484429 /nfs/dbraw/zinc/48/44/29/598484429.db2.gz DYYKKQZLXOSLRK-JTQLQIEISA-N -1 3 367.796 3.919 20 0 FHADHM C[C@@H](OC(=O)COc1cccc2ccccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000736154983 598487544 /nfs/dbraw/zinc/48/75/44/598487544.db2.gz FCMSLOQEKBWSRB-CQSZACIVSA-N -1 3 374.400 3.703 20 0 FHADHM C[C@@H](OC(=O)COc1cccc2ccccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000736154983 598487546 /nfs/dbraw/zinc/48/75/46/598487546.db2.gz FCMSLOQEKBWSRB-CQSZACIVSA-N -1 3 374.400 3.703 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)c1cc2c(s1)CCCC2 ZINC000735661123 598487672 /nfs/dbraw/zinc/48/76/72/598487672.db2.gz JEAATGWAWHSKPR-UHFFFAOYSA-N -1 3 370.482 3.616 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)c1cc2c(s1)CCCC2 ZINC000735661123 598487673 /nfs/dbraw/zinc/48/76/73/598487673.db2.gz JEAATGWAWHSKPR-UHFFFAOYSA-N -1 3 370.482 3.616 20 0 FHADHM C[C@@H](CC(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C)c1ccccc1 ZINC000735974262 598488188 /nfs/dbraw/zinc/48/81/88/598488188.db2.gz GDUOLHUKBZASAN-ZDUSSCGKSA-N -1 3 352.442 3.556 20 0 FHADHM C[C@@H](CC(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C)c1ccccc1 ZINC000735974262 598488190 /nfs/dbraw/zinc/48/81/90/598488190.db2.gz GDUOLHUKBZASAN-ZDUSSCGKSA-N -1 3 352.442 3.556 20 0 FHADHM C[C@@H](OC(=O)/C=C\Sc1ccccc1)c1cccc(-c2nnn[n-]2)c1 ZINC000736153669 598489157 /nfs/dbraw/zinc/48/91/57/598489157.db2.gz RIBDHIWEBWRBOS-BSYHEUMXSA-N -1 3 352.419 3.777 20 0 FHADHM C[C@@H](OC(=O)/C=C\Sc1ccccc1)c1cccc(-c2nn[n-]n2)c1 ZINC000736153669 598489158 /nfs/dbraw/zinc/48/91/58/598489158.db2.gz RIBDHIWEBWRBOS-BSYHEUMXSA-N -1 3 352.419 3.777 20 0 FHADHM Cc1ccc(C(C)(C)C)cc1[S@](=O)Cc1cccc(-c2nnn[n-]2)c1 ZINC000737316463 598491012 /nfs/dbraw/zinc/49/10/12/598491012.db2.gz CLLIXBWJRGVYPI-RUZDIDTESA-N -1 3 354.479 3.780 20 0 FHADHM Cc1ccc(C(C)(C)C)cc1[S@](=O)Cc1cccc(-c2nn[n-]n2)c1 ZINC000737316463 598491013 /nfs/dbraw/zinc/49/10/13/598491013.db2.gz CLLIXBWJRGVYPI-RUZDIDTESA-N -1 3 354.479 3.780 20 0 FHADHM C[C@@H](OC(=O)[C@H](C)Oc1cccc(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000736180420 598491919 /nfs/dbraw/zinc/49/19/19/598491919.db2.gz ILEPSSISNIGYIT-NEPJUHHUSA-N -1 3 372.812 3.592 20 0 FHADHM C[C@@H](OC(=O)[C@H](C)Oc1cccc(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000736180420 598491921 /nfs/dbraw/zinc/49/19/21/598491921.db2.gz ILEPSSISNIGYIT-NEPJUHHUSA-N -1 3 372.812 3.592 20 0 FHADHM C[C@@H](NC(=O)C[C@@H]1CCCc2ccccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000736102028 598493093 /nfs/dbraw/zinc/49/30/93/598493093.db2.gz QBXRTIKZZNJDJP-KDOFPFPSSA-N -1 3 361.449 3.554 20 0 FHADHM C[C@@H](NC(=O)C[C@@H]1CCCc2ccccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000736102028 598493096 /nfs/dbraw/zinc/49/30/96/598493096.db2.gz QBXRTIKZZNJDJP-KDOFPFPSSA-N -1 3 361.449 3.554 20 0 FHADHM CCc1ccc([C@@H](C)C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCC3)cc1 ZINC000736684542 598496753 /nfs/dbraw/zinc/49/67/53/598496753.db2.gz APYGUFRXRHZAQQ-LLVKDONJSA-N -1 3 367.478 3.722 20 0 FHADHM CCc1ccc([C@@H](C)C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCC3)cc1 ZINC000736684542 598496755 /nfs/dbraw/zinc/49/67/55/598496755.db2.gz APYGUFRXRHZAQQ-LLVKDONJSA-N -1 3 367.478 3.722 20 0 FHADHM Cc1cccc(-c2noc(CSCc3cccc(-c4nnn[n-]4)c3)n2)c1 ZINC000737380433 598512315 /nfs/dbraw/zinc/51/23/15/598512315.db2.gz OQUQAJINLYVKJI-UHFFFAOYSA-N -1 3 364.434 3.659 20 0 FHADHM Cc1cccc(-c2noc(CSCc3cccc(-c4nn[n-]n4)c3)n2)c1 ZINC000737380433 598512317 /nfs/dbraw/zinc/51/23/17/598512317.db2.gz OQUQAJINLYVKJI-UHFFFAOYSA-N -1 3 364.434 3.659 20 0 FHADHM CCS[C@@H](C(=O)Nc1sc(C)c(CC)c1-c1nnn[n-]1)C(C)C ZINC000736664048 598513922 /nfs/dbraw/zinc/51/39/22/598513922.db2.gz HSJOESWYYSUGDV-GFCCVEGCSA-N -1 3 353.517 3.515 20 0 FHADHM CCS[C@@H](C(=O)Nc1sc(C)c(CC)c1-c1nn[n-]n1)C(C)C ZINC000736664048 598513924 /nfs/dbraw/zinc/51/39/24/598513924.db2.gz HSJOESWYYSUGDV-GFCCVEGCSA-N -1 3 353.517 3.515 20 0 FHADHM CC(C)CC[C@H]1CCC[C@@H]1NC(=O)CCc1ccc(-c2nnn[n-]2)cc1 ZINC000735796341 598519330 /nfs/dbraw/zinc/51/93/30/598519330.db2.gz AHCUOGJBEXKKFM-AEFFLSMTSA-N -1 3 355.486 3.520 20 0 FHADHM CC(C)CC[C@H]1CCC[C@@H]1NC(=O)CCc1ccc(-c2nn[n-]n2)cc1 ZINC000735796341 598519332 /nfs/dbraw/zinc/51/93/32/598519332.db2.gz AHCUOGJBEXKKFM-AEFFLSMTSA-N -1 3 355.486 3.520 20 0 FHADHM O=C(Nc1ccccc1-c1nnn[n-]1)c1ccc(SC(F)(F)F)cc1 ZINC000738191855 598532000 /nfs/dbraw/zinc/53/20/00/598532000.db2.gz LXIMTNRDGPURME-UHFFFAOYSA-N -1 3 365.340 3.731 20 0 FHADHM O=C(Nc1ccccc1-c1nn[n-]n1)c1ccc(SC(F)(F)F)cc1 ZINC000738191855 598532002 /nfs/dbraw/zinc/53/20/02/598532002.db2.gz LXIMTNRDGPURME-UHFFFAOYSA-N -1 3 365.340 3.731 20 0 FHADHM CCN(C(=O)Cc1cc(C)ccc1C)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736504170 598540733 /nfs/dbraw/zinc/54/07/33/598540733.db2.gz ASWSLZGBIYQSNX-INIZCTEOSA-N -1 3 363.465 3.636 20 0 FHADHM CCN(C(=O)Cc1cc(C)ccc1C)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736504170 598540734 /nfs/dbraw/zinc/54/07/34/598540734.db2.gz ASWSLZGBIYQSNX-INIZCTEOSA-N -1 3 363.465 3.636 20 0 FHADHM Cc1cc(OCc2cccc(-c3nnn[n-]3)c2)ccc1NC(=O)CC(C)C ZINC000737281412 598543030 /nfs/dbraw/zinc/54/30/30/598543030.db2.gz XWZJDLLVHWXPOL-UHFFFAOYSA-N -1 3 365.437 3.739 20 0 FHADHM Cc1cc(OCc2cccc(-c3nn[n-]n3)c2)ccc1NC(=O)CC(C)C ZINC000737281412 598543031 /nfs/dbraw/zinc/54/30/31/598543031.db2.gz XWZJDLLVHWXPOL-UHFFFAOYSA-N -1 3 365.437 3.739 20 0 FHADHM CCCCC[C@@H](NC(=O)c1sccc1-c1nnn[n-]1)c1ccccc1 ZINC000736441482 598543488 /nfs/dbraw/zinc/54/34/88/598543488.db2.gz QSDUMBWFFKOWBK-OAHLLOKOSA-N -1 3 355.467 3.980 20 0 FHADHM CCCCC[C@@H](NC(=O)c1sccc1-c1nn[n-]n1)c1ccccc1 ZINC000736441482 598543490 /nfs/dbraw/zinc/54/34/90/598543490.db2.gz QSDUMBWFFKOWBK-OAHLLOKOSA-N -1 3 355.467 3.980 20 0 FHADHM CC=CC=CC(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736301650 598543697 /nfs/dbraw/zinc/54/36/97/598543697.db2.gz BTWYQNACUPDMSX-HOJFPOIOSA-N -1 3 361.405 3.517 20 0 FHADHM CC=CC=CC(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736301650 598543698 /nfs/dbraw/zinc/54/36/98/598543698.db2.gz BTWYQNACUPDMSX-HOJFPOIOSA-N -1 3 361.405 3.517 20 0 FHADHM O=C(OCc1ccc(-c2nnn[n-]2)cc1)[C@@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000738236302 598544582 /nfs/dbraw/zinc/54/45/82/598544582.db2.gz ITVKJHUYVMZIRP-VQTJNVASSA-N -1 3 370.412 3.867 20 0 FHADHM O=C(OCc1ccc(-c2nn[n-]n2)cc1)[C@@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000738236302 598544584 /nfs/dbraw/zinc/54/45/84/598544584.db2.gz ITVKJHUYVMZIRP-VQTJNVASSA-N -1 3 370.412 3.867 20 0 FHADHM O=C(OCc1cccc(-c2nnn[n-]2)c1)[C@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000738233153 598544589 /nfs/dbraw/zinc/54/45/89/598544589.db2.gz QNKCXOKOOLAHIC-PMACEKPBSA-N -1 3 370.412 3.867 20 0 FHADHM O=C(OCc1cccc(-c2nn[n-]n2)c1)[C@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000738233153 598544591 /nfs/dbraw/zinc/54/45/91/598544591.db2.gz QNKCXOKOOLAHIC-PMACEKPBSA-N -1 3 370.412 3.867 20 0 FHADHM C[C@H]1CCCC[C@@H]1CC(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(F)F ZINC000736263449 598545079 /nfs/dbraw/zinc/54/50/79/598545079.db2.gz QUNYUJHKCBWSSE-WDEREUQCSA-N -1 3 365.384 3.623 20 0 FHADHM C[C@H]1CCCC[C@@H]1CC(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(F)F ZINC000736263449 598545081 /nfs/dbraw/zinc/54/50/81/598545081.db2.gz QUNYUJHKCBWSSE-WDEREUQCSA-N -1 3 365.384 3.623 20 0 FHADHM Cc1c2ccccc2sc1C(=O)COc1ccc(-c2nnn[n-]2)c(F)c1 ZINC000737201684 598550205 /nfs/dbraw/zinc/55/02/05/598550205.db2.gz GYDZFHLLWZEKPR-UHFFFAOYSA-N -1 3 368.393 3.791 20 0 FHADHM Cc1c2ccccc2sc1C(=O)COc1ccc(-c2nn[n-]n2)c(F)c1 ZINC000737201684 598550207 /nfs/dbraw/zinc/55/02/07/598550207.db2.gz GYDZFHLLWZEKPR-UHFFFAOYSA-N -1 3 368.393 3.791 20 0 FHADHM CC(=CC(=O)Nc1ccccc1-c1nnn[n-]1)c1ccc(C(F)(F)F)cc1 ZINC000735449087 598573163 /nfs/dbraw/zinc/57/31/63/598573163.db2.gz VKJUQNYEWLLANR-ZHACJKMWSA-N -1 3 373.338 3.928 20 0 FHADHM CC(=CC(=O)Nc1ccccc1-c1nn[n-]n1)c1ccc(C(F)(F)F)cc1 ZINC000735449087 598573165 /nfs/dbraw/zinc/57/31/65/598573165.db2.gz VKJUQNYEWLLANR-ZHACJKMWSA-N -1 3 373.338 3.928 20 0 FHADHM CCOc1cccc(CNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)c1 ZINC000736654695 598575160 /nfs/dbraw/zinc/57/51/60/598575160.db2.gz MIKFGRZIGZKMFE-UHFFFAOYSA-N -1 3 363.343 3.896 20 0 FHADHM CCOc1cccc(CNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)c1 ZINC000736654695 598575161 /nfs/dbraw/zinc/57/51/61/598575161.db2.gz MIKFGRZIGZKMFE-UHFFFAOYSA-N -1 3 363.343 3.896 20 0 FHADHM FC(F)(F)c1cc(NCc2cc3ccccc3[nH]2)ccc1-c1nnn[n-]1 ZINC000737633438 598578105 /nfs/dbraw/zinc/57/81/05/598578105.db2.gz RIASOLDOFAYENT-UHFFFAOYSA-N -1 3 358.327 3.979 20 0 FHADHM FC(F)(F)c1cc(NCc2cc3ccccc3[nH]2)ccc1-c1nn[n-]n1 ZINC000737633438 598578106 /nfs/dbraw/zinc/57/81/06/598578106.db2.gz RIASOLDOFAYENT-UHFFFAOYSA-N -1 3 358.327 3.979 20 0 FHADHM Fc1cc(Nc2nccs2)ccc1OCc1cccc(-c2nnn[n-]2)c1 ZINC000737650232 598602409 /nfs/dbraw/zinc/60/24/09/598602409.db2.gz GUDXSGZGBZOBSK-UHFFFAOYSA-N -1 3 368.397 3.785 20 0 FHADHM Fc1cc(Nc2nccs2)ccc1OCc1cccc(-c2nn[n-]n2)c1 ZINC000737650232 598602410 /nfs/dbraw/zinc/60/24/10/598602410.db2.gz GUDXSGZGBZOBSK-UHFFFAOYSA-N -1 3 368.397 3.785 20 0 FHADHM CC(C)c1cc(NC(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)n[nH]1 ZINC000735923014 598604104 /nfs/dbraw/zinc/60/41/04/598604104.db2.gz RWEWONNRPRPYQS-UHFFFAOYSA-N -1 3 373.420 3.633 20 0 FHADHM CC(C)c1cc(NC(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)n[nH]1 ZINC000735923014 598604105 /nfs/dbraw/zinc/60/41/05/598604105.db2.gz RWEWONNRPRPYQS-UHFFFAOYSA-N -1 3 373.420 3.633 20 0 FHADHM FC(F)(F)c1cccc(-c2noc(-c3ccc(-c4nnn[n-]4)cc3)n2)c1 ZINC000737635516 598609364 /nfs/dbraw/zinc/60/93/64/598609364.db2.gz IPQBMOUHBLYDST-UHFFFAOYSA-N -1 3 358.283 3.603 20 0 FHADHM FC(F)(F)c1cccc(-c2noc(-c3ccc(-c4nn[n-]n4)cc3)n2)c1 ZINC000737635516 598609366 /nfs/dbraw/zinc/60/93/66/598609366.db2.gz IPQBMOUHBLYDST-UHFFFAOYSA-N -1 3 358.283 3.603 20 0 FHADHM Cc1ccc([C@@H](C)NC(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)cc1C ZINC000737321273 598629625 /nfs/dbraw/zinc/62/96/25/598629625.db2.gz SHSYIZHLPAFXEL-GFCCVEGCSA-N -1 3 354.389 3.505 20 0 FHADHM Cc1ccc([C@@H](C)NC(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)cc1C ZINC000737321273 598629627 /nfs/dbraw/zinc/62/96/27/598629627.db2.gz SHSYIZHLPAFXEL-GFCCVEGCSA-N -1 3 354.389 3.505 20 0 FHADHM Clc1cc(N2CCC(OCc3ccccc3)CC2)ccc1-c1nnn[n-]1 ZINC000737564857 598638042 /nfs/dbraw/zinc/63/80/42/598638042.db2.gz KPHNHJIYFLLXJH-UHFFFAOYSA-N -1 3 369.856 3.706 20 0 FHADHM Clc1cc(N2CCC(OCc3ccccc3)CC2)ccc1-c1nn[n-]n1 ZINC000737564857 598638044 /nfs/dbraw/zinc/63/80/44/598638044.db2.gz KPHNHJIYFLLXJH-UHFFFAOYSA-N -1 3 369.856 3.706 20 0 FHADHM CCCCn1c(C)c(C)nc1SCc1ccc(F)cc1-c1nnn[n-]1 ZINC000736467295 598644141 /nfs/dbraw/zinc/64/41/41/598644141.db2.gz BMLTYGDJGNPVSV-UHFFFAOYSA-N -1 3 360.462 3.912 20 0 FHADHM CCCCn1c(C)c(C)nc1SCc1ccc(F)cc1-c1nn[n-]n1 ZINC000736467295 598644143 /nfs/dbraw/zinc/64/41/43/598644143.db2.gz BMLTYGDJGNPVSV-UHFFFAOYSA-N -1 3 360.462 3.912 20 0 FHADHM Fc1ccc(COc2ccc(Cl)c3cccnc23)c(-c2nnn[n-]2)c1 ZINC000737647348 598644928 /nfs/dbraw/zinc/64/49/28/598644928.db2.gz CEOWOLLQTYJUJW-UHFFFAOYSA-N -1 3 355.760 3.786 20 0 FHADHM Fc1ccc(COc2ccc(Cl)c3cccnc23)c(-c2nn[n-]n2)c1 ZINC000737647348 598644930 /nfs/dbraw/zinc/64/49/30/598644930.db2.gz CEOWOLLQTYJUJW-UHFFFAOYSA-N -1 3 355.760 3.786 20 0 FHADHM O=C(CCCCOc1cccc(-c2nnn[n-]2)c1)OC1CCCCCC1 ZINC000737840678 598645592 /nfs/dbraw/zinc/64/55/92/598645592.db2.gz CRENDGLEXLVUKV-UHFFFAOYSA-N -1 3 358.442 3.682 20 0 FHADHM O=C(CCCCOc1cccc(-c2nn[n-]n2)c1)OC1CCCCCC1 ZINC000737840678 598645593 /nfs/dbraw/zinc/64/55/93/598645593.db2.gz CRENDGLEXLVUKV-UHFFFAOYSA-N -1 3 358.442 3.682 20 0 FHADHM CCn1c(CSc2ccc(-c3nnn[n-]3)cc2)nc2c1cccc2F ZINC000736714703 598645762 /nfs/dbraw/zinc/64/57/62/598645762.db2.gz UITPDSVCHUENOL-UHFFFAOYSA-N -1 3 354.414 3.668 20 0 FHADHM CCn1c(CSc2ccc(-c3nn[n-]n3)cc2)nc2c1cccc2F ZINC000736714703 598645764 /nfs/dbraw/zinc/64/57/64/598645764.db2.gz UITPDSVCHUENOL-UHFFFAOYSA-N -1 3 354.414 3.668 20 0 FHADHM C[C@H]1CCC[C@@H](OC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)C1 ZINC000736253330 598646147 /nfs/dbraw/zinc/64/61/47/598646147.db2.gz MXSOKXZLUDUGMI-WMLDXEAASA-N -1 3 358.442 3.538 20 0 FHADHM C[C@H]1CCC[C@@H](OC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)C1 ZINC000736253330 598646150 /nfs/dbraw/zinc/64/61/50/598646150.db2.gz MXSOKXZLUDUGMI-WMLDXEAASA-N -1 3 358.442 3.538 20 0 FHADHM CCCC(C)(C)NC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736416488 598658129 /nfs/dbraw/zinc/65/81/29/598658129.db2.gz OFIKQWOWDMCDRC-UHFFFAOYSA-N -1 3 365.437 3.968 20 0 FHADHM CCCC(C)(C)NC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736416488 598658131 /nfs/dbraw/zinc/65/81/31/598658131.db2.gz OFIKQWOWDMCDRC-UHFFFAOYSA-N -1 3 365.437 3.968 20 0 FHADHM O=C(CSc1ccc(-c2nnn[n-]2)cc1)N1CCC2(CCCCC2)CC1 ZINC000737941452 598659452 /nfs/dbraw/zinc/65/94/52/598659452.db2.gz BCKSPTCSKFJGKT-UHFFFAOYSA-N -1 3 371.510 3.532 20 0 FHADHM O=C(CSc1ccc(-c2nn[n-]n2)cc1)N1CCC2(CCCCC2)CC1 ZINC000737941452 598659453 /nfs/dbraw/zinc/65/94/53/598659453.db2.gz BCKSPTCSKFJGKT-UHFFFAOYSA-N -1 3 371.510 3.532 20 0 FHADHM FC(F)COc1cccc(CNc2ccc(-c3nnn[n-]3)c(Cl)c2)c1 ZINC000737639314 598669474 /nfs/dbraw/zinc/66/94/74/598669474.db2.gz QXOTVADXCIKFMF-UHFFFAOYSA-N -1 3 365.771 3.776 20 0 FHADHM FC(F)COc1cccc(CNc2ccc(-c3nn[n-]n3)c(Cl)c2)c1 ZINC000737639314 598669476 /nfs/dbraw/zinc/66/94/76/598669476.db2.gz QXOTVADXCIKFMF-UHFFFAOYSA-N -1 3 365.771 3.776 20 0 FHADHM CC[C@H](c1ccccc1)N(CC(C)C)C(=O)c1ccc(-c2nnn[n-]2)cn1 ZINC000736392346 598672222 /nfs/dbraw/zinc/67/22/22/598672222.db2.gz QUCWIECXMIQHBB-GOSISDBHSA-N -1 3 364.453 3.511 20 0 FHADHM CC[C@H](c1ccccc1)N(CC(C)C)C(=O)c1ccc(-c2nn[n-]n2)cn1 ZINC000736392346 598672225 /nfs/dbraw/zinc/67/22/25/598672225.db2.gz QUCWIECXMIQHBB-GOSISDBHSA-N -1 3 364.453 3.511 20 0 FHADHM C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736298462 598727618 /nfs/dbraw/zinc/72/76/18/598727618.db2.gz QAQANYJRVJNDCP-QLJPJBMISA-N -1 3 368.828 3.575 20 0 FHADHM C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736298462 598727620 /nfs/dbraw/zinc/72/76/20/598727620.db2.gz QAQANYJRVJNDCP-QLJPJBMISA-N -1 3 368.828 3.575 20 0 FHADHM C[C@@H](OC(=O)CCCCOc1cccc(-c2nnn[n-]2)c1)c1cccs1 ZINC000736150885 598735391 /nfs/dbraw/zinc/73/53/91/598735391.db2.gz OPCJAUNXWQXBBS-CYBMUJFWSA-N -1 3 372.450 3.782 20 0 FHADHM C[C@@H](OC(=O)CCCCOc1cccc(-c2nn[n-]n2)c1)c1cccs1 ZINC000736150885 598735392 /nfs/dbraw/zinc/73/53/92/598735392.db2.gz OPCJAUNXWQXBBS-CYBMUJFWSA-N -1 3 372.450 3.782 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H](C)Cc2ccccc2)c1-c1nnn[n-]1 ZINC000736669257 598741550 /nfs/dbraw/zinc/74/15/50/598741550.db2.gz BDWIOJAJXKQMNJ-LLVKDONJSA-N -1 3 355.467 3.616 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H](C)Cc2ccccc2)c1-c1nn[n-]n1 ZINC000736669257 598741552 /nfs/dbraw/zinc/74/15/52/598741552.db2.gz BDWIOJAJXKQMNJ-LLVKDONJSA-N -1 3 355.467 3.616 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)C[C@@H]2CCc3ccccc3C2)s1 ZINC000736678678 598741831 /nfs/dbraw/zinc/74/18/31/598741831.db2.gz DRPIALNLXCGYLE-GFCCVEGCSA-N -1 3 367.478 3.624 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)C[C@@H]2CCc3ccccc3C2)s1 ZINC000736678678 598741832 /nfs/dbraw/zinc/74/18/32/598741832.db2.gz DRPIALNLXCGYLE-GFCCVEGCSA-N -1 3 367.478 3.624 20 0 FHADHM CC[C@@H](Cc1ccccc1)C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2 ZINC000736353751 598763213 /nfs/dbraw/zinc/76/32/13/598763213.db2.gz XSTXSZSVTICJJY-ZDUSSCGKSA-N -1 3 367.478 3.624 20 0 FHADHM CC[C@@H](Cc1ccccc1)C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2 ZINC000736353751 598763214 /nfs/dbraw/zinc/76/32/14/598763214.db2.gz XSTXSZSVTICJJY-ZDUSSCGKSA-N -1 3 367.478 3.624 20 0 FHADHM CC(C)(C)SCCNc1c(-c2nnn[n-]2)cnc2c(F)cc(F)cc21 ZINC000735644093 598771353 /nfs/dbraw/zinc/77/13/53/598771353.db2.gz UMHRPGNLZWHTTC-UHFFFAOYSA-N -1 3 364.425 3.637 20 0 FHADHM CC(C)(C)SCCNc1c(-c2nn[n-]n2)cnc2c(F)cc(F)cc21 ZINC000735644093 598771354 /nfs/dbraw/zinc/77/13/54/598771354.db2.gz UMHRPGNLZWHTTC-UHFFFAOYSA-N -1 3 364.425 3.637 20 0 FHADHM CC(C)CC(CC(C)C)NC(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000735762299 598777030 /nfs/dbraw/zinc/77/70/30/598777030.db2.gz XBKFIPJDJWGEGN-AWEZNQCLSA-N -1 3 358.490 3.688 20 0 FHADHM CC(C)CC(CC(C)C)NC(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000735762299 598777032 /nfs/dbraw/zinc/77/70/32/598777032.db2.gz XBKFIPJDJWGEGN-AWEZNQCLSA-N -1 3 358.490 3.688 20 0 FHADHM Fc1ccc(OCc2nc(-c3ccc(-c4nnn[n-]4)cc3)cs2)cc1 ZINC000737657594 598777142 /nfs/dbraw/zinc/77/71/42/598777142.db2.gz XQKMRPNTOQYDFF-UHFFFAOYSA-N -1 3 353.382 3.708 20 0 FHADHM Fc1ccc(OCc2nc(-c3ccc(-c4nn[n-]n4)cc3)cs2)cc1 ZINC000737657594 598777144 /nfs/dbraw/zinc/77/71/44/598777144.db2.gz XQKMRPNTOQYDFF-UHFFFAOYSA-N -1 3 353.382 3.708 20 0 FHADHM O=C(Nc1ccc2[nH]ccc2c1)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000738174798 598782612 /nfs/dbraw/zinc/78/26/12/598782612.db2.gz MQDSOKKPDDGWPE-UHFFFAOYSA-N -1 3 373.420 3.545 20 0 FHADHM O=C(Nc1ccc2[nH]ccc2c1)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000738174798 598782614 /nfs/dbraw/zinc/78/26/14/598782614.db2.gz MQDSOKKPDDGWPE-UHFFFAOYSA-N -1 3 373.420 3.545 20 0 FHADHM Cc1ccccc1[C@@H](NC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)C1CC1 ZINC000737418513 598782678 /nfs/dbraw/zinc/78/26/78/598782678.db2.gz BRSOABBXSZKJQB-KRWDZBQOSA-N -1 3 366.400 3.587 20 0 FHADHM Cc1ccccc1[C@@H](NC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)C1CC1 ZINC000737418513 598782679 /nfs/dbraw/zinc/78/26/79/598782679.db2.gz BRSOABBXSZKJQB-KRWDZBQOSA-N -1 3 366.400 3.587 20 0 FHADHM O=C(Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1)C1CCSCC1 ZINC000738211761 598791035 /nfs/dbraw/zinc/79/10/35/598791035.db2.gz XWDXGQPOHMPSID-UHFFFAOYSA-N -1 3 371.491 3.677 20 0 FHADHM O=C(Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1)C1CCSCC1 ZINC000738211761 598791036 /nfs/dbraw/zinc/79/10/36/598791036.db2.gz XWDXGQPOHMPSID-UHFFFAOYSA-N -1 3 371.491 3.677 20 0 FHADHM Cc1sc(NC(=O)C2(c3ccccc3)CCC2)c(-c2nnn[n-]2)c1C ZINC000737559854 598793070 /nfs/dbraw/zinc/79/30/70/598793070.db2.gz BAWHNEQJBWNGBF-UHFFFAOYSA-N -1 3 353.451 3.605 20 0 FHADHM Cc1sc(NC(=O)C2(c3ccccc3)CCC2)c(-c2nn[n-]n2)c1C ZINC000737559854 598793072 /nfs/dbraw/zinc/79/30/72/598793072.db2.gz BAWHNEQJBWNGBF-UHFFFAOYSA-N -1 3 353.451 3.605 20 0 FHADHM Clc1ccc(N2CCC(OC3CCCCC3)CC2)c(-c2nnn[n-]2)c1 ZINC000737573826 598794772 /nfs/dbraw/zinc/79/47/72/598794772.db2.gz CHUGRFJTZCTEAK-UHFFFAOYSA-N -1 3 361.877 3.838 20 0 FHADHM Clc1ccc(N2CCC(OC3CCCCC3)CC2)c(-c2nn[n-]n2)c1 ZINC000737573826 598794773 /nfs/dbraw/zinc/79/47/73/598794773.db2.gz CHUGRFJTZCTEAK-UHFFFAOYSA-N -1 3 361.877 3.838 20 0 FHADHM FC(F)Oc1ccc(CCNc2cccc(Cl)c2-c2nnn[n-]2)cc1 ZINC000822733351 599311738 /nfs/dbraw/zinc/31/17/38/599311738.db2.gz YYWLVVHTGFFTGB-UHFFFAOYSA-N -1 3 365.771 3.776 20 0 FHADHM FC(F)Oc1ccc(CCNc2cccc(Cl)c2-c2nn[n-]n2)cc1 ZINC000822733351 599311742 /nfs/dbraw/zinc/31/17/42/599311742.db2.gz YYWLVVHTGFFTGB-UHFFFAOYSA-N -1 3 365.771 3.776 20 0 FHADHM C[C@H](c1ccc(-c2nnn[n-]2)cc1)N1CCO[C@H](c2ccccc2Cl)C1 ZINC000736201240 599314260 /nfs/dbraw/zinc/31/42/60/599314260.db2.gz WJIMRIVWZPHXSV-ACJLOTCBSA-N -1 3 369.856 3.655 20 0 FHADHM C[C@H](c1ccc(-c2nn[n-]n2)cc1)N1CCO[C@H](c2ccccc2Cl)C1 ZINC000736201240 599314262 /nfs/dbraw/zinc/31/42/62/599314262.db2.gz WJIMRIVWZPHXSV-ACJLOTCBSA-N -1 3 369.856 3.655 20 0 FHADHM C[C@@H](SCc1noc(-c2cccs2)n1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736192171 599325532 /nfs/dbraw/zinc/32/55/32/599325532.db2.gz LGVOLOLGZBQECH-SNVBAGLBSA-N -1 3 370.463 3.973 20 0 FHADHM C[C@@H](SCc1noc(-c2cccs2)n1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736192171 599325534 /nfs/dbraw/zinc/32/55/34/599325534.db2.gz LGVOLOLGZBQECH-SNVBAGLBSA-N -1 3 370.463 3.973 20 0 FHADHM C[C@@H](SCc1ccc2c(c1)OCCO2)c1ccc(-c2nnn[n-]2)cc1 ZINC000736189830 599325874 /nfs/dbraw/zinc/32/58/74/599325874.db2.gz CQEQDWOPIVSFGY-GFCCVEGCSA-N -1 3 354.435 3.632 20 0 FHADHM C[C@@H](SCc1ccc2c(c1)OCCO2)c1ccc(-c2nn[n-]n2)cc1 ZINC000736189830 599325877 /nfs/dbraw/zinc/32/58/77/599325877.db2.gz CQEQDWOPIVSFGY-GFCCVEGCSA-N -1 3 354.435 3.632 20 0 FHADHM C[C@@H](S[C@@H](C)C(=O)Nc1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736188003 599327877 /nfs/dbraw/zinc/32/78/77/599327877.db2.gz GIYSBZQJOCOVOI-OLZOCXBDSA-N -1 3 353.451 3.688 20 0 FHADHM C[C@@H](S[C@@H](C)C(=O)Nc1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736188003 599327880 /nfs/dbraw/zinc/32/78/80/599327880.db2.gz GIYSBZQJOCOVOI-OLZOCXBDSA-N -1 3 353.451 3.688 20 0 FHADHM C[C@@H](S[C@H](C)c1ccc(-c2nnn[n-]2)cc1)C(=O)Nc1ccccc1 ZINC000736188002 599328113 /nfs/dbraw/zinc/32/81/13/599328113.db2.gz GIYSBZQJOCOVOI-CHWSQXEVSA-N -1 3 353.451 3.688 20 0 FHADHM C[C@@H](S[C@H](C)c1ccc(-c2nn[n-]n2)cc1)C(=O)Nc1ccccc1 ZINC000736188002 599328116 /nfs/dbraw/zinc/32/81/16/599328116.db2.gz GIYSBZQJOCOVOI-CHWSQXEVSA-N -1 3 353.451 3.688 20 0 FHADHM C[C@@H](NC(=O)CS[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1cccs1 ZINC000736103792 599328132 /nfs/dbraw/zinc/32/81/32/599328132.db2.gz FEPWHSRZEXOTQK-NEPJUHHUSA-N -1 3 373.507 3.600 20 0 FHADHM C[C@@H](NC(=O)CS[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1cccs1 ZINC000736103792 599328135 /nfs/dbraw/zinc/32/81/35/599328135.db2.gz FEPWHSRZEXOTQK-NEPJUHHUSA-N -1 3 373.507 3.600 20 0 FHADHM C[C@@H](S[C@@H](C)C(=O)NCC1CCCCC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736190351 599328876 /nfs/dbraw/zinc/32/88/76/599328876.db2.gz RKASBGPRBUJSEB-KGLIPLIRSA-N -1 3 373.526 3.746 20 0 FHADHM C[C@@H](S[C@@H](C)C(=O)NCC1CCCCC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736190351 599328879 /nfs/dbraw/zinc/32/88/79/599328879.db2.gz RKASBGPRBUJSEB-KGLIPLIRSA-N -1 3 373.526 3.746 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NCc1ccc(Br)s1 ZINC000737296228 599329022 /nfs/dbraw/zinc/32/90/22/599329022.db2.gz FTHNRNYFUSVYIY-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NCc1ccc(Br)s1 ZINC000737296228 599329024 /nfs/dbraw/zinc/32/90/24/599329024.db2.gz FTHNRNYFUSVYIY-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM Cc1ccc(C)c(NC(=O)CS[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737325336 599332452 /nfs/dbraw/zinc/33/24/52/599332452.db2.gz DBXSEEZHZDJUER-CQSZACIVSA-N -1 3 367.478 3.916 20 0 FHADHM Cc1ccc(C)c(NC(=O)CS[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737325336 599332455 /nfs/dbraw/zinc/33/24/55/599332455.db2.gz DBXSEEZHZDJUER-CQSZACIVSA-N -1 3 367.478 3.916 20 0 FHADHM CC(C)[C@H](Sc1ccccc1-c1nnn[n-]1)C(=O)N[C@@H]1CCCC[C@H]1C ZINC000820033594 599348865 /nfs/dbraw/zinc/34/88/65/599348865.db2.gz XJHUDMJSFDVJMM-UNEWFSDZSA-N -1 3 373.526 3.678 20 0 FHADHM CC(C)[C@H](Sc1ccccc1-c1nn[n-]n1)C(=O)N[C@@H]1CCCC[C@H]1C ZINC000820033594 599348867 /nfs/dbraw/zinc/34/88/67/599348867.db2.gz XJHUDMJSFDVJMM-UNEWFSDZSA-N -1 3 373.526 3.678 20 0 FHADHM CCN(C(=O)Nc1cc(C)ccc1F)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736505436 599352054 /nfs/dbraw/zinc/35/20/54/599352054.db2.gz IMORVQBMJZDSGH-ZDUSSCGKSA-N -1 3 368.416 3.929 20 0 FHADHM CCN(C(=O)Nc1cc(C)ccc1F)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736505436 599352058 /nfs/dbraw/zinc/35/20/58/599352058.db2.gz IMORVQBMJZDSGH-ZDUSSCGKSA-N -1 3 368.416 3.929 20 0 FHADHM C[C@@H](Nc1ncnc2cc(Cl)ccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000820461252 599354928 /nfs/dbraw/zinc/35/49/28/599354928.db2.gz GHWURQQFJURWNB-SNVBAGLBSA-N -1 3 351.801 3.636 20 0 FHADHM C[C@@H](Nc1ncnc2cc(Cl)ccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000820461252 599354932 /nfs/dbraw/zinc/35/49/32/599354932.db2.gz GHWURQQFJURWNB-SNVBAGLBSA-N -1 3 351.801 3.636 20 0 FHADHM CCOc1ccc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1OCC ZINC000821422139 599363055 /nfs/dbraw/zinc/36/30/55/599363055.db2.gz PCLZUJMBNPNCRG-ZDUSSCGKSA-N -1 3 353.426 3.837 20 0 FHADHM CCOc1ccc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1OCC ZINC000821422139 599363058 /nfs/dbraw/zinc/36/30/58/599363058.db2.gz PCLZUJMBNPNCRG-ZDUSSCGKSA-N -1 3 353.426 3.837 20 0 FHADHM C[C@H](NCc1ccc(-c2nnn[n-]2)cc1F)c1ncc(-c2ccccc2)o1 ZINC000820426687 599375287 /nfs/dbraw/zinc/37/52/87/599375287.db2.gz MJTGMLWLJCPZDM-LBPRGKRZSA-N -1 3 364.384 3.512 20 0 FHADHM C[C@H](NCc1ccc(-c2nn[n-]n2)cc1F)c1ncc(-c2ccccc2)o1 ZINC000820426687 599375290 /nfs/dbraw/zinc/37/52/90/599375290.db2.gz MJTGMLWLJCPZDM-LBPRGKRZSA-N -1 3 364.384 3.512 20 0 FHADHM O=C(NCCCC1CC1)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000738055308 599379416 /nfs/dbraw/zinc/37/94/16/599379416.db2.gz KLIKWOXWEPSMGS-UHFFFAOYSA-N -1 3 363.421 3.579 20 0 FHADHM O=C(NCCCC1CC1)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000738055308 599379417 /nfs/dbraw/zinc/37/94/17/599379417.db2.gz KLIKWOXWEPSMGS-UHFFFAOYSA-N -1 3 363.421 3.579 20 0 FHADHM CN(Cc1nc2ccccc2s1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000736832035 599397748 /nfs/dbraw/zinc/39/77/48/599397748.db2.gz YFRYYUSOUUBESP-UHFFFAOYSA-N -1 3 356.842 3.766 20 0 FHADHM CN(Cc1nc2ccccc2s1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000736832035 599397751 /nfs/dbraw/zinc/39/77/51/599397751.db2.gz YFRYYUSOUUBESP-UHFFFAOYSA-N -1 3 356.842 3.766 20 0 FHADHM C[C@@H](NC(=O)N[C@@H](C)c1ccc(Cl)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000820353387 599398321 /nfs/dbraw/zinc/39/83/21/599398321.db2.gz ZPVBKQDGQVPKAG-NWDGAFQWSA-N -1 3 370.844 3.642 20 0 FHADHM C[C@@H](NC(=O)N[C@@H](C)c1ccc(Cl)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000820353387 599398323 /nfs/dbraw/zinc/39/83/23/599398323.db2.gz ZPVBKQDGQVPKAG-NWDGAFQWSA-N -1 3 370.844 3.642 20 0 FHADHM CCOc1ccc(CNc2cc(Cl)ccc2-c2nnn[n-]2)cc1OC ZINC000736644889 599406065 /nfs/dbraw/zinc/40/60/65/599406065.db2.gz SXTGLQRIHAMIQS-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM CCOc1ccc(CNc2cc(Cl)ccc2-c2nn[n-]n2)cc1OC ZINC000736644889 599406066 /nfs/dbraw/zinc/40/60/66/599406066.db2.gz SXTGLQRIHAMIQS-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(NCc2csc(Br)c2)c1 ZINC000737571076 599410171 /nfs/dbraw/zinc/41/01/71/599410171.db2.gz QOBPJPFOJFNZRI-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(NCc2csc(Br)c2)c1 ZINC000737571076 599410174 /nfs/dbraw/zinc/41/01/74/599410174.db2.gz QOBPJPFOJFNZRI-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM Cc1ccc(C)n1C1CCN(c2cc(Cl)ccc2-c2nnn[n-]2)CC1 ZINC000737332385 599422828 /nfs/dbraw/zinc/42/28/28/599422828.db2.gz UEACIMZBPSEYMN-UHFFFAOYSA-N -1 3 356.861 3.780 20 0 FHADHM Cc1ccc(C)n1C1CCN(c2cc(Cl)ccc2-c2nn[n-]n2)CC1 ZINC000737332385 599422829 /nfs/dbraw/zinc/42/28/29/599422829.db2.gz UEACIMZBPSEYMN-UHFFFAOYSA-N -1 3 356.861 3.780 20 0 FHADHM Cc1cccc(Oc2ccccc2CNCc2ccc(-c3nnn[n-]3)o2)c1 ZINC000822333097 599431870 /nfs/dbraw/zinc/43/18/70/599431870.db2.gz WIDKKGIWWDRWMW-UHFFFAOYSA-N -1 3 361.405 3.850 20 0 FHADHM Cc1cccc(Oc2ccccc2CNCc2ccc(-c3nn[n-]n3)o2)c1 ZINC000822333097 599431872 /nfs/dbraw/zinc/43/18/72/599431872.db2.gz WIDKKGIWWDRWMW-UHFFFAOYSA-N -1 3 361.405 3.850 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@H]1NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820073850 599432427 /nfs/dbraw/zinc/43/24/27/599432427.db2.gz WJAGNYQMLZCYQB-RVKKMQEKSA-N -1 3 370.501 3.832 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@H]1NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820073850 599432428 /nfs/dbraw/zinc/43/24/28/599432428.db2.gz WJAGNYQMLZCYQB-RVKKMQEKSA-N -1 3 370.501 3.832 20 0 FHADHM C[C@@H](CCC1CCCCC1)NC(=O)NCc1cc(-c2nnn[n-]2)ccc1F ZINC000820242232 599440913 /nfs/dbraw/zinc/44/09/13/599440913.db2.gz LYDOVNYZMYFCCC-ZDUSSCGKSA-N -1 3 374.464 3.554 20 0 FHADHM C[C@@H](CCC1CCCCC1)NC(=O)NCc1cc(-c2nn[n-]n2)ccc1F ZINC000820242232 599440914 /nfs/dbraw/zinc/44/09/14/599440914.db2.gz LYDOVNYZMYFCCC-ZDUSSCGKSA-N -1 3 374.464 3.554 20 0 FHADHM CCN(c1ccccc1)c1ccc(CNCc2ccc(-c3nnn[n-]3)o2)cc1 ZINC000821242633 599451966 /nfs/dbraw/zinc/45/19/66/599451966.db2.gz VRULWVWVNVJJHJ-UHFFFAOYSA-N -1 3 374.448 3.908 20 0 FHADHM CCCCC1CCC(NC(=O)NCc2cc(-c3nnn[n-]3)ccc2F)CC1 ZINC000821043169 599463603 /nfs/dbraw/zinc/46/36/03/599463603.db2.gz MJWSVQIEFJZKLI-UHFFFAOYSA-N -1 3 374.464 3.554 20 0 FHADHM CCCCC1CCC(NC(=O)NCc2cc(-c3nn[n-]n3)ccc2F)CC1 ZINC000821043169 599463606 /nfs/dbraw/zinc/46/36/06/599463606.db2.gz MJWSVQIEFJZKLI-UHFFFAOYSA-N -1 3 374.464 3.554 20 0 FHADHM c1cc2nccc(NCCSCc3ccccc3-c3nn[n-]n3)c2s1 ZINC000823771966 599466617 /nfs/dbraw/zinc/46/66/17/599466617.db2.gz GLVCYYTUPRHPBD-UHFFFAOYSA-N -1 3 368.491 3.822 20 0 FHADHM CO[C@@H](CNc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)c1ccccc1 ZINC000821677403 599468912 /nfs/dbraw/zinc/46/89/12/599468912.db2.gz WHQSLAMCLBDCKF-HNNXBMFYSA-N -1 3 363.343 3.685 20 0 FHADHM CO[C@@H](CNc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)c1ccccc1 ZINC000821677403 599468913 /nfs/dbraw/zinc/46/89/13/599468913.db2.gz WHQSLAMCLBDCKF-HNNXBMFYSA-N -1 3 363.343 3.685 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1NCc1ccc(Br)s1 ZINC000822585536 599472734 /nfs/dbraw/zinc/47/27/34/599472734.db2.gz CWYNYLXTFZSYRN-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1NCc1ccc(Br)s1 ZINC000822585536 599472735 /nfs/dbraw/zinc/47/27/35/599472735.db2.gz CWYNYLXTFZSYRN-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM CC[C@@H](NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(C)cc1 ZINC000820921133 599474928 /nfs/dbraw/zinc/47/49/28/599474928.db2.gz WFBDMDKUZJBLKP-RDTXWAMCSA-N -1 3 364.453 3.687 20 0 FHADHM CC[C@@H](NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(C)cc1 ZINC000820921133 599474930 /nfs/dbraw/zinc/47/49/30/599474930.db2.gz WFBDMDKUZJBLKP-RDTXWAMCSA-N -1 3 364.453 3.687 20 0 FHADHM C[C@@H](NC(=O)N1CCC[C@@H]1c1ccsc1)c1cccc(-c2nnn[n-]2)c1 ZINC000820348179 599477739 /nfs/dbraw/zinc/47/77/39/599477739.db2.gz ASFSNKQBYXXOLP-MLGOLLRUSA-N -1 3 368.466 3.536 20 0 FHADHM C[C@@H](NC(=O)N1CCC[C@@H]1c1ccsc1)c1cccc(-c2nn[n-]n2)c1 ZINC000820348179 599477741 /nfs/dbraw/zinc/47/77/41/599477741.db2.gz ASFSNKQBYXXOLP-MLGOLLRUSA-N -1 3 368.466 3.536 20 0 FHADHM CCCOc1ccc([C@@H](C)Nc2ccc(F)cc2-c2nnn[n-]2)cc1OC ZINC000821134097 599480067 /nfs/dbraw/zinc/48/00/67/599480067.db2.gz NSSAKKZTLZCCRR-GFCCVEGCSA-N -1 3 371.416 3.976 20 0 FHADHM CCCOc1ccc([C@@H](C)Nc2ccc(F)cc2-c2nn[n-]n2)cc1OC ZINC000821134097 599480070 /nfs/dbraw/zinc/48/00/70/599480070.db2.gz NSSAKKZTLZCCRR-GFCCVEGCSA-N -1 3 371.416 3.976 20 0 FHADHM C[C@H](NC(=O)N1CCC[C@@H]1c1cccs1)c1cccc(-c2nnn[n-]2)c1 ZINC000820349881 599485949 /nfs/dbraw/zinc/48/59/49/599485949.db2.gz JXIMJNJSGTXCTD-SWLSCSKDSA-N -1 3 368.466 3.536 20 0 FHADHM C[C@H](NC(=O)N1CCC[C@@H]1c1cccs1)c1cccc(-c2nn[n-]n2)c1 ZINC000820349881 599485951 /nfs/dbraw/zinc/48/59/51/599485951.db2.gz JXIMJNJSGTXCTD-SWLSCSKDSA-N -1 3 368.466 3.536 20 0 FHADHM CCC(=CC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(C)cc1 ZINC000820832766 599499998 /nfs/dbraw/zinc/49/99/98/599499998.db2.gz NPKMHRLSPFOWIY-NWCRWOLESA-N -1 3 361.449 3.846 20 0 FHADHM CCC(=CC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(C)cc1 ZINC000820832766 599500001 /nfs/dbraw/zinc/50/00/01/599500001.db2.gz NPKMHRLSPFOWIY-NWCRWOLESA-N -1 3 361.449 3.846 20 0 FHADHM CCCCc1ccc(CC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000821077761 599512551 /nfs/dbraw/zinc/51/25/51/599512551.db2.gz RZPXJRXCCLOVFX-OAHLLOKOSA-N -1 3 363.465 3.629 20 0 FHADHM CCCCc1ccc(CC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000821077761 599512554 /nfs/dbraw/zinc/51/25/54/599512554.db2.gz RZPXJRXCCLOVFX-OAHLLOKOSA-N -1 3 363.465 3.629 20 0 FHADHM C[C@H](NC(=O)C[C@H]1CCCc2ccccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000820321586 599515789 /nfs/dbraw/zinc/51/57/89/599515789.db2.gz IXFSRHVOWWJODC-WMLDXEAASA-N -1 3 361.449 3.554 20 0 FHADHM C[C@H](NC(=O)C[C@H]1CCCc2ccccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000820321586 599515791 /nfs/dbraw/zinc/51/57/91/599515791.db2.gz IXFSRHVOWWJODC-WMLDXEAASA-N -1 3 361.449 3.554 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1NCCCc1nc2c(s1)CCCC2 ZINC000822581254 599519758 /nfs/dbraw/zinc/51/97/58/599519758.db2.gz GCFCVTQZUSDTPC-UHFFFAOYSA-N -1 3 374.901 3.900 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1NCCCc1nc2c(s1)CCCC2 ZINC000822581254 599519759 /nfs/dbraw/zinc/51/97/59/599519759.db2.gz GCFCVTQZUSDTPC-UHFFFAOYSA-N -1 3 374.901 3.900 20 0 FHADHM COc1ccc(CNc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)cc1F ZINC000737095822 599521209 /nfs/dbraw/zinc/52/12/09/599521209.db2.gz OTGJQLVJFKFDLD-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM CCOc1ccc(CNc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)cc1 ZINC000736644594 599522802 /nfs/dbraw/zinc/52/28/02/599522802.db2.gz LHSADHZROWNHQR-UHFFFAOYSA-N -1 3 363.343 3.896 20 0 FHADHM CCCO[C@@H]1CCCN(c2ccc(-c3nn[n-]n3)cc2C(F)(F)F)CC1 ZINC000736488570 599524161 /nfs/dbraw/zinc/52/41/61/599524161.db2.gz PBZSCGMFHILTIM-CYBMUJFWSA-N -1 3 369.391 3.671 20 0 FHADHM C[C@@H](SCCC(=O)Nc1cccc(-c2nnn[n-]2)c1)c1cccs1 ZINC000736187539 599524534 /nfs/dbraw/zinc/52/45/34/599524534.db2.gz BPHLVOIVSUDFQN-LLVKDONJSA-N -1 3 359.480 3.751 20 0 FHADHM C[C@@H](SCCC(=O)Nc1cccc(-c2nn[n-]n2)c1)c1cccs1 ZINC000736187539 599524537 /nfs/dbraw/zinc/52/45/37/599524537.db2.gz BPHLVOIVSUDFQN-LLVKDONJSA-N -1 3 359.480 3.751 20 0 FHADHM Cc1nc(C)c(CCNc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)s1 ZINC000737474801 599524879 /nfs/dbraw/zinc/52/48/79/599524879.db2.gz VAXGPAMZGMGKGD-UHFFFAOYSA-N -1 3 368.388 3.613 20 0 FHADHM FC(F)(F)c1cc(-c2nn[n-]n2)ccc1N1CCCc2sccc2C1 ZINC000737625620 599525475 /nfs/dbraw/zinc/52/54/75/599525475.db2.gz CQTBUCDSUSNWJU-UHFFFAOYSA-N -1 3 365.384 3.900 20 0 FHADHM C[C@@H](NC(=O)CCc1ccc2ccccc2c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820328599 599528481 /nfs/dbraw/zinc/52/84/81/599528481.db2.gz PTBYKJJINPVAQG-OAHLLOKOSA-N -1 3 371.444 3.830 20 0 FHADHM C[C@@H](NC(=O)CCc1ccc2ccccc2c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820328599 599528483 /nfs/dbraw/zinc/52/84/83/599528483.db2.gz PTBYKJJINPVAQG-OAHLLOKOSA-N -1 3 371.444 3.830 20 0 FHADHM CCCC(O)(CCC)CNc1ccc(-c2nn[n-]n2)cc1C(F)(F)F ZINC000736434364 599530215 /nfs/dbraw/zinc/53/02/15/599530215.db2.gz FHOLLDZTWKSKON-UHFFFAOYSA-N -1 3 357.380 3.629 20 0 FHADHM Cc1noc(C)c1C[C@@H](C)Nc1ccc(-c2nn[n-]n2)cc1C(F)(F)F ZINC000737541166 599531510 /nfs/dbraw/zinc/53/15/10/599531510.db2.gz YTOSJDLDJQIMPC-MRVPVSSYSA-N -1 3 366.347 3.533 20 0 FHADHM CC(C)(C)CCC(=O)Nc1nc(-c2ccc(-c3nnn[n-]3)cc2)cs1 ZINC000735602861 599539330 /nfs/dbraw/zinc/53/93/30/599539330.db2.gz HPCJNCXOVQTJKV-UHFFFAOYSA-N -1 3 356.455 3.755 20 0 FHADHM CC(C)(C)CCC(=O)Nc1nc(-c2ccc(-c3nn[n-]n3)cc2)cs1 ZINC000735602861 599539332 /nfs/dbraw/zinc/53/93/32/599539332.db2.gz HPCJNCXOVQTJKV-UHFFFAOYSA-N -1 3 356.455 3.755 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCC2)c1cccs1 ZINC000735571168 599539414 /nfs/dbraw/zinc/53/94/14/599539414.db2.gz SXQARKAOZWXVMO-VIFPVBQESA-N -1 3 359.480 3.611 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCC2)c1cccs1 ZINC000735571168 599539416 /nfs/dbraw/zinc/53/94/16/599539416.db2.gz SXQARKAOZWXVMO-VIFPVBQESA-N -1 3 359.480 3.611 20 0 FHADHM CC(C)CN(C(=O)[C@@H](C)c1cccs1)c1ccc(-c2nnn[n-]2)cc1 ZINC000735818656 599541490 /nfs/dbraw/zinc/54/14/90/599541490.db2.gz QIAFSFIJUSLAFE-ZDUSSCGKSA-N -1 3 355.467 3.721 20 0 FHADHM CC(C)CN(C(=O)[C@@H](C)c1cccs1)c1ccc(-c2nn[n-]n2)cc1 ZINC000735818656 599541493 /nfs/dbraw/zinc/54/14/93/599541493.db2.gz QIAFSFIJUSLAFE-ZDUSSCGKSA-N -1 3 355.467 3.721 20 0 FHADHM CCN(C(=O)[C@H](C)c1ccsc1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736502571 599541908 /nfs/dbraw/zinc/54/19/08/599541908.db2.gz NYBPIOUCMYCSPL-OLZOCXBDSA-N -1 3 355.467 3.641 20 0 FHADHM CCN(C(=O)[C@H](C)c1ccsc1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736502571 599541911 /nfs/dbraw/zinc/54/19/11/599541911.db2.gz NYBPIOUCMYCSPL-OLZOCXBDSA-N -1 3 355.467 3.641 20 0 FHADHM CC[C@H](CC(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1)c1ccc(C)cc1 ZINC000736331782 599542502 /nfs/dbraw/zinc/54/25/02/599542502.db2.gz KQPIAJCWCFIAMH-QGZVFWFLSA-N -1 3 363.465 3.717 20 0 FHADHM CC[C@H](CC(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1)c1ccc(C)cc1 ZINC000736331782 599542504 /nfs/dbraw/zinc/54/25/04/599542504.db2.gz KQPIAJCWCFIAMH-QGZVFWFLSA-N -1 3 363.465 3.717 20 0 FHADHM CCN(C(=O)[C@@H](C)c1ccsc1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736502572 599542555 /nfs/dbraw/zinc/54/25/55/599542555.db2.gz NYBPIOUCMYCSPL-QWHCGFSZSA-N -1 3 355.467 3.641 20 0 FHADHM CCN(C(=O)[C@@H](C)c1ccsc1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736502572 599542558 /nfs/dbraw/zinc/54/25/58/599542558.db2.gz NYBPIOUCMYCSPL-QWHCGFSZSA-N -1 3 355.467 3.641 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1NCc1ccc(Br)cc1 ZINC000822586366 599542615 /nfs/dbraw/zinc/54/26/15/599542615.db2.gz WJKHXAKSYAURAQ-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1NCc1ccc(Br)cc1 ZINC000822586366 599542616 /nfs/dbraw/zinc/54/26/16/599542616.db2.gz WJKHXAKSYAURAQ-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)CC/C=C\c2ccccc2)s1 ZINC000736678215 599543967 /nfs/dbraw/zinc/54/39/67/599543967.db2.gz ARTVTBGOIRYELE-POHAHGRESA-N -1 3 353.451 3.923 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)CC/C=C\c2ccccc2)s1 ZINC000736678215 599543969 /nfs/dbraw/zinc/54/39/69/599543969.db2.gz ARTVTBGOIRYELE-POHAHGRESA-N -1 3 353.451 3.923 20 0 FHADHM COc1ccc2[nH]cc(CCNc3c(Cl)cccc3-c3nnn[n-]3)c2c1 ZINC000821849327 599556043 /nfs/dbraw/zinc/55/60/43/599556043.db2.gz DHMKETWJFXNQMV-UHFFFAOYSA-N -1 3 368.828 3.665 20 0 FHADHM COc1ccc2[nH]cc(CCNc3c(Cl)cccc3-c3nn[n-]n3)c2c1 ZINC000821849327 599556045 /nfs/dbraw/zinc/55/60/45/599556045.db2.gz DHMKETWJFXNQMV-UHFFFAOYSA-N -1 3 368.828 3.665 20 0 FHADHM CC(C)[C@@H](C)N(C)C(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735703884 599561768 /nfs/dbraw/zinc/56/17/68/599561768.db2.gz XEWDTQSPDTUYHM-CQSZACIVSA-N -1 3 364.453 3.727 20 0 FHADHM CC(C)[C@H](C)N(C)C(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735703882 599562286 /nfs/dbraw/zinc/56/22/86/599562286.db2.gz XEWDTQSPDTUYHM-AWEZNQCLSA-N -1 3 364.453 3.727 20 0 FHADHM CC(C)(C)CCNC(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000735601934 599563717 /nfs/dbraw/zinc/56/37/17/599563717.db2.gz GWHMQWXIEGQTGQ-UHFFFAOYSA-N -1 3 364.453 3.776 20 0 FHADHM CC[C@H](C)[C@@H]1CCCCN1C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000736330635 599599127 /nfs/dbraw/zinc/59/91/27/599599127.db2.gz NBXDFPDCTGRMAA-ZFWWWQNUSA-N -1 3 373.505 3.856 20 0 FHADHM CC[C@H](C)[C@@H]1CCCCN1C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000736330635 599599129 /nfs/dbraw/zinc/59/91/29/599599129.db2.gz NBXDFPDCTGRMAA-ZFWWWQNUSA-N -1 3 373.505 3.856 20 0 FHADHM Cc1ccc([C@H]2CCCCCN2C(=O)Nc2ccc(-c3nnn[n-]3)cc2)o1 ZINC000737328144 599601463 /nfs/dbraw/zinc/60/14/63/599601463.db2.gz CTCFDYIPNGMBIR-MRXNPFEDSA-N -1 3 366.425 3.917 20 0 FHADHM Cc1ccc([C@H]2CCCCCN2C(=O)Nc2ccc(-c3nn[n-]n3)cc2)o1 ZINC000737328144 599601465 /nfs/dbraw/zinc/60/14/65/599601465.db2.gz CTCFDYIPNGMBIR-MRXNPFEDSA-N -1 3 366.425 3.917 20 0 FHADHM Cc1ccc([C@H]2CCCCCN2C(=O)Nc2cccc(-c3nnn[n-]3)c2)o1 ZINC000737331046 599601763 /nfs/dbraw/zinc/60/17/63/599601763.db2.gz OMUKGYPSDKPNNX-MRXNPFEDSA-N -1 3 366.425 3.917 20 0 FHADHM Cc1ccc([C@H]2CCCCCN2C(=O)Nc2cccc(-c3nn[n-]n3)c2)o1 ZINC000737331046 599601765 /nfs/dbraw/zinc/60/17/65/599601765.db2.gz OMUKGYPSDKPNNX-MRXNPFEDSA-N -1 3 366.425 3.917 20 0 FHADHM O=C(CC1CCC1)Nc1sc2c(c1-c1nnn[n-]1)-c1ccccc1CC2 ZINC000822941354 599630890 /nfs/dbraw/zinc/63/08/90/599630890.db2.gz VSVPXSQWCRMBTO-UHFFFAOYSA-N -1 3 365.462 3.823 20 0 FHADHM O=C(CC1CCC1)Nc1sc2c(c1-c1nn[n-]n1)-c1ccccc1CC2 ZINC000822941354 599630891 /nfs/dbraw/zinc/63/08/91/599630891.db2.gz VSVPXSQWCRMBTO-UHFFFAOYSA-N -1 3 365.462 3.823 20 0 FHADHM O=C(C=Cc1cccs1)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000822935241 599633151 /nfs/dbraw/zinc/63/31/51/599633151.db2.gz IJNJGKQQFOZXNG-XQRVVYSFSA-N -1 3 365.340 3.599 20 0 FHADHM O=C(C=Cc1cccs1)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000822935241 599633152 /nfs/dbraw/zinc/63/31/52/599633152.db2.gz IJNJGKQQFOZXNG-XQRVVYSFSA-N -1 3 365.340 3.599 20 0 FHADHM Cc1cc(F)cc(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)c1 ZINC000822203391 599633655 /nfs/dbraw/zinc/63/36/55/599633655.db2.gz REXOWMAUOCDXHC-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM 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ZINC000820116370 599675215 /nfs/dbraw/zinc/67/52/15/599675215.db2.gz JCSRRBUJSVICIE-UHFFFAOYSA-N -1 3 370.501 3.756 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)NC1CCC(C)(C)CC1 ZINC000820116370 599675216 /nfs/dbraw/zinc/67/52/16/599675216.db2.gz JCSRRBUJSVICIE-UHFFFAOYSA-N -1 3 370.501 3.756 20 0 FHADHM FC(F)(F)C1CCC(CNc2ncc(-c3nnn[n-]3)cc2Cl)CC1 ZINC000822714611 599689506 /nfs/dbraw/zinc/68/95/06/599689506.db2.gz QIUNGUWAPNOFET-UHFFFAOYSA-N -1 3 360.771 3.696 20 0 FHADHM FC(F)(F)C1CCC(CNc2ncc(-c3nn[n-]n3)cc2Cl)CC1 ZINC000822714611 599689507 /nfs/dbraw/zinc/68/95/07/599689507.db2.gz QIUNGUWAPNOFET-UHFFFAOYSA-N -1 3 360.771 3.696 20 0 FHADHM Fc1cc(-c2nnn[n-]2)cc(F)c1NCC1CCC(C(F)(F)F)CC1 ZINC000822737450 599689557 /nfs/dbraw/zinc/68/95/57/599689557.db2.gz WAGPGTRBDBEBHF-UHFFFAOYSA-N -1 3 361.318 3.926 20 0 FHADHM Fc1cc(-c2nn[n-]n2)cc(F)c1NCC1CCC(C(F)(F)F)CC1 ZINC000822737450 599689558 /nfs/dbraw/zinc/68/95/58/599689558.db2.gz WAGPGTRBDBEBHF-UHFFFAOYSA-N -1 3 361.318 3.926 20 0 FHADHM CN(C(=O)CN1CCC[C@@H](c2ccccc2)CC1)c1ccccc1C(=O)[O-] ZINC000737323787 599709316 /nfs/dbraw/zinc/70/93/16/599709316.db2.gz HQNOHKRTLFWLCF-GOSISDBHSA-N -1 3 366.461 3.617 20 0 FHADHM Cc1ccc(C(=O)C2CCN([C@H](C(=O)[O-])c3ccc(F)cc3)CC2)cc1 ZINC000579967342 599711485 /nfs/dbraw/zinc/71/14/85/599711485.db2.gz DSZBDCQTEONNQA-IBGZPJMESA-N -1 3 355.409 3.855 20 0 FHADHM Cc1ccc(C(=O)[O-])cc1NC(=O)CNC1(c2ccc(F)cc2)CCCC1 ZINC000738534371 599712672 /nfs/dbraw/zinc/71/26/72/599712672.db2.gz ZUSIIJPUEIMQDF-UHFFFAOYSA-N -1 3 370.424 3.830 20 0 FHADHM Cc1ccc(C(=O)[O-])cc1NC(=O)CN[C@@H](c1ccc(F)cc1)C1CCC1 ZINC000738532986 599793079 /nfs/dbraw/zinc/79/30/79/599793079.db2.gz QLZSAVYJXALCHU-HXUWFJFHSA-N -1 3 370.424 3.902 20 0 FHADHM CC(C)Oc1ccc(NC(=O)c2ccc(Cl)s2)cc1-c1nnn[n-]1 ZINC000820170171 607397090 /nfs/dbraw/zinc/39/70/90/607397090.db2.gz SUWDNTUHYIBHIQ-UHFFFAOYSA-N -1 3 363.830 3.621 20 0 FHADHM CC(C)Oc1ccc(NC(=O)c2ccc(Cl)s2)cc1-c1nn[n-]n1 ZINC000820170171 607397092 /nfs/dbraw/zinc/39/70/92/607397092.db2.gz SUWDNTUHYIBHIQ-UHFFFAOYSA-N -1 3 363.830 3.621 20 0 FHADHM CC(C)Oc1ccc(NC(=O)c2sccc2C2CC2)cc1-c1nnn[n-]1 ZINC000820174694 607397488 /nfs/dbraw/zinc/39/74/88/607397488.db2.gz WEYDYFUABCOHKH-UHFFFAOYSA-N -1 3 369.450 3.845 20 0 FHADHM CC(C)Oc1ccc(NC(=O)c2sccc2C2CC2)cc1-c1nn[n-]n1 ZINC000820174694 607397489 /nfs/dbraw/zinc/39/74/89/607397489.db2.gz WEYDYFUABCOHKH-UHFFFAOYSA-N -1 3 369.450 3.845 20 0 FHADHM O=C([O-])CN(Cc1ccc(F)c(F)c1)Cc1ccc(F)c2cccnc12 ZINC000739795126 599866220 /nfs/dbraw/zinc/86/62/20/599866220.db2.gz AWTHWDWXBOCDIY-UHFFFAOYSA-N -1 3 360.335 3.739 20 0 FHADHM O=C([O-])c1sc2ccccc2c1CN1CCN(c2ccccc2)CC1 ZINC000327298210 599935685 /nfs/dbraw/zinc/93/56/85/599935685.db2.gz PNPPNRYIDKYTOF-UHFFFAOYSA-N -1 3 352.459 3.922 20 0 FHADHM O=C([O-])c1sc2ccccc2c1CN1CCN(c2ccccc2O)CC1 ZINC000740281723 599936802 /nfs/dbraw/zinc/93/68/02/599936802.db2.gz WBBZRYQIXRUEDY-UHFFFAOYSA-N -1 3 368.458 3.627 20 0 FHADHM O=C([O-])c1cc(Cl)ccc1OC(=O)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000740074865 599969528 /nfs/dbraw/zinc/96/95/28/599969528.db2.gz FFLDWXOQELVASF-HNNXBMFYSA-N -1 3 373.836 3.856 20 0 FHADHM CCN(C)c1ccccc1CNCc1cc(C)c(OCC(=O)[O-])c(C)c1 ZINC000737069356 600008709 /nfs/dbraw/zinc/00/87/09/600008709.db2.gz SXPRNHBDDLSBNZ-UHFFFAOYSA-N -1 3 356.466 3.513 20 0 FHADHM O=C([O-])c1occc1CN(CCCO)C(c1ccccc1)c1ccccc1 ZINC000740280958 600014761 /nfs/dbraw/zinc/01/47/61/600014761.db2.gz FRFHKHFFJVIXMS-UHFFFAOYSA-N -1 3 365.429 3.952 20 0 FHADHM C[C@H](c1ccc(C(=O)[O-])o1)N1CCC[C@H](CN(C)C(=O)OC(C)(C)C)C1 ZINC000736716588 600025467 /nfs/dbraw/zinc/02/54/67/600025467.db2.gz HNGIXNLYEMLWIF-ZIAGYGMSSA-N -1 3 366.458 3.618 20 0 FHADHM CCSc1ccc(CC(=O)Nc2sc(C)c(C)c2-c2nnn[n-]2)cc1 ZINC000825674658 607783311 /nfs/dbraw/zinc/78/33/11/607783311.db2.gz PLXQAHPXRMDQGR-UHFFFAOYSA-N -1 3 373.507 3.838 20 0 FHADHM CCSc1ccc(CC(=O)Nc2sc(C)c(C)c2-c2nn[n-]n2)cc1 ZINC000825674658 607783312 /nfs/dbraw/zinc/78/33/12/607783312.db2.gz PLXQAHPXRMDQGR-UHFFFAOYSA-N -1 3 373.507 3.838 20 0 FHADHM CC(C)CCN(C(=O)Nc1ccc(OC(C)C)c(-c2nnn[n-]2)c1)C1CC1 ZINC000820072109 607423821 /nfs/dbraw/zinc/42/38/21/607423821.db2.gz BPMMUDITHSEJFE-UHFFFAOYSA-N -1 3 372.473 3.696 20 0 FHADHM CC(C)CCN(C(=O)Nc1ccc(OC(C)C)c(-c2nn[n-]n2)c1)C1CC1 ZINC000820072109 607423823 /nfs/dbraw/zinc/42/38/23/607423823.db2.gz BPMMUDITHSEJFE-UHFFFAOYSA-N -1 3 372.473 3.696 20 0 FHADHM Cc1ccc(C(=O)[O-])cc1NC(=O)[C@H](C)N(C)C[C@@H](C)c1ccccc1 ZINC000738521044 600144132 /nfs/dbraw/zinc/14/41/32/600144132.db2.gz XTEAOBUJYXMWRC-CVEARBPZSA-N -1 3 354.450 3.756 20 0 FHADHM Cc1ccccc1NC(=O)Nc1ccc(OC(C)C)c(-c2nnn[n-]2)c1 ZINC000822361408 607428493 /nfs/dbraw/zinc/42/84/93/607428493.db2.gz AGRGPGLJNGFCRV-UHFFFAOYSA-N -1 3 352.398 3.606 20 0 FHADHM Cc1ccccc1NC(=O)Nc1ccc(OC(C)C)c(-c2nn[n-]n2)c1 ZINC000822361408 607428494 /nfs/dbraw/zinc/42/84/94/607428494.db2.gz AGRGPGLJNGFCRV-UHFFFAOYSA-N -1 3 352.398 3.606 20 0 FHADHM Cc1ccsc1[C@H]1C[C@H]1C(=O)Nc1sc(C)c(C)c1-c1nnn[n-]1 ZINC000826316517 607428962 /nfs/dbraw/zinc/42/89/62/607428962.db2.gz QWQBOTYUZIEWPX-WDEREUQCSA-N -1 3 359.480 3.657 20 0 FHADHM Cc1ccsc1[C@H]1C[C@H]1C(=O)Nc1sc(C)c(C)c1-c1nn[n-]n1 ZINC000826316517 607428965 /nfs/dbraw/zinc/42/89/65/607428965.db2.gz QWQBOTYUZIEWPX-WDEREUQCSA-N -1 3 359.480 3.657 20 0 FHADHM CC(C)Oc1ccc(NC(=O)N[C@@H](C)c2ccccc2)cc1-c1nnn[n-]1 ZINC000820164846 607428983 /nfs/dbraw/zinc/42/89/83/607428983.db2.gz MCGMQZSTPXWVOW-ZDUSSCGKSA-N -1 3 366.425 3.537 20 0 FHADHM CC(C)Oc1ccc(NC(=O)N[C@@H](C)c2ccccc2)cc1-c1nn[n-]n1 ZINC000820164846 607428985 /nfs/dbraw/zinc/42/89/85/607428985.db2.gz MCGMQZSTPXWVOW-ZDUSSCGKSA-N -1 3 366.425 3.537 20 0 FHADHM CC(C)(C)[C@@H]1CCCN(CC(=O)NCc2ccc(NC(=O)[O-])cc2)CC1 ZINC000736252425 600216382 /nfs/dbraw/zinc/21/63/82/600216382.db2.gz PNPIVPHSZKPKJM-MRXNPFEDSA-N -1 3 361.486 3.541 20 0 FHADHM O=C([O-])CCCN1CCN(Cc2ccc(-c3cccc(F)c3)s2)CC1 ZINC000116349277 600224356 /nfs/dbraw/zinc/22/43/56/600224356.db2.gz HHCSLVAPXZUHKG-UHFFFAOYSA-N -1 3 362.470 3.537 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1[C@H](C)C[C@H](c2ccccc2)[C@H]1C ZINC000826244613 607432309 /nfs/dbraw/zinc/43/23/09/607432309.db2.gz YRIGFQHWBDNJPQ-CLCXKQKWSA-N -1 3 361.449 3.582 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1[C@H](C)C[C@H](c2ccccc2)[C@H]1C ZINC000826244613 607432311 /nfs/dbraw/zinc/43/23/11/607432311.db2.gz YRIGFQHWBDNJPQ-CLCXKQKWSA-N -1 3 361.449 3.582 20 0 FHADHM CN(C)Cc1c2ccccc2oc1C(=O)Nc1ccc(CNC(=O)[O-])cc1 ZINC000737368358 600295177 /nfs/dbraw/zinc/29/51/77/600295177.db2.gz NLVQZGMABFPFGK-UHFFFAOYSA-N -1 3 367.405 3.514 20 0 FHADHM CCC[C@](C)(NCc1csc(-c2cccc(OC)c2OC)n1)C(=O)[O-] ZINC000736963216 600323024 /nfs/dbraw/zinc/32/30/24/600323024.db2.gz UWOJLJWYSFDFBN-SFHVURJKSA-N -1 3 364.467 3.560 20 0 FHADHM C[C@@H](c1ccc(C(=O)[O-])o1)N1CCC(CN2CCc3ccccc32)CC1 ZINC000736718073 600334753 /nfs/dbraw/zinc/33/47/53/600334753.db2.gz QNWVSUOTWKNHMS-HNNXBMFYSA-N -1 3 354.450 3.814 20 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Cc1ccc([C@@H]2CCC[C@H]2N(C)CC(=O)Nc2ccsc2C(=O)[O-])cc1 ZINC000832931264 600840063 /nfs/dbraw/zinc/84/00/63/600840063.db2.gz VFVRFYRPFVOOSV-DOTOQJQBSA-N -1 3 372.490 3.961 20 0 FHADHM CCN(CCOc1ccc(Br)cc1)Cc1occc1C(=O)[O-] ZINC000568067531 600974915 /nfs/dbraw/zinc/97/49/15/600974915.db2.gz YADKKOWVLQRRQR-UHFFFAOYSA-N -1 3 368.227 3.641 20 0 FHADHM CC1CCN(c2ccc(NCc3ccc(-c4nn[n-]n4)cc3F)cc2)CC1 ZINC000820727687 607488393 /nfs/dbraw/zinc/48/83/93/607488393.db2.gz NVQVARLNXFGJQA-UHFFFAOYSA-N -1 3 366.444 3.854 20 0 FHADHM C[C@H](c1ccc(C(=O)[O-])o1)N1CCC[C@H](c2cc(C(F)(F)F)n[nH]2)C1 ZINC000736715929 601118904 /nfs/dbraw/zinc/11/89/04/601118904.db2.gz DCERUPNENWATAB-ZJUUUORDSA-N -1 3 357.332 3.660 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1CNc1cccc(SC(F)F)c1 ZINC000822744198 607489865 /nfs/dbraw/zinc/48/98/65/607489865.db2.gz OGSPTPMDFFFBHS-UHFFFAOYSA-N -1 3 351.357 3.933 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CNc1cccc(SC(F)F)c1 ZINC000822744198 607489866 /nfs/dbraw/zinc/48/98/66/607489866.db2.gz 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Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1nc(-c2cccs2)cs1 ZINC000826250452 607687433 /nfs/dbraw/zinc/68/74/33/607687433.db2.gz BSIXBABNWBAGAJ-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1nc(-c2cccs2)cs1 ZINC000826250452 607687435 /nfs/dbraw/zinc/68/74/35/607687435.db2.gz BSIXBABNWBAGAJ-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM O=C([O-])c1sc2ccccc2c1CN1CCC([C@H](O)C(F)(F)F)CC1 ZINC000833347986 604370697 /nfs/dbraw/zinc/37/06/97/604370697.db2.gz YQPSRWUVZYQADJ-HNNXBMFYSA-N -1 3 373.396 3.735 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1ccnc(Oc2ccccc2)c1 ZINC000826250631 607690026 /nfs/dbraw/zinc/69/00/26/607690026.db2.gz JSBYXVYXCIJRSN-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1ccnc(Oc2ccccc2)c1 ZINC000826250631 607690029 /nfs/dbraw/zinc/69/00/29/607690029.db2.gz JSBYXVYXCIJRSN-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM CCN(CC)[C@H](CNC(=O)Nc1cc(C(=O)[O-])cs1)c1ccsc1 ZINC000829666388 604520988 /nfs/dbraw/zinc/52/09/88/604520988.db2.gz FYEHCROBOWVKRN-CYBMUJFWSA-N -1 3 367.496 3.712 20 0 FHADHM Cc1ccc(C(C)(C)CN(C)C(=O)c2ccc(-c3nnn[n-]3)cc2C)cc1 ZINC000826282559 607696452 /nfs/dbraw/zinc/69/64/52/607696452.db2.gz UQEVZUDWSFVQQM-UHFFFAOYSA-N -1 3 363.465 3.533 20 0 FHADHM Cc1ccc(C(C)(C)CN(C)C(=O)c2ccc(-c3nn[n-]n3)cc2C)cc1 ZINC000826282559 607696454 /nfs/dbraw/zinc/69/64/54/607696454.db2.gz UQEVZUDWSFVQQM-UHFFFAOYSA-N -1 3 363.465 3.533 20 0 FHADHM Cc1cc([C@@H](C)OC(=O)[C@H]2CCCN(Cc3ccccc3)C2)oc1C(=O)[O-] ZINC000832873263 604585863 /nfs/dbraw/zinc/58/58/63/604585863.db2.gz FRRLVDGOZWJCIL-WBVHZDCISA-N -1 3 371.433 3.803 20 0 FHADHM C[C@H](Oc1ccc(CN2CCS[C@H](c3ccccc3)C2)cc1)C(=O)[O-] ZINC000833539722 604653607 /nfs/dbraw/zinc/65/36/07/604653607.db2.gz IAJKORYQJVHXNL-KXBFYZLASA-N -1 3 357.475 3.829 20 0 FHADHM O=C(Nc1ccc(O)cc1)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000826455118 607708181 /nfs/dbraw/zinc/70/81/81/607708181.db2.gz ZTWHQBUXGZKGTE-UHFFFAOYSA-N -1 3 372.388 3.568 20 0 FHADHM O=C([O-])CCCN(Cc1ccccc1)Cc1cncc(Br)c1 ZINC000833226762 604803625 /nfs/dbraw/zinc/80/36/25/604803625.db2.gz FDAPAXDICXPRDP-UHFFFAOYSA-N -1 3 363.255 3.711 20 0 FHADHM CN(C(=O)CN[C@@H](c1ccc(F)cc1)C(C)(C)C)c1ccccc1C(=O)[O-] ZINC000833685158 604922276 /nfs/dbraw/zinc/92/22/76/604922276.db2.gz BSGUTDMNSXETFS-IBGZPJMESA-N -1 3 372.440 3.864 20 0 FHADHM CC(C)(C(=O)[O-])[C@H]1CCCN(Cc2nn(-c3ccccc3)c3c2CCC3)C1 ZINC000652500056 604954718 /nfs/dbraw/zinc/95/47/18/604954718.db2.gz YUSONDSKZVCRPJ-INIZCTEOSA-N -1 3 367.493 3.684 20 0 FHADHM COc1cc([C@H](C)N[C@@H](C(=O)[O-])c2cccnc2)ccc1OC1CCCC1 ZINC000831955543 604993286 /nfs/dbraw/zinc/99/32/86/604993286.db2.gz LDFITVYHEQYBDX-VBKZILBWSA-N -1 3 370.449 3.888 20 0 FHADHM O=C([O-])[C@@H](NCc1ccc(-c2ccc3c(c2)CCO3)cc1)c1cccnc1 ZINC000833165223 604998320 /nfs/dbraw/zinc/99/83/20/604998320.db2.gz GVJZGDWHKVHFPY-NRFANRHFSA-N -1 3 360.413 3.599 20 0 FHADHM Clc1cc(N2CCS[C@H](c3ccccc3)C2)ccc1-c1nnn[n-]1 ZINC000826350539 607728304 /nfs/dbraw/zinc/72/83/04/607728304.db2.gz AODWDTZNCZOJCL-INIZCTEOSA-N -1 3 357.870 3.815 20 0 FHADHM Clc1cc(N2CCS[C@H](c3ccccc3)C2)ccc1-c1nn[n-]n1 ZINC000826350539 607728305 /nfs/dbraw/zinc/72/83/05/607728305.db2.gz AODWDTZNCZOJCL-INIZCTEOSA-N -1 3 357.870 3.815 20 0 FHADHM C[C@@]1(NCc2coc(-c3c(F)cccc3F)n2)CCCC[C@H]1C(=O)[O-] ZINC000833568413 605070744 /nfs/dbraw/zinc/07/07/44/605070744.db2.gz FIEJYRSGJPLKTD-KPZWWZAWSA-N -1 3 350.365 3.743 20 0 FHADHM CC(C)N(Cc1ccc(C(=O)[O-])[nH]1)Cc1ccc(Br)cc1 ZINC000833496310 605103456 /nfs/dbraw/zinc/10/34/56/605103456.db2.gz FRCYSMMWEQITSI-UHFFFAOYSA-N -1 3 351.244 3.886 20 0 FHADHM CC(C)OC1CCC(Nc2cc(-c3nnn[n-]3)c3ccccc3n2)CC1 ZINC000824309885 607734718 /nfs/dbraw/zinc/73/47/18/607734718.db2.gz YNSUIPXNJVXTOG-UHFFFAOYSA-N -1 3 352.442 3.563 20 0 FHADHM CC(C)OC1CCC(Nc2cc(-c3nn[n-]n3)c3ccccc3n2)CC1 ZINC000824309885 607734719 /nfs/dbraw/zinc/73/47/19/607734719.db2.gz YNSUIPXNJVXTOG-UHFFFAOYSA-N -1 3 352.442 3.563 20 0 FHADHM C[C@H](Oc1ccc(CN[C@@H]2CC(C)(C)Oc3ccccc32)cc1)C(=O)[O-] ZINC000833541609 605117243 /nfs/dbraw/zinc/11/72/43/605117243.db2.gz RVHUEFMIXVMQLB-KBXCAEBGSA-N -1 3 355.434 3.931 20 0 FHADHM CCc1oc(C(=O)[O-])cc1CN[C@@H](C)c1ccc(-n2ccnc2C)cc1 ZINC000833680485 605132866 /nfs/dbraw/zinc/13/28/66/605132866.db2.gz KCWAQGCXTYTMRV-ZDUSSCGKSA-N -1 3 353.422 3.885 20 0 FHADHM C/C(=C/CN1CCC[C@H](Cc2nc(C3CCCCCC3)no2)C1)C(=O)[O-] ZINC000833381976 605150621 /nfs/dbraw/zinc/15/06/21/605150621.db2.gz GBKNMXLMIDXRRY-DDITZMBXSA-N -1 3 361.486 3.793 20 0 FHADHM CCCCN(C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@H](CC)c1ccccc1 ZINC000825281409 607739626 /nfs/dbraw/zinc/73/96/26/607739626.db2.gz DKEJTSHBGIYHHS-QGZVFWFLSA-N -1 3 352.442 3.588 20 0 FHADHM CCCCN(C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@H](CC)c1ccccc1 ZINC000825281409 607739627 /nfs/dbraw/zinc/73/96/27/607739627.db2.gz DKEJTSHBGIYHHS-QGZVFWFLSA-N -1 3 352.442 3.588 20 0 FHADHM O=C(c1ccc(-c2nnn[n-]2)[nH]1)N1CCCCC[C@@H]1c1ccc(Cl)cc1 ZINC000826471837 607740881 /nfs/dbraw/zinc/74/08/81/607740881.db2.gz OICVGZBKIYSWDP-MRXNPFEDSA-N -1 3 370.844 3.606 20 0 FHADHM O=C(c1ccc(-c2nn[n-]n2)[nH]1)N1CCCCC[C@@H]1c1ccc(Cl)cc1 ZINC000826471837 607740882 /nfs/dbraw/zinc/74/08/82/607740882.db2.gz OICVGZBKIYSWDP-MRXNPFEDSA-N -1 3 370.844 3.606 20 0 FHADHM CC1([C@@H]2CCCN([C@@H](C(=O)[O-])c3cccc(Cl)c3Cl)C2)OCCO1 ZINC000833564727 605444705 /nfs/dbraw/zinc/44/47/05/605444705.db2.gz PGFLWOXNXNPWBB-IAQYHMDHSA-N -1 3 374.264 3.594 20 0 FHADHM CC1(C)CCC(CC(=O)NC2(c3cccc(-c4nnn[n-]4)c3)CC2)CC1 ZINC000824795963 607756982 /nfs/dbraw/zinc/75/69/82/607756982.db2.gz KALSWUGQURVISN-UHFFFAOYSA-N -1 3 353.470 3.579 20 0 FHADHM CC1(C)CCC(CC(=O)NC2(c3cccc(-c4nn[n-]n4)c3)CC2)CC1 ZINC000824795963 607756983 /nfs/dbraw/zinc/75/69/83/607756983.db2.gz KALSWUGQURVISN-UHFFFAOYSA-N -1 3 353.470 3.579 20 0 FHADHM CCCN(CC(=O)Nc1ccccc1C(C)C)C1CCN(C(=O)[O-])CC1 ZINC000826904323 605471137 /nfs/dbraw/zinc/47/11/37/605471137.db2.gz QPIZSRDIAYTUNR-UHFFFAOYSA-N -1 3 361.486 3.603 20 0 FHADHM COc1ccc2c(c1)CCC[C@@H]2N[C@@H](C)c1ccc(CNC(=O)[O-])nc1C ZINC000833890369 605596868 /nfs/dbraw/zinc/59/68/68/605596868.db2.gz LBCKCICGJVBCPW-XOBRGWDASA-N -1 3 369.465 3.894 20 0 FHADHM CCOc1cccc2cc([C@H](C)Nc3ccc(-c4nnn[n-]4)nc3)oc21 ZINC000821430657 606029058 /nfs/dbraw/zinc/02/90/58/606029058.db2.gz BPNMHHBFSXBJSU-NSHDSACASA-N -1 3 350.382 3.580 20 0 FHADHM CCOc1cccc2cc([C@H](C)Nc3ccc(-c4nn[n-]n4)nc3)oc21 ZINC000821430657 606029061 /nfs/dbraw/zinc/02/90/61/606029061.db2.gz BPNMHHBFSXBJSU-NSHDSACASA-N -1 3 350.382 3.580 20 0 FHADHM Cc1ccc(C(F)(F)F)cc1NC(=O)C=Cc1ccccc1-c1nnn[n-]1 ZINC000822231114 606031625 /nfs/dbraw/zinc/03/16/25/606031625.db2.gz ZWBBSLJJVTYXQN-CLFYSBASSA-N -1 3 373.338 3.846 20 0 FHADHM Cc1ccc(C(F)(F)F)cc1NC(=O)C=Cc1ccccc1-c1nn[n-]n1 ZINC000822231114 606031630 /nfs/dbraw/zinc/03/16/30/606031630.db2.gz ZWBBSLJJVTYXQN-CLFYSBASSA-N -1 3 373.338 3.846 20 0 FHADHM CCOc1ccccc1[C@H](CC(C)C)Nc1ncccc1-c1nnn[n-]1 ZINC000821431121 606042130 /nfs/dbraw/zinc/04/21/30/606042130.db2.gz MXULPRAKLDIORN-INIZCTEOSA-N -1 3 352.442 3.860 20 0 FHADHM CCOc1ccccc1[C@H](CC(C)C)Nc1ncccc1-c1nn[n-]n1 ZINC000821431121 606042136 /nfs/dbraw/zinc/04/21/36/606042136.db2.gz MXULPRAKLDIORN-INIZCTEOSA-N -1 3 352.442 3.860 20 0 FHADHM c1ccc(COCc2cccc(CNc3ccc(-c4nnn[n-]4)nc3)c2)cc1 ZINC000823786652 606044113 /nfs/dbraw/zinc/04/41/13/606044113.db2.gz AEAXAHWYTSREAX-UHFFFAOYSA-N -1 3 372.432 3.591 20 0 FHADHM c1ccc(COCc2cccc(CNc3ccc(-c4nn[n-]n4)nc3)c2)cc1 ZINC000823786652 606044117 /nfs/dbraw/zinc/04/41/17/606044117.db2.gz AEAXAHWYTSREAX-UHFFFAOYSA-N -1 3 372.432 3.591 20 0 FHADHM c1ccc(COCc2ccc(CNc3ccc(-c4nnn[n-]4)nc3)cc2)cc1 ZINC000823788245 606044972 /nfs/dbraw/zinc/04/49/72/606044972.db2.gz VXTQTWUOJAORTK-UHFFFAOYSA-N -1 3 372.432 3.591 20 0 FHADHM c1ccc(COCc2ccc(CNc3ccc(-c4nn[n-]n4)nc3)cc2)cc1 ZINC000823788245 606044976 /nfs/dbraw/zinc/04/49/76/606044976.db2.gz VXTQTWUOJAORTK-UHFFFAOYSA-N -1 3 372.432 3.591 20 0 FHADHM C[C@H](Nc1ccc(-c2nnn[n-]2)nc1)c1c(Cl)ccc(F)c1Cl ZINC000820455459 606049262 /nfs/dbraw/zinc/04/92/62/606049262.db2.gz IQKURNDCTCLDRO-ZETCQYMHSA-N -1 3 353.188 3.881 20 0 FHADHM C[C@H](Nc1ccc(-c2nn[n-]n2)nc1)c1c(Cl)ccc(F)c1Cl ZINC000820455459 606049267 /nfs/dbraw/zinc/04/92/67/606049267.db2.gz IQKURNDCTCLDRO-ZETCQYMHSA-N -1 3 353.188 3.881 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N(C)Cc1cc2ccccc2o1 ZINC000822217480 606116402 /nfs/dbraw/zinc/11/64/02/606116402.db2.gz FTJKMMZQTZVXQU-UHFFFAOYSA-N -1 3 362.393 3.585 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N(C)Cc1cc2ccccc2o1 ZINC000822217480 606116404 /nfs/dbraw/zinc/11/64/04/606116404.db2.gz FTJKMMZQTZVXQU-UHFFFAOYSA-N -1 3 362.393 3.585 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)C/C=C\c1cccc(F)c1 ZINC000819975781 606125908 /nfs/dbraw/zinc/12/59/08/606125908.db2.gz CPXSDZYLYXUWMU-ALCCZGGFSA-N -1 3 368.416 3.604 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)C/C=C\c1cccc(F)c1 ZINC000819975781 606125909 /nfs/dbraw/zinc/12/59/09/606125909.db2.gz CPXSDZYLYXUWMU-ALCCZGGFSA-N -1 3 368.416 3.604 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@@H](CC)Oc2ccccc2C)s1 ZINC000821465684 606126027 /nfs/dbraw/zinc/12/60/27/606126027.db2.gz NMSWXYBHCCCZRD-CQSZACIVSA-N -1 3 371.466 3.595 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@@H](CC)Oc2ccccc2C)s1 ZINC000821465684 606126029 /nfs/dbraw/zinc/12/60/29/606126029.db2.gz NMSWXYBHCCCZRD-CQSZACIVSA-N -1 3 371.466 3.595 20 0 FHADHM CC[C@H](Oc1ccccc1C)C(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820938300 606127157 /nfs/dbraw/zinc/12/71/57/606127157.db2.gz IDIKATJQVOMDFY-PBHICJAKSA-N -1 3 366.421 3.637 20 0 FHADHM CC[C@H](Oc1ccccc1C)C(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820938300 606127158 /nfs/dbraw/zinc/12/71/58/606127158.db2.gz IDIKATJQVOMDFY-PBHICJAKSA-N -1 3 366.421 3.637 20 0 FHADHM Cc1sc(NC(=O)C/C=C\c2ccc(F)cc2)c(-c2nnn[n-]2)c1C ZINC000822559097 606174982 /nfs/dbraw/zinc/17/49/82/606174982.db2.gz WDPDRSOPANVFRH-ARJAWSKDSA-N -1 3 357.414 3.726 20 0 FHADHM Cc1sc(NC(=O)C/C=C\c2ccc(F)cc2)c(-c2nn[n-]n2)c1C ZINC000822559097 606174983 /nfs/dbraw/zinc/17/49/83/606174983.db2.gz WDPDRSOPANVFRH-ARJAWSKDSA-N -1 3 357.414 3.726 20 0 FHADHM C[C@H](C(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(Cl)s1 ZINC000820481535 606177212 /nfs/dbraw/zinc/17/72/12/606177212.db2.gz XDMFDPNFYQOYKR-UWVGGRQHSA-N -1 3 362.842 3.990 20 0 FHADHM C[C@H](C(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(Cl)s1 ZINC000820481535 606177214 /nfs/dbraw/zinc/17/72/14/606177214.db2.gz XDMFDPNFYQOYKR-UWVGGRQHSA-N -1 3 362.842 3.990 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)CCCc2ccc(C)s2)s1 ZINC000821465471 606185144 /nfs/dbraw/zinc/18/51/44/606185144.db2.gz ILCMSBCPIZAVNH-UHFFFAOYSA-N -1 3 361.496 3.822 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)CCCc2ccc(C)s2)s1 ZINC000821465471 606185146 /nfs/dbraw/zinc/18/51/46/606185146.db2.gz ILCMSBCPIZAVNH-UHFFFAOYSA-N -1 3 361.496 3.822 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cc(C)c(C)s1 ZINC000821123735 606192846 /nfs/dbraw/zinc/19/28/46/606192846.db2.gz WVBKBAMBIDSSJP-UHFFFAOYSA-N -1 3 356.455 3.619 20 0 FHADHM CC(C)c1cccc(C(C)C)c1NC(=O)c1cc(-c2nnn[n-]2)cn1C ZINC000820192739 606207528 /nfs/dbraw/zinc/20/75/28/606207528.db2.gz XLJZVSMWWQTFTM-UHFFFAOYSA-N -1 3 352.442 3.704 20 0 FHADHM CC(C)c1cccc(C(C)C)c1NC(=O)c1cc(-c2nn[n-]n2)cn1C ZINC000820192739 606207530 /nfs/dbraw/zinc/20/75/30/606207530.db2.gz XLJZVSMWWQTFTM-UHFFFAOYSA-N -1 3 352.442 3.704 20 0 FHADHM C[C@@H](NCc1cc(-c2nnn[n-]2)cs1)c1nc(-c2ccccc2)cs1 ZINC000820427468 606217776 /nfs/dbraw/zinc/21/77/76/606217776.db2.gz RGEJJKJWAZOQOX-LLVKDONJSA-N -1 3 368.491 3.903 20 0 FHADHM C[C@@H](NCc1cc(-c2nn[n-]n2)cs1)c1nc(-c2ccccc2)cs1 ZINC000820427468 606217778 /nfs/dbraw/zinc/21/77/78/606217778.db2.gz RGEJJKJWAZOQOX-LLVKDONJSA-N -1 3 368.491 3.903 20 0 FHADHM O=C(Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1)[C@@H]1C[C@H]1C1CC1 ZINC000823350529 606238154 /nfs/dbraw/zinc/23/81/54/606238154.db2.gz QIVLLZYZMZAIKY-ZWKOTPCHSA-N -1 3 361.405 3.644 20 0 FHADHM O=C(Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1)[C@@H]1C[C@H]1C1CC1 ZINC000823350529 606238156 /nfs/dbraw/zinc/23/81/56/606238156.db2.gz QIVLLZYZMZAIKY-ZWKOTPCHSA-N -1 3 361.405 3.644 20 0 FHADHM CCSCc1ccc(C(=O)Nc2ccc(F)cc2-c2nnn[n-]2)cc1 ZINC000821460680 606263435 /nfs/dbraw/zinc/26/34/35/606263435.db2.gz AGDGQSHUIXYWPV-UHFFFAOYSA-N -1 3 357.414 3.511 20 0 FHADHM CCSCc1ccc(C(=O)Nc2ccc(F)cc2-c2nn[n-]n2)cc1 ZINC000821460680 606263437 /nfs/dbraw/zinc/26/34/37/606263437.db2.gz AGDGQSHUIXYWPV-UHFFFAOYSA-N -1 3 357.414 3.511 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)c1cc(C2CC2)nc2ccccc21 ZINC000823343745 606263696 /nfs/dbraw/zinc/26/36/96/606263696.db2.gz FTYHYRRMPHJRMF-UHFFFAOYSA-N -1 3 374.379 3.684 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)c1cc(C2CC2)nc2ccccc21 ZINC000823343745 606263698 /nfs/dbraw/zinc/26/36/98/606263698.db2.gz FTYHYRRMPHJRMF-UHFFFAOYSA-N -1 3 374.379 3.684 20 0 FHADHM Cc1cc(SC(C)(C)C)ccc1NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC000822212734 606267091 /nfs/dbraw/zinc/26/70/91/606267091.db2.gz FMTYSFNYSCACMW-UHFFFAOYSA-N -1 3 356.455 3.646 20 0 FHADHM Cc1cc(SC(C)(C)C)ccc1NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC000822212734 606267092 /nfs/dbraw/zinc/26/70/92/606267092.db2.gz FMTYSFNYSCACMW-UHFFFAOYSA-N -1 3 356.455 3.646 20 0 FHADHM CC[C@@H](C)c1ccccc1OCC(=O)Nc1ccc(F)cc1-c1nnn[n-]1 ZINC000820882761 606269753 /nfs/dbraw/zinc/26/97/53/606269753.db2.gz ZYKCAUZANJOVAZ-GFCCVEGCSA-N -1 3 369.400 3.537 20 0 FHADHM CC[C@@H](C)c1ccccc1OCC(=O)Nc1ccc(F)cc1-c1nn[n-]n1 ZINC000820882761 606269756 /nfs/dbraw/zinc/26/97/56/606269756.db2.gz ZYKCAUZANJOVAZ-GFCCVEGCSA-N -1 3 369.400 3.537 20 0 FHADHM CC(C)=CCOc1cccc(C(=O)Nc2ccc(F)cc2-c2nnn[n-]2)c1 ZINC000820005442 606271682 /nfs/dbraw/zinc/27/16/82/606271682.db2.gz QVMOWFNPOXHMTO-UHFFFAOYSA-N -1 3 367.384 3.603 20 0 FHADHM CC(C)=CCOc1cccc(C(=O)Nc2ccc(F)cc2-c2nn[n-]n2)c1 ZINC000820005442 606271684 /nfs/dbraw/zinc/27/16/84/606271684.db2.gz QVMOWFNPOXHMTO-UHFFFAOYSA-N -1 3 367.384 3.603 20 0 FHADHM CC[C@H](CC(=O)Nc1ccc(F)cc1-c1nnn[n-]1)c1ccc(C)cc1 ZINC000820882645 606273941 /nfs/dbraw/zinc/27/39/41/606273941.db2.gz WPSUANXUZUQEHV-CYBMUJFWSA-N -1 3 353.401 3.837 20 0 FHADHM CC[C@H](CC(=O)Nc1ccc(F)cc1-c1nn[n-]n1)c1ccc(C)cc1 ZINC000820882645 606273943 /nfs/dbraw/zinc/27/39/43/606273943.db2.gz WPSUANXUZUQEHV-CYBMUJFWSA-N -1 3 353.401 3.837 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)Cc1cccc(Cl)c1 ZINC000821123703 606282092 /nfs/dbraw/zinc/28/20/92/606282092.db2.gz WELGTDMVNXLBTN-UHFFFAOYSA-N -1 3 370.844 3.523 20 0 FHADHM C[C@@H](OC(=O)C(C)(C)c1cccc(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820481284 606340370 /nfs/dbraw/zinc/34/03/70/606340370.db2.gz UMYQPBVMUORUJJ-GFCCVEGCSA-N -1 3 354.385 3.588 20 0 FHADHM C[C@@H](OC(=O)C(C)(C)c1cccc(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820481284 606340371 /nfs/dbraw/zinc/34/03/71/606340371.db2.gz UMYQPBVMUORUJJ-GFCCVEGCSA-N -1 3 354.385 3.588 20 0 FHADHM C[C@H](OC(=O)c1scnc1C(C)(C)C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820519163 606340839 /nfs/dbraw/zinc/34/08/39/606340839.db2.gz PYIHEECKOJHCBK-JTQLQIEISA-N -1 3 357.439 3.539 20 0 FHADHM C[C@H](OC(=O)c1scnc1C(C)(C)C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820519163 606340841 /nfs/dbraw/zinc/34/08/41/606340841.db2.gz PYIHEECKOJHCBK-JTQLQIEISA-N -1 3 357.439 3.539 20 0 FHADHM C[C@@H](OC(=O)c1scnc1C(C)(C)C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820519164 606341119 /nfs/dbraw/zinc/34/11/19/606341119.db2.gz PYIHEECKOJHCBK-SNVBAGLBSA-N -1 3 357.439 3.539 20 0 FHADHM C[C@@H](OC(=O)c1scnc1C(C)(C)C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820519164 606341121 /nfs/dbraw/zinc/34/11/21/606341121.db2.gz PYIHEECKOJHCBK-SNVBAGLBSA-N -1 3 357.439 3.539 20 0 FHADHM COc1ccccc1C(C)=CC(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821882707 606341470 /nfs/dbraw/zinc/34/14/70/606341470.db2.gz INYHEXWFKJJMMR-XTZCOPOCSA-N -1 3 364.405 3.583 20 0 FHADHM COc1ccccc1C(C)=CC(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821882707 606341471 /nfs/dbraw/zinc/34/14/71/606341471.db2.gz INYHEXWFKJJMMR-XTZCOPOCSA-N -1 3 364.405 3.583 20 0 FHADHM COc1ccccc1C(C)=CC(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821882705 606341850 /nfs/dbraw/zinc/34/18/50/606341850.db2.gz INYHEXWFKJJMMR-FNDVETGQSA-N -1 3 364.405 3.583 20 0 FHADHM COc1ccccc1C(C)=CC(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821882705 606341852 /nfs/dbraw/zinc/34/18/52/606341852.db2.gz INYHEXWFKJJMMR-FNDVETGQSA-N -1 3 364.405 3.583 20 0 FHADHM C[C@@H](OC(=O)[C@@H](C)CCOc1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820249563 606341910 /nfs/dbraw/zinc/34/19/10/606341910.db2.gz WSHOBPLKWUFNBE-LSDHHAIUSA-N -1 3 366.421 3.576 20 0 FHADHM C[C@@H](OC(=O)[C@@H](C)CCOc1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820249563 606341912 /nfs/dbraw/zinc/34/19/12/606341912.db2.gz WSHOBPLKWUFNBE-LSDHHAIUSA-N -1 3 366.421 3.576 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccc2ccccc2n1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488943 606349429 /nfs/dbraw/zinc/34/94/29/606349429.db2.gz XCDQPYRZCPIYPD-WUFNSSIPSA-N -1 3 371.400 3.733 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccc2ccccc2n1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488943 606349431 /nfs/dbraw/zinc/34/94/31/606349431.db2.gz XCDQPYRZCPIYPD-WUFNSSIPSA-N -1 3 371.400 3.733 20 0 FHADHM C[C@@H](SCc1ccccc1)C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820549905 606349932 /nfs/dbraw/zinc/34/99/32/606349932.db2.gz SYNPLMUZLQKFKZ-UONOGXRCSA-N -1 3 368.462 3.793 20 0 FHADHM C[C@@H](SCc1ccccc1)C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820549905 606349934 /nfs/dbraw/zinc/34/99/34/606349934.db2.gz SYNPLMUZLQKFKZ-UONOGXRCSA-N -1 3 368.462 3.793 20 0 FHADHM Cc1ccc(OCCCC(=O)O[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000822262973 606350509 /nfs/dbraw/zinc/35/05/09/606350509.db2.gz HDNQMFWEPUYHMJ-HNNXBMFYSA-N -1 3 366.421 3.639 20 0 FHADHM Cc1ccc(OCCCC(=O)O[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000822262973 606350510 /nfs/dbraw/zinc/35/05/10/606350510.db2.gz HDNQMFWEPUYHMJ-HNNXBMFYSA-N -1 3 366.421 3.639 20 0 FHADHM C[C@@H](OC(=O)C1(c2cccc(Cl)c2)CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488027 606352221 /nfs/dbraw/zinc/35/22/21/606352221.db2.gz KJCASSSATCKYOA-GFCCVEGCSA-N -1 3 368.824 3.856 20 0 FHADHM C[C@@H](OC(=O)C1(c2cccc(Cl)c2)CC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488027 606352223 /nfs/dbraw/zinc/35/22/23/606352223.db2.gz KJCASSSATCKYOA-GFCCVEGCSA-N -1 3 368.824 3.856 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccc(Cl)s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488987 606357417 /nfs/dbraw/zinc/35/74/17/606357417.db2.gz XPVGTNFCWMWWBO-TTZKWOQHSA-N -1 3 360.826 3.899 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccc(Cl)s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488987 606357419 /nfs/dbraw/zinc/35/74/19/606357419.db2.gz XPVGTNFCWMWWBO-TTZKWOQHSA-N -1 3 360.826 3.899 20 0 FHADHM C[C@H](OC(=O)[C@@H]1C[C@@H]1c1cc(F)ccc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000820487748 606359392 /nfs/dbraw/zinc/35/93/92/606359392.db2.gz IKXLYOMIUFIWRP-DRZCJDIDSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@@H]1C[C@@H]1c1cc(F)ccc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000820487748 606359393 /nfs/dbraw/zinc/35/93/93/606359393.db2.gz IKXLYOMIUFIWRP-DRZCJDIDSA-N -1 3 370.359 3.553 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1cc(C)c(F)cc1F ZINC000821104410 606362649 /nfs/dbraw/zinc/36/26/49/606362649.db2.gz BZQOPRRSHWLAFI-UHFFFAOYSA-N -1 3 371.391 3.506 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1cc(C)c(F)cc1F ZINC000821104410 606362651 /nfs/dbraw/zinc/36/26/51/606362651.db2.gz BZQOPRRSHWLAFI-UHFFFAOYSA-N -1 3 371.391 3.506 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccc(Oc2ccccc2)o1 ZINC000823337041 606364140 /nfs/dbraw/zinc/36/41/40/606364140.db2.gz FLSYPMHJQVQRGE-UHFFFAOYSA-N -1 3 365.324 3.643 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccc(Oc2ccccc2)o1 ZINC000823337041 606364141 /nfs/dbraw/zinc/36/41/41/606364141.db2.gz FLSYPMHJQVQRGE-UHFFFAOYSA-N -1 3 365.324 3.643 20 0 FHADHM CC[C@@H]1CCc2ccccc2N1C(=O)CCc1ccc(-c2nnn[n-]2)cc1 ZINC000820989074 606373651 /nfs/dbraw/zinc/37/36/51/606373651.db2.gz LOMWRTKQSZKSNP-GOSISDBHSA-N -1 3 361.449 3.557 20 0 FHADHM CC[C@@H]1CCc2ccccc2N1C(=O)CCc1ccc(-c2nn[n-]n2)cc1 ZINC000820989074 606373653 /nfs/dbraw/zinc/37/36/53/606373653.db2.gz LOMWRTKQSZKSNP-GOSISDBHSA-N -1 3 361.449 3.557 20 0 FHADHM C[C@@H](NCc1ccc(-c2nnn[n-]2)s1)c1ccccc1Br ZINC000820432986 606405780 /nfs/dbraw/zinc/40/57/80/606405780.db2.gz UUQKEKVRTZOXBW-SECBINFHSA-N -1 3 364.272 3.542 20 0 FHADHM CN(C(=O)c1cc2ccccc2o1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821573552 606414730 /nfs/dbraw/zinc/41/47/30/606414730.db2.gz VJGLRIJFESJFHY-UHFFFAOYSA-N -1 3 353.769 3.543 20 0 FHADHM CN(C(=O)c1cc2ccccc2o1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821573552 606414732 /nfs/dbraw/zinc/41/47/32/606414732.db2.gz VJGLRIJFESJFHY-UHFFFAOYSA-N -1 3 353.769 3.543 20 0 FHADHM Cc1cc([C@H](C)Nc2nc(C(F)(F)F)ccc2-c2nnn[n-]2)ccc1F ZINC000822191825 606430817 /nfs/dbraw/zinc/43/08/17/606430817.db2.gz RTZAJNGSJPDEKZ-VIFPVBQESA-N -1 3 366.322 3.901 20 0 FHADHM Cc1cc([C@H](C)Nc2nc(C(F)(F)F)ccc2-c2nn[n-]n2)ccc1F ZINC000822191825 606430818 /nfs/dbraw/zinc/43/08/18/606430818.db2.gz RTZAJNGSJPDEKZ-VIFPVBQESA-N -1 3 366.322 3.901 20 0 FHADHM Clc1ccc(C2=CCN(c3ncc(-c4nnn[n-]4)cc3Cl)CC2)cc1 ZINC000822573839 606432361 /nfs/dbraw/zinc/43/23/61/606432361.db2.gz JMEOGDNJCXUEFH-UHFFFAOYSA-N -1 3 373.247 3.862 20 0 FHADHM Clc1ccc(C2=CCN(c3ncc(-c4nn[n-]n4)cc3Cl)CC2)cc1 ZINC000822573839 606432362 /nfs/dbraw/zinc/43/23/62/606432362.db2.gz JMEOGDNJCXUEFH-UHFFFAOYSA-N -1 3 373.247 3.862 20 0 FHADHM Cc1ccc(NCc2cc(-c3nnn[n-]3)ccc2F)c(Br)c1 ZINC000822254284 606440438 /nfs/dbraw/zinc/44/04/38/606440438.db2.gz GFQCVGONMWJZFP-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Cc1ccc(NCc2cc(-c3nn[n-]n3)ccc2F)c(Br)c1 ZINC000822254284 606440440 /nfs/dbraw/zinc/44/04/40/606440440.db2.gz GFQCVGONMWJZFP-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM C[C@@H](Nc1ccc(F)cc1-c1nnn[n-]1)c1nc2ccccc2n1C(F)F ZINC000820455557 606444003 /nfs/dbraw/zinc/44/40/03/606444003.db2.gz JSXPRYDEIHBFKE-SECBINFHSA-N -1 3 373.342 3.924 20 0 FHADHM C[C@@H](Nc1ccc(F)cc1-c1nn[n-]n1)c1nc2ccccc2n1C(F)F ZINC000820455557 606444005 /nfs/dbraw/zinc/44/40/05/606444005.db2.gz JSXPRYDEIHBFKE-SECBINFHSA-N -1 3 373.342 3.924 20 0 FHADHM Fc1cc(-c2nnn[n-]2)cc(F)c1N(Cc1ccco1)Cc1ccco1 ZINC000822736723 606447510 /nfs/dbraw/zinc/44/75/10/606447510.db2.gz JBSSPNUHJVFCTL-UHFFFAOYSA-N -1 3 357.320 3.538 20 0 FHADHM Fc1cc(-c2nn[n-]n2)cc(F)c1N(Cc1ccco1)Cc1ccco1 ZINC000822736723 606447512 /nfs/dbraw/zinc/44/75/12/606447512.db2.gz JBSSPNUHJVFCTL-UHFFFAOYSA-N -1 3 357.320 3.538 20 0 FHADHM CC1(CNC(=O)c2cccc(Oc3ccc(-c4nnn[n-]4)cc3)c2)CCC1 ZINC000820618886 606449586 /nfs/dbraw/zinc/44/95/86/606449586.db2.gz RLXDIWYUDOOMQV-UHFFFAOYSA-N -1 3 363.421 3.579 20 0 FHADHM CC1(CNC(=O)c2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)CCC1 ZINC000820618886 606449588 /nfs/dbraw/zinc/44/95/88/606449588.db2.gz RLXDIWYUDOOMQV-UHFFFAOYSA-N -1 3 363.421 3.579 20 0 FHADHM Cc1ccc(NC(=O)C(C)(C)C)cc1NCc1cccc(-c2nnn[n-]2)c1 ZINC000822242514 606458881 /nfs/dbraw/zinc/45/88/81/606458881.db2.gz NKXGJNSEXTXHOJ-UHFFFAOYSA-N -1 3 364.453 3.772 20 0 FHADHM Cc1ccc(NC(=O)C(C)(C)C)cc1NCc1cccc(-c2nn[n-]n2)c1 ZINC000822242514 606458883 /nfs/dbraw/zinc/45/88/83/606458883.db2.gz NKXGJNSEXTXHOJ-UHFFFAOYSA-N -1 3 364.453 3.772 20 0 FHADHM O=C(OCc1ccc(SC(F)F)cc1)c1cc(-c2nnn[n-]2)cs1 ZINC000823426887 606464189 /nfs/dbraw/zinc/46/41/89/606464189.db2.gz PRSUJWQUQUCTFI-UHFFFAOYSA-N -1 3 368.390 3.600 20 0 FHADHM O=C(OCc1ccc(SC(F)F)cc1)c1cc(-c2nn[n-]n2)cs1 ZINC000823426887 606464191 /nfs/dbraw/zinc/46/41/91/606464191.db2.gz PRSUJWQUQUCTFI-UHFFFAOYSA-N -1 3 368.390 3.600 20 0 FHADHM COc1ccc([C@H](C)OC(=O)c2cc(-c3nnn[n-]3)cs2)cc1Cl ZINC000821777328 606464701 /nfs/dbraw/zinc/46/47/01/606464701.db2.gz DJEXKADUVRDLFS-QMMMGPOBSA-N -1 3 364.814 3.508 20 0 FHADHM COc1ccc([C@H](C)OC(=O)c2cc(-c3nn[n-]n3)cs2)cc1Cl ZINC000821777328 606464702 /nfs/dbraw/zinc/46/47/02/606464702.db2.gz DJEXKADUVRDLFS-QMMMGPOBSA-N -1 3 364.814 3.508 20 0 FHADHM COc1ccc(CNc2ccc(COC(C)(C)C)cc2)cc1-c1nnn[n-]1 ZINC000821821574 606474091 /nfs/dbraw/zinc/47/40/91/606474091.db2.gz LVEXWOLZICGUGK-UHFFFAOYSA-N -1 3 367.453 3.803 20 0 FHADHM COc1ccc(CNc2ccc(COC(C)(C)C)cc2)cc1-c1nn[n-]n1 ZINC000821821574 606474092 /nfs/dbraw/zinc/47/40/92/606474092.db2.gz LVEXWOLZICGUGK-UHFFFAOYSA-N -1 3 367.453 3.803 20 0 FHADHM Clc1ccc(-c2nc(COc3cccc(-c4nnn[n-]4)c3)co2)cc1 ZINC000822567672 606483178 /nfs/dbraw/zinc/48/31/78/606483178.db2.gz DWJNKNTUBBNRRZ-UHFFFAOYSA-N -1 3 353.769 3.754 20 0 FHADHM Clc1ccc(-c2nc(COc3cccc(-c4nn[n-]n4)c3)co2)cc1 ZINC000822567672 606483180 /nfs/dbraw/zinc/48/31/80/606483180.db2.gz DWJNKNTUBBNRRZ-UHFFFAOYSA-N -1 3 353.769 3.754 20 0 FHADHM CCCCCN(Cc1ccc(F)cc1)C(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000821056449 606483457 /nfs/dbraw/zinc/48/34/57/606483457.db2.gz RTRAFOAIWWSAHS-UHFFFAOYSA-N -1 3 373.457 3.900 20 0 FHADHM CCCCCN(Cc1ccc(F)cc1)C(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000821056449 606483458 /nfs/dbraw/zinc/48/34/58/606483458.db2.gz RTRAFOAIWWSAHS-UHFFFAOYSA-N -1 3 373.457 3.900 20 0 FHADHM O=C(Cc1cccc(-c2nnn[n-]2)c1)Nc1ccccc1Oc1ccccc1 ZINC000823108289 606489756 /nfs/dbraw/zinc/48/97/56/606489756.db2.gz LAXLWBWYGNIEFF-UHFFFAOYSA-N -1 3 371.400 3.840 20 0 FHADHM O=C(Cc1cccc(-c2nn[n-]n2)c1)Nc1ccccc1Oc1ccccc1 ZINC000823108289 606489757 /nfs/dbraw/zinc/48/97/57/606489757.db2.gz LAXLWBWYGNIEFF-UHFFFAOYSA-N -1 3 371.400 3.840 20 0 FHADHM CCSc1ccc(Cl)cc1C(=O)NCc1cccc(-c2nnn[n-]2)c1 ZINC000821461736 606490824 /nfs/dbraw/zinc/49/08/24/606490824.db2.gz SBXMGHNUWUTZQZ-UHFFFAOYSA-N -1 3 373.869 3.562 20 0 FHADHM CCSc1ccc(Cl)cc1C(=O)NCc1cccc(-c2nn[n-]n2)c1 ZINC000821461736 606490826 /nfs/dbraw/zinc/49/08/26/606490826.db2.gz SBXMGHNUWUTZQZ-UHFFFAOYSA-N -1 3 373.869 3.562 20 0 FHADHM CCCOc1ccc(Cl)cc1NC(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000821133852 606495611 /nfs/dbraw/zinc/49/56/11/606495611.db2.gz HOFNIJNBMRQLJV-UHFFFAOYSA-N -1 3 363.830 3.623 20 0 FHADHM CCCOc1ccc(Cl)cc1NC(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000821133852 606495612 /nfs/dbraw/zinc/49/56/12/606495612.db2.gz HOFNIJNBMRQLJV-UHFFFAOYSA-N -1 3 363.830 3.623 20 0 FHADHM Cc1ccc([C@H]2CCCN2C(=O)c2cc(-c3nnn[n-]3)cs2)cc1C ZINC000822233025 606499517 /nfs/dbraw/zinc/49/95/17/606499517.db2.gz GLMLEHYUFXXGEF-OAHLLOKOSA-N -1 3 353.451 3.522 20 0 FHADHM Cc1ccc([C@H]2CCCN2C(=O)c2cc(-c3nn[n-]n3)cs2)cc1C ZINC000822233025 606499518 /nfs/dbraw/zinc/49/95/18/606499518.db2.gz GLMLEHYUFXXGEF-OAHLLOKOSA-N -1 3 353.451 3.522 20 0 FHADHM CC(C)[C@H](NC(=O)Cc1cccc(-c2nnn[n-]2)c1)c1ccc(Cl)cc1 ZINC000820027034 606499870 /nfs/dbraw/zinc/49/98/70/606499870.db2.gz PSBJJWCZLNSVFZ-SFHVURJKSA-N -1 3 369.856 3.576 20 0 FHADHM CC(C)[C@H](NC(=O)Cc1cccc(-c2nn[n-]n2)c1)c1ccc(Cl)cc1 ZINC000820027034 606499872 /nfs/dbraw/zinc/49/98/72/606499872.db2.gz PSBJJWCZLNSVFZ-SFHVURJKSA-N -1 3 369.856 3.576 20 0 FHADHM O=C(c1cc(-c2nnn[n-]2)cs1)N1CC2(CCCC2)c2c1cccc2F ZINC000823466377 606501485 /nfs/dbraw/zinc/50/14/85/606501485.db2.gz KNCFDXKSQAZVMJ-UHFFFAOYSA-N -1 3 369.425 3.540 20 0 FHADHM O=C(c1cc(-c2nn[n-]n2)cs1)N1CC2(CCCC2)c2c1cccc2F ZINC000823466377 606501487 /nfs/dbraw/zinc/50/14/87/606501487.db2.gz KNCFDXKSQAZVMJ-UHFFFAOYSA-N -1 3 369.425 3.540 20 0 FHADHM C[C@H]1CN(Cc2ccc(-c3nn[n-]n3)cc2OC(F)F)[C@@H]1c1ccccc1 ZINC000820758780 606501952 /nfs/dbraw/zinc/50/19/52/606501952.db2.gz CVFLMFDBAKRMEE-SJCJKPOMSA-N -1 3 371.391 3.661 20 0 FHADHM CCCCN(C(=O)Cc1cccc(-c2nnn[n-]2)c1)[C@@H](C)c1ccccc1 ZINC000821061584 606504766 /nfs/dbraw/zinc/50/47/66/606504766.db2.gz RHCUQUKQRPALHL-INIZCTEOSA-N -1 3 363.465 3.799 20 0 FHADHM CCCCN(C(=O)Cc1cccc(-c2nn[n-]n2)c1)[C@@H](C)c1ccccc1 ZINC000821061584 606504768 /nfs/dbraw/zinc/50/47/68/606504768.db2.gz RHCUQUKQRPALHL-INIZCTEOSA-N -1 3 363.465 3.799 20 0 FHADHM Cc1ccccc1[C@H](C(C)C)N(C)C(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000822345693 606511187 /nfs/dbraw/zinc/51/11/87/606511187.db2.gz PFIUYRLGVHSHFM-INIZCTEOSA-N -1 3 355.467 3.706 20 0 FHADHM Cc1ccccc1[C@H](C(C)C)N(C)C(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000822345693 606511188 /nfs/dbraw/zinc/51/11/88/606511188.db2.gz PFIUYRLGVHSHFM-INIZCTEOSA-N -1 3 355.467 3.706 20 0 FHADHM Cc1ccc([C@H]2CCCCN2C(=O)c2cc(-c3nnn[n-]3)cs2)cc1 ZINC000822233838 606516530 /nfs/dbraw/zinc/51/65/30/606516530.db2.gz WFYIUIGXPHAJMB-OAHLLOKOSA-N -1 3 353.451 3.604 20 0 FHADHM Cc1ccc([C@H]2CCCCN2C(=O)c2cc(-c3nn[n-]n3)cs2)cc1 ZINC000822233838 606516531 /nfs/dbraw/zinc/51/65/31/606516531.db2.gz WFYIUIGXPHAJMB-OAHLLOKOSA-N -1 3 353.451 3.604 20 0 FHADHM CCc1ccc([C@@H]2C[C@H](C)CCN2C(=O)c2cc(-c3nnn[n-]3)cs2)o1 ZINC000821480848 606520573 /nfs/dbraw/zinc/52/05/73/606520573.db2.gz FLUQDBGTVWXJQG-RISCZKNCSA-N -1 3 371.466 3.697 20 0 FHADHM CCc1ccc([C@@H]2C[C@H](C)CCN2C(=O)c2cc(-c3nn[n-]n3)cs2)o1 ZINC000821480848 606520575 /nfs/dbraw/zinc/52/05/75/606520575.db2.gz FLUQDBGTVWXJQG-RISCZKNCSA-N -1 3 371.466 3.697 20 0 FHADHM CCCn1ccc2ccc(NC(=O)c3cc(-c4nnn[n-]4)cs3)cc21 ZINC000821147848 606522164 /nfs/dbraw/zinc/52/21/64/606522164.db2.gz KDKQYZSABZJXSO-UHFFFAOYSA-N -1 3 352.423 3.545 20 0 FHADHM CCCn1ccc2ccc(NC(=O)c3cc(-c4nn[n-]n4)cs3)cc21 ZINC000821147848 606522166 /nfs/dbraw/zinc/52/21/66/606522166.db2.gz KDKQYZSABZJXSO-UHFFFAOYSA-N -1 3 352.423 3.545 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@H](C)C1CCCC1 ZINC000820087438 606537651 /nfs/dbraw/zinc/53/76/51/606537651.db2.gz RTFIUDLZQFZKHN-OAHLLOKOSA-N -1 3 355.486 3.678 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@H](C)C1CCCC1 ZINC000820087438 606537653 /nfs/dbraw/zinc/53/76/53/606537653.db2.gz RTFIUDLZQFZKHN-OAHLLOKOSA-N -1 3 355.486 3.678 20 0 FHADHM CC[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000820938707 606538031 /nfs/dbraw/zinc/53/80/31/606538031.db2.gz MEPYFHPMBQOXIA-JKSUJKDBSA-N -1 3 367.478 3.727 20 0 FHADHM CC[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000820938707 606538033 /nfs/dbraw/zinc/53/80/33/606538033.db2.gz MEPYFHPMBQOXIA-JKSUJKDBSA-N -1 3 367.478 3.727 20 0 FHADHM CCSc1ccc(Cl)cc1NC(=O)c1ccc(-c2nnn[n-]2)s1 ZINC000821461902 606551701 /nfs/dbraw/zinc/55/17/01/606551701.db2.gz VIEKGNVOBVIDRZ-UHFFFAOYSA-N -1 3 365.871 3.946 20 0 FHADHM C[C@@H]1CCCN1C(=O)Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000820709103 606574318 /nfs/dbraw/zinc/57/43/18/606574318.db2.gz DBWAIYXUNHNJDN-CYBMUJFWSA-N -1 3 364.409 3.675 20 0 FHADHM C[C@@H]1CCCN1C(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000820709103 606574319 /nfs/dbraw/zinc/57/43/19/606574319.db2.gz DBWAIYXUNHNJDN-CYBMUJFWSA-N -1 3 364.409 3.675 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N[C@@H](C)c1c(F)cccc1Cl ZINC000822218182 606575175 /nfs/dbraw/zinc/57/51/75/606575175.db2.gz ZEEXIRPECMLCSO-JTQLQIEISA-N -1 3 374.807 3.850 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N[C@@H](C)c1c(F)cccc1Cl ZINC000822218182 606575177 /nfs/dbraw/zinc/57/51/77/606575177.db2.gz ZEEXIRPECMLCSO-JTQLQIEISA-N -1 3 374.807 3.850 20 0 FHADHM CC(=O)c1ccc(C)cc1OCc1ccc(-c2nnn[n-]2)cc1OC(F)F ZINC000819834746 606588812 /nfs/dbraw/zinc/58/88/12/606588812.db2.gz SOISMBAVGHVFJD-UHFFFAOYSA-N -1 3 374.347 3.558 20 0 FHADHM CC(=O)c1ccc(C)cc1OCc1ccc(-c2nn[n-]n2)cc1OC(F)F ZINC000819834746 606588814 /nfs/dbraw/zinc/58/88/14/606588814.db2.gz SOISMBAVGHVFJD-UHFFFAOYSA-N -1 3 374.347 3.558 20 0 FHADHM CC(C)(C)OCc1ccc(Nc2ncc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000819950675 606592058 /nfs/dbraw/zinc/59/20/58/606592058.db2.gz KUOWUYQMFMPTMM-UHFFFAOYSA-N -1 3 358.833 3.974 20 0 FHADHM CC(C)(C)OCc1ccc(Nc2ncc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000819950675 606592060 /nfs/dbraw/zinc/59/20/60/606592060.db2.gz KUOWUYQMFMPTMM-UHFFFAOYSA-N -1 3 358.833 3.974 20 0 FHADHM FC(F)Oc1cc(-c2nnn[n-]2)ccc1COc1ccc2ncccc2c1 ZINC000822732918 606595247 /nfs/dbraw/zinc/59/52/47/606595247.db2.gz ORKRUQQCWMOVPG-UHFFFAOYSA-N -1 3 369.331 3.595 20 0 FHADHM FC(F)Oc1cc(-c2nn[n-]n2)ccc1COc1ccc2ncccc2c1 ZINC000822732918 606595248 /nfs/dbraw/zinc/59/52/48/606595248.db2.gz ORKRUQQCWMOVPG-UHFFFAOYSA-N -1 3 369.331 3.595 20 0 FHADHM Fc1cc(Cl)ccc1NCc1ccc(-c2nnn[n-]2)cc1OC(F)F ZINC000822748175 606597311 /nfs/dbraw/zinc/59/73/11/606597311.db2.gz LKHQNKQVSCGLCE-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM Fc1cc(Cl)ccc1NCc1ccc(-c2nn[n-]n2)cc1OC(F)F ZINC000822748175 606597312 /nfs/dbraw/zinc/59/73/12/606597312.db2.gz LKHQNKQVSCGLCE-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)c1cc2cccc(Cl)c2o1 ZINC000822220543 606602874 /nfs/dbraw/zinc/60/28/74/606602874.db2.gz WCVMLLGDKPAHNZ-UHFFFAOYSA-N -1 3 353.769 3.827 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cc2cccc(Cl)c2o1 ZINC000822220543 606602875 /nfs/dbraw/zinc/60/28/75/606602875.db2.gz WCVMLLGDKPAHNZ-UHFFFAOYSA-N -1 3 353.769 3.827 20 0 FHADHM O=C(CCc1ccoc1)N(Cc1ccccc1)c1ccccc1-c1nnn[n-]1 ZINC000822982652 606603379 /nfs/dbraw/zinc/60/33/79/606603379.db2.gz GBLMNYGVDYWVCU-UHFFFAOYSA-N -1 3 373.416 3.626 20 0 FHADHM O=C(CCc1ccoc1)N(Cc1ccccc1)c1ccccc1-c1nn[n-]n1 ZINC000822982652 606603380 /nfs/dbraw/zinc/60/33/80/606603380.db2.gz GBLMNYGVDYWVCU-UHFFFAOYSA-N -1 3 373.416 3.626 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)ccc1OC(=O)C/C=C/c1ccc(C)cc1 ZINC000821389585 606620609 /nfs/dbraw/zinc/62/06/09/606620609.db2.gz PHEZGYKFGYTKIC-SNAWJCMRSA-N -1 3 364.405 3.583 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)ccc1OC(=O)C/C=C/c1ccc(C)cc1 ZINC000821389585 606620610 /nfs/dbraw/zinc/62/06/10/606620610.db2.gz PHEZGYKFGYTKIC-SNAWJCMRSA-N -1 3 364.405 3.583 20 0 FHADHM O=C(Nc1cccc(CCC(F)(F)F)c1)c1cc(-c2nnn[n-]2)cs1 ZINC000823364053 606623657 /nfs/dbraw/zinc/62/36/57/606623657.db2.gz XHDLXBCJAFHNCE-UHFFFAOYSA-N -1 3 367.356 3.675 20 0 FHADHM O=C(Nc1cccc(CCC(F)(F)F)c1)c1cc(-c2nn[n-]n2)cs1 ZINC000823364053 606623659 /nfs/dbraw/zinc/62/36/59/606623659.db2.gz XHDLXBCJAFHNCE-UHFFFAOYSA-N -1 3 367.356 3.675 20 0 FHADHM Cc1cnn(CCCCCSc2ccc(Cl)cc2-c2nnn[n-]2)c1 ZINC000822402546 606631115 /nfs/dbraw/zinc/63/11/15/606631115.db2.gz DXXWZBAMQVHXAT-UHFFFAOYSA-N -1 3 362.890 3.988 20 0 FHADHM Cc1cnn(CCCCCSc2ccc(Cl)cc2-c2nn[n-]n2)c1 ZINC000822402546 606631118 /nfs/dbraw/zinc/63/11/18/606631118.db2.gz DXXWZBAMQVHXAT-UHFFFAOYSA-N -1 3 362.890 3.988 20 0 FHADHM Fc1cc(Br)cc(F)c1NCc1cccc(-c2nnn[n-]2)c1 ZINC000822748074 606656668 /nfs/dbraw/zinc/65/66/68/606656668.db2.gz GFZZHMZETKYAAT-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1cc(Br)cc(F)c1NCc1cccc(-c2nn[n-]n2)c1 ZINC000822748074 606656669 /nfs/dbraw/zinc/65/66/69/606656669.db2.gz GFZZHMZETKYAAT-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM O=C(Nc1cccc(Cl)c1Cl)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000823363984 606664134 /nfs/dbraw/zinc/66/41/34/606664134.db2.gz UKMRMCPSHLOLME-UHFFFAOYSA-N -1 3 370.146 3.704 20 0 FHADHM O=C(Nc1cccc(Cl)c1Cl)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000823363984 606664135 /nfs/dbraw/zinc/66/41/35/606664135.db2.gz UKMRMCPSHLOLME-UHFFFAOYSA-N -1 3 370.146 3.704 20 0 FHADHM C[C@@H](c1ccccc1)N(C(=O)c1c(F)cc(-c2nnn[n-]2)cc1F)C1CC1 ZINC000820563519 606669120 /nfs/dbraw/zinc/66/91/20/606669120.db2.gz ROTRJAQRCLRBIK-NSHDSACASA-N -1 3 369.375 3.511 20 0 FHADHM C[C@@H](c1ccccc1)N(C(=O)c1c(F)cc(-c2nn[n-]n2)cc1F)C1CC1 ZINC000820563519 606669121 /nfs/dbraw/zinc/66/91/21/606669121.db2.gz ROTRJAQRCLRBIK-NSHDSACASA-N -1 3 369.375 3.511 20 0 FHADHM Cc1ccc(C)c([C@H](C)N(C)C(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)c1 ZINC000822230438 606669726 /nfs/dbraw/zinc/66/97/26/606669726.db2.gz GQDCEPAGNPNHTA-LBPRGKRZSA-N -1 3 371.391 3.595 20 0 FHADHM Cc1ccc(C)c([C@H](C)N(C)C(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)c1 ZINC000822230438 606669727 /nfs/dbraw/zinc/66/97/27/606669727.db2.gz GQDCEPAGNPNHTA-LBPRGKRZSA-N -1 3 371.391 3.595 20 0 FHADHM Cc1cc(OC(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)cc(C)c1Cl ZINC000822210718 606672177 /nfs/dbraw/zinc/67/21/77/606672177.db2.gz OMVHUHRPJOTQKK-UHFFFAOYSA-N -1 3 364.739 3.634 20 0 FHADHM Cc1cc(OC(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)cc(C)c1Cl ZINC000822210718 606672178 /nfs/dbraw/zinc/67/21/78/606672178.db2.gz OMVHUHRPJOTQKK-UHFFFAOYSA-N -1 3 364.739 3.634 20 0 FHADHM FC(F)Oc1ccc(NCc2cccc(-c3nnn[n-]3)c2)cc1Cl ZINC000822737485 606674602 /nfs/dbraw/zinc/67/46/02/606674602.db2.gz XCAYUPCJQZNBPA-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM FC(F)Oc1ccc(NCc2cccc(-c3nn[n-]n3)c2)cc1Cl ZINC000822737485 606674603 /nfs/dbraw/zinc/67/46/03/606674603.db2.gz XCAYUPCJQZNBPA-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1 ZINC000822220069 606675543 /nfs/dbraw/zinc/67/55/43/606675543.db2.gz CFOBOUMRHOOMPI-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1 ZINC000822220069 606675544 /nfs/dbraw/zinc/67/55/44/606675544.db2.gz CFOBOUMRHOOMPI-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM CC(C)(C)Oc1ccccc1NC(=O)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000819951598 606679652 /nfs/dbraw/zinc/67/96/52/606679652.db2.gz UJTVBDHUZRDHDH-UHFFFAOYSA-N -1 3 373.363 3.575 20 0 FHADHM CC(C)(C)Oc1ccccc1NC(=O)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000819951598 606679653 /nfs/dbraw/zinc/67/96/53/606679653.db2.gz UJTVBDHUZRDHDH-UHFFFAOYSA-N -1 3 373.363 3.575 20 0 FHADHM COCCC1(CNc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)CCC1 ZINC000821686835 606721058 /nfs/dbraw/zinc/72/10/58/606721058.db2.gz BIJFIRIARGFQBV-UHFFFAOYSA-N -1 3 355.364 3.504 20 0 FHADHM CC(C)CC[C@@H]1CCCCN1C(=O)CCc1ccc(-c2nnn[n-]2)cc1 ZINC000820072888 606746424 /nfs/dbraw/zinc/74/64/24/606746424.db2.gz MPRAUPHCQMRWSM-SFHVURJKSA-N -1 3 355.486 3.617 20 0 FHADHM CC(C)CC[C@@H]1CCCCN1C(=O)CCc1ccc(-c2nn[n-]n2)cc1 ZINC000820072888 606746427 /nfs/dbraw/zinc/74/64/27/606746427.db2.gz MPRAUPHCQMRWSM-SFHVURJKSA-N -1 3 355.486 3.617 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1Oc1ccc(C(=O)N2CCCCC2)cc1 ZINC000822137665 606773735 /nfs/dbraw/zinc/77/37/35/606773735.db2.gz WIHZRGDCDXHJPN-UHFFFAOYSA-N -1 3 363.421 3.594 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1Oc1ccc(C(=O)N2CCCCC2)cc1 ZINC000822137665 606773736 /nfs/dbraw/zinc/77/37/36/606773736.db2.gz WIHZRGDCDXHJPN-UHFFFAOYSA-N -1 3 363.421 3.594 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1Oc1ccc(C(=O)Nc2cccnc2)cc1 ZINC000822145249 606774228 /nfs/dbraw/zinc/77/42/28/606774228.db2.gz PJJMEELSKULZMT-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Fc1ccc(-c2csc(NCc3ccc(-c4nnn[n-]4)cc3)n2)cc1 ZINC000822753954 606799537 /nfs/dbraw/zinc/79/95/37/606799537.db2.gz TWGGYNKBCXUUKR-UHFFFAOYSA-N -1 3 352.398 3.741 20 0 FHADHM Fc1ccc(-c2csc(NCc3ccc(-c4nn[n-]n4)cc3)n2)cc1 ZINC000822753954 606799539 /nfs/dbraw/zinc/79/95/39/606799539.db2.gz TWGGYNKBCXUUKR-UHFFFAOYSA-N -1 3 352.398 3.741 20 0 FHADHM Cc1ccc(C)c([C@H]2CCCN2C(=O)C=Cc2ccccc2-c2nnn[n-]2)c1 ZINC000822230777 606807503 /nfs/dbraw/zinc/80/75/03/606807503.db2.gz QEMWRZVPSMPGGW-ZCPJJFRWSA-N -1 3 373.460 3.860 20 0 FHADHM Cc1ccc(C)c([C@H]2CCCN2C(=O)C=Cc2ccccc2-c2nn[n-]n2)c1 ZINC000822230777 606807504 /nfs/dbraw/zinc/80/75/04/606807504.db2.gz QEMWRZVPSMPGGW-ZCPJJFRWSA-N -1 3 373.460 3.860 20 0 FHADHM CN(c1ccccc1NC(=O)c1cc(-c2nnn[n-]2)cs1)C1CCCC1 ZINC000821619251 606809672 /nfs/dbraw/zinc/80/96/72/606809672.db2.gz PDCSILXXXDNWLT-UHFFFAOYSA-N -1 3 368.466 3.559 20 0 FHADHM CN(c1ccccc1NC(=O)c1cc(-c2nn[n-]n2)cs1)C1CCCC1 ZINC000821619251 606809674 /nfs/dbraw/zinc/80/96/74/606809674.db2.gz PDCSILXXXDNWLT-UHFFFAOYSA-N -1 3 368.466 3.559 20 0 FHADHM CC(C)CN(C(=O)c1cccc(-c2nnn[n-]2)c1)c1ccc(Cl)cc1 ZINC000820081647 606811814 /nfs/dbraw/zinc/81/18/14/606811814.db2.gz PDSJLCMJDKQGOU-UHFFFAOYSA-N -1 3 355.829 3.823 20 0 FHADHM CC(C)CN(C(=O)c1cccc(-c2nn[n-]n2)c1)c1ccc(Cl)cc1 ZINC000820081647 606811816 /nfs/dbraw/zinc/81/18/16/606811816.db2.gz PDSJLCMJDKQGOU-UHFFFAOYSA-N -1 3 355.829 3.823 20 0 FHADHM Cc1nc(CSCCCOc2cccc(-c3nnn[n-]3)c2)sc1C ZINC000822444684 606840992 /nfs/dbraw/zinc/84/09/92/606840992.db2.gz XKGNDCIUERZVMK-UHFFFAOYSA-N -1 3 361.496 3.642 20 0 FHADHM Cc1nc(CSCCCOc2cccc(-c3nn[n-]n3)c2)sc1C ZINC000822444684 606840993 /nfs/dbraw/zinc/84/09/93/606840993.db2.gz XKGNDCIUERZVMK-UHFFFAOYSA-N -1 3 361.496 3.642 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1cc(F)cc(Cl)c1 ZINC000823309376 606842572 /nfs/dbraw/zinc/84/25/72/606842572.db2.gz XSNNFIVHQIICTG-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1cc(F)cc(Cl)c1 ZINC000823309376 606842574 /nfs/dbraw/zinc/84/25/74/606842574.db2.gz XSNNFIVHQIICTG-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cc(F)cc(Cl)c2)c1-c1nnn[n-]1 ZINC000821466326 606849755 /nfs/dbraw/zinc/84/97/55/606849755.db2.gz VUKIPMIPHOFOIJ-UHFFFAOYSA-N -1 3 365.821 3.844 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cc(F)cc(Cl)c2)c1-c1nn[n-]n1 ZINC000821466326 606849756 /nfs/dbraw/zinc/84/97/56/606849756.db2.gz VUKIPMIPHOFOIJ-UHFFFAOYSA-N -1 3 365.821 3.844 20 0 FHADHM CCCCc1nc(CSc2ccc(-c3nnn[n-]3)cc2Cl)no1 ZINC000821077512 606851711 /nfs/dbraw/zinc/85/17/11/606851711.db2.gz JGNCKUHKFSESET-UHFFFAOYSA-N -1 3 350.835 3.538 20 0 FHADHM CCCCc1nc(CSc2ccc(-c3nn[n-]n3)cc2Cl)no1 ZINC000821077512 606851712 /nfs/dbraw/zinc/85/17/12/606851712.db2.gz JGNCKUHKFSESET-UHFFFAOYSA-N -1 3 350.835 3.538 20 0 FHADHM C[C@@H]1c2cc(Cl)cc(Cl)c2CCN1c1ccc(-c2nnn[n-]2)cn1 ZINC000820822337 606858224 /nfs/dbraw/zinc/85/82/24/606858224.db2.gz YSECFZNVGJQEQR-SECBINFHSA-N -1 3 361.236 3.692 20 0 FHADHM C[C@@H]1c2cc(Cl)cc(Cl)c2CCN1c1ccc(-c2nn[n-]n2)cn1 ZINC000820822337 606858225 /nfs/dbraw/zinc/85/82/25/606858225.db2.gz YSECFZNVGJQEQR-SECBINFHSA-N -1 3 361.236 3.692 20 0 FHADHM CCN(C(=O)c1cc(F)c(C)cc1F)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821161516 606861058 /nfs/dbraw/zinc/86/10/58/606861058.db2.gz ZBLURPZQKLXQOX-GFCCVEGCSA-N -1 3 371.391 3.677 20 0 FHADHM CCN(C(=O)c1cc(F)c(C)cc1F)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821161516 606861059 /nfs/dbraw/zinc/86/10/59/606861059.db2.gz ZBLURPZQKLXQOX-GFCCVEGCSA-N -1 3 371.391 3.677 20 0 FHADHM CCOc1cc(Br)ccc1NCc1ccccc1-c1nnn[n-]1 ZINC000821395437 606866658 /nfs/dbraw/zinc/86/66/58/606866658.db2.gz YAYGPIAIXRUUKT-UHFFFAOYSA-N -1 3 374.242 3.640 20 0 FHADHM CCOc1cc(Br)ccc1NCc1ccccc1-c1nn[n-]n1 ZINC000821395437 606866659 /nfs/dbraw/zinc/86/66/59/606866659.db2.gz YAYGPIAIXRUUKT-UHFFFAOYSA-N -1 3 374.242 3.640 20 0 FHADHM Cc1nc(CCNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)sc1C ZINC000822440605 606875410 /nfs/dbraw/zinc/87/54/10/606875410.db2.gz NTJCBWFKJPRHDF-UHFFFAOYSA-N -1 3 368.388 3.613 20 0 FHADHM Cc1nc(CCNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)sc1C ZINC000822440605 606875411 /nfs/dbraw/zinc/87/54/11/606875411.db2.gz NTJCBWFKJPRHDF-UHFFFAOYSA-N -1 3 368.388 3.613 20 0 FHADHM O[C@H](CNc1c(F)cc(-c2nnn[n-]2)cc1F)c1cc2ccccc2s1 ZINC000823689660 606878065 /nfs/dbraw/zinc/87/80/65/606878065.db2.gz IJXGARQRLNPBOZ-CYBMUJFWSA-N -1 3 373.388 3.505 20 0 FHADHM O[C@H](CNc1c(F)cc(-c2nn[n-]n2)cc1F)c1cc2ccccc2s1 ZINC000823689660 606878066 /nfs/dbraw/zinc/87/80/66/606878066.db2.gz IJXGARQRLNPBOZ-CYBMUJFWSA-N -1 3 373.388 3.505 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1N[C@@H]1CC2(CCC2)Oc2ccccc21 ZINC000822568105 606879860 /nfs/dbraw/zinc/87/98/60/606879860.db2.gz LKLDSJJUWVOSJW-CQSZACIVSA-N -1 3 368.828 3.774 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1N[C@@H]1CC2(CCC2)Oc2ccccc21 ZINC000822568105 606879861 /nfs/dbraw/zinc/87/98/61/606879861.db2.gz LKLDSJJUWVOSJW-CQSZACIVSA-N -1 3 368.828 3.774 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1N[C@H]1CC2(CCC2)Oc2ccccc21 ZINC000822568104 606880036 /nfs/dbraw/zinc/88/00/36/606880036.db2.gz LKLDSJJUWVOSJW-AWEZNQCLSA-N -1 3 368.828 3.774 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1N[C@H]1CC2(CCC2)Oc2ccccc21 ZINC000822568104 606880037 /nfs/dbraw/zinc/88/00/37/606880037.db2.gz LKLDSJJUWVOSJW-AWEZNQCLSA-N -1 3 368.828 3.774 20 0 FHADHM CCCN(Cc1ccn(C2CCCC2)n1)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000821104787 606884697 /nfs/dbraw/zinc/88/46/97/606884697.db2.gz QNGKSXFTWFIEPH-UHFFFAOYSA-N -1 3 365.485 3.591 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cccc(Cl)c1F ZINC000821123128 606899555 /nfs/dbraw/zinc/89/95/55/606899555.db2.gz KJEACYWBMIYQJS-UHFFFAOYSA-N -1 3 374.807 3.733 20 0 FHADHM Fc1ccc(CNc2ccc(SC(F)F)cc2)cc1-c1nnn[n-]1 ZINC000822772227 606926302 /nfs/dbraw/zinc/92/63/02/606926302.db2.gz UMHJNUZTPFRPGQ-UHFFFAOYSA-N -1 3 351.357 3.933 20 0 FHADHM Fc1ccc(CNc2ccc(SC(F)F)cc2)cc1-c1nn[n-]n1 ZINC000822772227 606926304 /nfs/dbraw/zinc/92/63/04/606926304.db2.gz UMHJNUZTPFRPGQ-UHFFFAOYSA-N -1 3 351.357 3.933 20 0 FHADHM CC(C)c1ccc(N(C)C(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)cc1 ZINC000820192567 606935977 /nfs/dbraw/zinc/93/59/77/606935977.db2.gz UCWIJAVPCCCWDC-UHFFFAOYSA-N -1 3 357.364 3.545 20 0 FHADHM CC(C)c1ccc(N(C)C(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)cc1 ZINC000820192567 606935979 /nfs/dbraw/zinc/93/59/79/606935979.db2.gz UCWIJAVPCCCWDC-UHFFFAOYSA-N -1 3 357.364 3.545 20 0 FHADHM COC1CCC(CNc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)CC1 ZINC000821679616 606943298 /nfs/dbraw/zinc/94/32/98/606943298.db2.gz FLDVCZMTMUETRW-UHFFFAOYSA-N -1 3 355.364 3.503 20 0 FHADHM COC1CCC(CNc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)CC1 ZINC000821679616 606943300 /nfs/dbraw/zinc/94/33/00/606943300.db2.gz FLDVCZMTMUETRW-UHFFFAOYSA-N -1 3 355.364 3.503 20 0 FHADHM Cc1cccc([C@@H](C)OC(=O)CSCc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737391332 606952499 /nfs/dbraw/zinc/95/24/99/606952499.db2.gz ZXKQSVYUEWZERW-CQSZACIVSA-N -1 3 368.462 3.713 20 0 FHADHM Cc1cccc([C@@H](C)OC(=O)CSCc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737391332 606952501 /nfs/dbraw/zinc/95/25/01/606952501.db2.gz ZXKQSVYUEWZERW-CQSZACIVSA-N -1 3 368.462 3.713 20 0 FHADHM CN(C(=O)C[C@H]1CCc2ccccc21)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821569719 606960700 /nfs/dbraw/zinc/96/07/00/606960700.db2.gz SWNKQPRVUPSGSR-CYBMUJFWSA-N -1 3 367.840 3.603 20 0 FHADHM CN(C(=O)C[C@H]1CCc2ccccc21)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821569719 606960701 /nfs/dbraw/zinc/96/07/01/606960701.db2.gz SWNKQPRVUPSGSR-CYBMUJFWSA-N -1 3 367.840 3.603 20 0 FHADHM Clc1ncc(CSCCCOc2cccc(-c3nnn[n-]3)c2)s1 ZINC000822590095 606987616 /nfs/dbraw/zinc/98/76/16/606987616.db2.gz HXNKCOMOVMHJOU-UHFFFAOYSA-N -1 3 367.887 3.679 20 0 FHADHM Clc1ncc(CSCCCOc2cccc(-c3nn[n-]n3)c2)s1 ZINC000822590095 606987618 /nfs/dbraw/zinc/98/76/18/606987618.db2.gz HXNKCOMOVMHJOU-UHFFFAOYSA-N -1 3 367.887 3.679 20 0 FHADHM Cc1ccccc1[C@H](C)NC(=O)[C@H](C)Sc1cccc(-c2nnn[n-]2)c1 ZINC000822345731 607010679 /nfs/dbraw/zinc/01/06/79/607010679.db2.gz QDZMLUYDZGQASG-KBPBESRZSA-N -1 3 367.478 3.533 20 0 FHADHM Cc1ccccc1[C@H](C)NC(=O)[C@H](C)Sc1cccc(-c2nn[n-]n2)c1 ZINC000822345731 607010680 /nfs/dbraw/zinc/01/06/80/607010680.db2.gz QDZMLUYDZGQASG-KBPBESRZSA-N -1 3 367.478 3.533 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)c(CSCc2cc(-c3ccco3)on2)c1 ZINC000822758355 607035584 /nfs/dbraw/zinc/03/55/84/607035584.db2.gz MPZORGFPPBKGMI-UHFFFAOYSA-N -1 3 357.370 3.687 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)c(CSCc2cc(-c3ccco3)on2)c1 ZINC000822758355 607035586 /nfs/dbraw/zinc/03/55/86/607035586.db2.gz MPZORGFPPBKGMI-UHFFFAOYSA-N -1 3 357.370 3.687 20 0 FHADHM Cc1sc2ncnc(SCc3cc(F)ccc3-c3nnn[n-]3)c2c1C ZINC000822564123 607038134 /nfs/dbraw/zinc/03/81/34/607038134.db2.gz VCONZTXJZJLSLI-UHFFFAOYSA-N -1 3 372.454 3.920 20 0 FHADHM Cc1sc2ncnc(SCc3cc(F)ccc3-c3nn[n-]n3)c2c1C ZINC000822564123 607038135 /nfs/dbraw/zinc/03/81/35/607038135.db2.gz VCONZTXJZJLSLI-UHFFFAOYSA-N -1 3 372.454 3.920 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CN[C@@H]1CCCOc2c(Cl)cccc21 ZINC000822739692 607058239 /nfs/dbraw/zinc/05/82/39/607058239.db2.gz BUPKUDQTRDHZLF-MRXNPFEDSA-N -1 3 373.819 3.663 20 0 FHADHM C[C@H](C(=O)OCc1cc(F)ccc1-c1nnn[n-]1)c1cccc(Cl)c1 ZINC000819884031 607083472 /nfs/dbraw/zinc/08/34/72/607083472.db2.gz RGJFKOPHBXSEGA-JTQLQIEISA-N -1 3 360.776 3.506 20 0 FHADHM C[C@H](C(=O)OCc1cc(F)ccc1-c1nn[n-]n1)c1cccc(Cl)c1 ZINC000819884031 607083475 /nfs/dbraw/zinc/08/34/75/607083475.db2.gz RGJFKOPHBXSEGA-JTQLQIEISA-N -1 3 360.776 3.506 20 0 FHADHM C[C@@H](NC(=O)N(C1CC1)C1CCC(C)CC1)c1cccc(-c2nnn[n-]2)c1 ZINC000820690537 607108264 /nfs/dbraw/zinc/10/82/64/607108264.db2.gz NQXKWXYBBZLXFF-XOYHFGRZSA-N -1 3 368.485 3.680 20 0 FHADHM C[C@@H](NC(=O)N(C1CC1)C1CCC(C)CC1)c1cccc(-c2nn[n-]n2)c1 ZINC000820690537 607108266 /nfs/dbraw/zinc/10/82/66/607108266.db2.gz NQXKWXYBBZLXFF-XOYHFGRZSA-N -1 3 368.485 3.680 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1N1CCC2(CC1)OCc1ccccc12 ZINC000822581730 607119577 /nfs/dbraw/zinc/11/95/77/607119577.db2.gz MJTJIXXLKPATKR-UHFFFAOYSA-N -1 3 367.840 3.546 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1N1CCC2(CC1)OCc1ccccc12 ZINC000822581730 607119579 /nfs/dbraw/zinc/11/95/79/607119579.db2.gz MJTJIXXLKPATKR-UHFFFAOYSA-N -1 3 367.840 3.546 20 0 FHADHM O=C(Nc1ccc(Oc2ccccc2-c2nnn[n-]2)cc1)[C@@H]1CC12CCC2 ZINC000823355996 607121059 /nfs/dbraw/zinc/12/10/59/607121059.db2.gz HWIKCCDQVWCERX-INIZCTEOSA-N -1 3 361.405 3.788 20 0 FHADHM O=C(Nc1ccc(Oc2ccccc2-c2nn[n-]n2)cc1)[C@@H]1CC12CCC2 ZINC000823355996 607121061 /nfs/dbraw/zinc/12/10/61/607121061.db2.gz HWIKCCDQVWCERX-INIZCTEOSA-N -1 3 361.405 3.788 20 0 FHADHM Fc1cc(F)c2ncc(-c3nnn[n-]3)c(N[C@H]3CCCC(F)(F)C3)c2c1 ZINC000822753605 607131082 /nfs/dbraw/zinc/13/10/82/607131082.db2.gz PDLKKKNUENLFDJ-VIFPVBQESA-N -1 3 366.322 3.683 20 0 FHADHM Fc1cc(F)c2ncc(-c3nn[n-]n3)c(N[C@H]3CCCC(F)(F)C3)c2c1 ZINC000822753605 607131083 /nfs/dbraw/zinc/13/10/83/607131083.db2.gz PDLKKKNUENLFDJ-VIFPVBQESA-N -1 3 366.322 3.683 20 0 FHADHM O=C(Oc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1)[C@H]1CC12CCC2 ZINC000823453858 607132238 /nfs/dbraw/zinc/13/22/38/607132238.db2.gz CEEQNUSKVJHWOV-QGZVFWFLSA-N -1 3 362.389 3.755 20 0 FHADHM O=C(Oc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1)[C@H]1CC12CCC2 ZINC000823453858 607132240 /nfs/dbraw/zinc/13/22/40/607132240.db2.gz CEEQNUSKVJHWOV-QGZVFWFLSA-N -1 3 362.389 3.755 20 0 FHADHM CCc1oc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCC3)cc1C ZINC000821559166 607148120 /nfs/dbraw/zinc/14/81/20/607148120.db2.gz XJHQGBAJMFAEKM-UHFFFAOYSA-N -1 3 357.439 3.523 20 0 FHADHM CCc1oc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCC3)cc1C ZINC000821559166 607148122 /nfs/dbraw/zinc/14/81/22/607148122.db2.gz XJHQGBAJMFAEKM-UHFFFAOYSA-N -1 3 357.439 3.523 20 0 FHADHM CCc1oc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CC[C@H](C)C3)cc1C ZINC000821559117 607151100 /nfs/dbraw/zinc/15/11/00/607151100.db2.gz UKOMJNPEUWGSEF-VIFPVBQESA-N -1 3 371.466 3.769 20 0 FHADHM CCc1oc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CC[C@H](C)C3)cc1C ZINC000821559117 607151102 /nfs/dbraw/zinc/15/11/02/607151102.db2.gz UKOMJNPEUWGSEF-VIFPVBQESA-N -1 3 371.466 3.769 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccc2sccc2c1 ZINC000823309100 607151652 /nfs/dbraw/zinc/15/16/52/607151652.db2.gz SHJHVLAVQSGZSI-UHFFFAOYSA-N -1 3 355.810 3.987 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccc2sccc2c1 ZINC000823309100 607151654 /nfs/dbraw/zinc/15/16/54/607151654.db2.gz SHJHVLAVQSGZSI-UHFFFAOYSA-N -1 3 355.810 3.987 20 0 FHADHM CC(C)CC[C@@H]1CCCN1C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820072266 607152733 /nfs/dbraw/zinc/15/27/33/607152733.db2.gz DDXKOSLTOIPXDV-PBHICJAKSA-N -1 3 356.474 3.538 20 0 FHADHM CC(C)CC[C@@H]1CCCN1C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820072266 607152735 /nfs/dbraw/zinc/15/27/35/607152735.db2.gz DDXKOSLTOIPXDV-PBHICJAKSA-N -1 3 356.474 3.538 20 0 FHADHM CCCCC[C@@H]1CCCN1C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821048601 607153237 /nfs/dbraw/zinc/15/32/37/607153237.db2.gz CZTIIMKYLBVAFL-RHSMWYFYSA-N -1 3 356.474 3.682 20 0 FHADHM CCCCC[C@@H]1CCCN1C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821048601 607153239 /nfs/dbraw/zinc/15/32/39/607153239.db2.gz CZTIIMKYLBVAFL-RHSMWYFYSA-N -1 3 356.474 3.682 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@H](C)OC2CCCCCC2)s1 ZINC000821465662 607157093 /nfs/dbraw/zinc/15/70/93/607157093.db2.gz NBORZRWSEFQCOV-NSHDSACASA-N -1 3 363.487 3.557 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@H](C)OC2CCCCCC2)s1 ZINC000821465662 607157094 /nfs/dbraw/zinc/15/70/94/607157094.db2.gz NBORZRWSEFQCOV-NSHDSACASA-N -1 3 363.487 3.557 20 0 FHADHM CCOC(=O)c1ccc(-c2nnn[n-]2)c(S[C@@H](C)c2ccccc2C)n1 ZINC000821343160 607160934 /nfs/dbraw/zinc/16/09/34/607160934.db2.gz LBCFAUHOBSDVGL-LBPRGKRZSA-N -1 3 369.450 3.600 20 0 FHADHM CCOC(=O)c1ccc(-c2nn[n-]n2)c(S[C@@H](C)c2ccccc2C)n1 ZINC000821343160 607160936 /nfs/dbraw/zinc/16/09/36/607160936.db2.gz LBCFAUHOBSDVGL-LBPRGKRZSA-N -1 3 369.450 3.600 20 0 FHADHM c1ccc2cc(NCc3nnc(-c4cccc(-c5nnn[n-]5)c4)o3)ccc2c1 ZINC000823738432 607165332 /nfs/dbraw/zinc/16/53/32/607165332.db2.gz VGNOMYGKKIEICS-UHFFFAOYSA-N -1 3 369.388 3.682 20 0 FHADHM c1ccc2cc(NCc3nnc(-c4cccc(-c5nn[n-]n5)c4)o3)ccc2c1 ZINC000823738432 607165333 /nfs/dbraw/zinc/16/53/33/607165333.db2.gz VGNOMYGKKIEICS-UHFFFAOYSA-N -1 3 369.388 3.682 20 0 FHADHM FC(F)(F)c1ccc(N[C@H]2CCOc3ccccc32)c(-c2nnn[n-]2)c1 ZINC000822723794 607173101 /nfs/dbraw/zinc/17/31/01/607173101.db2.gz ONPAAKIYMBADHM-AWEZNQCLSA-N -1 3 361.327 3.821 20 0 FHADHM FC(F)(F)c1ccc(N[C@H]2CCOc3ccccc32)c(-c2nn[n-]n2)c1 ZINC000822723794 607173102 /nfs/dbraw/zinc/17/31/02/607173102.db2.gz ONPAAKIYMBADHM-AWEZNQCLSA-N -1 3 361.327 3.821 20 0 FHADHM C[C@H](CCOc1ccccc1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820249755 607189822 /nfs/dbraw/zinc/18/98/22/607189822.db2.gz ZIPINZOMEDLXBH-GFCCVEGCSA-N -1 3 371.828 3.564 20 0 FHADHM C[C@H](CCOc1ccccc1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820249755 607189823 /nfs/dbraw/zinc/18/98/23/607189823.db2.gz ZIPINZOMEDLXBH-GFCCVEGCSA-N -1 3 371.828 3.564 20 0 FHADHM Cc1ccc(C)c(SCC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)c1 ZINC000822232067 607190848 /nfs/dbraw/zinc/19/08/48/607190848.db2.gz SDIZVCXFETYVNT-UHFFFAOYSA-N -1 3 373.869 3.868 20 0 FHADHM Cc1ccc(C)c(SCC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)c1 ZINC000822232067 607190849 /nfs/dbraw/zinc/19/08/49/607190849.db2.gz SDIZVCXFETYVNT-UHFFFAOYSA-N -1 3 373.869 3.868 20 0 FHADHM O=C(C[C@H]1CCCc2ccccc21)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822945644 607192165 /nfs/dbraw/zinc/19/21/65/607192165.db2.gz MKEWQVXBTGUZFE-CYBMUJFWSA-N -1 3 367.840 3.969 20 0 FHADHM O=C(C[C@H]1CCCc2ccccc21)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822945644 607192166 /nfs/dbraw/zinc/19/21/66/607192166.db2.gz MKEWQVXBTGUZFE-CYBMUJFWSA-N -1 3 367.840 3.969 20 0 FHADHM C[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820675219 607196426 /nfs/dbraw/zinc/19/64/26/607196426.db2.gz ILFMIEVKTBFXJG-UEKVPHQBSA-N -1 3 360.849 3.705 20 0 FHADHM C[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820675219 607196427 /nfs/dbraw/zinc/19/64/27/607196427.db2.gz ILFMIEVKTBFXJG-UEKVPHQBSA-N -1 3 360.849 3.705 20 0 FHADHM CC(C)CC[C@@H]1CCCN1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820073090 607197827 /nfs/dbraw/zinc/19/78/27/607197827.db2.gz POHGLDLFNKWSTB-ZDUSSCGKSA-N -1 3 362.865 3.953 20 0 FHADHM CC(C)CC[C@@H]1CCCN1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820073090 607197828 /nfs/dbraw/zinc/19/78/28/607197828.db2.gz POHGLDLFNKWSTB-ZDUSSCGKSA-N -1 3 362.865 3.953 20 0 FHADHM CC(C)C[C@@H]1CCCCN1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820063501 607198032 /nfs/dbraw/zinc/19/80/32/607198032.db2.gz VANHZFPUVAICIT-ZDUSSCGKSA-N -1 3 362.865 3.953 20 0 FHADHM CC(C)C[C@@H]1CCCCN1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820063501 607198033 /nfs/dbraw/zinc/19/80/33/607198033.db2.gz VANHZFPUVAICIT-ZDUSSCGKSA-N -1 3 362.865 3.953 20 0 FHADHM CC[C@@H](c1ccncc1)N(C)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820945779 607201661 /nfs/dbraw/zinc/20/16/61/607201661.db2.gz VMXKDLLHZYXODZ-HNNXBMFYSA-N -1 3 371.832 3.530 20 0 FHADHM CC[C@@H](c1ccncc1)N(C)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820945779 607201662 /nfs/dbraw/zinc/20/16/62/607201662.db2.gz VMXKDLLHZYXODZ-HNNXBMFYSA-N -1 3 371.832 3.530 20 0 FHADHM Cc1sc(NC(=O)c2ccc(F)c(Cl)c2)c(-c2nn[n-]n2)c1C ZINC000822564320 607235967 /nfs/dbraw/zinc/23/59/67/607235967.db2.gz ZPLIEIDZFCRJKZ-UHFFFAOYSA-N -1 3 351.794 3.590 20 0 FHADHM Cc1sc(NC(=O)c2ccc(F)c(Cl)c2)c(-c2nnn[n-]2)c1C ZINC000822564320 607235966 /nfs/dbraw/zinc/23/59/66/607235966.db2.gz ZPLIEIDZFCRJKZ-UHFFFAOYSA-N -1 3 351.794 3.590 20 0 FHADHM C[C@@]1(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)CCCc2ccccc21 ZINC000820577552 607240225 /nfs/dbraw/zinc/24/02/25/607240225.db2.gz QXPRSHJOCCRWII-LJQANCHMSA-N -1 3 367.840 3.753 20 0 FHADHM C[C@@]1(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)CCCc2ccccc21 ZINC000820577552 607240226 /nfs/dbraw/zinc/24/02/26/607240226.db2.gz QXPRSHJOCCRWII-LJQANCHMSA-N -1 3 367.840 3.753 20 0 FHADHM CC(C)(Cc1ccccc1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000819988359 607240252 /nfs/dbraw/zinc/24/02/52/607240252.db2.gz YWCMVHMLIHDQDC-UHFFFAOYSA-N -1 3 355.829 3.728 20 0 FHADHM CC(C)(Cc1ccccc1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000819988359 607240253 /nfs/dbraw/zinc/24/02/53/607240253.db2.gz YWCMVHMLIHDQDC-UHFFFAOYSA-N -1 3 355.829 3.728 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)c1cccc(F)c1Cl ZINC000823318341 607241817 /nfs/dbraw/zinc/24/18/17/607241817.db2.gz COOVANLGMLDDCN-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)c1cccc(F)c1Cl ZINC000823318341 607241818 /nfs/dbraw/zinc/24/18/18/607241818.db2.gz COOVANLGMLDDCN-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccccc1C(F)(F)F ZINC000823318668 607243254 /nfs/dbraw/zinc/24/32/54/607243254.db2.gz GZIBYLOTOZGTBG-UHFFFAOYSA-N -1 3 367.718 3.791 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccccc1C(F)(F)F ZINC000823318668 607243255 /nfs/dbraw/zinc/24/32/55/607243255.db2.gz GZIBYLOTOZGTBG-UHFFFAOYSA-N -1 3 367.718 3.791 20 0 FHADHM O=C(Oc1ccc(-c2nnn[n-]2)cc1)c1ccc(CCC(F)(F)F)cc1 ZINC000826468494 607776854 /nfs/dbraw/zinc/77/68/54/607776854.db2.gz UDTUZDKCWXDCEZ-UHFFFAOYSA-N -1 3 362.311 3.581 20 0 FHADHM O=C(Oc1ccc(-c2nn[n-]n2)cc1)c1ccc(CCC(F)(F)F)cc1 ZINC000826468494 607776855 /nfs/dbraw/zinc/77/68/55/607776855.db2.gz UDTUZDKCWXDCEZ-UHFFFAOYSA-N -1 3 362.311 3.581 20 0 FHADHM c1c(-c2ccccc2)oc2ncnc(NCc3cccc(-c4nnn[n-]4)c3)c12 ZINC000826519052 607781053 /nfs/dbraw/zinc/78/10/53/607781053.db2.gz HYJZMMGWSMFLTI-UHFFFAOYSA-N -1 3 369.388 3.682 20 0 FHADHM c1c(-c2ccccc2)oc2ncnc(NCc3cccc(-c4nn[n-]n4)c3)c12 ZINC000826519052 607781054 /nfs/dbraw/zinc/78/10/54/607781054.db2.gz HYJZMMGWSMFLTI-UHFFFAOYSA-N -1 3 369.388 3.682 20 0 FHADHM CC[C@@H](CC(=O)Nc1ccc(F)cc1-c1nnn[n-]1)c1ccc(OC)cc1 ZINC000825081154 607786237 /nfs/dbraw/zinc/78/62/37/607786237.db2.gz GWQCSWZHDPGVPO-LBPRGKRZSA-N -1 3 369.400 3.537 20 0 FHADHM CC[C@@H](CC(=O)Nc1ccc(F)cc1-c1nn[n-]n1)c1ccc(OC)cc1 ZINC000825081154 607786238 /nfs/dbraw/zinc/78/62/38/607786238.db2.gz GWQCSWZHDPGVPO-LBPRGKRZSA-N -1 3 369.400 3.537 20 0 FHADHM CCN(C(=O)Cc1csc2ccccc12)c1ccc(-c2nnn[n-]2)cc1 ZINC000825377248 607797451 /nfs/dbraw/zinc/79/74/51/607797451.db2.gz YYZCAEBZIXGQKZ-UHFFFAOYSA-N -1 3 363.446 3.677 20 0 FHADHM CCN(C(=O)Cc1csc2ccccc12)c1ccc(-c2nn[n-]n2)cc1 ZINC000825377248 607797452 /nfs/dbraw/zinc/79/74/52/607797452.db2.gz YYZCAEBZIXGQKZ-UHFFFAOYSA-N -1 3 363.446 3.677 20 0 FHADHM CCN(C(=O)C[C@@H](C)c1cccc(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825367568 607798162 /nfs/dbraw/zinc/79/81/62/607798162.db2.gz SQRHPYOIMAXGLQ-CYBMUJFWSA-N -1 3 353.401 3.553 20 0 FHADHM CCN(C(=O)C[C@@H](C)c1cccc(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825367568 607798163 /nfs/dbraw/zinc/79/81/63/607798163.db2.gz SQRHPYOIMAXGLQ-CYBMUJFWSA-N -1 3 353.401 3.553 20 0 FHADHM Cc1c(NC(=O)[C@H](C)Cc2ccccc2Cl)cccc1-c1nnn[n-]1 ZINC000826240920 607823067 /nfs/dbraw/zinc/82/30/67/607823067.db2.gz LOLUJQIXOZHIDG-LLVKDONJSA-N -1 3 355.829 3.646 20 0 FHADHM Cc1c(NC(=O)[C@H](C)Cc2ccccc2Cl)cccc1-c1nn[n-]n1 ZINC000826240920 607823068 /nfs/dbraw/zinc/82/30/68/607823068.db2.gz LOLUJQIXOZHIDG-LLVKDONJSA-N -1 3 355.829 3.646 20 0 FHADHM CC(C)(CCC(=O)Nc1ccc(F)cc1-c1nnn[n-]1)c1ccccc1 ZINC000824152858 607830526 /nfs/dbraw/zinc/83/05/26/607830526.db2.gz QFKLPLBQZKNSEC-UHFFFAOYSA-N -1 3 353.401 3.702 20 0 FHADHM CC(C)(CCC(=O)Nc1ccc(F)cc1-c1nn[n-]n1)c1ccccc1 ZINC000824152858 607830527 /nfs/dbraw/zinc/83/05/27/607830527.db2.gz QFKLPLBQZKNSEC-UHFFFAOYSA-N -1 3 353.401 3.702 20 0 FHADHM CCCCC[C@H](C)NC(=O)c1c(Cl)cc(-c2nnn[n-]2)cc1Cl ZINC000825268379 607833263 /nfs/dbraw/zinc/83/32/63/607833263.db2.gz UIVZDFPFCIYSOA-VIFPVBQESA-N -1 3 356.257 3.872 20 0 FHADHM CCCCC[C@H](C)NC(=O)c1c(Cl)cc(-c2nn[n-]n2)cc1Cl ZINC000825268379 607833264 /nfs/dbraw/zinc/83/32/64/607833264.db2.gz UIVZDFPFCIYSOA-VIFPVBQESA-N -1 3 356.257 3.872 20 0 FHADHM Cc1c(F)cccc1NC(=O)c1c(Cl)cc(-c2nnn[n-]2)cc1Cl ZINC000826240961 607835220 /nfs/dbraw/zinc/83/52/20/607835220.db2.gz MYRAEKNEIUTXMS-UHFFFAOYSA-N -1 3 366.183 3.873 20 0 FHADHM Cc1c(F)cccc1NC(=O)c1c(Cl)cc(-c2nn[n-]n2)cc1Cl ZINC000826240961 607835221 /nfs/dbraw/zinc/83/52/21/607835221.db2.gz MYRAEKNEIUTXMS-UHFFFAOYSA-N -1 3 366.183 3.873 20 0 FHADHM CCOCc1ccccc1CNc1ccc2cc(-c3nnn[n-]3)ccc2n1 ZINC000825604994 607839501 /nfs/dbraw/zinc/83/95/01/607839501.db2.gz MONWTMHMORGMIL-UHFFFAOYSA-N -1 3 360.421 3.564 20 0 FHADHM CCOCc1ccccc1CNc1ccc2cc(-c3nn[n-]n3)ccc2n1 ZINC000825604994 607839502 /nfs/dbraw/zinc/83/95/02/607839502.db2.gz MONWTMHMORGMIL-UHFFFAOYSA-N -1 3 360.421 3.564 20 0 FHADHM COc1cccc(F)c1[C@H](C)Nc1ccc2cc(-c3nnn[n-]3)ccc2n1 ZINC000826216473 607842122 /nfs/dbraw/zinc/84/21/22/607842122.db2.gz AENFJQMVUPXEHL-NSHDSACASA-N -1 3 364.384 3.736 20 0 FHADHM COc1cccc(F)c1[C@H](C)Nc1ccc2cc(-c3nn[n-]n3)ccc2n1 ZINC000826216473 607842123 /nfs/dbraw/zinc/84/21/23/607842123.db2.gz AENFJQMVUPXEHL-NSHDSACASA-N -1 3 364.384 3.736 20 0 FHADHM CN(C)C(=O)c1cccc(CSc2ccc(-c3nnn[n-]3)cc2Cl)c1 ZINC000825851975 607844426 /nfs/dbraw/zinc/84/44/26/607844426.db2.gz ZGZHSZGZSZQHLL-UHFFFAOYSA-N -1 3 373.869 3.514 20 0 FHADHM CN(C)C(=O)c1cccc(CSc2ccc(-c3nn[n-]n3)cc2Cl)c1 ZINC000825851975 607844427 /nfs/dbraw/zinc/84/44/27/607844427.db2.gz ZGZHSZGZSZQHLL-UHFFFAOYSA-N -1 3 373.869 3.514 20 0 FHADHM CC1(NC(=O)Nc2ccc(Oc3ccc(-c4nnn[n-]4)cc3)cc2)CCC1 ZINC000824829459 607856164 /nfs/dbraw/zinc/85/61/64/607856164.db2.gz DVVQRCPXQRYUIT-UHFFFAOYSA-N -1 3 364.409 3.723 20 0 FHADHM CC1(NC(=O)Nc2ccc(Oc3ccc(-c4nn[n-]n4)cc3)cc2)CCC1 ZINC000824829459 607856165 /nfs/dbraw/zinc/85/61/65/607856165.db2.gz DVVQRCPXQRYUIT-UHFFFAOYSA-N -1 3 364.409 3.723 20 0 FHADHM Cc1c(C(=O)N(C)c2ccccc2-c2nnn[n-]2)cccc1-c1ccccn1 ZINC000826234504 607861331 /nfs/dbraw/zinc/86/13/31/607861331.db2.gz ZKJBICUUHWOOSF-UHFFFAOYSA-N -1 3 370.416 3.514 20 0 FHADHM Cc1c(C(=O)N(C)c2ccccc2-c2nn[n-]n2)cccc1-c1ccccn1 ZINC000826234504 607861332 /nfs/dbraw/zinc/86/13/32/607861332.db2.gz ZKJBICUUHWOOSF-UHFFFAOYSA-N -1 3 370.416 3.514 20 0 FHADHM O[C@H](COc1ccccc1-c1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000826505183 607869743 /nfs/dbraw/zinc/86/97/43/607869743.db2.gz PAWWOBCQBZACAX-LJQANCHMSA-N -1 3 358.401 3.646 20 0 FHADHM O[C@H](COc1ccccc1-c1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000826505183 607869744 /nfs/dbraw/zinc/86/97/44/607869744.db2.gz PAWWOBCQBZACAX-LJQANCHMSA-N -1 3 358.401 3.646 20 0 FHADHM CCN(C(=O)[C@H]1CCCC(C)(C)C1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825367214 607885924 /nfs/dbraw/zinc/88/59/24/607885924.db2.gz LEIFTEOJDFMKRE-PBHICJAKSA-N -1 3 355.486 3.993 20 0 FHADHM CCN(C(=O)[C@H]1CCCC(C)(C)C1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825367214 607885925 /nfs/dbraw/zinc/88/59/25/607885925.db2.gz LEIFTEOJDFMKRE-PBHICJAKSA-N -1 3 355.486 3.993 20 0 FHADHM C[C@@H](Cc1cccc(Cl)c1)C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000824459073 607906080 /nfs/dbraw/zinc/90/60/80/607906080.db2.gz ZJSCPWBJDLNSHA-STQMWFEESA-N -1 3 369.856 3.576 20 0 FHADHM C[C@@H](Cc1cccc(Cl)c1)C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000824459073 607906081 /nfs/dbraw/zinc/90/60/81/607906081.db2.gz ZJSCPWBJDLNSHA-STQMWFEESA-N -1 3 369.856 3.576 20 0 FHADHM Clc1cccc(Cl)c1C1(NCc2ccccc2-c2nn[n-]n2)CC1 ZINC000826353381 607910807 /nfs/dbraw/zinc/91/08/07/607910807.db2.gz MZEGSDNIYJDFEV-UHFFFAOYSA-N -1 3 360.248 3.952 20 0 FHADHM CS[C@@H](C)CC(=O)Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000826224943 607934139 /nfs/dbraw/zinc/93/41/39/607934139.db2.gz POKICAMXXMMSKZ-LBPRGKRZSA-N -1 3 369.450 3.739 20 0 FHADHM CS[C@@H](C)CC(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000826224943 607934140 /nfs/dbraw/zinc/93/41/40/607934140.db2.gz POKICAMXXMMSKZ-LBPRGKRZSA-N -1 3 369.450 3.739 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@@H]2C(=O)N2CCc3ccc(-c4nnn[n-]4)cc32)cc1 ZINC000824347840 607947771 /nfs/dbraw/zinc/94/77/71/607947771.db2.gz PGERBONHADNMTK-OALUTQOASA-N -1 3 373.460 3.683 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@@H]2C(=O)N2CCc3ccc(-c4nn[n-]n4)cc32)cc1 ZINC000824347840 607947772 /nfs/dbraw/zinc/94/77/72/607947772.db2.gz PGERBONHADNMTK-OALUTQOASA-N -1 3 373.460 3.683 20 0 FHADHM C[C@H](C(=O)N1CCc2ccc(-c3nnn[n-]3)cc21)c1ccc2ccccc2c1 ZINC000824039280 607949881 /nfs/dbraw/zinc/94/98/81/607949881.db2.gz DAGOZXANQNFEBI-AWEZNQCLSA-N -1 3 369.428 3.713 20 0 FHADHM C[C@H](C(=O)N1CCc2ccc(-c3nn[n-]n3)cc21)c1ccc2ccccc2c1 ZINC000824039280 607949882 /nfs/dbraw/zinc/94/98/82/607949882.db2.gz DAGOZXANQNFEBI-AWEZNQCLSA-N -1 3 369.428 3.713 20 0 FHADHM Cc1cc(N[C@H](C)c2cccc(-c3nnn[n-]3)c2)ncc1Br ZINC000826270569 607965864 /nfs/dbraw/zinc/96/58/64/607965864.db2.gz FSTKZOSSUDVPDP-SNVBAGLBSA-N -1 3 359.231 3.506 20 0 FHADHM Cc1cc(N[C@H](C)c2cccc(-c3nn[n-]n3)c2)ncc1Br ZINC000826270569 607965865 /nfs/dbraw/zinc/96/58/65/607965865.db2.gz FSTKZOSSUDVPDP-SNVBAGLBSA-N -1 3 359.231 3.506 20 0 FHADHM Cc1cc([C@@H](Nc2ncc(-c3nnn[n-]3)cc2Cl)C2CC2)ccc1F ZINC000826262670 607968897 /nfs/dbraw/zinc/96/88/97/607968897.db2.gz VDPOYLFLUPOABF-HNNXBMFYSA-N -1 3 358.808 3.926 20 0 FHADHM Cc1cc([C@@H](Nc2ncc(-c3nn[n-]n3)cc2Cl)C2CC2)ccc1F ZINC000826262670 607968898 /nfs/dbraw/zinc/96/88/98/607968898.db2.gz VDPOYLFLUPOABF-HNNXBMFYSA-N -1 3 358.808 3.926 20 0 FHADHM CCCN(Cc1csc(C2CC2)n1)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000825322472 607982534 /nfs/dbraw/zinc/98/25/34/607982534.db2.gz FDKVQRKSGUSYTI-UHFFFAOYSA-N -1 3 354.483 3.613 20 0 FHADHM CCCN(Cc1csc(C2CC2)n1)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000825322472 607982535 /nfs/dbraw/zinc/98/25/35/607982535.db2.gz FDKVQRKSGUSYTI-UHFFFAOYSA-N -1 3 354.483 3.613 20 0 FHADHM FC(F)(F)c1cc(NCc2csc(C3CC3)n2)ccc1-c1nnn[n-]1 ZINC000826368425 607982935 /nfs/dbraw/zinc/98/29/35/607982935.db2.gz OYQDSKNFEIEWMW-UHFFFAOYSA-N -1 3 366.372 3.832 20 0 FHADHM FC(F)(F)c1cc(NCc2csc(C3CC3)n2)ccc1-c1nn[n-]n1 ZINC000826368425 607982936 /nfs/dbraw/zinc/98/29/36/607982936.db2.gz OYQDSKNFEIEWMW-UHFFFAOYSA-N -1 3 366.372 3.832 20 0 FHADHM Cc1ncc(-c2ccccc2)cc1NC(=O)c1sccc1-c1nnn[n-]1 ZINC000826329806 608027317 /nfs/dbraw/zinc/02/73/17/608027317.db2.gz SLUFYWMNQATJCH-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1ncc(-c2ccccc2)cc1NC(=O)c1sccc1-c1nn[n-]n1 ZINC000826329806 608027318 /nfs/dbraw/zinc/02/73/18/608027318.db2.gz SLUFYWMNQATJCH-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Oc1ccc(CN(Cc2ccco2)c2cccc(F)c2-c2nnn[n-]2)cc1 ZINC000826511346 608076686 /nfs/dbraw/zinc/07/66/86/608076686.db2.gz LVOCEWXMFJQMMF-UHFFFAOYSA-N -1 3 365.368 3.511 20 0 FHADHM Oc1ccc(CN(Cc2ccco2)c2cccc(F)c2-c2nn[n-]n2)cc1 ZINC000826511346 608076687 /nfs/dbraw/zinc/07/66/87/608076687.db2.gz LVOCEWXMFJQMMF-UHFFFAOYSA-N -1 3 365.368 3.511 20 0 FHADHM CCn1c2ccc(-c3nnn[n-]3)cc2nc1-c1cc2cc(OC)ccc2o1 ZINC000825782355 608109469 /nfs/dbraw/zinc/10/94/69/608109469.db2.gz DVXWDMYKFMZBJU-UHFFFAOYSA-N -1 3 360.377 3.658 20 0 FHADHM CCn1c2ccc(-c3nn[n-]n3)cc2nc1-c1cc2cc(OC)ccc2o1 ZINC000825782355 608109470 /nfs/dbraw/zinc/10/94/70/608109470.db2.gz DVXWDMYKFMZBJU-UHFFFAOYSA-N -1 3 360.377 3.658 20 0 FHADHM Cc1cc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCC3)cc(C)c1F ZINC000826260773 608122467 /nfs/dbraw/zinc/12/24/67/608122467.db2.gz DGKPYADKGGAMDL-UHFFFAOYSA-N -1 3 371.441 3.815 20 0 FHADHM Cc1cc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCC3)cc(C)c1F ZINC000826260773 608122468 /nfs/dbraw/zinc/12/24/68/608122468.db2.gz DGKPYADKGGAMDL-UHFFFAOYSA-N -1 3 371.441 3.815 20 0 FHADHM Fc1cccc(F)c1-c1csc(COc2cccc(-c3nnn[n-]3)c2)n1 ZINC000826377561 608144421 /nfs/dbraw/zinc/14/44/21/608144421.db2.gz WWDWCYORQGVEDN-UHFFFAOYSA-N -1 3 371.372 3.847 20 0 FHADHM Fc1cccc(F)c1-c1csc(COc2cccc(-c3nn[n-]n3)c2)n1 ZINC000826377561 608144422 /nfs/dbraw/zinc/14/44/22/608144422.db2.gz WWDWCYORQGVEDN-UHFFFAOYSA-N -1 3 371.372 3.847 20 0 FHADHM Cc1cc([C@@H]2CN(c3cc(Cl)ccc3-c3nnn[n-]3)CCO2)ccc1F ZINC000826266164 608153113 /nfs/dbraw/zinc/15/31/13/608153113.db2.gz FFCHMRLZXYFLSZ-KRWDZBQOSA-N -1 3 373.819 3.546 20 0 FHADHM Cc1cc([C@@H]2CN(c3cc(Cl)ccc3-c3nn[n-]n3)CCO2)ccc1F ZINC000826266164 608153115 /nfs/dbraw/zinc/15/31/15/608153115.db2.gz FFCHMRLZXYFLSZ-KRWDZBQOSA-N -1 3 373.819 3.546 20 0 FHADHM Cc1cc([C@H]2CN(c3cc(Cl)ccc3-c3nnn[n-]3)CCO2)ccc1F ZINC000826266165 608153875 /nfs/dbraw/zinc/15/38/75/608153875.db2.gz FFCHMRLZXYFLSZ-QGZVFWFLSA-N -1 3 373.819 3.546 20 0 FHADHM Cc1cc([C@H]2CN(c3cc(Cl)ccc3-c3nn[n-]n3)CCO2)ccc1F ZINC000826266165 608153877 /nfs/dbraw/zinc/15/38/77/608153877.db2.gz FFCHMRLZXYFLSZ-QGZVFWFLSA-N -1 3 373.819 3.546 20 0 FHADHM COc1ccccc1OCCSc1cccc(Cl)c1-c1nnn[n-]1 ZINC000826221303 608206158 /nfs/dbraw/zinc/20/61/58/608206158.db2.gz YSPFMZXWGCXWGU-UHFFFAOYSA-N -1 3 362.842 3.700 20 0 FHADHM COc1ccccc1OCCSc1cccc(Cl)c1-c1nn[n-]n1 ZINC000826221303 608206160 /nfs/dbraw/zinc/20/61/60/608206160.db2.gz YSPFMZXWGCXWGU-UHFFFAOYSA-N -1 3 362.842 3.700 20 0 FHADHM Cc1cccc2nc(CSc3cccc(Cl)c3-c3nnn[n-]3)cn21 ZINC000826305510 608207719 /nfs/dbraw/zinc/20/77/19/608207719.db2.gz ZHFMUNCKNWYWLF-UHFFFAOYSA-N -1 3 356.842 3.769 20 0 FHADHM Cc1cccc2nc(CSc3cccc(Cl)c3-c3nn[n-]n3)cn21 ZINC000826305510 608207720 /nfs/dbraw/zinc/20/77/20/608207720.db2.gz ZHFMUNCKNWYWLF-UHFFFAOYSA-N -1 3 356.842 3.769 20 0 FHADHM Fc1ccc([C@H]2CCCN2c2ccc3cc(-c4nnn[n-]4)ccc3n2)cc1 ZINC000826374150 608221790 /nfs/dbraw/zinc/22/17/90/608221790.db2.gz NONLDLRNNXHFEW-GOSISDBHSA-N -1 3 360.396 3.896 20 0 FHADHM Fc1ccc([C@H]2CCCN2c2ccc3cc(-c4nn[n-]n4)ccc3n2)cc1 ZINC000826374150 608221791 /nfs/dbraw/zinc/22/17/91/608221791.db2.gz NONLDLRNNXHFEW-GOSISDBHSA-N -1 3 360.396 3.896 20 0 FHADHM CC[C@@H](Nc1ccc2cc(-c3nnn[n-]3)ccc2n1)c1ccccc1OC ZINC000825146255 608222853 /nfs/dbraw/zinc/22/28/53/608222853.db2.gz BBFUVCDWZLDQIX-MRXNPFEDSA-N -1 3 360.421 3.987 20 0 FHADHM CC[C@@H](Nc1ccc2cc(-c3nn[n-]n3)ccc2n1)c1ccccc1OC ZINC000825146255 608222855 /nfs/dbraw/zinc/22/28/55/608222855.db2.gz BBFUVCDWZLDQIX-MRXNPFEDSA-N -1 3 360.421 3.987 20 0 FHADHM Fc1ccccc1[C@@H]1CCN(c2ccc3cc(-c4nnn[n-]4)ccc3n2)C1 ZINC000826377863 608227408 /nfs/dbraw/zinc/22/74/08/608227408.db2.gz JUULDRFFYQKIEK-OAHLLOKOSA-N -1 3 360.396 3.548 20 0 FHADHM Fc1ccccc1[C@@H]1CCN(c2ccc3cc(-c4nn[n-]n4)ccc3n2)C1 ZINC000826377863 608227409 /nfs/dbraw/zinc/22/74/09/608227409.db2.gz JUULDRFFYQKIEK-OAHLLOKOSA-N -1 3 360.396 3.548 20 0 FHADHM Cc1cccc([C@@H](Nc2nc(C)cc(C)c2-c2nnn[n-]2)c2ccccn2)c1 ZINC000826297195 608230646 /nfs/dbraw/zinc/23/06/46/608230646.db2.gz YLINDCYPLCEDNP-LJQANCHMSA-N -1 3 371.448 3.783 20 0 FHADHM Cc1cccc([C@@H](Nc2nc(C)cc(C)c2-c2nn[n-]n2)c2ccccn2)c1 ZINC000826297195 608230648 /nfs/dbraw/zinc/23/06/48/608230648.db2.gz YLINDCYPLCEDNP-LJQANCHMSA-N -1 3 371.448 3.783 20 0 FHADHM C[C@H](Nc1ccc2cc(-c3nnn[n-]3)ccc2n1)c1cccc(F)c1F ZINC000824662686 608235394 /nfs/dbraw/zinc/23/53/94/608235394.db2.gz PLOVRLPMBASGGN-JTQLQIEISA-N -1 3 352.348 3.866 20 0 FHADHM C[C@H](Nc1ccc2cc(-c3nn[n-]n3)ccc2n1)c1cccc(F)c1F ZINC000824662686 608235395 /nfs/dbraw/zinc/23/53/95/608235395.db2.gz PLOVRLPMBASGGN-JTQLQIEISA-N -1 3 352.348 3.866 20 0 FHADHM CCc1ccc(C2=CCN(C(=O)Nc3ccc(-c4nnn[n-]4)cc3)CC2)cc1 ZINC000825705198 608241040 /nfs/dbraw/zinc/24/10/40/608241040.db2.gz YQGLRJRCMURDGL-UHFFFAOYSA-N -1 3 374.448 3.750 20 0 FHADHM CCc1ccc(C2=CCN(C(=O)Nc3ccc(-c4nn[n-]n4)cc3)CC2)cc1 ZINC000825705198 608241042 /nfs/dbraw/zinc/24/10/42/608241042.db2.gz YQGLRJRCMURDGL-UHFFFAOYSA-N -1 3 374.448 3.750 20 0 FHADHM Cc1cc(C)n(-c2ccc([C@@H](C)Nc3nc(C)ccc3-c3nnn[n-]3)cc2)n1 ZINC000826274964 608297139 /nfs/dbraw/zinc/29/71/39/608297139.db2.gz KFTVRIBTIUWJPA-OAHLLOKOSA-N -1 3 374.452 3.546 20 0 FHADHM Cc1cc(C)n(-c2ccc([C@@H](C)Nc3nc(C)ccc3-c3nn[n-]n3)cc2)n1 ZINC000826274964 608297141 /nfs/dbraw/zinc/29/71/41/608297141.db2.gz KFTVRIBTIUWJPA-OAHLLOKOSA-N -1 3 374.452 3.546 20 0 FHADHM O=C(NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1)[C@H]1CC12CCCC2 ZINC000826440492 608304207 /nfs/dbraw/zinc/30/42/07/608304207.db2.gz OFOVQCHEXMLPKO-LJQANCHMSA-N -1 3 373.460 3.730 20 0 FHADHM O=C(NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1)[C@H]1CC12CCCC2 ZINC000826440492 608304208 /nfs/dbraw/zinc/30/42/08/608304208.db2.gz OFOVQCHEXMLPKO-LJQANCHMSA-N -1 3 373.460 3.730 20 0 FHADHM O=C(CCC1CCC1)NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000826405472 608304228 /nfs/dbraw/zinc/30/42/28/608304228.db2.gz GXQIHQQXVMDIGW-UHFFFAOYSA-N -1 3 361.449 3.730 20 0 FHADHM O=C(CCC1CCC1)NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000826405472 608304230 /nfs/dbraw/zinc/30/42/30/608304230.db2.gz GXQIHQQXVMDIGW-UHFFFAOYSA-N -1 3 361.449 3.730 20 0 FHADHM C[C@H](Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1)c1cccc(F)c1F ZINC000824662048 608304421 /nfs/dbraw/zinc/30/44/21/608304421.db2.gz BASQIAOCYLSXFJ-ZETCQYMHSA-N -1 3 370.285 3.732 20 0 FHADHM C[C@H](Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1)c1cccc(F)c1F ZINC000824662048 608304423 /nfs/dbraw/zinc/30/44/23/608304423.db2.gz BASQIAOCYLSXFJ-ZETCQYMHSA-N -1 3 370.285 3.732 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccc(Cl)c(F)c2)c1-c1nnn[n-]1 ZINC000825687582 608304818 /nfs/dbraw/zinc/30/48/18/608304818.db2.gz JRXSGKPMRILBPU-UHFFFAOYSA-N -1 3 365.821 3.844 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccc(Cl)c(F)c2)c1-c1nn[n-]n1 ZINC000825687582 608304821 /nfs/dbraw/zinc/30/48/21/608304821.db2.gz JRXSGKPMRILBPU-UHFFFAOYSA-N -1 3 365.821 3.844 20 0 FHADHM COc1ccc([C@@H](OC(=O)c2sccc2-c2nnn[n-]2)C2CC2)c(C)c1 ZINC000826188745 608317188 /nfs/dbraw/zinc/31/71/88/608317188.db2.gz FLSFSXLWCGMNNL-HNNXBMFYSA-N -1 3 370.434 3.553 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CNc1cccc(Cl)c1Cl ZINC000826170849 608319493 /nfs/dbraw/zinc/31/94/93/608319493.db2.gz RLWKNVDSBUDEIH-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CNc1cccc(Cl)c1Cl ZINC000826170849 608319495 /nfs/dbraw/zinc/31/94/95/608319495.db2.gz RLWKNVDSBUDEIH-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM Cc1ccc2c(c1)CCN2C(=O)c1c(Cl)cc(-c2nnn[n-]2)cc1Cl ZINC000826293915 608331507 /nfs/dbraw/zinc/33/15/07/608331507.db2.gz DXWVLLUXORTRDI-UHFFFAOYSA-N -1 3 374.231 3.685 20 0 FHADHM Cc1ccc2c(c1)CCN2C(=O)c1c(Cl)cc(-c2nn[n-]n2)cc1Cl ZINC000826293915 608331508 /nfs/dbraw/zinc/33/15/08/608331508.db2.gz DXWVLLUXORTRDI-UHFFFAOYSA-N -1 3 374.231 3.685 20 0 FHADHM CS[C@H](C)CCC(=O)Nc1sc2c(c1-c1nnn[n-]1)CC[C@@H](C)C2 ZINC000826225619 608339142 /nfs/dbraw/zinc/33/91/42/608339142.db2.gz GPNFCQMCFBCUGF-NXEZZACHSA-N -1 3 365.528 3.523 20 0 FHADHM CS[C@H](C)CCC(=O)Nc1sc2c(c1-c1nn[n-]n1)CC[C@@H](C)C2 ZINC000826225619 608339144 /nfs/dbraw/zinc/33/91/44/608339144.db2.gz GPNFCQMCFBCUGF-NXEZZACHSA-N -1 3 365.528 3.523 20 0 FHADHM CCN(C(=O)c1cccc(C)c1C)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825385274 608342105 /nfs/dbraw/zinc/34/21/05/608342105.db2.gz BCPQXAPHSJPDLB-UHFFFAOYSA-N -1 3 355.829 3.804 20 0 FHADHM CCN(C(=O)c1cccc(C)c1C)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825385274 608342106 /nfs/dbraw/zinc/34/21/06/608342106.db2.gz BCPQXAPHSJPDLB-UHFFFAOYSA-N -1 3 355.829 3.804 20 0 FHADHM CCN(C(=O)[C@H](C)Cc1ccccc1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825362716 608346565 /nfs/dbraw/zinc/34/65/65/608346565.db2.gz QNUWYBVLQATCAQ-CYBMUJFWSA-N -1 3 369.856 3.752 20 0 FHADHM CCN(C(=O)[C@H](C)Cc1ccccc1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825362716 608346567 /nfs/dbraw/zinc/34/65/67/608346567.db2.gz QNUWYBVLQATCAQ-CYBMUJFWSA-N -1 3 369.856 3.752 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(NCc2cc(-c3ccccc3)no2)c1 ZINC000826351627 608365600 /nfs/dbraw/zinc/36/56/00/608365600.db2.gz TUROOEHLCLUMND-UHFFFAOYSA-N -1 3 352.785 3.787 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(NCc2cc(-c3ccccc3)no2)c1 ZINC000826351627 608365602 /nfs/dbraw/zinc/36/56/02/608365602.db2.gz TUROOEHLCLUMND-UHFFFAOYSA-N -1 3 352.785 3.787 20 0 FHADHM Cc1nc2ccccc2c(SCc2cccc(-c3nnn[n-]3)c2F)n1 ZINC000826327831 608392173 /nfs/dbraw/zinc/39/21/73/608392173.db2.gz VXAUMOWUZDPWOF-UHFFFAOYSA-N -1 3 352.398 3.550 20 0 FHADHM Cc1nc2ccccc2c(SCc2cccc(-c3nn[n-]n3)c2F)n1 ZINC000826327831 608392175 /nfs/dbraw/zinc/39/21/75/608392175.db2.gz VXAUMOWUZDPWOF-UHFFFAOYSA-N -1 3 352.398 3.550 20 0 FHADHM CCOc1ccccc1[C@@H](CC)NCc1cccc(-c2nnn[n-]2)c1F ZINC000825653628 608458394 /nfs/dbraw/zinc/45/83/94/608458394.db2.gz GRSLYZIRWXHRPZ-MRXNPFEDSA-N -1 3 355.417 3.645 20 0 FHADHM Cc1cccc(NC(=O)N2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)c1C ZINC000826299545 608469399 /nfs/dbraw/zinc/46/93/99/608469399.db2.gz KCXWKROOYYEWMD-UHFFFAOYSA-N -1 3 374.448 3.805 20 0 FHADHM Cc1cccc(NC(=O)N2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)c1C ZINC000826299545 608469400 /nfs/dbraw/zinc/46/94/00/608469400.db2.gz KCXWKROOYYEWMD-UHFFFAOYSA-N -1 3 374.448 3.805 20 0 FHADHM C[C@H](CC(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1)CC(C)(C)C ZINC000824384340 608481402 /nfs/dbraw/zinc/48/14/02/608481402.db2.gz ANQVIWOUWRRSDI-OAHLLOKOSA-N -1 3 367.497 3.945 20 0 FHADHM C[C@H](CC(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1)CC(C)(C)C ZINC000824384340 608481404 /nfs/dbraw/zinc/48/14/04/608481404.db2.gz ANQVIWOUWRRSDI-OAHLLOKOSA-N -1 3 367.497 3.945 20 0 FHADHM Cc1ccccc1-c1cnc(CN[C@H](C)c2cccc(-c3nn[n-]n3)c2)o1 ZINC000826305191 608484163 /nfs/dbraw/zinc/48/41/63/608484163.db2.gz NUWRGBDHAOQYEF-CQSZACIVSA-N -1 3 360.421 3.681 20 0 FHADHM CC[C@@H](CC(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1)C(C)C ZINC000825080885 608486062 /nfs/dbraw/zinc/48/60/62/608486062.db2.gz CSUFUUNOTRFYKI-HNNXBMFYSA-N -1 3 353.470 3.555 20 0 FHADHM CC[C@@H](CC(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1)C(C)C ZINC000825080885 608486065 /nfs/dbraw/zinc/48/60/65/608486065.db2.gz CSUFUUNOTRFYKI-HNNXBMFYSA-N -1 3 353.470 3.555 20 0 FHADHM CC[C@H](CC(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1)C(C)C ZINC000825080886 608486163 /nfs/dbraw/zinc/48/61/63/608486163.db2.gz CSUFUUNOTRFYKI-OAHLLOKOSA-N -1 3 353.470 3.555 20 0 FHADHM CC[C@H](CC(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1)C(C)C ZINC000825080886 608486165 /nfs/dbraw/zinc/48/61/65/608486165.db2.gz CSUFUUNOTRFYKI-OAHLLOKOSA-N -1 3 353.470 3.555 20 0 FHADHM CN(Cc1ccc(-c2nnn[n-]2)s1)Cc1ccc(Cl)c(Cl)c1 ZINC000825965745 608500236 /nfs/dbraw/zinc/50/02/36/608500236.db2.gz FZKNLQYHZDVIET-UHFFFAOYSA-N -1 3 354.266 3.867 20 0 FHADHM CC(C)c1ncc(CN(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)s1 ZINC000824364760 608518402 /nfs/dbraw/zinc/51/84/02/608518402.db2.gz TXIWZCJVXZVLOP-UHFFFAOYSA-N -1 3 354.483 3.611 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)Nc1ccc(-c2ccc[nH]2)cc1 ZINC000826401751 608561226 /nfs/dbraw/zinc/56/12/26/608561226.db2.gz GAIIHPARIPFULZ-XFXZXTDPSA-N -1 3 356.389 3.514 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)Nc1ccc(-c2ccc[nH]2)cc1 ZINC000826401751 608561227 /nfs/dbraw/zinc/56/12/27/608561227.db2.gz GAIIHPARIPFULZ-XFXZXTDPSA-N -1 3 356.389 3.514 20 0 FHADHM FC(F)(F)[C@H](CCc1ccccc1)NCc1cccc(-c2nnn[n-]2)c1 ZINC000826367226 608580165 /nfs/dbraw/zinc/58/01/65/608580165.db2.gz QFEMKYZYFQWGLQ-INIZCTEOSA-N -1 3 361.371 3.520 20 0 FHADHM FC(F)(F)[C@H](CCc1ccccc1)NCc1cccc(-c2nn[n-]n2)c1 ZINC000826367226 608580166 /nfs/dbraw/zinc/58/01/66/608580166.db2.gz QFEMKYZYFQWGLQ-INIZCTEOSA-N -1 3 361.371 3.520 20 0 FHADHM C[C@@H]1SCCN(Cc2cccc(-c3nnn[n-]3)c2F)[C@@H]1c1ccccc1 ZINC000825019576 608650526 /nfs/dbraw/zinc/65/05/26/608650526.db2.gz FLKAKBSYTKVZGG-UGSOOPFHSA-N -1 3 369.469 3.684 20 0 FHADHM C[C@H](Nc1cnccc1-c1nnn[n-]1)c1cc(F)c(Cl)cc1Cl ZINC000824663243 608768066 /nfs/dbraw/zinc/76/80/66/608768066.db2.gz XBMVIWNHGBFUDS-ZETCQYMHSA-N -1 3 353.188 3.881 20 0 FHADHM C[C@H](Nc1cnccc1-c1nn[n-]n1)c1cc(F)c(Cl)cc1Cl ZINC000824663243 608768069 /nfs/dbraw/zinc/76/80/69/608768069.db2.gz XBMVIWNHGBFUDS-ZETCQYMHSA-N -1 3 353.188 3.881 20 0 FHADHM Fc1ccc([C@@H]2CCCCN2Cc2ccc(-c3nnn[n-]3)s2)c(F)c1 ZINC000826374217 608848288 /nfs/dbraw/zinc/84/82/88/608848288.db2.gz QLKJKFPDNOEPMM-HNNXBMFYSA-N -1 3 361.421 3.934 20 0 FHADHM Fc1ccc([C@@H]2CCCCN2Cc2ccc(-c3nn[n-]n3)s2)c(F)c1 ZINC000826374217 608848290 /nfs/dbraw/zinc/84/82/90/608848290.db2.gz QLKJKFPDNOEPMM-HNNXBMFYSA-N -1 3 361.421 3.934 20 0 FHADHM O=C(CCc1ccc(-c2nnn[n-]2)cc1)N1CCC[C@@H]1/C=C/c1ccccc1 ZINC000826408551 609138104 /nfs/dbraw/zinc/13/81/04/609138104.db2.gz LIGBAHIENASJKF-YNEJIKTKSA-N -1 3 373.460 3.504 20 0 FHADHM O=C(CCc1ccc(-c2nn[n-]n2)cc1)N1CCC[C@@H]1/C=C/c1ccccc1 ZINC000826408551 609138106 /nfs/dbraw/zinc/13/81/06/609138106.db2.gz LIGBAHIENASJKF-YNEJIKTKSA-N -1 3 373.460 3.504 20 0 FHADHM CC(C)COC[C@@H](N[C@H](C)c1ccc(-c2nnn[n-]2)c(F)c1)c1ccco1 ZINC000824266070 609139136 /nfs/dbraw/zinc/13/91/36/609139136.db2.gz FAHVCVOMNNIHCI-CXAGYDPISA-N -1 3 373.432 3.663 20 0 FHADHM CC(C)COC[C@@H](N[C@H](C)c1ccc(-c2nn[n-]n2)c(F)c1)c1ccco1 ZINC000824266070 609139138 /nfs/dbraw/zinc/13/91/38/609139138.db2.gz FAHVCVOMNNIHCI-CXAGYDPISA-N -1 3 373.432 3.663 20 0 FHADHM CCOc1ccc(N[C@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)cc1OCC ZINC000825643807 609162406 /nfs/dbraw/zinc/16/24/06/609162406.db2.gz VYSJOIYNUNMSOE-GFCCVEGCSA-N -1 3 371.416 3.976 20 0 FHADHM CCOc1ccc(N[C@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)cc1OCC ZINC000825643807 609162408 /nfs/dbraw/zinc/16/24/08/609162408.db2.gz VYSJOIYNUNMSOE-GFCCVEGCSA-N -1 3 371.416 3.976 20 0 FHADHM c1cc(N2CCCC2)ccc1N[C@H]1CCCc2cc(-c3nn[n-]n3)ccc21 ZINC000826517146 609163888 /nfs/dbraw/zinc/16/38/88/609163888.db2.gz SPLXDOAESIUHBD-FQEVSTJZSA-N -1 3 360.465 3.956 20 0 FHADHM Cc1c(C)n(-c2ccccc2)c(NC(=O)CCC(C)(F)F)c1-c1nnn[n-]1 ZINC000826233377 609165040 /nfs/dbraw/zinc/16/50/40/609165040.db2.gz FEVQSPWLPZBWRY-UHFFFAOYSA-N -1 3 374.395 3.648 20 0 FHADHM Cc1c(C)n(-c2ccccc2)c(NC(=O)CCC(C)(F)F)c1-c1nn[n-]n1 ZINC000826233377 609165041 /nfs/dbraw/zinc/16/50/41/609165041.db2.gz FEVQSPWLPZBWRY-UHFFFAOYSA-N -1 3 374.395 3.648 20 0 FHADHM Cc1c(C)n(-c2ccccc2)c(NC(=O)[C@@H]2CC=CCC2)c1-c1nnn[n-]1 ZINC000826233633 609165329 /nfs/dbraw/zinc/16/53/29/609165329.db2.gz POGYCEPAQJFKAY-OAHLLOKOSA-N -1 3 362.437 3.569 20 0 FHADHM Cc1c(C)n(-c2ccccc2)c(NC(=O)[C@@H]2CC=CCC2)c1-c1nn[n-]n1 ZINC000826233633 609165331 /nfs/dbraw/zinc/16/53/31/609165331.db2.gz POGYCEPAQJFKAY-OAHLLOKOSA-N -1 3 362.437 3.569 20 0 FHADHM Fc1ccc2c(c1)OCCC[C@@H]2Nc1c(F)cc(-c2nnn[n-]2)cc1F ZINC000826376342 609169883 /nfs/dbraw/zinc/16/98/83/609169883.db2.gz ZEMKTASNKWHPBQ-AWEZNQCLSA-N -1 3 361.327 3.610 20 0 FHADHM Fc1ccc2c(c1)OCCC[C@@H]2Nc1c(F)cc(-c2nn[n-]n2)cc1F ZINC000826376342 609169886 /nfs/dbraw/zinc/16/98/86/609169886.db2.gz ZEMKTASNKWHPBQ-AWEZNQCLSA-N -1 3 361.327 3.610 20 0 FHADHM CC(C)C[C@H]1C[C@@H](Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)CCO1 ZINC000824243626 609170754 /nfs/dbraw/zinc/17/07/54/609170754.db2.gz KSHWWBSCVWTGAT-STQMWFEESA-N -1 3 369.391 3.891 20 0 FHADHM CC(C)C[C@H]1C[C@@H](Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)CCO1 ZINC000824243626 609170756 /nfs/dbraw/zinc/17/07/56/609170756.db2.gz KSHWWBSCVWTGAT-STQMWFEESA-N -1 3 369.391 3.891 20 0 FHADHM CC(C)C[C@H]1C[C@H](Nc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)CCO1 ZINC000824243570 609171037 /nfs/dbraw/zinc/17/10/37/609171037.db2.gz JKXVJRHAGBWKMG-OLZOCXBDSA-N -1 3 369.391 3.891 20 0 FHADHM Fc1ccccc1-c1nc(CNc2ccc(F)c(-c3nnn[n-]3)c2)cs1 ZINC000826375509 609176779 /nfs/dbraw/zinc/17/67/79/609176779.db2.gz QFANTXVZOQSGNQ-UHFFFAOYSA-N -1 3 370.388 3.881 20 0 FHADHM Fc1ccccc1-c1nc(CNc2ccc(F)c(-c3nn[n-]n3)c2)cs1 ZINC000826375509 609176781 /nfs/dbraw/zinc/17/67/81/609176781.db2.gz QFANTXVZOQSGNQ-UHFFFAOYSA-N -1 3 370.388 3.881 20 0 FHADHM C[C@@H](Nc1cc(F)ccc1OC(F)F)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824650863 609247003 /nfs/dbraw/zinc/24/70/03/609247003.db2.gz VBKBLNROVOWTDB-MRVPVSSYSA-N -1 3 367.306 3.919 20 0 FHADHM C[C@@H](Nc1cc(F)ccc1OC(F)F)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824650863 609247005 /nfs/dbraw/zinc/24/70/05/609247005.db2.gz VBKBLNROVOWTDB-MRVPVSSYSA-N -1 3 367.306 3.919 20 0 FHADHM C[C@H](Nc1cnn(-c2ccccc2F)c1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824663076 609253273 /nfs/dbraw/zinc/25/32/73/609253273.db2.gz VOOVRHRDHLBGNT-NSHDSACASA-N -1 3 367.363 3.504 20 0 FHADHM C[C@H](Nc1cnn(-c2ccccc2F)c1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824663076 609253275 /nfs/dbraw/zinc/25/32/75/609253275.db2.gz VOOVRHRDHLBGNT-NSHDSACASA-N -1 3 367.363 3.504 20 0 FHADHM C[C@@H](Cc1nnc(NCc2ccc(-c3nnn[n-]3)cc2F)o1)CC(C)(C)C ZINC000824465675 609265815 /nfs/dbraw/zinc/26/58/15/609265815.db2.gz RHDHMXMOUUVTEH-NSHDSACASA-N -1 3 373.436 3.616 20 0 FHADHM C[C@@H](Cc1nnc(NCc2ccc(-c3nn[n-]n3)cc2F)o1)CC(C)(C)C ZINC000824465675 609265817 /nfs/dbraw/zinc/26/58/17/609265817.db2.gz RHDHMXMOUUVTEH-NSHDSACASA-N -1 3 373.436 3.616 20 0 FHADHM Cc1cc(Cl)c(C(=O)N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1C ZINC000826267548 609278776 /nfs/dbraw/zinc/27/87/76/609278776.db2.gz KLGBMHWOZYMZRW-GFCCVEGCSA-N -1 3 355.829 3.628 20 0 FHADHM Cc1cc(Cl)c(C(=O)N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1C ZINC000826267548 609278778 /nfs/dbraw/zinc/27/87/78/609278778.db2.gz KLGBMHWOZYMZRW-GFCCVEGCSA-N -1 3 355.829 3.628 20 0 FHADHM C[C@@H](Nc1ccc2c(cnn2C(F)F)c1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824655759 609279602 /nfs/dbraw/zinc/27/96/02/609279602.db2.gz FTOFBFWQBHZTRM-SECBINFHSA-N -1 3 373.342 3.924 20 0 FHADHM C[C@@H](Nc1ccc2c(cnn2C(F)F)c1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824655759 609279604 /nfs/dbraw/zinc/27/96/04/609279604.db2.gz FTOFBFWQBHZTRM-SECBINFHSA-N -1 3 373.342 3.924 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)c1cc(C)c(C)cc1Cl ZINC000825626399 609280056 /nfs/dbraw/zinc/28/00/56/609280056.db2.gz LPRDKMMLFJLWLP-UHFFFAOYSA-N -1 3 371.828 3.788 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cc(C)c(C)cc1Cl ZINC000825626399 609280057 /nfs/dbraw/zinc/28/00/57/609280057.db2.gz LPRDKMMLFJLWLP-UHFFFAOYSA-N -1 3 371.828 3.788 20 0 FHADHM COc1ccc(Br)c(N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000826186596 609281785 /nfs/dbraw/zinc/28/17/85/609281785.db2.gz BCEWXLHVTZGSGG-JTQLQIEISA-N -1 3 374.242 3.811 20 0 FHADHM COc1ccc(Br)c(N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000826186596 609281787 /nfs/dbraw/zinc/28/17/87/609281787.db2.gz BCEWXLHVTZGSGG-JTQLQIEISA-N -1 3 374.242 3.811 20 0 FHADHM Cc1cc(Cl)c(C(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1C ZINC000826267750 609283406 /nfs/dbraw/zinc/28/34/06/609283406.db2.gz URLVOTVAELITLQ-GFCCVEGCSA-N -1 3 355.829 3.628 20 0 FHADHM Cc1cc(Cl)c(C(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1C ZINC000826267750 609283408 /nfs/dbraw/zinc/28/34/08/609283408.db2.gz URLVOTVAELITLQ-GFCCVEGCSA-N -1 3 355.829 3.628 20 0 FHADHM CCCN(Cc1ccccc1)C(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000825323299 609286747 /nfs/dbraw/zinc/28/67/47/609286747.db2.gz SCHHVBKNRUUANZ-UHFFFAOYSA-N -1 3 355.829 3.573 20 0 FHADHM CCCN(Cc1ccccc1)C(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000825323299 609286748 /nfs/dbraw/zinc/28/67/48/609286748.db2.gz SCHHVBKNRUUANZ-UHFFFAOYSA-N -1 3 355.829 3.573 20 0 FHADHM CCCOc1ccc(NC(=O)c2ccc(Cl)c(-c3nnn[n-]3)c2)c(C)c1 ZINC000825342191 609289934 /nfs/dbraw/zinc/28/99/34/609289934.db2.gz QMMWEOMVOPWBAC-UHFFFAOYSA-N -1 3 371.828 3.870 20 0 FHADHM CCCOc1ccc(NC(=O)c2ccc(Cl)c(-c3nn[n-]n3)c2)c(C)c1 ZINC000825342191 609289936 /nfs/dbraw/zinc/28/99/36/609289936.db2.gz QMMWEOMVOPWBAC-UHFFFAOYSA-N -1 3 371.828 3.870 20 0 FHADHM Cc1ccccc1[C@H]1CCCN1C(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000826306667 609290564 /nfs/dbraw/zinc/29/05/64/609290564.db2.gz HLXINMCOVDZBMA-QGZVFWFLSA-N -1 3 367.840 3.806 20 0 FHADHM Cc1ccccc1[C@H]1CCCN1C(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000826306667 609290566 /nfs/dbraw/zinc/29/05/66/609290566.db2.gz HLXINMCOVDZBMA-QGZVFWFLSA-N -1 3 367.840 3.806 20 0 FHADHM O=C(Nc1ccc(Cl)c(F)c1)c1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000826453612 609298981 /nfs/dbraw/zinc/29/89/81/609298981.db2.gz RLQNVEKWSIOOEJ-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(Cl)c(F)c1)c1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000826453612 609298983 /nfs/dbraw/zinc/29/89/83/609298983.db2.gz RLQNVEKWSIOOEJ-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM CC(C)[C@@H](c1ccccc1)N(C)C(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000824214936 609299356 /nfs/dbraw/zinc/29/93/56/609299356.db2.gz ILILQNFVXOBEOK-KRWDZBQOSA-N -1 3 369.856 3.989 20 0 FHADHM CC(C)[C@@H](c1ccccc1)N(C)C(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000824214936 609299357 /nfs/dbraw/zinc/29/93/57/609299357.db2.gz ILILQNFVXOBEOK-KRWDZBQOSA-N -1 3 369.856 3.989 20 0 FHADHM Cc1nc(SCc2ccc(-c3nnn[n-]3)cc2Br)oc1C ZINC000826327930 609307741 /nfs/dbraw/zinc/30/77/41/609307741.db2.gz ZZLKCBDZMUFCGP-UHFFFAOYSA-N -1 3 366.244 3.526 20 0 FHADHM Cc1nc(SCc2ccc(-c3nn[n-]n3)cc2Br)oc1C ZINC000826327930 609307742 /nfs/dbraw/zinc/30/77/42/609307742.db2.gz ZZLKCBDZMUFCGP-UHFFFAOYSA-N -1 3 366.244 3.526 20 0 FHADHM Cc1nnc(SCc2csc(C3CCCC3)n2)c(-c2nnn[n-]2)c1C ZINC000826337747 609309392 /nfs/dbraw/zinc/30/93/92/609309392.db2.gz ZQECGURZBFXEIW-UHFFFAOYSA-N -1 3 373.511 3.680 20 0 FHADHM Cc1nnc(SCc2csc(C3CCCC3)n2)c(-c2nn[n-]n2)c1C ZINC000826337747 609309393 /nfs/dbraw/zinc/30/93/93/609309393.db2.gz ZQECGURZBFXEIW-UHFFFAOYSA-N -1 3 373.511 3.680 20 0 FHADHM CCC(CC)[C@@H]1C[C@H](Nc2cc(-c3nnn[n-]3)c3ccccc3n2)CCO1 ZINC000825107521 609322387 /nfs/dbraw/zinc/32/23/87/609322387.db2.gz PRXKCCXKIORCRY-KDOFPFPSSA-N -1 3 366.469 3.811 20 0 FHADHM CCC(CC)[C@@H]1C[C@H](Nc2cc(-c3nn[n-]n3)c3ccccc3n2)CCO1 ZINC000825107521 609322389 /nfs/dbraw/zinc/32/23/89/609322389.db2.gz PRXKCCXKIORCRY-KDOFPFPSSA-N -1 3 366.469 3.811 20 0 FHADHM CC(=O)Nc1c(C)ccc(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2F)c1C ZINC000823993883 609345912 /nfs/dbraw/zinc/34/59/12/609345912.db2.gz BJKRKBWUWSAQKW-GFCCVEGCSA-N -1 3 368.416 3.754 20 0 FHADHM CC(=O)Nc1c(C)ccc(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2F)c1C ZINC000823993883 609345913 /nfs/dbraw/zinc/34/59/13/609345913.db2.gz BJKRKBWUWSAQKW-GFCCVEGCSA-N -1 3 368.416 3.754 20 0 FHADHM C[C@@H](Nc1ccccc1OCC(F)F)c1ccc(-c2nnn[n-]2)cc1F ZINC000824663155 609347721 /nfs/dbraw/zinc/34/77/21/609347721.db2.gz VXGZDTWJNGDVAC-SNVBAGLBSA-N -1 3 363.343 3.823 20 0 FHADHM C[C@@H](Nc1ccccc1OCC(F)F)c1ccc(-c2nn[n-]n2)cc1F ZINC000824663155 609347723 /nfs/dbraw/zinc/34/77/23/609347723.db2.gz VXGZDTWJNGDVAC-SNVBAGLBSA-N -1 3 363.343 3.823 20 0 FHADHM C[C@H](Nc1ccc2c(c1)OC(C)(C)O2)c1ccc(-c2nnn[n-]2)cc1F ZINC000824658322 609348959 /nfs/dbraw/zinc/34/89/59/609348959.db2.gz VZSUGGHWFMOVOT-JTQLQIEISA-N -1 3 355.373 3.686 20 0 FHADHM C[C@H](Nc1ccc2c(c1)OC(C)(C)O2)c1ccc(-c2nn[n-]n2)cc1F ZINC000824658322 609348961 /nfs/dbraw/zinc/34/89/61/609348961.db2.gz VZSUGGHWFMOVOT-JTQLQIEISA-N -1 3 355.373 3.686 20 0 FHADHM Cc1c(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2F)cnn1-c1ccccc1 ZINC000826242349 609349826 /nfs/dbraw/zinc/34/98/26/609349826.db2.gz LITPKYNAHWXYDG-LBPRGKRZSA-N -1 3 363.400 3.673 20 0 FHADHM Cc1c(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2F)cnn1-c1ccccc1 ZINC000826242349 609349828 /nfs/dbraw/zinc/34/98/28/609349828.db2.gz LITPKYNAHWXYDG-LBPRGKRZSA-N -1 3 363.400 3.673 20 0 FHADHM S=C(Nc1csc2ccccc12)Nc1ccccc1-c1nnn[n-]1 ZINC000826511775 609410093 /nfs/dbraw/zinc/41/00/93/609410093.db2.gz DFUHJQZXNDFOOG-UHFFFAOYSA-N -1 3 352.448 3.890 20 0 FHADHM S=C(Nc1csc2ccccc12)Nc1ccccc1-c1nn[n-]n1 ZINC000826511775 609410095 /nfs/dbraw/zinc/41/00/95/609410095.db2.gz DFUHJQZXNDFOOG-UHFFFAOYSA-N -1 3 352.448 3.890 20 0 FHADHM CC(=O)c1ccc(-c2nnn[n-]2)cc1N[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000824019800 609420479 /nfs/dbraw/zinc/42/04/79/609420479.db2.gz OXAKYSBQJDUYEO-VXGBXAGGSA-N -1 3 353.348 3.602 20 0 FHADHM CC(=O)c1ccc(-c2nn[n-]n2)cc1N[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000824019800 609420480 /nfs/dbraw/zinc/42/04/80/609420480.db2.gz OXAKYSBQJDUYEO-VXGBXAGGSA-N -1 3 353.348 3.602 20 0 FHADHM Fc1c(CNc2ccccc2CC(F)(F)F)cccc1-c1nnn[n-]1 ZINC000826370659 609479111 /nfs/dbraw/zinc/47/91/11/609479111.db2.gz CQCGUAZQNYLCPK-UHFFFAOYSA-N -1 3 351.307 3.723 20 0 FHADHM Fc1c(CNc2ccccc2CC(F)(F)F)cccc1-c1nn[n-]n1 ZINC000826370659 609479112 /nfs/dbraw/zinc/47/91/12/609479112.db2.gz CQCGUAZQNYLCPK-UHFFFAOYSA-N -1 3 351.307 3.723 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@H](C)c1ccccc1 ZINC000824255457 609480339 /nfs/dbraw/zinc/48/03/39/609480339.db2.gz KLVKWGDMRDQBAK-MRXNPFEDSA-N -1 3 363.465 3.655 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@H](C)c1ccccc1 ZINC000824255457 609480340 /nfs/dbraw/zinc/48/03/40/609480340.db2.gz KLVKWGDMRDQBAK-MRXNPFEDSA-N -1 3 363.465 3.655 20 0 FHADHM CC(C)Oc1ccc(NC2CCC3(CCOCC3)CC2)cc1-c1nnn[n-]1 ZINC000824329563 609492332 /nfs/dbraw/zinc/49/23/32/609492332.db2.gz QZLJCQDMXTUSTH-UHFFFAOYSA-N -1 3 371.485 3.805 20 0 FHADHM CC(C)Oc1ccc(NC2CCC3(CCOCC3)CC2)cc1-c1nn[n-]n1 ZINC000824329563 609492333 /nfs/dbraw/zinc/49/23/33/609492333.db2.gz QZLJCQDMXTUSTH-UHFFFAOYSA-N -1 3 371.485 3.805 20 0 FHADHM FC(F)Oc1cc(NCc2cccc(-c3nnn[n-]3)c2)ccc1Cl ZINC000826369610 609513280 /nfs/dbraw/zinc/51/32/80/609513280.db2.gz JZMRAUPAMKQFLI-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM FC(F)Oc1cc(NCc2cccc(-c3nn[n-]n3)c2)ccc1Cl ZINC000826369610 609513281 /nfs/dbraw/zinc/51/32/81/609513281.db2.gz JZMRAUPAMKQFLI-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM c1ccc(-c2ccc(CS[C@H]3CCCOC3)cc2)c(-c2nnn[n-]2)c1 ZINC000826519548 609527329 /nfs/dbraw/zinc/52/73/29/609527329.db2.gz CORHMBWHDMKWMQ-INIZCTEOSA-N -1 3 352.463 3.946 20 0 FHADHM c1ccc(-c2ccc(CS[C@H]3CCCOC3)cc2)c(-c2nn[n-]n2)c1 ZINC000826519548 609527331 /nfs/dbraw/zinc/52/73/31/609527331.db2.gz CORHMBWHDMKWMQ-INIZCTEOSA-N -1 3 352.463 3.946 20 0 FHADHM Cc1c(Cl)cnc(N[C@H]2CCCOc3ccccc32)c1-c1nnn[n-]1 ZINC000826239169 609543462 /nfs/dbraw/zinc/54/34/62/609543462.db2.gz ZEJRUABDHPPQJB-ZDUSSCGKSA-N -1 3 356.817 3.549 20 0 FHADHM Cc1c(Cl)cnc(N[C@H]2CCCOc3ccccc32)c1-c1nn[n-]n1 ZINC000826239169 609543465 /nfs/dbraw/zinc/54/34/65/609543465.db2.gz ZEJRUABDHPPQJB-ZDUSSCGKSA-N -1 3 356.817 3.549 20 0 FHADHM Cc1ccnc(N2CCC[C@@H](c3nc(C(C)C)cs3)C2)c1-c1nnn[n-]1 ZINC000826310066 609560663 /nfs/dbraw/zinc/56/06/63/609560663.db2.gz KLSVUGKPYODYPN-CYBMUJFWSA-N -1 3 369.498 3.534 20 0 FHADHM Cc1ccnc(N2CCC[C@@H](c3nc(C(C)C)cs3)C2)c1-c1nn[n-]n1 ZINC000826310066 609560666 /nfs/dbraw/zinc/56/06/66/609560666.db2.gz KLSVUGKPYODYPN-CYBMUJFWSA-N -1 3 369.498 3.534 20 0 FHADHM COc1cccc([C@@H]2C[C@H](C)CN2c2ccc(-c3nn[n-]n3)cc2F)c1 ZINC000826215275 609592671 /nfs/dbraw/zinc/59/26/71/609592671.db2.gz KLHACZJRXBOIGJ-SGTLLEGYSA-N -1 3 353.401 3.602 20 0 FHADHM C[C@@H](CN(C)c1ccc(-c2nn[n-]n2)cc1C(F)(F)F)c1nccs1 ZINC000824412833 609606670 /nfs/dbraw/zinc/60/66/70/609606670.db2.gz GOYZVBPCKJLSGP-VIFPVBQESA-N -1 3 368.388 3.582 20 0 FHADHM CC/C(C)=C(\C)C(=O)NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000825050360 609609882 /nfs/dbraw/zinc/60/98/82/609609882.db2.gz IIZPOYGBACYTFJ-CCEZHUSRSA-N -1 3 361.449 3.896 20 0 FHADHM CC/C(C)=C(\C)C(=O)NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000825050360 609609884 /nfs/dbraw/zinc/60/98/84/609609884.db2.gz IIZPOYGBACYTFJ-CCEZHUSRSA-N -1 3 361.449 3.896 20 0 FHADHM O=C(N=c1cc2ccccn2[n-]1)N(Cc1ccccc1Cl)CC1CC1 ZINC000583015839 936370915 /nfs/dbraw/zinc/37/09/15/936370915.db2.gz GWCLZCMFFKTENR-UHFFFAOYSA-N -1 3 354.841 3.854 20 0 FHADHM CCCOc1ccc(C(C)(C)NC(=O)c2cc(=O)[n-]c(C3CC3)n2)cc1 ZINC000583034691 936382481 /nfs/dbraw/zinc/38/24/81/936382481.db2.gz RBISUGMNGZFLGT-UHFFFAOYSA-N -1 3 355.438 3.514 20 0 FHADHM O=S(=O)([N-]c1ccc2c(c1)OCCCO2)c1ccc2c(c1)CCCC2 ZINC000005126602 936387071 /nfs/dbraw/zinc/38/70/71/936387071.db2.gz PHSHZAKIXQIAJT-UHFFFAOYSA-N -1 3 359.447 3.528 20 0 FHADHM CC(C)Cn1cc(C(=O)Nc2ccc(Cc3nnn[n-]3)cc2)c2ccccc21 ZINC000427081225 945065877 /nfs/dbraw/zinc/06/58/77/945065877.db2.gz LLAMNIQBPRBUSB-UHFFFAOYSA-N -1 3 374.448 3.654 20 0 FHADHM CC(C)Cn1cc(C(=O)Nc2ccc(Cc3nn[n-]n3)cc2)c2ccccc21 ZINC000427081225 945065887 /nfs/dbraw/zinc/06/58/87/945065887.db2.gz LLAMNIQBPRBUSB-UHFFFAOYSA-N -1 3 374.448 3.654 20 0 FHADHM Cc1cccc2c1CCN2C(=O)NCc1ccc([O-])c(Br)c1 ZINC000126166690 937090082 /nfs/dbraw/zinc/09/00/82/937090082.db2.gz PEKZEFOYCVTEEZ-UHFFFAOYSA-N -1 3 361.239 3.735 20 0 FHADHM O=C(Nc1ccc(-c2cn3ccsc3n2)cc1)c1ccc2[n-]nnc2c1 ZINC000029794828 927241582 /nfs/dbraw/zinc/24/15/82/927241582.db2.gz AWEHLJBLTCHFEB-UHFFFAOYSA-N -1 3 360.402 3.586 20 0 FHADHM O=C(N[C@H](Cc1ccccc1)c1cccs1)c1cc(=O)[n-]c(C2CC2)n1 ZINC000654804411 927345059 /nfs/dbraw/zinc/34/50/59/927345059.db2.gz PQOIZODPISITPA-OAHLLOKOSA-N -1 3 365.458 3.835 20 0 FHADHM CCc1ccc([C@H]2CCCCCN2C(=O)c2cc(=O)[n-]c(C3CC3)n2)o1 ZINC000654823058 927377977 /nfs/dbraw/zinc/37/79/77/927377977.db2.gz LKMJJNFVIZLGPI-MRXNPFEDSA-N -1 3 355.438 3.973 20 0 FHADHM O=C(Nc1ccc(Br)c2ncccc12)c1cccc2n[n-]nc21 ZINC001167052958 927467094 /nfs/dbraw/zinc/46/70/94/927467094.db2.gz ICDAWFBVMRKYNC-UHFFFAOYSA-N -1 3 368.194 3.521 20 0 FHADHM Cc1nc(-c2ccc(N3CC[C@@](F)(c4ccccc4)C3)nc2)[n-]c(=O)c1C ZINC000583155841 937182604 /nfs/dbraw/zinc/18/26/04/937182604.db2.gz XWJHCGICVZKTHE-NRFANRHFSA-N -1 3 364.424 3.936 20 0 FHADHM CC(C)(CO)[C@H](NC(=O)CCCc1ccc([O-])c(F)c1)c1ccccc1 ZINC000614083733 927706874 /nfs/dbraw/zinc/70/68/74/927706874.db2.gz NTKQGLOJMIBADL-HXUWFJFHSA-N -1 3 359.441 3.730 20 0 FHADHM COc1ccc([C@@H](CC(=O)[O-])NCc2ccc(Br)cc2)cc1 ZINC000683171584 927747986 /nfs/dbraw/zinc/74/79/86/927747986.db2.gz MLWRVYNWKCFIMI-MRXNPFEDSA-N -1 3 364.239 3.763 20 0 FHADHM COc1ccc([C@H](CC(=O)[O-])NCc2csc(Br)c2)cc1 ZINC000683171597 927748013 /nfs/dbraw/zinc/74/80/13/927748013.db2.gz MVNARCIUKQNYOJ-ZDUSSCGKSA-N -1 3 370.268 3.825 20 0 FHADHM CCCc1c(C(=O)[N-]c2c(C)noc2CC)nnn1-c1cccc(Cl)c1 ZINC000153985140 927769663 /nfs/dbraw/zinc/76/96/63/927769663.db2.gz PPERSZKTQPJBFC-UHFFFAOYSA-N -1 3 373.844 3.984 20 0 FHADHM CC[C@H](C)Oc1cc(CNCc2ccccc2CC(=O)[O-])ccc1OC ZINC000683176699 927772247 /nfs/dbraw/zinc/77/22/47/927772247.db2.gz OLADSLKNXLETKW-HNNXBMFYSA-N -1 3 357.450 3.789 20 0 FHADHM O=C(NCc1ccc([O-])c(F)c1)N1CC(c2cccc(C(F)(F)F)c2)C1 ZINC000458414896 937209266 /nfs/dbraw/zinc/20/92/66/937209266.db2.gz LNSCSIDFGBJYDM-UHFFFAOYSA-N -1 3 368.330 3.859 20 0 FHADHM O=C([O-])c1ccccc1CCN1CCC(Oc2ccc(F)cc2F)CC1 ZINC000579842581 928384455 /nfs/dbraw/zinc/38/44/55/928384455.db2.gz KVMGFOWRFTUJQO-UHFFFAOYSA-N -1 3 361.388 3.749 20 0 FHADHM COCCCOc1ccccc1[N-]S(=O)(=O)/C=C\c1ccc(F)cc1 ZINC000254949850 928469310 /nfs/dbraw/zinc/46/93/10/928469310.db2.gz PVMQDXIXHUTMSE-KAMYIIQDSA-N -1 3 365.426 3.654 20 0 FHADHM O=C(NCCC(c1ccccc1)c1ccccc1)c1cccc2n[n-]nc21 ZINC000583222941 937254870 /nfs/dbraw/zinc/25/48/70/937254870.db2.gz OZKSOGHDZSVUEL-UHFFFAOYSA-N -1 3 356.429 3.910 20 0 FHADHM COCCOc1ccc(S(=O)(=O)[N-]c2ccc(C)c(Cl)c2)cc1C ZINC000046623919 928650615 /nfs/dbraw/zinc/65/06/15/928650615.db2.gz OYSPOSCRZCONKN-UHFFFAOYSA-N -1 3 369.870 3.783 20 0 FHADHM O=C(c1cc(=O)[n-]c(C2CC2)n1)N1CCc2ccccc2[C@@H]1c1ccccc1 ZINC000579858006 928658715 /nfs/dbraw/zinc/65/87/15/928658715.db2.gz OJSFVDWHGUDHCY-NRFANRHFSA-N -1 3 371.440 3.848 20 0 FHADHM CCCCn1ncc(C(=O)Nc2cc(Br)ccc2[O-])c1CC ZINC000430260679 928837916 /nfs/dbraw/zinc/83/79/16/928837916.db2.gz HOWNOMLVFFELLS-UHFFFAOYSA-N -1 3 366.259 3.966 20 0 FHADHM CCCCn1ncc(C(=O)N=c2cc(-c3ccccc3C)[n-][nH]2)c1CC ZINC000430285321 929249552 /nfs/dbraw/zinc/24/95/52/929249552.db2.gz SIBUMFPXFYXUGK-UHFFFAOYSA-N -1 3 351.454 3.618 20 0 FHADHM Cc1cc([N-]C(=O)c2coc(-c3ccc(Br)cc3F)n2)no1 ZINC000180007747 929301878 /nfs/dbraw/zinc/30/18/78/929301878.db2.gz VXWTYQUMMVACQJ-UHFFFAOYSA-N -1 3 366.146 3.792 20 0 FHADHM C[C@H](Sc1ccccc1Cl)C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000079086129 929309472 /nfs/dbraw/zinc/30/94/72/929309472.db2.gz COJOZVOZEARJCR-JTQLQIEISA-N -1 3 359.842 3.639 20 0 FHADHM C[C@H](Sc1ccccc1Cl)C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000079086129 929309483 /nfs/dbraw/zinc/30/94/83/929309483.db2.gz COJOZVOZEARJCR-JTQLQIEISA-N -1 3 359.842 3.639 20 0 FHADHM O=C(Nc1cc(Br)ccc1[O-])c1ccnc(OC2CCC2)c1 ZINC000535631498 929458872 /nfs/dbraw/zinc/45/88/72/929458872.db2.gz OCWLTCDSUGPZPG-UHFFFAOYSA-N -1 3 363.211 3.733 20 0 FHADHM Cc1ccc(Cl)c(S(=O)(=O)[N-][C@H](C)c2cscn2)c1Cl ZINC000579973319 929717010 /nfs/dbraw/zinc/71/70/10/929717010.db2.gz ZFNLEFYEIDEXBT-MRVPVSSYSA-N -1 3 351.280 3.798 20 0 FHADHM Cc1nc(C)c(CCC(=O)Nc2c(F)cc(Cl)c(C)c2F)c(=O)[n-]1 ZINC000535638820 929735781 /nfs/dbraw/zinc/73/57/81/929735781.db2.gz ZMQLDCHHZYSGFZ-UHFFFAOYSA-N -1 3 355.772 3.610 20 0 FHADHM Cc1cc(=O)[n-]c(-c2cccc(NC(=O)c3ccc4ccccc4n3)c2)n1 ZINC000047329126 929869392 /nfs/dbraw/zinc/86/93/92/929869392.db2.gz 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Cc1csc([C@@H]([N-]S(=O)(=O)Cc2cc(F)ccc2Cl)C2CC2)n1 ZINC000656915998 932765757 /nfs/dbraw/zinc/76/57/57/932765757.db2.gz AGMMUSPSYLIKHK-AWEZNQCLSA-N -1 3 374.890 3.815 20 0 FHADHM O=S(=O)(Cc1ccc(F)c(Cl)c1)[N-]c1nccn1-c1ccccc1 ZINC000430672489 932854890 /nfs/dbraw/zinc/85/48/90/932854890.db2.gz ULXWUFQRMLHYQQ-UHFFFAOYSA-N -1 3 365.817 3.607 20 0 FHADHM O=C(Nc1cc(F)c(N2CCCC2)c(F)c1)c1c[n-]c2ccccc2c1=O ZINC000065008694 932866537 /nfs/dbraw/zinc/86/65/37/932866537.db2.gz HEKHXNNNSDPDAR-UHFFFAOYSA-N -1 3 369.371 3.659 20 0 FHADHM COc1cccc(-c2nc(C(=O)[N-]c3nc(C(C)(C)C)cs3)no2)c1 ZINC000471806113 932977756 /nfs/dbraw/zinc/97/77/56/932977756.db2.gz WLGYBEIRZIMQQS-UHFFFAOYSA-N -1 3 358.423 3.752 20 0 FHADHM COC(=O)c1ccc([N-]S(=O)(=O)/C=C\c2ccc(F)cc2)cc1Cl ZINC000255388785 933027987 /nfs/dbraw/zinc/02/79/87/933027987.db2.gz PPRNCKJIHAERSX-HJWRWDBZSA-N -1 3 369.801 3.678 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)CCO[C@H](C)CC(C)C)c2)n1 ZINC000087132219 933135966 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CCOc1ccc(Cl)cc1CCNC(=O)c1c[n-]c2ccccc2c1=O ZINC000159334152 933552292 /nfs/dbraw/zinc/55/22/92/933552292.db2.gz KZNUHPOCKUZNMI-UHFFFAOYSA-N -1 3 370.836 3.553 20 0 FHADHM C[C@H]1CCc2c(F)cccc2[C@@H]1NC(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000431039643 933719163 /nfs/dbraw/zinc/71/91/63/933719163.db2.gz JAAUZFUOBAPORR-FKIZINRSSA-N -1 3 350.393 3.721 20 0 FHADHM O=C(Nc1nnc(C(F)(F)F)[n-]1)c1ccccc1COc1ccccc1 ZINC000247502749 934016571 /nfs/dbraw/zinc/01/65/71/934016571.db2.gz QISGURMYNJOZPG-UHFFFAOYSA-N -1 3 362.311 3.655 20 0 FHADHM O=C(Nc1nc(C(F)(F)F)n[n-]1)c1ccccc1COc1ccccc1 ZINC000247502749 934016576 /nfs/dbraw/zinc/01/65/76/934016576.db2.gz QISGURMYNJOZPG-UHFFFAOYSA-N -1 3 362.311 3.655 20 0 FHADHM Cc1cccc(C(=O)Nc2cc(I)ccc2[O-])c1F ZINC000610765733 934128819 /nfs/dbraw/zinc/12/88/19/934128819.db2.gz JYEFCJIHHQWLEY-UHFFFAOYSA-N -1 3 371.149 3.697 20 0 FHADHM COc1ccc(CN[C@@H](CC(=O)[O-])c2ccsc2)cc1Br ZINC000277077927 934477237 /nfs/dbraw/zinc/47/72/37/934477237.db2.gz WFDQPGNYBRPJIS-ZDUSSCGKSA-N 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O=C(c1cc([O-])ccc1Cl)N(CCc1ccccn1)Cc1cccnc1 ZINC000511547870 942764767 /nfs/dbraw/zinc/76/47/67/942764767.db2.gz VUXJBSNSIYAUNP-UHFFFAOYSA-N -1 3 367.836 3.721 20 0 FHADHM COc1ccc(N[C@H]2CCCc3cc(F)ccc32)cc1[N-]S(C)(=O)=O ZINC000182735303 942781401 /nfs/dbraw/zinc/78/14/01/942781401.db2.gz OSTCTPZUMYCHMP-INIZCTEOSA-N -1 3 364.442 3.695 20 0 FHADHM C[C@@H]1CCCC[C@H]1NC(=O)Cc1nc(=O)c2cc(C(F)(F)F)sc2[n-]1 ZINC000416418349 942807789 /nfs/dbraw/zinc/80/77/89/942807789.db2.gz ZXAYMTCNDZYHEK-PSASIEDQSA-N -1 3 373.400 3.653 20 0 FHADHM CC[C@H]1CCCCN1C(=O)[C@@H](C)N1CCC(c2ccccc2C(=O)[O-])CC1 ZINC000363858500 942870209 /nfs/dbraw/zinc/87/02/09/942870209.db2.gz UGWSRAASKBZHMS-AEFFLSMTSA-N -1 3 372.509 3.744 20 0 FHADHM CC(=O)Nc1cc(F)c(S(=O)(=O)[N-][C@@H](C)CC(C)(C)C)cc1Cl ZINC000416509111 942892987 /nfs/dbraw/zinc/89/29/87/942892987.db2.gz TWCQJKKWZDXYTB-VIFPVBQESA-N -1 3 364.870 3.541 20 0 FHADHM O=C([N-]c1ncn(C2CCCCC2)n1)c1csc(-c2ncccc2F)n1 ZINC000273170621 942901139 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C[C@@H]1C[C@H]([N-]S(=O)(=O)c2ccc(Cl)cc2C(F)(F)F)CS1 ZINC000416577588 942981944 /nfs/dbraw/zinc/98/19/44/942981944.db2.gz ABTRCHNDAVTRAC-APPZFPTMSA-N -1 3 359.822 3.531 20 0 FHADHM COC(=O)c1ccc([N-]S(=O)(=O)/C=C/c2cccc(Cl)c2)cc1F ZINC000184243375 942988035 /nfs/dbraw/zinc/98/80/35/942988035.db2.gz NBOXMVQMCJVLBU-BQYQJAHWSA-N -1 3 369.801 3.678 20 0 FHADHM O=C([N-]c1ncsc1C1CC1)c1nnn(-c2ccccc2)c1C(F)F ZINC000893264305 943013616 /nfs/dbraw/zinc/01/36/16/943013616.db2.gz YXEOIZJXHZQOBD-UHFFFAOYSA-N -1 3 361.377 3.791 20 0 FHADHM Cc1nn(C(C)(C)C)c2nc(C(C)C)cc(C(=O)Nc3ncccc3[O-])c12 ZINC000514463870 943033723 /nfs/dbraw/zinc/03/37/23/943033723.db2.gz MSVWHDRGCSCVQR-UHFFFAOYSA-N -1 3 367.453 3.971 20 0 FHADHM CC(=O)c1ccc(C(=O)N2CCC(OCC3CCCCC3)CC2)cc1[O-] ZINC000514659464 943187349 /nfs/dbraw/zinc/18/73/49/943187349.db2.gz AGIZWVMUIMWFLL-UHFFFAOYSA-N -1 3 359.466 3.796 20 0 FHADHM Cc1ccc(NC(=O)CSCc2cc(=O)[n-]c(C3CC3)n2)c(Cl)c1 ZINC000514663567 943189746 /nfs/dbraw/zinc/18/97/46/943189746.db2.gz 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943371735 /nfs/dbraw/zinc/37/17/35/943371735.db2.gz IXGGNLQZIPUYJG-UHFFFAOYSA-N -1 3 364.367 3.981 20 0 FHADHM Cc1ccc(Cl)c(S(=O)(=O)[N-][C@H](c2ccccc2)[C@H](C)O)c1Cl ZINC000660162848 943376301 /nfs/dbraw/zinc/37/63/01/943376301.db2.gz QBBLXVJEKURQQR-NHYWBVRUSA-N -1 3 374.289 3.702 20 0 FHADHM O=S(=O)([N-][C@@H]1C[C@H]1c1c(F)cccc1F)c1cc(F)ccc1Cl ZINC000435441497 943418562 /nfs/dbraw/zinc/41/85/62/943418562.db2.gz GGSCZQDGPDNDGD-NOZJJQNGSA-N -1 3 361.772 3.592 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NCCc3ccc(SC)cc3)nc2)n1 ZINC000435584094 943503555 /nfs/dbraw/zinc/50/35/55/943503555.db2.gz JTBKJHQBHZEREE-UHFFFAOYSA-N -1 3 366.490 3.605 20 0 FHADHM CN(C)[C@H](CNC(=O)c1ccc([O-])cc1F)c1cccc(C(F)(F)F)c1 ZINC000183900356 943524276 /nfs/dbraw/zinc/52/42/76/943524276.db2.gz WTQHXRCOAOMWIB-MRXNPFEDSA-N -1 3 370.346 3.583 20 0 FHADHM CCC(O)(CC)CC[N-]S(=O)(=O)c1cc(Cl)ccc1C(F)(F)F ZINC000509976592 943560332 /nfs/dbraw/zinc/56/03/32/943560332.db2.gz MWUVYLWIZYPVFR-UHFFFAOYSA-N -1 3 373.824 3.578 20 0 FHADHM O=S(=O)([N-][C@H]1CCCOc2ccccc21)c1ccc(Cl)cc1F ZINC000504538219 943652166 /nfs/dbraw/zinc/65/21/66/943652166.db2.gz HHBXGIUCMWCNEE-AWEZNQCLSA-N -1 3 355.818 3.671 20 0 FHADHM CC(C)(C)OC(=O)c1cccc(CN[C@H](C(=O)[O-])c2cccc(F)c2)c1 ZINC000417557678 943704397 /nfs/dbraw/zinc/70/43/97/943704397.db2.gz SCUBDKDDSYUYFQ-KRWDZBQOSA-N -1 3 359.397 3.697 20 0 FHADHM C[C@@H]1CC[C@](CNCc2c(F)cccc2Br)(CC(=O)[O-])C1 ZINC000417571949 943710185 /nfs/dbraw/zinc/71/01/85/943710185.db2.gz UJLLBWNMXXBLAP-BDJLRTHQSA-N -1 3 358.251 3.959 20 0 FHADHM COc1cc(CN[C@H](CC(=O)[O-])c2ccc(C(C)C)cc2)cc2c1OCO2 ZINC000417578402 943723331 /nfs/dbraw/zinc/72/33/31/943723331.db2.gz YONWFBOBEMUDPM-QGZVFWFLSA-N -1 3 371.433 3.853 20 0 FHADHM CCn1cc(CN[C@@H](CCC(=O)[O-])c2ccc(Cl)c(Cl)c2)cn1 ZINC000417575842 943733988 /nfs/dbraw/zinc/73/39/88/943733988.db2.gz TXKXTNSZBGHNSI-HNNXBMFYSA-N -1 3 356.253 3.906 20 0 FHADHM Cc1cc(Br)c(CN[C@@H](CC(F)F)C(=O)[O-])cc1Cl ZINC000417598209 943750006 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Cc1ncccc1CN[C@H](c1ccc(Br)cc1)[C@H](C)C(=O)[O-] ZINC000417639140 943788754 /nfs/dbraw/zinc/78/87/54/943788754.db2.gz LHUKWADTDSZXAP-ZBEGNZNMSA-N -1 3 363.255 3.704 20 0 FHADHM O=S(=O)(CCOCC1CC1)[N-]c1cc(C(F)(F)F)ccc1Cl ZINC000424213402 943800784 /nfs/dbraw/zinc/80/07/84/943800784.db2.gz UHSRXNJWELGRRA-UHFFFAOYSA-N -1 3 357.781 3.527 20 0 FHADHM CCc1ccc(-c2nc(C[C@H](C)N(C)C(=O)OC(C)(C)C)no2)c([O-])c1 ZINC000189188087 943849941 /nfs/dbraw/zinc/84/99/41/943849941.db2.gz KQHPLZRTNWMLHF-LBPRGKRZSA-N -1 3 361.442 3.803 20 0 FHADHM Cc1ncc(S(=O)(=O)[N-][C@H](C)c2ccc(F)c3ccccc32)s1 ZINC000516993463 943898602 /nfs/dbraw/zinc/89/86/02/943898602.db2.gz UQQXZYGWDMMLPN-SNVBAGLBSA-N -1 3 350.440 3.783 20 0 FHADHM Cc1ncc(CNC(=O)N[C@@H]2CCC[C@H](c3cccc(Cl)c3)C2)c(=O)[n-]1 ZINC000517015355 943912106 /nfs/dbraw/zinc/91/21/06/943912106.db2.gz PWAUJNHXGWOMKO-WMLDXEAASA-N -1 3 374.872 3.670 20 0 FHADHM Cc1[nH]c2c(cc(C)cc2CNC(=O)c2cc(=O)c3ccccc3[n-]2)c1C ZINC000500030932 943973975 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FHADHM C[C@@H]1CCC[C@H]1NC(=O)C[C@@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436484032 944369216 /nfs/dbraw/zinc/36/92/16/944369216.db2.gz DAXUQWKLLXQYAP-CDHQVMDDSA-N -1 3 366.461 3.558 20 0 FHADHM O=C(NCCCCCOC1CCCCC1)c1cc(=O)c2ccccc2[n-]1 ZINC000518434499 944380088 /nfs/dbraw/zinc/38/00/88/944380088.db2.gz IRQPDZQOKGCJEJ-UHFFFAOYSA-N -1 3 356.466 3.778 20 0 FHADHM COc1ccc(C(=O)Nc2ccc3nc(-c4ccccn4)[nH]c3c2)c([O-])c1 ZINC000436546519 944406387 /nfs/dbraw/zinc/40/63/87/944406387.db2.gz GEQBARFENBEDFX-UHFFFAOYSA-N -1 3 360.373 3.591 20 0 FHADHM CC(C)c1ccc(C(=O)Nc2ccccc2CN2CCOCC2)c([O-])c1 ZINC000436552617 944411877 /nfs/dbraw/zinc/41/18/77/944411877.db2.gz ADOPUJWLLINNBW-UHFFFAOYSA-N -1 3 354.450 3.600 20 0 FHADHM Cc1ccc(C(=O)Nc2ccccc2CN2C[C@H](C)O[C@@H](C)C2)c([O-])c1C ZINC000436555929 944412834 /nfs/dbraw/zinc/41/28/34/944412834.db2.gz JVYIALQXMRYAFP-HOTGVXAUSA-N -1 3 368.477 3.871 20 0 FHADHM COc1ccc(C(=O)N[C@H](C)c2nc3ccccc3n2C(C)C)c([O-])c1 ZINC000436539384 944417217 /nfs/dbraw/zinc/41/72/17/944417217.db2.gz SWZXOOJIDAPWMR-CYBMUJFWSA-N -1 3 353.422 3.822 20 0 FHADHM COCCN(CC(F)F)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436540731 944417799 /nfs/dbraw/zinc/41/77/99/944417799.db2.gz ZZEBOSCFBHXZEC-UHFFFAOYSA-N -1 3 351.349 3.538 20 0 FHADHM COCc1csc(NC(=O)c2cc(Cc3ccccc3)ccc2[O-])n1 ZINC000436543065 944421035 /nfs/dbraw/zinc/42/10/35/944421035.db2.gz CXRAJBJNIOFQDN-UHFFFAOYSA-N -1 3 354.431 3.838 20 0 FHADHM Cc1cc(C[C@@H](C)NC(=O)c2cc(Oc3ccccc3)ccc2[O-])[nH]n1 ZINC000436596520 944441308 /nfs/dbraw/zinc/44/13/08/944441308.db2.gz QTXOPFPPQWVMDM-CYBMUJFWSA-N -1 3 351.406 3.577 20 0 FHADHM C[C@H](NC(=O)c1cc(CCc2ccccc2)ccc1[O-])[C@@H]1CCCOC1 ZINC000436579052 944444446 /nfs/dbraw/zinc/44/44/46/944444446.db2.gz TZSJIKVFXKUCIJ-QFBILLFUSA-N -1 3 353.462 3.722 20 0 FHADHM CN(CCC(=O)OC(C)(C)C)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436580010 944444616 /nfs/dbraw/zinc/44/46/16/944444616.db2.gz YXIGPJPNFHHSGW-UHFFFAOYSA-N -1 3 369.461 3.787 20 0 FHADHM CC[C@@H]1C[C@@H](C(=O)N=c2cc(-c3cc(Cl)cc(Cl)c3)[n-][nH]2)CCO1 ZINC000506196079 944446078 /nfs/dbraw/zinc/44/60/78/944446078.db2.gz WDBDPNCIXUKDHO-IINYFYTJSA-N -1 3 368.264 3.949 20 0 FHADHM CC(C)c1ccc(C(=O)N[C@H](CC(N)=O)c2cccc(Cl)c2)c([O-])c1 ZINC000436588920 944450782 /nfs/dbraw/zinc/45/07/82/944450782.db2.gz NSQBBGISNQDISM-MRXNPFEDSA-N -1 3 360.841 3.516 20 0 FHADHM CCc1ccc(C(=O)N2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)c([O-])c1 ZINC000436600696 944453025 /nfs/dbraw/zinc/45/30/25/944453025.db2.gz AUAYCLBEFCBXPE-VAMGGRTRSA-N -1 3 351.446 3.599 20 0 FHADHM COc1ccc(C(=O)N[C@H]2C[C@H]2c2ccccc2C(F)(F)F)c([O-])c1 ZINC000436624412 944465232 /nfs/dbraw/zinc/46/52/32/944465232.db2.gz LHVCHNCFFBOMSJ-ZFWWWQNUSA-N -1 3 351.324 3.706 20 0 FHADHM CC[C@@H]1CN(C(=O)c2cc(Oc3ccccc3)ccc2[O-])C[C@H](C)[S@@]1=O ZINC000436624562 944466177 /nfs/dbraw/zinc/46/61/77/944466177.db2.gz JWIISJLFONWXEL-CHLCXMBXSA-N -1 3 373.474 3.556 20 0 FHADHM CC(C)[C@H]1CCN1C(=O)C[C@@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436635880 944474641 /nfs/dbraw/zinc/47/46/41/944474641.db2.gz OXPMIXZELSEQPE-WOJBJXKFSA-N -1 3 366.461 3.510 20 0 FHADHM CC(=O)c1ccc(C(=O)N2CCC(Cc3ccc(F)cc3)CC2)cc1[O-] ZINC000436636435 944475374 /nfs/dbraw/zinc/47/53/74/944475374.db2.gz QZKKPDAULMZLJX-UHFFFAOYSA-N -1 3 355.409 3.829 20 0 FHADHM O=C(N[C@H]1CCO[C@@H](C2CC2)C1)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436654125 944486914 /nfs/dbraw/zinc/48/69/14/944486914.db2.gz DSYIFOPCBHNZKR-GHTZIAJQSA-N -1 3 351.446 3.670 20 0 FHADHM Cc1sc(NC(=O)c2c([O-])cccc2O)nc1-c1c[nH]c2ncccc12 ZINC000436645912 944494556 /nfs/dbraw/zinc/49/45/56/944494556.db2.gz FFRFTLFUFJIBPI-UHFFFAOYSA-N -1 3 366.402 3.658 20 0 FHADHM CCC(=O)c1ccc([O-])c(NC(=O)c2ccc(Nc3ccncc3)cc2)c1 ZINC000436646798 944494865 /nfs/dbraw/zinc/49/48/65/944494865.db2.gz PFBRNTORIQHPPI-UHFFFAOYSA-N -1 3 361.401 3.798 20 0 FHADHM CCOc1ccc(CCC2CCN(C(=O)c3ccc(O)cc3[O-])CC2)cc1 ZINC000436673142 944507720 /nfs/dbraw/zinc/50/77/20/944507720.db2.gz POOCMUAWOXEFKV-UHFFFAOYSA-N -1 3 369.461 3.982 20 0 FHADHM COc1ccc(C(=O)N[C@@H](C)COc2ccccc2C(F)(F)F)c([O-])c1 ZINC000436677147 944515888 /nfs/dbraw/zinc/51/58/88/944515888.db2.gz BPBWKICPLHUFLZ-NSHDSACASA-N -1 3 369.339 3.617 20 0 FHADHM CC(C)C(=O)Nc1cccc(NC(=O)c2ccc3c(c2[O-])OC(C)(C)C3)c1 ZINC000436681427 944520251 /nfs/dbraw/zinc/52/02/51/944520251.db2.gz NGYQCCBEMHKSCK-UHFFFAOYSA-N -1 3 368.433 3.953 20 0 FHADHM COc1cc(-c2nc(COc3ccc(Cl)cc3)no2)cc(OC)c1[O-] ZINC000436686032 944523832 /nfs/dbraw/zinc/52/38/32/944523832.db2.gz DITPUOPGSNCYNN-UHFFFAOYSA-N -1 3 362.769 3.692 20 0 FHADHM CCc1nc(C)c(CNC(=O)c2cc(Cc3ccccc3)ccc2[O-])o1 ZINC000436688774 944527684 /nfs/dbraw/zinc/52/76/84/944527684.db2.gz LTYDRJZRIXKXDS-UHFFFAOYSA-N -1 3 350.418 3.772 20 0 FHADHM COc1cc(-c2nc([C@@H](C)c3c(F)cccc3F)no2)cc(OC)c1[O-] ZINC000436692013 944530447 /nfs/dbraw/zinc/53/04/47/944530447.db2.gz VRYZEKFOGJWHJY-VIFPVBQESA-N -1 3 362.332 3.889 20 0 FHADHM CCCNC(=O)c1ccc(NC(=O)c2cc3c(cc2[O-])CCCC3)cc1 ZINC000436695310 944535513 /nfs/dbraw/zinc/53/55/13/944535513.db2.gz DCZCOIGJMNBTFV-UHFFFAOYSA-N -1 3 352.434 3.663 20 0 FHADHM O=C(c1ccccc1[O-])N1CCN(Cc2c(Cl)oc3ccccc32)CC1 ZINC000436696169 944537343 /nfs/dbraw/zinc/53/73/43/944537343.db2.gz HDOGLEAJXNCHFS-UHFFFAOYSA-N -1 3 370.836 3.750 20 0 FHADHM O=C(NCCCc1c[nH]c2ccc(F)cc12)c1cc(=O)c2ccccc2[n-]1 ZINC000506213551 944538739 /nfs/dbraw/zinc/53/87/39/944538739.db2.gz ZHNMSHHEODQJPX-UHFFFAOYSA-N -1 3 363.392 3.511 20 0 FHADHM COC(=O)c1cccc2[n-]c(NC(=O)[C@@H](C)SCc3ccccc3)nc21 ZINC000438353014 944541870 /nfs/dbraw/zinc/54/18/70/944541870.db2.gz JDZDZNXDQQRSAO-GFCCVEGCSA-N -1 3 369.446 3.610 20 0 FHADHM CCc1nc2cc(CNC(=O)c3ccc(OC)cc3[O-])ccc2n1C1CC1 ZINC000436704780 944544624 /nfs/dbraw/zinc/54/46/24/944544624.db2.gz PRLQSKZOEZQISA-UHFFFAOYSA-N -1 3 365.433 3.578 20 0 FHADHM [O-]c1ccccc1-c1nc(CSc2nccn2Cc2ccccc2)no1 ZINC000436706958 944545777 /nfs/dbraw/zinc/54/57/77/944545777.db2.gz QRJGQUYMIGAHON-UHFFFAOYSA-N -1 3 364.430 3.979 20 0 FHADHM CC(C)c1ccc(C(=O)N[C@H](C)c2ncc(Br)cn2)c([O-])c1 ZINC000436707386 944547885 /nfs/dbraw/zinc/54/78/85/944547885.db2.gz GTNMYNYMBOZPEI-SNVBAGLBSA-N -1 3 364.243 3.559 20 0 FHADHM CN(C)C[C@H](NC(=O)c1ccc([O-])c(Cl)c1)c1ccc(Cl)cc1 ZINC000436718529 944557763 /nfs/dbraw/zinc/55/77/63/944557763.db2.gz FIJHTUIOVDRBDN-HNNXBMFYSA-N -1 3 353.249 3.732 20 0 FHADHM CN(C)C[C@H](NC(=O)c1cc(F)c([O-])c(Cl)c1)c1ccc(Cl)cc1 ZINC000436720226 944560183 /nfs/dbraw/zinc/56/01/83/944560183.db2.gz IRJPKFXYASHCFF-HNNXBMFYSA-N -1 3 371.239 3.871 20 0 FHADHM CN(C)C[C@@H](NC(=O)c1cc(F)c([O-])c(Cl)c1)c1ccc(Cl)cc1 ZINC000436720228 944560422 /nfs/dbraw/zinc/56/04/22/944560422.db2.gz IRJPKFXYASHCFF-OAHLLOKOSA-N -1 3 371.239 3.871 20 0 FHADHM CC(C)c1ccc(C(=O)N2CSC[C@H]2C(=O)Nc2ccccc2)c([O-])c1 ZINC000436760360 944583661 /nfs/dbraw/zinc/58/36/61/944583661.db2.gz ORGIOMNKCOWAAS-KRWDZBQOSA-N -1 3 370.474 3.669 20 0 FHADHM CC[C@](C)([N-]S(=O)(=O)c1cc(F)c(C)cc1F)c1nc(C)cs1 ZINC000122322365 944586417 /nfs/dbraw/zinc/58/64/17/944586417.db2.gz OSQLGCIDHDJVOZ-HNNXBMFYSA-N -1 3 360.451 3.642 20 0 FHADHM CC(C)c1ccc(C(=O)N2CCCN(C(=O)c3ccccc3)CC2)c([O-])c1 ZINC000436749683 944588972 /nfs/dbraw/zinc/58/89/72/944588972.db2.gz ZRPKBUSSESIDIW-UHFFFAOYSA-N -1 3 366.461 3.504 20 0 FHADHM CC(C)c1ccc(C(=O)N[C@H](c2nccn2C)c2cccc(F)c2)c([O-])c1 ZINC000436757205 944599219 /nfs/dbraw/zinc/59/92/19/944599219.db2.gz UATNPKWCDYHIBE-IBGZPJMESA-N -1 3 367.424 3.908 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)NC[C@H](C)Oc2ccc(C(C)C)cc2)c1 ZINC000436774049 944602651 /nfs/dbraw/zinc/60/26/51/944602651.db2.gz VCYMTGZQHSIXRF-AWEZNQCLSA-N -1 3 370.449 3.671 20 0 FHADHM CC[C@@H](C)N(CC(=O)Nc1cccc(C)c1C)C(=O)c1ccc(O)cc1[O-] ZINC000436798481 944623967 /nfs/dbraw/zinc/62/39/67/944623967.db2.gz UDEOOXCNMSIFLM-CQSZACIVSA-N -1 3 370.449 3.594 20 0 FHADHM C[C@H](C(=O)Nc1ccc(-c2nnn[n-]2)cc1)c1c(Cl)cccc1Cl ZINC000591175365 944637619 /nfs/dbraw/zinc/63/76/19/944637619.db2.gz TVMVJACSCDDEDP-VIFPVBQESA-N -1 3 362.220 3.916 20 0 FHADHM C[C@H](C(=O)Nc1ccc(-c2nn[n-]n2)cc1)c1c(Cl)cccc1Cl ZINC000591175365 944637625 /nfs/dbraw/zinc/63/76/25/944637625.db2.gz TVMVJACSCDDEDP-VIFPVBQESA-N -1 3 362.220 3.916 20 0 FHADHM C[C@H]1C[C@H]1N1CCN(C(=O)c2c([O-])cc(Cl)cc2Cl)C[C@@H](C)C1 ZINC000436790231 944637659 /nfs/dbraw/zinc/63/76/59/944637659.db2.gz GDYMLJLDVBDQMF-COPLHBTASA-N -1 3 357.281 3.501 20 0 FHADHM CC(C)[C@H](Oc1cccc(Cl)c1)C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000538746034 944637866 /nfs/dbraw/zinc/63/78/66/944637866.db2.gz RHHBLJUXTKANIK-INIZCTEOSA-N -1 3 371.828 3.562 20 0 FHADHM CC(C)[C@H](Oc1cccc(Cl)c1)C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000538746034 944637873 /nfs/dbraw/zinc/63/78/73/944637873.db2.gz RHHBLJUXTKANIK-INIZCTEOSA-N -1 3 371.828 3.562 20 0 FHADHM C[C@H](c1cnn(C)c1)N(C)C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436815889 944651483 /nfs/dbraw/zinc/65/14/83/944651483.db2.gz MVBUGXMHDGALMC-MRXNPFEDSA-N -1 3 363.461 3.744 20 0 FHADHM COc1ccccc1[C@H](CNC(=O)c1ccc(Cl)cc1[O-])N1CCCC1 ZINC000436817843 944653926 /nfs/dbraw/zinc/65/39/26/944653926.db2.gz ISKNCKFUCZONBQ-KRWDZBQOSA-N -1 3 374.868 3.621 20 0 FHADHM CCc1ccc(C(=O)Nc2cccc(C(=O)N3CCCCC3)c2)c([O-])c1 ZINC000436805066 944658949 /nfs/dbraw/zinc/65/89/49/944658949.db2.gz DDEONVSUNCUPFP-UHFFFAOYSA-N -1 3 352.434 3.833 20 0 FHADHM CC(C)c1ccc(C(=O)N2CCC[C@@H](Oc3ncccc3F)C2)c([O-])c1 ZINC000436807528 944663646 /nfs/dbraw/zinc/66/36/46/944663646.db2.gz IMOMOPWKEVWISW-OAHLLOKOSA-N -1 3 358.413 3.733 20 0 FHADHM COC[C@H]1CCCCN(C(=O)c2cc(Cc3ccccc3)ccc2[O-])C1 ZINC000436812643 944669868 /nfs/dbraw/zinc/66/98/68/944669868.db2.gz BKZCHTHOCYFZGU-IBGZPJMESA-N -1 3 353.462 3.872 20 0 FHADHM CCc1ccc(C(=O)Nc2ccc3[nH]c([C@@H]4CCCO4)nc3c2)c([O-])c1 ZINC000436827569 944672788 /nfs/dbraw/zinc/67/27/88/944672788.db2.gz KPYJXTIVMWPEJE-SFHVURJKSA-N -1 3 351.406 3.935 20 0 FHADHM C[C@H](C(=O)Oc1ccc(-c2ccc(-c3nnn[n-]3)cc2)cc1)c1ccco1 ZINC000735572077 944672862 /nfs/dbraw/zinc/67/28/62/944672862.db2.gz QKKSROVDWXNZTO-ZDUSSCGKSA-N -1 3 360.373 3.836 20 0 FHADHM C[C@H](C(=O)Oc1ccc(-c2ccc(-c3nn[n-]n3)cc2)cc1)c1ccco1 ZINC000735572077 944672872 /nfs/dbraw/zinc/67/28/72/944672872.db2.gz QKKSROVDWXNZTO-ZDUSSCGKSA-N -1 3 360.373 3.836 20 0 FHADHM O=C(Cc1coc2ccc3ccccc3c12)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000517811349 944678708 /nfs/dbraw/zinc/67/87/08/944678708.db2.gz CMJMCAQWILOFAX-UHFFFAOYSA-N -1 3 369.384 3.947 20 0 FHADHM O=C(Cc1coc2ccc3ccccc3c12)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000517811349 944678717 /nfs/dbraw/zinc/67/87/17/944678717.db2.gz CMJMCAQWILOFAX-UHFFFAOYSA-N -1 3 369.384 3.947 20 0 FHADHM O=C([O-])C[C@@H](NCc1ccc(Oc2cnccn2)cc1)c1ccsc1 ZINC000426684097 944681101 /nfs/dbraw/zinc/68/11/01/944681101.db2.gz XFPYYNJOCWHBAT-MRXNPFEDSA-N -1 3 355.419 3.636 20 0 FHADHM CC(C)(C)c1ccc(NC(=O)CSc2ccccc2-c2nnn[n-]2)cc1 ZINC000735648436 944684432 /nfs/dbraw/zinc/68/44/32/944684432.db2.gz DZVQVPBFWIGFDV-UHFFFAOYSA-N -1 3 367.478 3.895 20 0 FHADHM CC(C)(C)c1ccc(NC(=O)CSc2ccccc2-c2nn[n-]n2)cc1 ZINC000735648436 944684442 /nfs/dbraw/zinc/68/44/42/944684442.db2.gz DZVQVPBFWIGFDV-UHFFFAOYSA-N -1 3 367.478 3.895 20 0 FHADHM COc1ccc(C(=O)N[C@H](C)Cc2ccc(C(F)(F)F)cc2)c([O-])c1 ZINC000436835530 944684393 /nfs/dbraw/zinc/68/43/93/944684393.db2.gz AETWPMZJZKUTQN-LLVKDONJSA-N -1 3 353.340 3.781 20 0 FHADHM CCc1ccc(C(=O)Nc2ccccc2CN2C[C@@H](C)O[C@@H](C)C2)c([O-])c1 ZINC000436820859 944689747 /nfs/dbraw/zinc/68/97/47/944689747.db2.gz SZCLGRYCPBMINV-IYBDPMFKSA-N -1 3 368.477 3.816 20 0 FHADHM Cc1ccc([C@H](NCc2cnn(-c3ccc(Cl)cc3)c2)C(=O)[O-])cc1 ZINC000426677509 944690914 /nfs/dbraw/zinc/69/09/14/944690914.db2.gz LZOSXQXRMSRVCP-SFHVURJKSA-N -1 3 355.825 3.750 20 0 FHADHM CCc1ccc(C(=O)Nc2ccc(CS(=O)(=O)C(C)C)cc2)c([O-])c1 ZINC000436823579 944693046 /nfs/dbraw/zinc/69/30/46/944693046.db2.gz BTXMDZSQOXBFPH-UHFFFAOYSA-N -1 3 361.463 3.530 20 0 FHADHM Cc1cccc(C(=O)Nc2ccc3c(c2)N(C(=O)C(C)(C)C)CCO3)c1[O-] ZINC000436825469 944695619 /nfs/dbraw/zinc/69/56/19/944695619.db2.gz KUSKMLRFSHWMBO-UHFFFAOYSA-N -1 3 368.433 3.724 20 0 FHADHM Cc1cccc(C(=O)Nc2cc(F)c(Cl)cc2N2CCOCC2)c1[O-] ZINC000436855563 944702829 /nfs/dbraw/zinc/70/28/29/944702829.db2.gz VLGSYLSSMTUPCC-UHFFFAOYSA-N -1 3 364.804 3.582 20 0 FHADHM Cc1ccc(C(=O)N2CCO[C@@H](c3ccc(OC(F)F)cc3)C2)c([O-])c1 ZINC000436839846 944704890 /nfs/dbraw/zinc/70/48/90/944704890.db2.gz QMPNWDRMAICQON-QGZVFWFLSA-N -1 3 363.360 3.516 20 0 FHADHM CCc1ccc(C(=O)N[C@@H](c2noc(C)n2)c2ccc(Cl)cc2)c([O-])c1 ZINC000436840395 944707269 /nfs/dbraw/zinc/70/72/69/944707269.db2.gz QMMZRHLENMLBRG-QGZVFWFLSA-N -1 3 371.824 3.819 20 0 FHADHM CCc1ccc(C(=O)NC[C@@H](NCc2ccccc2)c2ccco2)c([O-])c1 ZINC000436856617 944707312 /nfs/dbraw/zinc/70/73/12/944707312.db2.gz MSDRVNKNIROMHR-LJQANCHMSA-N -1 3 364.445 3.809 20 0 FHADHM COc1ccc(CNCc2ccccc2CC(=O)[O-])cc1OCC(C)C ZINC000426692248 944712554 /nfs/dbraw/zinc/71/25/54/944712554.db2.gz QCQKEUVUQQPOLD-UHFFFAOYSA-N -1 3 357.450 3.647 20 0 FHADHM COc1cccc([C@@H]2C[C@@H](C)CN2C(=O)c2cc(OC)c([O-])c(OC)c2)c1 ZINC000436848300 944715238 /nfs/dbraw/zinc/71/52/38/944715238.db2.gz UPWXWFWRNGRWFW-DYVFJYSZSA-N -1 3 371.433 3.641 20 0 FHADHM CCc1nc(CNC(=O)c2cc(Cc3ccccc3)ccc2[O-])cs1 ZINC000436862932 944727839 /nfs/dbraw/zinc/72/78/39/944727839.db2.gz GSBTUCFXYZZDMT-UHFFFAOYSA-N -1 3 352.459 3.932 20 0 FHADHM CC(=O)c1ccc(C(=O)N(C)Cc2ccc(Br)s2)cc1[O-] ZINC000436864027 944729229 /nfs/dbraw/zinc/72/92/29/944729229.db2.gz MPPOEROENFHETI-UHFFFAOYSA-N -1 3 368.252 3.691 20 0 FHADHM O=C([O-])C[C@H](CNCc1ccn(-c2ccccc2)n1)c1ccc(Cl)cc1 ZINC000426711605 944734484 /nfs/dbraw/zinc/73/44/84/944734484.db2.gz PPKNDAIEHYRANM-MRXNPFEDSA-N -1 3 369.852 3.874 20 0 FHADHM O=C([O-])Cc1ccccc1CNCc1c[nH]nc1-c1ccc(Cl)cc1 ZINC000426711694 944734851 /nfs/dbraw/zinc/73/48/51/944734851.db2.gz QRBXPAPCGBLKRP-UHFFFAOYSA-N -1 3 355.825 3.647 20 0 FHADHM CCOc1ccc2nc(NC(=O)c3ccc(C(C)=O)c([O-])c3)sc2c1 ZINC000436857520 944746657 /nfs/dbraw/zinc/74/66/57/944746657.db2.gz AUWKWZGUAQBVRJ-UHFFFAOYSA-N -1 3 356.403 3.856 20 0 FHADHM O=C([O-])CC[C@H](Cc1ccccc1)NCc1coc(-c2ccccc2)n1 ZINC000426738040 944748647 /nfs/dbraw/zinc/74/86/47/944748647.db2.gz SHLODQWSHOPRKG-GOSISDBHSA-N -1 3 350.418 3.907 20 0 FHADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(NC(=O)C3(C)CCC3)cc2)cc1 ZINC000426057632 944755754 /nfs/dbraw/zinc/75/57/54/944755754.db2.gz JRKHAFMDRPPTHD-UHFFFAOYSA-N -1 3 358.463 3.925 20 0 FHADHM COc1ccc([O-])c(-c2nc(Cc3cc(Br)cs3)no2)c1 ZINC000436885324 944758122 /nfs/dbraw/zinc/75/81/22/944758122.db2.gz CHUPYGABVCKSGT-UHFFFAOYSA-N -1 3 367.224 3.866 20 0 FHADHM COCc1nc(Cc2noc(-c3cc4ccccc4cc3[O-])n2)cs1 ZINC000436885578 944760806 /nfs/dbraw/zinc/76/08/06/944760806.db2.gz KPWWMBOPOSJELT-UHFFFAOYSA-N -1 3 353.403 3.789 20 0 FHADHM COc1ccccc1[C@@H](NCc1ccc(Br)cc1C)C(=O)[O-] ZINC000426763432 944763605 /nfs/dbraw/zinc/76/36/05/944763605.db2.gz BRACFAMHKVCPCG-MRXNPFEDSA-N -1 3 364.239 3.682 20 0 FHADHM O=C([O-])[C@@H](NCc1ccc(OC(F)F)c(Cl)c1)c1ccc(F)cc1 ZINC000426766089 944765067 /nfs/dbraw/zinc/76/50/67/944765067.db2.gz WIQQMSBRXOVPSZ-AWEZNQCLSA-N -1 3 359.731 3.996 20 0 FHADHM C[C@@H](CN1CCN(C(=O)c2ccc([O-])cc2)CC1)c1cccc(Cl)c1 ZINC000436891965 944767787 /nfs/dbraw/zinc/76/77/87/944767787.db2.gz JJVPPVGEIGFBBH-HNNXBMFYSA-N -1 3 358.869 3.607 20 0 FHADHM COc1cccc(-c2nc(Cc3nc4ccccc4n3C(F)F)no2)c1[O-] ZINC000436891784 944767911 /nfs/dbraw/zinc/76/79/11/944767911.db2.gz HTGXEFCKOUBUIM-UHFFFAOYSA-N -1 3 372.331 3.786 20 0 FHADHM Cc1cc(C)cc([C@@H](NCc2cnc3c(cnn3C(C)C)c2)C(=O)[O-])c1 ZINC000426749214 944768015 /nfs/dbraw/zinc/76/80/15/944768015.db2.gz DLGNSIHALDMCMJ-GOSISDBHSA-N -1 3 352.438 3.545 20 0 FHADHM C[C@H](C(=O)[O-])[C@@H](NCc1ccc(OC(F)F)c(F)c1)c1ccccc1 ZINC000426749935 944769241 /nfs/dbraw/zinc/76/92/41/944769241.db2.gz JNUCUBAUAQKARP-MEDUHNTESA-N -1 3 353.340 3.979 20 0 FHADHM CN(C[C@H]1CCCC[C@H]1O)C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436904170 944770946 /nfs/dbraw/zinc/77/09/46/944770946.db2.gz KLJISEYRQWVFSA-TZIWHRDSSA-N -1 3 367.489 3.801 20 0 FHADHM COc1ccc(CN[C@H](C(=O)[O-])c2cc(C)cc(C)c2)cc1OC(F)F ZINC000426753944 944774387 /nfs/dbraw/zinc/77/43/87/944774387.db2.gz MFJAWXHSSNHTMS-KRWDZBQOSA-N -1 3 365.376 3.829 20 0 FHADHM C[C@@H]1CCC[C@H](C)N(C(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)C1 ZINC000736245122 944775770 /nfs/dbraw/zinc/77/57/70/944775770.db2.gz QTCLZANGJYCYRL-MNOVXSKESA-N -1 3 364.906 3.727 20 0 FHADHM C[C@@H]1CCC[C@H](C)N(C(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)C1 ZINC000736245122 944775778 /nfs/dbraw/zinc/77/57/78/944775778.db2.gz QTCLZANGJYCYRL-MNOVXSKESA-N -1 3 364.906 3.727 20 0 FHADHM O=C([O-])C[C@H](NCc1cccc2[nH]ccc21)c1cnn(-c2ccccc2)c1 ZINC000426758163 944777905 /nfs/dbraw/zinc/77/79/05/944777905.db2.gz RJXLQGTYAHYENQ-FQEVSTJZSA-N -1 3 360.417 3.659 20 0 FHADHM CCOc1c(OC)cc(CN[C@@H](C(=O)[O-])c2cc(C)cc(C)c2)cc1OC ZINC000426758157 944778267 /nfs/dbraw/zinc/77/82/67/944778267.db2.gz RHRFOQPYVHSWEW-LJQANCHMSA-N -1 3 373.449 3.635 20 0 FHADHM CC(C)c1ccc(C(=O)NCc2noc(-c3cccc(F)c3)n2)c([O-])c1 ZINC000436911851 944780595 /nfs/dbraw/zinc/78/05/95/944780595.db2.gz RPORNEPFFYVHOR-UHFFFAOYSA-N -1 3 355.369 3.635 20 0 FHADHM CCOc1cc(CN[C@@H](C(=O)[O-])c2ccc(Cl)c(F)c2)ccc1OC ZINC000426759634 944782159 /nfs/dbraw/zinc/78/21/59/944782159.db2.gz WZIKBPWZZGEYCN-QGZVFWFLSA-N -1 3 367.804 3.802 20 0 FHADHM CC(C)(C)CCNC(=O)C[C@@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436911429 944782160 /nfs/dbraw/zinc/78/21/60/944782160.db2.gz QKCDQKKLCLMTGW-LJQANCHMSA-N -1 3 368.477 3.806 20 0 FHADHM C[C@@H]1CCc2c(sc(NC(=O)[C@H]3CCC[C@H](C)C3)c2-c2nnn[n-]2)C1 ZINC000736279768 944783299 /nfs/dbraw/zinc/78/32/99/944783299.db2.gz MJJFEPKRYWQNPI-TUAOUCFPSA-N -1 3 359.499 3.818 20 0 FHADHM C[C@@H]1CCc2c(sc(NC(=O)[C@H]3CCC[C@H](C)C3)c2-c2nn[n-]n2)C1 ZINC000736279768 944783308 /nfs/dbraw/zinc/78/33/08/944783308.db2.gz MJJFEPKRYWQNPI-TUAOUCFPSA-N -1 3 359.499 3.818 20 0 FHADHM CN(C[C@@H]1CCCC[C@H]1O)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436901196 944789677 /nfs/dbraw/zinc/78/96/77/944789677.db2.gz AFEYRCITFMGQSV-AZUAARDMSA-N -1 3 353.462 3.606 20 0 FHADHM CCC[C@@]1(CO)CCN(C(=O)c2cc(Cc3ccccc3)ccc2[O-])C1 ZINC000436929494 944792158 /nfs/dbraw/zinc/79/21/58/944792158.db2.gz VOWISBHHSNXTCN-JOCHJYFZSA-N -1 3 353.462 3.608 20 0 FHADHM CCC[C@@]1(CO)CCN(C(=O)c2cc(Oc3ccccc3)ccc2[O-])C1 ZINC000436930957 944794788 /nfs/dbraw/zinc/79/47/88/944794788.db2.gz ZKQQPRRWDAFJKN-OAQYLSRUSA-N -1 3 355.434 3.809 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(NC[C@@H]3CCCO3)c(F)c2)c([O-])c1C ZINC000436917891 944800634 /nfs/dbraw/zinc/80/06/34/944800634.db2.gz CLDCNFIZXSTYIK-HNNXBMFYSA-N -1 3 358.413 3.991 20 0 FHADHM CC(C)CC1(C)CCN(C(=O)[C@@H]2CCCN2C(=O)c2ccccc2[O-])CC1 ZINC000436922024 944806424 /nfs/dbraw/zinc/80/64/24/944806424.db2.gz LVWDMGDUCDEUEZ-SFHVURJKSA-N -1 3 372.509 3.672 20 0 FHADHM CCCCOc1ccc(C(=O)N(C)Cc2ccccc2N(C)C)c([O-])c1 ZINC000436924507 944811948 /nfs/dbraw/zinc/81/19/48/944811948.db2.gz GAACDQFESLFDQE-UHFFFAOYSA-N -1 3 356.466 3.909 20 0 FHADHM CCOc1c(Cl)cc(CN[C@H](C(=O)[O-])c2cccs2)cc1OC ZINC000426788371 944812111 /nfs/dbraw/zinc/81/21/11/944812111.db2.gz MNJSGZOGWMBRIT-AWEZNQCLSA-N -1 3 355.843 3.724 20 0 FHADHM COCCOc1cccc(CN[C@@H](CC(=O)[O-])c2cccc(Cl)c2)c1 ZINC000426796622 944818685 /nfs/dbraw/zinc/81/86/85/944818685.db2.gz COBGIAKVDYBGKA-SFHVURJKSA-N -1 3 363.841 3.671 20 0 FHADHM CCOc1c(OC)cc(CN[C@@H](C(=O)[O-])c2ccc(CC)cc2)cc1OC ZINC000426809165 944828265 /nfs/dbraw/zinc/82/82/65/944828265.db2.gz CHOIRGNCIARMGT-LJQANCHMSA-N -1 3 373.449 3.580 20 0 FHADHM [O-]c1ccccc1-c1nc(-c2cc(C(F)(F)F)ccc2-n2cncn2)no1 ZINC000436942711 944830949 /nfs/dbraw/zinc/83/09/49/944830949.db2.gz XFOVGFQCZOGNHQ-UHFFFAOYSA-N -1 3 373.294 3.709 20 0 FHADHM CCC[C@@H](NC(=O)c1ccccc1)c1noc(-c2cc(OC)ccc2[O-])n1 ZINC000436944778 944831910 /nfs/dbraw/zinc/83/19/10/944831910.db2.gz NUQPTYPOOFHVIZ-MRXNPFEDSA-N -1 3 367.405 3.722 20 0 FHADHM COc1ccc([C@@H](CC(=O)[O-])NCc2ccc(Cl)c(C)c2)cc1OC ZINC000426814681 944835887 /nfs/dbraw/zinc/83/58/87/944835887.db2.gz IBQRRWPFNKUIIV-MRXNPFEDSA-N -1 3 363.841 3.971 20 0 FHADHM CN(C)c1cnc(-c2noc(-c3cc(Cc4ccccc4)ccc3[O-])n2)cn1 ZINC000436950669 944847535 /nfs/dbraw/zinc/84/75/35/944847535.db2.gz NWXRXICBASKQCU-UHFFFAOYSA-N -1 3 373.416 3.556 20 0 FHADHM COc1ccc([C@H](NCc2ccc3nc(C)ccc3c2)C(=O)[O-])cc1F ZINC000426824626 944849101 /nfs/dbraw/zinc/84/91/01/944849101.db2.gz NLTFXDPWJZTXDL-IBGZPJMESA-N -1 3 354.381 3.606 20 0 FHADHM CN1CC[C@@H]2CCN(C(=O)c3cc(-c4ccccc4)cc(Cl)c3[O-])[C@@H]2C1 ZINC000436968805 944851099 /nfs/dbraw/zinc/85/10/99/944851099.db2.gz VNUKCBGDZPGEGZ-DNVCBOLYSA-N -1 3 370.880 3.879 20 0 FHADHM COc1ccc([C@H](NCc2cccc(-c3ccncc3)c2)C(=O)[O-])cc1F ZINC000426827026 944851333 /nfs/dbraw/zinc/85/13/33/944851333.db2.gz VKRDWBPBILYFNB-FQEVSTJZSA-N -1 3 366.392 3.812 20 0 FHADHM [O-]c1ccc(F)c(CNc2ccnc(OCC(F)(F)C(F)F)c2)c1F ZINC000436955715 944852008 /nfs/dbraw/zinc/85/20/08/944852008.db2.gz LWOVCNDLYRSYBJ-UHFFFAOYSA-N -1 3 366.261 3.957 20 0 FHADHM CCCSC[C@H](NCc1ccc(Br)cc1Cl)C(=O)[O-] ZINC000426827603 944852418 /nfs/dbraw/zinc/85/24/18/944852418.db2.gz SQWOSXMTVZSAIU-LBPRGKRZSA-N -1 3 366.708 3.789 20 0 FHADHM CCOc1cc(CN[C@@H](C(=O)[O-])c2ccc(Cl)c(C)c2)ccc1OC ZINC000426828662 944853860 /nfs/dbraw/zinc/85/38/60/944853860.db2.gz LXQQZNONOPEOHD-GOSISDBHSA-N -1 3 363.841 3.971 20 0 FHADHM CCCCOc1ccc(C(=O)N2CCO[C@H](c3cccc(F)c3)C2)c([O-])c1 ZINC000436972623 944860893 /nfs/dbraw/zinc/86/08/93/944860893.db2.gz PPAPBQURRDMLBF-FQEVSTJZSA-N -1 3 373.424 3.924 20 0 FHADHM O=C(c1ccccc1[O-])N1CCN(c2ccc3ccc(Cl)cc3n2)CC1 ZINC000436974607 944864941 /nfs/dbraw/zinc/86/49/41/944864941.db2.gz ZVCGIZBRBXPBPP-UHFFFAOYSA-N -1 3 367.836 3.556 20 0 FHADHM C[C@@H](Cc1cccs1)[N-]S(=O)(=O)c1csc(-c2ccccc2)n1 ZINC000500424430 944872729 /nfs/dbraw/zinc/87/27/29/944872729.db2.gz VIZKKEAITFWPLM-LBPRGKRZSA-N -1 3 364.517 3.781 20 0 FHADHM COc1cccc(C(=O)Nc2cc(F)cc(NCC(F)(F)F)c2)c1[O-] ZINC000436987187 944878506 /nfs/dbraw/zinc/87/85/06/944878506.db2.gz TZEUVMMIPGODBV-UHFFFAOYSA-N -1 3 358.291 3.766 20 0 FHADHM C[C@H]1CN(C(=O)c2cc(Oc3ccccc3)ccc2[O-])C[C@@H](C2CC2)O1 ZINC000436987241 944878524 /nfs/dbraw/zinc/87/85/24/944878524.db2.gz ULIKCKBBNGMLRG-XOBRGWDASA-N -1 3 353.418 3.824 20 0 FHADHM CCCCOc1ccc(C(=O)NC[C@H](C[C@H](C)O)c2ccccc2)c([O-])c1 ZINC000436988311 944880072 /nfs/dbraw/zinc/88/00/72/944880072.db2.gz OCQNYJIJZAUKSQ-WMZOPIPTSA-N -1 3 371.477 3.856 20 0 FHADHM C[C@@H]1CN(C(=O)c2cc(CCc3ccccc3)ccc2[O-])C[C@@H](C2CC2)O1 ZINC000436988151 944880813 /nfs/dbraw/zinc/88/08/13/944880813.db2.gz VWQDRUIFLGNSHS-ZHRRBRCNSA-N -1 3 365.473 3.817 20 0 FHADHM C[C@H]1CN(C(=O)c2cc(CCc3ccccc3)ccc2[O-])C[C@@H](C2CC2)O1 ZINC000436988148 944880831 /nfs/dbraw/zinc/88/08/31/944880831.db2.gz VWQDRUIFLGNSHS-AOMKIAJQSA-N -1 3 365.473 3.817 20 0 FHADHM COc1cccc([C@H](C)CCCC(=O)N=c2cc([C@H]3CCCO3)[n-][nH]2)c1 ZINC000473850554 944887248 /nfs/dbraw/zinc/88/72/48/944887248.db2.gz OFDLHRXEGSYDKY-RDTXWAMCSA-N -1 3 357.454 3.604 20 0 FHADHM COc1cccc2c1CCCN2C(=O)c1ccc2c(c1[O-])OC(C)(C)C2 ZINC000436985330 944895277 /nfs/dbraw/zinc/89/52/77/944895277.db2.gz 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CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@@H](C)Cc2ccc(C)cc2)s1 ZINC000825694312 947293386 /nfs/dbraw/zinc/29/33/86/947293386.db2.gz NPQXNLRLTKFFLN-LBPRGKRZSA-N -1 3 355.467 3.616 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@@H](C)Cc2ccc(C)cc2)s1 ZINC000825694312 947293395 /nfs/dbraw/zinc/29/33/95/947293395.db2.gz NPQXNLRLTKFFLN-LBPRGKRZSA-N -1 3 355.467 3.616 20 0 FHADHM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2ccc(N3CCC3=O)cc2)cc1 ZINC000523520427 947347964 /nfs/dbraw/zinc/34/79/64/947347964.db2.gz QWDOCNHSUKEPOV-AWEZNQCLSA-N -1 3 358.463 3.738 20 0 FHADHM COCCOc1ccc(-c2nnn[n-]2)cc1N[C@H](C)c1cccc(Cl)c1 ZINC000826162182 947509436 /nfs/dbraw/zinc/50/94/36/947509436.db2.gz RETZDXQOTFFESV-GFCCVEGCSA-N -1 3 373.844 3.718 20 0 FHADHM COCCOc1ccc(-c2nn[n-]n2)cc1N[C@H](C)c1cccc(Cl)c1 ZINC000826162182 947509444 /nfs/dbraw/zinc/50/94/44/947509444.db2.gz RETZDXQOTFFESV-GFCCVEGCSA-N -1 3 373.844 3.718 20 0 FHADHM O=C(NCc1ccc([O-])c(F)c1)C1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000188780500 947517238 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CC(C)Cn1ccc2c1cccc2C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000445256801 947659808 /nfs/dbraw/zinc/65/98/08/947659808.db2.gz XMKYUYNXOIBQOH-UHFFFAOYSA-N -1 3 360.421 3.730 20 0 FHADHM CC(C)Cn1ccc2c1cccc2C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000445256801 947659817 /nfs/dbraw/zinc/65/98/17/947659817.db2.gz XMKYUYNXOIBQOH-UHFFFAOYSA-N -1 3 360.421 3.730 20 0 FHADHM CS/C=C/C(=O)N[C@H](C)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000826226977 947667965 /nfs/dbraw/zinc/66/79/65/947667965.db2.gz JMJGAISYMXODFK-OCHBPSSRSA-N -1 3 365.462 3.588 20 0 FHADHM CS/C=C/C(=O)N[C@H](C)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000826226977 947667973 /nfs/dbraw/zinc/66/79/73/947667973.db2.gz JMJGAISYMXODFK-OCHBPSSRSA-N -1 3 365.462 3.588 20 0 FHADHM CC(C)c1ccc(-c2nc(CC(=O)Nc3ccccc3F)no2)c([O-])c1 ZINC000445308315 947695618 /nfs/dbraw/zinc/69/56/18/947695618.db2.gz YJWQELGDESFFAI-UHFFFAOYSA-N -1 3 355.369 3.886 20 0 FHADHM C/C(=C\C1CCC(C)CC1)C(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1 ZINC001573363117 947709344 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365.412 3.538 20 0 FHADHM CCSc1ccc([C@H](C)N/C=C2\C(=O)[N-]C(=O)c3ccccc32)cc1 ZINC000728853994 947778630 /nfs/dbraw/zinc/77/86/30/947778630.db2.gz FFJZQGIBWOKDBD-CYUIRQCWSA-N -1 3 352.459 3.760 20 0 FHADHM C[C@@H](C(=O)N1CCCc2c(-c3nnn[n-]3)cccc21)c1cc2ccccc2o1 ZINC001573638023 947829996 /nfs/dbraw/zinc/82/99/96/947829996.db2.gz AUEGRHCJNPGNFR-CYBMUJFWSA-N -1 3 373.416 3.696 20 0 FHADHM C[C@@H](C(=O)N1CCCc2c(-c3nn[n-]n3)cccc21)c1cc2ccccc2o1 ZINC001573638023 947830006 /nfs/dbraw/zinc/83/00/06/947830006.db2.gz AUEGRHCJNPGNFR-CYBMUJFWSA-N -1 3 373.416 3.696 20 0 FHADHM Cc1ccnc(N2Cc3ccccc3-c3ccccc3C2)c1-c1nnn[n-]1 ZINC000826311938 947904264 /nfs/dbraw/zinc/90/42/64/947904264.db2.gz QYTGBGNXLHGBRW-UHFFFAOYSA-N -1 3 354.417 3.757 20 0 FHADHM Cc1ccnc(N2Cc3ccccc3-c3ccccc3C2)c1-c1nn[n-]n1 ZINC000826311938 947904270 /nfs/dbraw/zinc/90/42/70/947904270.db2.gz QYTGBGNXLHGBRW-UHFFFAOYSA-N -1 3 354.417 3.757 20 0 FHADHM O=S(=O)([N-]c1cc(F)cc(F)c1Br)c1cccc(F)c1 ZINC000190073670 947917553 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Cn1c(CCSc2cccc(Cl)c2-c2nn[n-]n2)nc2ccccc21 ZINC000826354948 948106687 /nfs/dbraw/zinc/10/66/87/948106687.db2.gz CUCWCWREUIRUAO-UHFFFAOYSA-N -1 3 370.869 3.742 20 0 FHADHM Cn1cc(CNc2ccc(Cl)cc2-c2nnn[n-]2)c(-c2ccccc2)n1 ZINC000826361992 948133866 /nfs/dbraw/zinc/13/38/66/948133866.db2.gz YURFATROYLLHBG-UHFFFAOYSA-N -1 3 365.828 3.533 20 0 FHADHM Cn1cc(CNc2ccc(Cl)cc2-c2nn[n-]n2)c(-c2ccccc2)n1 ZINC000826361992 948133875 /nfs/dbraw/zinc/13/38/75/948133875.db2.gz YURFATROYLLHBG-UHFFFAOYSA-N -1 3 365.828 3.533 20 0 FHADHM FC(F)(F)COCCSc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000826367961 948148431 /nfs/dbraw/zinc/14/84/31/948148431.db2.gz WAEUWZQCOAKICY-UHFFFAOYSA-N -1 3 372.294 3.557 20 0 FHADHM FC(F)(F)COCCSc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000826367961 948148435 /nfs/dbraw/zinc/14/84/35/948148435.db2.gz WAEUWZQCOAKICY-UHFFFAOYSA-N -1 3 372.294 3.557 20 0 FHADHM CC(C)c1cnc(CNC[C@H](Cc2cccc(Cl)c2)C(=O)[O-])s1 ZINC000417544348 948165618 /nfs/dbraw/zinc/16/56/18/948165618.db2.gz HFHGCSLYJYHTTR-ZDUSSCGKSA-N -1 3 352.887 3.953 20 0 FHADHM CC(C)c1ccc([C@H](CC(=O)[O-])NCc2ccc([S@](C)=O)cc2)cc1 ZINC000417564524 948249293 /nfs/dbraw/zinc/24/92/93/948249293.db2.gz FRGWRFRLPDSSSL-DFBJGRDBSA-N -1 3 359.491 3.853 20 0 FHADHM COc1cc2c(c(CN[C@H](CCC(=O)[O-])c3ccccc3)c1)O[C@@H](C)C2 ZINC000417605998 948331199 /nfs/dbraw/zinc/33/11/99/948331199.db2.gz ZZZNKMZIHVMERT-IFXJQAMLSA-N -1 3 355.434 3.714 20 0 FHADHM O=C([O-])[C@H]1C[C@@H](NCc2cc(Cl)c3c(c2)OCCCO3)c2ccccc21 ZINC000417627733 948361251 /nfs/dbraw/zinc/36/12/51/948361251.db2.gz VGTMAEQKSNDSOM-DOTOQJQBSA-N -1 3 373.836 3.904 20 0 FHADHM Cc1cc(C)n(-c2ccc(CNCc3c([O-])ccc(Cl)c3F)cn2)n1 ZINC000190786470 948418474 /nfs/dbraw/zinc/41/84/74/948418474.db2.gz LMNVUKQACAAISA-UHFFFAOYSA-N -1 3 360.820 3.672 20 0 FHADHM COc1ccccc1-c1cccc(NC(=O)c2cnc3c(cnn3C)c2[O-])c1 ZINC000512105235 948431944 /nfs/dbraw/zinc/43/19/44/948431944.db2.gz OLXIYJSXUWMHTH-UHFFFAOYSA-N -1 3 374.400 3.602 20 0 FHADHM O=C(N=c1cc(-c2ccccc2)[n-][nH]1)c1cnn(-c2ccc(Cl)cc2)c1 ZINC000520631882 948464176 /nfs/dbraw/zinc/46/41/76/948464176.db2.gz JDNLFHCLXGWYEC-UHFFFAOYSA-N -1 3 363.808 3.590 20 0 FHADHM COc1ccccc1C(=O)N[N-]C(=O)c1sccc1-c1ccc(F)cc1 ZINC000067433670 948467060 /nfs/dbraw/zinc/46/70/60/948467060.db2.gz OKAHFXDMOUCCBF-UHFFFAOYSA-N -1 3 370.405 3.638 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)c1cc2cccc(Cl)c2s1 ZINC001539570590 948547884 /nfs/dbraw/zinc/54/78/84/948547884.db2.gz ZVUHMRHRGRYLHM-UHFFFAOYSA-N -1 3 355.810 3.987 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)c1cc2cccc(Cl)c2s1 ZINC001539570590 948547892 /nfs/dbraw/zinc/54/78/92/948547892.db2.gz ZVUHMRHRGRYLHM-UHFFFAOYSA-N -1 3 355.810 3.987 20 0 FHADHM C[C@H](C(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1)C1CCC1 ZINC001573729137 948565349 /nfs/dbraw/zinc/56/53/49/948565349.db2.gz HHVQTEUQJIXXGZ-LBPRGKRZSA-N -1 3 367.478 3.648 20 0 FHADHM C[C@@H](c1ccc(OC(F)(F)F)cc1)N1CC[C@](C(=O)[O-])(C(F)(F)F)C1 ZINC000327135834 948572322 /nfs/dbraw/zinc/57/23/22/948572322.db2.gz UHMFINCIFRPDAH-ZANVPECISA-N -1 3 371.277 3.985 20 0 FHADHM CCOC(=O)c1nc([C@H](CC(C)C)NCc2ccc([C@@H]3C[C@@H]3C)o2)n[n-]1 ZINC000895105993 948610069 /nfs/dbraw/zinc/61/00/69/948610069.db2.gz WGYXMUFWPCWIIK-CFVMTHIKSA-N -1 3 360.458 3.575 20 0 FHADHM CCOC(=O)c1nnc([C@H](CC(C)C)NCc2ccc([C@@H]3C[C@@H]3C)o2)[n-]1 ZINC000895105993 948610073 /nfs/dbraw/zinc/61/00/73/948610073.db2.gz WGYXMUFWPCWIIK-CFVMTHIKSA-N -1 3 360.458 3.575 20 0 FHADHM CCOC(=O)c1n[n-]c([C@H](CC(C)C)NCc2ccc([C@@H]3C[C@@H]3C)o2)n1 ZINC000895105993 948610077 /nfs/dbraw/zinc/61/00/77/948610077.db2.gz WGYXMUFWPCWIIK-CFVMTHIKSA-N -1 3 360.458 3.575 20 0 FHADHM CCSc1cccc(F)c1[N-]C(=O)c1cncc(N2CCCC2=O)c1 ZINC000637284044 948720218 /nfs/dbraw/zinc/72/02/18/948720218.db2.gz AUJCTKDYEPQEJR-UHFFFAOYSA-N -1 3 359.426 3.712 20 0 FHADHM CC(C)c1cccc(COC(=O)CCc2ccc(-c3nnn[n-]3)cc2)c1 ZINC001574419606 948786592 /nfs/dbraw/zinc/78/65/92/948786592.db2.gz GSHFDZAYVROFBV-UHFFFAOYSA-N -1 3 350.422 3.666 20 0 FHADHM CC(C)c1cccc(COC(=O)CCc2ccc(-c3nn[n-]n3)cc2)c1 ZINC001574419606 948786598 /nfs/dbraw/zinc/78/65/98/948786598.db2.gz GSHFDZAYVROFBV-UHFFFAOYSA-N -1 3 350.422 3.666 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)NC2CCC(c3ccccc3)CC2)c1 ZINC000524024109 948794910 /nfs/dbraw/zinc/79/49/10/948794910.db2.gz SSRGGEUJJORCDF-UHFFFAOYSA-N -1 3 352.434 3.807 20 0 FHADHM Cc1cc(C)cc(-c2nnc(NC(=O)c3cc4c(cc3[O-])OCO4)s2)c1 ZINC000436746520 948805542 /nfs/dbraw/zinc/80/55/42/948805542.db2.gz YKAROTCVMMRTAQ-UHFFFAOYSA-N -1 3 369.402 3.509 20 0 FHADHM C[C@H](CC(F)(F)F)NC(=O)N=c1cc2ccc(Br)cn2[n-]1 ZINC000482248902 515624546 /nfs/dbraw/zinc/62/45/46/515624546.db2.gz ZZKVAPFIYNFDRJ-SSDOTTSWSA-N -1 3 365.153 3.559 20 0 FHADHM CCN=c1[n-]c(C(=O)N2CC[C@@](F)(c3cc(F)cc(F)c3)C2)cs1 ZINC000511845833 516051544 /nfs/dbraw/zinc/05/15/44/516051544.db2.gz BSYCMNVYVAZSBE-INIZCTEOSA-N -1 3 355.385 3.564 20 0 FHADHM O=C(N=c1ccn(-c2ccccc2Cl)[n-]1)NCc1cn2ccsc2n1 ZINC000495249115 516118807 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FHADHM O=C(Cc1nc(-c2ccccc2)cs1)N=c1cc([C@@H]2CCCO2)[n-][nH]1 ZINC000616824721 520165167 /nfs/dbraw/zinc/16/51/67/520165167.db2.gz MSMCOWCFEJQZCY-HNNXBMFYSA-N -1 3 354.435 3.566 20 0 FHADHM Cc1[n-][nH]c(=NC(=O)c2cn3c(n2)C[C@@H](C)CC3)c1-c1ccccc1F ZINC000634422740 523394357 /nfs/dbraw/zinc/39/43/57/523394357.db2.gz NOWNZNSVNZBWQU-NSHDSACASA-N -1 3 353.401 3.555 20 0 FHADHM Cn1c(=O)[nH]c2cc(C(=O)N=c3cc(-c4cccc(Cl)c4)[n-][nH]3)ccc21 ZINC000622891260 523532123 /nfs/dbraw/zinc/53/21/23/523532123.db2.gz PHCBVXTVRACINA-UHFFFAOYSA-N -1 3 367.796 3.575 20 0 FHADHM CN(CC(=O)N=c1cc(-c2cccc(Cl)c2)[n-][nH]1)C(=O)c1cccs1 ZINC000622891391 523532207 /nfs/dbraw/zinc/53/22/07/523532207.db2.gz WYDPYNNYVBUMKV-UHFFFAOYSA-N -1 3 374.853 3.502 20 0 FHADHM COc1ccc(COCC(=O)N=c2cc(-c3ccccc3C)[n-][nH]2)cc1 ZINC000622899002 523543352 /nfs/dbraw/zinc/54/33/52/523543352.db2.gz MPPCRSDEXBIQPJ-UHFFFAOYSA-N -1 3 351.406 3.549 20 0 FHADHM CNC(=O)c1ccc(NC(=O)c2ccc3c(c2[O-])CCCC3)cc1Cl ZINC000185405803 567840683 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Cc1cc(C)n(-c2cccc(NC(=O)c3n[n-]nc3-c3ccccc3)c2)n1 ZINC000188617898 567998731 /nfs/dbraw/zinc/99/87/31/567998731.db2.gz HTGZWRNKRAKEJA-UHFFFAOYSA-N -1 3 358.405 3.527 20 0 FHADHM COc1cc(C)c(S(=O)(=O)[N-]c2ccc(OCC3CC3)cc2)c(C)c1 ZINC000603169691 568070788 /nfs/dbraw/zinc/07/07/88/568070788.db2.gz QOPSLUGCNYHDJB-UHFFFAOYSA-N -1 3 361.463 3.902 20 0 FHADHM O=C([O-])c1ccccc1CCNCc1ccc(Br)cc1F ZINC000228492947 568086745 /nfs/dbraw/zinc/08/67/45/568086745.db2.gz YXDZZBRGJADCIM-UHFFFAOYSA-N -1 3 352.203 3.619 20 0 FHADHM CSCc1c2ccccc2oc1C(=O)Nc1nc(C(F)(F)F)n[n-]1 ZINC000603457204 568104492 /nfs/dbraw/zinc/10/44/92/568104492.db2.gz VLLHYUMHFVPXJL-UHFFFAOYSA-N -1 3 356.329 3.685 20 0 FHADHM CSCc1c2ccccc2oc1C(=O)Nc1nnc(C(F)(F)F)[n-]1 ZINC000603457204 568104493 /nfs/dbraw/zinc/10/44/93/568104493.db2.gz VLLHYUMHFVPXJL-UHFFFAOYSA-N -1 3 356.329 3.685 20 0 FHADHM Cc1noc(C)c1[C@H](C)NC(=O)Nc1ccc(-c2cc(=O)[n-]c(C)n2)cc1 ZINC000603724281 568142564 /nfs/dbraw/zinc/14/25/64/568142564.db2.gz JHNLVIBJVIALSQ-JTQLQIEISA-N -1 3 367.409 3.645 20 0 FHADHM Cc1noc(C)c1[C@H](C)[N-]S(=O)(=O)c1c(Cl)ccc(C)c1Cl ZINC000603718953 568147250 /nfs/dbraw/zinc/14/72/50/568147250.db2.gz WUAZMDZCVWXRTJ-VIFPVBQESA-N -1 3 363.266 3.946 20 0 FHADHM CCOC(=O)c1ncc(NC(=O)c2sc(-c3ccccc3)cc2OC)[n-]1 ZINC000617877178 568193383 /nfs/dbraw/zinc/19/33/83/568193383.db2.gz GCWLGCUQAXOSKP-UHFFFAOYSA-N -1 3 371.418 3.576 20 0 FHADHM CCOC(=O)c1nc(NC(=O)c2sc(-c3ccccc3)cc2OC)c[n-]1 ZINC000617877178 568193384 /nfs/dbraw/zinc/19/33/84/568193384.db2.gz GCWLGCUQAXOSKP-UHFFFAOYSA-N -1 3 371.418 3.576 20 0 FHADHM COC(=O)c1cc2cc([N-]S(=O)(=O)c3c(C)cc(C)cc3C)ccc2o1 ZINC000603978653 568193542 /nfs/dbraw/zinc/19/35/42/568193542.db2.gz ABWDBSRSIHHWEC-UHFFFAOYSA-N -1 3 373.430 3.945 20 0 FHADHM COc1ccc([O-])c(C(=O)Nc2nnc(-c3cc(C)cc(C)c3)s2)c1 ZINC000604264377 568237170 /nfs/dbraw/zinc/23/71/70/568237170.db2.gz DNPDDKLKFYTCOM-UHFFFAOYSA-N -1 3 355.419 3.788 20 0 FHADHM CCCS(=O)(=O)[N-]c1cc(NC(=O)[C@H](C)C(C)(C)C)c(F)cc1F ZINC000604323487 568249442 /nfs/dbraw/zinc/24/94/42/568249442.db2.gz STVMRTPBOFNGJJ-JTQLQIEISA-N -1 3 362.442 3.737 20 0 FHADHM Cc1ccccc1-c1cc(=NC(=O)CSCc2ccc(F)cc2)[nH][n-]1 ZINC000604523512 568305320 /nfs/dbraw/zinc/30/53/20/568305320.db2.gz QEWMZPFROXRWRS-UHFFFAOYSA-N -1 3 355.438 3.818 20 0 FHADHM COc1ccc2c(c1)[n-]cc(C(=O)N1C[C@H](c3ccccc3)C[C@@H]1C)c2=O ZINC000604605394 568325415 /nfs/dbraw/zinc/32/54/15/568325415.db2.gz LYPAZTVTPONREH-GOEBONIOSA-N -1 3 362.429 3.555 20 0 FHADHM COc1ccc2c(c1)[n-]cc(C(=O)N1C[C@@H](c3ccccc3)C[C@@H]1C)c2=O ZINC000604605395 568325421 /nfs/dbraw/zinc/32/54/21/568325421.db2.gz LYPAZTVTPONREH-HOCLYGCPSA-N -1 3 362.429 3.555 20 0 FHADHM O=C([N-]c1ccnc(OCC(F)(F)C(F)F)c1)c1ocnc1C(F)F ZINC000637084138 568350602 /nfs/dbraw/zinc/35/06/02/568350602.db2.gz SKEOWIKSMBQWCJ-UHFFFAOYSA-N -1 3 369.221 3.539 20 0 FHADHM C[C@H](c1ccccc1)N1CCC(NC(=O)c2c([O-])cc(F)cc2F)CC1 ZINC000604790421 568367406 /nfs/dbraw/zinc/36/74/06/568367406.db2.gz QLJBARYIIUEMMV-CYBMUJFWSA-N -1 3 360.404 3.626 20 0 FHADHM O=C(N=c1cc(-c2cccc(Cl)c2)[n-][nH]1)c1cccc(-n2cccn2)c1 ZINC000604901141 568384728 /nfs/dbraw/zinc/38/47/28/568384728.db2.gz HGOIWEJDHIBXEC-UHFFFAOYSA-N -1 3 363.808 3.590 20 0 FHADHM CCCCOc1ccc(C(=O)N2CCn3c(C(C)C)nnc3[C@H]2C)c([O-])c1 ZINC000365289368 568426430 /nfs/dbraw/zinc/42/64/30/568426430.db2.gz AWJULARHFXUXDR-CQSZACIVSA-N -1 3 372.469 3.503 20 0 FHADHM CC[C@H](CS(=O)(=O)[N-]c1ccc(C(F)(F)C(F)(F)F)cc1)OC ZINC000643269330 568449866 /nfs/dbraw/zinc/44/98/66/568449866.db2.gz SNVJRTOFKBPDJA-LLVKDONJSA-N -1 3 361.332 3.507 20 0 FHADHM CC(C)Cc1csc2[n-]c(CN(C)C(=O)c3ccccc3)nc(=O)c12 ZINC000605025862 568530694 /nfs/dbraw/zinc/53/06/94/568530694.db2.gz CYKRUYWFGGPAQB-UHFFFAOYSA-N -1 3 355.463 3.868 20 0 FHADHM COc1c(C)cc(S(=O)(=O)[N-]c2ccc(-c3cncnc3)cc2)cc1C ZINC000605118923 568573586 /nfs/dbraw/zinc/57/35/86/568573586.db2.gz PYCBPVADXRELBS-UHFFFAOYSA-N -1 3 369.446 3.570 20 0 FHADHM Cc1ccc(Oc2ccc(NC(=O)c3ccc(-c4nnn[n-]4)cc3)cc2)nc1 ZINC000737366128 598823225 /nfs/dbraw/zinc/82/32/25/598823225.db2.gz PHRMGFYNRPIVMX-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccc(Oc2ccc(NC(=O)c3ccc(-c4nn[n-]n4)cc3)cc2)nc1 ZINC000737366128 598823226 /nfs/dbraw/zinc/82/32/26/598823226.db2.gz PHRMGFYNRPIVMX-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM CCCCSCCC(=O)N(CC)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736462205 598830664 /nfs/dbraw/zinc/83/06/64/598830664.db2.gz CCSFHDMOAVUZBI-CQSZACIVSA-N -1 3 361.515 3.700 20 0 FHADHM CCCCSCCC(=O)N(CC)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736462205 598830666 /nfs/dbraw/zinc/83/06/66/598830666.db2.gz CCSFHDMOAVUZBI-CQSZACIVSA-N -1 3 361.515 3.700 20 0 FHADHM CCC(CC)C(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000736338062 598833415 /nfs/dbraw/zinc/83/34/15/598833415.db2.gz OWHLILKWXIOPSH-UHFFFAOYSA-N -1 3 355.467 3.648 20 0 FHADHM C/C(=C/C(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1)C1CC1 ZINC000735447476 598833757 /nfs/dbraw/zinc/83/37/57/598833757.db2.gz FFCSRAVUCRDCET-XFXZXTDPSA-N -1 3 365.462 3.568 20 0 FHADHM CC(C)Oc1ccccc1NC(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000735913902 598848906 /nfs/dbraw/zinc/84/89/06/598848906.db2.gz NHGUHODYPQHCLP-UHFFFAOYSA-N -1 3 372.816 3.951 20 0 FHADHM CC(C)Oc1ccccc1NC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000735913902 598848907 /nfs/dbraw/zinc/84/89/07/598848907.db2.gz NHGUHODYPQHCLP-UHFFFAOYSA-N -1 3 372.816 3.951 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@H]1CC[C@@H](C)C[C@@H]1C ZINC000736242961 598853814 /nfs/dbraw/zinc/85/38/14/598853814.db2.gz SRLUTOGLKQQDHI-VKJFTORMSA-N -1 3 370.501 3.611 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@H]1CC[C@@H](C)C[C@@H]1C ZINC000736242961 598853815 /nfs/dbraw/zinc/85/38/15/598853815.db2.gz SRLUTOGLKQQDHI-VKJFTORMSA-N -1 3 370.501 3.611 20 0 FHADHM CCSc1cccc(NC(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)c1 ZINC000736665031 598879707 /nfs/dbraw/zinc/87/97/07/598879707.db2.gz DFHLQWKXYHKZCF-UHFFFAOYSA-N -1 3 358.402 3.762 20 0 FHADHM CCSc1cccc(NC(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)c1 ZINC000736665031 598879708 /nfs/dbraw/zinc/87/97/08/598879708.db2.gz DFHLQWKXYHKZCF-UHFFFAOYSA-N -1 3 358.402 3.762 20 0 FHADHM C[C@@H](Oc1ccccc1-c1nnn[n-]1)C(=O)OCc1ccc2ccccc2c1 ZINC000736186411 598895401 /nfs/dbraw/zinc/89/54/01/598895401.db2.gz BFAFSIDTOWKGBM-CQSZACIVSA-N -1 3 374.400 3.531 20 0 FHADHM C[C@@H](Oc1ccccc1-c1nn[n-]n1)C(=O)OCc1ccc2ccccc2c1 ZINC000736186411 598895402 /nfs/dbraw/zinc/89/54/02/598895402.db2.gz BFAFSIDTOWKGBM-CQSZACIVSA-N -1 3 374.400 3.531 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@@H](CC)CC1CCCC1 ZINC000736636783 598904429 /nfs/dbraw/zinc/90/44/29/598904429.db2.gz SERWSXVCKRRBRI-AWEZNQCLSA-N -1 3 357.458 3.810 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@@H](CC)CC1CCCC1 ZINC000736636783 598904431 /nfs/dbraw/zinc/90/44/31/598904431.db2.gz SERWSXVCKRRBRI-AWEZNQCLSA-N -1 3 357.458 3.810 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)NC1C[C@H](C)C[C@@H](C)C1 ZINC000736222522 598908135 /nfs/dbraw/zinc/90/81/35/598908135.db2.gz CSIWKZCJHCZFOQ-HUUCEWRRSA-N -1 3 370.501 3.611 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)NC1C[C@H](C)C[C@@H](C)C1 ZINC000736222522 598908136 /nfs/dbraw/zinc/90/81/36/598908136.db2.gz CSIWKZCJHCZFOQ-HUUCEWRRSA-N -1 3 370.501 3.611 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@H]2C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)cc1 ZINC000735924115 598912318 /nfs/dbraw/zinc/91/23/18/598912318.db2.gz QJOIXURNZJRYKK-HZPDHXFCSA-N -1 3 365.412 3.871 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@H]2C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)cc1 ZINC000735924115 598912319 /nfs/dbraw/zinc/91/23/19/598912319.db2.gz QJOIXURNZJRYKK-HZPDHXFCSA-N -1 3 365.412 3.871 20 0 FHADHM CC[C@@H](NC(=O)Nc1ccc(-c2nnn[n-]2)cc1)c1ccc(Cl)s1 ZINC000736363558 598919960 /nfs/dbraw/zinc/91/99/60/598919960.db2.gz NTKFGGGMSSVGJT-LLVKDONJSA-N -1 3 362.846 3.854 20 0 FHADHM CC[C@@H](NC(=O)Nc1ccc(-c2nn[n-]n2)cc1)c1ccc(Cl)s1 ZINC000736363558 598919961 /nfs/dbraw/zinc/91/99/61/598919961.db2.gz NTKFGGGMSSVGJT-LLVKDONJSA-N -1 3 362.846 3.854 20 0 FHADHM Cc1ccc([C@H]2CCC[C@H]2OC(=O)Cc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000737328161 598925384 /nfs/dbraw/zinc/92/53/84/598925384.db2.gz DIWKWEMMHNELPF-RTBURBONSA-N -1 3 362.433 3.597 20 0 FHADHM Cc1ccc([C@H]2CCC[C@H]2OC(=O)Cc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000737328161 598925387 /nfs/dbraw/zinc/92/53/87/598925387.db2.gz DIWKWEMMHNELPF-RTBURBONSA-N -1 3 362.433 3.597 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1OC(=O)[C@H](CC(C)C)c1ccccc1 ZINC000737027168 598939385 /nfs/dbraw/zinc/93/93/85/598939385.db2.gz ZJVUEXFAJNKFHA-MRXNPFEDSA-N -1 3 366.421 3.611 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1OC(=O)[C@H](CC(C)C)c1ccccc1 ZINC000737027168 598939387 /nfs/dbraw/zinc/93/93/87/598939387.db2.gz ZJVUEXFAJNKFHA-MRXNPFEDSA-N -1 3 366.421 3.611 20 0 FHADHM Cc1cc(Oc2ccc(-c3nnn[n-]3)cc2)ccc1NC(=O)C1CC=CC1 ZINC000737281425 598941287 /nfs/dbraw/zinc/94/12/87/598941287.db2.gz YJQMUDCFKWZBIQ-UHFFFAOYSA-N -1 3 361.405 3.872 20 0 FHADHM Cc1cc(Oc2ccc(-c3nn[n-]n3)cc2)ccc1NC(=O)C1CC=CC1 ZINC000737281425 598941288 /nfs/dbraw/zinc/94/12/88/598941288.db2.gz YJQMUDCFKWZBIQ-UHFFFAOYSA-N -1 3 361.405 3.872 20 0 FHADHM Cc1ccc(Nc2ncc(-c3nnn[n-]3)cc2Cl)cc1OCC(F)F ZINC000737361577 598942083 /nfs/dbraw/zinc/94/20/83/598942083.db2.gz KILHJIGPSDYOKP-UHFFFAOYSA-N -1 3 366.759 3.611 20 0 FHADHM Cc1ccc(Nc2ncc(-c3nn[n-]n3)cc2Cl)cc1OCC(F)F ZINC000737361577 598942084 /nfs/dbraw/zinc/94/20/84/598942084.db2.gz KILHJIGPSDYOKP-UHFFFAOYSA-N -1 3 366.759 3.611 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1Sc1nnc(-c2ccccc2)s1 ZINC000737565724 598942953 /nfs/dbraw/zinc/94/29/53/598942953.db2.gz PQROEEZIZMNFQB-UHFFFAOYSA-N -1 3 373.854 3.585 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1Sc1nnc(-c2ccccc2)s1 ZINC000737565724 598942954 /nfs/dbraw/zinc/94/29/54/598942954.db2.gz PQROEEZIZMNFQB-UHFFFAOYSA-N -1 3 373.854 3.585 20 0 FHADHM Cc1ccc(CN(C(=O)C=Cc2ccccc2-c2nnn[n-]2)C2CC2)cc1C ZINC000737336352 598943171 /nfs/dbraw/zinc/94/31/71/598943171.db2.gz AFKCIQZBIQTDFG-XFXZXTDPSA-N -1 3 373.460 3.688 20 0 FHADHM Cc1ccc(CN(C(=O)C=Cc2ccccc2-c2nn[n-]n2)C2CC2)cc1C ZINC000737336352 598943173 /nfs/dbraw/zinc/94/31/73/598943173.db2.gz AFKCIQZBIQTDFG-XFXZXTDPSA-N -1 3 373.460 3.688 20 0 FHADHM CCc1ccccc1CNc1c(-c2nnn[n-]2)cnc2c(F)cc(F)cc21 ZINC000736701587 598972583 /nfs/dbraw/zinc/97/25/83/598972583.db2.gz FHYWESMKXQVWNN-UHFFFAOYSA-N -1 3 366.375 3.868 20 0 FHADHM CCc1ccccc1CNc1c(-c2nn[n-]n2)cnc2c(F)cc(F)cc21 ZINC000736701587 598972585 /nfs/dbraw/zinc/97/25/85/598972585.db2.gz FHYWESMKXQVWNN-UHFFFAOYSA-N -1 3 366.375 3.868 20 0 FHADHM CC(C)[C@@H](CC1CCCCC1)C(=O)NCc1ccc(-c2nnn[n-]2)cc1F ZINC000735709851 599003772 /nfs/dbraw/zinc/00/37/72/599003772.db2.gz SOGVHDMVFFQNNE-QGZVFWFLSA-N -1 3 373.476 3.865 20 0 FHADHM CC(C)[C@@H](CC1CCCCC1)C(=O)NCc1ccc(-c2nn[n-]n2)cc1F ZINC000735709851 599003774 /nfs/dbraw/zinc/00/37/74/599003774.db2.gz SOGVHDMVFFQNNE-QGZVFWFLSA-N -1 3 373.476 3.865 20 0 FHADHM CC(C)[C@H](CC1CCCCC1)C(=O)NCc1ccc(-c2nnn[n-]2)cc1F ZINC000735709848 599003969 /nfs/dbraw/zinc/00/39/69/599003969.db2.gz SOGVHDMVFFQNNE-KRWDZBQOSA-N -1 3 373.476 3.865 20 0 FHADHM CC(C)[C@H](CC1CCCCC1)C(=O)NCc1ccc(-c2nn[n-]n2)cc1F ZINC000735709848 599003971 /nfs/dbraw/zinc/00/39/71/599003971.db2.gz SOGVHDMVFFQNNE-KRWDZBQOSA-N -1 3 373.476 3.865 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)C[C@@H]2CCc3ccccc32)s1 ZINC000736679476 599015695 /nfs/dbraw/zinc/01/56/95/599015695.db2.gz UQLVHCWGBYVKNV-LBPRGKRZSA-N -1 3 353.451 3.549 20 0 FHADHM C[C@H](C(=O)Nc1ncc(Cc2ccc(-c3nnn[n-]3)cc2)s1)C(C)(C)C ZINC000735568734 599014741 /nfs/dbraw/zinc/01/47/41/599014741.db2.gz AOTAKRMCMYDYBX-LLVKDONJSA-N -1 3 370.482 3.535 20 0 FHADHM C[C@H](C(=O)Nc1ncc(Cc2ccc(-c3nn[n-]n3)cc2)s1)C(C)(C)C ZINC000735568734 599014742 /nfs/dbraw/zinc/01/47/42/599014742.db2.gz AOTAKRMCMYDYBX-LLVKDONJSA-N -1 3 370.482 3.535 20 0 FHADHM CC[C@@H](NC(=S)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1cccs1 ZINC000736368348 599014137 /nfs/dbraw/zinc/01/41/37/599014137.db2.gz CJWOMNIVCXVXFP-SMDDNHRTSA-N -1 3 372.523 3.605 20 0 FHADHM CC[C@@H](NC(=S)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1cccs1 ZINC000736368348 599014139 /nfs/dbraw/zinc/01/41/39/599014139.db2.gz CJWOMNIVCXVXFP-SMDDNHRTSA-N -1 3 372.523 3.605 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)C[C@@H]2CCc3ccccc32)s1 ZINC000736679476 599015693 /nfs/dbraw/zinc/01/56/93/599015693.db2.gz UQLVHCWGBYVKNV-LBPRGKRZSA-N -1 3 353.451 3.549 20 0 FHADHM Cc1c(NCc2ccc(SC(=O)N(C)C)cc2)cccc1-c1nnn[n-]1 ZINC000822122812 607257633 /nfs/dbraw/zinc/25/76/33/607257633.db2.gz QVDBJRQICONFDF-UHFFFAOYSA-N -1 3 368.466 3.561 20 0 FHADHM Cc1c(NCc2ccc(SC(=O)N(C)C)cc2)cccc1-c1nn[n-]n1 ZINC000822122812 607257634 /nfs/dbraw/zinc/25/76/34/607257634.db2.gz QVDBJRQICONFDF-UHFFFAOYSA-N -1 3 368.466 3.561 20 0 FHADHM CCN(Cc1ccc(C)cc1)c1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000736556546 599049237 /nfs/dbraw/zinc/04/92/37/599049237.db2.gz XVEMDSMPNIPMLT-UHFFFAOYSA-N -1 3 362.359 3.615 20 0 FHADHM CCN(Cc1ccc(C)cc1)c1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000736556546 599049240 /nfs/dbraw/zinc/04/92/40/599049240.db2.gz XVEMDSMPNIPMLT-UHFFFAOYSA-N -1 3 362.359 3.615 20 0 FHADHM Fc1cccc(Cl)c1CNc1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000737661650 599049519 /nfs/dbraw/zinc/04/95/19/599049519.db2.gz ONBFRHGNQJEWFQ-UHFFFAOYSA-N -1 3 372.713 3.685 20 0 FHADHM Fc1cccc(Cl)c1CNc1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000737661650 599049521 /nfs/dbraw/zinc/04/95/21/599049521.db2.gz ONBFRHGNQJEWFQ-UHFFFAOYSA-N -1 3 372.713 3.685 20 0 FHADHM Cc1sc2ncnc(Sc3ccc(-c4nnn[n-]4)cc3F)c2c1C ZINC000822562519 599058037 /nfs/dbraw/zinc/05/80/37/599058037.db2.gz AFOYBFHSKHYUPK-UHFFFAOYSA-N -1 3 358.427 3.779 20 0 FHADHM Cc1sc2ncnc(Sc3ccc(-c4nn[n-]n4)cc3F)c2c1C ZINC000822562519 599058040 /nfs/dbraw/zinc/05/80/40/599058040.db2.gz AFOYBFHSKHYUPK-UHFFFAOYSA-N -1 3 358.427 3.779 20 0 FHADHM COc1cc(-c2nnn[n-]2)cc(Cl)c1OCc1ccc2c(c1)CCC2 ZINC000737025872 599065430 /nfs/dbraw/zinc/06/54/30/599065430.db2.gz OOQYHHRLDGJOMO-UHFFFAOYSA-N -1 3 356.813 3.596 20 0 FHADHM COc1cc(-c2nn[n-]n2)cc(Cl)c1OCc1ccc2c(c1)CCC2 ZINC000737025872 599065432 /nfs/dbraw/zinc/06/54/32/599065432.db2.gz OOQYHHRLDGJOMO-UHFFFAOYSA-N -1 3 356.813 3.596 20 0 FHADHM COc1ccc(Cl)cc1CSc1ccc(-c2nnn[n-]2)cc1F ZINC000737100061 599065730 /nfs/dbraw/zinc/06/57/30/599065730.db2.gz RFCKOJNLJFKMQN-UHFFFAOYSA-N -1 3 350.806 3.960 20 0 FHADHM COc1ccc(Cl)cc1CSc1ccc(-c2nn[n-]n2)cc1F ZINC000737100061 599065733 /nfs/dbraw/zinc/06/57/33/599065733.db2.gz RFCKOJNLJFKMQN-UHFFFAOYSA-N -1 3 350.806 3.960 20 0 FHADHM CCc1ccc(NC(=O)[C@H](C)Sc2ccc(-c3nnn[n-]3)cc2F)cc1 ZINC000736690268 599066019 /nfs/dbraw/zinc/06/60/19/599066019.db2.gz IHOQTSKEOWTHFO-NSHDSACASA-N -1 3 371.441 3.688 20 0 FHADHM CCc1ccc(NC(=O)[C@H](C)Sc2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000736690268 599066020 /nfs/dbraw/zinc/06/60/20/599066020.db2.gz IHOQTSKEOWTHFO-NSHDSACASA-N -1 3 371.441 3.688 20 0 FHADHM O=C(Nc1cc(-c2nnn[n-]2)ccc1OC(F)F)C1CCCCCCC1 ZINC000738146207 599076222 /nfs/dbraw/zinc/07/62/22/599076222.db2.gz QXWAPDONQWZYRG-UHFFFAOYSA-N -1 3 365.384 3.767 20 0 FHADHM O=C(Nc1cc(-c2nn[n-]n2)ccc1OC(F)F)C1CCCCCCC1 ZINC000738146207 599076224 /nfs/dbraw/zinc/07/62/24/599076224.db2.gz QXWAPDONQWZYRG-UHFFFAOYSA-N -1 3 365.384 3.767 20 0 FHADHM CO[C@@H](CNc1ccc(-c2nnn[n-]2)c(Cl)c1)c1cccc(Cl)c1 ZINC000821676575 599090082 /nfs/dbraw/zinc/09/00/82/599090082.db2.gz AXLZNNUZWAEKFR-HNNXBMFYSA-N -1 3 364.236 3.973 20 0 FHADHM CO[C@@H](CNc1ccc(-c2nn[n-]n2)c(Cl)c1)c1cccc(Cl)c1 ZINC000821676575 599090085 /nfs/dbraw/zinc/09/00/85/599090085.db2.gz AXLZNNUZWAEKFR-HNNXBMFYSA-N -1 3 364.236 3.973 20 0 FHADHM C[C@H](CNc1c(F)cc(-c2nnn[n-]2)cc1F)c1ccc(F)cc1F ZINC000820275249 599097283 /nfs/dbraw/zinc/09/72/83/599097283.db2.gz OIDUONZSADJUEH-MRVPVSSYSA-N -1 3 351.307 3.639 20 0 FHADHM C[C@H](CNc1c(F)cc(-c2nn[n-]n2)cc1F)c1ccc(F)cc1F ZINC000820275249 599097286 /nfs/dbraw/zinc/09/72/86/599097286.db2.gz OIDUONZSADJUEH-MRVPVSSYSA-N -1 3 351.307 3.639 20 0 FHADHM COC(=O)[C@H](SCc1cccc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736903011 599113856 /nfs/dbraw/zinc/11/38/56/599113856.db2.gz XQYRRLNVXGRUCO-OAHLLOKOSA-N -1 3 374.853 3.668 20 0 FHADHM COC(=O)[C@H](SCc1cccc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736903011 599113858 /nfs/dbraw/zinc/11/38/58/599113858.db2.gz XQYRRLNVXGRUCO-OAHLLOKOSA-N -1 3 374.853 3.668 20 0 FHADHM Cc1cccc2oc(CCNc3ccc(Cl)cc3-c3nnn[n-]3)nc21 ZINC000822340668 599111571 /nfs/dbraw/zinc/11/15/71/599111571.db2.gz BUQFHFAMFKRTTP-UHFFFAOYSA-N -1 3 354.801 3.624 20 0 FHADHM Cc1cccc2oc(CCNc3ccc(Cl)cc3-c3nn[n-]n3)nc21 ZINC000822340668 599111574 /nfs/dbraw/zinc/11/15/74/599111574.db2.gz BUQFHFAMFKRTTP-UHFFFAOYSA-N -1 3 354.801 3.624 20 0 FHADHM O=C(CCC(F)(F)F)Oc1ccc(-c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000822950455 599135709 /nfs/dbraw/zinc/13/57/09/599135709.db2.gz OOHPSEQMSNHPRW-UHFFFAOYSA-N -1 3 362.311 3.782 20 0 FHADHM O=C(CCC(F)(F)F)Oc1ccc(-c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000822950455 599135712 /nfs/dbraw/zinc/13/57/12/599135712.db2.gz OOHPSEQMSNHPRW-UHFFFAOYSA-N -1 3 362.311 3.782 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N1C[C@H](c2ccccc2)C[C@H]1C ZINC000737293067 599146164 /nfs/dbraw/zinc/14/61/64/599146164.db2.gz ZUBZWOVXVQXVCW-RHSMWYFYSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N1C[C@H](c2ccccc2)C[C@H]1C ZINC000737293067 599146167 /nfs/dbraw/zinc/14/61/67/599146167.db2.gz ZUBZWOVXVQXVCW-RHSMWYFYSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1ccc([C@@H](C)C(=O)N(CC(C)C)c2ccc(-c3nnn[n-]3)cc2)o1 ZINC000822227680 599147721 /nfs/dbraw/zinc/14/77/21/599147721.db2.gz RHFAPGYEKWOMFL-CQSZACIVSA-N -1 3 353.426 3.561 20 0 FHADHM Cc1ccc([C@@H](C)C(=O)N(CC(C)C)c2ccc(-c3nn[n-]n3)cc2)o1 ZINC000822227680 599147723 /nfs/dbraw/zinc/14/77/23/599147723.db2.gz RHFAPGYEKWOMFL-CQSZACIVSA-N -1 3 353.426 3.561 20 0 FHADHM COc1ccc(-c2nc3cc(Cl)ccc3n2C2CC2)cc1-c1nnn[n-]1 ZINC000821731340 599155658 /nfs/dbraw/zinc/15/56/58/599155658.db2.gz AWIRSEIYIBITBA-UHFFFAOYSA-N -1 3 366.812 3.880 20 0 FHADHM COc1ccc(-c2nc3cc(Cl)ccc3n2C2CC2)cc1-c1nn[n-]n1 ZINC000821731340 599155661 /nfs/dbraw/zinc/15/56/61/599155661.db2.gz AWIRSEIYIBITBA-UHFFFAOYSA-N -1 3 366.812 3.880 20 0 FHADHM Cc1ccc(SCc2nnc(-c3cccc(-c4nnn[n-]4)c3)o2)cc1 ZINC000737367874 599159255 /nfs/dbraw/zinc/15/92/55/599159255.db2.gz BPAUTQVDYJZYMF-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM Cc1ccc(SCc2nnc(-c3cccc(-c4nn[n-]n4)c3)o2)cc1 ZINC000737367874 599159257 /nfs/dbraw/zinc/15/92/57/599159257.db2.gz BPAUTQVDYJZYMF-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM S=C(Nc1ccccc1-c1nnn[n-]1)N1CCCCCc2ccccc21 ZINC000738409149 599177660 /nfs/dbraw/zinc/17/76/60/599177660.db2.gz QZKRCCHZMVDUFV-UHFFFAOYSA-N -1 3 364.478 3.797 20 0 FHADHM S=C(Nc1ccccc1-c1nn[n-]n1)N1CCCCCc2ccccc21 ZINC000738409149 599177662 /nfs/dbraw/zinc/17/76/62/599177662.db2.gz QZKRCCHZMVDUFV-UHFFFAOYSA-N -1 3 364.478 3.797 20 0 FHADHM COc1ccc2sc(C(=O)Nc3cccc(-c4nnn[n-]4)c3)c(C)c2c1 ZINC000460693992 599177680 /nfs/dbraw/zinc/17/76/80/599177680.db2.gz YBARFWIYLJHKHY-UHFFFAOYSA-N -1 3 365.418 3.651 20 0 FHADHM COc1ccc2sc(C(=O)Nc3cccc(-c4nn[n-]n4)c3)c(C)c2c1 ZINC000460693992 599177682 /nfs/dbraw/zinc/17/76/82/599177682.db2.gz YBARFWIYLJHKHY-UHFFFAOYSA-N -1 3 365.418 3.651 20 0 FHADHM C[C@H](C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C)c1cccc(Cl)c1 ZINC000735552635 599183757 /nfs/dbraw/zinc/18/37/57/599183757.db2.gz XTRJQQYFWYMODV-NSHDSACASA-N -1 3 372.860 3.819 20 0 FHADHM C[C@H](C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C)c1cccc(Cl)c1 ZINC000735552635 599183760 /nfs/dbraw/zinc/18/37/60/599183760.db2.gz XTRJQQYFWYMODV-NSHDSACASA-N -1 3 372.860 3.819 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CCC[C@H](C(C)(C)C)CC1 ZINC000737290107 599188070 /nfs/dbraw/zinc/18/80/70/599188070.db2.gz BNVYAKVZPDLNRB-HNNXBMFYSA-N -1 3 356.474 3.855 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CCC[C@H](C(C)(C)C)CC1 ZINC000737290107 599188071 /nfs/dbraw/zinc/18/80/71/599188071.db2.gz BNVYAKVZPDLNRB-HNNXBMFYSA-N -1 3 356.474 3.855 20 0 FHADHM Cc1ccccc1[C@@H](C)CC(=O)OCc1ccc(-c2nnn[n-]2)cc1F ZINC000737420228 599186356 /nfs/dbraw/zinc/18/63/56/599186356.db2.gz HQKPSMPERCGXLI-ZDUSSCGKSA-N -1 3 354.385 3.551 20 0 FHADHM Cc1ccccc1[C@@H](C)CC(=O)OCc1ccc(-c2nn[n-]n2)cc1F ZINC000737420228 599186357 /nfs/dbraw/zinc/18/63/57/599186357.db2.gz HQKPSMPERCGXLI-ZDUSSCGKSA-N -1 3 354.385 3.551 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H](C)c2cccc(F)c2)c1-c1nnn[n-]1 ZINC000736669776 599186889 /nfs/dbraw/zinc/18/68/89/599186889.db2.gz KNNPCYQYVRECNZ-VIFPVBQESA-N -1 3 359.430 3.680 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H](C)c2cccc(F)c2)c1-c1nn[n-]n1 ZINC000736669776 599186890 /nfs/dbraw/zinc/18/68/90/599186890.db2.gz KNNPCYQYVRECNZ-VIFPVBQESA-N -1 3 359.430 3.680 20 0 FHADHM CN(C(=O)c1sccc1-c1nnn[n-]1)c1ccc(-c2ccccc2)cc1 ZINC000821574598 599192693 /nfs/dbraw/zinc/19/26/93/599192693.db2.gz NSCAVLOFRGPZND-UHFFFAOYSA-N -1 3 361.430 3.872 20 0 FHADHM CN(C(=O)c1sccc1-c1nn[n-]n1)c1ccc(-c2ccccc2)cc1 ZINC000821574598 599192696 /nfs/dbraw/zinc/19/26/96/599192696.db2.gz NSCAVLOFRGPZND-UHFFFAOYSA-N -1 3 361.430 3.872 20 0 FHADHM CC(C)CNC(=O)c1cccc(Oc2ccc(Cl)cc2-c2nnn[n-]2)c1 ZINC000735838881 599193975 /nfs/dbraw/zinc/19/39/75/599193975.db2.gz KHDSTEBVKRTIGB-UHFFFAOYSA-N -1 3 371.828 3.698 20 0 FHADHM CC(C)CNC(=O)c1cccc(Oc2ccc(Cl)cc2-c2nn[n-]n2)c1 ZINC000735838881 599193976 /nfs/dbraw/zinc/19/39/76/599193976.db2.gz KHDSTEBVKRTIGB-UHFFFAOYSA-N -1 3 371.828 3.698 20 0 FHADHM C[C@@H](CCSc1ccccc1)OC(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000820249344 607260834 /nfs/dbraw/zinc/26/08/34/607260834.db2.gz UYMPSHRVRFTRPH-ZDUSSCGKSA-N -1 3 354.435 3.594 20 0 FHADHM C[C@@H](CCSc1ccccc1)OC(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC000820249344 607260835 /nfs/dbraw/zinc/26/08/35/607260835.db2.gz UYMPSHRVRFTRPH-ZDUSSCGKSA-N -1 3 354.435 3.594 20 0 FHADHM CC[C@@H](Cc1ccc(C)cc1)N(CC)C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000736354632 599232615 /nfs/dbraw/zinc/23/26/15/599232615.db2.gz VJHGZTYJGLREHB-IBGZPJMESA-N -1 3 363.465 3.659 20 0 FHADHM CC[C@@H](Cc1ccc(C)cc1)N(CC)C(=O)c1cccc(-c2nn[n-]n2)c1 ZINC000736354632 599232616 /nfs/dbraw/zinc/23/26/16/599232616.db2.gz VJHGZTYJGLREHB-IBGZPJMESA-N -1 3 363.465 3.659 20 0 FHADHM Cc1cccc([C@H](C)SCC(=O)Nc2cccc(-c3nnn[n-]3)c2)c1 ZINC000822288614 599226778 /nfs/dbraw/zinc/22/67/78/599226778.db2.gz CZBUMZLNSQCXEC-ZDUSSCGKSA-N -1 3 353.451 3.608 20 0 FHADHM Cc1cccc([C@H](C)SCC(=O)Nc2cccc(-c3nn[n-]n3)c2)c1 ZINC000822288614 599226781 /nfs/dbraw/zinc/22/67/81/599226781.db2.gz CZBUMZLNSQCXEC-ZDUSSCGKSA-N -1 3 353.451 3.608 20 0 FHADHM O=C(Nc1nc(C=Cc2ccccc2)cs1)c1cccc(-c2nnn[n-]2)c1 ZINC000738212695 599227976 /nfs/dbraw/zinc/22/79/76/599227976.db2.gz TWXNJAQWLVDNSV-KTKRTIGZSA-N -1 3 374.429 3.746 20 0 FHADHM O=C(Nc1nc(C=Cc2ccccc2)cs1)c1cccc(-c2nn[n-]n2)c1 ZINC000738212695 599227977 /nfs/dbraw/zinc/22/79/77/599227977.db2.gz TWXNJAQWLVDNSV-KTKRTIGZSA-N -1 3 374.429 3.746 20 0 FHADHM CN(C(=O)c1ccccc1Sc1ccccc1-c1nnn[n-]1)C1CCC1 ZINC000736741091 599229069 /nfs/dbraw/zinc/22/90/69/599229069.db2.gz NBXAHWQWLRSZTP-UHFFFAOYSA-N -1 3 365.462 3.642 20 0 FHADHM CN(C(=O)c1ccccc1Sc1ccccc1-c1nn[n-]n1)C1CCC1 ZINC000736741091 599229070 /nfs/dbraw/zinc/22/90/70/599229070.db2.gz NBXAHWQWLRSZTP-UHFFFAOYSA-N -1 3 365.462 3.642 20 0 FHADHM CC[C@@H](C)Oc1ccc(C(=O)Nc2cccc(-c3nnn[n-]3)c2C)cc1 ZINC000820876938 607268428 /nfs/dbraw/zinc/26/84/28/607268428.db2.gz WVXJTZPLXVCXJB-GFCCVEGCSA-N -1 3 351.410 3.605 20 0 FHADHM CC[C@@H](C)Oc1ccc(C(=O)Nc2cccc(-c3nn[n-]n3)c2C)cc1 ZINC000820876938 607268429 /nfs/dbraw/zinc/26/84/29/607268429.db2.gz WVXJTZPLXVCXJB-GFCCVEGCSA-N -1 3 351.410 3.605 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc2ccccc2c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820380250 599235391 /nfs/dbraw/zinc/23/53/91/599235391.db2.gz ODZOLMGNPRQMPB-CYBMUJFWSA-N -1 3 358.405 3.903 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc2ccccc2c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820380250 599235393 /nfs/dbraw/zinc/23/53/93/599235393.db2.gz ODZOLMGNPRQMPB-CYBMUJFWSA-N -1 3 358.405 3.903 20 0 FHADHM Cc1c(NC(=O)[C@H](C)CSc2ccc(F)cc2)cccc1-c1nnn[n-]1 ZINC000822060748 607270288 /nfs/dbraw/zinc/27/02/88/607270288.db2.gz IYNHJWRYRWDPLY-LLVKDONJSA-N -1 3 371.441 3.681 20 0 FHADHM Cc1c(NC(=O)[C@H](C)CSc2ccc(F)cc2)cccc1-c1nn[n-]n1 ZINC000822060748 607270289 /nfs/dbraw/zinc/27/02/89/607270289.db2.gz IYNHJWRYRWDPLY-LLVKDONJSA-N -1 3 371.441 3.681 20 0 FHADHM Cc1c(NC(=O)Cc2ccc(Cl)cc2Cl)cccc1-c1nnn[n-]1 ZINC000822077804 607270791 /nfs/dbraw/zinc/27/07/91/607270791.db2.gz YHQLIIYJOADXOF-UHFFFAOYSA-N -1 3 362.220 3.663 20 0 FHADHM Cc1c(NC(=O)Cc2ccc(Cl)cc2Cl)cccc1-c1nn[n-]n1 ZINC000822077804 607270792 /nfs/dbraw/zinc/27/07/92/607270792.db2.gz YHQLIIYJOADXOF-UHFFFAOYSA-N -1 3 362.220 3.663 20 0 FHADHM C[C@H]1C[C@H](c2ccccc2F)N(C(=O)Nc2cccc(-c3nnn[n-]3)c2)C1 ZINC000820669166 599245594 /nfs/dbraw/zinc/24/55/94/599245594.db2.gz ZGOQJVSTYIJBNO-YVEFUNNKSA-N -1 3 366.400 3.621 20 0 FHADHM C[C@H]1C[C@H](c2ccccc2F)N(C(=O)Nc2cccc(-c3nn[n-]n3)c2)C1 ZINC000820669166 599245597 /nfs/dbraw/zinc/24/55/97/599245597.db2.gz ZGOQJVSTYIJBNO-YVEFUNNKSA-N -1 3 366.400 3.621 20 0 FHADHM C[C@@H]1CN(C(=O)Nc2cccc(-c3nnn[n-]3)c2)CC[C@H]1c1ccccc1 ZINC000820743485 599245740 /nfs/dbraw/zinc/24/57/40/599245740.db2.gz UQZOGIWXBMUXDJ-RDTXWAMCSA-N -1 3 362.437 3.524 20 0 FHADHM C[C@@H]1CN(C(=O)Nc2cccc(-c3nn[n-]n3)c2)CC[C@H]1c1ccccc1 ZINC000820743485 599245741 /nfs/dbraw/zinc/24/57/41/599245741.db2.gz UQZOGIWXBMUXDJ-RDTXWAMCSA-N -1 3 362.437 3.524 20 0 FHADHM CCC(CC)(CNC(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)SC ZINC000820887542 599247464 /nfs/dbraw/zinc/24/74/64/599247464.db2.gz FWIVFYINDGSBPS-UHFFFAOYSA-N -1 3 368.894 3.563 20 0 FHADHM CCC(CC)(CNC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)SC ZINC000820887542 599247466 /nfs/dbraw/zinc/24/74/66/599247466.db2.gz FWIVFYINDGSBPS-UHFFFAOYSA-N -1 3 368.894 3.563 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)c2cc3cc(F)ccc3o2)s1 ZINC000736679520 599248635 /nfs/dbraw/zinc/24/86/35/599248635.db2.gz WKSWHRIJXUBZQK-UHFFFAOYSA-N -1 3 357.370 3.628 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)c2cc3cc(F)ccc3o2)s1 ZINC000736679520 599248637 /nfs/dbraw/zinc/24/86/37/599248637.db2.gz WKSWHRIJXUBZQK-UHFFFAOYSA-N -1 3 357.370 3.628 20 0 FHADHM C[C@H](NC(=O)Nc1nc(C(C)(C)C)cs1)c1cccc(-c2nnn[n-]2)c1 ZINC000820380278 599248697 /nfs/dbraw/zinc/24/86/97/599248697.db2.gz PCPQQWCIVAGBHT-JTQLQIEISA-N -1 3 371.470 3.503 20 0 FHADHM C[C@H](NC(=O)Nc1nc(C(C)(C)C)cs1)c1cccc(-c2nn[n-]n2)c1 ZINC000820380278 599248699 /nfs/dbraw/zinc/24/86/99/599248699.db2.gz PCPQQWCIVAGBHT-JTQLQIEISA-N -1 3 371.470 3.503 20 0 FHADHM CC(C)c1cccc(NC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000820197160 599248953 /nfs/dbraw/zinc/24/89/53/599248953.db2.gz GXPHJAXFKFGNKN-CYBMUJFWSA-N -1 3 350.426 3.873 20 0 FHADHM CC(C)c1cccc(NC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000820197160 599248956 /nfs/dbraw/zinc/24/89/56/599248956.db2.gz GXPHJAXFKFGNKN-CYBMUJFWSA-N -1 3 350.426 3.873 20 0 FHADHM CC(C)c1cccc(NC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000820197162 599249015 /nfs/dbraw/zinc/24/90/15/599249015.db2.gz GXPHJAXFKFGNKN-ZDUSSCGKSA-N -1 3 350.426 3.873 20 0 FHADHM CC(C)c1cccc(NC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000820197162 599249018 /nfs/dbraw/zinc/24/90/18/599249018.db2.gz GXPHJAXFKFGNKN-ZDUSSCGKSA-N -1 3 350.426 3.873 20 0 FHADHM Cc1c(NC(=O)N(C)Cc2ccc(C(C)C)cc2)cccc1-c1nnn[n-]1 ZINC000822075725 607280217 /nfs/dbraw/zinc/28/02/17/607280217.db2.gz IHKZSRAIGATTBP-UHFFFAOYSA-N -1 3 364.453 3.962 20 0 FHADHM Cc1c(NC(=O)N(C)Cc2ccc(C(C)C)cc2)cccc1-c1nn[n-]n1 ZINC000822075725 607280218 /nfs/dbraw/zinc/28/02/18/607280218.db2.gz IHKZSRAIGATTBP-UHFFFAOYSA-N -1 3 364.453 3.962 20 0 FHADHM CCCc1ccccc1NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821142659 599252154 /nfs/dbraw/zinc/25/21/54/599252154.db2.gz KNWVHAMZHFBINA-CYBMUJFWSA-N -1 3 350.426 3.702 20 0 FHADHM CCCc1ccccc1NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821142659 599252156 /nfs/dbraw/zinc/25/21/56/599252156.db2.gz KNWVHAMZHFBINA-CYBMUJFWSA-N -1 3 350.426 3.702 20 0 FHADHM Cc1c(NC(=O)N(C)[C@H](C)c2ccccc2F)cccc1-c1nnn[n-]1 ZINC000822075837 607283104 /nfs/dbraw/zinc/28/31/04/607283104.db2.gz JMDWMWTVFRGUEZ-GFCCVEGCSA-N -1 3 354.389 3.539 20 0 FHADHM Cc1c(NC(=O)N(C)[C@H](C)c2ccccc2F)cccc1-c1nn[n-]n1 ZINC000822075837 607283105 /nfs/dbraw/zinc/28/31/05/607283105.db2.gz JMDWMWTVFRGUEZ-GFCCVEGCSA-N -1 3 354.389 3.539 20 0 FHADHM Cc1cc([C@H](C)NC(=O)Nc2cccc(-c3nnn[n-]3)c2C)ccc1F ZINC000822191812 607282797 /nfs/dbraw/zinc/28/27/97/607282797.db2.gz RNFNSDZEBIWJIU-LBPRGKRZSA-N -1 3 354.389 3.505 20 0 FHADHM Cc1cc([C@H](C)NC(=O)Nc2cccc(-c3nn[n-]n3)c2C)ccc1F ZINC000822191812 607282798 /nfs/dbraw/zinc/28/27/98/607282798.db2.gz RNFNSDZEBIWJIU-LBPRGKRZSA-N -1 3 354.389 3.505 20 0 FHADHM Cc1cc([C@H](C)NC(=O)Nc2cccc(-c3nnn[n-]3)c2C)c(C)s1 ZINC000822190834 607283706 /nfs/dbraw/zinc/28/37/06/607283706.db2.gz BWIXMJNYJAMTOW-NSHDSACASA-N -1 3 356.455 3.736 20 0 FHADHM Cc1cc([C@H](C)NC(=O)Nc2cccc(-c3nn[n-]n3)c2C)c(C)s1 ZINC000822190834 607283707 /nfs/dbraw/zinc/28/37/07/607283707.db2.gz BWIXMJNYJAMTOW-NSHDSACASA-N -1 3 356.455 3.736 20 0 FHADHM CC[C@H]1c2ccsc2CCN1C(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000821002238 607286210 /nfs/dbraw/zinc/28/62/10/607286210.db2.gz VFHISEQYYYPZLO-HNNXBMFYSA-N -1 3 368.466 3.778 20 0 FHADHM CC[C@H]1c2ccsc2CCN1C(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000821002238 607286211 /nfs/dbraw/zinc/28/62/11/607286211.db2.gz VFHISEQYYYPZLO-HNNXBMFYSA-N -1 3 368.466 3.778 20 0 FHADHM CCc1ccc([C@@H](C)NC(=O)Nc2cccc(-c3nnn[n-]3)c2C)cc1 ZINC000821482517 607287127 /nfs/dbraw/zinc/28/71/27/607287127.db2.gz SFZCCLHHVQJUPF-CYBMUJFWSA-N -1 3 350.426 3.620 20 0 FHADHM CCc1ccc([C@@H](C)NC(=O)Nc2cccc(-c3nn[n-]n3)c2C)cc1 ZINC000821482517 607287128 /nfs/dbraw/zinc/28/71/28/607287128.db2.gz SFZCCLHHVQJUPF-CYBMUJFWSA-N -1 3 350.426 3.620 20 0 FHADHM Cc1c(NC(=O)[C@H](Sc2ccccc2)C(C)C)cccc1-c1nnn[n-]1 ZINC000822061806 607294092 /nfs/dbraw/zinc/29/40/92/607294092.db2.gz YIUJWGXYUFOWLQ-QGZVFWFLSA-N -1 3 367.478 3.931 20 0 FHADHM Cc1c(NC(=O)[C@H](Sc2ccccc2)C(C)C)cccc1-c1nn[n-]n1 ZINC000822061806 607294093 /nfs/dbraw/zinc/29/40/93/607294093.db2.gz YIUJWGXYUFOWLQ-QGZVFWFLSA-N -1 3 367.478 3.931 20 0 FHADHM Cc1c(NC(=O)[C@H](C)Oc2cccc(C(C)C)c2)cccc1-c1nnn[n-]1 ZINC000822060714 607297281 /nfs/dbraw/zinc/29/72/81/607297281.db2.gz ICUKCBOFSWAXFO-AWEZNQCLSA-N -1 3 365.437 3.705 20 0 FHADHM Cc1c(NC(=O)[C@H](C)Oc2cccc(C(C)C)c2)cccc1-c1nn[n-]n1 ZINC000822060714 607297282 /nfs/dbraw/zinc/29/72/82/607297282.db2.gz ICUKCBOFSWAXFO-AWEZNQCLSA-N -1 3 365.437 3.705 20 0 FHADHM O=C(CCc1ccc(-c2nnn[n-]2)cc1)NC(C1CCCC1)C1CCCC1 ZINC000737854381 599260623 /nfs/dbraw/zinc/26/06/23/599260623.db2.gz ZMWXXRDCLZCRNO-UHFFFAOYSA-N -1 3 367.497 3.665 20 0 FHADHM O=C(CCc1ccc(-c2nn[n-]n2)cc1)NC(C1CCCC1)C1CCCC1 ZINC000737854381 599260625 /nfs/dbraw/zinc/26/06/25/599260625.db2.gz ZMWXXRDCLZCRNO-UHFFFAOYSA-N -1 3 367.497 3.665 20 0 FHADHM Cc1c(Br)cccc1NCc1ccc(-c2nnn[n-]2)s1 ZINC000822015258 607311426 /nfs/dbraw/zinc/31/14/26/607311426.db2.gz GMAFCZSRNPHJMS-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM COc1ccc(CNc2ccc(SC)c(Cl)c2)cc1-c1nnn[n-]1 ZINC000821821648 607316213 /nfs/dbraw/zinc/31/62/13/607316213.db2.gz PENWMZFMMIADNO-UHFFFAOYSA-N -1 3 361.858 3.863 20 0 FHADHM COc1ccc(CNc2ccc(SC)c(Cl)c2)cc1-c1nn[n-]n1 ZINC000821821648 607316214 /nfs/dbraw/zinc/31/62/14/607316214.db2.gz PENWMZFMMIADNO-UHFFFAOYSA-N -1 3 361.858 3.863 20 0 FHADHM CC(C)(C)[S@](=O)Cc1cccc(NCc2cccc(-c3nnn[n-]3)c2)c1 ZINC000819950810 607316648 /nfs/dbraw/zinc/31/66/48/607316648.db2.gz NBZFWBVHWNJGBQ-AREMUKBSSA-N -1 3 369.494 3.526 20 0 FHADHM CC(C)(C)[S@](=O)Cc1cccc(NCc2cccc(-c3nn[n-]n3)c2)c1 ZINC000819950810 607316649 /nfs/dbraw/zinc/31/66/49/607316649.db2.gz NBZFWBVHWNJGBQ-AREMUKBSSA-N -1 3 369.494 3.526 20 0 FHADHM Cc1nc(-c2cccnc2)nc(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1C ZINC000737464800 599273800 /nfs/dbraw/zinc/27/38/00/599273800.db2.gz YNRYNYUWILKNOT-CQSZACIVSA-N -1 3 372.436 3.509 20 0 FHADHM Cc1nc(-c2cccnc2)nc(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1C ZINC000737464800 599273802 /nfs/dbraw/zinc/27/38/02/599273802.db2.gz YNRYNYUWILKNOT-CQSZACIVSA-N -1 3 372.436 3.509 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)C[C@@H](C)c1ccccc1 ZINC000736487874 599275548 /nfs/dbraw/zinc/27/55/48/599275548.db2.gz MQPWBIIUAZYJLM-CQSZACIVSA-N -1 3 364.453 3.821 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cc(Cl)ccc1F ZINC000736487122 599276740 /nfs/dbraw/zinc/27/67/40/599276740.db2.gz CVZXTVQQEFKOKP-UHFFFAOYSA-N -1 3 374.807 3.733 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)Cc1ccc(Cl)cc1 ZINC000736487151 599276889 /nfs/dbraw/zinc/27/68/89/599276889.db2.gz DFDYURXYTDDIMD-UHFFFAOYSA-N -1 3 370.844 3.523 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cc(C)sc1C ZINC000736487545 599276962 /nfs/dbraw/zinc/27/69/62/599276962.db2.gz HPLZEGOXJAKYBI-UHFFFAOYSA-N -1 3 356.455 3.619 20 0 FHADHM Cc1coc(-c2ccc(C)c(NCc3cc(-c4nnn[n-]4)cs3)c2)n1 ZINC000822402774 607319592 /nfs/dbraw/zinc/31/95/92/607319592.db2.gz FXAVOBKUPPGWDM-UHFFFAOYSA-N -1 3 352.423 3.812 20 0 FHADHM Cc1coc(-c2ccc(C)c(NCc3cc(-c4nn[n-]n4)cs3)c2)n1 ZINC000822402774 607319593 /nfs/dbraw/zinc/31/95/93/607319593.db2.gz FXAVOBKUPPGWDM-UHFFFAOYSA-N -1 3 352.423 3.812 20 0 FHADHM Cc1coc(-c2cc(NCc3cc(-c4nnn[n-]4)cs3)ccc2C)n1 ZINC000822403801 607319650 /nfs/dbraw/zinc/31/96/50/607319650.db2.gz VFRKCNHUWJKDET-UHFFFAOYSA-N -1 3 352.423 3.812 20 0 FHADHM Cc1coc(-c2cc(NCc3cc(-c4nn[n-]n4)cs3)ccc2C)n1 ZINC000822403801 607319651 /nfs/dbraw/zinc/31/96/51/607319651.db2.gz VFRKCNHUWJKDET-UHFFFAOYSA-N -1 3 352.423 3.812 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)Cc1ccccc1Cl ZINC000736489380 599278211 /nfs/dbraw/zinc/27/82/11/599278211.db2.gz ZDDMHLYQCZCOCZ-UHFFFAOYSA-N -1 3 370.844 3.523 20 0 FHADHM CCc1ccc([C@H]2CCCN2C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)o1 ZINC000736686020 599280788 /nfs/dbraw/zinc/28/07/88/599280788.db2.gz NOBANGARPQKSRL-OAHLLOKOSA-N -1 3 370.388 3.530 20 0 FHADHM CCc1ccc([C@H]2CCCN2C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)o1 ZINC000736686020 599280792 /nfs/dbraw/zinc/28/07/92/599280792.db2.gz NOBANGARPQKSRL-OAHLLOKOSA-N -1 3 370.388 3.530 20 0 FHADHM Cc1cc(-c2nn[n-]n2)cc(C)c1OCc1coc(-c2ccc(F)cc2)n1 ZINC000737221348 599282942 /nfs/dbraw/zinc/28/29/42/599282942.db2.gz JQGYKHKPUIDYLH-UHFFFAOYSA-N -1 3 365.368 3.857 20 0 FHADHM C[C@@H](Sc1nccn1Cc1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736190976 599286672 /nfs/dbraw/zinc/28/66/72/599286672.db2.gz GJCZMULRGGDUFE-CQSZACIVSA-N -1 3 362.462 3.965 20 0 FHADHM C[C@@H](Sc1nccn1Cc1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736190976 599286673 /nfs/dbraw/zinc/28/66/73/599286673.db2.gz GJCZMULRGGDUFE-CQSZACIVSA-N -1 3 362.462 3.965 20 0 FHADHM CC(C)CNc1nnc(S[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)s1 ZINC000735838826 599286841 /nfs/dbraw/zinc/28/68/41/599286841.db2.gz ISQXQTXESMBSCH-JTQLQIEISA-N -1 3 361.500 3.639 20 0 FHADHM CC(C)CNc1nnc(S[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)s1 ZINC000735838826 599286843 /nfs/dbraw/zinc/28/68/43/599286843.db2.gz ISQXQTXESMBSCH-JTQLQIEISA-N -1 3 361.500 3.639 20 0 FHADHM C[C@H]1CCC[C@@H](NC(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)C1 ZINC000820697918 599288556 /nfs/dbraw/zinc/28/85/56/599288556.db2.gz NXVSKBAMNHZYOB-VHSXEESVSA-N -1 3 368.363 3.586 20 0 FHADHM C[C@H]1CCC[C@@H](NC(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)C1 ZINC000820697918 599288559 /nfs/dbraw/zinc/28/85/59/599288559.db2.gz NXVSKBAMNHZYOB-VHSXEESVSA-N -1 3 368.363 3.586 20 0 FHADHM C[C@@H]1CCCCCN1C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000820703088 599290918 /nfs/dbraw/zinc/29/09/18/599290918.db2.gz CSDVBKCLVRYVBN-SNVBAGLBSA-N -1 3 368.363 3.682 20 0 FHADHM C[C@@H]1CCCCCN1C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000820703088 599290921 /nfs/dbraw/zinc/29/09/21/599290921.db2.gz CSDVBKCLVRYVBN-SNVBAGLBSA-N -1 3 368.363 3.682 20 0 FHADHM CSc1ccc2cc(Cn3cc(C)c(-c4nnn[n-]4)c3)c(Cl)nc2c1 ZINC000821984743 607330239 /nfs/dbraw/zinc/33/02/39/607330239.db2.gz SEUSRUDVUDMCNP-UHFFFAOYSA-N -1 3 370.869 3.948 20 0 FHADHM CSc1ccc2cc(Cn3cc(C)c(-c4nn[n-]n4)c3)c(Cl)nc2c1 ZINC000821984743 607330240 /nfs/dbraw/zinc/33/02/40/607330240.db2.gz SEUSRUDVUDMCNP-UHFFFAOYSA-N -1 3 370.869 3.948 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)N[C@H](c1ccccc1)C1CCC1 ZINC000737798580 598232190 /nfs/dbraw/zinc/23/21/90/598232190.db2.gz MGMZSEXRDIIMRO-FBRRREGBSA-N -1 3 359.433 3.538 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)N[C@H](c1ccccc1)C1CCC1 ZINC000737798580 598232192 /nfs/dbraw/zinc/23/21/92/598232192.db2.gz MGMZSEXRDIIMRO-FBRRREGBSA-N -1 3 359.433 3.538 20 0 FHADHM O=C(N[C@H](c1ccc(Cl)cc1)C1CCC1)c1sccc1-c1nnn[n-]1 ZINC000737997538 598235616 /nfs/dbraw/zinc/23/56/16/598235616.db2.gz JXECCVAAYHLSJY-AWEZNQCLSA-N -1 3 373.869 3.853 20 0 FHADHM O=C(N[C@H](c1ccc(Cl)cc1)C1CCC1)c1sccc1-c1nn[n-]n1 ZINC000737997538 598235617 /nfs/dbraw/zinc/23/56/17/598235617.db2.gz JXECCVAAYHLSJY-AWEZNQCLSA-N -1 3 373.869 3.853 20 0 FHADHM CCNc1nc(Sc2cccc(F)c2-c2nnn[n-]2)nc2ccccc21 ZINC000736586460 598235866 /nfs/dbraw/zinc/23/58/66/598235866.db2.gz ZTTSNESNQFMTPK-UHFFFAOYSA-N -1 3 367.413 3.532 20 0 FHADHM C[C@H](Nc1ccc(-c2nn[n-]n2)cc1F)c1ccc(NC(=O)C2CC2)cc1 ZINC000736136165 598236609 /nfs/dbraw/zinc/23/66/09/598236609.db2.gz DMXSQQNMDQOXST-NSHDSACASA-N -1 3 366.400 3.527 20 0 FHADHM Cc1ccc(C)c(OC2CCN(c3ccc(-c4nn[n-]n4)cc3F)CC2)c1 ZINC000737325270 598240898 /nfs/dbraw/zinc/24/08/98/598240898.db2.gz CGNASUCFAFGESQ-UHFFFAOYSA-N -1 3 367.428 3.670 20 0 FHADHM CN(C[C@H]1CCCO[C@@H]1c1ccccc1)c1ccc(-c2nn[n-]n2)cc1F ZINC000736793392 598243172 /nfs/dbraw/zinc/24/31/72/598243172.db2.gz WSMNNXGJQYYJFY-VQIMIIECSA-N -1 3 367.428 3.610 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nnn[n-]2)c1)[C@H]1CCCc2sccc21 ZINC000823332947 607348460 /nfs/dbraw/zinc/34/84/60/607348460.db2.gz VKKPHFJMGXKVAL-NSHDSACASA-N -1 3 359.842 3.640 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nn[n-]n2)c1)[C@H]1CCCc2sccc21 ZINC000823332947 607348462 /nfs/dbraw/zinc/34/84/62/607348462.db2.gz VKKPHFJMGXKVAL-NSHDSACASA-N -1 3 359.842 3.640 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N[C@@H](c1ccco1)c1ccccc1 ZINC000737292155 598266036 /nfs/dbraw/zinc/26/60/36/598266036.db2.gz SMRGVWYNDAKVAL-GOSISDBHSA-N -1 3 374.404 3.679 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N[C@@H](c1ccco1)c1ccccc1 ZINC000737292155 598266037 /nfs/dbraw/zinc/26/60/37/598266037.db2.gz SMRGVWYNDAKVAL-GOSISDBHSA-N -1 3 374.404 3.679 20 0 FHADHM CCCCN(C)C(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736453183 598267395 /nfs/dbraw/zinc/26/73/95/598267395.db2.gz MXUKQPFRCWGMMY-UHFFFAOYSA-N -1 3 366.425 3.923 20 0 FHADHM CCCCN(C)C(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736453183 598267396 /nfs/dbraw/zinc/26/73/96/598267396.db2.gz MXUKQPFRCWGMMY-UHFFFAOYSA-N -1 3 366.425 3.923 20 0 FHADHM COc1ccc(Cl)cc1CSc1nc(C)cc(C)c1-c1nnn[n-]1 ZINC000737100331 598271045 /nfs/dbraw/zinc/27/10/45/598271045.db2.gz USKRGZGUALDMBJ-UHFFFAOYSA-N -1 3 361.858 3.833 20 0 FHADHM COc1ccc(Cl)cc1CSc1nc(C)cc(C)c1-c1nn[n-]n1 ZINC000737100331 598271046 /nfs/dbraw/zinc/27/10/46/598271046.db2.gz USKRGZGUALDMBJ-UHFFFAOYSA-N -1 3 361.858 3.833 20 0 FHADHM COc1ccc(CCNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)cc1 ZINC000737090333 598274010 /nfs/dbraw/zinc/27/40/10/598274010.db2.gz MYQGOMZGBRBNHD-UHFFFAOYSA-N -1 3 363.343 3.549 20 0 FHADHM COc1ccc(CCNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)cc1 ZINC000737090333 598274011 /nfs/dbraw/zinc/27/40/11/598274011.db2.gz MYQGOMZGBRBNHD-UHFFFAOYSA-N -1 3 363.343 3.549 20 0 FHADHM COc1cccc(CN(C)c2ccc(-c3nn[n-]n3)cc2C(F)(F)F)c1 ZINC000737131334 598274377 /nfs/dbraw/zinc/27/43/77/598274377.db2.gz OFMIFVQQOKVROU-UHFFFAOYSA-N -1 3 363.343 3.531 20 0 FHADHM C[C@@H](c1cccs1)N(C)C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000736203902 598279555 /nfs/dbraw/zinc/27/95/55/598279555.db2.gz PCCHUCPIWYGSQP-NSHDSACASA-N -1 3 373.486 3.710 20 0 FHADHM C[C@@H](c1cccs1)N(C)C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000736203902 598279557 /nfs/dbraw/zinc/27/95/57/598279557.db2.gz PCCHUCPIWYGSQP-NSHDSACASA-N -1 3 373.486 3.710 20 0 FHADHM Cc1ccc([C@@H](C)NC(=O)Nc2cc(-c3nnn[n-]3)cn2C(C)(C)C)cc1 ZINC000737322358 598279777 /nfs/dbraw/zinc/27/97/77/598279777.db2.gz YXADFESOHORUBL-CYBMUJFWSA-N -1 3 367.457 3.614 20 0 FHADHM Cc1ccc([C@@H](C)NC(=O)Nc2cc(-c3nn[n-]n3)cn2C(C)(C)C)cc1 ZINC000737322358 598279778 /nfs/dbraw/zinc/27/97/78/598279778.db2.gz YXADFESOHORUBL-CYBMUJFWSA-N -1 3 367.457 3.614 20 0 FHADHM Cc1c2cccc(C)c2oc1C(=O)N(C)c1ccc(-c2nnn[n-]2)cc1F ZINC000737203570 598281082 /nfs/dbraw/zinc/28/10/82/598281082.db2.gz VKISPOCBDBYRLX-UHFFFAOYSA-N -1 3 365.368 3.645 20 0 FHADHM Cc1c2cccc(C)c2oc1C(=O)N(C)c1ccc(-c2nn[n-]n2)cc1F ZINC000737203570 598281083 /nfs/dbraw/zinc/28/10/83/598281083.db2.gz VKISPOCBDBYRLX-UHFFFAOYSA-N -1 3 365.368 3.645 20 0 FHADHM Fc1cccc(-n2ccc(CSCc3ccc(-c4nnn[n-]4)cc3)n2)c1 ZINC000737667382 598315645 /nfs/dbraw/zinc/31/56/45/598315645.db2.gz PXIVJYMXGDJPJQ-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM Fc1cccc(-n2ccc(CSCc3ccc(-c4nn[n-]n4)cc3)n2)c1 ZINC000737667382 598315646 /nfs/dbraw/zinc/31/56/46/598315646.db2.gz PXIVJYMXGDJPJQ-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM CN(CC1CCCCC1)C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736794433 598320782 /nfs/dbraw/zinc/32/07/82/598320782.db2.gz SLJUENACIBZMPN-UHFFFAOYSA-N -1 3 364.906 3.729 20 0 FHADHM CN(CC1CCCCC1)C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736794433 598320783 /nfs/dbraw/zinc/32/07/83/598320783.db2.gz SLJUENACIBZMPN-UHFFFAOYSA-N -1 3 364.906 3.729 20 0 FHADHM S=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)N1CC[C@H]1c1ccccc1 ZINC000738401810 598321649 /nfs/dbraw/zinc/32/16/49/598321649.db2.gz UNVAKUABDVHUSI-HNNXBMFYSA-N -1 3 370.869 3.664 20 0 FHADHM S=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)N1CC[C@H]1c1ccccc1 ZINC000738401810 598321650 /nfs/dbraw/zinc/32/16/50/598321650.db2.gz UNVAKUABDVHUSI-HNNXBMFYSA-N -1 3 370.869 3.664 20 0 FHADHM CC(C)(NC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccccc1 ZINC000735677871 598322954 /nfs/dbraw/zinc/32/29/54/598322954.db2.gz JIQXDJFMIUPKJJ-UHFFFAOYSA-N -1 3 372.885 3.742 20 0 FHADHM CC(C)(NC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccccc1 ZINC000735677871 598322956 /nfs/dbraw/zinc/32/29/56/598322956.db2.gz JIQXDJFMIUPKJJ-UHFFFAOYSA-N -1 3 372.885 3.742 20 0 FHADHM Cc1ccc2c(c1)N(C(=S)Nc1ccc(-c3nnn[n-]3)c(Cl)c1)CC2 ZINC000737378467 598324226 /nfs/dbraw/zinc/32/42/26/598324226.db2.gz SKFGRMYASUPXKH-UHFFFAOYSA-N -1 3 370.869 3.588 20 0 FHADHM Cc1ccc2c(c1)N(C(=S)Nc1ccc(-c3nn[n-]n3)c(Cl)c1)CC2 ZINC000737378467 598324228 /nfs/dbraw/zinc/32/42/28/598324228.db2.gz SKFGRMYASUPXKH-UHFFFAOYSA-N -1 3 370.869 3.588 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)[C@H]1CCCc2sccc21 ZINC000823303855 607350243 /nfs/dbraw/zinc/35/02/43/607350243.db2.gz XCTHUOCUXZDYEE-NSHDSACASA-N -1 3 359.842 3.640 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)[C@H]1CCCc2sccc21 ZINC000823303855 607350244 /nfs/dbraw/zinc/35/02/44/607350244.db2.gz XCTHUOCUXZDYEE-NSHDSACASA-N -1 3 359.842 3.640 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@H]2CCCc3sccc32)s1 ZINC000821466675 607350557 /nfs/dbraw/zinc/35/05/57/607350557.db2.gz YSOYVNAIYUFAKM-NSHDSACASA-N -1 3 359.480 3.611 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@H]2CCCc3sccc32)s1 ZINC000821466675 607350560 /nfs/dbraw/zinc/35/05/60/607350560.db2.gz YSOYVNAIYUFAKM-NSHDSACASA-N -1 3 359.480 3.611 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@@H]2CCCc3sccc32)s1 ZINC000821466669 607350811 /nfs/dbraw/zinc/35/08/11/607350811.db2.gz YSOYVNAIYUFAKM-LLVKDONJSA-N -1 3 359.480 3.611 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@@H]2CCCc3sccc32)s1 ZINC000821466669 607350812 /nfs/dbraw/zinc/35/08/12/607350812.db2.gz YSOYVNAIYUFAKM-LLVKDONJSA-N -1 3 359.480 3.611 20 0 FHADHM COc1ccc(CNc2ccc(-c3nn[n-]n3)cc2F)c(C(F)(F)F)c1 ZINC000737095940 598353158 /nfs/dbraw/zinc/35/31/58/598353158.db2.gz QYNLSDKMNBGGJZ-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM CC[C@H](Oc1ccccc1C(C)C)C(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000592035466 598357805 /nfs/dbraw/zinc/35/78/05/598357805.db2.gz ZAKIYMVBLUAVPE-KRWDZBQOSA-N -1 3 365.437 3.786 20 0 FHADHM CC[C@H](Oc1ccccc1C(C)C)C(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000592035466 598357807 /nfs/dbraw/zinc/35/78/07/598357807.db2.gz ZAKIYMVBLUAVPE-KRWDZBQOSA-N -1 3 365.437 3.786 20 0 FHADHM CC/C=C\CCOC(=O)c1occc1COc1cccc(-c2nnn[n-]2)c1 ZINC000736411887 598363035 /nfs/dbraw/zinc/36/30/35/598363035.db2.gz PYERPEBKENJMIM-ARJAWSKDSA-N -1 3 368.393 3.552 20 0 FHADHM CC/C=C\CCOC(=O)c1occc1COc1cccc(-c2nn[n-]n2)c1 ZINC000736411887 598363037 /nfs/dbraw/zinc/36/30/37/598363037.db2.gz PYERPEBKENJMIM-ARJAWSKDSA-N -1 3 368.393 3.552 20 0 FHADHM C[C@@H](NC(=O)Nc1cccc(-c2nnn[n-]2)c1)c1csc2ccccc21 ZINC000736119473 598369459 /nfs/dbraw/zinc/36/94/59/598369459.db2.gz YZZDIUUKOUBUAQ-LLVKDONJSA-N -1 3 364.434 3.964 20 0 FHADHM C[C@@H](NC(=O)Nc1cccc(-c2nn[n-]n2)c1)c1csc2ccccc21 ZINC000736119473 598369461 /nfs/dbraw/zinc/36/94/61/598369461.db2.gz YZZDIUUKOUBUAQ-LLVKDONJSA-N -1 3 364.434 3.964 20 0 FHADHM CN(Cc1ccc2ccccc2c1)c1ncc(-c2nnn[n-]2)cc1Cl ZINC000736820536 598386457 /nfs/dbraw/zinc/38/64/57/598386457.db2.gz OSIJBPNOHXRQMB-UHFFFAOYSA-N -1 3 350.813 3.705 20 0 FHADHM CN(Cc1ccc2ccccc2c1)c1ncc(-c2nn[n-]n2)cc1Cl ZINC000736820536 598386459 /nfs/dbraw/zinc/38/64/59/598386459.db2.gz OSIJBPNOHXRQMB-UHFFFAOYSA-N -1 3 350.813 3.705 20 0 FHADHM Fc1cccc(NCCOc2ccccc2C(F)(F)F)c1-c1nnn[n-]1 ZINC000737665762 598387266 /nfs/dbraw/zinc/38/72/66/598387266.db2.gz VDINTYWAGSPALE-UHFFFAOYSA-N -1 3 367.306 3.516 20 0 FHADHM Fc1cccc(NCCOc2ccccc2C(F)(F)F)c1-c1nn[n-]n1 ZINC000737665762 598387267 /nfs/dbraw/zinc/38/72/67/598387267.db2.gz VDINTYWAGSPALE-UHFFFAOYSA-N -1 3 367.306 3.516 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1NCCc1csc2ccccc12 ZINC000737558122 598391554 /nfs/dbraw/zinc/39/15/54/598391554.db2.gz KVCAPKNFEZPWHV-UHFFFAOYSA-N -1 3 356.842 3.784 20 0 FHADHM Clc1cc(-c2nn[n-]n2)cnc1NCCc1csc2ccccc12 ZINC000737558122 598391556 /nfs/dbraw/zinc/39/15/56/598391556.db2.gz KVCAPKNFEZPWHV-UHFFFAOYSA-N -1 3 356.842 3.784 20 0 FHADHM Cc1ccc2c(c1)[C@H](NC(=O)Nc1ccc(-c3nnn[n-]3)c(Cl)c1)CC2 ZINC000737371753 598393315 /nfs/dbraw/zinc/39/33/15/598393315.db2.gz KRNWLFDJCXRFAZ-MRXNPFEDSA-N -1 3 368.828 3.638 20 0 FHADHM Cc1ccc2c(c1)[C@H](NC(=O)Nc1ccc(-c3nn[n-]n3)c(Cl)c1)CC2 ZINC000737371753 598393316 /nfs/dbraw/zinc/39/33/16/598393316.db2.gz KRNWLFDJCXRFAZ-MRXNPFEDSA-N -1 3 368.828 3.638 20 0 FHADHM Cc1oc(-c2ccsc2)nc1COc1ccc(-c2nn[n-]n2)cc1C ZINC000737220547 598394921 /nfs/dbraw/zinc/39/49/21/598394921.db2.gz BXLPCDCROAJVEE-UHFFFAOYSA-N -1 3 353.407 3.779 20 0 FHADHM Cc1oc(-c2cccs2)nc1COc1ccc(-c2nn[n-]n2)cc1C ZINC000737221277 598394964 /nfs/dbraw/zinc/39/49/64/598394964.db2.gz HRSHHAVSRRJXBW-UHFFFAOYSA-N -1 3 353.407 3.779 20 0 FHADHM CCc1ccccc1NC(=O)[C@H](C)Sc1ccc(-c2nnn[n-]2)cc1 ZINC000736701545 598415918 /nfs/dbraw/zinc/41/59/18/598415918.db2.gz DDDBLYNDSAVAHK-LBPRGKRZSA-N -1 3 353.451 3.548 20 0 FHADHM CCc1ccccc1NC(=O)[C@H](C)Sc1ccc(-c2nn[n-]n2)cc1 ZINC000736701545 598415920 /nfs/dbraw/zinc/41/59/20/598415920.db2.gz DDDBLYNDSAVAHK-LBPRGKRZSA-N -1 3 353.451 3.548 20 0 FHADHM O=C(C[C@@H]1C=CCC1)Nc1ccccc1NCc1ccccc1-c1nnn[n-]1 ZINC000737813141 598418428 /nfs/dbraw/zinc/41/84/28/598418428.db2.gz HRNQEUJPJWFQLX-OAHLLOKOSA-N -1 3 374.448 3.774 20 0 FHADHM O=C(C[C@@H]1C=CCC1)Nc1ccccc1NCc1ccccc1-c1nn[n-]n1 ZINC000737813141 598418429 /nfs/dbraw/zinc/41/84/29/598418429.db2.gz HRNQEUJPJWFQLX-OAHLLOKOSA-N -1 3 374.448 3.774 20 0 FHADHM Cc1cccc(N(C)C(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c1 ZINC000737396675 598418716 /nfs/dbraw/zinc/41/87/16/598418716.db2.gz JVMSEEMAGJTMRF-UHFFFAOYSA-N -1 3 358.858 3.662 20 0 FHADHM Cc1cccc(N(C)C(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c1 ZINC000737396675 598418717 /nfs/dbraw/zinc/41/87/17/598418717.db2.gz JVMSEEMAGJTMRF-UHFFFAOYSA-N -1 3 358.858 3.662 20 0 FHADHM CN(C(=O)c1sccc1SC(F)F)c1cccc(-c2nnn[n-]2)c1 ZINC000736740493 598420821 /nfs/dbraw/zinc/42/08/21/598420821.db2.gz ACNASCPLZBTZSD-UHFFFAOYSA-N -1 3 367.406 3.520 20 0 FHADHM CN(C(=O)c1sccc1SC(F)F)c1cccc(-c2nn[n-]n2)c1 ZINC000736740493 598420822 /nfs/dbraw/zinc/42/08/22/598420822.db2.gz ACNASCPLZBTZSD-UHFFFAOYSA-N -1 3 367.406 3.520 20 0 FHADHM CC(C)CC[C@@H](C)NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C(C)C ZINC000735797353 598427311 /nfs/dbraw/zinc/42/73/11/598427311.db2.gz NRFKWUHEDJEIQT-OAHLLOKOSA-N -1 3 358.490 3.611 20 0 FHADHM CC(C)CC[C@@H](C)NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C(C)C ZINC000735797353 598427312 /nfs/dbraw/zinc/42/73/12/598427312.db2.gz NRFKWUHEDJEIQT-OAHLLOKOSA-N -1 3 358.490 3.611 20 0 FHADHM CC(C)[C@H](SCc1ccccc1)C(=O)Oc1ccc(-c2nnn[n-]2)cc1 ZINC000735733891 598440502 /nfs/dbraw/zinc/44/05/02/598440502.db2.gz CTMXZMYVCUNQDS-KRWDZBQOSA-N -1 3 368.462 3.730 20 0 FHADHM CC(C)[C@H](SCc1ccccc1)C(=O)Oc1ccc(-c2nn[n-]n2)cc1 ZINC000735733891 598440504 /nfs/dbraw/zinc/44/05/04/598440504.db2.gz CTMXZMYVCUNQDS-KRWDZBQOSA-N -1 3 368.462 3.730 20 0 FHADHM CSCc1ccc(NC(=S)Nc2ccccc2-c2nnn[n-]2)cc1 ZINC000737181099 598441714 /nfs/dbraw/zinc/44/17/14/598441714.db2.gz GTQSYXGWBXZIID-UHFFFAOYSA-N -1 3 356.480 3.539 20 0 FHADHM CSCc1ccc(NC(=S)Nc2ccccc2-c2nn[n-]n2)cc1 ZINC000737181099 598441716 /nfs/dbraw/zinc/44/17/16/598441716.db2.gz GTQSYXGWBXZIID-UHFFFAOYSA-N -1 3 356.480 3.539 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)C[C@@H]1C[C@@H](C)CC(C)(C)C1 ZINC000737057800 598444110 /nfs/dbraw/zinc/44/41/10/598444110.db2.gz JQFJRVGOBACTNV-OLZOCXBDSA-N -1 3 357.458 3.666 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)C[C@@H]1C[C@@H](C)CC(C)(C)C1 ZINC000737057800 598444112 /nfs/dbraw/zinc/44/41/12/598444112.db2.gz JQFJRVGOBACTNV-OLZOCXBDSA-N -1 3 357.458 3.666 20 0 FHADHM Clc1ccc(-c2cnc(COc3ccc(-c4nn[n-]n4)cc3)o2)cc1 ZINC000737567047 598454056 /nfs/dbraw/zinc/45/40/56/598454056.db2.gz WWSHHNJJHUGCPY-UHFFFAOYSA-N -1 3 353.769 3.754 20 0 FHADHM C[C@H](Cc1nc(-c2ccc(-c3nnn[n-]3)cc2)cs1)n1cc(Cl)cn1 ZINC000736065325 598464278 /nfs/dbraw/zinc/46/42/78/598464278.db2.gz CLKBBLOBTYKFGZ-SNVBAGLBSA-N -1 3 371.857 3.644 20 0 FHADHM C[C@H](Cc1nc(-c2ccc(-c3nn[n-]n3)cc2)cs1)n1cc(Cl)cn1 ZINC000736065325 598464280 /nfs/dbraw/zinc/46/42/80/598464280.db2.gz CLKBBLOBTYKFGZ-SNVBAGLBSA-N -1 3 371.857 3.644 20 0 FHADHM O=C(OCc1ccccc1-c1nnn[n-]1)[C@H]1C[C@@H]1c1cccc2ccccc21 ZINC000738235315 598475924 /nfs/dbraw/zinc/47/59/24/598475924.db2.gz QOGXVIJJEPQFPG-UXHICEINSA-N -1 3 370.412 3.867 20 0 FHADHM O=C(OCc1ccccc1-c1nn[n-]n1)[C@H]1C[C@@H]1c1cccc2ccccc21 ZINC000738235315 598475926 /nfs/dbraw/zinc/47/59/26/598475926.db2.gz QOGXVIJJEPQFPG-UXHICEINSA-N -1 3 370.412 3.867 20 0 FHADHM C[C@H](OC(=O)CCc1ccc(Cl)s1)c1cccc(-c2nnn[n-]2)c1 ZINC000736149971 598484014 /nfs/dbraw/zinc/48/40/14/598484014.db2.gz LUHMLDGGAOYBPM-JTQLQIEISA-N -1 3 362.842 3.819 20 0 FHADHM C[C@H](OC(=O)CCc1ccc(Cl)s1)c1cccc(-c2nn[n-]n2)c1 ZINC000736149971 598484015 /nfs/dbraw/zinc/48/40/15/598484015.db2.gz LUHMLDGGAOYBPM-JTQLQIEISA-N -1 3 362.842 3.819 20 0 FHADHM C[C@H](OC(=O)CCOc1ccc(Cl)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000736148288 598487406 /nfs/dbraw/zinc/48/74/06/598487406.db2.gz GRWVRKPLLRXOHX-LBPRGKRZSA-N -1 3 372.812 3.593 20 0 FHADHM C[C@H](OC(=O)CCOc1ccc(Cl)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000736148288 598487407 /nfs/dbraw/zinc/48/74/07/598487407.db2.gz GRWVRKPLLRXOHX-LBPRGKRZSA-N -1 3 372.812 3.593 20 0 FHADHM CCc1ccc([C@H](C)C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1 ZINC000736688776 598497076 /nfs/dbraw/zinc/49/70/76/598497076.db2.gz RVGFOJVJQSPWDC-NSHDSACASA-N -1 3 355.829 3.825 20 0 FHADHM CCc1ccc([C@H](C)C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1 ZINC000736688776 598497078 /nfs/dbraw/zinc/49/70/78/598497078.db2.gz RVGFOJVJQSPWDC-NSHDSACASA-N -1 3 355.829 3.825 20 0 FHADHM CC1CCC(OC2CCN(c3cccc(F)c3-c3nnn[n-]3)CC2)CC1 ZINC000736246120 598501920 /nfs/dbraw/zinc/50/19/20/598501920.db2.gz ZIXQSNLOPVMUHY-UHFFFAOYSA-N -1 3 359.449 3.570 20 0 FHADHM CC1CCC(OC2CCN(c3cccc(F)c3-c3nn[n-]n3)CC2)CC1 ZINC000736246120 598501921 /nfs/dbraw/zinc/50/19/21/598501921.db2.gz ZIXQSNLOPVMUHY-UHFFFAOYSA-N -1 3 359.449 3.570 20 0 FHADHM CCc1c(C)sc(NC(=O)Cc2cccc(Cl)c2)c1-c1nnn[n-]1 ZINC000736677031 598514118 /nfs/dbraw/zinc/51/41/18/598514118.db2.gz YLYAIKNPQDZBMD-UHFFFAOYSA-N -1 3 361.858 3.634 20 0 FHADHM CCc1c(C)sc(NC(=O)Cc2cccc(Cl)c2)c1-c1nn[n-]n1 ZINC000736677031 598514119 /nfs/dbraw/zinc/51/41/19/598514119.db2.gz YLYAIKNPQDZBMD-UHFFFAOYSA-N -1 3 361.858 3.634 20 0 FHADHM CCc1c(C)sc(NC(=O)C=C(C)c2ccc(F)cc2)c1-c1nnn[n-]1 ZINC000736669305 598514994 /nfs/dbraw/zinc/51/49/94/598514994.db2.gz CWSPSMKWRDCKHE-KTKRTIGZSA-N -1 3 371.441 3.980 20 0 FHADHM CCc1c(C)sc(NC(=O)C=C(C)c2ccc(F)cc2)c1-c1nn[n-]n1 ZINC000736669305 598514995 /nfs/dbraw/zinc/51/49/95/598514995.db2.gz CWSPSMKWRDCKHE-KTKRTIGZSA-N -1 3 371.441 3.980 20 0 FHADHM O=C(C[C@@H]1CCCc2ccccc21)OCc1ccc(-c2nnn[n-]2)cc1F ZINC000737822709 598515123 /nfs/dbraw/zinc/51/51/23/598515123.db2.gz OGFZMHGWOYYAMC-AWEZNQCLSA-N -1 3 366.396 3.559 20 0 FHADHM O=C(C[C@@H]1CCCc2ccccc21)OCc1ccc(-c2nn[n-]n2)cc1F ZINC000737822709 598515124 /nfs/dbraw/zinc/51/51/24/598515124.db2.gz OGFZMHGWOYYAMC-AWEZNQCLSA-N -1 3 366.396 3.559 20 0 FHADHM CCCC[C@H]1CCC[C@H]1NC(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000736441741 598519570 /nfs/dbraw/zinc/51/95/70/598519570.db2.gz UEOUPACUCMLZLD-DOTOQJQBSA-N -1 3 373.526 3.575 20 0 FHADHM CCCC[C@H]1CCC[C@H]1NC(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000736441741 598519572 /nfs/dbraw/zinc/51/95/72/598519572.db2.gz UEOUPACUCMLZLD-DOTOQJQBSA-N -1 3 373.526 3.575 20 0 FHADHM Cc1c(NCc2ccccc2-c2nnn[n-]2)cccc1OCC(F)(F)F ZINC000737219025 598522939 /nfs/dbraw/zinc/52/29/39/598522939.db2.gz OTGFHFWABZBGGP-UHFFFAOYSA-N -1 3 363.343 3.728 20 0 FHADHM Cc1c(NCc2ccccc2-c2nn[n-]n2)cccc1OCC(F)(F)F ZINC000737219025 598522940 /nfs/dbraw/zinc/52/29/40/598522940.db2.gz OTGFHFWABZBGGP-UHFFFAOYSA-N -1 3 363.343 3.728 20 0 FHADHM Fc1cccc(N[C@@H]2CCc3c2cccc3Br)c1-c1nnn[n-]1 ZINC000737659998 598523636 /nfs/dbraw/zinc/52/36/36/598523636.db2.gz HJRSBZULHPWVCB-CYBMUJFWSA-N -1 3 374.217 3.868 20 0 FHADHM Fc1cccc(N[C@@H]2CCc3c2cccc3Br)c1-c1nn[n-]n1 ZINC000737659998 598523638 /nfs/dbraw/zinc/52/36/38/598523638.db2.gz HJRSBZULHPWVCB-CYBMUJFWSA-N -1 3 374.217 3.868 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@@H]1NC(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000735796849 598528422 /nfs/dbraw/zinc/52/84/22/598528422.db2.gz IUVLXDNZKBUTTO-WMZOPIPTSA-N -1 3 370.501 3.613 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@@H]1NC(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000735796849 598528424 /nfs/dbraw/zinc/52/84/24/598528424.db2.gz IUVLXDNZKBUTTO-WMZOPIPTSA-N -1 3 370.501 3.613 20 0 FHADHM CCCC[C@@H]1CCC[C@@H]1NC(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736442273 598528680 /nfs/dbraw/zinc/52/86/80/598528680.db2.gz WDYXBRAXRRWGPY-LXZKKBNFSA-N -1 3 356.474 3.586 20 0 FHADHM CCCC[C@@H]1CCC[C@@H]1NC(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736442273 598528681 /nfs/dbraw/zinc/52/86/81/598528681.db2.gz WDYXBRAXRRWGPY-LXZKKBNFSA-N -1 3 356.474 3.586 20 0 FHADHM O=C(Nc1sccc1-c1nnn[n-]1)[C@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000738206757 598534087 /nfs/dbraw/zinc/53/40/87/598534087.db2.gz GWMDKVFJTKNRDB-CVEARBPZSA-N -1 3 361.430 3.824 20 0 FHADHM O=C(Nc1sccc1-c1nn[n-]n1)[C@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000738206757 598534089 /nfs/dbraw/zinc/53/40/89/598534089.db2.gz GWMDKVFJTKNRDB-CVEARBPZSA-N -1 3 361.430 3.824 20 0 FHADHM O=C(OCc1ccc(-c2nnn[n-]2)cc1)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000738236303 598544621 /nfs/dbraw/zinc/54/46/21/598544621.db2.gz ITVKJHUYVMZIRP-WOJBJXKFSA-N -1 3 370.412 3.867 20 0 FHADHM O=C(OCc1ccc(-c2nn[n-]n2)cc1)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000738236303 598544623 /nfs/dbraw/zinc/54/46/23/598544623.db2.gz ITVKJHUYVMZIRP-WOJBJXKFSA-N -1 3 370.412 3.867 20 0 FHADHM Cc1occc1C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000737556497 598555455 /nfs/dbraw/zinc/55/54/55/598555455.db2.gz KMVMDLIDOIAADI-UHFFFAOYSA-N -1 3 361.361 3.813 20 0 FHADHM Cc1occc1C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000737556497 598555457 /nfs/dbraw/zinc/55/54/57/598555457.db2.gz KMVMDLIDOIAADI-UHFFFAOYSA-N -1 3 361.361 3.813 20 0 FHADHM CCCCC[C@@H](C)NC(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(F)F ZINC000736440528 598560666 /nfs/dbraw/zinc/56/06/66/598560666.db2.gz CTQRDZYWWUUABR-SNVBAGLBSA-N -1 3 368.388 3.558 20 0 FHADHM CCCCC[C@@H](C)NC(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(F)F ZINC000736440528 598560668 /nfs/dbraw/zinc/56/06/68/598560668.db2.gz CTQRDZYWWUUABR-SNVBAGLBSA-N -1 3 368.388 3.558 20 0 FHADHM Cc1noc([C@H](C)Nc2ccc(Oc3cccc(-c4nnn[n-]4)c3)cc2)n1 ZINC000737538821 598560662 /nfs/dbraw/zinc/56/06/62/598560662.db2.gz PTWXTWDYHFJNNO-NSHDSACASA-N -1 3 363.381 3.524 20 0 FHADHM Cc1noc([C@H](C)Nc2ccc(Oc3cccc(-c4nn[n-]n4)c3)cc2)n1 ZINC000737538821 598560664 /nfs/dbraw/zinc/56/06/64/598560664.db2.gz PTWXTWDYHFJNNO-NSHDSACASA-N -1 3 363.381 3.524 20 0 FHADHM CC(C)[C@H](C)NC(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000735709136 598564571 /nfs/dbraw/zinc/56/45/71/598564571.db2.gz PNBOOBZYEGIJKI-ZDUSSCGKSA-N -1 3 366.425 3.825 20 0 FHADHM CC(C)[C@H](C)NC(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000735709136 598564573 /nfs/dbraw/zinc/56/45/73/598564573.db2.gz PNBOOBZYEGIJKI-ZDUSSCGKSA-N -1 3 366.425 3.825 20 0 FHADHM C[C@@H]1CCN(C(=O)Nc2ccc(Oc3cccc(-c4nnn[n-]4)c3)cc2)C1 ZINC000736276440 598565295 /nfs/dbraw/zinc/56/52/95/598565295.db2.gz HUJTVFVTJZXYAA-CYBMUJFWSA-N -1 3 364.409 3.533 20 0 FHADHM C[C@@H]1CCN(C(=O)Nc2ccc(Oc3cccc(-c4nn[n-]n4)c3)cc2)C1 ZINC000736276440 598565296 /nfs/dbraw/zinc/56/52/96/598565296.db2.gz HUJTVFVTJZXYAA-CYBMUJFWSA-N -1 3 364.409 3.533 20 0 FHADHM CN(C(=O)CCCCCc1cccs1)c1ccc(-c2nnn[n-]2)cc1F ZINC000736733848 598569561 /nfs/dbraw/zinc/56/95/61/598569561.db2.gz XYSBGZOMMRAKGR-UHFFFAOYSA-N -1 3 373.457 3.833 20 0 FHADHM CN(C(=O)CCCCCc1cccs1)c1ccc(-c2nn[n-]n2)cc1F ZINC000736733848 598569563 /nfs/dbraw/zinc/56/95/63/598569563.db2.gz XYSBGZOMMRAKGR-UHFFFAOYSA-N -1 3 373.457 3.833 20 0 FHADHM COc1ccccc1CN(C)c1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000737148944 598571378 /nfs/dbraw/zinc/57/13/78/598571378.db2.gz CIEMUHQCXVXOGA-UHFFFAOYSA-N -1 3 363.343 3.531 20 0 FHADHM COc1ccccc1CN(C)c1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000737148944 598571379 /nfs/dbraw/zinc/57/13/79/598571379.db2.gz CIEMUHQCXVXOGA-UHFFFAOYSA-N -1 3 363.343 3.531 20 0 FHADHM COc1ccc(CNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)cc1F ZINC000737095789 598572791 /nfs/dbraw/zinc/57/27/91/598572791.db2.gz NQGSHVDRHPWZNF-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM COc1ccc(CNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)cc1F ZINC000737095789 598572792 /nfs/dbraw/zinc/57/27/92/598572792.db2.gz NQGSHVDRHPWZNF-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM Cc1cc([C@@H]2CCCN2c2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)no1 ZINC000737266279 598573436 /nfs/dbraw/zinc/57/34/36/598573436.db2.gz YDDRFTBOFJVKPW-AWEZNQCLSA-N -1 3 364.331 3.523 20 0 FHADHM Cc1cc([C@@H]2CCCN2c2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)no1 ZINC000737266279 598573437 /nfs/dbraw/zinc/57/34/37/598573437.db2.gz YDDRFTBOFJVKPW-AWEZNQCLSA-N -1 3 364.331 3.523 20 0 FHADHM Cc1cc([C@H]2CCCN2c2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)no1 ZINC000737266281 598573696 /nfs/dbraw/zinc/57/36/96/598573696.db2.gz YDDRFTBOFJVKPW-CQSZACIVSA-N -1 3 364.331 3.523 20 0 FHADHM Cc1cc([C@H]2CCCN2c2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)no1 ZINC000737266281 598573698 /nfs/dbraw/zinc/57/36/98/598573698.db2.gz YDDRFTBOFJVKPW-CQSZACIVSA-N -1 3 364.331 3.523 20 0 FHADHM CCCO[C@H]1CCCN(c2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)CC1 ZINC000736489627 598580208 /nfs/dbraw/zinc/58/02/08/598580208.db2.gz XYRRABWRNOFZHU-ZDUSSCGKSA-N -1 3 369.391 3.671 20 0 FHADHM CCCO[C@H]1CCCN(c2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)CC1 ZINC000736489627 598580209 /nfs/dbraw/zinc/58/02/09/598580209.db2.gz XYRRABWRNOFZHU-ZDUSSCGKSA-N -1 3 369.391 3.671 20 0 FHADHM Fc1ccccc1-c1nc(CSc2cc(-c3nnn[n-]3)ccn2)cs1 ZINC000737665568 598580854 /nfs/dbraw/zinc/58/08/54/598580854.db2.gz SDLBVOBVDVATQZ-UHFFFAOYSA-N -1 3 370.438 3.817 20 0 FHADHM Fc1ccccc1-c1nc(CSc2cc(-c3nn[n-]n3)ccn2)cs1 ZINC000737665568 598580855 /nfs/dbraw/zinc/58/08/55/598580855.db2.gz SDLBVOBVDVATQZ-UHFFFAOYSA-N -1 3 370.438 3.817 20 0 FHADHM Cc1nc(-c2ccccc2)ccc1C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000737463460 598588279 /nfs/dbraw/zinc/58/82/79/598588279.db2.gz SQLYZSLPLYLBIW-UHFFFAOYSA-N -1 3 374.379 3.629 20 0 FHADHM Cc1nc(-c2ccccc2)ccc1C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000737463460 598588280 /nfs/dbraw/zinc/58/82/80/598588280.db2.gz SQLYZSLPLYLBIW-UHFFFAOYSA-N -1 3 374.379 3.629 20 0 FHADHM CC[C@@H](C)[C@@H](C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccccc1 ZINC000736335678 598590056 /nfs/dbraw/zinc/59/00/56/598590056.db2.gz ZKPPYQNMVPFDOU-SJKOYZFVSA-N -1 3 353.401 3.774 20 0 FHADHM CC[C@@H](C)[C@@H](C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccccc1 ZINC000736335678 598590057 /nfs/dbraw/zinc/59/00/57/598590057.db2.gz ZKPPYQNMVPFDOU-SJKOYZFVSA-N -1 3 353.401 3.774 20 0 FHADHM CC(C)CCOc1ccc(C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)cc1 ZINC000735820812 598590101 /nfs/dbraw/zinc/59/01/01/598590101.db2.gz WYXNFLCDFYSHKS-UHFFFAOYSA-N -1 3 369.400 3.683 20 0 FHADHM CC(C)CCOc1ccc(C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)cc1 ZINC000735820812 598590103 /nfs/dbraw/zinc/59/01/03/598590103.db2.gz WYXNFLCDFYSHKS-UHFFFAOYSA-N -1 3 369.400 3.683 20 0 FHADHM Fc1ccc(NCc2ncc(-c3cccc(Cl)c3)o2)cc1-c1nnn[n-]1 ZINC000737656079 598602460 /nfs/dbraw/zinc/60/24/60/598602460.db2.gz HSFGFBFGFCSCEH-UHFFFAOYSA-N -1 3 370.775 3.926 20 0 FHADHM Fc1ccc(NCc2ncc(-c3cccc(Cl)c3)o2)cc1-c1nn[n-]n1 ZINC000737656079 598602462 /nfs/dbraw/zinc/60/24/62/598602462.db2.gz HSFGFBFGFCSCEH-UHFFFAOYSA-N -1 3 370.775 3.926 20 0 FHADHM C[C@H](Oc1ccc(-c2nn[n-]n2)cc1)c1nc(-c2cccc(Cl)c2)no1 ZINC000736167711 598608591 /nfs/dbraw/zinc/60/85/91/598608591.db2.gz HHPJHZXXEXSVBJ-JTQLQIEISA-N -1 3 368.784 3.710 20 0 FHADHM C[C@@H](Sc1cccs1)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736191030 598613489 /nfs/dbraw/zinc/61/34/89/598613489.db2.gz GXZOFYLFJVNBRX-MRVPVSSYSA-N -1 3 365.871 3.701 20 0 FHADHM C[C@@H](Sc1cccs1)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736191030 598613491 /nfs/dbraw/zinc/61/34/91/598613491.db2.gz GXZOFYLFJVNBRX-MRVPVSSYSA-N -1 3 365.871 3.701 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)N(CC1CCCCC1)C1CC1 ZINC000738161606 598630083 /nfs/dbraw/zinc/63/00/83/598630083.db2.gz GWAGVCHVWGKFAW-UHFFFAOYSA-N -1 3 358.421 3.582 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)N(CC1CCCCC1)C1CC1 ZINC000738161606 598630085 /nfs/dbraw/zinc/63/00/85/598630085.db2.gz GWAGVCHVWGKFAW-UHFFFAOYSA-N -1 3 358.421 3.582 20 0 FHADHM CC(C)[C@H](CNC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccccc1 ZINC000735711828 598631782 /nfs/dbraw/zinc/63/17/82/598631782.db2.gz YPLPIQZDBNOZQU-INIZCTEOSA-N -1 3 368.416 3.567 20 0 FHADHM CC(C)[C@H](CNC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccccc1 ZINC000735711828 598631784 /nfs/dbraw/zinc/63/17/84/598631784.db2.gz YPLPIQZDBNOZQU-INIZCTEOSA-N -1 3 368.416 3.567 20 0 FHADHM O=C(CCSCCCc1ccccc1)Nc1ccccc1-c1nnn[n-]1 ZINC000737850428 598644408 /nfs/dbraw/zinc/64/44/08/598644408.db2.gz XTOXSJORGJKZFU-UHFFFAOYSA-N -1 3 367.478 3.561 20 0 FHADHM O=C(CCSCCCc1ccccc1)Nc1ccccc1-c1nn[n-]n1 ZINC000737850428 598644410 /nfs/dbraw/zinc/64/44/10/598644410.db2.gz XTOXSJORGJKZFU-UHFFFAOYSA-N -1 3 367.478 3.561 20 0 FHADHM Cc1cc(C)cc(OC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)c1 ZINC000737250242 598645120 /nfs/dbraw/zinc/64/51/20/598645120.db2.gz KSOFRJMNCKYJIA-UHFFFAOYSA-N -1 3 366.421 3.638 20 0 FHADHM Cc1cc(C)cc(OC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)c1 ZINC000737250242 598645122 /nfs/dbraw/zinc/64/51/22/598645122.db2.gz KSOFRJMNCKYJIA-UHFFFAOYSA-N -1 3 366.421 3.638 20 0 FHADHM C[C@@H](OC(=O)CCCCOc1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000736148293 598645924 /nfs/dbraw/zinc/64/59/24/598645924.db2.gz GTOUPZAJMHEWOX-OAHLLOKOSA-N -1 3 366.421 3.720 20 0 FHADHM C[C@@H](OC(=O)CCCCOc1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000736148293 598645926 /nfs/dbraw/zinc/64/59/26/598645926.db2.gz GTOUPZAJMHEWOX-OAHLLOKOSA-N -1 3 366.421 3.720 20 0 FHADHM C[C@@H](CSc1ccccc1)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736046444 598646123 /nfs/dbraw/zinc/64/61/23/598646123.db2.gz JSVYFAHXYPQGOP-NSHDSACASA-N -1 3 373.869 3.887 20 0 FHADHM C[C@@H](CSc1ccccc1)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736046444 598646125 /nfs/dbraw/zinc/64/61/25/598646125.db2.gz JSVYFAHXYPQGOP-NSHDSACASA-N -1 3 373.869 3.887 20 0 FHADHM O=C(C[C@@H](c1ccccc1)C(F)(F)F)Nc1cccc(-c2nnn[n-]2)c1 ZINC000103065629 598646683 /nfs/dbraw/zinc/64/66/83/598646683.db2.gz HEEYYERNZGKNQM-AWEZNQCLSA-N -1 3 361.327 3.541 20 0 FHADHM O=C(C[C@@H](c1ccccc1)C(F)(F)F)Nc1cccc(-c2nn[n-]n2)c1 ZINC000103065629 598646685 /nfs/dbraw/zinc/64/66/85/598646685.db2.gz HEEYYERNZGKNQM-AWEZNQCLSA-N -1 3 361.327 3.541 20 0 FHADHM COc1ccccc1[C@H](C)CC(=O)Nc1sc(C)c(C)c1-c1nnn[n-]1 ZINC000737142360 598647278 /nfs/dbraw/zinc/64/72/78/598647278.db2.gz NBAWOWWRAGEXGE-SNVBAGLBSA-N -1 3 371.466 3.686 20 0 FHADHM COc1ccccc1[C@H](C)CC(=O)Nc1sc(C)c(C)c1-c1nn[n-]n1 ZINC000737142360 598647280 /nfs/dbraw/zinc/64/72/80/598647280.db2.gz NBAWOWWRAGEXGE-SNVBAGLBSA-N -1 3 371.466 3.686 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1OC(=O)C[C@H](c1ccccc1)C(C)C ZINC000737024055 598648852 /nfs/dbraw/zinc/64/88/52/598648852.db2.gz JMFKJBUJQFYTMC-INIZCTEOSA-N -1 3 366.421 3.611 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1OC(=O)C[C@H](c1ccccc1)C(C)C ZINC000737024055 598648853 /nfs/dbraw/zinc/64/88/53/598648853.db2.gz JMFKJBUJQFYTMC-INIZCTEOSA-N -1 3 366.421 3.611 20 0 FHADHM COc1ccccc1[C@@H](C)CC(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000737141666 598650747 /nfs/dbraw/zinc/65/07/47/598650747.db2.gz JCIPZKIZLLOZFW-NSHDSACASA-N -1 3 371.828 3.661 20 0 FHADHM COc1ccccc1[C@@H](C)CC(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000737141666 598650750 /nfs/dbraw/zinc/65/07/50/598650750.db2.gz JCIPZKIZLLOZFW-NSHDSACASA-N -1 3 371.828 3.661 20 0 FHADHM CC(C)N(C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)C1CC1 ZINC000735856120 598651244 /nfs/dbraw/zinc/65/12/44/598651244.db2.gz DEQKKHQFRGJCOO-UHFFFAOYSA-N -1 3 363.421 3.672 20 0 FHADHM CC(C)N(C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)C1CC1 ZINC000735856120 598651245 /nfs/dbraw/zinc/65/12/45/598651245.db2.gz DEQKKHQFRGJCOO-UHFFFAOYSA-N -1 3 363.421 3.672 20 0 FHADHM COc1ccc([C@@H](C)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1OC ZINC000737075101 598653022 /nfs/dbraw/zinc/65/30/22/598653022.db2.gz KNTJWEDIWIIPAQ-SNVBAGLBSA-N -1 3 359.817 3.710 20 0 FHADHM COc1ccc([C@@H](C)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1OC ZINC000737075101 598653024 /nfs/dbraw/zinc/65/30/24/598653024.db2.gz KNTJWEDIWIIPAQ-SNVBAGLBSA-N -1 3 359.817 3.710 20 0 FHADHM C[C@@H](CNc1ccc(-c2nnn[n-]2)c(Cl)c1)COCc1ccccc1 ZINC000736026979 598655731 /nfs/dbraw/zinc/65/57/31/598655731.db2.gz UBIFTKBTSJDDJL-ZDUSSCGKSA-N -1 3 357.845 3.785 20 0 FHADHM C[C@@H](CNc1ccc(-c2nn[n-]n2)c(Cl)c1)COCc1ccccc1 ZINC000736026979 598655733 /nfs/dbraw/zinc/65/57/33/598655733.db2.gz UBIFTKBTSJDDJL-ZDUSSCGKSA-N -1 3 357.845 3.785 20 0 FHADHM Cc1cc(C)c(-c2nnn[n-]2)c(N2CC[C@@H](c3ccc(Cl)cc3)C2)n1 ZINC000737247072 598679538 /nfs/dbraw/zinc/67/95/38/598679538.db2.gz YPIRHEOEEMAFRQ-CQSZACIVSA-N -1 3 354.845 3.526 20 0 FHADHM Cc1cc(C)c(-c2nn[n-]n2)c(N2CC[C@@H](c3ccc(Cl)cc3)C2)n1 ZINC000737247072 598679540 /nfs/dbraw/zinc/67/95/40/598679540.db2.gz YPIRHEOEEMAFRQ-CQSZACIVSA-N -1 3 354.845 3.526 20 0 FHADHM Fc1cc(-c2nnn[n-]2)cc(F)c1N1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000737639805 598680486 /nfs/dbraw/zinc/68/04/86/598680486.db2.gz SWJVAXBEZNWTQY-LLVKDONJSA-N -1 3 361.783 3.792 20 0 FHADHM Fc1cc(-c2nn[n-]n2)cc(F)c1N1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000737639805 598680487 /nfs/dbraw/zinc/68/04/87/598680487.db2.gz SWJVAXBEZNWTQY-LLVKDONJSA-N -1 3 361.783 3.792 20 0 FHADHM Fc1ccccc1CC1CCN(c2ncc(-c3nnn[n-]3)cc2Cl)CC1 ZINC000737671102 598681771 /nfs/dbraw/zinc/68/17/71/598681771.db2.gz YGZKDAYNIREJDL-UHFFFAOYSA-N -1 3 372.835 3.513 20 0 FHADHM Fc1ccccc1CC1CCN(c2ncc(-c3nn[n-]n3)cc2Cl)CC1 ZINC000737671102 598681773 /nfs/dbraw/zinc/68/17/73/598681773.db2.gz YGZKDAYNIREJDL-UHFFFAOYSA-N -1 3 372.835 3.513 20 0 FHADHM C[C@@H](OC(=O)CSc1ccc(-c2nnn[n-]2)cc1)c1cccc(Cl)c1 ZINC000736155004 598713229 /nfs/dbraw/zinc/71/32/29/598713229.db2.gz FKFQXKBZYSVNNF-LLVKDONJSA-N -1 3 374.853 3.917 20 0 FHADHM C[C@@H](OC(=O)CSc1ccc(-c2nn[n-]n2)cc1)c1cccc(Cl)c1 ZINC000736155004 598713232 /nfs/dbraw/zinc/71/32/32/598713232.db2.gz FKFQXKBZYSVNNF-LLVKDONJSA-N -1 3 374.853 3.917 20 0 FHADHM CCC1CCC(N(C)C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)CC1 ZINC000736396069 598724332 /nfs/dbraw/zinc/72/43/32/598724332.db2.gz LOLZMXFWDJZNJE-UHFFFAOYSA-N -1 3 362.865 3.953 20 0 FHADHM CCC1CCC(N(C)C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)CC1 ZINC000736396069 598724333 /nfs/dbraw/zinc/72/43/33/598724333.db2.gz LOLZMXFWDJZNJE-UHFFFAOYSA-N -1 3 362.865 3.953 20 0 FHADHM C[C@@H](NC(=O)N1CCCC2(CCCCC2)C1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736113499 598728824 /nfs/dbraw/zinc/72/88/24/598728824.db2.gz OSTFCWINSPFCDZ-OAHLLOKOSA-N -1 3 368.485 3.684 20 0 FHADHM C[C@@H](NC(=O)N1CCCC2(CCCCC2)C1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736113499 598728826 /nfs/dbraw/zinc/72/88/26/598728826.db2.gz OSTFCWINSPFCDZ-OAHLLOKOSA-N -1 3 368.485 3.684 20 0 FHADHM COc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)CCCC(C)(C)C ZINC000737026422 598735048 /nfs/dbraw/zinc/73/50/48/598735048.db2.gz SICQSTYVGIIUHV-UHFFFAOYSA-N -1 3 352.822 3.651 20 0 FHADHM COc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)CCCC(C)(C)C ZINC000737026422 598735049 /nfs/dbraw/zinc/73/50/49/598735049.db2.gz SICQSTYVGIIUHV-UHFFFAOYSA-N -1 3 352.822 3.651 20 0 FHADHM Cc1ccccc1CCC(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(C)C ZINC000737426143 598736895 /nfs/dbraw/zinc/73/68/95/598736895.db2.gz KEDRTPRELAJGQQ-UHFFFAOYSA-N -1 3 365.437 3.534 20 0 FHADHM Cc1ccccc1CCC(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(C)C ZINC000737426143 598736896 /nfs/dbraw/zinc/73/68/96/598736896.db2.gz KEDRTPRELAJGQQ-UHFFFAOYSA-N -1 3 365.437 3.534 20 0 FHADHM Clc1ccc(NCc2cc(-c3ccccc3)no2)c(-c2nnn[n-]2)c1 ZINC000737573407 598744793 /nfs/dbraw/zinc/74/47/93/598744793.db2.gz GZIPVVNBHNAJGR-UHFFFAOYSA-N -1 3 352.785 3.787 20 0 FHADHM Clc1ccc(NCc2cc(-c3ccccc3)no2)c(-c2nn[n-]n2)c1 ZINC000737573407 598744794 /nfs/dbraw/zinc/74/47/94/598744794.db2.gz GZIPVVNBHNAJGR-UHFFFAOYSA-N -1 3 352.785 3.787 20 0 FHADHM CCS[C@@H]1CCCCN(c2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)C1 ZINC000736668228 598749112 /nfs/dbraw/zinc/74/91/12/598749112.db2.gz YYRUYZJXUAFOEL-GFCCVEGCSA-N -1 3 371.432 3.998 20 0 FHADHM CCS[C@@H]1CCCCN(c2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)C1 ZINC000736668228 598749113 /nfs/dbraw/zinc/74/91/13/598749113.db2.gz YYRUYZJXUAFOEL-GFCCVEGCSA-N -1 3 371.432 3.998 20 0 FHADHM Cc1ccccc1[C@@H](CC(C)C)NC(=O)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000737424040 598764910 /nfs/dbraw/zinc/76/49/10/598764910.db2.gz UHRJMTJCOZLPNL-LJQANCHMSA-N -1 3 363.465 3.621 20 0 FHADHM Cc1ccccc1[C@@H](CC(C)C)NC(=O)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000737424040 598764912 /nfs/dbraw/zinc/76/49/12/598764912.db2.gz UHRJMTJCOZLPNL-LJQANCHMSA-N -1 3 363.465 3.621 20 0 FHADHM C[C@H](Nc1c(-c2nnn[n-]2)cnc2c(F)cc(F)cc21)c1cccs1 ZINC000736137903 598770115 /nfs/dbraw/zinc/77/01/15/598770115.db2.gz MOSAGLXDHJTURQ-QMMMGPOBSA-N -1 3 358.377 3.928 20 0 FHADHM C[C@H](Nc1c(-c2nn[n-]n2)cnc2c(F)cc(F)cc21)c1cccs1 ZINC000736137903 598770117 /nfs/dbraw/zinc/77/01/17/598770117.db2.gz MOSAGLXDHJTURQ-QMMMGPOBSA-N -1 3 358.377 3.928 20 0 FHADHM Cc1ccc(CN(C)c2c(-c3nnn[n-]3)cnc3c(F)cc(F)cc32)cc1 ZINC000737341618 598770876 /nfs/dbraw/zinc/77/08/76/598770876.db2.gz NKAUGLXIQIBWMO-UHFFFAOYSA-N -1 3 366.375 3.638 20 0 FHADHM Cc1ccc(CN(C)c2c(-c3nn[n-]n3)cnc3c(F)cc(F)cc32)cc1 ZINC000737341618 598770878 /nfs/dbraw/zinc/77/08/78/598770878.db2.gz NKAUGLXIQIBWMO-UHFFFAOYSA-N -1 3 366.375 3.638 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1N[C@H](C)c1ccc(Br)cc1 ZINC000737062402 598776759 /nfs/dbraw/zinc/77/67/59/598776759.db2.gz KLPCMXLDMVMYDZ-SNVBAGLBSA-N -1 3 374.242 3.811 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1N[C@H](C)c1ccc(Br)cc1 ZINC000737062402 598776761 /nfs/dbraw/zinc/77/67/61/598776761.db2.gz KLPCMXLDMVMYDZ-SNVBAGLBSA-N -1 3 374.242 3.811 20 0 FHADHM CC[C@@H](CC(=O)OCc1cc(-c2nnn[n-]2)ccc1F)c1ccccc1 ZINC000736334390 598780953 /nfs/dbraw/zinc/78/09/53/598780953.db2.gz HCGSDJJSXPSTEY-ZDUSSCGKSA-N -1 3 354.385 3.633 20 0 FHADHM CC[C@@H](CC(=O)OCc1cc(-c2nn[n-]n2)ccc1F)c1ccccc1 ZINC000736334390 598780954 /nfs/dbraw/zinc/78/09/54/598780954.db2.gz HCGSDJJSXPSTEY-ZDUSSCGKSA-N -1 3 354.385 3.633 20 0 FHADHM CC(C)CN(C(=O)[C@@H]1CCc2ccccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000735819556 598790275 /nfs/dbraw/zinc/79/02/75/598790275.db2.gz XUZVXRRVCKVYEP-LJQANCHMSA-N -1 3 361.449 3.586 20 0 FHADHM CC(C)CN(C(=O)[C@@H]1CCc2ccccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000735819556 598790277 /nfs/dbraw/zinc/79/02/77/598790277.db2.gz XUZVXRRVCKVYEP-LJQANCHMSA-N -1 3 361.449 3.586 20 0 FHADHM Fc1ccc(N2CC[C@@H](CNc3ccc(Cl)cc3-c3nnn[n-]3)C2)cc1 ZINC000737660274 598794763 /nfs/dbraw/zinc/79/47/63/598794763.db2.gz PMPUBGKNETYURN-LBPRGKRZSA-N -1 3 372.835 3.598 20 0 FHADHM Fc1ccc(N2CC[C@@H](CNc3ccc(Cl)cc3-c3nn[n-]n3)C2)cc1 ZINC000737660274 598794764 /nfs/dbraw/zinc/79/47/64/598794764.db2.gz PMPUBGKNETYURN-LBPRGKRZSA-N -1 3 372.835 3.598 20 0 FHADHM CC(C)[C@H](c1ccccc1)N(C)C(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000735736317 598797969 /nfs/dbraw/zinc/79/79/69/598797969.db2.gz RXUFPJXCAWILDY-QGZVFWFLSA-N -1 3 350.426 3.728 20 0 FHADHM CC(C)[C@H](c1ccccc1)N(C)C(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000735736317 598797971 /nfs/dbraw/zinc/79/79/71/598797971.db2.gz RXUFPJXCAWILDY-QGZVFWFLSA-N -1 3 350.426 3.728 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)N1CCC[C@H]1c1ccc(F)c(F)c1 ZINC000738178155 598799438 /nfs/dbraw/zinc/79/94/38/598799438.db2.gz GDGXHKFBNSWSQN-INIZCTEOSA-N -1 3 370.363 3.514 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)N1CCC[C@H]1c1ccc(F)c(F)c1 ZINC000738178155 598799439 /nfs/dbraw/zinc/79/94/39/598799439.db2.gz GDGXHKFBNSWSQN-INIZCTEOSA-N -1 3 370.363 3.514 20 0 FHADHM CC[C@@H](OC1CCCC1)C(=O)N(CC(C)C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736379663 598804111 /nfs/dbraw/zinc/80/41/11/598804111.db2.gz VIMJXEZHBNPRTR-GOSISDBHSA-N -1 3 371.485 3.594 20 0 FHADHM CC[C@@H](OC1CCCC1)C(=O)N(CC(C)C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736379663 598804113 /nfs/dbraw/zinc/80/41/13/598804113.db2.gz VIMJXEZHBNPRTR-GOSISDBHSA-N -1 3 371.485 3.594 20 0 FHADHM CC(C)CN(C(=O)c1cnc(C2CC2)s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000735818613 598819453 /nfs/dbraw/zinc/81/94/53/598819453.db2.gz ONFIPAFJUKCCCG-UHFFFAOYSA-N -1 3 368.466 3.503 20 0 FHADHM CC(C)CN(C(=O)c1cnc(C2CC2)s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000735818613 598819454 /nfs/dbraw/zinc/81/94/54/598819454.db2.gz ONFIPAFJUKCCCG-UHFFFAOYSA-N -1 3 368.466 3.503 20 0 FHADHM CCC/C=C\C(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736440018 598821079 /nfs/dbraw/zinc/82/10/79/598821079.db2.gz WZMYRRPPLGLVJJ-YWEYNIOJSA-N -1 3 363.421 3.741 20 0 FHADHM CCC/C=C\C(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736440018 598821081 /nfs/dbraw/zinc/82/10/81/598821081.db2.gz WZMYRRPPLGLVJJ-YWEYNIOJSA-N -1 3 363.421 3.741 20 0 FHADHM Cc1ccc(N(C)C(=O)C=Cc2ccccc2-c2nnn[n-]2)cc1Cl ZINC000737347352 598822756 /nfs/dbraw/zinc/82/27/56/598822756.db2.gz NUNFXSUCUGDLQX-NTMALXAHSA-N -1 3 353.813 3.505 20 0 FHADHM Cc1ccc(N(C)C(=O)C=Cc2ccccc2-c2nn[n-]n2)cc1Cl ZINC000737347352 598822757 /nfs/dbraw/zinc/82/27/57/598822757.db2.gz NUNFXSUCUGDLQX-NTMALXAHSA-N -1 3 353.813 3.505 20 0 FHADHM CN(C(=O)CCSc1ccc(Cl)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736732186 599310500 /nfs/dbraw/zinc/31/05/00/599310500.db2.gz LCNAHQOYHPLYAX-UHFFFAOYSA-N -1 3 373.869 3.665 20 0 FHADHM CN(C(=O)CCSc1ccc(Cl)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736732186 599310503 /nfs/dbraw/zinc/31/05/03/599310503.db2.gz LCNAHQOYHPLYAX-UHFFFAOYSA-N -1 3 373.869 3.665 20 0 FHADHM CCN(C(=O)[C@H]1CCC[C@H](C(F)(F)F)C1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736501303 599310781 /nfs/dbraw/zinc/31/07/81/599310781.db2.gz CIDYTXCACBKMGU-STQMWFEESA-N -1 3 367.375 3.588 20 0 FHADHM CCN(C(=O)[C@H]1CCC[C@H](C(F)(F)F)C1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736501303 599310783 /nfs/dbraw/zinc/31/07/83/599310783.db2.gz CIDYTXCACBKMGU-STQMWFEESA-N -1 3 367.375 3.588 20 0 FHADHM CC(=O)c1c(F)cccc1NCCSCc1ccccc1-c1nnn[n-]1 ZINC000819834085 599310944 /nfs/dbraw/zinc/31/09/44/599310944.db2.gz LOTZZDJZIDFYMT-UHFFFAOYSA-N -1 3 371.441 3.554 20 0 FHADHM CC(=O)c1c(F)cccc1NCCSCc1ccccc1-c1nn[n-]n1 ZINC000819834085 599310947 /nfs/dbraw/zinc/31/09/47/599310947.db2.gz LOTZZDJZIDFYMT-UHFFFAOYSA-N -1 3 371.441 3.554 20 0 FHADHM C[C@@H](S[C@H](C)c1ccc(-c2nnn[n-]2)cc1)C(=O)N(C)c1ccccc1 ZINC000736189701 599325776 /nfs/dbraw/zinc/32/57/76/599325776.db2.gz QKOCAUALMLLTPX-ZIAGYGMSSA-N -1 3 367.478 3.712 20 0 FHADHM C[C@@H](S[C@H](C)c1ccc(-c2nn[n-]n2)cc1)C(=O)N(C)c1ccccc1 ZINC000736189701 599325778 /nfs/dbraw/zinc/32/57/78/599325778.db2.gz QKOCAUALMLLTPX-ZIAGYGMSSA-N -1 3 367.478 3.712 20 0 FHADHM COCCOc1c(Cl)cccc1N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000737011491 599327075 /nfs/dbraw/zinc/32/70/75/599327075.db2.gz UTBGRQADUUDFRY-LBPRGKRZSA-N -1 3 373.844 3.718 20 0 FHADHM COCCOc1c(Cl)cccc1N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000737011491 599327078 /nfs/dbraw/zinc/32/70/78/599327078.db2.gz UTBGRQADUUDFRY-LBPRGKRZSA-N -1 3 373.844 3.718 20 0 FHADHM CCn1c(C)cc(C(=O)CS[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1C ZINC000736719980 599329403 /nfs/dbraw/zinc/32/94/03/599329403.db2.gz HZXHHMXXZPQLIV-CQSZACIVSA-N -1 3 369.494 3.982 20 0 FHADHM CCn1c(C)cc(C(=O)CS[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1C ZINC000736719980 599329405 /nfs/dbraw/zinc/32/94/05/599329405.db2.gz HZXHHMXXZPQLIV-CQSZACIVSA-N -1 3 369.494 3.982 20 0 FHADHM CC(C)(C)Oc1ccccc1NCCOc1cccc(-c2nnn[n-]2)c1 ZINC000735642965 599329802 /nfs/dbraw/zinc/32/98/02/599329802.db2.gz IJHHBENCDFLGMC-UHFFFAOYSA-N -1 3 353.426 3.535 20 0 FHADHM CC(C)(C)Oc1ccccc1NCCOc1cccc(-c2nn[n-]n2)c1 ZINC000735642965 599329805 /nfs/dbraw/zinc/32/98/05/599329805.db2.gz IJHHBENCDFLGMC-UHFFFAOYSA-N -1 3 353.426 3.535 20 0 FHADHM Brc1ccc(CSc2ccccc2-c2nnn[n-]2)s1 ZINC000819688158 599342044 /nfs/dbraw/zinc/34/20/44/599342044.db2.gz DWVKUDJASGUEJO-UHFFFAOYSA-N -1 3 353.270 3.983 20 0 FHADHM CC(C)[C@@H](Sc1ccccc1-c1nnn[n-]1)C(=O)NC1CCCCCC1 ZINC000820032607 599341930 /nfs/dbraw/zinc/34/19/30/599341930.db2.gz OJVWEFPMLURHQU-QGZVFWFLSA-N -1 3 373.526 3.822 20 0 FHADHM CC(C)[C@@H](Sc1ccccc1-c1nn[n-]n1)C(=O)NC1CCCCCC1 ZINC000820032607 599341933 /nfs/dbraw/zinc/34/19/33/599341933.db2.gz OJVWEFPMLURHQU-QGZVFWFLSA-N -1 3 373.526 3.822 20 0 FHADHM Brc1ccc(CSc2ccccc2-c2nn[n-]n2)s1 ZINC000819688158 599342047 /nfs/dbraw/zinc/34/20/47/599342047.db2.gz DWVKUDJASGUEJO-UHFFFAOYSA-N -1 3 353.270 3.983 20 0 FHADHM Fc1ccc(-c2cc(CSc3ccccc3-c3nnn[n-]3)on2)cc1 ZINC000822753130 599345100 /nfs/dbraw/zinc/34/51/00/599345100.db2.gz FUZFTGFYHAQEEJ-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM Fc1ccc(-c2cc(CSc3ccccc3-c3nn[n-]n3)on2)cc1 ZINC000822753130 599345103 /nfs/dbraw/zinc/34/51/03/599345103.db2.gz FUZFTGFYHAQEEJ-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM CC(C)[C@@H](Sc1ccccc1-c1nnn[n-]1)C(=O)Nc1ccccc1F ZINC000820031324 599348967 /nfs/dbraw/zinc/34/89/67/599348967.db2.gz CEGKWAZIGKZJJT-MRXNPFEDSA-N -1 3 371.441 3.761 20 0 FHADHM CC(C)[C@@H](Sc1ccccc1-c1nn[n-]n1)C(=O)Nc1ccccc1F ZINC000820031324 599348969 /nfs/dbraw/zinc/34/89/69/599348969.db2.gz CEGKWAZIGKZJJT-MRXNPFEDSA-N -1 3 371.441 3.761 20 0 FHADHM COc1ccc(-c2cnc(CSc3ccccc3-c3nnn[n-]3)o2)cc1 ZINC000821732661 599349776 /nfs/dbraw/zinc/34/97/76/599349776.db2.gz RSESGWMDIPPKHB-UHFFFAOYSA-N -1 3 365.418 3.823 20 0 FHADHM COc1ccc(-c2cnc(CSc3ccccc3-c3nn[n-]n3)o2)cc1 ZINC000821732661 599349779 /nfs/dbraw/zinc/34/97/79/599349779.db2.gz RSESGWMDIPPKHB-UHFFFAOYSA-N -1 3 365.418 3.823 20 0 FHADHM Cc1ccc(NC(=O)[C@H](C)Sc2ccccc2-c2nnn[n-]2)c(Cl)c1 ZINC000822242635 599350716 /nfs/dbraw/zinc/35/07/16/599350716.db2.gz RWXTZBCEXAJCTO-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM Cc1ccc(NC(=O)[C@H](C)Sc2ccccc2-c2nn[n-]n2)c(Cl)c1 ZINC000822242635 599350719 /nfs/dbraw/zinc/35/07/19/599350719.db2.gz RWXTZBCEXAJCTO-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM COCCOc1ccc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1Cl ZINC000821693980 599369327 /nfs/dbraw/zinc/36/93/27/599369327.db2.gz XRYKXGNGYZDBHY-LBPRGKRZSA-N -1 3 373.844 3.718 20 0 FHADHM COCCOc1ccc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1Cl ZINC000821693980 599369330 /nfs/dbraw/zinc/36/93/30/599369330.db2.gz XRYKXGNGYZDBHY-LBPRGKRZSA-N -1 3 373.844 3.718 20 0 FHADHM CCOC(=O)N(C)c1ccc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000821334087 599371905 /nfs/dbraw/zinc/37/19/05/599371905.db2.gz HWWVYXNRIVQMSB-ZDUSSCGKSA-N -1 3 366.425 3.633 20 0 FHADHM CCOC(=O)N(C)c1ccc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000821334087 599371907 /nfs/dbraw/zinc/37/19/07/599371907.db2.gz HWWVYXNRIVQMSB-ZDUSSCGKSA-N -1 3 366.425 3.633 20 0 FHADHM C[C@@H](NC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1ccc(F)cc1Cl ZINC000736099084 599378155 /nfs/dbraw/zinc/37/81/55/599378155.db2.gz GKXJVADMCXYNAQ-DHHDDZJSSA-N -1 3 371.803 3.550 20 0 FHADHM C[C@@H](NC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1ccc(F)cc1Cl ZINC000736099084 599378158 /nfs/dbraw/zinc/37/81/58/599378158.db2.gz GKXJVADMCXYNAQ-DHHDDZJSSA-N -1 3 371.803 3.550 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1CNc1cccc(Br)c1C ZINC000821737235 607371849 /nfs/dbraw/zinc/37/18/49/607371849.db2.gz SGTVSBCOJYZKTH-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CNc1cccc(Br)c1C ZINC000821737235 607371851 /nfs/dbraw/zinc/37/18/51/607371851.db2.gz SGTVSBCOJYZKTH-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM CN(Cc1c(F)cccc1Cl)c1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000736815551 599395144 /nfs/dbraw/zinc/39/51/44/599395144.db2.gz UKYSNVVLSWLAGH-UHFFFAOYSA-N -1 3 368.803 3.844 20 0 FHADHM CN(Cc1c(F)cccc1Cl)c1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000736815551 599395146 /nfs/dbraw/zinc/39/51/46/599395146.db2.gz UKYSNVVLSWLAGH-UHFFFAOYSA-N -1 3 368.803 3.844 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(NCc2coc(-c3cccs3)n2)c1 ZINC000737570944 599399616 /nfs/dbraw/zinc/39/96/16/599399616.db2.gz MRUNKKBMLUVUEP-UHFFFAOYSA-N -1 3 358.814 3.849 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(NCc2coc(-c3cccs3)n2)c1 ZINC000737570944 599399618 /nfs/dbraw/zinc/39/96/18/599399618.db2.gz MRUNKKBMLUVUEP-UHFFFAOYSA-N -1 3 358.814 3.849 20 0 FHADHM FC(F)Oc1ccccc1CNc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000737639098 599402675 /nfs/dbraw/zinc/40/26/75/599402675.db2.gz NSEBUJBAYRPTFP-UHFFFAOYSA-N -1 3 368.347 3.628 20 0 FHADHM FC(F)Oc1ccccc1CNc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000737639098 599402677 /nfs/dbraw/zinc/40/26/77/599402677.db2.gz NSEBUJBAYRPTFP-UHFFFAOYSA-N -1 3 368.347 3.628 20 0 FHADHM Cc1cc([C@@H](C)NC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c(C)s1 ZINC000822191345 599407604 /nfs/dbraw/zinc/40/76/04/599407604.db2.gz IUPUYKTUNVJJLL-VXGBXAGGSA-N -1 3 370.482 3.666 20 0 FHADHM Cc1cc([C@@H](C)NC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c(C)s1 ZINC000822191345 599407608 /nfs/dbraw/zinc/40/76/08/599407608.db2.gz IUPUYKTUNVJJLL-VXGBXAGGSA-N -1 3 370.482 3.666 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(NCc2cc(Br)cs2)c1 ZINC000737571186 599412805 /nfs/dbraw/zinc/41/28/05/599412805.db2.gz VNKJOZAGULQXST-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(NCc2cc(Br)cs2)c1 ZINC000737571186 599412809 /nfs/dbraw/zinc/41/28/09/599412809.db2.gz VNKJOZAGULQXST-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM Fc1ccc(N2CC[C@@H](CNc3cc(Cl)ccc3-c3nnn[n-]3)C2)cc1 ZINC000737661420 599417015 /nfs/dbraw/zinc/41/70/15/599417015.db2.gz VUCVEFHVZOZSKD-LBPRGKRZSA-N -1 3 372.835 3.598 20 0 FHADHM Fc1ccc(N2CC[C@@H](CNc3cc(Cl)ccc3-c3nn[n-]n3)C2)cc1 ZINC000737661420 599417018 /nfs/dbraw/zinc/41/70/18/599417018.db2.gz VUCVEFHVZOZSKD-LBPRGKRZSA-N -1 3 372.835 3.598 20 0 FHADHM COc1ccc([C@@H]2CCN(c3cc(Cl)ccc3-c3nnn[n-]3)C2)cc1 ZINC000737074101 599421571 /nfs/dbraw/zinc/42/15/71/599421571.db2.gz FAAOCHBWQWFVCV-CYBMUJFWSA-N -1 3 355.829 3.523 20 0 FHADHM COc1ccc([C@@H]2CCN(c3cc(Cl)ccc3-c3nn[n-]n3)C2)cc1 ZINC000737074101 599421573 /nfs/dbraw/zinc/42/15/73/599421573.db2.gz FAAOCHBWQWFVCV-CYBMUJFWSA-N -1 3 355.829 3.523 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(N2CCC(OC3CCCCC3)CC2)c1 ZINC000737570161 599422822 /nfs/dbraw/zinc/42/28/22/599422822.db2.gz COFPMDZQICFIPJ-UHFFFAOYSA-N -1 3 361.877 3.838 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(N2CCC(OC3CCCCC3)CC2)c1 ZINC000737570161 599422823 /nfs/dbraw/zinc/42/28/23/599422823.db2.gz COFPMDZQICFIPJ-UHFFFAOYSA-N -1 3 361.877 3.838 20 0 FHADHM Cc1ccc(OCCCNc2cc(-c3nnn[n-]3)c3ccccc3n2)cc1 ZINC000737365403 599424996 /nfs/dbraw/zinc/42/49/96/599424996.db2.gz JEOWBZOTNNJANO-UHFFFAOYSA-N -1 3 360.421 3.604 20 0 FHADHM Cc1ccc(OCCCNc2cc(-c3nn[n-]n3)c3ccccc3n2)cc1 ZINC000737365403 599424998 /nfs/dbraw/zinc/42/49/98/599424998.db2.gz JEOWBZOTNNJANO-UHFFFAOYSA-N -1 3 360.421 3.604 20 0 FHADHM C[C@@H](NC(=O)NCc1cccc2ccccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000820374925 599425403 /nfs/dbraw/zinc/42/54/03/599425403.db2.gz TZCVHHVTEQQRLF-CQSZACIVSA-N -1 3 372.432 3.580 20 0 FHADHM C[C@@H](NC(=O)NCc1cccc2ccccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000820374925 599425407 /nfs/dbraw/zinc/42/54/07/599425407.db2.gz TZCVHHVTEQQRLF-CQSZACIVSA-N -1 3 372.432 3.580 20 0 FHADHM C[C@H](NC(=O)NCc1cccc2ccccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000820374924 599425514 /nfs/dbraw/zinc/42/55/14/599425514.db2.gz TZCVHHVTEQQRLF-AWEZNQCLSA-N -1 3 372.432 3.580 20 0 FHADHM C[C@H](NC(=O)NCc1cccc2ccccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000820374924 599425517 /nfs/dbraw/zinc/42/55/17/599425517.db2.gz TZCVHHVTEQQRLF-AWEZNQCLSA-N -1 3 372.432 3.580 20 0 FHADHM Clc1ccc(C2(NCc3ccc(-c4nnn[n-]4)o3)CC2)cc1Cl ZINC000822574397 599426816 /nfs/dbraw/zinc/42/68/16/599426816.db2.gz UGLNJLPBXBZKDU-UHFFFAOYSA-N -1 3 350.209 3.545 20 0 FHADHM Clc1ccc(C2(NCc3ccc(-c4nn[n-]n4)o3)CC2)cc1Cl ZINC000822574397 599426817 /nfs/dbraw/zinc/42/68/17/599426817.db2.gz UGLNJLPBXBZKDU-UHFFFAOYSA-N -1 3 350.209 3.545 20 0 FHADHM Clc1ccc2c(c1Cl)CC[C@H]2NCc1ccc(-c2nnn[n-]2)o1 ZINC000822581234 599437584 /nfs/dbraw/zinc/43/75/84/599437584.db2.gz FHZPZTIMSMGQML-GFCCVEGCSA-N -1 3 350.209 3.544 20 0 FHADHM CCc1ccc([C@H]2CCCN2c2cc(-c3nnn[n-]3)c3ccccc3n2)o1 ZINC000736686878 599440737 /nfs/dbraw/zinc/44/07/37/599440737.db2.gz RKQBXZJHSHFKAY-QGZVFWFLSA-N -1 3 360.421 3.912 20 0 FHADHM CCc1ccc([C@H]2CCCN2c2cc(-c3nn[n-]n3)c3ccccc3n2)o1 ZINC000736686878 599440740 /nfs/dbraw/zinc/44/07/40/599440740.db2.gz RKQBXZJHSHFKAY-QGZVFWFLSA-N -1 3 360.421 3.912 20 0 FHADHM CCc1ccc([C@@H]2CCCN2c2cc(-c3nnn[n-]3)c3ccccc3n2)o1 ZINC000736686874 599440762 /nfs/dbraw/zinc/44/07/62/599440762.db2.gz RKQBXZJHSHFKAY-KRWDZBQOSA-N -1 3 360.421 3.912 20 0 FHADHM CCc1ccc([C@@H]2CCCN2c2cc(-c3nn[n-]n3)c3ccccc3n2)o1 ZINC000736686874 599440765 /nfs/dbraw/zinc/44/07/65/599440765.db2.gz RKQBXZJHSHFKAY-KRWDZBQOSA-N -1 3 360.421 3.912 20 0 FHADHM CSCCCCNc1cc(C)c(-c2nnn[n-]2)c2nc3ccccc3n21 ZINC000737181912 599443783 /nfs/dbraw/zinc/44/37/83/599443783.db2.gz LEKKSEYZJBDBQD-UHFFFAOYSA-N -1 3 367.482 3.531 20 0 FHADHM CSCCCCNc1cc(C)c(-c2nn[n-]n2)c2nc3ccccc3n21 ZINC000737181912 599443787 /nfs/dbraw/zinc/44/37/87/599443787.db2.gz LEKKSEYZJBDBQD-UHFFFAOYSA-N -1 3 367.482 3.531 20 0 FHADHM Clc1ccc2ccc(C=Cc3cnc4ccc(-c5nnn[n-]5)cn34)nc2c1 ZINC000737575646 599463968 /nfs/dbraw/zinc/46/39/68/599463968.db2.gz ZVDYEZFLKMKDOQ-SREVYHEPSA-N -1 3 373.807 3.886 20 0 FHADHM Clc1ccc2ccc(C=Cc3cnc4ccc(-c5nn[n-]n5)cn34)nc2c1 ZINC000737575646 599463971 /nfs/dbraw/zinc/46/39/71/599463971.db2.gz ZVDYEZFLKMKDOQ-SREVYHEPSA-N -1 3 373.807 3.886 20 0 FHADHM C[C@@H](NC(=O)c1cc2c(cccc2F)s1)c1cccc(-c2nnn[n-]2)c1 ZINC000820390094 599501518 /nfs/dbraw/zinc/50/15/18/599501518.db2.gz DWYVAWQEIUDJEJ-SNVBAGLBSA-N -1 3 367.409 3.712 20 0 FHADHM C[C@@H](NC(=O)c1cc2c(cccc2F)s1)c1cccc(-c2nn[n-]n2)c1 ZINC000820390094 599501520 /nfs/dbraw/zinc/50/15/20/599501520.db2.gz DWYVAWQEIUDJEJ-SNVBAGLBSA-N -1 3 367.409 3.712 20 0 FHADHM Cc1cc(F)cc2c1ncc(-c1nnn[n-]1)c2N1CC[C@@H](c2ccccc2)C1 ZINC000822204428 599503218 /nfs/dbraw/zinc/50/32/18/599503218.db2.gz OOSFPXKQOSVRRH-OAHLLOKOSA-N -1 3 374.423 3.856 20 0 FHADHM Cc1cc(F)cc2c1ncc(-c1nn[n-]n1)c2N1CC[C@@H](c2ccccc2)C1 ZINC000822204428 599503221 /nfs/dbraw/zinc/50/32/21/599503221.db2.gz OOSFPXKQOSVRRH-OAHLLOKOSA-N -1 3 374.423 3.856 20 0 FHADHM C[C@H](C[C@H](O)c1ccc(F)cc1)Nc1cc(Cl)ccc1-c1nnn[n-]1 ZINC000820232973 607381771 /nfs/dbraw/zinc/38/17/71/607381771.db2.gz ISNLEXPAKVPVAS-HWPZZCPQSA-N -1 3 361.808 3.583 20 0 FHADHM C[C@H](C[C@H](O)c1ccc(F)cc1)Nc1cc(Cl)ccc1-c1nn[n-]n1 ZINC000820232973 607381773 /nfs/dbraw/zinc/38/17/73/607381773.db2.gz ISNLEXPAKVPVAS-HWPZZCPQSA-N -1 3 361.808 3.583 20 0 FHADHM Cc1c2cccc(C)c2oc1C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000822020773 599510467 /nfs/dbraw/zinc/51/04/67/599510467.db2.gz ISMNOUPOVTWDIW-CYBMUJFWSA-N -1 3 361.405 3.721 20 0 FHADHM Cc1c2cccc(C)c2oc1C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000822020773 599510469 /nfs/dbraw/zinc/51/04/69/599510469.db2.gz ISMNOUPOVTWDIW-CYBMUJFWSA-N -1 3 361.405 3.721 20 0 FHADHM C[C@@H](NC(=O)c1ccc(Cl)cc1Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000820396909 599512344 /nfs/dbraw/zinc/51/23/44/599512344.db2.gz JODHKCDMENJLJR-SECBINFHSA-N -1 3 362.220 3.665 20 0 FHADHM C[C@@H](NC(=O)c1ccc(Cl)cc1Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000820396909 599512346 /nfs/dbraw/zinc/51/23/46/599512346.db2.gz JODHKCDMENJLJR-SECBINFHSA-N -1 3 362.220 3.665 20 0 FHADHM C[C@@H](C[C@@H](O)c1ccc(F)cc1)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820235623 607381956 /nfs/dbraw/zinc/38/19/56/607381956.db2.gz TXKCIGNPGMSSPU-MGPLVRAMSA-N -1 3 361.808 3.583 20 0 FHADHM C[C@@H](C[C@@H](O)c1ccc(F)cc1)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820235623 607381958 /nfs/dbraw/zinc/38/19/58/607381958.db2.gz TXKCIGNPGMSSPU-MGPLVRAMSA-N -1 3 361.808 3.583 20 0 FHADHM C[C@H](Cc1ccsc1)Nc1ccc(-c2nn[n-]n2)cc1C(F)(F)F ZINC000736066303 599519200 /nfs/dbraw/zinc/51/92/00/599519200.db2.gz NDMSSGCYLLDWEM-SECBINFHSA-N -1 3 353.373 3.990 20 0 FHADHM FC(F)(F)c1cc(-c2nn[n-]n2)ccc1N[C@H]1CCN(c2ccccc2)C1 ZINC000737628578 599524881 /nfs/dbraw/zinc/52/48/81/599524881.db2.gz XQEFBWIOXCSOJP-ZDUSSCGKSA-N -1 3 374.370 3.576 20 0 FHADHM C[C@H](NC(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820321774 599525747 /nfs/dbraw/zinc/52/57/47/599525747.db2.gz MGWLCLONKTTWFC-MZPVMMEZSA-N -1 3 367.840 3.501 20 0 FHADHM C[C@H](NC(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820321774 599525749 /nfs/dbraw/zinc/52/57/49/599525749.db2.gz MGWLCLONKTTWFC-MZPVMMEZSA-N -1 3 367.840 3.501 20 0 FHADHM C[C@@H](CNc1ccc(-c2nn[n-]n2)cc1C(F)(F)F)Oc1ccccc1 ZINC000736025495 599526259 /nfs/dbraw/zinc/52/62/59/599526259.db2.gz HULPBHOPTURBJS-NSHDSACASA-N -1 3 363.343 3.765 20 0 FHADHM Cc1c2cc(F)ccc2oc1C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000822020468 599529875 /nfs/dbraw/zinc/52/98/75/599529875.db2.gz CXGPERRBOJQUQW-NSHDSACASA-N -1 3 365.368 3.551 20 0 FHADHM Cc1c2cc(F)ccc2oc1C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000822020468 599529876 /nfs/dbraw/zinc/52/98/76/599529876.db2.gz CXGPERRBOJQUQW-NSHDSACASA-N -1 3 365.368 3.551 20 0 FHADHM C[C@H](CCc1ccccc1F)C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000820254909 599556703 /nfs/dbraw/zinc/55/67/03/599556703.db2.gz ZPGSTKUDWWFOEK-LLVKDONJSA-N -1 3 373.819 3.867 20 0 FHADHM C[C@H](CCc1ccccc1F)C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000820254909 599556704 /nfs/dbraw/zinc/55/67/04/599556704.db2.gz ZPGSTKUDWWFOEK-LLVKDONJSA-N -1 3 373.819 3.867 20 0 FHADHM Cc1ccc([C@H]2[C@H](C)CCCN2C(=O)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000737332976 599558252 /nfs/dbraw/zinc/55/82/52/599558252.db2.gz ZGZCIOYLOVBFBB-DNVCBOLYSA-N -1 3 361.449 3.789 20 0 FHADHM Cc1ccc([C@H]2[C@H](C)CCCN2C(=O)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000737332976 599558253 /nfs/dbraw/zinc/55/82/53/599558253.db2.gz ZGZCIOYLOVBFBB-DNVCBOLYSA-N -1 3 361.449 3.789 20 0 FHADHM Cc1ccc([C@@H]2[C@@H](C)CCCN2C(=O)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000737332981 599558317 /nfs/dbraw/zinc/55/83/17/599558317.db2.gz ZGZCIOYLOVBFBB-KXBFYZLASA-N -1 3 361.449 3.789 20 0 FHADHM Cc1ccc([C@@H]2[C@@H](C)CCCN2C(=O)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000737332981 599558320 /nfs/dbraw/zinc/55/83/20/599558320.db2.gz ZGZCIOYLOVBFBB-KXBFYZLASA-N -1 3 361.449 3.789 20 0 FHADHM CCC(CC)NC(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736345518 599562130 /nfs/dbraw/zinc/56/21/30/599562130.db2.gz IAUXONDZKHVCFP-UHFFFAOYSA-N -1 3 350.426 3.529 20 0 FHADHM O=C(NC1CCCCC1)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000738022619 599562857 /nfs/dbraw/zinc/56/28/57/599562857.db2.gz DZIVBBQHZGLDAL-UHFFFAOYSA-N -1 3 362.437 3.673 20 0 FHADHM CC(C)N(C(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1)C1CC1 ZINC000735856957 599566273 /nfs/dbraw/zinc/56/62/73/599566273.db2.gz MSSICBXQQIJJKR-UHFFFAOYSA-N -1 3 362.437 3.623 20 0 FHADHM CC[C@H](C)CN(C)C(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736321940 599568846 /nfs/dbraw/zinc/56/88/46/599568846.db2.gz GSTAJTMDJFRVRX-AWEZNQCLSA-N -1 3 364.453 3.728 20 0 FHADHM Cc1cc(NCc2ccc(-c3nnn[n-]3)cc2)ccc1OCC(F)(F)F ZINC000737281766 599582691 /nfs/dbraw/zinc/58/26/91/599582691.db2.gz YWROXTDUZIKAFJ-UHFFFAOYSA-N -1 3 363.343 3.728 20 0 FHADHM Cc1cc(NCc2ccc(-c3nn[n-]n3)cc2)ccc1OCC(F)(F)F ZINC000737281766 599582693 /nfs/dbraw/zinc/58/26/93/599582693.db2.gz YWROXTDUZIKAFJ-UHFFFAOYSA-N -1 3 363.343 3.728 20 0 FHADHM CS[C@@H]1CCCCN(c2ccc(-c3nn[n-]n3)cc2C(F)(F)F)C1 ZINC000821956312 607385473 /nfs/dbraw/zinc/38/54/73/607385473.db2.gz LZFSQTLNNZZQCA-LLVKDONJSA-N -1 3 357.405 3.607 20 0 FHADHM Cc1ccc(C[C@H](C)N(C)C(=O)Nc2cc(-c3nnn[n-]3)ccc2C)cc1 ZINC000737334653 599611139 /nfs/dbraw/zinc/61/11/39/599611139.db2.gz KNABHYOCRIJRPR-HNNXBMFYSA-N -1 3 364.453 3.578 20 0 FHADHM Cc1ccc(C[C@H](C)N(C)C(=O)Nc2cc(-c3nn[n-]n3)ccc2C)cc1 ZINC000737334653 599611141 /nfs/dbraw/zinc/61/11/41/599611141.db2.gz KNABHYOCRIJRPR-HNNXBMFYSA-N -1 3 364.453 3.578 20 0 FHADHM Cc1sc(NC(=O)c2cccc(F)c2Cl)c(-c2nnn[n-]2)c1C ZINC000822563195 599629096 /nfs/dbraw/zinc/62/90/96/599629096.db2.gz GWVFBIFKTJCQJU-UHFFFAOYSA-N -1 3 351.794 3.590 20 0 FHADHM Cc1sc(NC(=O)c2cccc(F)c2Cl)c(-c2nn[n-]n2)c1C ZINC000822563195 599629097 /nfs/dbraw/zinc/62/90/97/599629097.db2.gz GWVFBIFKTJCQJU-UHFFFAOYSA-N -1 3 351.794 3.590 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@@H](C)CCc2cccc(F)c2)s1 ZINC000821465808 599630463 /nfs/dbraw/zinc/63/04/63/599630463.db2.gz QCJRAKFXENFRFT-NSHDSACASA-N -1 3 373.457 3.837 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@@H](C)CCc2cccc(F)c2)s1 ZINC000821465808 599630464 /nfs/dbraw/zinc/63/04/64/599630464.db2.gz QCJRAKFXENFRFT-NSHDSACASA-N -1 3 373.457 3.837 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@H](C)CCc2ccccc2F)s1 ZINC000821465054 599630619 /nfs/dbraw/zinc/63/06/19/599630619.db2.gz AKZJXLZPEVTNNI-LLVKDONJSA-N -1 3 373.457 3.837 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@H](C)CCc2ccccc2F)s1 ZINC000821465054 599630620 /nfs/dbraw/zinc/63/06/20/599630620.db2.gz AKZJXLZPEVTNNI-LLVKDONJSA-N -1 3 373.457 3.837 20 0 FHADHM Cc1ccc([C@H](C)C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)o1 ZINC000822227811 599632709 /nfs/dbraw/zinc/63/27/09/599632709.db2.gz WPYGZESBEGVENK-VIFPVBQESA-N -1 3 365.315 3.529 20 0 FHADHM Cc1ccc([C@H](C)C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)o1 ZINC000822227811 599632710 /nfs/dbraw/zinc/63/27/10/599632710.db2.gz WPYGZESBEGVENK-VIFPVBQESA-N -1 3 365.315 3.529 20 0 FHADHM Cc1ccc([C@@H](C)C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)o1 ZINC000822227810 599632718 /nfs/dbraw/zinc/63/27/18/599632718.db2.gz WPYGZESBEGVENK-SECBINFHSA-N -1 3 365.315 3.529 20 0 FHADHM Cc1ccc([C@@H](C)C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)o1 ZINC000822227810 599632719 /nfs/dbraw/zinc/63/27/19/599632719.db2.gz WPYGZESBEGVENK-SECBINFHSA-N -1 3 365.315 3.529 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)[C@@H]1CCc2ccccc21 ZINC000823303453 599633889 /nfs/dbraw/zinc/63/38/89/599633889.db2.gz IVCULUBBZOHOFX-CYBMUJFWSA-N -1 3 373.338 3.554 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)[C@@H]1CCc2ccccc21 ZINC000823303453 599633890 /nfs/dbraw/zinc/63/38/90/599633890.db2.gz IVCULUBBZOHOFX-CYBMUJFWSA-N -1 3 373.338 3.554 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)c1ccccc1Cl ZINC000823303810 599634339 /nfs/dbraw/zinc/63/43/39/599634339.db2.gz WILDHZPAYXUZPV-UHFFFAOYSA-N -1 3 367.718 3.791 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)c1ccccc1Cl ZINC000823303810 599634340 /nfs/dbraw/zinc/63/43/40/599634340.db2.gz WILDHZPAYXUZPV-UHFFFAOYSA-N -1 3 367.718 3.791 20 0 FHADHM C[C@H]1CC[C@H](C)N(C(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)C1 ZINC000820686727 599635260 /nfs/dbraw/zinc/63/52/60/599635260.db2.gz ZRAFHLPVFZHRSF-GJZGRUSLSA-N -1 3 361.449 3.794 20 0 FHADHM C[C@H]1CC[C@H](C)N(C(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)C1 ZINC000820686727 599635261 /nfs/dbraw/zinc/63/52/61/599635261.db2.gz ZRAFHLPVFZHRSF-GJZGRUSLSA-N -1 3 361.449 3.794 20 0 FHADHM CCC(=CC(=O)NCc1ccc(-c2nnn[n-]2)cc1)c1cccc(Cl)c1 ZINC000820833459 599647668 /nfs/dbraw/zinc/64/76/68/599647668.db2.gz XRNFFBWPGRKRKK-SDNWHVSQSA-N -1 3 367.840 3.630 20 0 FHADHM CCC(=CC(=O)NCc1ccc(-c2nn[n-]n2)cc1)c1cccc(Cl)c1 ZINC000820833459 599647669 /nfs/dbraw/zinc/64/76/69/599647669.db2.gz XRNFFBWPGRKRKK-SDNWHVSQSA-N -1 3 367.840 3.630 20 0 FHADHM C[C@@H](C(=O)OCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1)c1ccco1 ZINC000819883823 599662854 /nfs/dbraw/zinc/66/28/54/599662854.db2.gz OIDVHNRXJNKRHW-CQSZACIVSA-N -1 3 374.400 3.974 20 0 FHADHM C[C@@H](C(=O)OCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1)c1ccco1 ZINC000819883823 599662855 /nfs/dbraw/zinc/66/28/55/599662855.db2.gz OIDVHNRXJNKRHW-CQSZACIVSA-N -1 3 374.400 3.974 20 0 FHADHM CC(C)C[C@H]1CCN(C(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)C1 ZINC000820067189 599663573 /nfs/dbraw/zinc/66/35/73/599663573.db2.gz FRPFOXCXJDSQNE-LLVKDONJSA-N -1 3 364.906 3.585 20 0 FHADHM CC(C)C[C@H]1CCN(C(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)C1 ZINC000820067189 599663574 /nfs/dbraw/zinc/66/35/74/599663574.db2.gz FRPFOXCXJDSQNE-LLVKDONJSA-N -1 3 364.906 3.585 20 0 FHADHM C[C@H](NC(=O)N[C@@H]1CC[C@@H]2CCCC[C@H]2C1)c1cccc(-c2nnn[n-]2)c1 ZINC000820356681 599667093 /nfs/dbraw/zinc/66/70/93/599667093.db2.gz ASXSHRLTHOBHLN-ILXVDBEPSA-N -1 3 368.485 3.586 20 0 FHADHM C[C@H](NC(=O)N[C@@H]1CC[C@@H]2CCCC[C@H]2C1)c1cccc(-c2nn[n-]n2)c1 ZINC000820356681 599667094 /nfs/dbraw/zinc/66/70/94/599667094.db2.gz ASXSHRLTHOBHLN-ILXVDBEPSA-N -1 3 368.485 3.586 20 0 FHADHM CC(C)C[C@H]1CCCCCN1C(=O)NCc1cc(-c2nnn[n-]2)ccc1F ZINC000820062483 599678624 /nfs/dbraw/zinc/67/86/24/599678624.db2.gz MRKDRVPNSPGNON-MRXNPFEDSA-N -1 3 374.464 3.506 20 0 FHADHM CC(C)C[C@H]1CCCCCN1C(=O)NCc1cc(-c2nn[n-]n2)ccc1F ZINC000820062483 599678625 /nfs/dbraw/zinc/67/86/25/599678625.db2.gz MRKDRVPNSPGNON-MRXNPFEDSA-N -1 3 374.464 3.506 20 0 FHADHM CC(C)CN(C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)C1CCCC1 ZINC000820081637 599681908 /nfs/dbraw/zinc/68/19/08/599681908.db2.gz OUOJDTPEXSXEIJ-AWEZNQCLSA-N -1 3 356.474 3.538 20 0 FHADHM CC(C)CN(C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)C1CCCC1 ZINC000820081637 599681909 /nfs/dbraw/zinc/68/19/09/599681909.db2.gz OUOJDTPEXSXEIJ-AWEZNQCLSA-N -1 3 356.474 3.538 20 0 FHADHM CC(C)CN(C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)C1CCCC1 ZINC000820081638 599682104 /nfs/dbraw/zinc/68/21/04/599682104.db2.gz OUOJDTPEXSXEIJ-CQSZACIVSA-N -1 3 356.474 3.538 20 0 FHADHM CC(C)CN(C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)C1CCCC1 ZINC000820081638 599682105 /nfs/dbraw/zinc/68/21/05/599682105.db2.gz OUOJDTPEXSXEIJ-CQSZACIVSA-N -1 3 356.474 3.538 20 0 FHADHM Cc1sc(NC(=O)[C@@H](C)CCOc2ccccc2)c(-c2nnn[n-]2)c1C ZINC000822559066 599690142 /nfs/dbraw/zinc/69/01/42/599690142.db2.gz VHHIBGOSBBNLHP-NSHDSACASA-N -1 3 371.466 3.589 20 0 FHADHM Cc1sc(NC(=O)[C@@H](C)CCOc2ccccc2)c(-c2nn[n-]n2)c1C ZINC000822559066 599690143 /nfs/dbraw/zinc/69/01/43/599690143.db2.gz VHHIBGOSBBNLHP-NSHDSACASA-N -1 3 371.466 3.589 20 0 FHADHM Cc1cc(C)c(NC(=S)Nc2cccc(-c3nnn[n-]3)c2)c(Cl)c1 ZINC000822194202 599691597 /nfs/dbraw/zinc/69/15/97/599691597.db2.gz MWKXYRXBMBGEJF-UHFFFAOYSA-N -1 3 358.858 3.946 20 0 FHADHM Cc1cc(C)c(NC(=S)Nc2cccc(-c3nn[n-]n3)c2)c(Cl)c1 ZINC000822194202 599691598 /nfs/dbraw/zinc/69/15/98/599691598.db2.gz MWKXYRXBMBGEJF-UHFFFAOYSA-N -1 3 358.858 3.946 20 0 FHADHM COc1cc(CCC2CCN(Cc3cc(C(=O)[O-])co3)CC2)cc(OC)c1 ZINC000579848263 599845843 /nfs/dbraw/zinc/84/58/43/599845843.db2.gz TVRIUZMQXRBWBL-UHFFFAOYSA-N -1 3 373.449 3.840 20 0 FHADHM Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@@H]1N2C(=O)c1cccc(NC(=O)[O-])c1 ZINC000738669816 599899059 /nfs/dbraw/zinc/89/90/59/599899059.db2.gz IUDKDHLHCFDKGK-HKUYNNGSSA-N -1 3 365.433 3.533 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1COC(=O)[C@@H](C)SCc1ccccc1 ZINC000826252366 607406143 /nfs/dbraw/zinc/40/61/43/607406143.db2.gz AKDHZQUTMACNOO-CQSZACIVSA-N -1 3 368.462 3.540 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1COC(=O)[C@@H](C)SCc1ccccc1 ZINC000826252366 607406145 /nfs/dbraw/zinc/40/61/45/607406145.db2.gz AKDHZQUTMACNOO-CQSZACIVSA-N -1 3 368.462 3.540 20 0 FHADHM Cc1cc(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)ccc1C(=O)[O-] ZINC000738442778 600018210 /nfs/dbraw/zinc/01/82/10/600018210.db2.gz RNXATUMIQOERIS-IBGZPJMESA-N -1 3 367.449 3.652 20 0 FHADHM Cc1cc(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)ccc1C(=O)[O-] ZINC000738443205 600018325 /nfs/dbraw/zinc/01/83/25/600018325.db2.gz VETWMALMKIYAJP-LJQANCHMSA-N -1 3 367.449 3.652 20 0 FHADHM C[C@](NCc1ccc(F)cc1)(C(=O)[O-])c1cccc(Br)c1 ZINC000041756953 600076648 /nfs/dbraw/zinc/07/66/48/600076648.db2.gz WQEGWKQBKHBZCG-MRXNPFEDSA-N -1 3 352.203 3.678 20 0 FHADHM C[C@@H](c1ccc(C(=O)[O-])o1)N1CCC(CN(C)C(=O)OC(C)(C)C)CC1 ZINC000736715364 600104524 /nfs/dbraw/zinc/10/45/24/600104524.db2.gz RGNQFEGLBBLOBB-ZDUSSCGKSA-N -1 3 366.458 3.618 20 0 FHADHM C[C@@H](C(=O)Nc1cccc(CSCCC(=O)[O-])c1)N1[C@H](C)CC[C@@H]1C ZINC000736762756 600109613 /nfs/dbraw/zinc/10/96/13/600109613.db2.gz LUQJMMNZNHOKHN-ZNMIVQPWSA-N -1 3 364.511 3.594 20 0 FHADHM C[C@@H](c1ccc(C(=O)[O-])o1)N1CCC(c2nc(-c3ccccc3)n[nH]2)CC1 ZINC000576829768 600127947 /nfs/dbraw/zinc/12/79/47/600127947.db2.gz GHZDKZFOYRLGAN-ZDUSSCGKSA-N -1 3 366.421 3.704 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H]2C[C@H]2c2sccc2C)c1-c1nnn[n-]1 ZINC000825688257 607431727 /nfs/dbraw/zinc/43/17/27/607431727.db2.gz VPOZMCOKIBQDSN-VXGBXAGGSA-N -1 3 373.507 3.911 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H]2C[C@H]2c2sccc2C)c1-c1nn[n-]n1 ZINC000825688257 607431728 /nfs/dbraw/zinc/43/17/28/607431728.db2.gz VPOZMCOKIBQDSN-VXGBXAGGSA-N -1 3 373.507 3.911 20 0 FHADHM C[C@@H](Sc1ccccc1Cl)C(=O)N(C)c1ccc(-c2nnn[n-]2)cc1 ZINC000824762630 607433030 /nfs/dbraw/zinc/43/30/30/607433030.db2.gz IAPUGFDBYBZXEC-LLVKDONJSA-N -1 3 373.869 3.664 20 0 FHADHM C[C@@H](Sc1ccccc1Cl)C(=O)N(C)c1ccc(-c2nn[n-]n2)cc1 ZINC000824762630 607433031 /nfs/dbraw/zinc/43/30/31/607433031.db2.gz IAPUGFDBYBZXEC-LLVKDONJSA-N -1 3 373.869 3.664 20 0 FHADHM O=C([O-])c1ccc2c(cnn2CN2CC[C@H](c3ccc(Cl)cc3)C2)c1 ZINC000740203302 600282189 /nfs/dbraw/zinc/28/21/89/600282189.db2.gz OPEXKGIHDUWBOX-HNNXBMFYSA-N -1 3 355.825 3.835 20 0 FHADHM Cc1nn(-c2ccccc2)c(Cl)c1CN1CCC2(C[C@@H]2C(=O)[O-])CC1 ZINC000738902965 600305113 /nfs/dbraw/zinc/30/51/13/600305113.db2.gz RVCQCFBFCTZESE-MRXNPFEDSA-N -1 3 359.857 3.521 20 0 FHADHM C[C@@H]1CCCC[C@]1(CNC(=O)OC(C)(C)C)NCc1cc(C(=O)[O-])co1 ZINC000387863350 600316014 /nfs/dbraw/zinc/31/60/14/600316014.db2.gz OVHMTQQBZFQSMD-BFUOFWGJSA-N -1 3 366.458 3.541 20 0 FHADHM O=C([O-])[C@H](NCc1ccc(OCC(F)(F)F)cc1)c1ccc(F)cc1 ZINC000739498553 600420917 /nfs/dbraw/zinc/42/09/17/600420917.db2.gz AMEXZAODMGOTBO-OAHLLOKOSA-N -1 3 357.303 3.682 20 0 FHADHM O=C([O-])[C@@H](NCc1cc(Cl)c2c(c1)OCCO2)c1cccc(Cl)c1 ZINC000426730789 600422264 /nfs/dbraw/zinc/42/22/64/600422264.db2.gz BKHIGJBFDJMVPA-HNNXBMFYSA-N -1 3 368.216 3.680 20 0 FHADHM O=C([O-])[C@H](NCc1ccc(N2CCCCC2)nc1)c1cccc(Cl)c1 ZINC000739499778 600425063 /nfs/dbraw/zinc/42/50/63/600425063.db2.gz JZWZTVIYGBGQOD-GOSISDBHSA-N -1 3 359.857 3.641 20 0 FHADHM Cc1[nH]c(C(=O)CN2C[C@H](c3ccccc3C)C[C@H]2C)c(C)c1C(=O)[O-] ZINC000738761182 600433975 /nfs/dbraw/zinc/43/39/75/600433975.db2.gz PAVJAHKVRDFXNI-CZUORRHYSA-N -1 3 354.450 3.699 20 0 FHADHM O=C([O-])[C@@H](NCc1nccc2ccccc21)c1ccc(Br)cc1 ZINC000739505392 600436006 /nfs/dbraw/zinc/43/60/06/600436006.db2.gz NEJWXNZMRWZYDT-KRWDZBQOSA-N -1 3 371.234 3.913 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1CC(C)(C)Sc2ccccc21 ZINC000826244016 607444208 /nfs/dbraw/zinc/44/42/08/607444208.db2.gz DWWDPUGJUBDRQB-UHFFFAOYSA-N -1 3 365.462 3.706 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1CC(C)(C)Sc2ccccc21 ZINC000826244016 607444209 /nfs/dbraw/zinc/44/42/09/607444209.db2.gz DWWDPUGJUBDRQB-UHFFFAOYSA-N -1 3 365.462 3.706 20 0 FHADHM Cc1ccsc1CCCC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000826316803 607444388 /nfs/dbraw/zinc/44/43/88/607444388.db2.gz ZISYIRUSMHBZHZ-UHFFFAOYSA-N -1 3 361.858 3.851 20 0 FHADHM Cc1ccsc1CCCC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000826316803 607444390 /nfs/dbraw/zinc/44/43/90/607444390.db2.gz ZISYIRUSMHBZHZ-UHFFFAOYSA-N -1 3 361.858 3.851 20 0 FHADHM Cc1nc(-c2ccc(Cl)c(Cl)c2)n(CN(CCC(=O)[O-])C(C)C)n1 ZINC000738829647 600609793 /nfs/dbraw/zinc/60/97/93/600609793.db2.gz PABCMGZDWFDMNU-UHFFFAOYSA-N -1 3 371.268 3.703 20 0 FHADHM Cc1ccc([C@@H](C)N[C@@H]2CCN(c3sccc3C(=O)[O-])C2=O)cc1C ZINC000832921382 600692822 /nfs/dbraw/zinc/69/28/22/600692822.db2.gz PPCXUJGCYGETJP-CZUORRHYSA-N -1 3 358.463 3.519 20 0 FHADHM O=C([O-])c1ccc2c(cnn2CN2CC[C@@H](CSc3ccccc3)C2)c1 ZINC000833326081 600717532 /nfs/dbraw/zinc/71/75/32/600717532.db2.gz HQVOTKHAXXJVKX-OAHLLOKOSA-N -1 3 367.474 3.806 20 0 FHADHM COc1ccccc1OCCN[C@@H](C(=O)[O-])c1ccc(Cl)cc1Cl ZINC000832632612 600732402 /nfs/dbraw/zinc/73/24/02/600732402.db2.gz KOKULLAGDYYSTB-MRXNPFEDSA-N -1 3 370.232 3.796 20 0 FHADHM Cc1cc(F)ccc1N(Cc1ccncc1)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000826269035 607465001 /nfs/dbraw/zinc/46/50/01/607465001.db2.gz YEMDJDZKKMPIRI-UHFFFAOYSA-N -1 3 374.423 3.916 20 0 FHADHM Cc1cc(F)ccc1N(Cc1ccncc1)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000826269035 607465002 /nfs/dbraw/zinc/46/50/02/607465002.db2.gz YEMDJDZKKMPIRI-UHFFFAOYSA-N -1 3 374.423 3.916 20 0 FHADHM CC[C@@H](Cc1ccc(C)cc1)N(C)CC(=O)N(C)c1ccccc1C(=O)[O-] ZINC000828890532 600839309 /nfs/dbraw/zinc/83/93/09/600839309.db2.gz ILEOMDWODMZTNL-SFHVURJKSA-N -1 3 368.477 3.609 20 0 FHADHM CC(C)Oc1ccccc1[C@@H](C)NCc1ccc(-c2nn[n-]n2)cc1F ZINC000820178419 607473409 /nfs/dbraw/zinc/47/34/09/607473409.db2.gz PDYQCCYOHYJMIW-CYBMUJFWSA-N -1 3 355.417 3.644 20 0 FHADHM Cc1cccc(C2(O)CCN([C@@H](C(=O)[O-])c3ccccc3F)CC2)c1C ZINC000832965220 601017360 /nfs/dbraw/zinc/01/73/60/601017360.db2.gz GLLQJLQRWVHDEL-LJQANCHMSA-N -1 3 357.425 3.552 20 0 FHADHM Cc1ncccc1NCc1cccc(OCc2ccccc2-c2nnn[n-]2)c1 ZINC000822477240 607491073 /nfs/dbraw/zinc/49/10/73/607491073.db2.gz KAXRTOBEAYONTO-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM Cc1ncccc1NCc1cccc(OCc2ccccc2-c2nn[n-]n2)c1 ZINC000822477240 607491075 /nfs/dbraw/zinc/49/10/75/607491075.db2.gz KAXRTOBEAYONTO-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM Cc1cc2oc(=O)cc(CN[C@@H](c3ccccc3)[C@@H](C)C(=O)[O-])c2cc1C ZINC000832906844 601203610 /nfs/dbraw/zinc/20/36/10/601203610.db2.gz YTESCEMOVWOKSA-QVKFZJNVSA-N -1 3 365.429 3.961 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@H](C)CSCc1ccccc1 ZINC000822216032 607500955 /nfs/dbraw/zinc/50/09/55/607500955.db2.gz CJTMHIZRYYMDMA-CQSZACIVSA-N -1 3 367.478 3.683 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@H](C)CSCc1ccccc1 ZINC000822216032 607500956 /nfs/dbraw/zinc/50/09/56/607500956.db2.gz CJTMHIZRYYMDMA-CQSZACIVSA-N -1 3 367.478 3.683 20 0 FHADHM CCc1oc(C(=O)[O-])cc1CNC1(c2ccc3c(c2)OCCO3)CCCC1 ZINC000830375978 601414916 /nfs/dbraw/zinc/41/49/16/601414916.db2.gz SPQCSXSBGPNIBK-UHFFFAOYSA-N -1 3 371.433 3.871 20 0 FHADHM Cc1cc2oc(=O)cc(CN3CCc4ccccc4[C@@H]3C(=O)[O-])c2cc1C ZINC000832906914 601544169 /nfs/dbraw/zinc/54/41/69/601544169.db2.gz ZSLBXZYDOOEPPG-OAQYLSRUSA-N -1 3 363.413 3.594 20 0 FHADHM CN(C)C(=O)Sc1cccc(CN2CCc3ccccc3[C@H]2C(=O)[O-])c1 ZINC000830569943 601548603 /nfs/dbraw/zinc/54/86/03/601548603.db2.gz XXYGNLPHXYGXKX-SFHVURJKSA-N -1 3 370.474 3.644 20 0 FHADHM O=C([O-])c1cc(F)ccc1CN(Cc1ccccc1)C[C@@H](O)c1ccco1 ZINC000833299232 601611776 /nfs/dbraw/zinc/61/17/76/601611776.db2.gz PAERVHRJGZJMQR-LJQANCHMSA-N -1 3 369.392 3.853 20 0 FHADHM Cc1sc(C(=O)[O-])cc1CN1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000833032512 601615312 /nfs/dbraw/zinc/61/53/12/601615312.db2.gz IJNREIFHFQVHKE-OAHLLOKOSA-N -1 3 359.447 3.863 20 0 FHADHM O=C([O-])c1ccc(CNC2(c3ccc(Cl)cc3)CCOCC2)cc1F ZINC000833315250 601633462 /nfs/dbraw/zinc/63/34/62/601633462.db2.gz YDHMGEOJVVUSSW-UHFFFAOYSA-N -1 3 363.816 3.973 20 0 FHADHM O=C([O-])CC[C@@H](NCc1cnc(-c2ccncc2)s1)c1ccccc1 ZINC000833221944 601833621 /nfs/dbraw/zinc/83/36/21/601833621.db2.gz DWBKSMCOJHPTPV-QGZVFWFLSA-N -1 3 353.447 3.901 20 0 FHADHM CCC[C@H](NC(=O)[C@H](C)N1CCC(CCC(=O)[O-])CC1)c1ccccc1 ZINC000662218874 601840599 /nfs/dbraw/zinc/84/05/99/601840599.db2.gz VTLSLXAMQCBJCM-LPHOPBHVSA-N -1 3 360.498 3.609 20 0 FHADHM C[C@@H](NCC(C)(C)C(=O)[O-])c1nnc(-c2ccc(Cl)cc2Cl)o1 ZINC000827735472 601850357 /nfs/dbraw/zinc/85/03/57/601850357.db2.gz VUULKICHKJQVTK-MRVPVSSYSA-N -1 3 358.225 3.805 20 0 FHADHM O=C([O-])N1CCC[C@H]1[C@H]1CCCCN1Cc1cnc(-c2ccccc2)nc1 ZINC000740514565 601924586 /nfs/dbraw/zinc/92/45/86/601924586.db2.gz CUPJIAWBMSPVNE-MOPGFXCFSA-N -1 3 366.465 3.641 20 0 FHADHM COc1ccc(CN[C@H](C(=O)[O-])c2cc(Cl)cc(Cl)c2)cc1OC ZINC000832340296 601971081 /nfs/dbraw/zinc/97/10/81/601971081.db2.gz CJGVXQWEEQIESB-INIZCTEOSA-N -1 3 370.232 3.926 20 0 FHADHM O=C([O-])[C@@H](c1cc(Cl)cc(Cl)c1)N1CCC[C@H](c2ncc[nH]2)C1 ZINC000833169397 602044275 /nfs/dbraw/zinc/04/42/75/602044275.db2.gz BBBIXHSUHYACGJ-IINYFYTJSA-N -1 3 354.237 3.722 20 0 FHADHM COc1ccc(CSc2nc3cc(C)ccc3o2)cc1-c1nnn[n-]1 ZINC000826208062 607547957 /nfs/dbraw/zinc/54/79/57/607547957.db2.gz QZKGODVTXZDILK-UHFFFAOYSA-N -1 3 353.407 3.617 20 0 FHADHM COc1ccc(CSc2nc3cc(C)ccc3o2)cc1-c1nn[n-]n1 ZINC000826208062 607547958 /nfs/dbraw/zinc/54/79/58/607547958.db2.gz QZKGODVTXZDILK-UHFFFAOYSA-N -1 3 353.407 3.617 20 0 FHADHM Cc1nc2ccccn2c1CN[C@@H](C(=O)[O-])c1ccccc1C(F)(F)F ZINC000833007540 602327663 /nfs/dbraw/zinc/32/76/63/602327663.db2.gz OJJTYIZLLZKACV-MRXNPFEDSA-N -1 3 363.339 3.577 20 0 FHADHM CCC(CC)[C@@H](CCNc1nc(C(F)(F)F)ccc1-c1nnn[n-]1)OC ZINC000825094777 607564388 /nfs/dbraw/zinc/56/43/88/607564388.db2.gz BLAYROQNYMSMPA-GFCCVEGCSA-N -1 3 372.395 3.534 20 0 FHADHM CCC(CC)[C@@H](CCNc1nc(C(F)(F)F)ccc1-c1nn[n-]n1)OC ZINC000825094777 607564389 /nfs/dbraw/zinc/56/43/89/607564389.db2.gz BLAYROQNYMSMPA-GFCCVEGCSA-N -1 3 372.395 3.534 20 0 FHADHM C[C@@H](NC(=O)[O-])C1CCN(Cc2cc(-c3ccc(Cl)cc3)no2)CC1 ZINC000739016813 602450991 /nfs/dbraw/zinc/45/09/91/602450991.db2.gz VXFCBNWIHCNIOU-GFCCVEGCSA-N -1 3 363.845 3.863 20 0 FHADHM COC[C@@H](Nc1ccc(C(F)(F)F)c(-c2nnn[n-]2)c1)c1ccc(C)o1 ZINC000826151776 607568907 /nfs/dbraw/zinc/56/89/07/607568907.db2.gz JIMHEHDBGHPWNH-CYBMUJFWSA-N -1 3 367.331 3.587 20 0 FHADHM COC[C@@H](Nc1ccc(C(F)(F)F)c(-c2nn[n-]n2)c1)c1ccc(C)o1 ZINC000826151776 607568908 /nfs/dbraw/zinc/56/89/08/607568908.db2.gz JIMHEHDBGHPWNH-CYBMUJFWSA-N -1 3 367.331 3.587 20 0 FHADHM CC[C@H](SC)C(=O)Oc1ccc(-c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000825159287 607571035 /nfs/dbraw/zinc/57/10/35/607571035.db2.gz MWVZTLPPGXTOST-INIZCTEOSA-N -1 3 354.435 3.581 20 0 FHADHM CC[C@H](SC)C(=O)Oc1ccc(-c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000825159287 607571037 /nfs/dbraw/zinc/57/10/37/607571037.db2.gz MWVZTLPPGXTOST-INIZCTEOSA-N -1 3 354.435 3.581 20 0 FHADHM O=C([O-])Nc1ccc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000740710071 602603097 /nfs/dbraw/zinc/60/30/97/602603097.db2.gz JTPDINPKFMHYCJ-OAHLLOKOSA-N -1 3 374.466 3.797 20 0 FHADHM CC[C@H](SC)C(=O)Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1 ZINC000825159392 607577845 /nfs/dbraw/zinc/57/78/45/607577845.db2.gz OJFZFJLMRYXKJJ-LBPRGKRZSA-N -1 3 359.480 3.675 20 0 FHADHM CC[C@H](SC)C(=O)Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1 ZINC000825159392 607577847 /nfs/dbraw/zinc/57/78/47/607577847.db2.gz OJFZFJLMRYXKJJ-LBPRGKRZSA-N -1 3 359.480 3.675 20 0 FHADHM Cc1ccc(NC(=O)[C@@H](C)[C@@H](NC(=O)[O-])c2ccccc2)c(CN(C)C)c1 ZINC000830352786 602934802 /nfs/dbraw/zinc/93/48/02/602934802.db2.gz JWPBLCLBAORQHO-HNAYVOBHSA-N -1 3 369.465 3.640 20 0 FHADHM O=C([O-])N1CC[C@@H](CN2CCC[C@H]2c2ccc(Br)cc2)C1 ZINC000740500814 603328315 /nfs/dbraw/zinc/32/83/15/603328315.db2.gz SDNVODPJRSXGMX-WFASDCNBSA-N -1 3 353.260 3.586 20 0 FHADHM C[C@@H](NCc1ccc(NC(=O)[O-])nc1)c1ccc(OCC(F)(F)F)cc1 ZINC000825501708 603540481 /nfs/dbraw/zinc/54/04/81/603540481.db2.gz DSEIDBBIAPPYEA-LLVKDONJSA-N -1 3 369.343 3.963 20 0 FHADHM CN1CCC(N(Cc2ccccc2)C(=O)c2cccc(NC(=O)[O-])c2)CC1 ZINC000828465366 603603403 /nfs/dbraw/zinc/60/34/03/603603403.db2.gz GKRROFBVEYDONA-UHFFFAOYSA-N -1 3 367.449 3.513 20 0 FHADHM Cc1cc2sc(NC(=O)c3ccc(-c4nnn[n-]4)cc3C)nc2c(C)c1 ZINC000826263723 607652020 /nfs/dbraw/zinc/65/20/20/607652020.db2.gz NPERZUWHVSAFMD-UHFFFAOYSA-N -1 3 364.434 3.654 20 0 FHADHM Cc1cc2sc(NC(=O)c3ccc(-c4nn[n-]n4)cc3C)nc2c(C)c1 ZINC000826263723 607652022 /nfs/dbraw/zinc/65/20/22/607652022.db2.gz NPERZUWHVSAFMD-UHFFFAOYSA-N -1 3 364.434 3.654 20 0 FHADHM CC[C@H](NC(=O)c1ccc(-c2nnn[n-]2)cc1C)c1cccc(Cl)c1 ZINC000825132642 607659377 /nfs/dbraw/zinc/65/93/77/607659377.db2.gz CCIDYKRUIZYDGY-INIZCTEOSA-N -1 3 355.829 3.710 20 0 FHADHM CC[C@H](NC(=O)c1ccc(-c2nn[n-]n2)cc1C)c1cccc(Cl)c1 ZINC000825132642 607659379 /nfs/dbraw/zinc/65/93/79/607659379.db2.gz CCIDYKRUIZYDGY-INIZCTEOSA-N -1 3 355.829 3.710 20 0 FHADHM CC(C)n1c2ccccc2nc1[C@@H]1CCCN1C[C@H]1CCN(C(=O)[O-])C1 ZINC000824515570 604098870 /nfs/dbraw/zinc/09/88/70/604098870.db2.gz QQZWSHCUSDBJQO-QAPCUYQASA-N -1 3 356.470 3.754 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1ccc(F)c(C(F)(F)F)c1 ZINC000826250146 607673774 /nfs/dbraw/zinc/67/37/74/607673774.db2.gz MVCNJRRRHKENPO-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1ccc(F)c(C(F)(F)F)c1 ZINC000826250146 607673776 /nfs/dbraw/zinc/67/37/76/607673776.db2.gz MVCNJRRRHKENPO-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM Cc1ccc(NC(=O)NC2(c3cccc(-c4nnn[n-]4)c3)CC2)cc1Cl ZINC000826290965 607673877 /nfs/dbraw/zinc/67/38/77/607673877.db2.gz IXOMDUSVNOQNAU-UHFFFAOYSA-N -1 3 368.828 3.639 20 0 FHADHM Cc1ccc(NC(=O)NC2(c3cccc(-c4nn[n-]n4)c3)CC2)cc1Cl ZINC000826290965 607673878 /nfs/dbraw/zinc/67/38/78/607673878.db2.gz IXOMDUSVNOQNAU-UHFFFAOYSA-N -1 3 368.828 3.639 20 0 FHADHM Cc1ccc(Oc2ccccc2NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)cc1 ZINC000826292577 607682786 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607734320 /nfs/dbraw/zinc/73/43/20/607734320.db2.gz ZHYQNOHCERTQRR-QMMMGPOBSA-N -1 3 366.347 3.706 20 0 FHADHM C[C@@H](NC(=O)[O-])c1ccc(CN[C@@H](C)c2ccc3c(c2)OCCO3)cc1 ZINC000825502736 605118612 /nfs/dbraw/zinc/11/86/12/605118612.db2.gz KCPKMYPFZLALOY-UONOGXRCSA-N -1 3 356.422 3.637 20 0 FHADHM COc1ccc([C@@H](C)NCc2ccc([C@H](C)NC(=O)[O-])cc2)cc1OC ZINC000829301300 605119721 /nfs/dbraw/zinc/11/97/21/605119721.db2.gz BNEDLAQMJZSUOK-KGLIPLIRSA-N -1 3 358.438 3.883 20 0 FHADHM CC(C)N(C(=O)CN[C@H](c1ccccc1)C(C)(C)C(=O)[O-])c1ccccc1 ZINC000833495792 605178443 /nfs/dbraw/zinc/17/84/43/605178443.db2.gz WAUPKXWCGDNWAH-HXUWFJFHSA-N -1 3 368.477 3.870 20 0 FHADHM C[C@H](c1ccccc1)N(C)C(=O)CN[C@H](c1ccccc1)C(C)(C)C(=O)[O-] ZINC000833548228 605184004 /nfs/dbraw/zinc/18/40/04/605184004.db2.gz JHILTYLHQOYDSZ-OXQOHEQNSA-N -1 3 368.477 3.648 20 0 FHADHM C[C@]1(CCCO)CCCN1Cc1csc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000833562821 605193574 /nfs/dbraw/zinc/19/35/74/605193574.db2.gz HLOYOJFSMSIYAT-LJQANCHMSA-N -1 3 360.479 3.635 20 0 FHADHM CC1=C(C(=O)[O-])C[C@@H](CN2CCC(c3nc(C(C)(C)C)cs3)CC2)O1 ZINC000833585738 605329466 /nfs/dbraw/zinc/32/94/66/605329466.db2.gz UTJUPVOYTTZDIW-AWEZNQCLSA-N -1 3 364.511 3.768 20 0 FHADHM CC[C@H](CC(=O)Nc1cccc(-c2nnn[n-]2)c1C)c1ccc(OC)cc1 ZINC000825083067 607755183 /nfs/dbraw/zinc/75/51/83/607755183.db2.gz WZYXUYSARRBTRM-CQSZACIVSA-N -1 3 365.437 3.706 20 0 FHADHM CC[C@H](CC(=O)Nc1cccc(-c2nn[n-]n2)c1C)c1ccc(OC)cc1 ZINC000825083067 607755184 /nfs/dbraw/zinc/75/51/84/607755184.db2.gz WZYXUYSARRBTRM-CQSZACIVSA-N -1 3 365.437 3.706 20 0 FHADHM CC1([C@@H]2CCCN([C@@H](C(=O)[O-])c3ccc(Cl)cc3Cl)C2)OCCO1 ZINC000833563129 605443200 /nfs/dbraw/zinc/44/32/00/605443200.db2.gz DEPWFSWYPOWZOC-IAQYHMDHSA-N -1 3 374.264 3.594 20 0 FHADHM O=C([O-])N1CCC[C@H]1[C@@H]1CCCN(Cc2cnc(-c3ccncc3)s2)C1 ZINC000834103956 605467983 /nfs/dbraw/zinc/46/79/83/605467983.db2.gz BLECRELNOBUJSX-WBVHZDCISA-N -1 3 372.494 3.560 20 0 FHADHM CCCN(Cc1coc(-c2ccc(OC)cc2)n1)C1CCN(C(=O)[O-])CC1 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O=C([O-])N1CCC([C@H](NCc2cccc(O)c2)c2ccc(F)cc2)CC1 ZINC000834074244 605982820 /nfs/dbraw/zinc/98/28/20/605982820.db2.gz LHIVLOUPQRYFKZ-LJQANCHMSA-N -1 3 358.413 3.752 20 0 FHADHM C[C@H](Nc1nc2ccccc2cc1-c1nnn[n-]1)c1ccc(F)cc1F ZINC000820461549 606025735 /nfs/dbraw/zinc/02/57/35/606025735.db2.gz MDCMTBQWOZNUPJ-JTQLQIEISA-N -1 3 352.348 3.866 20 0 FHADHM C[C@H](Nc1nc2ccccc2cc1-c1nn[n-]n1)c1ccc(F)cc1F ZINC000820461549 606025741 /nfs/dbraw/zinc/02/57/41/606025741.db2.gz MDCMTBQWOZNUPJ-JTQLQIEISA-N -1 3 352.348 3.866 20 0 FHADHM CCOc1ccc([C@H](C)Nc2nc3ccccc3cc2-c2nnn[n-]2)cc1 ZINC000821416922 606029167 /nfs/dbraw/zinc/02/91/67/606029167.db2.gz FPYASGQCUCBPTO-ZDUSSCGKSA-N -1 3 360.421 3.987 20 0 FHADHM CCOc1ccc([C@H](C)Nc2nc3ccccc3cc2-c2nn[n-]n2)cc1 ZINC000821416922 606029169 /nfs/dbraw/zinc/02/91/69/606029169.db2.gz FPYASGQCUCBPTO-ZDUSSCGKSA-N -1 3 360.421 3.987 20 0 FHADHM CCc1cccc2c(C3CCN(c4ccc(-c5nnn[n-]5)nc4)CC3)c[nH]c21 ZINC000821492863 606055643 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CC(=CC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1cccc(Cl)c1 ZINC000819765318 606116367 /nfs/dbraw/zinc/11/63/67/606116367.db2.gz OHOHMPQGTZLGSA-CNELAYHGSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=CC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1cccc(Cl)c1 ZINC000819765318 606116369 /nfs/dbraw/zinc/11/63/69/606116369.db2.gz OHOHMPQGTZLGSA-CNELAYHGSA-N -1 3 367.840 3.801 20 0 FHADHM CC[C@@H](C)Oc1ccc(C(=O)Nc2sc(C)c(C)c2-c2nnn[n-]2)cc1 ZINC000820877051 606121471 /nfs/dbraw/zinc/12/14/71/606121471.db2.gz YTSFGHLLEVOBOT-SNVBAGLBSA-N -1 3 371.466 3.975 20 0 FHADHM CC[C@@H](C)Oc1ccc(C(=O)Nc2sc(C)c(C)c2-c2nn[n-]n2)cc1 ZINC000820877051 606121473 /nfs/dbraw/zinc/12/14/73/606121473.db2.gz YTSFGHLLEVOBOT-SNVBAGLBSA-N -1 3 371.466 3.975 20 0 FHADHM C[C@H](OC(=O)[C@H](C)c1ccc(Cl)s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820480889 606127052 /nfs/dbraw/zinc/12/70/52/606127052.db2.gz QEEKDTWJKCCHSL-ZJUUUORDSA-N -1 3 362.842 3.990 20 0 FHADHM C[C@H](OC(=O)[C@H](C)c1ccc(Cl)s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820480889 606127054 /nfs/dbraw/zinc/12/70/54/606127054.db2.gz QEEKDTWJKCCHSL-ZJUUUORDSA-N -1 3 362.842 3.990 20 0 FHADHM COc1ccc([C@H](C)CC(=O)O[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000821777119 606127840 /nfs/dbraw/zinc/12/78/40/606127840.db2.gz APMWEKKHVZYMTH-KGLIPLIRSA-N -1 3 366.421 3.673 20 0 FHADHM COc1ccc([C@H](C)CC(=O)O[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000821777119 606127841 /nfs/dbraw/zinc/12/78/41/606127841.db2.gz APMWEKKHVZYMTH-KGLIPLIRSA-N -1 3 366.421 3.673 20 0 FHADHM COc1ccc(CNc2ccc(OC(C)C)cc2C)cc1-c1nnn[n-]1 ZINC000821821572 606132838 /nfs/dbraw/zinc/13/28/38/606132838.db2.gz LPPVHWJUQRTRSV-UHFFFAOYSA-N -1 3 353.426 3.583 20 0 FHADHM COc1ccc(CNc2ccc(OC(C)C)cc2C)cc1-c1nn[n-]n1 ZINC000821821572 606132839 /nfs/dbraw/zinc/13/28/39/606132839.db2.gz LPPVHWJUQRTRSV-UHFFFAOYSA-N -1 3 353.426 3.583 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NCc1cn2cc(Cl)cc(Cl)c2n1 ZINC000822221469 606156526 /nfs/dbraw/zinc/15/65/26/606156526.db2.gz PTSDKMZGWGYMRD-UHFFFAOYSA-N -1 3 374.235 3.742 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NCc1cn2cc(Cl)cc(Cl)c2n1 ZINC000822221469 606156527 /nfs/dbraw/zinc/15/65/27/606156527.db2.gz PTSDKMZGWGYMRD-UHFFFAOYSA-N -1 3 374.235 3.742 20 0 FHADHM CCN(Cc1csc([C@H](C)OC)n1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821230562 606158355 /nfs/dbraw/zinc/15/83/55/606158355.db2.gz NICVCNWCDASRAX-STQMWFEESA-N -1 3 372.498 3.614 20 0 FHADHM CCN(Cc1csc([C@H](C)OC)n1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821230562 606158357 /nfs/dbraw/zinc/15/83/57/606158357.db2.gz NICVCNWCDASRAX-STQMWFEESA-N -1 3 372.498 3.614 20 0 FHADHM C[C@@H]1c2ccccc2CN1C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820825651 606165539 /nfs/dbraw/zinc/16/55/39/606165539.db2.gz AGUXYLZUAIKDNQ-SNVBAGLBSA-N -1 3 370.869 3.794 20 0 FHADHM C[C@@H]1c2ccccc2CN1C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820825651 606165540 /nfs/dbraw/zinc/16/55/40/606165540.db2.gz AGUXYLZUAIKDNQ-SNVBAGLBSA-N -1 3 370.869 3.794 20 0 FHADHM O=C(Nc1sc2c(c1-c1nnn[n-]1)CCCCC2)[C@H]1[C@@H]2CCCC[C@@H]21 ZINC000823387764 606183663 /nfs/dbraw/zinc/18/36/63/606183663.db2.gz WXIAOJUMSREZJL-YABSGUDNSA-N -1 3 357.483 3.572 20 0 FHADHM O=C(Nc1sc2c(c1-c1nn[n-]n1)CCCCC2)[C@H]1[C@@H]2CCCC[C@@H]21 ZINC000823387764 606183664 /nfs/dbraw/zinc/18/36/64/606183664.db2.gz WXIAOJUMSREZJL-YABSGUDNSA-N -1 3 357.483 3.572 20 0 FHADHM COC[C@@H](Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)c1ccc(C)o1 ZINC000821684374 606223409 /nfs/dbraw/zinc/22/34/09/606223409.db2.gz ZUDPZZMKZGRELL-CYBMUJFWSA-N -1 3 367.331 3.587 20 0 FHADHM COC[C@@H](Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)c1ccc(C)o1 ZINC000821684374 606223412 /nfs/dbraw/zinc/22/34/12/606223412.db2.gz ZUDPZZMKZGRELL-CYBMUJFWSA-N -1 3 367.331 3.587 20 0 FHADHM CC(C)[C@@H](CNc1cc(-c2nnn[n-]2)nc2ccccc21)c1cccnc1 ZINC000820021507 606229259 /nfs/dbraw/zinc/22/92/59/606229259.db2.gz VRCCOGGBSXYVLA-MRXNPFEDSA-N -1 3 359.437 3.662 20 0 FHADHM O=C(Nc1sc2c(c1-c1nnn[n-]1)CCCCCC2)[C@@H]1C[C@@H]1C1CC1 ZINC000823387642 606233434 /nfs/dbraw/zinc/23/34/34/606233434.db2.gz SDKIRUGHVHZARF-CHWSQXEVSA-N -1 3 357.483 3.572 20 0 FHADHM O=C(Nc1sc2c(c1-c1nn[n-]n1)CCCCCC2)[C@@H]1C[C@@H]1C1CC1 ZINC000823387642 606233436 /nfs/dbraw/zinc/23/34/36/606233436.db2.gz SDKIRUGHVHZARF-CHWSQXEVSA-N -1 3 357.483 3.572 20 0 FHADHM CCc1cc(Oc2ccc(Oc3ccc(-c4nnn[n-]4)cc3)cc2)ncn1 ZINC000821476926 606241577 /nfs/dbraw/zinc/24/15/77/606241577.db2.gz VBBIHSWVENIXBE-UHFFFAOYSA-N -1 3 360.377 3.804 20 0 FHADHM CCc1cc(Oc2ccc(Oc3ccc(-c4nn[n-]n4)cc3)cc2)ncn1 ZINC000821476926 606241579 /nfs/dbraw/zinc/24/15/79/606241579.db2.gz VBBIHSWVENIXBE-UHFFFAOYSA-N -1 3 360.377 3.804 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)c1ccc2c(c1)Cc1ccccc1-2 ZINC000823345674 606265696 /nfs/dbraw/zinc/26/56/96/606265696.db2.gz BMYSMLOSADUVKF-UHFFFAOYSA-N -1 3 371.375 3.829 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)c1ccc2c(c1)Cc1ccccc1-2 ZINC000823345674 606265697 /nfs/dbraw/zinc/26/56/97/606265697.db2.gz BMYSMLOSADUVKF-UHFFFAOYSA-N -1 3 371.375 3.829 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@H]2C(=O)Nc2ccc(F)cc2-c2nnn[n-]2)cc1 ZINC000820192786 606266388 /nfs/dbraw/zinc/26/63/88/606266388.db2.gz ZIJVRGKEKBHWFR-JKSUJKDBSA-N -1 3 365.412 3.871 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@H]2C(=O)Nc2ccc(F)cc2-c2nn[n-]n2)cc1 ZINC000820192786 606266390 /nfs/dbraw/zinc/26/63/90/606266390.db2.gz ZIJVRGKEKBHWFR-JKSUJKDBSA-N -1 3 365.412 3.871 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)[C@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000823344355 606271144 /nfs/dbraw/zinc/27/11/44/606271144.db2.gz WGQFTNBILDXUCO-IRXDYDNUSA-N -1 3 373.391 3.901 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)[C@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000823344355 606271145 /nfs/dbraw/zinc/27/11/45/606271145.db2.gz WGQFTNBILDXUCO-IRXDYDNUSA-N -1 3 373.391 3.901 20 0 FHADHM CCCCCOc1ccc(C(=O)Nc2ccc(F)cc2-c2nnn[n-]2)cc1 ZINC000821062338 606272741 /nfs/dbraw/zinc/27/27/41/606272741.db2.gz WTGOWFHRZHCPFO-UHFFFAOYSA-N -1 3 369.400 3.827 20 0 FHADHM CCCCCOc1ccc(C(=O)Nc2ccc(F)cc2-c2nn[n-]n2)cc1 ZINC000821062338 606272743 /nfs/dbraw/zinc/27/27/43/606272743.db2.gz WTGOWFHRZHCPFO-UHFFFAOYSA-N -1 3 369.400 3.827 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@@H](C)c1cccc(F)c1 ZINC000821119378 606281835 /nfs/dbraw/zinc/28/18/35/606281835.db2.gz YFXSNLACXLLTCS-LBPRGKRZSA-N -1 3 368.416 3.570 20 0 FHADHM C/C=C(/C)C(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)cc1C ZINC000820826130 606285744 /nfs/dbraw/zinc/28/57/44/606285744.db2.gz JQAUCICPXTXFQO-PQMHYQBVSA-N -1 3 363.421 3.659 20 0 FHADHM C/C=C(/C)C(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)cc1C ZINC000820826130 606285745 /nfs/dbraw/zinc/28/57/45/606285745.db2.gz JQAUCICPXTXFQO-PQMHYQBVSA-N -1 3 363.421 3.659 20 0 FHADHM C/C=C(\C)C(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1 ZINC000820825847 606293976 /nfs/dbraw/zinc/29/39/76/606293976.db2.gz FNHDGHQMTQCHRJ-QDEBKDIKSA-N -1 3 353.357 3.703 20 0 FHADHM C/C=C(\C)C(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1 ZINC000820825847 606293978 /nfs/dbraw/zinc/29/39/78/606293978.db2.gz FNHDGHQMTQCHRJ-QDEBKDIKSA-N -1 3 353.357 3.703 20 0 FHADHM Fc1ccccc1-c1nc(CNc2ccc(-c3nn[n-]n3)cc2)cs1 ZINC000822792263 606309986 /nfs/dbraw/zinc/30/99/86/606309986.db2.gz SSVYJTHIILZNFV-UHFFFAOYSA-N -1 3 352.398 3.741 20 0 FHADHM C[C@@H](Sc1cccc(-c2nnn[n-]2)c1)C(=O)Nc1cccc(Cl)c1 ZINC000820557022 606325490 /nfs/dbraw/zinc/32/54/90/606325490.db2.gz XHHKKXQSZVMYEZ-SNVBAGLBSA-N -1 3 359.842 3.639 20 0 FHADHM C[C@@H](Sc1cccc(-c2nn[n-]n2)c1)C(=O)Nc1cccc(Cl)c1 ZINC000820557022 606325492 /nfs/dbraw/zinc/32/54/92/606325492.db2.gz XHHKKXQSZVMYEZ-SNVBAGLBSA-N -1 3 359.842 3.639 20 0 FHADHM c1sc(-c2ccccn2)nc1CSc1cccc(-c2nnn[n-]2)c1 ZINC000823766705 606328003 /nfs/dbraw/zinc/32/80/03/606328003.db2.gz IBARCFCATFZBCP-UHFFFAOYSA-N -1 3 352.448 3.678 20 0 FHADHM c1sc(-c2ccccn2)nc1CSc1cccc(-c2nn[n-]n2)c1 ZINC000823766705 606328004 /nfs/dbraw/zinc/32/80/04/606328004.db2.gz IBARCFCATFZBCP-UHFFFAOYSA-N -1 3 352.448 3.678 20 0 FHADHM c1[nH]c(-c2nc(-c3ccc(-c4ccccc4)cc3)no2)cc1-c1nnn[n-]1 ZINC000823767126 606328350 /nfs/dbraw/zinc/32/83/50/606328350.db2.gz MWSIMYKXOPJMGQ-UHFFFAOYSA-N -1 3 355.361 3.579 20 0 FHADHM c1[nH]c(-c2nc(-c3ccc(-c4ccccc4)cc3)no2)cc1-c1nn[n-]n1 ZINC000823767126 606328351 /nfs/dbraw/zinc/32/83/51/606328351.db2.gz MWSIMYKXOPJMGQ-UHFFFAOYSA-N -1 3 355.361 3.579 20 0 FHADHM Clc1ccccc1-c1nnc(CSc2cccc(-c3nnn[n-]3)c2)o1 ZINC000822586198 606329085 /nfs/dbraw/zinc/32/90/85/606329085.db2.gz SUDPPRSIMPVSNT-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1ccccc1-c1nnc(CSc2cccc(-c3nn[n-]n3)c2)o1 ZINC000822586198 606329087 /nfs/dbraw/zinc/32/90/87/606329087.db2.gz SUDPPRSIMPVSNT-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM CCC(CC)N(CC(C)C)C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820898003 606330957 /nfs/dbraw/zinc/33/09/57/606330957.db2.gz RYJYXQUIJIEIPT-AWEZNQCLSA-N -1 3 358.490 3.784 20 0 FHADHM CCC(CC)N(CC(C)C)C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820898003 606330959 /nfs/dbraw/zinc/33/09/59/606330959.db2.gz RYJYXQUIJIEIPT-AWEZNQCLSA-N -1 3 358.490 3.784 20 0 FHADHM C[C@@H](OC(=O)C1(c2ccc(Cl)cc2)CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820486712 606340234 /nfs/dbraw/zinc/34/02/34/606340234.db2.gz CKRCCDBSGPIVIJ-GFCCVEGCSA-N -1 3 368.824 3.856 20 0 FHADHM C[C@@H](OC(=O)C1(c2ccc(Cl)cc2)CC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820486712 606340236 /nfs/dbraw/zinc/34/02/36/606340236.db2.gz CKRCCDBSGPIVIJ-GFCCVEGCSA-N -1 3 368.824 3.856 20 0 FHADHM C[C@H](OC(=O)C(C)(C)c1ccccc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000820480996 606340666 /nfs/dbraw/zinc/34/06/66/606340666.db2.gz RGTAGORFVWKOSD-LBPRGKRZSA-N -1 3 354.385 3.588 20 0 FHADHM C[C@H](OC(=O)C(C)(C)c1ccccc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000820480996 606340668 /nfs/dbraw/zinc/34/06/68/606340668.db2.gz RGTAGORFVWKOSD-LBPRGKRZSA-N -1 3 354.385 3.588 20 0 FHADHM C[C@H](CCOc1ccccc1)C(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820249562 606341422 /nfs/dbraw/zinc/34/14/22/606341422.db2.gz WSHOBPLKWUFNBE-HUUCEWRRSA-N -1 3 366.421 3.576 20 0 FHADHM C[C@H](CCOc1ccccc1)C(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820249562 606341423 /nfs/dbraw/zinc/34/14/23/606341423.db2.gz WSHOBPLKWUFNBE-HUUCEWRRSA-N -1 3 366.421 3.576 20 0 FHADHM C[C@H](SCc1ccccc1)C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820549901 606349861 /nfs/dbraw/zinc/34/98/61/606349861.db2.gz SYNPLMUZLQKFKZ-KBPBESRZSA-N -1 3 368.462 3.793 20 0 FHADHM C[C@H](SCc1ccccc1)C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820549901 606349862 /nfs/dbraw/zinc/34/98/62/606349862.db2.gz SYNPLMUZLQKFKZ-KBPBESRZSA-N -1 3 368.462 3.793 20 0 FHADHM Cc1ccc(Cl)c(OCC(=O)O[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000822239859 606351713 /nfs/dbraw/zinc/35/17/13/606351713.db2.gz HZUFRDQHQQIFLB-GFCCVEGCSA-N -1 3 372.812 3.512 20 0 FHADHM Cc1ccc(Cl)c(OCC(=O)O[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000822239859 606351714 /nfs/dbraw/zinc/35/17/14/606351714.db2.gz HZUFRDQHQQIFLB-GFCCVEGCSA-N -1 3 372.812 3.512 20 0 FHADHM C[C@H](CC(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1)c1cccc(F)c1 ZINC000820225282 606353951 /nfs/dbraw/zinc/35/39/51/606353951.db2.gz FPYLKQPUKOLJRI-CHWSQXEVSA-N -1 3 354.385 3.804 20 0 FHADHM C[C@H](CC(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1)c1cccc(F)c1 ZINC000820225282 606353953 /nfs/dbraw/zinc/35/39/53/606353953.db2.gz FPYLKQPUKOLJRI-CHWSQXEVSA-N -1 3 354.385 3.804 20 0 FHADHM Cc1cccc(C(=O)Oc2ccc(Oc3ccc(-c4nnn[n-]4)cc3)cc2)n1 ZINC000822289319 606360660 /nfs/dbraw/zinc/36/06/60/606360660.db2.gz VWPNXEDIYAQXKL-UHFFFAOYSA-N -1 3 373.372 3.582 20 0 FHADHM Cc1cccc(C(=O)Oc2ccc(Oc3ccc(-c4nn[n-]n4)cc3)cc2)n1 ZINC000822289319 606360662 /nfs/dbraw/zinc/36/06/62/606360662.db2.gz VWPNXEDIYAQXKL-UHFFFAOYSA-N -1 3 373.372 3.582 20 0 FHADHM CC(=O)c1ccc2cc(OCc3ccc(-c4nnn[n-]4)cc3F)ccc2c1 ZINC000819833663 606366839 /nfs/dbraw/zinc/36/68/39/606366839.db2.gz JTSSKCKLVLKZRL-UHFFFAOYSA-N -1 3 362.364 3.941 20 0 FHADHM CC(=O)c1ccc2cc(OCc3ccc(-c4nn[n-]n4)cc3F)ccc2c1 ZINC000819833663 606366842 /nfs/dbraw/zinc/36/68/42/606366842.db2.gz JTSSKCKLVLKZRL-UHFFFAOYSA-N -1 3 362.364 3.941 20 0 FHADHM Fc1cc2nc(C(Cl)=Cc3ccc(-c4nnn[n-]4)s3)[nH]c2cc1F ZINC000822754417 606390793 /nfs/dbraw/zinc/39/07/93/606390793.db2.gz ZOUCJQBOECUONX-XVNBXDOJSA-N -1 3 364.768 3.820 20 0 FHADHM CCc1ccc(CCC(=O)N(C)c2cc(Cl)ccc2-c2nnn[n-]2)cc1 ZINC000821480651 606413804 /nfs/dbraw/zinc/41/38/04/606413804.db2.gz CPCUFKNUQLKPMF-UHFFFAOYSA-N -1 3 369.856 3.678 20 0 FHADHM CCc1ccc(CCC(=O)N(C)c2cc(Cl)ccc2-c2nn[n-]n2)cc1 ZINC000821480651 606413805 /nfs/dbraw/zinc/41/38/05/606413805.db2.gz CPCUFKNUQLKPMF-UHFFFAOYSA-N -1 3 369.856 3.678 20 0 FHADHM C[C@H]1c2c(Cl)cc(Cl)cc2CCN1c1ccc(-c2nnn[n-]2)cn1 ZINC000820819338 606429921 /nfs/dbraw/zinc/42/99/21/606429921.db2.gz HPTSHNMQVJYRIY-VIFPVBQESA-N -1 3 361.236 3.692 20 0 FHADHM C[C@H]1c2c(Cl)cc(Cl)cc2CCN1c1ccc(-c2nn[n-]n2)cn1 ZINC000820819338 606429922 /nfs/dbraw/zinc/42/99/22/606429922.db2.gz HPTSHNMQVJYRIY-VIFPVBQESA-N -1 3 361.236 3.692 20 0 FHADHM CC1(CNC(=O)c2ccc(Sc3ccccc3-c3nnn[n-]3)cc2)CC1 ZINC000820618522 606446371 /nfs/dbraw/zinc/44/63/71/606446371.db2.gz HFBCEQAWLYDSPT-UHFFFAOYSA-N -1 3 365.462 3.548 20 0 FHADHM CC1(CNC(=O)c2ccc(Sc3ccccc3-c3nn[n-]n3)cc2)CC1 ZINC000820618522 606446373 /nfs/dbraw/zinc/44/63/73/606446373.db2.gz HFBCEQAWLYDSPT-UHFFFAOYSA-N -1 3 365.462 3.548 20 0 FHADHM Cc1ccc(Br)cc1NCc1cc(-c2nnn[n-]2)ccc1F ZINC000822225167 606449046 /nfs/dbraw/zinc/44/90/46/606449046.db2.gz QZVPOFOKIZFORQ-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Cc1ccc(Br)cc1NCc1cc(-c2nn[n-]n2)ccc1F ZINC000822225167 606449048 /nfs/dbraw/zinc/44/90/48/606449048.db2.gz QZVPOFOKIZFORQ-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM O=C(c1ccccc1)c1cccc(NCc2cccc(-c3nnn[n-]3)c2)c1 ZINC000823493528 606456208 /nfs/dbraw/zinc/45/62/08/606456208.db2.gz PKRRYTXTCYWEEG-UHFFFAOYSA-N -1 3 355.401 3.710 20 0 FHADHM O=C(c1ccccc1)c1cccc(NCc2cccc(-c3nn[n-]n3)c2)c1 ZINC000823493528 606456210 /nfs/dbraw/zinc/45/62/10/606456210.db2.gz PKRRYTXTCYWEEG-UHFFFAOYSA-N -1 3 355.401 3.710 20 0 FHADHM CCC(=O)Nc1ccc(Cl)c(NCc2cc(-c3nnn[n-]3)ccc2F)c1 ZINC000820837257 606458292 /nfs/dbraw/zinc/45/82/92/606458292.db2.gz HKGJCJWKBQUNOZ-UHFFFAOYSA-N -1 3 374.807 3.620 20 0 FHADHM CCC(=O)Nc1ccc(Cl)c(NCc2cc(-c3nn[n-]n3)ccc2F)c1 ZINC000820837257 606458294 /nfs/dbraw/zinc/45/82/94/606458294.db2.gz HKGJCJWKBQUNOZ-UHFFFAOYSA-N -1 3 374.807 3.620 20 0 FHADHM Fc1ccc(NCc2cccc(-c3nnn[n-]3)c2)c(OCC(F)(F)F)c1 ZINC000822783155 606459500 /nfs/dbraw/zinc/45/95/00/606459500.db2.gz XPXSZVWJZYNNJO-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM Fc1ccc(NCc2cccc(-c3nn[n-]n3)c2)c(OCC(F)(F)F)c1 ZINC000822783155 606459501 /nfs/dbraw/zinc/45/95/01/606459501.db2.gz XPXSZVWJZYNNJO-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM CC[C@@H](OC(=O)c1cc(-c2nnn[n-]2)cs1)c1ccc(F)cc1F ZINC000820938450 606466886 /nfs/dbraw/zinc/46/68/86/606466886.db2.gz JAADJAYKYCJRHO-GFCCVEGCSA-N -1 3 350.350 3.515 20 0 FHADHM CC[C@@H](OC(=O)c1cc(-c2nn[n-]n2)cs1)c1ccc(F)cc1F ZINC000820938450 606466887 /nfs/dbraw/zinc/46/68/87/606466887.db2.gz JAADJAYKYCJRHO-GFCCVEGCSA-N -1 3 350.350 3.515 20 0 FHADHM CC(C)(C)OCc1ccc(NC(=O)Nc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000819950758 606479416 /nfs/dbraw/zinc/47/94/16/606479416.db2.gz MOLJMOWXHBPBOP-UHFFFAOYSA-N -1 3 366.425 3.826 20 0 FHADHM CC(C)(C)OCc1ccc(NC(=O)Nc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000819950758 606479419 /nfs/dbraw/zinc/47/94/19/606479419.db2.gz MOLJMOWXHBPBOP-UHFFFAOYSA-N -1 3 366.425 3.826 20 0 FHADHM O=C(N[C@@H](c1ccccc1)C1CCCC1)c1cc(-c2nnn[n-]2)cs1 ZINC000823140354 606496142 /nfs/dbraw/zinc/49/61/42/606496142.db2.gz SZOMWSJMUXLHQN-INIZCTEOSA-N -1 3 353.451 3.590 20 0 FHADHM O=C(N[C@@H](c1ccccc1)C1CCCC1)c1cc(-c2nn[n-]n2)cs1 ZINC000823140354 606496143 /nfs/dbraw/zinc/49/61/43/606496143.db2.gz SZOMWSJMUXLHQN-INIZCTEOSA-N -1 3 353.451 3.590 20 0 FHADHM O=C(c1cc(-c2nnn[n-]2)cs1)N1CCCCC[C@H]1c1ccccc1 ZINC000823472482 606496406 /nfs/dbraw/zinc/49/64/06/606496406.db2.gz OCVCOMNKHHJLIF-HNNXBMFYSA-N -1 3 353.451 3.686 20 0 FHADHM O=C(c1cc(-c2nn[n-]n2)cs1)N1CCCCC[C@H]1c1ccccc1 ZINC000823472482 606496407 /nfs/dbraw/zinc/49/64/07/606496407.db2.gz OCVCOMNKHHJLIF-HNNXBMFYSA-N -1 3 353.451 3.686 20 0 FHADHM C[C@H](NC(=O)Cc1cccc(-c2nnn[n-]2)c1)c1ccc(C(C)(C)C)cc1 ZINC000820333460 606504612 /nfs/dbraw/zinc/50/46/12/606504612.db2.gz CNPQCSKZBRSVLE-AWEZNQCLSA-N -1 3 363.465 3.584 20 0 FHADHM C[C@H](NC(=O)Cc1cccc(-c2nn[n-]n2)c1)c1ccc(C(C)(C)C)cc1 ZINC000820333460 606504614 /nfs/dbraw/zinc/50/46/14/606504614.db2.gz CNPQCSKZBRSVLE-AWEZNQCLSA-N -1 3 363.465 3.584 20 0 FHADHM O=C(CCC1CCC1)N(Cc1ccccc1)c1ccccc1-c1nnn[n-]1 ZINC000822950545 606507677 /nfs/dbraw/zinc/50/76/77/606507677.db2.gz SDKSXMYRGWZIBP-UHFFFAOYSA-N -1 3 361.449 3.980 20 0 FHADHM O=C(CCC1CCC1)N(Cc1ccccc1)c1ccccc1-c1nn[n-]n1 ZINC000822950545 606507680 /nfs/dbraw/zinc/50/76/80/606507680.db2.gz SDKSXMYRGWZIBP-UHFFFAOYSA-N -1 3 361.449 3.980 20 0 FHADHM Cc1cccc([C@@H]2CCCCCN2C(=O)c2cc(-c3nnn[n-]3)cs2)c1 ZINC000822299884 606514266 /nfs/dbraw/zinc/51/42/66/606514266.db2.gz YHFCVQBESJJMMP-INIZCTEOSA-N -1 3 367.478 3.994 20 0 FHADHM Cc1cccc([C@@H]2CCCCCN2C(=O)c2cc(-c3nn[n-]n3)cs2)c1 ZINC000822299884 606514268 /nfs/dbraw/zinc/51/42/68/606514268.db2.gz YHFCVQBESJJMMP-INIZCTEOSA-N -1 3 367.478 3.994 20 0 FHADHM Cc1ccc([C@@H]2[C@H](C)CCCN2C(=O)c2cc(-c3nnn[n-]3)cs2)cc1 ZINC000822231786 606516129 /nfs/dbraw/zinc/51/61/29/606516129.db2.gz HNGXNMBQEJBYDP-DYVFJYSZSA-N -1 3 367.478 3.850 20 0 FHADHM Cc1ccc([C@@H]2[C@H](C)CCCN2C(=O)c2cc(-c3nn[n-]n3)cs2)cc1 ZINC000822231786 606516130 /nfs/dbraw/zinc/51/61/30/606516130.db2.gz HNGXNMBQEJBYDP-DYVFJYSZSA-N -1 3 367.478 3.850 20 0 FHADHM CCN(Cc1ccc2ccccc2c1)C(=O)Cc1cccc(-c2nnn[n-]2)c1 ZINC000821222793 606524457 /nfs/dbraw/zinc/52/44/57/606524457.db2.gz ZOKCPHWAABCMSX-UHFFFAOYSA-N -1 3 371.444 3.611 20 0 FHADHM CCN(Cc1ccc2ccccc2c1)C(=O)Cc1cccc(-c2nn[n-]n2)c1 ZINC000821222793 606524459 /nfs/dbraw/zinc/52/44/59/606524459.db2.gz ZOKCPHWAABCMSX-UHFFFAOYSA-N -1 3 371.444 3.611 20 0 FHADHM O=C(Cc1cccc(-c2nnn[n-]2)c1)Nc1cccc(-c2cccs2)c1 ZINC000823109019 606544663 /nfs/dbraw/zinc/54/46/63/606544663.db2.gz VINFZWFPKHKYIN-UHFFFAOYSA-N -1 3 361.430 3.776 20 0 FHADHM O=C(Cc1cccc(-c2nn[n-]n2)c1)Nc1cccc(-c2cccs2)c1 ZINC000823109019 606544665 /nfs/dbraw/zinc/54/46/65/606544665.db2.gz VINFZWFPKHKYIN-UHFFFAOYSA-N -1 3 361.430 3.776 20 0 FHADHM Cc1ccccc1[C@@H](CC(C)C)NC(=O)Cc1cccc(-c2nnn[n-]2)c1 ZINC000822345759 606560470 /nfs/dbraw/zinc/56/04/70/606560470.db2.gz QTSSMPRGMGWYTN-LJQANCHMSA-N -1 3 363.465 3.621 20 0 FHADHM Cc1ccccc1[C@@H](CC(C)C)NC(=O)Cc1cccc(-c2nn[n-]n2)c1 ZINC000822345759 606560472 /nfs/dbraw/zinc/56/04/72/606560472.db2.gz QTSSMPRGMGWYTN-LJQANCHMSA-N -1 3 363.465 3.621 20 0 FHADHM CN(C(=O)Cc1cccc(-c2nnn[n-]2)c1)c1ccc(-c2ccccc2)cc1 ZINC000821572298 606575824 /nfs/dbraw/zinc/57/58/24/606575824.db2.gz YXPCFMYZEINNDD-UHFFFAOYSA-N -1 3 369.428 3.739 20 0 FHADHM CN(C(=O)Cc1cccc(-c2nn[n-]n2)c1)c1ccc(-c2ccccc2)cc1 ZINC000821572298 606575826 /nfs/dbraw/zinc/57/58/26/606575826.db2.gz YXPCFMYZEINNDD-UHFFFAOYSA-N -1 3 369.428 3.739 20 0 FHADHM CC(=O)c1ccc(OCc2ccc(-c3nnn[n-]3)cc2OC(F)F)c(C)c1 ZINC000819832675 606590408 /nfs/dbraw/zinc/59/04/08/606590408.db2.gz AOPHEWKWFUDDNZ-UHFFFAOYSA-N -1 3 374.347 3.558 20 0 FHADHM CC(=O)c1ccc(OCc2ccc(-c3nn[n-]n3)cc2OC(F)F)c(C)c1 ZINC000819832675 606590410 /nfs/dbraw/zinc/59/04/10/606590410.db2.gz AOPHEWKWFUDDNZ-UHFFFAOYSA-N -1 3 374.347 3.558 20 0 FHADHM CC(C)(C)OCCSCc1ccc(-c2nnn[n-]2)cc1OC(F)F ZINC000819950871 606597821 /nfs/dbraw/zinc/59/78/21/606597821.db2.gz NUJMTQFTCZBBEV-UHFFFAOYSA-N -1 3 358.414 3.516 20 0 FHADHM CC(C)(C)OCCSCc1ccc(-c2nn[n-]n2)cc1OC(F)F ZINC000819950871 606597823 /nfs/dbraw/zinc/59/78/23/606597823.db2.gz NUJMTQFTCZBBEV-UHFFFAOYSA-N -1 3 358.414 3.516 20 0 FHADHM O=C(CCc1ccoc1)Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1 ZINC000822983142 606603486 /nfs/dbraw/zinc/60/34/86/606603486.db2.gz LDUOXRWLJCCUPX-UHFFFAOYSA-N -1 3 365.418 3.760 20 0 FHADHM O=C(CCc1ccoc1)Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1 ZINC000822983142 606603487 /nfs/dbraw/zinc/60/34/87/606603487.db2.gz LDUOXRWLJCCUPX-UHFFFAOYSA-N -1 3 365.418 3.760 20 0 FHADHM Cc1ccc(Oc2ccccc2)c(NC(=O)c2cc(-c3nnn[n-]3)cn2C)c1 ZINC000822266802 606622583 /nfs/dbraw/zinc/62/25/83/606622583.db2.gz JLHNAHDOFSAVMW-UHFFFAOYSA-N -1 3 374.404 3.558 20 0 FHADHM Cc1ccc(Oc2ccccc2)c(NC(=O)c2cc(-c3nn[n-]n3)cn2C)c1 ZINC000822266802 606622585 /nfs/dbraw/zinc/62/25/85/606622585.db2.gz JLHNAHDOFSAVMW-UHFFFAOYSA-N -1 3 374.404 3.558 20 0 FHADHM O=C(OCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1)C1CC(F)(F)C1 ZINC000823417581 606635513 /nfs/dbraw/zinc/63/55/13/606635513.db2.gz DHGQLFQIYIPPGT-UHFFFAOYSA-N -1 3 370.359 3.622 20 0 FHADHM O=C(OCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1)C1CC(F)(F)C1 ZINC000823417581 606635514 /nfs/dbraw/zinc/63/55/14/606635514.db2.gz DHGQLFQIYIPPGT-UHFFFAOYSA-N -1 3 370.359 3.622 20 0 FHADHM CC(C)(C)c1ccc(OC(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)cc1 ZINC000819957527 606663537 /nfs/dbraw/zinc/66/35/37/606663537.db2.gz AXYGUWBORRVQNW-UHFFFAOYSA-N -1 3 358.348 3.662 20 0 FHADHM CC(C)(C)c1ccc(OC(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)cc1 ZINC000819957527 606663538 /nfs/dbraw/zinc/66/35/38/606663538.db2.gz AXYGUWBORRVQNW-UHFFFAOYSA-N -1 3 358.348 3.662 20 0 FHADHM CN(C(=O)c1c(F)cc(-c2nnn[n-]2)cc1F)c1ccc(C(C)(C)C)cc1 ZINC000821572282 606672876 /nfs/dbraw/zinc/67/28/76/606672876.db2.gz YMALIJXMUROXLS-UHFFFAOYSA-N -1 3 371.391 3.719 20 0 FHADHM CN(C(=O)c1c(F)cc(-c2nn[n-]n2)cc1F)c1ccc(C(C)(C)C)cc1 ZINC000821572282 606672877 /nfs/dbraw/zinc/67/28/77/606672877.db2.gz YMALIJXMUROXLS-UHFFFAOYSA-N -1 3 371.391 3.719 20 0 FHADHM FC(F)Oc1ccc(NCc2ccccc2-c2nnn[n-]2)cc1Cl ZINC000822737278 606674527 /nfs/dbraw/zinc/67/45/27/606674527.db2.gz SOCOPSBJRDPLME-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM FC(F)Oc1ccc(NCc2ccccc2-c2nn[n-]n2)cc1Cl ZINC000822737278 606674528 /nfs/dbraw/zinc/67/45/28/606674528.db2.gz SOCOPSBJRDPLME-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM Cc1cccc(N(C(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)C(C)C)c1 ZINC000822309059 606677229 /nfs/dbraw/zinc/67/72/29/606677229.db2.gz MKNPDPVURXCKFF-UHFFFAOYSA-N -1 3 357.364 3.509 20 0 FHADHM Cc1cccc(N(C(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)C(C)C)c1 ZINC000822309059 606677230 /nfs/dbraw/zinc/67/72/30/606677230.db2.gz MKNPDPVURXCKFF-UHFFFAOYSA-N -1 3 357.364 3.509 20 0 FHADHM C[C@H](OC(=O)CCCc1ccc(F)c(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820495920 606684940 /nfs/dbraw/zinc/68/49/40/606684940.db2.gz KNTGPRYPNNZMEO-LBPRGKRZSA-N -1 3 372.375 3.772 20 0 FHADHM C[C@H](OC(=O)CCCc1ccc(F)c(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820495920 606684941 /nfs/dbraw/zinc/68/49/41/606684941.db2.gz KNTGPRYPNNZMEO-LBPRGKRZSA-N -1 3 372.375 3.772 20 0 FHADHM Cc1cc(C)cc(CS[C@H](C)C(=O)Nc2ccccc2-c2nnn[n-]2)c1 ZINC000822196881 606706849 /nfs/dbraw/zinc/70/68/49/606706849.db2.gz ZVRWJKGMGGSYPJ-CQSZACIVSA-N -1 3 367.478 3.744 20 0 FHADHM Cc1cc(C)cc(CS[C@H](C)C(=O)Nc2ccccc2-c2nn[n-]n2)c1 ZINC000822196881 606706851 /nfs/dbraw/zinc/70/68/51/606706851.db2.gz ZVRWJKGMGGSYPJ-CQSZACIVSA-N -1 3 367.478 3.744 20 0 FHADHM Clc1ccc(NCc2cccc(-c3nnn[n-]3)c2)cc1Br ZINC000822578326 606707722 /nfs/dbraw/zinc/70/77/22/606707722.db2.gz GUEFYULXSRBVSZ-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM Clc1ccc(NCc2cccc(-c3nn[n-]n3)c2)cc1Br ZINC000822578326 606707724 /nfs/dbraw/zinc/70/77/24/606707724.db2.gz GUEFYULXSRBVSZ-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM C[C@H](OC(=O)c1c(F)cc(-c2nnn[n-]2)cc1F)c1ccccc1Cl ZINC000820501379 606754759 /nfs/dbraw/zinc/75/47/59/606754759.db2.gz JAZLUFORJMUUHZ-QMMMGPOBSA-N -1 3 364.739 3.716 20 0 FHADHM C[C@H](OC(=O)c1c(F)cc(-c2nn[n-]n2)cc1F)c1ccccc1Cl ZINC000820501379 606754761 /nfs/dbraw/zinc/75/47/61/606754761.db2.gz JAZLUFORJMUUHZ-QMMMGPOBSA-N -1 3 364.739 3.716 20 0 FHADHM CC(C)N(C)C(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1 ZINC000820112492 606771602 /nfs/dbraw/zinc/77/16/02/606771602.db2.gz VQMXPJZOLFCKJC-UHFFFAOYSA-N -1 3 370.388 3.670 20 0 FHADHM CC(C)N(C)C(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1 ZINC000820112492 606771604 /nfs/dbraw/zinc/77/16/04/606771604.db2.gz VQMXPJZOLFCKJC-UHFFFAOYSA-N -1 3 370.388 3.670 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nnn[n-]2)c1)c1cc(F)cc(Cl)c1 ZINC000823333127 606776596 /nfs/dbraw/zinc/77/65/96/606776596.db2.gz YATSBHVNHNWTQA-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nn[n-]n2)c1)c1cc(F)cc(Cl)c1 ZINC000823333127 606776598 /nfs/dbraw/zinc/77/65/98/606776598.db2.gz YATSBHVNHNWTQA-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM Fc1ccc(CSCc2ccn(C3CCCC3)n2)c(-c2nnn[n-]2)c1 ZINC000822774186 606841782 /nfs/dbraw/zinc/84/17/82/606841782.db2.gz GSHPEVCLMOOIHG-UHFFFAOYSA-N -1 3 358.446 3.751 20 0 FHADHM Fc1ccc(CSCc2ccn(C3CCCC3)n2)c(-c2nn[n-]n2)c1 ZINC000822774186 606841783 /nfs/dbraw/zinc/84/17/83/606841783.db2.gz GSHPEVCLMOOIHG-UHFFFAOYSA-N -1 3 358.446 3.751 20 0 FHADHM CC(C)c1cnc(CSCCCOc2cccc(-c3nnn[n-]3)c2)o1 ZINC000820197839 606842432 /nfs/dbraw/zinc/84/24/32/606842432.db2.gz NVDDZQWCWIWODA-UHFFFAOYSA-N -1 3 359.455 3.680 20 0 FHADHM CC(C)c1cnc(CSCCCOc2cccc(-c3nn[n-]n3)c2)o1 ZINC000820197839 606842433 /nfs/dbraw/zinc/84/24/33/606842433.db2.gz NVDDZQWCWIWODA-UHFFFAOYSA-N -1 3 359.455 3.680 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cc(F)cc(Cl)c1 ZINC000821123036 606849738 /nfs/dbraw/zinc/84/97/38/606849738.db2.gz IKKOLSNOKVAEHX-UHFFFAOYSA-N -1 3 374.807 3.733 20 0 FHADHM Cc1ccc(NC(=O)CSc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000822248795 606853339 /nfs/dbraw/zinc/85/33/39/606853339.db2.gz ODRIZKVMYYJFKE-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1ccc(NC(=O)CSc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000822248795 606853340 /nfs/dbraw/zinc/85/33/40/606853340.db2.gz ODRIZKVMYYJFKE-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1ccc(C)c(NC(=O)CSc2ccc(-c3nnn[n-]3)cc2Cl)c1 ZINC000822231921 606853556 /nfs/dbraw/zinc/85/35/56/606853556.db2.gz MTYXYPRTOKOGQS-UHFFFAOYSA-N -1 3 373.869 3.868 20 0 FHADHM Cc1ccc(C)c(NC(=O)CSc2ccc(-c3nn[n-]n3)cc2Cl)c1 ZINC000822231921 606853558 /nfs/dbraw/zinc/85/35/58/606853558.db2.gz MTYXYPRTOKOGQS-UHFFFAOYSA-N -1 3 373.869 3.868 20 0 FHADHM Clc1cc(-c2nnn[n-]2)ccc1SCc1noc(-c2ccccc2)n1 ZINC000822564328 606854391 /nfs/dbraw/zinc/85/43/91/606854391.db2.gz ZVKLSDMABPQHPU-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1cc(-c2nn[n-]n2)ccc1SCc1noc(-c2ccccc2)n1 ZINC000822564328 606854392 /nfs/dbraw/zinc/85/43/92/606854392.db2.gz ZVKLSDMABPQHPU-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)NCC1(C)CCCCC1 ZINC000820120357 606872293 /nfs/dbraw/zinc/87/22/93/606872293.db2.gz DJKYRIYORAKEGO-UHFFFAOYSA-N -1 3 370.501 3.757 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)NCC1(C)CCCCC1 ZINC000820120357 606872295 /nfs/dbraw/zinc/87/22/95/606872295.db2.gz DJKYRIYORAKEGO-UHFFFAOYSA-N -1 3 370.501 3.757 20 0 FHADHM CC(C)(C)NC(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)cc1 ZINC000819922278 606905222 /nfs/dbraw/zinc/90/52/22/606905222.db2.gz JEHZAOWDYXWJOU-UHFFFAOYSA-N -1 3 352.398 3.579 20 0 FHADHM CC(C)(C)NC(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)cc1 ZINC000819922278 606905224 /nfs/dbraw/zinc/90/52/24/606905224.db2.gz JEHZAOWDYXWJOU-UHFFFAOYSA-N -1 3 352.398 3.579 20 0 FHADHM O[C@@H](CN1Cc2ccccc2-c2ccccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000823682757 606921663 /nfs/dbraw/zinc/92/16/63/606921663.db2.gz UKMUOQZBGQATEE-NRFANRHFSA-N -1 3 369.428 3.587 20 0 FHADHM O[C@@H](CN1Cc2ccccc2-c2ccccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000823682757 606921665 /nfs/dbraw/zinc/92/16/65/606921665.db2.gz UKMUOQZBGQATEE-NRFANRHFSA-N -1 3 369.428 3.587 20 0 FHADHM FC(F)(F)c1ccc(N2CCC[C@@H]2c2ccccn2)c(-c2nnn[n-]2)c1 ZINC000822723649 606925196 /nfs/dbraw/zinc/92/51/96/606925196.db2.gz JJCAHHGEEZXCMH-OAHLLOKOSA-N -1 3 360.343 3.622 20 0 FHADHM FC(F)(F)c1ccc(N2CCC[C@@H]2c2ccccn2)c(-c2nn[n-]n2)c1 ZINC000822723649 606925198 /nfs/dbraw/zinc/92/51/98/606925198.db2.gz JJCAHHGEEZXCMH-OAHLLOKOSA-N -1 3 360.343 3.622 20 0 FHADHM Fc1ccc(CNc2cccc(OC(F)(F)F)c2)cc1-c1nnn[n-]1 ZINC000822772257 606928288 /nfs/dbraw/zinc/92/82/88/606928288.db2.gz UWZLNPMMHVEYAR-UHFFFAOYSA-N -1 3 353.279 3.517 20 0 FHADHM Fc1ccc(CNc2cccc(OC(F)(F)F)c2)cc1-c1nn[n-]n1 ZINC000822772257 606928290 /nfs/dbraw/zinc/92/82/90/606928290.db2.gz UWZLNPMMHVEYAR-UHFFFAOYSA-N -1 3 353.279 3.517 20 0 FHADHM Fc1ccc(C(F)(F)F)cc1NCc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000822766124 606930093 /nfs/dbraw/zinc/93/00/93/606930093.db2.gz DVHXPLLFQLQXAR-UHFFFAOYSA-N -1 3 355.270 3.776 20 0 FHADHM Fc1ccc(C(F)(F)F)cc1NCc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000822766124 606930095 /nfs/dbraw/zinc/93/00/95/606930095.db2.gz DVHXPLLFQLQXAR-UHFFFAOYSA-N -1 3 355.270 3.776 20 0 FHADHM CC(C)(C)C(=O)c1ccc(NCc2ccc(F)c(-c3nnn[n-]3)c2)cc1 ZINC000819899520 606930415 /nfs/dbraw/zinc/93/04/15/606930415.db2.gz VXTGDJQMRVOBAX-UHFFFAOYSA-N -1 3 353.401 3.847 20 0 FHADHM CC(C)(C)C(=O)c1ccc(NCc2ccc(F)c(-c3nn[n-]n3)c2)cc1 ZINC000819899520 606930416 /nfs/dbraw/zinc/93/04/16/606930416.db2.gz VXTGDJQMRVOBAX-UHFFFAOYSA-N -1 3 353.401 3.847 20 0 FHADHM Cc1noc(C)c1C[C@H](C)Nc1ccc(C(F)(F)F)cc1-c1nnn[n-]1 ZINC000822524190 606937745 /nfs/dbraw/zinc/93/77/45/606937745.db2.gz ZGOSEUGTWBBQMZ-QMMMGPOBSA-N -1 3 366.347 3.533 20 0 FHADHM Cc1noc(C)c1C[C@H](C)Nc1ccc(C(F)(F)F)cc1-c1nn[n-]n1 ZINC000822524190 606937746 /nfs/dbraw/zinc/93/77/46/606937746.db2.gz ZGOSEUGTWBBQMZ-QMMMGPOBSA-N -1 3 366.347 3.533 20 0 FHADHM CSc1ccsc1C(=O)N(C)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821989933 606963668 /nfs/dbraw/zinc/96/36/68/606963668.db2.gz OGZJWVXCEBMERK-UHFFFAOYSA-N -1 3 365.871 3.580 20 0 FHADHM CSc1ccsc1C(=O)N(C)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821989933 606963669 /nfs/dbraw/zinc/96/36/69/606963669.db2.gz OGZJWVXCEBMERK-UHFFFAOYSA-N -1 3 365.871 3.580 20 0 FHADHM CN(C(=O)CCSc1ccc(Cl)cc1)c1ccccc1-c1nnn[n-]1 ZINC000821569619 606974990 /nfs/dbraw/zinc/97/49/90/606974990.db2.gz PUDLECOQWLTNTF-UHFFFAOYSA-N -1 3 373.869 3.665 20 0 FHADHM CN(C(=O)CCSc1ccc(Cl)cc1)c1ccccc1-c1nn[n-]n1 ZINC000821569619 606974991 /nfs/dbraw/zinc/97/49/91/606974991.db2.gz PUDLECOQWLTNTF-UHFFFAOYSA-N -1 3 373.869 3.665 20 0 FHADHM Cc1c(Cl)cccc1NC(=O)C(C)(C)Oc1ccc(-c2nnn[n-]2)cc1 ZINC000822034679 606977895 /nfs/dbraw/zinc/97/78/95/606977895.db2.gz JHIJVRADLCURQR-UHFFFAOYSA-N -1 3 371.828 3.625 20 0 FHADHM Cc1c(Cl)cccc1NC(=O)C(C)(C)Oc1ccc(-c2nn[n-]n2)cc1 ZINC000822034679 606977897 /nfs/dbraw/zinc/97/78/97/606977897.db2.gz JHIJVRADLCURQR-UHFFFAOYSA-N -1 3 371.828 3.625 20 0 FHADHM O=C(OCc1ccc(F)c(-c2nnn[n-]2)c1)c1c(Cl)cccc1Cl ZINC000823421998 606990929 /nfs/dbraw/zinc/99/09/29/606990929.db2.gz MPKOZTHTKVPGNA-UHFFFAOYSA-N -1 3 367.167 3.670 20 0 FHADHM O=C(OCc1ccc(F)c(-c2nn[n-]n2)c1)c1c(Cl)cccc1Cl ZINC000823421998 606990930 /nfs/dbraw/zinc/99/09/30/606990930.db2.gz MPKOZTHTKVPGNA-UHFFFAOYSA-N -1 3 367.167 3.670 20 0 FHADHM O=C(OCc1ccc(F)c(-c2nnn[n-]2)c1)[C@@H]1C[C@H]1c1cccc(Cl)c1 ZINC000823422399 606997928 /nfs/dbraw/zinc/99/79/28/606997928.db2.gz UAIFBXCJZCSOGR-UONOGXRCSA-N -1 3 372.787 3.506 20 0 FHADHM O=C(OCc1ccc(F)c(-c2nn[n-]n2)c1)[C@@H]1C[C@H]1c1cccc(Cl)c1 ZINC000823422399 606997929 /nfs/dbraw/zinc/99/79/29/606997929.db2.gz UAIFBXCJZCSOGR-UONOGXRCSA-N -1 3 372.787 3.506 20 0 FHADHM Cc1sc2ncnc(SCc3ccc(F)c(-c4nnn[n-]4)c3)c2c1C ZINC000822563402 607005721 /nfs/dbraw/zinc/00/57/21/607005721.db2.gz HWJUREBCEQRPHJ-UHFFFAOYSA-N -1 3 372.454 3.920 20 0 FHADHM Cc1sc2ncnc(SCc3ccc(F)c(-c4nn[n-]n4)c3)c2c1C ZINC000822563402 607005723 /nfs/dbraw/zinc/00/57/23/607005723.db2.gz HWJUREBCEQRPHJ-UHFFFAOYSA-N -1 3 372.454 3.920 20 0 FHADHM Cc1cc(C)c(NC(=O)CSc2cccc(-c3nnn[n-]3)c2)c(C)c1 ZINC000822194154 607010171 /nfs/dbraw/zinc/01/01/71/607010171.db2.gz LBTAMYRHTOFJHS-UHFFFAOYSA-N -1 3 353.451 3.523 20 0 FHADHM Cc1cc(C)c(NC(=O)CSc2cccc(-c3nn[n-]n3)c2)c(C)c1 ZINC000822194154 607010173 /nfs/dbraw/zinc/01/01/73/607010173.db2.gz LBTAMYRHTOFJHS-UHFFFAOYSA-N -1 3 353.451 3.523 20 0 FHADHM Cc1ccccc1[C@@H](C)NC(=O)[C@@H](C)Sc1cccc(-c2nnn[n-]2)c1 ZINC000822345734 607010519 /nfs/dbraw/zinc/01/05/19/607010519.db2.gz QDZMLUYDZGQASG-ZIAGYGMSSA-N -1 3 367.478 3.533 20 0 FHADHM Cc1ccccc1[C@@H](C)NC(=O)[C@@H](C)Sc1cccc(-c2nn[n-]n2)c1 ZINC000822345734 607010522 /nfs/dbraw/zinc/01/05/22/607010522.db2.gz QDZMLUYDZGQASG-ZIAGYGMSSA-N -1 3 367.478 3.533 20 0 FHADHM Cc1cccc(NC(=O)[C@@H](C)Sc2cccc(-c3nnn[n-]3)c2)c1C ZINC000822323648 607012373 /nfs/dbraw/zinc/01/23/73/607012373.db2.gz LPSCGLJABADBBA-CYBMUJFWSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1cccc(NC(=O)[C@@H](C)Sc2cccc(-c3nn[n-]n3)c2)c1C ZINC000822323648 607012374 /nfs/dbraw/zinc/01/23/74/607012374.db2.gz LPSCGLJABADBBA-CYBMUJFWSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1ccc(Cl)cc1NC(=O)CSc1cccc(-c2nnn[n-]2)c1 ZINC000822239773 607013752 /nfs/dbraw/zinc/01/37/52/607013752.db2.gz DCSUJPGAUBUKNR-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1ccc(Cl)cc1NC(=O)CSc1cccc(-c2nn[n-]n2)c1 ZINC000822239773 607013753 /nfs/dbraw/zinc/01/37/53/607013753.db2.gz DCSUJPGAUBUKNR-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM COC(=O)[C@@H](Sc1cccc(-c2nnn[n-]2)c1)c1cccc(Cl)c1 ZINC000821650310 607015082 /nfs/dbraw/zinc/01/50/82/607015082.db2.gz OQBAPDCXPHEMJC-AWEZNQCLSA-N -1 3 360.826 3.527 20 0 FHADHM COC(=O)[C@@H](Sc1cccc(-c2nn[n-]n2)c1)c1cccc(Cl)c1 ZINC000821650310 607015084 /nfs/dbraw/zinc/01/50/84/607015084.db2.gz OQBAPDCXPHEMJC-AWEZNQCLSA-N -1 3 360.826 3.527 20 0 FHADHM C[C@@H](Sc1cccc(-c2nnn[n-]2)c1)c1nc(Cc2ccccc2)no1 ZINC000820556621 607015171 /nfs/dbraw/zinc/01/51/71/607015171.db2.gz UYJSHUVCHSSAGM-GFCCVEGCSA-N -1 3 364.434 3.694 20 0 FHADHM C[C@@H](Sc1cccc(-c2nn[n-]n2)c1)c1nc(Cc2ccccc2)no1 ZINC000820556621 607015172 /nfs/dbraw/zinc/01/51/72/607015172.db2.gz UYJSHUVCHSSAGM-GFCCVEGCSA-N -1 3 364.434 3.694 20 0 FHADHM CCOc1cc(Cl)ccc1NC(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000821395527 607034626 /nfs/dbraw/zinc/03/46/26/607034626.db2.gz YXKHNFWPGMNYQZ-UHFFFAOYSA-N -1 3 358.789 3.563 20 0 FHADHM CCOc1cc(Cl)ccc1NC(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000821395527 607034627 /nfs/dbraw/zinc/03/46/27/607034627.db2.gz YXKHNFWPGMNYQZ-UHFFFAOYSA-N -1 3 358.789 3.563 20 0 FHADHM Cc1cccc2c1ncc(-c1nnn[n-]1)c2N1CCC(OC(C)(C)C)CC1 ZINC000822333175 607044743 /nfs/dbraw/zinc/04/47/43/607044743.db2.gz ZNLXUUANYQHYNH-UHFFFAOYSA-N -1 3 366.469 3.507 20 0 FHADHM Cc1cccc2c1ncc(-c1nn[n-]n1)c2N1CCC(OC(C)(C)C)CC1 ZINC000822333175 607044745 /nfs/dbraw/zinc/04/47/45/607044745.db2.gz ZNLXUUANYQHYNH-UHFFFAOYSA-N -1 3 366.469 3.507 20 0 FHADHM C[C@@H](C(=O)OCc1cc(F)ccc1-c1nnn[n-]1)c1ccc(Cl)s1 ZINC000819883260 607085186 /nfs/dbraw/zinc/08/51/86/607085186.db2.gz GISUWCAZQBBESA-MRVPVSSYSA-N -1 3 366.805 3.568 20 0 FHADHM C[C@@H](C(=O)OCc1cc(F)ccc1-c1nn[n-]n1)c1ccc(Cl)s1 ZINC000819883260 607085187 /nfs/dbraw/zinc/08/51/87/607085187.db2.gz GISUWCAZQBBESA-MRVPVSSYSA-N -1 3 366.805 3.568 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NC(=O)CC(C)(C)c1ccccc1 ZINC000821292848 607099328 /nfs/dbraw/zinc/09/93/28/607099328.db2.gz FMIZGHYHENLGET-UHFFFAOYSA-N -1 3 364.453 3.605 20 0 FHADHM Cc1nc2sc3c(c2c(Oc2ccc(-c4nnn[n-]4)cc2F)n1)CCC3 ZINC000822453502 607128915 /nfs/dbraw/zinc/12/89/15/607128915.db2.gz KFPIAPKUEZOZMU-UHFFFAOYSA-N -1 3 368.397 3.600 20 0 FHADHM Cc1nc2sc3c(c2c(Oc2ccc(-c4nn[n-]n4)cc2F)n1)CCC3 ZINC000822453502 607128917 /nfs/dbraw/zinc/12/89/17/607128917.db2.gz KFPIAPKUEZOZMU-UHFFFAOYSA-N -1 3 368.397 3.600 20 0 FHADHM Cc1oc(-c2ccccc2)nc1COc1ccc(-c2nnn[n-]2)cc1F ZINC000822535270 607140121 /nfs/dbraw/zinc/14/01/21/607140121.db2.gz LRHICONSDLPJCT-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM Cc1oc(-c2ccccc2)nc1COc1ccc(-c2nn[n-]n2)cc1F ZINC000822535270 607140122 /nfs/dbraw/zinc/14/01/22/607140122.db2.gz LRHICONSDLPJCT-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM CCC[C@H](C)[C@@H]1CCCN1C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821014208 607152981 /nfs/dbraw/zinc/15/29/81/607152981.db2.gz BTHPAJHDVGHHAA-ZQIUZPCESA-N -1 3 356.474 3.538 20 0 FHADHM CCC[C@H](C)[C@@H]1CCCN1C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821014208 607152983 /nfs/dbraw/zinc/15/29/83/607152983.db2.gz BTHPAJHDVGHHAA-ZQIUZPCESA-N -1 3 356.474 3.538 20 0 FHADHM Cc1ccc(CCCC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000822235906 607190896 /nfs/dbraw/zinc/19/08/96/607190896.db2.gz BJUQEAQDBFBKLX-UHFFFAOYSA-N -1 3 355.829 3.790 20 0 FHADHM Cc1ccc(CCCC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000822235906 607190897 /nfs/dbraw/zinc/19/08/97/607190897.db2.gz BJUQEAQDBFBKLX-UHFFFAOYSA-N -1 3 355.829 3.790 20 0 FHADHM CC(=CC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccc(F)cc1 ZINC000819766230 607191280 /nfs/dbraw/zinc/19/12/80/607191280.db2.gz WEIXYGFUTINJEU-CSKARUKUSA-N -1 3 357.776 3.701 20 0 FHADHM CC(=CC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccc(F)cc1 ZINC000819766230 607191281 /nfs/dbraw/zinc/19/12/81/607191281.db2.gz WEIXYGFUTINJEU-CSKARUKUSA-N -1 3 357.776 3.701 20 0 FHADHM CC1(C)CCC(C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)CC1 ZINC000820589274 607192365 /nfs/dbraw/zinc/19/23/65/607192365.db2.gz BKOJAQQZWUBNDO-UHFFFAOYSA-N -1 3 353.470 3.574 20 0 FHADHM CC1(C)CCC(C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)CC1 ZINC000820589274 607192366 /nfs/dbraw/zinc/19/23/66/607192366.db2.gz BKOJAQQZWUBNDO-UHFFFAOYSA-N -1 3 353.470 3.574 20 0 FHADHM O=C(Cc1cccc(-c2nnn[n-]2)c1)Nc1cc(C(F)F)ccc1Cl ZINC000823104528 607192775 /nfs/dbraw/zinc/19/27/75/607192775.db2.gz YNFFOMHIVGKZJM-UHFFFAOYSA-N -1 3 363.755 3.639 20 0 FHADHM O=C(Cc1cccc(-c2nn[n-]n2)c1)Nc1cc(C(F)F)ccc1Cl ZINC000823104528 607192776 /nfs/dbraw/zinc/19/27/76/607192776.db2.gz YNFFOMHIVGKZJM-UHFFFAOYSA-N -1 3 363.755 3.639 20 0 FHADHM Cc1ccc([C@H]2CCCN2C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)o1 ZINC000822233592 607194943 /nfs/dbraw/zinc/19/49/43/607194943.db2.gz RRULZCHNDXLWTQ-CQSZACIVSA-N -1 3 372.816 3.791 20 0 FHADHM Cc1ccc([C@H]2CCCN2C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)o1 ZINC000822233592 607194944 /nfs/dbraw/zinc/19/49/44/607194944.db2.gz RRULZCHNDXLWTQ-CQSZACIVSA-N -1 3 372.816 3.791 20 0 FHADHM CC(C)(C)C[C@H]1CCCN1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000819906083 607195491 /nfs/dbraw/zinc/19/54/91/607195491.db2.gz CJPXYUOTNQUPOO-GFCCVEGCSA-N -1 3 362.865 3.953 20 0 FHADHM CC(C)(C)C[C@H]1CCCN1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000819906083 607195492 /nfs/dbraw/zinc/19/54/92/607195492.db2.gz CJPXYUOTNQUPOO-GFCCVEGCSA-N -1 3 362.865 3.953 20 0 FHADHM C[C@@H](c1ccccc1F)N(C)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820570759 607197087 /nfs/dbraw/zinc/19/70/87/607197087.db2.gz QUIOBSFOPNCNGV-JTQLQIEISA-N -1 3 374.807 3.884 20 0 FHADHM C[C@@H](c1ccccc1F)N(C)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820570759 607197088 /nfs/dbraw/zinc/19/70/88/607197088.db2.gz QUIOBSFOPNCNGV-JTQLQIEISA-N -1 3 374.807 3.884 20 0 FHADHM C[C@@H]1C[C@H]1c1ccc(CNC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)o1 ZINC000820674857 607202485 /nfs/dbraw/zinc/20/24/85/607202485.db2.gz GTRHYLMXHMDXLX-BXKDBHETSA-N -1 3 372.816 3.558 20 0 FHADHM C[C@@H]1C[C@H]1c1ccc(CNC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)o1 ZINC000820674857 607202486 /nfs/dbraw/zinc/20/24/86/607202486.db2.gz GTRHYLMXHMDXLX-BXKDBHETSA-N -1 3 372.816 3.558 20 0 FHADHM CC[C@H](NC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccccc1 ZINC000820921228 607203427 /nfs/dbraw/zinc/20/34/27/607203427.db2.gz XDRASLOPBBVCFY-AWEZNQCLSA-N -1 3 356.817 3.793 20 0 FHADHM CC[C@H](NC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccccc1 ZINC000820921228 607203428 /nfs/dbraw/zinc/20/34/28/607203428.db2.gz XDRASLOPBBVCFY-AWEZNQCLSA-N -1 3 356.817 3.793 20 0 FHADHM COCc1ccc(CNc2cc(-c3nnn[n-]3)ccc2C(F)(F)F)cc1 ZINC000821695314 607227432 /nfs/dbraw/zinc/22/74/32/607227432.db2.gz RQMHIOASNRUXQH-UHFFFAOYSA-N -1 3 363.343 3.644 20 0 FHADHM COCc1ccc(CNc2cc(-c3nn[n-]n3)ccc2C(F)(F)F)cc1 ZINC000821695314 607227433 /nfs/dbraw/zinc/22/74/33/607227433.db2.gz RQMHIOASNRUXQH-UHFFFAOYSA-N -1 3 363.343 3.644 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccc(F)c(Cl)c2)c1-c1nnn[n-]1 ZINC000821465131 607238052 /nfs/dbraw/zinc/23/80/52/607238052.db2.gz BUOZBWUUEJCQKQ-UHFFFAOYSA-N -1 3 365.821 3.844 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccc(F)c(Cl)c2)c1-c1nn[n-]n1 ZINC000821465131 607238053 /nfs/dbraw/zinc/23/80/53/607238053.db2.gz BUOZBWUUEJCQKQ-UHFFFAOYSA-N -1 3 365.821 3.844 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)C1(c2ccccc2)CCC1 ZINC000823314213 607242586 /nfs/dbraw/zinc/24/25/86/607242586.db2.gz OVUSBNAJAPRSTG-UHFFFAOYSA-N -1 3 353.813 3.581 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)C1(c2ccccc2)CCC1 ZINC000823314213 607242587 /nfs/dbraw/zinc/24/25/87/607242587.db2.gz OVUSBNAJAPRSTG-UHFFFAOYSA-N -1 3 353.813 3.581 20 0 FHADHM O=C(CCCCCc1cccs1)Oc1ccc(-c2nnn[n-]2)cc1F ZINC000822955425 607248881 /nfs/dbraw/zinc/24/88/81/607248881.db2.gz 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ZINC000824385607 607778852 /nfs/dbraw/zinc/77/88/52/607778852.db2.gz XNKWHXQTKAOPOA-VXGBXAGGSA-N -1 3 372.375 3.943 20 0 FHADHM CC(C)c1ccc(SCC(=O)N(C)c2ccccc2-c2nnn[n-]2)cc1 ZINC000824347738 607788678 /nfs/dbraw/zinc/78/86/78/607788678.db2.gz MEFFCOVTGVYICA-UHFFFAOYSA-N -1 3 367.478 3.745 20 0 FHADHM CC(C)c1ccc(SCC(=O)N(C)c2ccccc2-c2nn[n-]n2)cc1 ZINC000824347738 607788679 /nfs/dbraw/zinc/78/86/79/607788679.db2.gz MEFFCOVTGVYICA-UHFFFAOYSA-N -1 3 367.478 3.745 20 0 FHADHM CC[C@H](CC(=O)Oc1ccc(-c2nnn[n-]2)cc1F)c1ccc(OC)cc1 ZINC000825081121 607791314 /nfs/dbraw/zinc/79/13/14/607791314.db2.gz GMRFKSJJQMKRKL-GFCCVEGCSA-N -1 3 370.384 3.504 20 0 FHADHM CC[C@H](CC(=O)Oc1ccc(-c2nn[n-]n2)cc1F)c1ccc(OC)cc1 ZINC000825081121 607791315 /nfs/dbraw/zinc/79/13/15/607791315.db2.gz GMRFKSJJQMKRKL-GFCCVEGCSA-N -1 3 370.384 3.504 20 0 FHADHM CCc1cccnc1NC(=O)c1ccccc1-c1ccccc1-c1nnn[n-]1 ZINC000825728708 607791438 /nfs/dbraw/zinc/79/14/38/607791438.db2.gz WXEPGZWLCKQRRA-UHFFFAOYSA-N -1 3 370.416 3.743 20 0 FHADHM CCc1cccnc1NC(=O)c1ccccc1-c1ccccc1-c1nn[n-]n1 ZINC000825728708 607791439 /nfs/dbraw/zinc/79/14/39/607791439.db2.gz WXEPGZWLCKQRRA-UHFFFAOYSA-N -1 3 370.416 3.743 20 0 FHADHM CCN(C(=O)c1ccc(C)c(-n2cccc2)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825379201 607799224 /nfs/dbraw/zinc/79/92/24/607799224.db2.gz CHGXNJPIZNLXMI-UHFFFAOYSA-N -1 3 372.432 3.633 20 0 FHADHM CCN(C(=O)c1ccc(C)c(-n2cccc2)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825379201 607799225 /nfs/dbraw/zinc/79/92/25/607799225.db2.gz CHGXNJPIZNLXMI-UHFFFAOYSA-N -1 3 372.432 3.633 20 0 FHADHM O=C(NCCC1=CCCC1)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000826436575 607804422 /nfs/dbraw/zinc/80/44/22/607804422.db2.gz YWSOHFAUJTYQTH-UHFFFAOYSA-N -1 3 366.347 3.507 20 0 FHADHM O=C(NCCC1=CCCC1)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000826436575 607804423 /nfs/dbraw/zinc/80/44/23/607804423.db2.gz YWSOHFAUJTYQTH-UHFFFAOYSA-N -1 3 366.347 3.507 20 0 FHADHM Cc1ccc(C(=O)OCc2ccc(-c3ccccc3-c3nnn[n-]3)cc2)nc1 ZINC000826282231 607805534 /nfs/dbraw/zinc/80/55/34/607805534.db2.gz DXNVEJRPOWYIQT-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM Cc1ccc(C(=O)OCc2ccc(-c3ccccc3-c3nn[n-]n3)cc2)nc1 ZINC000826282231 607805535 /nfs/dbraw/zinc/80/55/35/607805535.db2.gz DXNVEJRPOWYIQT-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM Cc1nc(C)c(-c2nnn[n-]2)c(S[C@H]2CCCc3ccc(F)cc32)n1 ZINC000826324402 607808678 /nfs/dbraw/zinc/80/86/78/607808678.db2.gz PJGNZGQUVOGTDF-AWEZNQCLSA-N -1 3 356.430 3.582 20 0 FHADHM CN(Cc1ccsc1)C(=O)c1c(Cl)cc(-c2nnn[n-]2)cc1Cl ZINC000825986253 607833383 /nfs/dbraw/zinc/83/33/83/607833383.db2.gz VWOOBQXAZSCSLJ-UHFFFAOYSA-N -1 3 368.249 3.507 20 0 FHADHM CN(Cc1ccsc1)C(=O)c1c(Cl)cc(-c2nn[n-]n2)cc1Cl ZINC000825986253 607833384 /nfs/dbraw/zinc/83/33/84/607833384.db2.gz VWOOBQXAZSCSLJ-UHFFFAOYSA-N -1 3 368.249 3.507 20 0 FHADHM COc1ccc(C)cc1[C@@H](C)Nc1ccc2cc(-c3nnn[n-]3)ccc2n1 ZINC000826190050 607838939 /nfs/dbraw/zinc/83/89/39/607838939.db2.gz OBNXMIQZNFPOPF-CYBMUJFWSA-N -1 3 360.421 3.905 20 0 FHADHM COc1ccc(C)cc1[C@@H](C)Nc1ccc2cc(-c3nn[n-]n3)ccc2n1 ZINC000826190050 607838940 /nfs/dbraw/zinc/83/89/40/607838940.db2.gz OBNXMIQZNFPOPF-CYBMUJFWSA-N -1 3 360.421 3.905 20 0 FHADHM O[C@H](CSc1ccc(-c2nnn[n-]2)cc1Cl)c1cc(F)ccc1F ZINC000826505100 607843225 /nfs/dbraw/zinc/84/32/25/607843225.db2.gz MMEJFYYKUSGECG-CYBMUJFWSA-N -1 3 368.796 3.624 20 0 FHADHM O[C@H](CSc1ccc(-c2nn[n-]n2)cc1Cl)c1cc(F)ccc1F ZINC000826505100 607843226 /nfs/dbraw/zinc/84/32/26/607843226.db2.gz MMEJFYYKUSGECG-CYBMUJFWSA-N -1 3 368.796 3.624 20 0 FHADHM COc1ccccc1C(=O)CSc1ccc(-c2nnn[n-]2)cc1Cl ZINC000826217773 607843777 /nfs/dbraw/zinc/84/37/77/607843777.db2.gz BNLWCGXEIVVRNN-UHFFFAOYSA-N -1 3 360.826 3.504 20 0 FHADHM COc1ccccc1C(=O)CSc1ccc(-c2nn[n-]n2)cc1Cl ZINC000826217773 607843778 /nfs/dbraw/zinc/84/37/78/607843778.db2.gz BNLWCGXEIVVRNN-UHFFFAOYSA-N -1 3 360.826 3.504 20 0 FHADHM CC[C@@H](C)NC(=O)[C@@H](Sc1ccc(-c2nnn[n-]2)cc1Cl)C(C)C ZINC000825069316 607844423 /nfs/dbraw/zinc/84/44/23/607844423.db2.gz ZYPKZIUUEJHDRK-YGRLFVJLSA-N -1 3 367.906 3.552 20 0 FHADHM CC[C@@H](C)NC(=O)[C@@H](Sc1ccc(-c2nn[n-]n2)cc1Cl)C(C)C ZINC000825069316 607844424 /nfs/dbraw/zinc/84/44/24/607844424.db2.gz ZYPKZIUUEJHDRK-YGRLFVJLSA-N -1 3 367.906 3.552 20 0 FHADHM Cc1cccc(C(=O)Nc2ccc(OC(C)C)c(-c3nnn[n-]3)c2)c1Cl ZINC000826296480 607854816 /nfs/dbraw/zinc/85/48/16/607854816.db2.gz YPMCIIZHQPXAGE-UHFFFAOYSA-N -1 3 371.828 3.868 20 0 FHADHM Cc1cccc(C(=O)Nc2ccc(OC(C)C)c(-c3nn[n-]n3)c2)c1Cl ZINC000826296480 607854817 /nfs/dbraw/zinc/85/48/17/607854817.db2.gz YPMCIIZHQPXAGE-UHFFFAOYSA-N -1 3 371.828 3.868 20 0 FHADHM C[C@H](NC(=O)[C@@H]1CC[C@@H]2CCCC[C@H]2C1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824472993 607881108 /nfs/dbraw/zinc/88/11/08/607881108.db2.gz YAQPSRUFAPJCJY-QXRTWZOPSA-N -1 3 353.470 3.650 20 0 FHADHM C[C@H](NC(=O)[C@@H]1CC[C@@H]2CCCC[C@H]2C1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824472993 607881109 /nfs/dbraw/zinc/88/11/09/607881109.db2.gz YAQPSRUFAPJCJY-QXRTWZOPSA-N -1 3 353.470 3.650 20 0 FHADHM CCN(C(=O)[C@H]1CCCC(C)(C)C1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825367217 607885948 /nfs/dbraw/zinc/88/59/48/607885948.db2.gz LEIFTEOJDFMKRE-YOEHRIQHSA-N -1 3 355.486 3.993 20 0 FHADHM CCN(C(=O)[C@H]1CCCC(C)(C)C1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825367217 607885949 /nfs/dbraw/zinc/88/59/49/607885949.db2.gz LEIFTEOJDFMKRE-YOEHRIQHSA-N -1 3 355.486 3.993 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@@H](c1ccc(F)cc1)C(C)C ZINC000826277466 607889440 /nfs/dbraw/zinc/88/94/40/607889440.db2.gz VPROUPLRDYYSHD-QGZVFWFLSA-N -1 3 353.401 3.693 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@@H](c1ccc(F)cc1)C(C)C ZINC000826277466 607889441 /nfs/dbraw/zinc/88/94/41/607889441.db2.gz VPROUPLRDYYSHD-QGZVFWFLSA-N -1 3 353.401 3.693 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000823942321 607905789 /nfs/dbraw/zinc/90/57/89/607905789.db2.gz BCGKUKJAXDOICD-RSKUSDAESA-N -1 3 367.840 3.801 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000823942321 607905790 /nfs/dbraw/zinc/90/57/90/607905790.db2.gz BCGKUKJAXDOICD-RSKUSDAESA-N -1 3 367.840 3.801 20 0 FHADHM C[C@H](NC(=O)[C@@H]1CC[C@H]2CCCC[C@H]2C1)c1cccc(-c2nnn[n-]2)c1 ZINC000824472818 607906056 /nfs/dbraw/zinc/90/60/56/607906056.db2.gz XCEDWERQKMVVFL-JSSFPYSZSA-N -1 3 353.470 3.650 20 0 FHADHM C[C@H](NC(=O)[C@@H]1CC[C@H]2CCCC[C@H]2C1)c1cccc(-c2nn[n-]n2)c1 ZINC000824472818 607906057 /nfs/dbraw/zinc/90/60/57/607906057.db2.gz XCEDWERQKMVVFL-JSSFPYSZSA-N -1 3 353.470 3.650 20 0 FHADHM Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000826323748 607913033 /nfs/dbraw/zinc/91/30/33/607913033.db2.gz PVCJTTGHMOHBFE-GFCCVEGCSA-N -1 3 370.482 3.588 20 0 FHADHM Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)c1cccc(-c2nn[n-]n2)c1 ZINC000826323748 607913034 /nfs/dbraw/zinc/91/30/34/607913034.db2.gz PVCJTTGHMOHBFE-GFCCVEGCSA-N -1 3 370.482 3.588 20 0 FHADHM CS[C@H](C)CC(=O)Oc1ccc(-c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000826225320 607931195 /nfs/dbraw/zinc/93/11/95/607931195.db2.gz YUIZVUABKMIYLO-GFCCVEGCSA-N -1 3 354.435 3.581 20 0 FHADHM CS[C@H](C)CC(=O)Oc1ccc(-c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000826225320 607931196 /nfs/dbraw/zinc/93/11/96/607931196.db2.gz YUIZVUABKMIYLO-GFCCVEGCSA-N -1 3 354.435 3.581 20 0 FHADHM Cc1c2ccccc2sc1C(=O)COc1ccccc1-c1nnn[n-]1 ZINC000826233924 607964195 /nfs/dbraw/zinc/96/41/95/607964195.db2.gz ABVMBONYCXKEGP-UHFFFAOYSA-N -1 3 350.403 3.652 20 0 FHADHM Cc1c2ccccc2sc1C(=O)COc1ccccc1-c1nn[n-]n1 ZINC000826233924 607964196 /nfs/dbraw/zinc/96/41/96/607964196.db2.gz ABVMBONYCXKEGP-UHFFFAOYSA-N -1 3 350.403 3.652 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1OC[C@H](O)c1ccc(Cl)cc1Cl ZINC000826254890 607981790 /nfs/dbraw/zinc/98/17/90/607981790.db2.gz DUIOCUQRYBXEHM-AWEZNQCLSA-N -1 3 365.220 3.594 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NCc1csc(C2CC2)n1 ZINC000824324149 607982557 /nfs/dbraw/zinc/98/25/57/607982557.db2.gz IILZLFIXYIUJOV-UHFFFAOYSA-N -1 3 356.455 3.600 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NCc1csc(C2CC2)n1 ZINC000824324149 607982558 /nfs/dbraw/zinc/98/25/58/607982558.db2.gz IILZLFIXYIUJOV-UHFFFAOYSA-N -1 3 356.455 3.600 20 0 FHADHM c1sc(C2CC2)nc1CSCCOc1ccc(-c2nn[n-]n2)cc1 ZINC000826513920 607984060 /nfs/dbraw/zinc/98/40/60/607984060.db2.gz ARLGDZPBGLMZAT-UHFFFAOYSA-N -1 3 359.480 3.513 20 0 FHADHM CCc1c(C)sc(NC(=O)C2CCC(F)(F)CC2)c1-c1nnn[n-]1 ZINC000825686893 608003731 /nfs/dbraw/zinc/00/37/31/608003731.db2.gz AUHTVIQPEMXCPV-UHFFFAOYSA-N -1 3 355.414 3.563 20 0 FHADHM CCc1c(C)sc(NC(=O)C2CCC(F)(F)CC2)c1-c1nn[n-]n1 ZINC000825686893 608003732 /nfs/dbraw/zinc/00/37/32/608003732.db2.gz AUHTVIQPEMXCPV-UHFFFAOYSA-N -1 3 355.414 3.563 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)Nc1ccc(F)cc1-c1nnn[n-]1 ZINC000823943120 608005976 /nfs/dbraw/zinc/00/59/76/608005976.db2.gz NXLATEHDJNUTPF-JXMROGBWSA-N -1 3 357.776 3.701 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)Nc1ccc(F)cc1-c1nn[n-]n1 ZINC000823943120 608005977 /nfs/dbraw/zinc/00/59/77/608005977.db2.gz NXLATEHDJNUTPF-JXMROGBWSA-N -1 3 357.776 3.701 20 0 FHADHM Cc1c2ccccc2sc1C(=O)COc1cccc(-c2nnn[n-]2)c1 ZINC000826234163 608017134 /nfs/dbraw/zinc/01/71/34/608017134.db2.gz KHKJENUVPUZNCR-UHFFFAOYSA-N -1 3 350.403 3.652 20 0 FHADHM Cc1c2ccccc2sc1C(=O)COc1cccc(-c2nn[n-]n2)c1 ZINC000826234163 608017135 /nfs/dbraw/zinc/01/71/35/608017135.db2.gz KHKJENUVPUZNCR-UHFFFAOYSA-N -1 3 350.403 3.652 20 0 FHADHM C[C@H]1c2ccccc2CN1c1ccc(-c2nn[n-]n2)cc1Br ZINC000825027967 608050786 /nfs/dbraw/zinc/05/07/86/608050786.db2.gz ASQANHBRJLLYOR-JTQLQIEISA-N -1 3 356.227 3.710 20 0 FHADHM C[C@H](c1ccc(Cl)cc1)N1CCO[C@H](c2cccc(-c3nnn[n-]3)c2)C1 ZINC000824763500 608071724 /nfs/dbraw/zinc/07/17/24/608071724.db2.gz MYKSRWKEQBOMMP-ACJLOTCBSA-N -1 3 369.856 3.655 20 0 FHADHM C[C@H](c1ccc(Cl)cc1)N1CCO[C@H](c2cccc(-c3nn[n-]n3)c2)C1 ZINC000824763500 608071725 /nfs/dbraw/zinc/07/17/25/608071725.db2.gz MYKSRWKEQBOMMP-ACJLOTCBSA-N -1 3 369.856 3.655 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NCc1ccc(OC)c(Cl)c1 ZINC000825632674 608110239 /nfs/dbraw/zinc/11/02/39/608110239.db2.gz ZIQQJMCIGOIMFN-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NCc1ccc(OC)c(Cl)c1 ZINC000825632674 608110240 /nfs/dbraw/zinc/11/02/40/608110240.db2.gz ZIQQJMCIGOIMFN-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM CC(C)(C)[C@@H]1C[C@@H](Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)CCO1 ZINC000824079362 608149766 /nfs/dbraw/zinc/14/97/66/608149766.db2.gz PAAHGNSLYAXXIH-FZMZJTMJSA-N -1 3 369.391 3.891 20 0 FHADHM CC(C)(C)[C@@H]1C[C@@H](Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)CCO1 ZINC000824079362 608149767 /nfs/dbraw/zinc/14/97/67/608149767.db2.gz PAAHGNSLYAXXIH-FZMZJTMJSA-N -1 3 369.391 3.891 20 0 FHADHM C[C@@H](OC(=O)[C@@H](C)c1c(F)cccc1F)c1cccc(-c2nnn[n-]2)c1 ZINC000824705496 608182814 /nfs/dbraw/zinc/18/28/14/608182814.db2.gz BXJOOLQYGNRSMD-WDEREUQCSA-N -1 3 358.348 3.553 20 0 FHADHM C[C@@H](OC(=O)[C@@H](C)c1c(F)cccc1F)c1cccc(-c2nn[n-]n2)c1 ZINC000824705496 608182815 /nfs/dbraw/zinc/18/28/15/608182815.db2.gz BXJOOLQYGNRSMD-WDEREUQCSA-N -1 3 358.348 3.553 20 0 FHADHM C[C@@H](OC(=O)c1cc(F)c(Cl)cc1F)c1cccc(-c2nnn[n-]2)c1 ZINC000824723619 608183406 /nfs/dbraw/zinc/18/34/06/608183406.db2.gz SSKRQHAKEYOQEM-MRVPVSSYSA-N -1 3 364.739 3.716 20 0 FHADHM C[C@@H](OC(=O)c1cc(F)c(Cl)cc1F)c1cccc(-c2nn[n-]n2)c1 ZINC000824723619 608183407 /nfs/dbraw/zinc/18/34/07/608183407.db2.gz SSKRQHAKEYOQEM-MRVPVSSYSA-N -1 3 364.739 3.716 20 0 FHADHM FC(F)(F)[C@@H]1CCC[C@@H](Nc2ccc3cc(-c4nnn[n-]4)ccc3n2)C1 ZINC000826367037 608221911 /nfs/dbraw/zinc/22/19/11/608221911.db2.gz JETVVBCQQQPTLI-CHWSQXEVSA-N -1 3 362.359 3.948 20 0 FHADHM FC(F)(F)[C@@H]1CCC[C@@H](Nc2ccc3cc(-c4nn[n-]n4)ccc3n2)C1 ZINC000826367037 608221912 /nfs/dbraw/zinc/22/19/12/608221912.db2.gz JETVVBCQQQPTLI-CHWSQXEVSA-N -1 3 362.359 3.948 20 0 FHADHM CC(C)Oc1ccccc1CNc1ccc2cc(-c3nnn[n-]3)ccc2n1 ZINC000824333084 608222814 /nfs/dbraw/zinc/22/28/14/608222814.db2.gz DDCATXDMFZHONF-UHFFFAOYSA-N -1 3 360.421 3.814 20 0 FHADHM CC(C)Oc1ccccc1CNc1ccc2cc(-c3nn[n-]n3)ccc2n1 ZINC000824333084 608222815 /nfs/dbraw/zinc/22/28/15/608222815.db2.gz DDCATXDMFZHONF-UHFFFAOYSA-N -1 3 360.421 3.814 20 0 FHADHM CC[C@H](Nc1ccc2cc(-c3nnn[n-]3)ccc2n1)c1ccccc1OC ZINC000825146254 608223295 /nfs/dbraw/zinc/22/32/95/608223295.db2.gz BBFUVCDWZLDQIX-INIZCTEOSA-N -1 3 360.421 3.987 20 0 FHADHM CC[C@H](Nc1ccc2cc(-c3nn[n-]n3)ccc2n1)c1ccccc1OC ZINC000825146254 608223296 /nfs/dbraw/zinc/22/32/96/608223296.db2.gz BBFUVCDWZLDQIX-INIZCTEOSA-N -1 3 360.421 3.987 20 0 FHADHM CCS[C@@H]1CCCCN(c2ccc3cc(-c4nnn[n-]4)ccc3n2)C1 ZINC000825669090 608228541 /nfs/dbraw/zinc/22/85/41/608228541.db2.gz PUHRXZAPABHLHH-OAHLLOKOSA-N -1 3 354.483 3.527 20 0 FHADHM CCS[C@@H]1CCCCN(c2ccc3cc(-c4nn[n-]n4)ccc3n2)C1 ZINC000825669090 608228543 /nfs/dbraw/zinc/22/85/43/608228543.db2.gz PUHRXZAPABHLHH-OAHLLOKOSA-N -1 3 354.483 3.527 20 0 FHADHM COc1ccc([C@@H](OC)[C@H](C)Nc2c(Cl)cccc2-c2nnn[n-]2)cc1 ZINC000826189162 608238983 /nfs/dbraw/zinc/23/89/83/608238983.db2.gz OTVORTSMZRKZQM-GTNSWQLSSA-N -1 3 373.844 3.717 20 0 FHADHM COc1ccc([C@@H](OC)[C@H](C)Nc2c(Cl)cccc2-c2nn[n-]n2)cc1 ZINC000826189162 608238985 /nfs/dbraw/zinc/23/89/85/608238985.db2.gz OTVORTSMZRKZQM-GTNSWQLSSA-N -1 3 373.844 3.717 20 0 FHADHM COc1ccc([C@H](OC)[C@H](C)Nc2c(Cl)cccc2-c2nnn[n-]2)cc1 ZINC000826189160 608239175 /nfs/dbraw/zinc/23/91/75/608239175.db2.gz OTVORTSMZRKZQM-APPDUMDISA-N -1 3 373.844 3.717 20 0 FHADHM COc1ccc([C@H](OC)[C@H](C)Nc2c(Cl)cccc2-c2nn[n-]n2)cc1 ZINC000826189160 608239176 /nfs/dbraw/zinc/23/91/76/608239176.db2.gz OTVORTSMZRKZQM-APPDUMDISA-N -1 3 373.844 3.717 20 0 FHADHM COc1ccc([C@@H](OC)[C@@H](C)Nc2c(Cl)cccc2-c2nnn[n-]2)cc1 ZINC000826189161 608239195 /nfs/dbraw/zinc/23/91/95/608239195.db2.gz OTVORTSMZRKZQM-DIFFPNOSSA-N -1 3 373.844 3.717 20 0 FHADHM COc1ccc([C@@H](OC)[C@@H](C)Nc2c(Cl)cccc2-c2nn[n-]n2)cc1 ZINC000826189161 608239197 /nfs/dbraw/zinc/23/91/97/608239197.db2.gz OTVORTSMZRKZQM-DIFFPNOSSA-N -1 3 373.844 3.717 20 0 FHADHM CC(C)[C@@H]1C[C@@H](Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)CCO1 ZINC000824216635 608242620 /nfs/dbraw/zinc/24/26/20/608242620.db2.gz UFWISTDLDBXFLL-FZMZJTMJSA-N -1 3 355.364 3.501 20 0 FHADHM CC(C)[C@@H]1C[C@@H](Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)CCO1 ZINC000824216635 608242621 /nfs/dbraw/zinc/24/26/21/608242621.db2.gz UFWISTDLDBXFLL-FZMZJTMJSA-N -1 3 355.364 3.501 20 0 FHADHM C[C@@H](CC(=O)Nc1sccc1-c1nnn[n-]1)Cc1ccc(Cl)cc1 ZINC000824385589 608258083 /nfs/dbraw/zinc/25/80/83/608258083.db2.gz XDXFFAJGDGAIPQ-SNVBAGLBSA-N -1 3 361.858 3.789 20 0 FHADHM C[C@@H](CC(=O)Nc1sccc1-c1nn[n-]n1)Cc1ccc(Cl)cc1 ZINC000824385589 608258084 /nfs/dbraw/zinc/25/80/84/608258084.db2.gz XDXFFAJGDGAIPQ-SNVBAGLBSA-N -1 3 361.858 3.789 20 0 FHADHM Cc1sc(NC(=O)C=Cc2ccc3[nH]ccc3c2)c(-c2nnn[n-]2)c1C ZINC000826349240 608264903 /nfs/dbraw/zinc/26/49/03/608264903.db2.gz AOJBWXAVEZGIES-GQCTYLIASA-N -1 3 364.434 3.678 20 0 FHADHM Cc1sc(NC(=O)C=Cc2ccc3[nH]ccc3c2)c(-c2nn[n-]n2)c1C ZINC000826349240 608264905 /nfs/dbraw/zinc/26/49/05/608264905.db2.gz AOJBWXAVEZGIES-GQCTYLIASA-N -1 3 364.434 3.678 20 0 FHADHM CSc1cc(C(=O)Nc2cc(-c3nnn[n-]3)cn2C(C)(C)C)ccc1F ZINC000826229450 608270258 /nfs/dbraw/zinc/27/02/58/608270258.db2.gz FCNBPGRSZGAYDN-UHFFFAOYSA-N -1 3 374.445 3.537 20 0 FHADHM CSc1cc(C(=O)Nc2cc(-c3nn[n-]n3)cn2C(C)(C)C)ccc1F ZINC000826229450 608270260 /nfs/dbraw/zinc/27/02/60/608270260.db2.gz FCNBPGRSZGAYDN-UHFFFAOYSA-N -1 3 374.445 3.537 20 0 FHADHM CC[C@H](OC(=O)c1sccc1-c1nnn[n-]1)c1cc(C)ccc1OC ZINC000825152865 608272351 /nfs/dbraw/zinc/27/23/51/608272351.db2.gz DMEYFNCYFARZJQ-ZDUSSCGKSA-N -1 3 358.423 3.553 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)c(NCc2ccc(OC3CCCC3)cc2)n1 ZINC000826276330 608280431 /nfs/dbraw/zinc/28/04/31/608280431.db2.gz APVGCAZXBOSKOS-UHFFFAOYSA-N -1 3 350.426 3.504 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)c(NCc2ccc(OC3CCCC3)cc2)n1 ZINC000826276330 608280432 /nfs/dbraw/zinc/28/04/32/608280432.db2.gz APVGCAZXBOSKOS-UHFFFAOYSA-N -1 3 350.426 3.504 20 0 FHADHM COc1ccc2oc([C@H](C)Nc3nc(C)ccc3-c3nnn[n-]3)c(C)c2c1 ZINC000826214027 608284753 /nfs/dbraw/zinc/28/47/53/608284753.db2.gz XCGNWNLGEDGNKF-LBPRGKRZSA-N -1 3 364.409 3.806 20 0 FHADHM COc1ccc2oc([C@H](C)Nc3nc(C)ccc3-c3nn[n-]n3)c(C)c2c1 ZINC000826214027 608284754 /nfs/dbraw/zinc/28/47/54/608284754.db2.gz XCGNWNLGEDGNKF-LBPRGKRZSA-N -1 3 364.409 3.806 20 0 FHADHM C[C@H]1CCN(C(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)C[C@H]1C ZINC000824955461 608312867 /nfs/dbraw/zinc/31/28/67/608312867.db2.gz OVVAZJHOLQCZEP-LSDHHAIUSA-N -1 3 361.449 3.652 20 0 FHADHM C[C@H]1CCN(C(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)C[C@H]1C ZINC000824955461 608312869 /nfs/dbraw/zinc/31/28/69/608312869.db2.gz OVVAZJHOLQCZEP-LSDHHAIUSA-N -1 3 361.449 3.652 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CNc1cc(C(F)(F)F)ccc1F ZINC000826170460 608320076 /nfs/dbraw/zinc/32/00/76/608320076.db2.gz ANLXYMOJFXOQIN-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CNc1cc(C(F)(F)F)ccc1F ZINC000826170460 608320077 /nfs/dbraw/zinc/32/00/77/608320077.db2.gz ANLXYMOJFXOQIN-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM CCCC1(C(=O)NCc2ccc(-c3ccccc3-c3nnn[n-]3)cc2)CC1 ZINC000825248043 608327752 /nfs/dbraw/zinc/32/77/52/608327752.db2.gz LVSDAKHMKLETPQ-UHFFFAOYSA-N -1 3 361.449 3.730 20 0 FHADHM CCCC1(C(=O)NCc2ccc(-c3ccccc3-c3nn[n-]n3)cc2)CC1 ZINC000825248043 608327754 /nfs/dbraw/zinc/32/77/54/608327754.db2.gz LVSDAKHMKLETPQ-UHFFFAOYSA-N -1 3 361.449 3.730 20 0 FHADHM CCC/C(C)=C\C(=O)NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000825231872 608329288 /nfs/dbraw/zinc/32/92/88/608329288.db2.gz BODZFJHRLXCMRP-SQFISAMPSA-N -1 3 361.449 3.896 20 0 FHADHM CCC/C(C)=C\C(=O)NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000825231872 608329289 /nfs/dbraw/zinc/32/92/89/608329289.db2.gz BODZFJHRLXCMRP-SQFISAMPSA-N -1 3 361.449 3.896 20 0 FHADHM CCC[C@@H](C)NC(=O)NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000825234062 608341875 /nfs/dbraw/zinc/34/18/75/608341875.db2.gz VZGYLHKMEVUVOB-CQSZACIVSA-N -1 3 364.453 3.522 20 0 FHADHM CCC[C@@H](C)NC(=O)NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000825234062 608341877 /nfs/dbraw/zinc/34/18/77/608341877.db2.gz VZGYLHKMEVUVOB-CQSZACIVSA-N -1 3 364.453 3.522 20 0 FHADHM CCN(C(=O)[C@H](C)c1ccccc1F)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825367042 608343976 /nfs/dbraw/zinc/34/39/76/608343976.db2.gz IJKXJNRMOWJNHT-LLVKDONJSA-N -1 3 373.819 3.816 20 0 FHADHM CCN(C(=O)[C@H](C)c1ccccc1F)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825367042 608343978 /nfs/dbraw/zinc/34/39/78/608343978.db2.gz IJKXJNRMOWJNHT-LLVKDONJSA-N -1 3 373.819 3.816 20 0 FHADHM CCN(C(=O)CSCCC(C)C)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825376866 608345490 /nfs/dbraw/zinc/34/54/90/608345490.db2.gz OHBJGDCMIKYDLM-UHFFFAOYSA-N -1 3 367.906 3.652 20 0 FHADHM CCN(C(=O)CSCCC(C)C)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825376866 608345492 /nfs/dbraw/zinc/34/54/92/608345492.db2.gz OHBJGDCMIKYDLM-UHFFFAOYSA-N -1 3 367.906 3.652 20 0 FHADHM Clc1ccc(NCc2nc(-c3ccccc3)c[nH]2)c(-c2nnn[n-]2)c1 ZINC000826352837 608376561 /nfs/dbraw/zinc/37/65/61/608376561.db2.gz PWZBSFUVIMJWPT-UHFFFAOYSA-N -1 3 351.801 3.522 20 0 FHADHM Clc1ccc(NCc2nc(-c3ccccc3)c[nH]2)c(-c2nn[n-]n2)c1 ZINC000826352837 608376564 /nfs/dbraw/zinc/37/65/64/608376564.db2.gz PWZBSFUVIMJWPT-UHFFFAOYSA-N -1 3 351.801 3.522 20 0 FHADHM O=C(CC/C=C/c1ccccc1)OCc1cccc(-c2nnn[n-]2)c1F ZINC000826405640 608448126 /nfs/dbraw/zinc/44/81/26/608448126.db2.gz NITSNCUGQQEMCZ-RUDMXATFSA-N -1 3 352.369 3.543 20 0 FHADHM O=C(CC/C=C/c1ccccc1)OCc1cccc(-c2nn[n-]n2)c1F ZINC000826405640 608448128 /nfs/dbraw/zinc/44/81/28/608448128.db2.gz NITSNCUGQQEMCZ-RUDMXATFSA-N -1 3 352.369 3.543 20 0 FHADHM Cc1ccccc1-c1cnc(CN[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)o1 ZINC000826304916 608461674 /nfs/dbraw/zinc/46/16/74/608461674.db2.gz DMUPZHTWSCOLOE-AWEZNQCLSA-N -1 3 360.421 3.681 20 0 FHADHM Cc1ccccc1-c1cnc(CN[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)o1 ZINC000826304916 608461676 /nfs/dbraw/zinc/46/16/76/608461676.db2.gz DMUPZHTWSCOLOE-AWEZNQCLSA-N -1 3 360.421 3.681 20 0 FHADHM Cc1oc(-c2cccs2)nc1CN[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000826340606 608467899 /nfs/dbraw/zinc/46/78/99/608467899.db2.gz DVFDCWALOQSKEJ-NSHDSACASA-N -1 3 366.450 3.742 20 0 FHADHM CCc1ccccc1NC(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000825722734 608468613 /nfs/dbraw/zinc/46/86/13/608468613.db2.gz LCMIWONCVMJBER-UHFFFAOYSA-N -1 3 374.448 3.750 20 0 FHADHM CCc1ccccc1NC(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000825722734 608468615 /nfs/dbraw/zinc/46/86/15/608468615.db2.gz LCMIWONCVMJBER-UHFFFAOYSA-N -1 3 374.448 3.750 20 0 FHADHM Fc1c(CNc2ccccc2OC(F)(F)F)cccc1-c1nnn[n-]1 ZINC000826371221 608479547 /nfs/dbraw/zinc/47/95/47/608479547.db2.gz XJJBKSNPLGMBIU-UHFFFAOYSA-N -1 3 353.279 3.517 20 0 FHADHM Fc1c(CNc2ccccc2OC(F)(F)F)cccc1-c1nn[n-]n1 ZINC000826371221 608479548 /nfs/dbraw/zinc/47/95/48/608479548.db2.gz XJJBKSNPLGMBIU-UHFFFAOYSA-N -1 3 353.279 3.517 20 0 FHADHM CCCC(=O)Nc1cccc(NCc2cccc(-c3nnn[n-]3)c2F)c1C ZINC000825225179 608480657 /nfs/dbraw/zinc/48/06/57/608480657.db2.gz NHMYWWKVIQQFBU-UHFFFAOYSA-N -1 3 368.416 3.665 20 0 FHADHM CCCC(=O)Nc1cccc(NCc2cccc(-c3nn[n-]n3)c2F)c1C ZINC000825225179 608480659 /nfs/dbraw/zinc/48/06/59/608480659.db2.gz NHMYWWKVIQQFBU-UHFFFAOYSA-N -1 3 368.416 3.665 20 0 FHADHM CC1CCC(=CC(=O)N2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)CC1 ZINC000824899696 608483159 /nfs/dbraw/zinc/48/31/59/608483159.db2.gz NDBCWYGFXYZNRX-UHFFFAOYSA-N -1 3 363.465 3.619 20 0 FHADHM CC1CCC(=CC(=O)N2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)CC1 ZINC000824899696 608483161 /nfs/dbraw/zinc/48/31/61/608483161.db2.gz NDBCWYGFXYZNRX-UHFFFAOYSA-N -1 3 363.465 3.619 20 0 FHADHM C[C@@H](NCc1coc(-c2ccc(F)cc2)n1)c1cccc(-c2nn[n-]n2)c1 ZINC000824627280 608484679 /nfs/dbraw/zinc/48/46/79/608484679.db2.gz VXOBLAJGYATWFO-GFCCVEGCSA-N -1 3 364.384 3.512 20 0 FHADHM CN(Cc1cc(-c2nnn[n-]2)cs1)Cc1ccc(Cl)cc1Cl ZINC000825953369 608500798 /nfs/dbraw/zinc/50/07/98/608500798.db2.gz HHSBBQSDMXSUQG-UHFFFAOYSA-N -1 3 354.266 3.867 20 0 FHADHM CN(Cc1cc(-c2nn[n-]n2)cs1)Cc1ccc(Cl)cc1Cl ZINC000825953369 608500799 /nfs/dbraw/zinc/50/07/99/608500799.db2.gz HHSBBQSDMXSUQG-UHFFFAOYSA-N -1 3 354.266 3.867 20 0 FHADHM c1oc(-c2ccccc2)nc1CN[C@H]1CCCc2cc(-c3nn[n-]n3)ccc21 ZINC000826519107 608515067 /nfs/dbraw/zinc/51/50/67/608515067.db2.gz KKHHXYZKNNKHQY-IBGZPJMESA-N -1 3 372.432 3.689 20 0 FHADHM CCN(C(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1)c1ccc(C)cc1C ZINC000825381131 608575096 /nfs/dbraw/zinc/57/50/96/608575096.db2.gz ZUXNRKSQBMVIBD-UHFFFAOYSA-N -1 3 355.829 3.804 20 0 FHADHM CCN(C(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1)c1ccc(C)cc1C ZINC000825381131 608575098 /nfs/dbraw/zinc/57/50/98/608575098.db2.gz ZUXNRKSQBMVIBD-UHFFFAOYSA-N -1 3 355.829 3.804 20 0 FHADHM CC[C@H]1c2ccsc2CCN1C(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000825219219 608575363 /nfs/dbraw/zinc/57/53/63/608575363.db2.gz IBWBYAJWBWCJFN-AWEZNQCLSA-N -1 3 373.869 3.731 20 0 FHADHM CC[C@H]1c2ccsc2CCN1C(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000825219219 608575364 /nfs/dbraw/zinc/57/53/64/608575364.db2.gz IBWBYAJWBWCJFN-AWEZNQCLSA-N -1 3 373.869 3.731 20 0 FHADHM C[C@@H]1SCCN(Cc2cccc(-c3nnn[n-]3)c2F)[C@H]1c1ccccc1 ZINC000825019575 608650542 /nfs/dbraw/zinc/65/05/42/608650542.db2.gz FLKAKBSYTKVZGG-SCLBCKFNSA-N -1 3 369.469 3.684 20 0 FHADHM Cc1cc(Oc2ccc(-c3nnn[n-]3)cc2)ccc1NC(=O)C(C)(C)F ZINC000826271960 608667575 /nfs/dbraw/zinc/66/75/75/608667575.db2.gz OZQQELIJJTXHLN-UHFFFAOYSA-N -1 3 355.373 3.654 20 0 FHADHM Cc1cc(Oc2ccc(-c3nn[n-]n3)cc2)ccc1NC(=O)C(C)(C)F ZINC000826271960 608667576 /nfs/dbraw/zinc/66/75/76/608667576.db2.gz OZQQELIJJTXHLN-UHFFFAOYSA-N -1 3 355.373 3.654 20 0 FHADHM Cc1ccccc1-c1nnc(SCc2cccc(-c3nnn[n-]3)c2F)o1 ZINC000826304897 608669505 /nfs/dbraw/zinc/66/95/05/608669505.db2.gz CGXKZFDSQZBOMJ-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM Cc1ccccc1-c1nnc(SCc2cccc(-c3nn[n-]n3)c2F)o1 ZINC000826304897 608669506 /nfs/dbraw/zinc/66/95/06/608669506.db2.gz CGXKZFDSQZBOMJ-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM Fc1ccc([C@@H]2CCCCN2Cc2cc(-c3nnn[n-]3)cs2)c(F)c1 ZINC000826374379 608848614 /nfs/dbraw/zinc/84/86/14/608848614.db2.gz XBJQZKUVIUWZCI-INIZCTEOSA-N -1 3 361.421 3.934 20 0 FHADHM Fc1ccc([C@@H]2CCCCN2Cc2cc(-c3nn[n-]n3)cs2)c(F)c1 ZINC000826374379 608848617 /nfs/dbraw/zinc/84/86/17/608848617.db2.gz XBJQZKUVIUWZCI-INIZCTEOSA-N -1 3 361.421 3.934 20 0 FHADHM Cn1nc(-c2ccccc2)c(CNc2ccc(-c3nn[n-]n3)cc2)c1Cl ZINC000826366087 608866314 /nfs/dbraw/zinc/86/63/14/608866314.db2.gz RNWYEJAEWUQFNY-UHFFFAOYSA-N -1 3 365.828 3.533 20 0 FHADHM CCOc1c(Cl)cc(CNc2cccc(-c3nnn[n-]3)c2)cc1OC ZINC000825603788 608871671 /nfs/dbraw/zinc/87/16/71/608871671.db2.gz CLTBCMUWKWOKCJ-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM CCOc1c(Cl)cc(CNc2cccc(-c3nn[n-]n3)c2)cc1OC ZINC000825603788 608871675 /nfs/dbraw/zinc/87/16/75/608871675.db2.gz CLTBCMUWKWOKCJ-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM Cc1nn(Cc2ccc(C)cc2)c(C)c1CNc1cccc(-c2nnn[n-]2)c1 ZINC000826289094 608872155 /nfs/dbraw/zinc/87/21/55/608872155.db2.gz KJXAFBZXHUAVRA-UHFFFAOYSA-N -1 3 373.464 3.649 20 0 FHADHM Cc1nn(Cc2ccc(C)cc2)c(C)c1CNc1cccc(-c2nn[n-]n2)c1 ZINC000826289094 608872158 /nfs/dbraw/zinc/87/21/58/608872158.db2.gz KJXAFBZXHUAVRA-UHFFFAOYSA-N -1 3 373.464 3.649 20 0 FHADHM CCC(=O)Nc1ccc(C)c(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000825034159 609157739 /nfs/dbraw/zinc/15/77/39/609157739.db2.gz FMRVTKOLPMQPFJ-ZDUSSCGKSA-N -1 3 350.426 3.697 20 0 FHADHM CCC(=O)Nc1ccc(C)c(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000825034159 609157740 /nfs/dbraw/zinc/15/77/40/609157740.db2.gz FMRVTKOLPMQPFJ-ZDUSSCGKSA-N -1 3 350.426 3.697 20 0 FHADHM C[C@H](Nc1ccc(N2CCCC2)c(F)c1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824655432 609180311 /nfs/dbraw/zinc/18/03/11/609180311.db2.gz COWICRPIFBMVDP-LBPRGKRZSA-N -1 3 370.407 3.918 20 0 FHADHM C[C@H](Nc1ccc(N2CCCC2)c(F)c1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824655432 609180314 /nfs/dbraw/zinc/18/03/14/609180314.db2.gz COWICRPIFBMVDP-LBPRGKRZSA-N -1 3 370.407 3.918 20 0 FHADHM Fc1cc(CNc2ccc(Cl)c(-c3nnn[n-]3)c2)ccc1OC(F)F ZINC000826372263 609200085 /nfs/dbraw/zinc/20/00/85/609200085.db2.gz OURRPJGDTWPGLZ-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM Fc1cc(CNc2ccc(Cl)c(-c3nn[n-]n3)c2)ccc1OC(F)F ZINC000826372263 609200086 /nfs/dbraw/zinc/20/00/86/609200086.db2.gz OURRPJGDTWPGLZ-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM COCCOc1ccc(N[C@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)c(C)c1 ZINC000826162586 609236903 /nfs/dbraw/zinc/23/69/03/609236903.db2.gz JCPPBEXLAWFUPV-CYBMUJFWSA-N -1 3 371.416 3.513 20 0 FHADHM COCCOc1ccc(N[C@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)c(C)c1 ZINC000826162586 609236904 /nfs/dbraw/zinc/23/69/04/609236904.db2.gz JCPPBEXLAWFUPV-CYBMUJFWSA-N -1 3 371.416 3.513 20 0 FHADHM C[C@H](Nc1ccn([C@@H](C)c2ccccc2)n1)c1cccc(-c2nnn[n-]2)c1 ZINC000824663487 609245209 /nfs/dbraw/zinc/24/52/09/609245209.db2.gz ZVVIKWXEOYQCHV-GJZGRUSLSA-N -1 3 359.437 3.846 20 0 FHADHM C[C@H](Nc1ccn([C@@H](C)c2ccccc2)n1)c1cccc(-c2nn[n-]n2)c1 ZINC000824663487 609245211 /nfs/dbraw/zinc/24/52/11/609245211.db2.gz ZVVIKWXEOYQCHV-GJZGRUSLSA-N -1 3 359.437 3.846 20 0 FHADHM C[C@H](Nc1cnn(-c2ccccc2Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824662166 609251531 /nfs/dbraw/zinc/25/15/31/609251531.db2.gz DYMSROBYBWYTPU-LBPRGKRZSA-N -1 3 365.828 3.879 20 0 FHADHM C[C@H](Nc1cnn(-c2ccccc2Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824662166 609251533 /nfs/dbraw/zinc/25/15/33/609251533.db2.gz DYMSROBYBWYTPU-LBPRGKRZSA-N -1 3 365.828 3.879 20 0 FHADHM CCc1c(N[C@@H]2CCCc3cc(-c4nnn[n-]4)ccc32)cnn1CC(C)C ZINC000825693961 609253010 /nfs/dbraw/zinc/25/30/10/609253010.db2.gz ILIPMJHONZIADJ-QGZVFWFLSA-N -1 3 365.485 3.771 20 0 FHADHM CCc1c(N[C@@H]2CCCc3cc(-c4nn[n-]n4)ccc32)cnn1CC(C)C ZINC000825693961 609253012 /nfs/dbraw/zinc/25/30/12/609253012.db2.gz ILIPMJHONZIADJ-QGZVFWFLSA-N -1 3 365.485 3.771 20 0 FHADHM CCC(=O)Nc1ccc(N[C@H]2CCCc3cc(-c4nnn[n-]4)ccc32)cc1 ZINC000825035127 609269038 /nfs/dbraw/zinc/26/90/38/609269038.db2.gz VUFWTTVDJINIIC-SFHVURJKSA-N -1 3 362.437 3.705 20 0 FHADHM CCC(=O)Nc1ccc(N[C@H]2CCCc3cc(-c4nn[n-]n4)ccc32)cc1 ZINC000825035127 609269039 /nfs/dbraw/zinc/26/90/39/609269039.db2.gz VUFWTTVDJINIIC-SFHVURJKSA-N -1 3 362.437 3.705 20 0 FHADHM Cc1cc(Cl)c(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCC3)cc1C ZINC000826267424 609269240 /nfs/dbraw/zinc/26/92/40/609269240.db2.gz FKFWFTAXXRTSLW-UHFFFAOYSA-N -1 3 373.869 3.939 20 0 FHADHM Cc1cc(Cl)c(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCC3)cc1C ZINC000826267424 609269241 /nfs/dbraw/zinc/26/92/41/609269241.db2.gz FKFWFTAXXRTSLW-UHFFFAOYSA-N -1 3 373.869 3.939 20 0 FHADHM C[C@H](Nc1cccc(C(=O)NC(C)(C)C)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824662473 609273398 /nfs/dbraw/zinc/27/33/98/609273398.db2.gz LDSMPVIBLQPQNJ-ZDUSSCGKSA-N -1 3 364.453 3.568 20 0 FHADHM C[C@H](Nc1cccc(C(=O)NC(C)(C)C)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824662473 609273401 /nfs/dbraw/zinc/27/34/01/609273401.db2.gz LDSMPVIBLQPQNJ-ZDUSSCGKSA-N -1 3 364.453 3.568 20 0 FHADHM CCOc1cc2c(cc1N[C@@H](C)c1ccc(-c3nnn[n-]3)cc1)O[C@H](C)C2 ZINC000825621503 609273958 /nfs/dbraw/zinc/27/39/58/609273958.db2.gz VFVGRDWTRVDBBL-OLZOCXBDSA-N -1 3 365.437 3.762 20 0 FHADHM CCOc1cc2c(cc1N[C@@H](C)c1ccc(-c3nn[n-]n3)cc1)O[C@H](C)C2 ZINC000825621503 609273959 /nfs/dbraw/zinc/27/39/59/609273959.db2.gz VFVGRDWTRVDBBL-OLZOCXBDSA-N -1 3 365.437 3.762 20 0 FHADHM CSc1cc2c(cc1N[C@H](C)c1cccc(-c3nnn[n-]3)c1)OCCO2 ZINC000826230044 609278575 /nfs/dbraw/zinc/27/85/75/609278575.db2.gz BLHAZUADXHFXFO-LLVKDONJSA-N -1 3 369.450 3.533 20 0 FHADHM CSc1cc2c(cc1N[C@H](C)c1cccc(-c3nn[n-]n3)c1)OCCO2 ZINC000826230044 609278577 /nfs/dbraw/zinc/27/85/77/609278577.db2.gz BLHAZUADXHFXFO-LLVKDONJSA-N -1 3 369.450 3.533 20 0 FHADHM COc1ccc(OC(C)C)c(N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000826210298 609278911 /nfs/dbraw/zinc/27/89/11/609278911.db2.gz LWKPOSVJSNPSGB-CYBMUJFWSA-N -1 3 353.426 3.836 20 0 FHADHM COc1ccc(OC(C)C)c(N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000826210298 609278913 /nfs/dbraw/zinc/27/89/13/609278913.db2.gz LWKPOSVJSNPSGB-CYBMUJFWSA-N -1 3 353.426 3.836 20 0 FHADHM CSc1cc2c(cc1N[C@H](C)c1ccc(-c3nnn[n-]3)cc1)OCCO2 ZINC000826230519 609278963 /nfs/dbraw/zinc/27/89/63/609278963.db2.gz XHLJCFHLBSVFSN-LLVKDONJSA-N -1 3 369.450 3.533 20 0 FHADHM CSc1cc2c(cc1N[C@H](C)c1ccc(-c3nn[n-]n3)cc1)OCCO2 ZINC000826230519 609278965 /nfs/dbraw/zinc/27/89/65/609278965.db2.gz XHLJCFHLBSVFSN-LLVKDONJSA-N -1 3 369.450 3.533 20 0 FHADHM C[C@@H](Nc1ccc(N2CCSCC2)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000824656481 609279351 /nfs/dbraw/zinc/27/93/51/609279351.db2.gz KKDSUEUJCNSZJF-CQSZACIVSA-N -1 3 366.494 3.593 20 0 FHADHM C[C@@H](Nc1ccc(N2CCSCC2)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000824656481 609279352 /nfs/dbraw/zinc/27/93/52/609279352.db2.gz KKDSUEUJCNSZJF-CQSZACIVSA-N -1 3 366.494 3.593 20 0 FHADHM Cc1nscc1C(=O)Oc1ccc(-c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000826340003 609294501 /nfs/dbraw/zinc/29/45/01/609294501.db2.gz CWQAYBPYZCFJNR-UHFFFAOYSA-N -1 3 363.402 3.518 20 0 FHADHM Cc1nscc1C(=O)Oc1ccc(-c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000826340003 609294503 /nfs/dbraw/zinc/29/45/03/609294503.db2.gz CWQAYBPYZCFJNR-UHFFFAOYSA-N -1 3 363.402 3.518 20 0 FHADHM C[C@@H]1CCC[C@H]1NC(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000824937184 609317824 /nfs/dbraw/zinc/31/78/24/609317824.db2.gz ODUCMGWJKLPZGR-CZUORRHYSA-N -1 3 363.421 3.577 20 0 FHADHM C[C@@H]1CCC[C@H]1NC(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000824937184 609317826 /nfs/dbraw/zinc/31/78/26/609317826.db2.gz ODUCMGWJKLPZGR-CZUORRHYSA-N -1 3 363.421 3.577 20 0 FHADHM COCCCCCSCc1ccc(-c2nnn[n-]2)cc1Br ZINC000826156274 609329515 /nfs/dbraw/zinc/32/95/15/609329515.db2.gz WMOXLRRHUFMXIR-UHFFFAOYSA-N -1 3 371.304 3.679 20 0 FHADHM COCCCCCSCc1ccc(-c2nn[n-]n2)cc1Br ZINC000826156274 609329517 /nfs/dbraw/zinc/32/95/17/609329517.db2.gz WMOXLRRHUFMXIR-UHFFFAOYSA-N -1 3 371.304 3.679 20 0 FHADHM c1cc(OCCCSCc2ccc3c(c2)COC3)cc(-c2nnn[n-]2)c1 ZINC000826517383 609329863 /nfs/dbraw/zinc/32/98/63/609329863.db2.gz AGPFVGQJACSZHZ-UHFFFAOYSA-N -1 3 368.462 3.599 20 0 FHADHM c1cc(OCCCSCc2ccc3c(c2)COC3)cc(-c2nn[n-]n2)c1 ZINC000826517383 609329865 /nfs/dbraw/zinc/32/98/65/609329865.db2.gz AGPFVGQJACSZHZ-UHFFFAOYSA-N -1 3 368.462 3.599 20 0 FHADHM COCCOc1cc(C)ccc1N[C@H](C)c1ccc(-c2nnn[n-]2)cc1F ZINC000826161107 609346087 /nfs/dbraw/zinc/34/60/87/609346087.db2.gz UKALITMDOURAFQ-CYBMUJFWSA-N -1 3 371.416 3.513 20 0 FHADHM COCCOc1cc(C)ccc1N[C@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000826161107 609346088 /nfs/dbraw/zinc/34/60/88/609346088.db2.gz UKALITMDOURAFQ-CYBMUJFWSA-N -1 3 371.416 3.513 20 0 FHADHM C[C@H](NC1(c2cccc(Cl)c2)CC1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824539918 609347236 /nfs/dbraw/zinc/34/72/36/609347236.db2.gz QXTDLHXVAWWQDQ-NSHDSACASA-N -1 3 357.820 3.999 20 0 FHADHM C[C@@H](Nc1ccc(F)cc1OC(F)F)c1ccc(-c2nnn[n-]2)cc1F ZINC000824654921 609348381 /nfs/dbraw/zinc/34/83/81/609348381.db2.gz AIZGBRIAWHUQDB-MRVPVSSYSA-N -1 3 367.306 3.919 20 0 FHADHM C[C@@H](Nc1ccc(F)cc1OC(F)F)c1ccc(-c2nn[n-]n2)cc1F ZINC000824654921 609348383 /nfs/dbraw/zinc/34/83/83/609348383.db2.gz AIZGBRIAWHUQDB-MRVPVSSYSA-N -1 3 367.306 3.919 20 0 FHADHM CSCCCOC(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000826229084 609351868 /nfs/dbraw/zinc/35/18/68/609351868.db2.gz OFFSVMZBIMTARP-UHFFFAOYSA-N -1 3 370.434 3.569 20 0 FHADHM CSCCCOC(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000826229084 609351871 /nfs/dbraw/zinc/35/18/71/609351871.db2.gz OFFSVMZBIMTARP-UHFFFAOYSA-N -1 3 370.434 3.569 20 0 FHADHM Cc1ccc(-c2ccc(C(=O)Nc3cccc(-c4nnn[n-]4)c3)s2)o1 ZINC000541940664 609370388 /nfs/dbraw/zinc/37/03/88/609370388.db2.gz GOGFPHYBKXLYQP-UHFFFAOYSA-N -1 3 351.391 3.749 20 0 FHADHM Cc1ccc(-c2ccc(C(=O)Nc3cccc(-c4nn[n-]n4)c3)s2)o1 ZINC000541940664 609370390 /nfs/dbraw/zinc/37/03/90/609370390.db2.gz GOGFPHYBKXLYQP-UHFFFAOYSA-N -1 3 351.391 3.749 20 0 FHADHM Cc1c(NC(=O)N[C@H](CC(C)(C)C)C(F)(F)F)cccc1-c1nnn[n-]1 ZINC000826241800 609383637 /nfs/dbraw/zinc/38/36/37/609383637.db2.gz PCMLLHOZLFARSW-GFCCVEGCSA-N -1 3 370.379 3.664 20 0 FHADHM Cc1c(NC(=O)N[C@H](CC(C)(C)C)C(F)(F)F)cccc1-c1nn[n-]n1 ZINC000826241800 609383638 /nfs/dbraw/zinc/38/36/38/609383638.db2.gz PCMLLHOZLFARSW-GFCCVEGCSA-N -1 3 370.379 3.664 20 0 FHADHM C[C@@H]1CC[C@]2(CCN(C(=O)Nc3ccc(-c4nnn[n-]4)cc3Cl)C2)C1 ZINC000824919677 609405768 /nfs/dbraw/zinc/40/57/68/609405768.db2.gz WTOIJPDIKLLQPR-DIFFPNOSSA-N -1 3 360.849 3.564 20 0 FHADHM C[C@@H]1CC[C@]2(CCN(C(=O)Nc3ccc(-c4nn[n-]n4)cc3Cl)C2)C1 ZINC000824919677 609405769 /nfs/dbraw/zinc/40/57/69/609405769.db2.gz WTOIJPDIKLLQPR-DIFFPNOSSA-N -1 3 360.849 3.564 20 0 FHADHM CC(=O)c1ccc(-c2nnn[n-]2)cc1NCCCO[C@H](C)c1ccccc1 ZINC000824019809 609420473 /nfs/dbraw/zinc/42/04/73/609420473.db2.gz PDTSIOLMPVRLKE-OAHLLOKOSA-N -1 3 365.437 3.649 20 0 FHADHM CC(=O)c1ccc(-c2nn[n-]n2)cc1NCCCO[C@H](C)c1ccccc1 ZINC000824019809 609420474 /nfs/dbraw/zinc/42/04/74/609420474.db2.gz PDTSIOLMPVRLKE-OAHLLOKOSA-N -1 3 365.437 3.649 20 0 FHADHM CC(C)Nc1cccc(F)c1NCCCOc1cccc(-c2nnn[n-]2)c1 ZINC000824305455 609439103 /nfs/dbraw/zinc/43/91/03/609439103.db2.gz QMMKOLSJTGPMGP-UHFFFAOYSA-N -1 3 370.432 3.707 20 0 FHADHM CC(C)Nc1cccc(F)c1NCCCOc1cccc(-c2nn[n-]n2)c1 ZINC000824305455 609439104 /nfs/dbraw/zinc/43/91/04/609439104.db2.gz QMMKOLSJTGPMGP-UHFFFAOYSA-N -1 3 370.432 3.707 20 0 FHADHM Cc1cccc(CSc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)n1 ZINC000826298526 609451476 /nfs/dbraw/zinc/45/14/76/609451476.db2.gz 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/nfs/dbraw/zinc/47/85/34/609478534.db2.gz XLVCIFCWWFGRRM-UHFFFAOYSA-N -1 3 370.482 3.990 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NCc1cnc(C2CCC2)s1 ZINC000824324972 609478535 /nfs/dbraw/zinc/47/85/35/609478535.db2.gz XLVCIFCWWFGRRM-UHFFFAOYSA-N -1 3 370.482 3.990 20 0 FHADHM CCOc1c(Cl)cc(CNc2cc(-c3nnn[n-]3)ccc2C)cc1OC ZINC000825604276 609478584 /nfs/dbraw/zinc/47/85/84/609478584.db2.gz GZKHOJNQBLNSRE-UHFFFAOYSA-N -1 3 373.844 3.848 20 0 FHADHM CCOc1c(Cl)cc(CNc2cc(-c3nn[n-]n3)ccc2C)cc1OC ZINC000825604276 609478585 /nfs/dbraw/zinc/47/85/85/609478585.db2.gz GZKHOJNQBLNSRE-UHFFFAOYSA-N -1 3 373.844 3.848 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NCc1nc2c(s1)CCCC2 ZINC000824324759 609478971 /nfs/dbraw/zinc/47/89/71/609478971.db2.gz UNTOGANCHZMIDC-UHFFFAOYSA-N -1 3 370.482 3.601 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NCc1nc2c(s1)CCCC2 ZINC000824324759 609478973 /nfs/dbraw/zinc/47/89/73/609478973.db2.gz UNTOGANCHZMIDC-UHFFFAOYSA-N -1 3 370.482 3.601 20 0 FHADHM CCOC(=O)Nc1ccc(NCc2cccc(Cl)c2)cc1-c1nnn[n-]1 ZINC000825553414 609488329 /nfs/dbraw/zinc/48/83/29/609488329.db2.gz PVBMZCYGDGENIZ-UHFFFAOYSA-N -1 3 372.816 3.701 20 0 FHADHM CCOC(=O)Nc1ccc(NCc2cccc(Cl)c2)cc1-c1nn[n-]n1 ZINC000825553414 609488331 /nfs/dbraw/zinc/48/83/31/609488331.db2.gz PVBMZCYGDGENIZ-UHFFFAOYSA-N -1 3 372.816 3.701 20 0 FHADHM C[C@@H]1CCC[C@H]1C(=O)Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1 ZINC000824929120 609489347 /nfs/dbraw/zinc/48/93/47/609489347.db2.gz WCQHWTHPLZJVIO-DGCLKSJQSA-N -1 3 353.451 3.970 20 0 FHADHM C[C@@H]1CCC[C@H]1C(=O)Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1 ZINC000824929120 609489350 /nfs/dbraw/zinc/48/93/50/609489350.db2.gz WCQHWTHPLZJVIO-DGCLKSJQSA-N -1 3 353.451 3.970 20 0 FHADHM CC(C)Oc1ccc(NCc2cnc(C3CCC3)s2)cc1-c1nnn[n-]1 ZINC000824329557 609492109 /nfs/dbraw/zinc/49/21/09/609492109.db2.gz QTAJRUPVLSRQMR-UHFFFAOYSA-N -1 3 370.482 3.990 20 0 FHADHM CC(C)Oc1ccc(NCc2cnc(C3CCC3)s2)cc1-c1nn[n-]n1 ZINC000824329557 609492110 /nfs/dbraw/zinc/49/21/10/609492110.db2.gz QTAJRUPVLSRQMR-UHFFFAOYSA-N -1 3 370.482 3.990 20 0 FHADHM O=C(c1ccc(-c2nnn[n-]2)cc1)N1CC=C(c2cccc3ccccc32)C1 ZINC000826471944 609501993 /nfs/dbraw/zinc/50/19/93/609501993.db2.gz RSIPSPKSTDONBP-UHFFFAOYSA-N -1 3 367.412 3.559 20 0 FHADHM O=C(c1ccc(-c2nn[n-]n2)cc1)N1CC=C(c2cccc3ccccc32)C1 ZINC000826471944 609501994 /nfs/dbraw/zinc/50/19/94/609501994.db2.gz RSIPSPKSTDONBP-UHFFFAOYSA-N -1 3 367.412 3.559 20 0 FHADHM O=C(Nc1nc(-c2cccc(-c3nnn[n-]3)c2)cs1)C12CCC(CC1)C2 ZINC000826459302 609511378 /nfs/dbraw/zinc/51/13/78/609511378.db2.gz DZDBRSBPEXDYPF-UHFFFAOYSA-N -1 3 366.450 3.509 20 0 FHADHM O=C(Nc1nc(-c2cccc(-c3nn[n-]n3)c2)cs1)C12CCC(CC1)C2 ZINC000826459302 609511380 /nfs/dbraw/zinc/51/13/80/609511380.db2.gz DZDBRSBPEXDYPF-UHFFFAOYSA-N -1 3 366.450 3.509 20 0 FHADHM Cc1cc(NCc2ccc(-c3nn[n-]n3)cc2)cnc1N1CCCC[C@@H]1C ZINC000826271573 609512820 /nfs/dbraw/zinc/51/28/20/609512820.db2.gz XLQBOCDTIWIUPP-HNNXBMFYSA-N -1 3 363.469 3.561 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)C1C[C@H](C)C[C@@H](C)C1 ZINC000824875764 609521255 /nfs/dbraw/zinc/52/12/55/609521255.db2.gz OTAIXKFWSJCRIC-HUUCEWRRSA-N -1 3 355.486 3.676 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)C1C[C@H](C)C[C@@H](C)C1 ZINC000824875764 609521257 /nfs/dbraw/zinc/52/12/57/609521257.db2.gz OTAIXKFWSJCRIC-HUUCEWRRSA-N -1 3 355.486 3.676 20 0 FHADHM CCN(C(=O)C1C[C@H](C)C[C@@H](C)C1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825366511 609523435 /nfs/dbraw/zinc/52/34/35/609523435.db2.gz ATVMSVGNPMEJCR-KFWWJZLASA-N -1 3 355.486 3.849 20 0 FHADHM CCN(C(=O)C1C[C@H](C)C[C@@H](C)C1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825366511 609523437 /nfs/dbraw/zinc/52/34/37/609523437.db2.gz ATVMSVGNPMEJCR-KFWWJZLASA-N -1 3 355.486 3.849 20 0 FHADHM Cc1csc([C@@H](Nc2ncc(Cl)c(C)c2-c2nnn[n-]2)C2CC2)n1 ZINC000826320294 609561427 /nfs/dbraw/zinc/56/14/27/609561427.db2.gz LWNYGOOOQAKOQK-LBPRGKRZSA-N -1 3 361.862 3.552 20 0 FHADHM Cc1csc([C@@H](Nc2ncc(Cl)c(C)c2-c2nn[n-]n2)C2CC2)n1 ZINC000826320294 609561428 /nfs/dbraw/zinc/56/14/28/609561428.db2.gz LWNYGOOOQAKOQK-LBPRGKRZSA-N -1 3 361.862 3.552 20 0 FHADHM Cc1c(Cl)cnc(N2CC[C@H](C)C[C@@H]2c2ccco2)c1-c1nnn[n-]1 ZINC000826237296 609565425 /nfs/dbraw/zinc/56/54/25/609565425.db2.gz VCFLUNXFYSZURL-GXFFZTMASA-N -1 3 358.833 3.794 20 0 FHADHM Cc1c(Cl)cnc(N2CC[C@H](C)C[C@@H]2c2ccco2)c1-c1nn[n-]n1 ZINC000826237296 609565427 /nfs/dbraw/zinc/56/54/27/609565427.db2.gz VCFLUNXFYSZURL-GXFFZTMASA-N -1 3 358.833 3.794 20 0 FHADHM COc1cccc([C@@H]2C[C@@H](C)CN2c2cccc(F)c2-c2nnn[n-]2)c1 ZINC000826215187 609593000 /nfs/dbraw/zinc/59/30/00/609593000.db2.gz ITHPBXHFDUTPPJ-PXAZEXFGSA-N -1 3 353.401 3.602 20 0 FHADHM COc1cccc([C@@H]2C[C@@H](C)CN2c2cccc(F)c2-c2nn[n-]n2)c1 ZINC000826215187 609593002 /nfs/dbraw/zinc/59/30/02/609593002.db2.gz ITHPBXHFDUTPPJ-PXAZEXFGSA-N -1 3 353.401 3.602 20 0 FHADHM C[C@@H]1CC(C(=O)N2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)C[C@@H](C)C1 ZINC000824874506 609604324 /nfs/dbraw/zinc/60/43/24/609604324.db2.gz DFKUIMXYOZDBTH-GJZGRUSLSA-N -1 3 365.481 3.555 20 0 FHADHM C[C@@H]1CC(C(=O)N2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)C[C@@H](C)C1 ZINC000824874506 609604327 /nfs/dbraw/zinc/60/43/27/609604327.db2.gz DFKUIMXYOZDBTH-GJZGRUSLSA-N -1 3 365.481 3.555 20 0 FHADHM COc1cc(C(=O)N2C[C@@H](c3ccc(F)cc3)C[C@@H]2C)cc(OC)c1[O-] ZINC000162216376 936357563 /nfs/dbraw/zinc/35/75/63/936357563.db2.gz VPDJSCVIUULCRX-WFASDCNBSA-N -1 3 359.397 3.567 20 0 FHADHM CCCOc1ccc(-n2c([O-])c(CC(F)(F)F)[nH]c2=O)cc1Cl ZINC000278010190 936358314 /nfs/dbraw/zinc/35/83/14/936358314.db2.gz GIQVGSXRGZPNLU-JTQLQIEISA-N -1 3 350.724 3.506 20 0 FHADHM CO[C@H](CS(=O)(=O)[N-]c1ccc(C(F)(F)F)cc1Cl)C(C)C ZINC000647270920 936381936 /nfs/dbraw/zinc/38/19/36/936381936.db2.gz UNNVXIBUDMQRCU-GFCCVEGCSA-N -1 3 359.797 3.772 20 0 FHADHM CN(Cc1ccsc1)C(=O)NCc1ccc([O-])c(Br)c1 ZINC000126104021 936387959 /nfs/dbraw/zinc/38/79/59/936387959.db2.gz UGXMFAYCPGNBFH-UHFFFAOYSA-N -1 3 355.257 3.558 20 0 FHADHM Cc1cc(C(C#N)=C([O-])C=Cc2ccccc2OC(F)(F)F)nc(C)n1 ZINC000049406758 927041231 /nfs/dbraw/zinc/04/12/31/927041231.db2.gz NXQVLXPQKPTASR-HSBSLETESA-N -1 3 361.323 3.882 20 0 FHADHM CCc1noc(CC)c1C[N-]S(=O)(=O)c1cccc(Cl)c1Cl ZINC000088780515 927193278 /nfs/dbraw/zinc/19/32/78/927193278.db2.gz JBDWGOBFXDKWFN-UHFFFAOYSA-N -1 3 363.266 3.585 20 0 FHADHM Cc1c2ccccc2oc1C(=O)N=c1cc2ccc(Br)cn2[n-]1 ZINC000430144814 927296928 /nfs/dbraw/zinc/29/69/28/927296928.db2.gz HQRFLGOFNHOYFA-UHFFFAOYSA-N -1 3 370.206 3.826 20 0 FHADHM O=C(c1ccc(O)cc1[O-])N1CCC[C@H](c2nc(C(F)(F)F)cs2)C1 ZINC000153908221 937151311 /nfs/dbraw/zinc/15/13/11/937151311.db2.gz XPNGQVDRJWEUCN-VIFPVBQESA-N -1 3 372.368 3.593 20 0 FHADHM COc1cc(/C=C(/C(=O)[N-]O[C@@H]2CCCCO2)c2ccccc2)ccc1O ZINC000274646986 927324053 /nfs/dbraw/zinc/32/40/53/927324053.db2.gz GKQAMRLOJLCORX-XMJIKXADSA-N -1 3 369.417 3.516 20 0 FHADHM CC[C@@H]([N-]S(=O)(=O)c1cc(Cl)ccc1C(F)(F)F)[C@H]1CCCO1 ZINC000510047542 927404910 /nfs/dbraw/zinc/40/49/10/927404910.db2.gz AGQLRDBVZJBJIU-VXGBXAGGSA-N -1 3 371.808 3.595 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355.438 3.510 20 0 FHADHM O=C([O-])c1ccc(OCCN2CCC([C@@H]3CCCCO3)CC2)c(Cl)c1 ZINC000656767963 932405169 /nfs/dbraw/zinc/40/51/69/932405169.db2.gz IMKSDWKOVQLLIJ-KRWDZBQOSA-N -1 3 367.873 3.698 20 0 FHADHM C[C@H](NCc1nc2c3ccccc3oc2c(=O)[n-]1)c1nc2c(s1)CCC2 ZINC000656798682 932436165 /nfs/dbraw/zinc/43/61/65/932436165.db2.gz GAAVQLDFXRGHTQ-JTQLQIEISA-N -1 3 366.446 3.878 20 0 FHADHM CCOc1cc([C@H]2NC(=O)c3cc(Cl)ccc3N2)cc(Cl)c1[O-] ZINC000121438926 932512382 /nfs/dbraw/zinc/51/23/82/932512382.db2.gz HDBBAGMKOKCPGE-OAHLLOKOSA-N -1 3 353.205 3.952 20 0 FHADHM O=C([N-]c1cccc([N+](=O)[O-])c1Cl)c1cc(F)c([N+](=O)[O-])cc1F ZINC000326294080 932539394 /nfs/dbraw/zinc/53/93/94/932539394.db2.gz CKJLCKCBFSBORI-UHFFFAOYSA-N -1 3 357.656 3.687 20 0 FHADHM COc1ccc(Nc2nc(C(=O)[N-]c3nnc(C4CC4)s3)cs2)cc1 ZINC000155198553 932573734 /nfs/dbraw/zinc/57/37/34/932573734.db2.gz DAAOLEGFEUFOFE-UHFFFAOYSA-N -1 3 373.463 3.877 20 0 FHADHM O=S(=O)([N-]c1cc2c(cc1Cl)OCCCO2)c1ccccc1Cl ZINC000071814385 932574182 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ZINC000514993270 943438836 /nfs/dbraw/zinc/43/88/36/943438836.db2.gz QRQHQWAGXQICCD-MRXNPFEDSA-N -1 3 361.463 3.779 20 0 FHADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)c3ccc(Cl)c(F)c3)c2)n1 ZINC000162373249 943494598 /nfs/dbraw/zinc/49/45/98/943494598.db2.gz YHBKEKKGFXAKAV-UHFFFAOYSA-N -1 3 358.756 3.757 20 0 FHADHM O=C(N=c1cc(-c2ccccc2)[n-][nH]1)c1cnn(-c2ccccc2)c1C1CC1 ZINC000435674220 943553101 /nfs/dbraw/zinc/55/31/01/943553101.db2.gz FMFCGBBNCNGLPQ-UHFFFAOYSA-N -1 3 369.428 3.814 20 0 FHADHM Cc1ccnc2c1cccc2S(=O)(=O)[N-]c1cc2cn[nH]c2cc1C ZINC000515194393 943558913 /nfs/dbraw/zinc/55/89/13/943558913.db2.gz ZYBBNYHGCTZHOG-UHFFFAOYSA-N -1 3 352.419 3.529 20 0 FHADHM O=C([O-])COc1ccc(CCNCc2csc(Cl)c2Cl)cc1 ZINC000417534374 943666979 /nfs/dbraw/zinc/66/69/79/943666979.db2.gz OEROZJKEXZMALZ-UHFFFAOYSA-N -1 3 360.262 3.851 20 0 FHADHM O=C([O-])COc1ccc(CCNCc2cc(Cl)sc2Cl)cc1 ZINC000417541084 943679971 /nfs/dbraw/zinc/67/99/71/943679971.db2.gz XTLFOHXNZUKCCV-UHFFFAOYSA-N -1 3 360.262 3.851 20 0 FHADHM CC(C)c1cnc(CNC[C@H](Cc2ccccc2Cl)C(=O)[O-])s1 ZINC000417550648 943697321 /nfs/dbraw/zinc/69/73/21/943697321.db2.gz WHXUWNJUQLIVBI-ZDUSSCGKSA-N -1 3 352.887 3.953 20 0 FHADHM COc1ccc([C@@H](CC(=O)[O-])NCc2cc(C)cc(Cl)c2)cc1OC ZINC000417556578 943703566 /nfs/dbraw/zinc/70/35/66/943703566.db2.gz OUIYEYNXXPAHHS-MRXNPFEDSA-N -1 3 363.841 3.971 20 0 FHADHM CC(C)(C)OC(=O)c1cccc(CN[C@@H](C(=O)[O-])c2cccc(F)c2)c1 ZINC000417557681 943704570 /nfs/dbraw/zinc/70/45/70/943704570.db2.gz SCUBDKDDSYUYFQ-QGZVFWFLSA-N -1 3 359.397 3.697 20 0 FHADHM CCC(=O)c1ccc(C(=O)Oc2cccc(-c3nc(C)cc(=O)[n-]3)c2)cc1 ZINC000783391687 943712090 /nfs/dbraw/zinc/71/20/90/943712090.db2.gz ARHVQTPJNXOBNG-UHFFFAOYSA-N -1 3 362.385 3.970 20 0 FHADHM CC(C)Cn1cc(CN[C@]2(C(=O)[O-])C[C@@H](C(C)C)c3ccccc32)cn1 ZINC000417587639 943735322 /nfs/dbraw/zinc/73/53/22/943735322.db2.gz ODQXHGBACKRPAY-GHTZIAJQSA-N -1 3 355.482 3.752 20 0 FHADHM Cc1nn(C(C)C)cc1CN[C@]1(C(=O)[O-])C[C@H](C(C)C)c2ccccc21 ZINC000417594652 943740774 /nfs/dbraw/zinc/74/07/74/943740774.db2.gz WOWJKOIDXISSJG-WIYYLYMNSA-N -1 3 355.482 3.985 20 0 FHADHM CC(C)[C@@H]1C[C@](NCc2cnc(C3CC3)nc2)(C(=O)[O-])c2ccccc21 ZINC000417594092 943740879 /nfs/dbraw/zinc/74/08/79/943740879.db2.gz VRNDLYBVSWNPLA-LAUBAEHRSA-N -1 3 351.450 3.567 20 0 FHADHM O=C([O-])C1(CNCc2csc(-c3ccc(C(F)(F)F)cc3)n2)CC1 ZINC000417618296 943754273 /nfs/dbraw/zinc/75/42/73/943754273.db2.gz XSHOBLJRZCJUOB-UHFFFAOYSA-N -1 3 356.369 3.783 20 0 FHADHM Cc1ccc(CNC[C@@H](CC(=O)[O-])C(F)(F)F)c(Br)c1 ZINC000417616515 943766556 /nfs/dbraw/zinc/76/65/56/943766556.db2.gz AXPLCEVAZAFZBW-SNVBAGLBSA-N -1 3 354.166 3.500 20 0 FHADHM COc1ccc(CN[C@H]2C[C@H](C(=O)[O-])c3ccccc32)c(OC(F)F)c1 ZINC000417629487 943767754 /nfs/dbraw/zinc/76/77/54/943767754.db2.gz QHZWHPSNJIBCIH-HOTGVXAUSA-N -1 3 363.360 3.699 20 0 FHADHM O=C([O-])[C@@H]1C[C@@H](NCc2ccccc2OC(F)(F)F)c2ccccc21 ZINC000417624892 943774791 /nfs/dbraw/zinc/77/47/91/943774791.db2.gz LJEDRFYHSDBDKU-HUUCEWRRSA-N -1 3 351.324 3.988 20 0 FHADHM CC(C)(C)c1nn(-c2ccccc2Cl)cc1CN[C@@H]1C=C[C@H](C(=O)[O-])C1 ZINC000417626544 943776612 /nfs/dbraw/zinc/77/66/12/943776612.db2.gz TWOVUTPOXWLUNS-DZGCQCFKSA-N -1 3 373.884 3.942 20 0 FHADHM CCCOc1cc(CN[C@H]2C[C@H](C(=O)[O-])c3ccccc32)ccc1OC ZINC000417628383 943778720 /nfs/dbraw/zinc/77/87/20/943778720.db2.gz WDBLTJQSLMYKSZ-ROUUACIJSA-N -1 3 355.434 3.887 20 0 FHADHM Cc1ccc(-n2cc(CN[C@@H]3C=C[C@@H](C(=O)[O-])C3)c(C(C)(C)C)n2)cc1 ZINC000417628773 943778954 /nfs/dbraw/zinc/77/89/54/943778954.db2.gz WQMFXAVAIHBCBB-NVXWUHKLSA-N -1 3 353.466 3.597 20 0 FHADHM CCOC(=O)c1ccc(NC(=O)CO[C@@H]2CCCc3ccccc32)c([O-])c1 ZINC000435805132 943781403 /nfs/dbraw/zinc/78/14/03/943781403.db2.gz WWFPQAIBUHLARQ-LJQANCHMSA-N -1 3 369.417 3.602 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)C1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000435881222 943815048 /nfs/dbraw/zinc/81/50/48/943815048.db2.gz OHEHOLJPAGZPMI-UHFFFAOYSA-N -1 3 373.338 3.556 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)C1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000435881222 943815052 /nfs/dbraw/zinc/81/50/52/943815052.db2.gz OHEHOLJPAGZPMI-UHFFFAOYSA-N -1 3 373.338 3.556 20 0 FHADHM Cc1cccc(-c2cnc(NC(=O)c3cc(F)cc4n[n-]nc43)s2)c1 ZINC000516988291 943892238 /nfs/dbraw/zinc/89/22/38/943892238.db2.gz PBLSYBPOQDOHRK-UHFFFAOYSA-N -1 3 353.382 3.781 20 0 FHADHM CCCOc1c(Cl)cc(CN2CCC[C@H](C)[C@@H]2C(=O)[O-])cc1OC ZINC000424414274 943911159 /nfs/dbraw/zinc/91/11/59/943911159.db2.gz HBQCWTIMYRDOKZ-BLLLJJGKSA-N -1 3 355.862 3.823 20 0 FHADHM CC(C)(C)c1cccc(OCCNC(=O)c2cc(=O)c3ccccc3[n-]2)c1 ZINC000505737269 943914372 /nfs/dbraw/zinc/91/43/72/943914372.db2.gz WLTMKEHUIGSTIJ-UHFFFAOYSA-N -1 3 364.445 3.634 20 0 FHADHM C[C@H]1C[C@]1(NC(=O)c1cc(=O)c2ccccc2[n-]1)c1ccc(Cl)cc1 ZINC000505743362 943933086 /nfs/dbraw/zinc/93/30/86/943933086.db2.gz GNANGWUDUGZLMG-FKIZINRSSA-N -1 3 352.821 3.847 20 0 FHADHM O=C(c1cc(=O)c2ccccc2[n-]1)N(CCc1cccc(F)c1)C1CC1 ZINC000505742906 943954180 /nfs/dbraw/zinc/95/41/80/943954180.db2.gz YFCVJVZYCCQXOI-UHFFFAOYSA-N -1 3 350.393 3.515 20 0 FHADHM Cc1ccc([N-]S(=O)(=O)c2cnc(-c3ccccc3)nc2)c(Cl)c1 ZINC000436017387 943954793 /nfs/dbraw/zinc/95/47/93/943954793.db2.gz PNNBZMFMGUTOOV-UHFFFAOYSA-N -1 3 359.838 3.906 20 0 FHADHM NC(=O)[C@@H]1CCC2(C1)CCN(Cc1cc(Cl)c([O-])c(Cl)c1)CC2 ZINC001280029919 943956947 /nfs/dbraw/zinc/95/69/47/943956947.db2.gz CYPHBAJMCMZWKS-GFCCVEGCSA-N -1 3 357.281 3.567 20 0 FHADHM C[C@@H]1CCC[C@H]1[N-]S(=O)(=O)c1cc(Br)ccc1Cl ZINC000517084335 943978886 /nfs/dbraw/zinc/97/88/86/943978886.db2.gz LPRLTVSMVCJXML-LDYMZIIASA-N -1 3 352.681 3.569 20 0 FHADHM O=C([O-])[C@H]1CCO[C@@H]1CNCc1ccc(-c2cccc(Cl)c2Cl)o1 ZINC000424631063 944020463 /nfs/dbraw/zinc/02/04/63/944020463.db2.gz ZQGOMWQLSYGAMH-SWLSCSKDSA-N -1 3 370.232 3.833 20 0 FHADHM O=C(c1cc(F)cc2n[n-]nc21)N1C[C@@H](c2ccccc2)c2ccccc21 ZINC000505132796 944061328 /nfs/dbraw/zinc/06/13/28/944061328.db2.gz DQIIDXGRKKFRCT-KRWDZBQOSA-N -1 3 358.376 3.889 20 0 FHADHM CC(C)[C@H](C(=O)NCc1ccc([O-])c(Br)c1)c1cccnc1 ZINC000436186354 944080595 /nfs/dbraw/zinc/08/05/95/944080595.db2.gz NQJAPAMDBDCMFE-INIZCTEOSA-N -1 3 363.255 3.606 20 0 FHADHM C[C@]1(NC(=O)c2cc(F)c([O-])c(Cl)c2)CCN(Cc2ccccc2)C1 ZINC000515663465 944106878 /nfs/dbraw/zinc/10/68/78/944106878.db2.gz DALSTDLUTUAORZ-IBGZPJMESA-N -1 3 362.832 3.579 20 0 FHADHM O=C(c1c[n-]c2ccccc2c1=O)N1CC=C(c2c(F)cccc2F)CC1 ZINC000364276388 944208474 /nfs/dbraw/zinc/20/84/74/944208474.db2.gz ZIGFCKWHWJBLOL-UHFFFAOYSA-N -1 3 366.367 3.736 20 0 FHADHM CC(C)[C@@H]1CCCN(C(=O)NCc2ccc([O-])c(Br)c2)C1 ZINC000436386789 944255813 /nfs/dbraw/zinc/25/58/13/944255813.db2.gz KLWGUOWXSVIZEN-CYBMUJFWSA-N -1 3 355.276 3.732 20 0 FHADHM COc1cccc(C=C2CCN(Cc3cc(=O)[n-]c(C4CC4)n3)CC2)c1 ZINC000518330051 944278069 /nfs/dbraw/zinc/27/80/69/944278069.db2.gz SRLDBYJFIXHXEB-UHFFFAOYSA-N -1 3 351.450 3.748 20 0 FHADHM COc1ccc(SCCCC(=O)Nc2n[n-]c(-c3ccco3)n2)cc1 ZINC000436419885 944293052 /nfs/dbraw/zinc/29/30/52/944293052.db2.gz ZLBLVBJBKPYRIV-UHFFFAOYSA-N -1 3 358.423 3.584 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)c1cc(-c2ccc(Cl)cc2)c[nH]1 ZINC000425942171 944298916 /nfs/dbraw/zinc/29/89/16/944298916.db2.gz DTLTYXKQVBEPEX-UHFFFAOYSA-N -1 3 364.796 3.768 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)c1cc(-c2ccc(Cl)cc2)c[nH]1 ZINC000425942171 944298925 /nfs/dbraw/zinc/29/89/25/944298925.db2.gz DTLTYXKQVBEPEX-UHFFFAOYSA-N -1 3 364.796 3.768 20 0 FHADHM CC(=O)N1CCc2cc(S(=O)(=O)[N-]c3ccc(C4CCC4)cc3)ccc21 ZINC000517495571 944342969 /nfs/dbraw/zinc/34/29/69/944342969.db2.gz YGARXHAVJMQQOX-UHFFFAOYSA-N -1 3 370.474 3.664 20 0 FHADHM CN(Cc1ccco1)Cc1ccccc1CNC(=O)c1c([O-])cccc1F ZINC000436508596 944378908 /nfs/dbraw/zinc/37/89/08/944378908.db2.gz CMPUHGLWIOZLEB-UHFFFAOYSA-N -1 3 368.408 3.686 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N[C@@]2(c3ccc(Cl)cc3)C[C@H]2C)c1 ZINC000436509662 944379544 /nfs/dbraw/zinc/37/95/44/944379544.db2.gz SDSVXXYHNMGLCK-WYRIXSBYSA-N -1 3 358.825 3.669 20 0 FHADHM CCCCOc1ccc([C@H](C)NC(=O)c2ccc(O)cc2[O-])cc1OC ZINC000436511983 944383265 /nfs/dbraw/zinc/38/32/65/944383265.db2.gz IYYKEXOKBYWHFF-ZDUSSCGKSA-N -1 3 359.422 3.776 20 0 FHADHM CC1(C)Cc2ccc(C(=O)Nc3ccc(-c4cncnc4)cc3)c([O-])c2O1 ZINC000436526383 944394612 /nfs/dbraw/zinc/39/46/12/944394612.db2.gz DMJDVIAKRBVGBB-UHFFFAOYSA-N -1 3 361.401 3.815 20 0 FHADHM CC(=O)c1ccc(C(=O)Nc2ccc(NC(=O)CC(C)C)cc2)cc1[O-] ZINC000436528386 944395990 /nfs/dbraw/zinc/39/59/90/944395990.db2.gz XCEFGHPNZFAGHW-UHFFFAOYSA-N -1 3 354.406 3.832 20 0 FHADHM CNC(=O)c1cc(NC(=O)c2cc3c(cc2[O-])CCCC3)ccc1Cl ZINC000436535217 944402415 /nfs/dbraw/zinc/40/24/15/944402415.db2.gz QVSWNZBFETWGRE-UHFFFAOYSA-N -1 3 358.825 3.536 20 0 FHADHM CC(C)c1ccc(C(=O)NC[C@H]2CCN(c3ccc(F)cc3)C2)c([O-])c1 ZINC000436537654 944415637 /nfs/dbraw/zinc/41/56/37/944415637.db2.gz SMJQXLPHNMZSQO-OAHLLOKOSA-N -1 3 356.441 3.911 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2C)c([O-])c1C ZINC000436539924 944417074 /nfs/dbraw/zinc/41/70/74/944417074.db2.gz WYXLZAKSNUDENV-UHFFFAOYSA-N -1 3 352.434 3.806 20 0 FHADHM Cc1nc2c(cccc2C(=O)Nc2nnc(-c3cc4ccccc4o3)[n-]2)o1 ZINC000473774469 944417854 /nfs/dbraw/zinc/41/78/54/944417854.db2.gz HSMWTPLZENIIQH-UHFFFAOYSA-N -1 3 359.345 3.920 20 0 FHADHM Cc1nc2c(cccc2C(=O)Nc2n[n-]c(-c3cc4ccccc4o3)n2)o1 ZINC000473774469 944417863 /nfs/dbraw/zinc/41/78/63/944417863.db2.gz HSMWTPLZENIIQH-UHFFFAOYSA-N -1 3 359.345 3.920 20 0 FHADHM CCOC(=O)[C@H]1CCCCN1C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436542896 944420058 /nfs/dbraw/zinc/42/00/58/944420058.db2.gz JEWYUPOTEICNNQ-LJQANCHMSA-N -1 3 367.445 3.541 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(CCC(=O)N3CCCC3)cc2)c([O-])c1C ZINC000436544871 944421824 /nfs/dbraw/zinc/42/18/24/944421824.db2.gz LEOTUYPVUJQAOL-UHFFFAOYSA-N -1 3 366.461 3.816 20 0 FHADHM Cc1ccc(C(=O)NC2CC2)cc1NC(=O)c1cc2c(cc1[O-])CCCC2 ZINC000436560097 944427236 /nfs/dbraw/zinc/42/72/36/944427236.db2.gz DDVRLUVGHMOTGX-UHFFFAOYSA-N -1 3 364.445 3.724 20 0 FHADHM CC1(C)Cc2ccc(C(=O)Nc3ccc4c(c3)CCCC(=O)N4)c([O-])c2O1 ZINC000436569542 944433733 /nfs/dbraw/zinc/43/37/33/944433733.db2.gz FUUOIEJZLXHCJI-UHFFFAOYSA-N -1 3 366.417 3.633 20 0 FHADHM Cc1ccc2c(C)cc(N3CCN(C(=O)c4ccccc4[O-])CC3)nc2c1 ZINC000436595641 944440190 /nfs/dbraw/zinc/44/01/90/944440190.db2.gz NDWJUZXXHKVCNQ-UHFFFAOYSA-N -1 3 361.445 3.520 20 0 FHADHM CSCC[C@H](O)C(=O)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000436599037 944441839 /nfs/dbraw/zinc/44/18/39/944441839.db2.gz BSDKGLVXBXVCPY-HNNXBMFYSA-N -1 3 374.487 3.721 20 0 FHADHM CC(C)c1ccc(C(=O)NCCc2nnc(-c3ccccc3)o2)c([O-])c1 ZINC000436582291 944446200 /nfs/dbraw/zinc/44/62/00/944446200.db2.gz HZHFKOFNAUUAPJ-UHFFFAOYSA-N -1 3 351.406 3.538 20 0 FHADHM Cc1nn(C)c(C)c1[C@@H](NC(=O)c1ccc(C(C)C)cc1[O-])C(F)(F)F ZINC000436584120 944447982 /nfs/dbraw/zinc/44/79/82/944447982.db2.gz GINUIALDQZGPJS-MRXNPFEDSA-N -1 3 369.387 3.899 20 0 FHADHM Cc1ccc(C(=O)N(CC(=O)OC(C)(C)C)c2ccccc2)c([O-])c1C ZINC000436588166 944450839 /nfs/dbraw/zinc/45/08/39/944450839.db2.gz HOXJAXKBZPKVLH-UHFFFAOYSA-N -1 3 355.434 3.998 20 0 FHADHM Cc1ccc(C(=O)N2CCC(N3CCc4cc(F)ccc43)CC2)c([O-])c1 ZINC000436608763 944458694 /nfs/dbraw/zinc/45/86/94/944458694.db2.gz KQXYZTBSIREYMI-UHFFFAOYSA-N -1 3 354.425 3.507 20 0 FHADHM CC(=O)c1ccc(C(=O)N2CCC(COc3ccccc3)CC2)cc1[O-] ZINC000436611554 944461165 /nfs/dbraw/zinc/46/11/65/944461165.db2.gz WPZYDLRJCQYIQQ-UHFFFAOYSA-N -1 3 353.418 3.526 20 0 FHADHM CCOC(=O)CC(C)(C)N(C)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436615181 944463539 /nfs/dbraw/zinc/46/35/39/944463539.db2.gz CSEFPHPIIBBKAQ-UHFFFAOYSA-N -1 3 369.461 3.787 20 0 FHADHM CC(C)c1ccc(C(=O)N[C@H](C)c2ccc(-n3cncn3)cc2)c([O-])c1 ZINC000436637792 944476281 /nfs/dbraw/zinc/47/62/81/944476281.db2.gz YGIWNVZRILOONL-CQSZACIVSA-N -1 3 350.422 3.587 20 0 FHADHM CC(C)(C)[C@H]1CCCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2[O-])CC1 ZINC000436623567 944479798 /nfs/dbraw/zinc/47/97/98/944479798.db2.gz HAUPFBVHFUYPSE-FUHWJXTLSA-N -1 3 372.509 3.672 20 0 FHADHM CCOc1ccc([C@@H]2CCCN2C(=O)c2cc(OC)c([O-])c(OC)c2)cc1 ZINC000436642233 944490905 /nfs/dbraw/zinc/49/09/05/944490905.db2.gz ZZETYAYECVPXMR-KRWDZBQOSA-N -1 3 371.433 3.785 20 0 FHADHM O=c1[n-]c(CN2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)nc2c3ccccc3oc21 ZINC000519569453 944499460 /nfs/dbraw/zinc/49/94/60/944499460.db2.gz RAYZAKVAYLTJEV-KXBFYZLASA-N -1 3 365.433 3.615 20 0 FHADHM CC(C)c1ccc(C(=O)N2CCN(Cc3cccc(F)c3)CC2)c([O-])c1 ZINC000436674761 944508373 /nfs/dbraw/zinc/50/83/73/944508373.db2.gz JAVKCZVDBIIPIJ-UHFFFAOYSA-N -1 3 356.441 3.613 20 0 FHADHM O=C(N[C@@H]1CCO[C@@H](C2CC2)C1)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436657491 944508957 /nfs/dbraw/zinc/50/89/57/944508957.db2.gz QWKNKJUDTDUIJD-FOIQADDNSA-N -1 3 353.418 3.872 20 0 FHADHM CC(C)c1ccc(C(=O)N2CCN[C@@H](c3cccc(Cl)c3)C2)c([O-])c1 ZINC000436659005 944509038 /nfs/dbraw/zinc/50/90/38/944509038.db2.gz NHZMVEQMONFWPL-GOSISDBHSA-N -1 3 358.869 3.956 20 0 FHADHM O=C(Nc1ccc2c(c1)N(CC(F)F)CCS2)c1c([O-])cccc1O ZINC000436660162 944511813 /nfs/dbraw/zinc/51/18/13/944511813.db2.gz BSIQRQMVAAXLIG-UHFFFAOYSA-N -1 3 366.389 3.527 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N2C[C@H](C)CC[C@@H]2c2ccccc2)c1 ZINC000436661642 944512294 /nfs/dbraw/zinc/51/22/94/944512294.db2.gz ZHVFMXITPFXPAC-AUUYWEPGSA-N -1 3 352.434 3.964 20 0 FHADHM COc1cc(-c2nc(Cc3c(C)cc(C)cc3C)no2)cc(OC)c1[O-] ZINC000436688435 944526594 /nfs/dbraw/zinc/52/65/94/944526594.db2.gz KXJXVVZWDBJZMI-UHFFFAOYSA-N -1 3 354.406 3.975 20 0 FHADHM COc1cc(-c2nc(Cc3cccc4cccnc43)no2)cc(OC)c1[O-] ZINC000436691445 944531249 /nfs/dbraw/zinc/53/12/49/944531249.db2.gz SMXGAMLUIZECRF-UHFFFAOYSA-N -1 3 363.373 3.598 20 0 FHADHM C[C@H](C(=O)NC(C)(C)C)N(C)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436708640 944531949 /nfs/dbraw/zinc/53/19/49/944531949.db2.gz SNGUWKCBJHDTMV-CQSZACIVSA-N -1 3 370.449 3.560 20 0 FHADHM CCCc1noc2nc(-c3ccco3)cc(C(=O)[N-]c3nncs3)c12 ZINC000518611557 944534053 /nfs/dbraw/zinc/53/40/53/944534053.db2.gz PUHVSOLDAJZJDF-UHFFFAOYSA-N -1 3 355.379 3.539 20 0 FHADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1CCOC[C@@H]1CC(F)F ZINC000436696646 944536425 /nfs/dbraw/zinc/53/64/25/944536425.db2.gz JZUCZEWYPZGZBE-ZDUSSCGKSA-N -1 3 363.360 3.681 20 0 FHADHM CCc1ccc([C@@H]2CCCN(C(=O)c3cc(NC(C)=O)ccc3[O-])C2)cc1 ZINC000436699870 944538624 /nfs/dbraw/zinc/53/86/24/944538624.db2.gz WLNHJVWGKPLMRG-GOSISDBHSA-N -1 3 366.461 3.933 20 0 FHADHM CCC(C)(C)NC(=O)c1ccc(NC(=O)c2cc(OC)ccc2[O-])cc1 ZINC000436723453 944562825 /nfs/dbraw/zinc/56/28/25/944562825.db2.gz UPONASZUYRCSDC-UHFFFAOYSA-N -1 3 356.422 3.572 20 0 FHADHM CC[C@H](C)c1nc([C@H](C)NC(=O)c2ccc(C(F)(F)F)cc2[O-])n[nH]1 ZINC000436737476 944567482 /nfs/dbraw/zinc/56/74/82/944567482.db2.gz KZWSBFGZTIFODB-IUCAKERBSA-N -1 3 356.348 3.534 20 0 FHADHM CN1CCN(C(=O)c2cc3ccccc3cc2[O-])C[C@@H]1Cc1ccccc1 ZINC000436729100 944575178 /nfs/dbraw/zinc/57/51/78/944575178.db2.gz FJUPMFAXFYNAEP-FQEVSTJZSA-N -1 3 360.457 3.544 20 0 FHADHM CCN(C(=O)c1cc2c(cc1[O-])CCCC2)c1ccc(OC)c(OC)c1 ZINC000436759538 944582442 /nfs/dbraw/zinc/58/24/42/944582442.db2.gz ZQOKDZJBOHRQPB-UHFFFAOYSA-N -1 3 355.434 3.955 20 0 FHADHM O=C(NCc1ncccc1[O-])Nc1ccc(F)cc1OCCC(F)(F)F ZINC000505876747 944584955 /nfs/dbraw/zinc/58/49/55/944584955.db2.gz GNQXVECOTBOWJG-UHFFFAOYSA-N -1 3 373.306 3.579 20 0 FHADHM COc1ccc(C(=O)N[C@@H](C)Cc2cccc(Br)c2)c([O-])c1 ZINC000436762572 944584965 /nfs/dbraw/zinc/58/49/65/944584965.db2.gz CKNFKJZMJTYJTP-NSHDSACASA-N -1 3 364.239 3.524 20 0 FHADHM CC(=O)c1cccc(NC(=O)c2cn(-c3ccc(Cl)cc3)nc2C)c1[O-] ZINC000517766393 944585387 /nfs/dbraw/zinc/58/53/87/944585387.db2.gz ROADJRJTUNKCIB-UHFFFAOYSA-N -1 3 369.808 3.995 20 0 FHADHM CC(C)c1ccc(C(=O)N[C@H](c2nccn2C)c2ccc(F)cc2)c([O-])c1 ZINC000436753864 944594959 /nfs/dbraw/zinc/59/49/59/944594959.db2.gz FPFAWMQEWMBHDH-IBGZPJMESA-N -1 3 367.424 3.908 20 0 FHADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N(CCO)Cc1ccccc1 ZINC000436757051 944599707 /nfs/dbraw/zinc/59/97/07/944599707.db2.gz GBKOTZZQRNRHMT-UHFFFAOYSA-N -1 3 363.413 3.819 20 0 FHADHM O=C(NCc1ccc(-c2nc3ccccc3s2)o1)c1ccc(O)cc1[O-] ZINC000436777596 944608356 /nfs/dbraw/zinc/60/83/56/944608356.db2.gz ZMLLQBYLRURHKC-UHFFFAOYSA-N -1 3 366.398 3.898 20 0 FHADHM CC(=O)C1(C(=O)Nc2ccc([O-])c(-c3nc4ccccc4s3)c2)CC1 ZINC000436778910 944609684 /nfs/dbraw/zinc/60/96/84/944609684.db2.gz SLUWKDBJJLUCDG-UHFFFAOYSA-N -1 3 352.415 3.977 20 0 FHADHM CC[C@@H]1CN(C(=O)c2cc(CCc3ccccc3)ccc2[O-])CCCO1 ZINC000436780676 944611732 /nfs/dbraw/zinc/61/17/32/944611732.db2.gz FSUQDDCXLOMMAT-LJQANCHMSA-N -1 3 353.462 3.819 20 0 FHADHM COc1ccc([C@@H](CNC(=O)c2ccc(Cl)cc2[O-])N2CCCC2)cc1 ZINC000436767256 944619088 /nfs/dbraw/zinc/61/90/88/944619088.db2.gz UIWXVRIJCVARGK-GOSISDBHSA-N -1 3 374.868 3.621 20 0 FHADHM CCOc1cc(C=Cc2nc(C)cc(=O)[n-]2)cc(Br)c1O ZINC000436785519 944632976 /nfs/dbraw/zinc/63/29/76/944632976.db2.gz UTYJDXCXIRZSTG-SNAWJCMRSA-N -1 3 351.200 3.528 20 0 FHADHM CCCN(C(=O)c1cc(NC(C)=O)ccc1[O-])[C@H]1CCc2ccccc21 ZINC000436786653 944633896 /nfs/dbraw/zinc/63/38/96/944633896.db2.gz KDDYYZBTQGWLDV-IBGZPJMESA-N -1 3 352.434 3.890 20 0 FHADHM CC(C)c1ccc(SCC(=O)Nc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000615346197 944639257 /nfs/dbraw/zinc/63/92/57/944639257.db2.gz XUJJLCKLPKJPEO-UHFFFAOYSA-N -1 3 353.451 3.721 20 0 FHADHM CC(C)c1ccc(SCC(=O)Nc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000615346197 944639262 /nfs/dbraw/zinc/63/92/62/944639262.db2.gz XUJJLCKLPKJPEO-UHFFFAOYSA-N -1 3 353.451 3.721 20 0 FHADHM O=C(CCSCc1ccccn1)Nc1ccc(Br)cc1[O-] ZINC000516256804 944646929 /nfs/dbraw/zinc/64/69/29/944646929.db2.gz IZRMDVJZUXRWCE-UHFFFAOYSA-N -1 3 367.268 3.812 20 0 FHADHM C[C@@H]1C[C@@H](CC(=O)N2CCN(C(=O)c3ccccc3[O-])CC2)CC(C)(C)C1 ZINC000436795636 944648314 /nfs/dbraw/zinc/64/83/14/944648314.db2.gz ZRDUJFHSDDQERU-SJORKVTESA-N -1 3 372.509 3.529 20 0 FHADHM CC(C)[C@H]1CN(C(=O)c2cc(Cc3ccccc3)ccc2[O-])CCCO1 ZINC000436815639 944651446 /nfs/dbraw/zinc/65/14/46/944651446.db2.gz PCMJWPYCVRYIPY-OAQYLSRUSA-N -1 3 353.462 3.870 20 0 FHADHM C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)N=c1cc([C@H]2CCCO2)[n-][nH]1 ZINC000473846783 944663598 /nfs/dbraw/zinc/66/35/98/944663598.db2.gz AKXLZACLBKNTGN-XHDPSFHLSA-N -1 3 367.371 3.519 20 0 FHADHM C[C@H](O)C[C@H]1CCCCN1C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436807327 944663820 /nfs/dbraw/zinc/66/38/20/944663820.db2.gz XNQADXWIJHJKDP-QFBILLFUSA-N -1 3 353.462 3.749 20 0 FHADHM C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)N=c1cc([C@@H]2CCCO2)[n-][nH]1 ZINC000473846782 944663870 /nfs/dbraw/zinc/66/38/70/944663870.db2.gz AKXLZACLBKNTGN-NHYWBVRUSA-N -1 3 367.371 3.519 20 0 FHADHM Cc1ccc(C(=O)NC2CCN(c3nc4ccccc4s3)CC2)c([O-])c1 ZINC000436808406 944664919 /nfs/dbraw/zinc/66/49/19/944664919.db2.gz KVKGVBYVERBSIR-UHFFFAOYSA-N -1 3 367.474 3.709 20 0 FHADHM O=C(CCCc1cccc(C(F)(F)F)c1)N=c1cc([C@@H]2CCCO2)[n-][nH]1 ZINC000473847093 944672182 /nfs/dbraw/zinc/67/21/82/944672182.db2.gz BFSQENOUNOQAIB-HNNXBMFYSA-N -1 3 367.371 3.663 20 0 FHADHM O=C(N=c1cc([C@@H]2CCCO2)[n-][nH]1)c1csc(-c2cccc(Cl)c2)n1 ZINC000473848178 944673709 /nfs/dbraw/zinc/67/37/09/944673709.db2.gz HGVGNVUPPVMFKD-AWEZNQCLSA-N -1 3 374.853 3.712 20 0 FHADHM COc1cccc([C@H]2C[C@@H](C)CN2C(=O)c2cc(NC(C)=O)ccc2[O-])c1 ZINC000436829478 944677320 /nfs/dbraw/zinc/67/73/20/944677320.db2.gz BFQUEBVXXHBISS-BFUOFWGJSA-N -1 3 368.433 3.583 20 0 FHADHM O=C([O-])C[C@H](NCc1ccc(F)c(Br)c1)c1ccsc1 ZINC000426685629 944685471 /nfs/dbraw/zinc/68/54/71/944685471.db2.gz JFGCZJQZDDXFON-ZDUSSCGKSA-N -1 3 358.232 3.955 20 0 FHADHM COc1ccc(CN[C@H](C(=O)[O-])c2ccc(C)cc2)cc1OCC(C)C ZINC000426686859 944686847 /nfs/dbraw/zinc/68/68/47/944686847.db2.gz OOPSKKYPQWSCEZ-FQEVSTJZSA-N -1 3 357.450 3.954 20 0 FHADHM CCc1ccc(C(=O)Nc2cccc(C(=O)Nc3ccccn3)c2)c([O-])c1 ZINC000436821844 944690908 /nfs/dbraw/zinc/69/09/08/944690908.db2.gz QNEBUWLFYWAUAP-UHFFFAOYSA-N -1 3 361.401 3.854 20 0 FHADHM CC(C)[C@@H](CC(=O)N(C)c1ccc(-c2nnn[n-]2)cc1F)c1ccccc1 ZINC000735708702 944694081 /nfs/dbraw/zinc/69/40/81/944694081.db2.gz NSEIEVRVOIUTOR-MRXNPFEDSA-N -1 3 367.428 3.799 20 0 FHADHM CC(C)[C@@H](CC(=O)N(C)c1ccc(-c2nn[n-]n2)cc1F)c1ccccc1 ZINC000735708702 944694089 /nfs/dbraw/zinc/69/40/89/944694089.db2.gz NSEIEVRVOIUTOR-MRXNPFEDSA-N -1 3 367.428 3.799 20 0 FHADHM CCc1ccc(C(=O)NC[C@@H](C)c2nc(-c3ccccc3)no2)c([O-])c1 ZINC000436826858 944697785 /nfs/dbraw/zinc/69/77/85/944697785.db2.gz BSOUARJCRVROFF-CYBMUJFWSA-N -1 3 351.406 3.538 20 0 FHADHM O=C([O-])[C@H](CNCc1ccn(-c2ccccc2)n1)Cc1cccc(Cl)c1 ZINC000426699294 944700368 /nfs/dbraw/zinc/70/03/68/944700368.db2.gz HRJOEJTVUPXEDA-INIZCTEOSA-N -1 3 369.852 3.559 20 0 FHADHM CCc1ccc(C(=O)N(Cc2ccc(OC)cc2)[C@H](CO)C(C)C)c([O-])c1 ZINC000436843355 944711350 /nfs/dbraw/zinc/71/13/50/944711350.db2.gz GYHJLMADOFDPFQ-HXUWFJFHSA-N -1 3 371.477 3.623 20 0 FHADHM O=C([O-])C[C@H](NCc1ccc(OCC(F)(F)F)cc1)c1ccsc1 ZINC000426692829 944712018 /nfs/dbraw/zinc/71/20/18/944712018.db2.gz AQBFYZHARFDZGC-AWEZNQCLSA-N -1 3 359.369 3.995 20 0 FHADHM CC(C)c1ccc2c(c1)[C@H](NC(=O)Nc1ccc3c(c1)C(=O)[N-]C3=O)CC2 ZINC000426044313 944719674 /nfs/dbraw/zinc/71/96/74/944719674.db2.gz KZOSUCSGFFZLEP-GOSISDBHSA-N -1 3 363.417 3.503 20 0 FHADHM Cc1ccc(CS(=O)(=O)[N-]c2c(F)c(F)c(F)c(F)c2F)c(F)c1 ZINC000194663441 944720299 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C[C@H](C(=O)[O-])[C@H](NCc1cc(Cl)c2c(c1)OCCO2)c1ccccc1 ZINC000426751186 944770633 /nfs/dbraw/zinc/77/06/33/944770633.db2.gz UASKMIVXXYQESA-SJCJKPOMSA-N -1 3 361.825 3.663 20 0 FHADHM C[C@@]1(C(=O)[O-])CCCC[C@@H]1NCc1csc(COc2ccccc2)n1 ZINC000426752931 944772717 /nfs/dbraw/zinc/77/27/17/944772717.db2.gz GHBSSYLMTPOPED-QFBILLFUSA-N -1 3 360.479 3.845 20 0 FHADHM COc1ccccc1N1CC[C@H](CNC(=O)c2ccc(C(C)C)cc2[O-])C1 ZINC000436904573 944773656 /nfs/dbraw/zinc/77/36/56/944773656.db2.gz LWKXMOAREZCBKM-MRXNPFEDSA-N -1 3 368.477 3.781 20 0 FHADHM Cc1cc(C)cc([C@H](NCc2cnn(Cc3ccc(F)cc3)c2)C(=O)[O-])c1 ZINC000426753384 944774236 /nfs/dbraw/zinc/77/42/36/944774236.db2.gz IAWXNYVCZPTSGP-FQEVSTJZSA-N -1 3 367.424 3.603 20 0 FHADHM C[C@@H]1CCC[C@@H](C)N(C(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)C1 ZINC000736245117 944776231 /nfs/dbraw/zinc/77/62/31/944776231.db2.gz QTCLZANGJYCYRL-GHMZBOCLSA-N -1 3 364.906 3.727 20 0 FHADHM C[C@@H]1CCC[C@@H](C)N(C(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)C1 ZINC000736245117 944776238 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O=C(Nc1nc(-c2ccc([O-])c(Cl)c2)n[nH]1)c1ccc(Cl)s1 ZINC000436915800 944798305 /nfs/dbraw/zinc/79/83/05/944798305.db2.gz QIJQRNRDGUYHEL-UHFFFAOYSA-N -1 3 355.206 3.798 20 0 FHADHM COc1ccc([C@@H](CC(=O)[O-])NCc2ccc3ncccc3c2)cc1OC ZINC000426781369 944798710 /nfs/dbraw/zinc/79/87/10/944798710.db2.gz BOMNTCXFHCAWMS-GOSISDBHSA-N -1 3 366.417 3.558 20 0 FHADHM CC[C@H](CC(=O)N(C)c1ccc(-c2nnn[n-]2)cc1F)c1ccccc1 ZINC000736332460 944802054 /nfs/dbraw/zinc/80/20/54/944802054.db2.gz NHQTVOGQAJCYAF-CYBMUJFWSA-N -1 3 353.401 3.553 20 0 FHADHM CC[C@H](CC(=O)N(C)c1ccc(-c2nn[n-]n2)cc1F)c1ccccc1 ZINC000736332460 944802059 /nfs/dbraw/zinc/80/20/59/944802059.db2.gz NHQTVOGQAJCYAF-CYBMUJFWSA-N -1 3 353.401 3.553 20 0 FHADHM O=C([O-])[C@H](NCc1cc(Cl)cc(C(F)(F)F)c1)c1ccc(O)cc1 ZINC000426786784 944811079 /nfs/dbraw/zinc/81/10/79/944811079.db2.gz YMTJONBLFZANMN-CQSZACIVSA-N -1 3 359.731 3.980 20 0 FHADHM COc1cc(C=Cc2cc(=O)[n-]c(C3CC3)n2)c(Br)cc1O ZINC000436926719 944812743 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C[C@@H](Sc1cc(Cl)ccc1Cl)C(=O)NCc1ncccc1[O-] ZINC000473647241 945722765 /nfs/dbraw/zinc/72/27/65/945722765.db2.gz ZIWVIKYYECMKCZ-SECBINFHSA-N -1 3 357.262 3.891 20 0 FHADHM Cc1ccc([N-]S(=O)(=O)c2ccc(F)cc2)cc1NC(=O)C(C)(C)C ZINC000110591979 945731350 /nfs/dbraw/zinc/73/13/50/945731350.db2.gz QIYVVOPKZDXXEC-UHFFFAOYSA-N -1 3 364.442 3.920 20 0 FHADHM CCCc1nc(C(=O)[N-]c2c(C)noc2C)nn1-c1ccccc1Cl ZINC000522743670 945737261 /nfs/dbraw/zinc/73/72/61/945737261.db2.gz BBGQYBJSQBHDQQ-UHFFFAOYSA-N -1 3 359.817 3.730 20 0 FHADHM CCc1noc(C)c1C[N-]S(=O)(=O)Cc1cc(Cl)sc1Cl ZINC000651717386 945759909 /nfs/dbraw/zinc/75/99/09/945759909.db2.gz CNTJIDOCCHEMQL-UHFFFAOYSA-N -1 3 369.295 3.533 20 0 FHADHM Cc1cc(Br)cc(S(=O)(=O)[N-]C2(C(F)(F)F)CCC2)c1 ZINC000444058260 945760728 /nfs/dbraw/zinc/76/07/28/945760728.db2.gz JBKFNZBRBAEVEV-UHFFFAOYSA-N -1 3 372.206 3.521 20 0 FHADHM O=C(COC(=O)c1ccc(C2CCCCC2)cc1)[N-]C(=O)c1cccs1 ZINC000007442825 945819727 /nfs/dbraw/zinc/81/97/27/945819727.db2.gz 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/nfs/dbraw/zinc/65/70/55/947657055.db2.gz SPWKWSURWCTNIY-UHFFFAOYSA-N -1 3 368.249 3.869 20 0 FHADHM CS/C=C/C(=O)N[C@@H](C)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000826226976 947667804 /nfs/dbraw/zinc/66/78/04/947667804.db2.gz JMJGAISYMXODFK-NHAQELONSA-N -1 3 365.462 3.588 20 0 FHADHM CS/C=C/C(=O)N[C@@H](C)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000826226976 947667810 /nfs/dbraw/zinc/66/78/10/947667810.db2.gz JMJGAISYMXODFK-NHAQELONSA-N -1 3 365.462 3.588 20 0 FHADHM Cc1ccccc1-c1cc(=NC(=O)[C@@H]2C[C@@H]2c2c(F)cccc2F)[nH][n-]1 ZINC000523871182 947682486 /nfs/dbraw/zinc/68/24/86/947682486.db2.gz YPCOWYVAJLLTLS-UONOGXRCSA-N -1 3 353.372 3.827 20 0 FHADHM CC(=CC(=O)Nc1ccc(OC(C)C)c(-c2nnn[n-]2)c1)c1cccs1 ZINC001573361497 947690479 /nfs/dbraw/zinc/69/04/79/947690479.db2.gz AAHMLCASYJFIIA-XFXZXTDPSA-N -1 3 369.450 3.757 20 0 FHADHM CC(=CC(=O)Nc1ccc(OC(C)C)c(-c2nn[n-]n2)c1)c1cccs1 ZINC001573361497 947690493 /nfs/dbraw/zinc/69/04/93/947690493.db2.gz AAHMLCASYJFIIA-XFXZXTDPSA-N -1 3 369.450 3.757 20 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/nfs/dbraw/zinc/72/97/10/947729710.db2.gz SOFTUXOGHZRKIB-NTMALXAHSA-N -1 3 357.776 3.701 20 0 FHADHM CC(=CC(=O)Nc1ccc(Cl)cc1-c1nn[n-]n1)c1ccc(F)cc1 ZINC001573365217 947729717 /nfs/dbraw/zinc/72/97/17/947729717.db2.gz SOFTUXOGHZRKIB-NTMALXAHSA-N -1 3 357.776 3.701 20 0 FHADHM CC(=Cc1ccco1)C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC001573365568 947731874 /nfs/dbraw/zinc/73/18/74/947731874.db2.gz MMSBQXADSWFELJ-VQHVLOKHSA-N -1 3 363.299 3.521 20 0 FHADHM CC(=Cc1ccco1)C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC001573365568 947731879 /nfs/dbraw/zinc/73/18/79/947731879.db2.gz MMSBQXADSWFELJ-VQHVLOKHSA-N -1 3 363.299 3.521 20 0 FHADHM Cc1ccc(C2CCN(c3ccc(-c4nnn[n-]4)c(Cl)c3)CC2)cn1 ZINC000826285788 947821881 /nfs/dbraw/zinc/82/18/81/947821881.db2.gz JSEIDQSRXAZKBG-UHFFFAOYSA-N -1 3 354.845 3.608 20 0 FHADHM Cc1ccc(C2CCN(c3ccc(-c4nn[n-]n4)c(Cl)c3)CC2)cn1 ZINC000826285788 947821888 /nfs/dbraw/zinc/82/18/88/947821888.db2.gz JSEIDQSRXAZKBG-UHFFFAOYSA-N -1 3 354.845 3.608 20 0 FHADHM Cc1ccc(CN(C(=O)c2ccc(-c3nnn[n-]3)cc2C)C2CC2)cc1C ZINC000826287435 947832887 /nfs/dbraw/zinc/83/28/87/947832887.db2.gz OURSTSQREPDVAC-UHFFFAOYSA-N -1 3 361.449 3.597 20 0 FHADHM Cc1ccc(CN(C(=O)c2ccc(-c3nn[n-]n3)cc2C)C2CC2)cc1C ZINC000826287435 947832894 /nfs/dbraw/zinc/83/28/94/947832894.db2.gz OURSTSQREPDVAC-UHFFFAOYSA-N -1 3 361.449 3.597 20 0 FHADHM Cc1ccc2nc(CSc3cccc(Cl)c3-c3nnn[n-]3)cn2c1 ZINC000826295599 947855691 /nfs/dbraw/zinc/85/56/91/947855691.db2.gz OQTYASIYLSXBQK-UHFFFAOYSA-N -1 3 356.842 3.769 20 0 FHADHM Cc1ccc2nc(CSc3cccc(Cl)c3-c3nn[n-]n3)cn2c1 ZINC000826295599 947855701 /nfs/dbraw/zinc/85/57/01/947855701.db2.gz OQTYASIYLSXBQK-UHFFFAOYSA-N -1 3 356.842 3.769 20 0 FHADHM CCCCOc1ccc(C(=O)N2CC[C@@H](Nc3ccccc3)C2)c([O-])c1 ZINC000190286215 947964124 /nfs/dbraw/zinc/96/41/24/947964124.db2.gz DNTDBOPMDSNUCM-QGZVFWFLSA-N -1 3 354.450 3.898 20 0 FHADHM CN(C)C(=O)c1cc(Nc2cccc([O-])c2Br)ccc1F ZINC001211865765 948012477 /nfs/dbraw/zinc/01/24/77/948012477.db2.gz BLFRMAVAJOOMOZ-UHFFFAOYSA-N -1 3 353.191 3.739 20 0 FHADHM Cc1n[nH]c(C)c1[C@@H]1CCCN1Cc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000091081853 948103561 /nfs/dbraw/zinc/10/35/61/948103561.db2.gz MTMUCOYLWZJXDN-AWEZNQCLSA-N -1 3 363.421 3.759 20 0 FHADHM FC1(F)CN(c2ccc3cc(-c4nnn[n-]4)ccc3n2)Cc2ccccc21 ZINC000826370280 948153634 /nfs/dbraw/zinc/15/36/34/948153634.db2.gz LRNFAWXFSDMKCH-UHFFFAOYSA-N -1 3 364.359 3.527 20 0 FHADHM FC1(F)CN(c2ccc3cc(-c4nn[n-]n4)ccc3n2)Cc2ccccc21 ZINC000826370280 948153638 /nfs/dbraw/zinc/15/36/38/948153638.db2.gz LRNFAWXFSDMKCH-UHFFFAOYSA-N -1 3 364.359 3.527 20 0 FHADHM Fc1c2nc(NCc3cccc(-c4nnn[n-]4)c3)sc2ccc1Cl ZINC000826371387 948154285 /nfs/dbraw/zinc/15/42/85/948154285.db2.gz DXXCLYGHCBHKFO-UHFFFAOYSA-N -1 3 360.805 3.881 20 0 FHADHM Fc1c2nc(NCc3cccc(-c4nn[n-]n4)c3)sc2ccc1Cl ZINC000826371387 948154290 /nfs/dbraw/zinc/15/42/90/948154290.db2.gz DXXCLYGHCBHKFO-UHFFFAOYSA-N -1 3 360.805 3.881 20 0 FHADHM CSCc1cnc(CNC[C@H](Cc2cccc(Cl)c2)C(=O)[O-])s1 ZINC000417550445 948206811 /nfs/dbraw/zinc/20/68/11/948206811.db2.gz VNGOTKVNSLJUAG-LBPRGKRZSA-N -1 3 370.927 3.693 20 0 FHADHM CCCCN(Cc1ccccc1Cl)C(=O)c1cnc2c(cnn2C)c1[O-] ZINC000512028933 948223493 /nfs/dbraw/zinc/22/34/93/948223493.db2.gz RUYVOAABPQBPGX-UHFFFAOYSA-N -1 3 372.856 3.770 20 0 FHADHM O=C(CC1CCC(C(F)(F)F)CC1)OCc1cccc(-c2nnn[n-]2)c1 ZINC000826404393 948230783 /nfs/dbraw/zinc/23/07/83/948230783.db2.gz YVWOPHQOKVQQBK-UHFFFAOYSA-N -1 3 368.359 3.669 20 0 FHADHM O=C(CC1CCC(C(F)(F)F)CC1)OCc1cccc(-c2nn[n-]n2)c1 ZINC000826404393 948230792 /nfs/dbraw/zinc/23/07/92/948230792.db2.gz YVWOPHQOKVQQBK-UHFFFAOYSA-N -1 3 368.359 3.669 20 0 FHADHM Cc1n[nH]cc1-c1nnc([N-]C(=O)c2cc3cc(Cl)ccc3o2)s1 ZINC000441572196 948281371 /nfs/dbraw/zinc/28/13/71/948281371.db2.gz MIRIPVVFWNTCSG-UHFFFAOYSA-N -1 3 359.798 3.889 20 0 FHADHM O=C(Nc1nc2cc(F)c(F)cc2s1)c1c[n-]c2ccccc2c1=O ZINC000512045445 948292925 /nfs/dbraw/zinc/29/29/25/948292925.db2.gz LCNFEUAASCDKBG-UHFFFAOYSA-N -1 3 357.341 3.668 20 0 FHADHM CCO[C@H](CC[N-]S(=O)(=O)c1cccc(Cl)c1Cl)C(C)C ZINC000467787040 948342124 /nfs/dbraw/zinc/34/21/24/948342124.db2.gz MNHPSXCPDPRAIC-GFCCVEGCSA-N -1 3 354.299 3.723 20 0 FHADHM CC[C@@H](CCNCc1csc(COc2ccc(Cl)cc2)n1)C(=O)[O-] ZINC000417645258 948386761 /nfs/dbraw/zinc/38/67/61/948386761.db2.gz DDHOTSVHKSEBOY-LBPRGKRZSA-N -1 3 368.886 3.966 20 0 FHADHM Cc1cc(F)cc2c(=O)c(C(=O)Nc3cc(C4CCCC4)[nH]n3)c[n-]c12 ZINC000152385889 948466236 /nfs/dbraw/zinc/46/62/36/948466236.db2.gz LHKYEYWASMYGEE-UHFFFAOYSA-N -1 3 354.385 3.609 20 0 FHADHM CC(C)[C@H](CC(=O)Nc1cc(-c2nnn[n-]2)ccc1F)c1ccccc1 ZINC001275483033 948495578 /nfs/dbraw/zinc/49/55/78/948495578.db2.gz GKTPJTOPFNAURB-HNNXBMFYSA-N -1 3 353.401 3.774 20 0 FHADHM CC(C)[C@H](CC(=O)Nc1cc(-c2nn[n-]n2)ccc1F)c1ccccc1 ZINC001275483033 948495582 /nfs/dbraw/zinc/49/55/82/948495582.db2.gz GKTPJTOPFNAURB-HNNXBMFYSA-N -1 3 353.401 3.774 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)C=Cc3cccc(F)c3)c2)n1 ZINC000049301962 948536336 /nfs/dbraw/zinc/53/63/36/948536336.db2.gz OYSBMPBQQHZKOT-KTKRTIGZSA-N -1 3 363.392 3.790 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)Nc1cc(-c2nnn[n-]2)ccc1F ZINC001525059807 948538556 /nfs/dbraw/zinc/53/85/56/948538556.db2.gz LWSNPESNWGWHFJ-YFHOEESVSA-N -1 3 357.776 3.701 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)Nc1cc(-c2nn[n-]n2)ccc1F ZINC001525059807 948538562 /nfs/dbraw/zinc/53/85/62/948538562.db2.gz LWSNPESNWGWHFJ-YFHOEESVSA-N -1 3 357.776 3.701 20 0 FHADHM Cc1c(COC(C)(C)C)cccc1NC(=O)c1cnc2c(cnn2C)c1[O-] ZINC000512175840 948653029 /nfs/dbraw/zinc/65/30/29/948653029.db2.gz RLINMUWQMGYUCF-UHFFFAOYSA-N -1 3 368.437 3.550 20 0 FHADHM Cc1cccc(NC(=S)N[N-]C(=O)c2cc(Cl)ccc2Cl)c1 ZINC000006631756 948705586 /nfs/dbraw/zinc/70/55/86/948705586.db2.gz STCGIYAKQCKTPW-UHFFFAOYSA-N -1 3 354.262 3.933 20 0 FHADHM CC(C)c1cc(Nc2cccc(Oc3ccc(-c4nnn[n-]4)cn3)c2)ncn1 ZINC001574416346 948746262 /nfs/dbraw/zinc/74/62/62/948746262.db2.gz RPSSXQUMGQGLOO-UHFFFAOYSA-N -1 3 374.408 3.711 20 0 FHADHM CC(C)c1cc(Nc2cccc(Oc3ccc(-c4nn[n-]n4)cn3)c2)ncn1 ZINC001574416346 948746273 /nfs/dbraw/zinc/74/62/73/948746273.db2.gz RPSSXQUMGQGLOO-UHFFFAOYSA-N -1 3 374.408 3.711 20 0 FHADHM COc1ccc(Cl)c([N-]S(=O)(=O)c2ccc(F)c(Cl)c2)c1 ZINC000064374656 221145976 /nfs/dbraw/zinc/14/59/76/221145976.db2.gz UEQIKNAXMJLRLB-UHFFFAOYSA-N -1 3 350.198 3.942 20 0 FHADHM COc1cccc(C[N-]S(=O)(=O)c2cc(Cl)sc2Cl)c1 ZINC000069602858 221326912 /nfs/dbraw/zinc/32/69/12/221326912.db2.gz LDAWCLRWTWGWAD-UHFFFAOYSA-N -1 3 352.264 3.542 20 0 FHADHM C[C@@H]1CN(c2ccccc2NC(=O)c2cc(-c3ccco3)[n-]n2)C[C@H](C)O1 ZINC000130183809 132251024 /nfs/dbraw/zinc/25/10/24/132251024.db2.gz GZMUBDUKYRSXJI-OKILXGFUSA-N -1 3 366.421 3.536 20 0 FHADHM C[C@@H]1CN(c2ccccc2NC(=O)c2cc(-c3ccco3)n[n-]2)C[C@H](C)O1 ZINC000130183809 132251026 /nfs/dbraw/zinc/25/10/26/132251026.db2.gz GZMUBDUKYRSXJI-OKILXGFUSA-N -1 3 366.421 3.536 20 0 FHADHM CCCCCCNC(=O)[C@@H]1CCCN(C(=O)c2cc(CC)ccc2[O-])C1 ZINC000109822539 222472822 /nfs/dbraw/zinc/47/28/22/222472822.db2.gz DNECHGSTEUDLLR-QGZVFWFLSA-N -1 3 360.498 3.503 20 0 FHADHM Cc1cc(C)cc(-c2cc(=NC(=O)[C@H]3CC(=O)N[C@@H](CC(C)C)C3)[nH][n-]2)c1 ZINC000508852039 514920320 /nfs/dbraw/zinc/92/03/20/514920320.db2.gz ZJTMXIQZDPVBDD-SJORKVTESA-N -1 3 368.481 3.573 20 0 FHADHM COc1ccc2[nH]nc(NC(=O)c3cc([O-])ccc3C(F)(F)F)c2c1 ZINC000476554264 515098671 /nfs/dbraw/zinc/09/86/71/515098671.db2.gz XLIDCNGEWVDJRE-UHFFFAOYSA-N -1 3 351.284 3.548 20 0 FHADHM O=C(CCCOc1ccc2c(c1)CCC2)N=c1cc([C@@H]2CCCO2)[n-][nH]1 ZINC000473852134 515775748 /nfs/dbraw/zinc/77/57/48/515775748.db2.gz UJCDMAFGNNZMEB-SFHVURJKSA-N -1 3 355.438 3.548 20 0 FHADHM COc1cc(C(=O)N=c2cc([C@H]3CCCO3)[n-][nH]2)ccc1OCC(C)C ZINC000473854481 515777713 /nfs/dbraw/zinc/77/77/13/515777713.db2.gz YPIJTUWFTYAEEB-OAHLLOKOSA-N -1 3 359.426 3.557 20 0 FHADHM CCc1[n-][nH]c(=NC(=O)[C@@H]2CCO[C@H](CC)C2)c1-c1ccc2c(c1)OCO2 ZINC000506758245 515975685 /nfs/dbraw/zinc/97/56/85/515975685.db2.gz GZXATBIUNQMOBB-ZIAGYGMSSA-N -1 3 371.437 3.512 20 0 FHADHM CCN=c1[n-]c(C(=O)NCc2ccc(OC)cc2C(F)(F)F)cs1 ZINC000495206836 516100497 /nfs/dbraw/zinc/10/04/97/516100497.db2.gz ACXMOVLRUMGUKS-UHFFFAOYSA-N -1 3 359.373 3.532 20 0 FHADHM O=C(N=c1cc(-c2ccncc2)[n-][nH]1)c1ccn(-c2ccc(Cl)cc2)n1 ZINC000536059200 516611737 /nfs/dbraw/zinc/61/17/37/516611737.db2.gz IYZKEJZNOUNZSO-UHFFFAOYSA-N -1 3 364.796 3.563 20 0 FHADHM C[C@@H](CCc1ccccc1F)C(=O)N=c1[n-]n(C)cc1Br ZINC000519535357 517032545 /nfs/dbraw/zinc/03/25/45/517032545.db2.gz DNTVCYPJVSCMJV-JTQLQIEISA-N -1 3 354.223 3.529 20 0 FHADHM Cc1cc(C)c(-c2cc(=NC(=O)[C@@H](C)OC[C@H]3CCCO3)[nH][n-]2)cc1C ZINC000520607450 517454617 /nfs/dbraw/zinc/45/46/17/517454617.db2.gz LOHQXJBWCVTNBO-HZPDHXFCSA-N -1 3 357.454 3.525 20 0 FHADHM CCN1CCCN(C(=O)N=c2[n-]nc(-c3cc4ccccc4o3)s2)CC1 ZINC000527060004 517480843 /nfs/dbraw/zinc/48/08/43/517480843.db2.gz ALHYSXGCDSREHL-UHFFFAOYSA-N -1 3 371.466 3.511 20 0 FHADHM CCc1c(C(=O)N=c2cc([C@H]3CCCO3)[n-][nH]2)cnn1-c1ccc(C)cc1 ZINC000527208455 517562053 /nfs/dbraw/zinc/56/20/53/517562053.db2.gz KNGQCKXAHDCZTA-GOSISDBHSA-N -1 3 365.437 3.570 20 0 FHADHM CCc1onc(-c2ccccc2Cl)c1C(=O)N=c1cc(OC)n(C)[n-]1 ZINC000527259613 517598432 /nfs/dbraw/zinc/59/84/32/517598432.db2.gz GPICSNJOLNKDRL-UHFFFAOYSA-N -1 3 360.801 3.552 20 0 FHADHM Cc1nn(C)c(C)c1C[C@H](C)C(=O)N=c1[nH][n-]c(C)c1-c1ccccc1 ZINC000608359428 519947858 /nfs/dbraw/zinc/94/78/58/519947858.db2.gz PKWFUUSPNPOZQQ-LBPRGKRZSA-N -1 3 351.454 3.553 20 0 FHADHM Cc1[n-][nH]c(=NC(=O)[C@H](C)N(C)CC(F)(F)F)c1-c1ccc(C)cc1 ZINC000630021435 522585757 /nfs/dbraw/zinc/58/57/57/522585757.db2.gz RBXXHRVRSZUFGC-LBPRGKRZSA-N -1 3 354.376 3.515 20 0 FHADHM COCc1csc(C(=O)N=c2[n-]n(CC(F)(F)F)cc2Cl)c1 ZINC000622888127 523530095 /nfs/dbraw/zinc/53/00/95/523530095.db2.gz VAHMIPOIRQKMHI-UHFFFAOYSA-N -1 3 353.753 3.559 20 0 FHADHM O=C(Nc1ccc(CN2CCCC2=O)cc1)c1ccc2c(c1[O-])CCCC2 ZINC000185175692 567827313 /nfs/dbraw/zinc/82/73/13/567827313.db2.gz QRJAEOYIGGQAFR-UHFFFAOYSA-N -1 3 364.445 3.646 20 0 FHADHM O=C(Nc1ccccc1)[C@@H](Cc1ccccc1)NCc1cc([O-])cc(F)c1 ZINC000185527155 567847501 /nfs/dbraw/zinc/84/75/01/567847501.db2.gz ASJNCDIMAOBCLQ-OAQYLSRUSA-N -1 3 364.420 3.871 20 0 FHADHM COCc1ccc([C@H]2CCCN2C(=O)c2ccc3c(c2[O-])CCCC3)o1 ZINC000186245851 567894273 /nfs/dbraw/zinc/89/42/73/567894273.db2.gz OTNYUEVBPPQRDH-GOSISDBHSA-N -1 3 355.434 3.988 20 0 FHADHM O=C(Nc1ncc(-c2ccc(Cl)cc2)s1)c1ccc2n[n-]nc2c1 ZINC000461103453 567955222 /nfs/dbraw/zinc/95/52/22/567955222.db2.gz YTBKOBVURWAKLM-UHFFFAOYSA-N -1 3 355.810 3.987 20 0 FHADHM CC(C)n1cc([C@@H](C)[N-]S(=O)(=O)c2c(Cl)cccc2Cl)cn1 ZINC000602275982 567962342 /nfs/dbraw/zinc/96/23/42/567962342.db2.gz VFGIKAXDIVLRFE-SNVBAGLBSA-N -1 3 362.282 3.810 20 0 FHADHM CC(C)n1cc([C@H](C)[N-]S(=O)(=O)c2c(Cl)cccc2Cl)cn1 ZINC000602275980 567962378 /nfs/dbraw/zinc/96/23/78/567962378.db2.gz VFGIKAXDIVLRFE-JTQLQIEISA-N -1 3 362.282 3.810 20 0 FHADHM C[C@H]1COC2(CCC2)CN1C(=O)c1cc(OCc2ccccc2)ccc1[O-] ZINC000617945250 568012016 /nfs/dbraw/zinc/01/20/16/568012016.db2.gz NAPRXGCCKYRCKM-INIZCTEOSA-N -1 3 367.445 3.755 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)CO[C@@H]3CCC[C@@H](C)C3)c2)n1 ZINC000602661265 568012363 /nfs/dbraw/zinc/01/23/63/568012363.db2.gz KTKNHJMSXRDGFR-RDTXWAMCSA-N -1 3 369.465 3.945 20 0 FHADHM Cc1csc(C2([N-]S(=O)(=O)Cc3ccccc3Cl)CCCC2)n1 ZINC000602895410 568014120 /nfs/dbraw/zinc/01/41/20/568014120.db2.gz ITKAKISTGQVZRN-UHFFFAOYSA-N -1 3 370.927 3.994 20 0 FHADHM C[C@@H]1CCC[C@@H](NC(=O)c2cc(=O)c3cc(Br)ccc3[n-]2)C1 ZINC000602741121 568020932 /nfs/dbraw/zinc/02/09/32/568020932.db2.gz WEJVQHIZUQZBDU-ZYHUDNBSSA-N -1 3 363.255 3.599 20 0 FHADHM C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2C(=O)c2cc([O-])c3ccccc3c2)C1 ZINC000408223653 568032261 /nfs/dbraw/zinc/03/22/61/568032261.db2.gz CDMSHCUVQYMVJE-DPZWOIPNSA-N -1 3 353.462 3.947 20 0 FHADHM Cc1cc(C)c(-c2cc(=NC(=O)c3cccc(-n4ccnc4)c3)[nH][n-]2)cc1C ZINC000522760093 568063284 /nfs/dbraw/zinc/06/32/84/568063284.db2.gz OGIZGAQFKASNRU-UHFFFAOYSA-N -1 3 371.444 3.862 20 0 FHADHM COc1cc2cc(-c3nc(-c4ccc([O-])cc4)no3)[nH]c2c(OC)c1OC ZINC000603630846 568127950 /nfs/dbraw/zinc/12/79/50/568127950.db2.gz LUDXHYCSVQEJES-UHFFFAOYSA-N -1 3 367.361 3.616 20 0 FHADHM O=C([N-]c1c(F)cc(F)cc1F)c1nc(C(F)(F)F)n2c1CCCC2 ZINC000636931793 568206203 /nfs/dbraw/zinc/20/62/03/568206203.db2.gz YXVBAZKUWDQHST-UHFFFAOYSA-N -1 3 363.261 3.908 20 0 FHADHM C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCN2C(=O)c2cc([O-])ccc2C(F)(F)F)C1 ZINC000408262300 568225136 /nfs/dbraw/zinc/22/51/36/568225136.db2.gz WJNBBELLXJVFJH-PREXVCJDSA-N -1 3 371.399 3.813 20 0 FHADHM CCOC(=O)c1cc(NC(=O)c2cc(-c3ccco3)[n-]n2)ccc1Cl ZINC000604260757 568239578 /nfs/dbraw/zinc/23/95/78/568239578.db2.gz NXZKLIBGFUVNBZ-UHFFFAOYSA-N -1 3 359.769 3.752 20 0 FHADHM CCOC(=O)c1cc(NC(=O)c2cc(-c3ccco3)n[n-]2)ccc1Cl ZINC000604260757 568239579 /nfs/dbraw/zinc/23/95/79/568239579.db2.gz NXZKLIBGFUVNBZ-UHFFFAOYSA-N -1 3 359.769 3.752 20 0 FHADHM CCCOCc1ccccc1C[N-]S(=O)(=O)c1cc(F)c(F)cc1F ZINC000303334757 568266509 /nfs/dbraw/zinc/26/65/09/568266509.db2.gz XSHUVNRFQWHBBT-UHFFFAOYSA-N -1 3 373.396 3.509 20 0 FHADHM CC(=O)Nc1ccc(S(=O)(=O)[N-][C@@H](C)CCC2CCCCC2)c(F)c1 ZINC000604407836 568269161 /nfs/dbraw/zinc/26/91/61/568269161.db2.gz HIVANCDVXPTPBX-ZDUSSCGKSA-N -1 3 370.490 3.811 20 0 FHADHM Cc1conc1[N-]C(=O)c1nnn(-c2ccc(-c3ccccc3)cc2)c1C ZINC000123574651 568285567 /nfs/dbraw/zinc/28/55/67/568285567.db2.gz LWKWRELDKVOJPA-UHFFFAOYSA-N -1 3 359.389 3.791 20 0 FHADHM O=C(c1cc2c(cc1[O-])CCCC2)N1CCN(c2cccc(F)c2F)CC1 ZINC000604601847 568323814 /nfs/dbraw/zinc/32/38/14/568323814.db2.gz LFHWAYZQXPKCKB-UHFFFAOYSA-N -1 3 372.415 3.512 20 0 FHADHM Cc1ccc(Cl)c(S(=O)(=O)[N-]C(C)(C)c2nccs2)c1Cl ZINC000604770776 568363042 /nfs/dbraw/zinc/36/30/42/568363042.db2.gz FWSWJHADSGXTBI-UHFFFAOYSA-N -1 3 365.307 3.972 20 0 FHADHM O=S(=O)([N-][C@H]1C[C@H]1c1c(F)cccc1F)c1ccc(F)cc1Cl ZINC000604772921 568363612 /nfs/dbraw/zinc/36/36/12/568363612.db2.gz WMMQDAOYAHHDBD-RNCFNFMXSA-N -1 3 361.772 3.592 20 0 FHADHM Cc1cc(Cl)cc(NC(=O)CCc2nc3ccccc3c(=O)[nH]2)c1[O-] ZINC000604902036 568385059 /nfs/dbraw/zinc/38/50/59/568385059.db2.gz WWPKBIOZVKPOLC-UHFFFAOYSA-N -1 3 357.797 3.574 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2cccc(OC(F)F)c2)c(C)c1C ZINC000604971542 568462797 /nfs/dbraw/zinc/46/27/97/568462797.db2.gz YZJBORONTBNZQV-UHFFFAOYSA-N -1 3 357.378 3.714 20 0 FHADHM CCOC(=O)c1ccc(S(=O)(=O)[N-]c2cccc(Cl)c2Cl)cc1 ZINC000007405324 568504530 /nfs/dbraw/zinc/50/45/30/568504530.db2.gz UMVNLRRMOOTHRX-UHFFFAOYSA-N -1 3 374.245 3.971 20 0 FHADHM Cc1nc(C)c(CC(=O)Nc2nc(C=Cc3ccccc3)cs2)c(=O)[n-]1 ZINC000604990082 568509362 /nfs/dbraw/zinc/50/93/62/568509362.db2.gz AQQODBYUWOEDDH-CMDGGOBGSA-N -1 3 366.446 3.607 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)NCC3Cc4ccccc4C3)cc2)cc(=O)[n-]1 ZINC000605009479 568516691 /nfs/dbraw/zinc/51/66/91/568516691.db2.gz BJLQLVVUIHCQOY-UHFFFAOYSA-N -1 3 374.444 3.694 20 0 FHADHM CCO[C@H](C)c1nc(CC(=O)N=c2cc(-c3ccccc3C)[n-][nH]2)cs1 ZINC000605021998 568525434 /nfs/dbraw/zinc/52/54/34/568525434.db2.gz IGPVEOHTBVSVOZ-CYBMUJFWSA-N -1 3 370.478 3.542 20 0 FHADHM COc1ccc(Cl)cc1-c1cc(=NC(=O)c2c(C)noc2C(C)C)[nH][n-]1 ZINC000605022054 568525509 /nfs/dbraw/zinc/52/55/09/568525509.db2.gz MMSMCRCYFJWHAA-UHFFFAOYSA-N -1 3 374.828 3.833 20 0 FHADHM O=S(=O)([N-][C@@H]1CSc2ccccc21)c1csc(-c2ccccc2)n1 ZINC000605163954 568592567 /nfs/dbraw/zinc/59/25/67/568592567.db2.gz AYVXAHWGBFMLDI-CQSZACIVSA-N -1 3 374.512 3.935 20 0 FHADHM CCCCSCCC(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(C)C ZINC000736462532 598830677 /nfs/dbraw/zinc/83/06/77/598830677.db2.gz GXJHQYIADGCHJT-UHFFFAOYSA-N -1 3 363.487 3.516 20 0 FHADHM CCCCSCCC(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(C)C ZINC000736462532 598830678 /nfs/dbraw/zinc/83/06/78/598830678.db2.gz GXJHQYIADGCHJT-UHFFFAOYSA-N -1 3 363.487 3.516 20 0 FHADHM CCC/C(C)=C\C(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000736418161 598833396 /nfs/dbraw/zinc/83/33/96/598833396.db2.gz ASHVUOLYTHPRTJ-RAXLEYEMSA-N -1 3 367.478 3.958 20 0 FHADHM Cc1ccc(-c2nc(CNCc3cccc(-c4nn[n-]n4)c3)cs2)cc1 ZINC000737287545 598837578 /nfs/dbraw/zinc/83/75/78/598837578.db2.gz FNKDSINCWSQSTR-UHFFFAOYSA-N -1 3 362.462 3.588 20 0 FHADHM O=C(Nc1ccc(COC2CCCC2)cc1)c1sccc1-c1nnn[n-]1 ZINC000738159315 598839372 /nfs/dbraw/zinc/83/93/72/598839372.db2.gz ODHQAOIHHXFWNR-UHFFFAOYSA-N -1 3 369.450 3.640 20 0 FHADHM O=C(Nc1ccc(COC2CCCC2)cc1)c1sccc1-c1nn[n-]n1 ZINC000738159315 598839374 /nfs/dbraw/zinc/83/93/74/598839374.db2.gz ODHQAOIHHXFWNR-UHFFFAOYSA-N -1 3 369.450 3.640 20 0 FHADHM Cc1cc(C)c([C@H](C)OC(=O)CNc2ccc(-c3nn[n-]n3)cc2)c(C)c1 ZINC000737246611 598843990 /nfs/dbraw/zinc/84/39/90/598843990.db2.gz MGHWUSFXCYNGRI-HNNXBMFYSA-N -1 3 365.437 3.508 20 0 FHADHM Cc1occc1COC(=O)c1ccccc1-c1ccccc1-c1nnn[n-]1 ZINC000737558039 598857325 /nfs/dbraw/zinc/85/73/25/598857325.db2.gz ZOGYZZXNSPKVMO-UHFFFAOYSA-N -1 3 360.373 3.792 20 0 FHADHM Cc1occc1COC(=O)c1ccccc1-c1ccccc1-c1nn[n-]n1 ZINC000737558039 598857326 /nfs/dbraw/zinc/85/73/26/598857326.db2.gz ZOGYZZXNSPKVMO-UHFFFAOYSA-N -1 3 360.373 3.792 20 0 FHADHM CC(C)(C)C(=O)CSc1nc(-c2ccccc2)ccc1-c1nnn[n-]1 ZINC000735585406 598901692 /nfs/dbraw/zinc/90/16/92/598901692.db2.gz AIWSLHDWMFWAHG-UHFFFAOYSA-N -1 3 353.451 3.636 20 0 FHADHM CC(C)(C)C(=O)CSc1nc(-c2ccccc2)ccc1-c1nn[n-]n1 ZINC000735585406 598901694 /nfs/dbraw/zinc/90/16/94/598901694.db2.gz AIWSLHDWMFWAHG-UHFFFAOYSA-N -1 3 353.451 3.636 20 0 FHADHM c1ccc(-c2ccc(-c3nnn[n-]3)c(SC[C@@H]3CCCCO3)n2)cc1 ZINC000738421776 598902972 /nfs/dbraw/zinc/90/29/72/598902972.db2.gz VQHMATAONDLWDI-AWEZNQCLSA-N -1 3 353.451 3.590 20 0 FHADHM c1ccc(-c2ccc(-c3nn[n-]n3)c(SC[C@@H]3CCCCO3)n2)cc1 ZINC000738421776 598902974 /nfs/dbraw/zinc/90/29/74/598902974.db2.gz VQHMATAONDLWDI-AWEZNQCLSA-N -1 3 353.451 3.590 20 0 FHADHM CC(C)(C)/C=C/C(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)nc1 ZINC000735593858 598904240 /nfs/dbraw/zinc/90/42/40/598904240.db2.gz MYVYJFDASULHSL-ZHACJKMWSA-N -1 3 364.409 3.595 20 0 FHADHM C[C@H](CC1CCCC1)C(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(F)F ZINC000735987080 598905475 /nfs/dbraw/zinc/90/54/75/598905475.db2.gz WZCCVUJWTKUTFS-SNVBAGLBSA-N -1 3 365.384 3.623 20 0 FHADHM C[C@H](CC1CCCC1)C(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(F)F ZINC000735987080 598905476 /nfs/dbraw/zinc/90/54/76/598905476.db2.gz WZCCVUJWTKUTFS-SNVBAGLBSA-N -1 3 365.384 3.623 20 0 FHADHM CC[C@H](NC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1ccc(Cl)s1 ZINC000736353950 598907243 /nfs/dbraw/zinc/90/72/43/598907243.db2.gz CXGZTFFPWDYELD-RSPDNQDQSA-N -1 3 373.869 3.862 20 0 FHADHM CC[C@H](NC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1ccc(Cl)s1 ZINC000736353950 598907245 /nfs/dbraw/zinc/90/72/45/598907245.db2.gz CXGZTFFPWDYELD-RSPDNQDQSA-N -1 3 373.869 3.862 20 0 FHADHM CCOc1cc(CNc2ccc(-c3nnn[n-]3)c(Cl)c2)ccc1OC ZINC000736624546 598914543 /nfs/dbraw/zinc/91/45/43/598914543.db2.gz BZZCZGLGSUKXJJ-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM CCOc1cc(CNc2ccc(-c3nn[n-]n3)c(Cl)c2)ccc1OC ZINC000736624546 598914545 /nfs/dbraw/zinc/91/45/45/598914545.db2.gz BZZCZGLGSUKXJJ-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM CC[C@H](NC(=O)Nc1cccc(-c2nnn[n-]2)c1)c1ccc(Cl)s1 ZINC000736362981 598920253 /nfs/dbraw/zinc/92/02/53/598920253.db2.gz LPHSHYFBMALVBL-NSHDSACASA-N -1 3 362.846 3.854 20 0 FHADHM CC[C@H](NC(=O)Nc1cccc(-c2nn[n-]n2)c1)c1ccc(Cl)s1 ZINC000736362981 598920255 /nfs/dbraw/zinc/92/02/55/598920255.db2.gz LPHSHYFBMALVBL-NSHDSACASA-N -1 3 362.846 3.854 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)C=C1CCC(C)CC1 ZINC000735831760 598925856 /nfs/dbraw/zinc/92/58/56/598925856.db2.gz VAAQYSWYEMLPHL-UHFFFAOYSA-N -1 3 367.497 3.988 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)C=C1CCC(C)CC1 ZINC000735831760 598925858 /nfs/dbraw/zinc/92/58/58/598925858.db2.gz VAAQYSWYEMLPHL-UHFFFAOYSA-N -1 3 367.497 3.988 20 0 FHADHM Fc1ccc(-c2cnc(Sc3ncc(-c4nnn[n-]4)cc3Cl)o2)cc1 ZINC000737652960 598936784 /nfs/dbraw/zinc/93/67/84/598936784.db2.gz PQQVXDAODATBTL-UHFFFAOYSA-N -1 3 374.788 3.860 20 0 FHADHM Fc1ccc(-c2cnc(Sc3ncc(-c4nn[n-]n4)cc3Cl)o2)cc1 ZINC000737652960 598936786 /nfs/dbraw/zinc/93/67/86/598936786.db2.gz PQQVXDAODATBTL-UHFFFAOYSA-N -1 3 374.788 3.860 20 0 FHADHM Cc1cc2c(o1)CC(C)(C)C[C@H]2Nc1ncc(-c2nnn[n-]2)cc1Cl ZINC000737283344 598937511 /nfs/dbraw/zinc/93/75/11/598937511.db2.gz CWVKDPQZQJPJPC-CYBMUJFWSA-N -1 3 358.833 3.942 20 0 FHADHM Cc1cc2c(o1)CC(C)(C)C[C@H]2Nc1ncc(-c2nn[n-]n2)cc1Cl ZINC000737283344 598937513 /nfs/dbraw/zinc/93/75/13/598937513.db2.gz CWVKDPQZQJPJPC-CYBMUJFWSA-N -1 3 358.833 3.942 20 0 FHADHM Fc1cccc(C=C2CCN(c3ncc(-c4nnn[n-]4)cc3Cl)CC2)c1 ZINC000737664852 598939117 /nfs/dbraw/zinc/93/91/17/598939117.db2.gz FKPSQMKTGIOOJW-UHFFFAOYSA-N -1 3 370.819 3.738 20 0 FHADHM Fc1cccc(C=C2CCN(c3ncc(-c4nn[n-]n4)cc3Cl)CC2)c1 ZINC000737664852 598939119 /nfs/dbraw/zinc/93/91/19/598939119.db2.gz FKPSQMKTGIOOJW-UHFFFAOYSA-N -1 3 370.819 3.738 20 0 FHADHM Clc1ccc(CN(c2ncc(-c3nnn[n-]3)cc2Cl)C2CC2)cc1 ZINC000737573769 598939432 /nfs/dbraw/zinc/93/94/32/598939432.db2.gz BJRKRHNZDKVKON-UHFFFAOYSA-N -1 3 361.236 3.738 20 0 FHADHM Clc1ccc(CN(c2ncc(-c3nn[n-]n3)cc2Cl)C2CC2)cc1 ZINC000737573769 598939434 /nfs/dbraw/zinc/93/94/34/598939434.db2.gz BJRKRHNZDKVKON-UHFFFAOYSA-N -1 3 361.236 3.738 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N[C@@]1(C)CCCc2ccccc21 ZINC000737295481 598967022 /nfs/dbraw/zinc/96/70/22/598967022.db2.gz YCKJOGJMXUTCDJ-FQEVSTJZSA-N -1 3 362.437 3.548 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N[C@@]1(C)CCCc2ccccc21 ZINC000737295481 598967023 /nfs/dbraw/zinc/96/70/23/598967023.db2.gz YCKJOGJMXUTCDJ-FQEVSTJZSA-N -1 3 362.437 3.548 20 0 FHADHM Cc1c2ccccc2oc1COC(=O)C=Cc1ccccc1-c1nnn[n-]1 ZINC000737215510 598974915 /nfs/dbraw/zinc/97/49/15/598974915.db2.gz KDQDIPKKZNRGLG-ZHACJKMWSA-N -1 3 360.373 3.678 20 0 FHADHM Cc1c2ccccc2oc1COC(=O)C=Cc1ccccc1-c1nn[n-]n1 ZINC000737215510 598974916 /nfs/dbraw/zinc/97/49/16/598974916.db2.gz KDQDIPKKZNRGLG-ZHACJKMWSA-N -1 3 360.373 3.678 20 0 FHADHM Cc1c(NCc2cc(Br)cs2)cccc1-c1nnn[n-]1 ZINC000822123217 607256947 /nfs/dbraw/zinc/25/69/47/607256947.db2.gz VXQMUBCMXLVFQB-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM Cc1c(NCc2cc(Br)cs2)cccc1-c1nn[n-]n1 ZINC000822123217 607256948 /nfs/dbraw/zinc/25/69/48/607256948.db2.gz VXQMUBCMXLVFQB-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM C[C@@H](C(=O)Nc1ncc(Cc2ccc(-c3nnn[n-]3)cc2)s1)C(C)(C)C ZINC000735568737 599014951 /nfs/dbraw/zinc/01/49/51/599014951.db2.gz AOTAKRMCMYDYBX-NSHDSACASA-N -1 3 370.482 3.535 20 0 FHADHM C[C@@H](C(=O)Nc1ncc(Cc2ccc(-c3nn[n-]n3)cc2)s1)C(C)(C)C ZINC000735568737 599014953 /nfs/dbraw/zinc/01/49/53/599014953.db2.gz AOTAKRMCMYDYBX-NSHDSACASA-N -1 3 370.482 3.535 20 0 FHADHM CC[C@@H](NC(=S)Nc1cc(-c2nnn[n-]2)ccc1C)c1cccs1 ZINC000736370632 599013749 /nfs/dbraw/zinc/01/37/49/599013749.db2.gz NCPIOBVPAPZGHN-GFCCVEGCSA-N -1 3 358.496 3.674 20 0 FHADHM CC[C@@H](NC(=S)Nc1cc(-c2nn[n-]n2)ccc1C)c1cccs1 ZINC000736370632 599013751 /nfs/dbraw/zinc/01/37/51/599013751.db2.gz NCPIOBVPAPZGHN-GFCCVEGCSA-N -1 3 358.496 3.674 20 0 FHADHM CC[C@H](NC(=S)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1cccs1 ZINC000736368343 599013992 /nfs/dbraw/zinc/01/39/92/599013992.db2.gz CJWOMNIVCXVXFP-FZMZJTMJSA-N -1 3 372.523 3.605 20 0 FHADHM CC[C@H](NC(=S)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1cccs1 ZINC000736368343 599013994 /nfs/dbraw/zinc/01/39/94/599013994.db2.gz CJWOMNIVCXVXFP-FZMZJTMJSA-N -1 3 372.523 3.605 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(NCc2ccccc2Cl)n1 ZINC000737636418 599037368 /nfs/dbraw/zinc/03/73/68/599037368.db2.gz RDRANCPQGZWKQP-UHFFFAOYSA-N -1 3 354.723 3.546 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(NCc2ccccc2Cl)n1 ZINC000737636418 599037370 /nfs/dbraw/zinc/03/73/70/599037370.db2.gz RDRANCPQGZWKQP-UHFFFAOYSA-N -1 3 354.723 3.546 20 0 FHADHM Cc1ccc([C@@H]2CCCN2c2nc(C(F)(F)F)ccc2-c2nnn[n-]2)cc1 ZINC000737333634 599041582 /nfs/dbraw/zinc/04/15/82/599041582.db2.gz UWDRHUUOWRGRKJ-AWEZNQCLSA-N -1 3 374.370 3.930 20 0 FHADHM Cc1ccc([C@@H]2CCCN2c2nc(C(F)(F)F)ccc2-c2nn[n-]n2)cc1 ZINC000737333634 599041584 /nfs/dbraw/zinc/04/15/84/599041584.db2.gz UWDRHUUOWRGRKJ-AWEZNQCLSA-N -1 3 374.370 3.930 20 0 FHADHM C[C@H]1C[C@H]1c1ccc(CNc2nc(C(F)(F)F)ccc2-c2nnn[n-]2)o1 ZINC000736239913 599045495 /nfs/dbraw/zinc/04/54/95/599045495.db2.gz UTLJHRIDKYCIIC-GZMMTYOYSA-N -1 3 364.331 3.609 20 0 FHADHM C[C@H]1C[C@H]1c1ccc(CNc2nc(C(F)(F)F)ccc2-c2nn[n-]n2)o1 ZINC000736239913 599045499 /nfs/dbraw/zinc/04/54/99/599045499.db2.gz UTLJHRIDKYCIIC-GZMMTYOYSA-N -1 3 364.331 3.609 20 0 FHADHM Cc1cccc([C@H]2CCCN2c2nc(C(F)(F)F)ccc2-c2nnn[n-]2)c1 ZINC000737390161 599046742 /nfs/dbraw/zinc/04/67/42/599046742.db2.gz QTMYENQTNPKLCT-CQSZACIVSA-N -1 3 374.370 3.930 20 0 FHADHM Cc1cccc([C@H]2CCCN2c2nc(C(F)(F)F)ccc2-c2nn[n-]n2)c1 ZINC000737390161 599046744 /nfs/dbraw/zinc/04/67/44/599046744.db2.gz QTMYENQTNPKLCT-CQSZACIVSA-N -1 3 374.370 3.930 20 0 FHADHM COc1cccc(F)c1[C@H](C)Nc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000821873114 599055555 /nfs/dbraw/zinc/05/55/55/599055555.db2.gz ROZBHOCJBQACSS-NSHDSACASA-N -1 3 364.384 3.736 20 0 FHADHM COc1cccc(F)c1[C@H](C)Nc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000821873114 599055558 /nfs/dbraw/zinc/05/55/58/599055558.db2.gz ROZBHOCJBQACSS-NSHDSACASA-N -1 3 364.384 3.736 20 0 FHADHM CC(C)C1CCN(c2c(-c3nnn[n-]3)cnc3c(F)cc(F)cc32)CC1 ZINC000820045234 599057352 /nfs/dbraw/zinc/05/73/52/599057352.db2.gz LPIYNGGIWIJMEU-UHFFFAOYSA-N -1 3 358.396 3.566 20 0 FHADHM CC(C)C1CCN(c2c(-c3nn[n-]n3)cnc3c(F)cc(F)cc32)CC1 ZINC000820045234 599057355 /nfs/dbraw/zinc/05/73/55/599057355.db2.gz LPIYNGGIWIJMEU-UHFFFAOYSA-N -1 3 358.396 3.566 20 0 FHADHM CCc1cc2c(ncnc2Sc2ccc(-c3nnn[n-]3)cc2F)s1 ZINC000821476108 599057609 /nfs/dbraw/zinc/05/76/09/599057609.db2.gz IAYZBEPOTDTSIS-UHFFFAOYSA-N -1 3 358.427 3.724 20 0 FHADHM CCc1cc2c(ncnc2Sc2ccc(-c3nn[n-]n3)cc2F)s1 ZINC000821476108 599057611 /nfs/dbraw/zinc/05/76/11/599057611.db2.gz IAYZBEPOTDTSIS-UHFFFAOYSA-N -1 3 358.427 3.724 20 0 FHADHM Cc1cccc([C@@H](C)CNC(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c1 ZINC000737391307 599058383 /nfs/dbraw/zinc/05/83/83/599058383.db2.gz ZPLJSDSXAGPHAM-LBPRGKRZSA-N -1 3 370.844 3.754 20 0 FHADHM Cc1cccc([C@@H](C)CNC(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c1 ZINC000737391307 599058386 /nfs/dbraw/zinc/05/83/86/599058386.db2.gz ZPLJSDSXAGPHAM-LBPRGKRZSA-N -1 3 370.844 3.754 20 0 FHADHM Fc1cccc(N[C@H](c2ccccc2)C2CCOCC2)c1-c1nnn[n-]1 ZINC000737662331 599061812 /nfs/dbraw/zinc/06/18/12/599061812.db2.gz UUAMDFPHNBDENX-GOSISDBHSA-N -1 3 353.401 3.586 20 0 FHADHM Fc1cccc(N[C@H](c2ccccc2)C2CCOCC2)c1-c1nn[n-]n1 ZINC000737662331 599061815 /nfs/dbraw/zinc/06/18/15/599061815.db2.gz UUAMDFPHNBDENX-GOSISDBHSA-N -1 3 353.401 3.586 20 0 FHADHM Cc1cc(C)c(-c2nnn[n-]2)c(NCCc2c[nH]c3ccc(Cl)cc23)n1 ZINC000822192929 599065347 /nfs/dbraw/zinc/06/53/47/599065347.db2.gz GFPDNNPMEDEMBN-UHFFFAOYSA-N -1 3 367.844 3.668 20 0 FHADHM Cc1cc(C)c(-c2nn[n-]n2)c(NCCc2c[nH]c3ccc(Cl)cc23)n1 ZINC000822192929 599065350 /nfs/dbraw/zinc/06/53/50/599065350.db2.gz GFPDNNPMEDEMBN-UHFFFAOYSA-N -1 3 367.844 3.668 20 0 FHADHM C[C@@H]1CCCN(C(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)[C@@H]1C ZINC000736264323 599081738 /nfs/dbraw/zinc/08/17/38/599081738.db2.gz CVUWYTBSAYYNID-HUUCEWRRSA-N -1 3 361.449 3.794 20 0 FHADHM C[C@@H]1CCCN(C(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)[C@@H]1C ZINC000736264323 599081741 /nfs/dbraw/zinc/08/17/41/599081741.db2.gz CVUWYTBSAYYNID-HUUCEWRRSA-N -1 3 361.449 3.794 20 0 FHADHM Fc1cc(-c2nnn[n-]2)cc(F)c1N1CC[C@H](CSc2ccccc2)C1 ZINC000822736195 599088619 /nfs/dbraw/zinc/08/86/19/599088619.db2.gz ADGIVUWJHGYHRF-LBPRGKRZSA-N -1 3 373.432 3.764 20 0 FHADHM Fc1cc(-c2nn[n-]n2)cc(F)c1N1CC[C@H](CSc2ccccc2)C1 ZINC000822736195 599088622 /nfs/dbraw/zinc/08/86/22/599088622.db2.gz ADGIVUWJHGYHRF-LBPRGKRZSA-N -1 3 373.432 3.764 20 0 FHADHM Cc1cccc([C@H]2CCCN2C(=O)C=Cc2ccccc2-c2nnn[n-]2)c1C ZINC000737389617 599103535 /nfs/dbraw/zinc/10/35/35/599103535.db2.gz LKBMHDWFCJHKAT-DRUFCSCSSA-N -1 3 373.460 3.860 20 0 FHADHM Cc1cccc([C@H]2CCCN2C(=O)C=Cc2ccccc2-c2nn[n-]n2)c1C ZINC000737389617 599103537 /nfs/dbraw/zinc/10/35/37/599103537.db2.gz LKBMHDWFCJHKAT-DRUFCSCSSA-N -1 3 373.460 3.860 20 0 FHADHM C[C@@H](Sc1ccccc1-c1nnn[n-]1)C(=O)Nc1ccc(Cl)cc1 ZINC000736193323 599108505 /nfs/dbraw/zinc/10/85/05/599108505.db2.gz OTFJKHRBCJBSLU-SNVBAGLBSA-N -1 3 359.842 3.639 20 0 FHADHM C[C@@H](Sc1ccccc1-c1nn[n-]n1)C(=O)Nc1ccc(Cl)cc1 ZINC000736193323 599108507 /nfs/dbraw/zinc/10/85/07/599108507.db2.gz OTFJKHRBCJBSLU-SNVBAGLBSA-N -1 3 359.842 3.639 20 0 FHADHM Cc1ccc([C@@H]2OCCC[C@@H]2CNc2cccc(F)c2-c2nnn[n-]2)cc1 ZINC000822233570 599108918 /nfs/dbraw/zinc/10/89/18/599108918.db2.gz RLDFUAFUISKGGN-BEFAXECRSA-N -1 3 367.428 3.894 20 0 FHADHM Cc1ccc([C@@H]2OCCC[C@@H]2CNc2cccc(F)c2-c2nn[n-]n2)cc1 ZINC000822233570 599108919 /nfs/dbraw/zinc/10/89/19/599108919.db2.gz RLDFUAFUISKGGN-BEFAXECRSA-N -1 3 367.428 3.894 20 0 FHADHM Cc1ccc(-c2nnc(CSc3ccccc3-c3nnn[n-]3)o2)cc1 ZINC000737289564 599111675 /nfs/dbraw/zinc/11/16/75/599111675.db2.gz VIZHCHQVIPYUJO-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM Cc1ccc(-c2nnc(CSc3ccccc3-c3nn[n-]n3)o2)cc1 ZINC000737289564 599111678 /nfs/dbraw/zinc/11/16/78/599111678.db2.gz VIZHCHQVIPYUJO-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM O=C([O-])[C@@H](NCc1ccc(F)c(F)c1)c1ccc(Br)cc1 ZINC000426826377 599788914 /nfs/dbraw/zinc/78/89/14/599788914.db2.gz SXQQFTUGBWIAJR-AWEZNQCLSA-N -1 3 356.166 3.643 20 0 FHADHM CSc1ccc(OCCOc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000821984343 599123241 /nfs/dbraw/zinc/12/32/41/599123241.db2.gz NMRDXJWBZCVYTJ-UHFFFAOYSA-N -1 3 362.842 3.700 20 0 FHADHM CSc1ccc(OCCOc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000821984343 599123243 /nfs/dbraw/zinc/12/32/43/599123243.db2.gz NMRDXJWBZCVYTJ-UHFFFAOYSA-N -1 3 362.842 3.700 20 0 FHADHM Cc1ccc(-c2cnc(COc3ccc(-c4nnn[n-]4)c(F)c3)o2)cc1 ZINC000822213950 599128002 /nfs/dbraw/zinc/12/80/02/599128002.db2.gz ITEUXVGOOSGJBW-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM Cc1ccc(-c2cnc(COc3ccc(-c4nn[n-]n4)c(F)c3)o2)cc1 ZINC000822213950 599128005 /nfs/dbraw/zinc/12/80/05/599128005.db2.gz ITEUXVGOOSGJBW-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM Cc1cc(CNc2ccc(Oc3ccccc3-c3nnn[n-]3)c(F)c2)no1 ZINC000822200824 599133452 /nfs/dbraw/zinc/13/34/52/599133452.db2.gz CVPQCNNGLONTGU-UHFFFAOYSA-N -1 3 366.356 3.707 20 0 FHADHM Cc1cc(CNc2ccc(Oc3ccccc3-c3nn[n-]n3)c(F)c2)no1 ZINC000822200824 599133458 /nfs/dbraw/zinc/13/34/58/599133458.db2.gz CVPQCNNGLONTGU-UHFFFAOYSA-N -1 3 366.356 3.707 20 0 FHADHM O=C(CCCC1CCCC1)Nc1cc(-c2nnn[n-]2)ccc1OC(F)F ZINC000822955419 599151622 /nfs/dbraw/zinc/15/16/22/599151622.db2.gz UOLVHFCYPNGJPC-UHFFFAOYSA-N -1 3 365.384 3.767 20 0 FHADHM O=C(CCCC1CCCC1)Nc1cc(-c2nn[n-]n2)ccc1OC(F)F ZINC000822955419 599151624 /nfs/dbraw/zinc/15/16/24/599151624.db2.gz UOLVHFCYPNGJPC-UHFFFAOYSA-N -1 3 365.384 3.767 20 0 FHADHM CC[C@H]1CCC[C@@H](OC(=O)CSCc2ccc(-c3nnn[n-]3)cc2)C1 ZINC000736401907 599156220 /nfs/dbraw/zinc/15/62/20/599156220.db2.gz ZXJIUKTWMWETMJ-XJKSGUPXSA-N -1 3 360.483 3.612 20 0 FHADHM CC[C@H]1CCC[C@@H](OC(=O)CSCc2ccc(-c3nn[n-]n3)cc2)C1 ZINC000736401907 599156223 /nfs/dbraw/zinc/15/62/23/599156223.db2.gz ZXJIUKTWMWETMJ-XJKSGUPXSA-N -1 3 360.483 3.612 20 0 FHADHM CC[C@@H]1CCC[C@@H](OC(=O)CSCc2ccc(-c3nnn[n-]3)cc2)C1 ZINC000736401906 599156276 /nfs/dbraw/zinc/15/62/76/599156276.db2.gz ZXJIUKTWMWETMJ-CZUORRHYSA-N -1 3 360.483 3.612 20 0 FHADHM CC[C@@H]1CCC[C@@H](OC(=O)CSCc2ccc(-c3nn[n-]n3)cc2)C1 ZINC000736401906 599156278 /nfs/dbraw/zinc/15/62/78/599156278.db2.gz ZXJIUKTWMWETMJ-CZUORRHYSA-N -1 3 360.483 3.612 20 0 FHADHM Clc1cccc(SCc2nnc(-c3ccc(-c4nnn[n-]4)cc3)o2)c1 ZINC000737575262 599167196 /nfs/dbraw/zinc/16/71/96/599167196.db2.gz OHSCKUGPXLBDSB-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1cccc(SCc2nnc(-c3ccc(-c4nn[n-]n4)cc3)o2)c1 ZINC000737575262 599167199 /nfs/dbraw/zinc/16/71/99/599167199.db2.gz OHSCKUGPXLBDSB-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1cccc(SCc2nnc(-c3cccc(-c4nnn[n-]4)c3)o2)c1 ZINC000737574374 599167236 /nfs/dbraw/zinc/16/72/36/599167236.db2.gz JBODOWXRVFOONU-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1cccc(SCc2nnc(-c3cccc(-c4nn[n-]n4)c3)o2)c1 ZINC000737574374 599167237 /nfs/dbraw/zinc/16/72/37/599167237.db2.gz JBODOWXRVFOONU-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM CC(C)(C)c1ccc([C@H](O)CNc2c(F)cc(-c3nnn[n-]3)cc2F)cc1 ZINC000735650510 599170971 /nfs/dbraw/zinc/17/09/71/599170971.db2.gz PFNXCMXUSZUIIJ-MRXNPFEDSA-N -1 3 373.407 3.588 20 0 FHADHM CC(C)(C)c1ccc([C@H](O)CNc2c(F)cc(-c3nn[n-]n3)cc2F)cc1 ZINC000735650510 599170974 /nfs/dbraw/zinc/17/09/74/599170974.db2.gz PFNXCMXUSZUIIJ-MRXNPFEDSA-N -1 3 373.407 3.588 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1 ZINC000525157457 599177370 /nfs/dbraw/zinc/17/73/70/599177370.db2.gz RXWZJCQJQHHPBV-LSDHHAIUSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1 ZINC000525157457 599177373 /nfs/dbraw/zinc/17/73/73/599177373.db2.gz RXWZJCQJQHHPBV-LSDHHAIUSA-N -1 3 374.231 3.916 20 0 FHADHM CC(=CC(=O)Nc1ccc(-c2nnn[n-]2)cc1)c1ccccc1C(F)(F)F ZINC000735447090 599177588 /nfs/dbraw/zinc/17/75/88/599177588.db2.gz IQJUOWRYQMUJIT-ZHACJKMWSA-N -1 3 373.338 3.928 20 0 FHADHM CC(=CC(=O)Nc1ccc(-c2nn[n-]n2)cc1)c1ccccc1C(F)(F)F ZINC000735447090 599177589 /nfs/dbraw/zinc/17/75/89/599177589.db2.gz IQJUOWRYQMUJIT-ZHACJKMWSA-N -1 3 373.338 3.928 20 0 FHADHM Cc1sc(NC(=O)[C@H]2CCSc3ccccc32)c(-c2nnn[n-]2)c1C ZINC000737559862 599178660 /nfs/dbraw/zinc/17/86/60/599178660.db2.gz BJPNSSHFXTWPQD-LBPRGKRZSA-N -1 3 371.491 3.763 20 0 FHADHM Cc1sc(NC(=O)[C@H]2CCSc3ccccc32)c(-c2nn[n-]n2)c1C ZINC000737559862 599178661 /nfs/dbraw/zinc/17/86/61/599178661.db2.gz BJPNSSHFXTWPQD-LBPRGKRZSA-N -1 3 371.491 3.763 20 0 FHADHM C[C@@H](C(=O)Nc1sccc1-c1nnn[n-]1)c1ccccc1C(F)(F)F ZINC000735571447 599178990 /nfs/dbraw/zinc/17/89/90/599178990.db2.gz XFPJNIVNTLWYAJ-MRVPVSSYSA-N -1 3 367.356 3.689 20 0 FHADHM C[C@@H](C(=O)Nc1sccc1-c1nn[n-]n1)c1ccccc1C(F)(F)F ZINC000735571447 599178993 /nfs/dbraw/zinc/17/89/93/599178993.db2.gz XFPJNIVNTLWYAJ-MRVPVSSYSA-N -1 3 367.356 3.689 20 0 FHADHM O=C(Oc1ccc(-c2ccc(-c3nnn[n-]3)cc2)cc1)[C@@H]1Cc2ccccc21 ZINC000738250612 599179620 /nfs/dbraw/zinc/17/96/20/599179620.db2.gz JBCREXGIBAHIHA-HXUWFJFHSA-N -1 3 368.396 3.779 20 0 FHADHM O=C(Oc1ccc(-c2ccc(-c3nn[n-]n3)cc2)cc1)[C@@H]1Cc2ccccc21 ZINC000738250612 599179623 /nfs/dbraw/zinc/17/96/23/599179623.db2.gz JBCREXGIBAHIHA-HXUWFJFHSA-N -1 3 368.396 3.779 20 0 FHADHM CC(C)CN(C(=O)[C@H](C)c1cccc(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000735818642 599183989 /nfs/dbraw/zinc/18/39/89/599183989.db2.gz PNTVIUAXYWGKDG-CQSZACIVSA-N -1 3 367.428 3.799 20 0 FHADHM CC(C)CN(C(=O)[C@H](C)c1cccc(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000735818642 599183991 /nfs/dbraw/zinc/18/39/91/599183991.db2.gz PNTVIUAXYWGKDG-CQSZACIVSA-N -1 3 367.428 3.799 20 0 FHADHM Cc1ccncc1C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCCCC2 ZINC000737446134 599185438 /nfs/dbraw/zinc/18/54/38/599185438.db2.gz SSZCDCDJBVEHJH-UHFFFAOYSA-N -1 3 368.466 3.543 20 0 FHADHM Cc1ccncc1C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCCCC2 ZINC000737446134 599185440 /nfs/dbraw/zinc/18/54/40/599185440.db2.gz SSZCDCDJBVEHJH-UHFFFAOYSA-N -1 3 368.466 3.543 20 0 FHADHM Cc1ccncc1C(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)cc1 ZINC000737446801 599185624 /nfs/dbraw/zinc/18/56/24/599185624.db2.gz ZKTOBLNPQSIFRI-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccncc1C(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)cc1 ZINC000737446801 599185625 /nfs/dbraw/zinc/18/56/25/599185625.db2.gz ZKTOBLNPQSIFRI-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H](C)c2cccc(F)c2)c1-c1nnn[n-]1 ZINC000736669775 599186202 /nfs/dbraw/zinc/18/62/02/599186202.db2.gz KNNPCYQYVRECNZ-SECBINFHSA-N -1 3 359.430 3.680 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H](C)c2cccc(F)c2)c1-c1nn[n-]n1 ZINC000736669775 599186203 /nfs/dbraw/zinc/18/62/03/599186203.db2.gz KNNPCYQYVRECNZ-SECBINFHSA-N -1 3 359.430 3.680 20 0 FHADHM Cc1ccccc1[C@@H](C)CC(=O)OCc1ccc(F)cc1-c1nnn[n-]1 ZINC000737423340 599186688 /nfs/dbraw/zinc/18/66/88/599186688.db2.gz QPVLQVLQMMYECF-ZDUSSCGKSA-N -1 3 354.385 3.551 20 0 FHADHM Cc1ccccc1[C@@H](C)CC(=O)OCc1ccc(F)cc1-c1nn[n-]n1 ZINC000737423340 599186691 /nfs/dbraw/zinc/18/66/91/599186691.db2.gz QPVLQVLQMMYECF-ZDUSSCGKSA-N -1 3 354.385 3.551 20 0 FHADHM C[C@H](NC(=O)N1CCC[C@H](C(C)(C)C)CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736113521 599187303 /nfs/dbraw/zinc/18/73/03/599187303.db2.gz OWUIMUIOJYQZQM-YOEHRIQHSA-N -1 3 370.501 3.786 20 0 FHADHM C[C@H](NC(=O)N1CCC[C@H](C(C)(C)C)CC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736113521 599187306 /nfs/dbraw/zinc/18/73/06/599187306.db2.gz OWUIMUIOJYQZQM-YOEHRIQHSA-N -1 3 370.501 3.786 20 0 FHADHM CCN(CC)C(=O)c1cccc(Oc2ccc(Cl)cc2-c2nnn[n-]2)c1 ZINC000736529824 599193072 /nfs/dbraw/zinc/19/30/72/599193072.db2.gz SZNKLINJUIHBNR-UHFFFAOYSA-N -1 3 371.828 3.794 20 0 FHADHM CCN(CC)C(=O)c1cccc(Oc2ccc(Cl)cc2-c2nn[n-]n2)c1 ZINC000736529824 599193073 /nfs/dbraw/zinc/19/30/73/599193073.db2.gz SZNKLINJUIHBNR-UHFFFAOYSA-N -1 3 371.828 3.794 20 0 FHADHM CC=CC=CC(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1 ZINC000820832780 599219658 /nfs/dbraw/zinc/21/96/58/599219658.db2.gz NQVCXMOCSBAASG-DSXPNFDZSA-N -1 3 365.368 3.869 20 0 FHADHM CC=CC=CC(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1 ZINC000820832780 599219659 /nfs/dbraw/zinc/21/96/59/599219659.db2.gz NQVCXMOCSBAASG-DSXPNFDZSA-N -1 3 365.368 3.869 20 0 FHADHM CCc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)c2sccc2-c2nnn[n-]2)o1 ZINC000821480823 599221059 /nfs/dbraw/zinc/22/10/59/599221059.db2.gz FIWQVMBYGDGAMO-FZMZJTMJSA-N -1 3 371.466 3.697 20 0 FHADHM CCc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)c2sccc2-c2nn[n-]n2)o1 ZINC000821480823 599221061 /nfs/dbraw/zinc/22/10/61/599221061.db2.gz FIWQVMBYGDGAMO-FZMZJTMJSA-N -1 3 371.466 3.697 20 0 FHADHM C[C@@H]1CN(C(=O)C=Cc2ccccc2-c2nnn[n-]2)CC[C@@H]1c1ccccc1 ZINC000736278843 599222894 /nfs/dbraw/zinc/22/28/94/599222894.db2.gz IVZCXRHRNZZKGZ-VVSAXJSQSA-N -1 3 373.460 3.532 20 0 FHADHM C[C@@H]1CN(C(=O)C=Cc2ccccc2-c2nn[n-]n2)CC[C@@H]1c1ccccc1 ZINC000736278843 599222895 /nfs/dbraw/zinc/22/28/95/599222895.db2.gz IVZCXRHRNZZKGZ-VVSAXJSQSA-N -1 3 373.460 3.532 20 0 FHADHM CCOc1ccccc1OCCSCc1ccc(F)cc1-c1nnn[n-]1 ZINC000821437522 599223165 /nfs/dbraw/zinc/22/31/65/599223165.db2.gz OWKXRXXZJCRXJQ-UHFFFAOYSA-N -1 3 374.441 3.717 20 0 FHADHM CCOc1ccccc1OCCSCc1ccc(F)cc1-c1nn[n-]n1 ZINC000821437522 599223169 /nfs/dbraw/zinc/22/31/69/599223169.db2.gz OWKXRXXZJCRXJQ-UHFFFAOYSA-N -1 3 374.441 3.717 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)N[C@H](CC1CC1)c1ccccc1 ZINC000737795580 599224652 /nfs/dbraw/zinc/22/46/52/599224652.db2.gz ASURKNCXVSFSBG-JXOMPUQVSA-N -1 3 359.433 3.538 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)N[C@H](CC1CC1)c1ccccc1 ZINC000737795580 599224655 /nfs/dbraw/zinc/22/46/55/599224655.db2.gz ASURKNCXVSFSBG-JXOMPUQVSA-N -1 3 359.433 3.538 20 0 FHADHM C[C@@H](CCSc1ccccc1)OC(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000820247740 607261778 /nfs/dbraw/zinc/26/17/78/607261778.db2.gz AEGBVMXPVSAJPE-NSHDSACASA-N -1 3 360.464 3.656 20 0 FHADHM C[C@@H](CCSc1ccccc1)OC(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000820247740 607261779 /nfs/dbraw/zinc/26/17/79/607261779.db2.gz AEGBVMXPVSAJPE-NSHDSACASA-N -1 3 360.464 3.656 20 0 FHADHM O=C(Nc1ccc(OC2CCCC2)c(F)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000738172393 599234609 /nfs/dbraw/zinc/23/46/09/599234609.db2.gz IOKXFHYACALLET-UHFFFAOYSA-N -1 3 367.384 3.580 20 0 FHADHM O=C(Nc1ccc(OC2CCCC2)c(F)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000738172393 599234611 /nfs/dbraw/zinc/23/46/11/599234611.db2.gz IOKXFHYACALLET-UHFFFAOYSA-N -1 3 367.384 3.580 20 0 FHADHM Cc1ccc(C(=O)Nc2cccc(-c3nnn[n-]3)c2C)cc1-n1cccc1 ZINC000822227306 607268461 /nfs/dbraw/zinc/26/84/61/607268461.db2.gz CTZPFSAGNURYMR-UHFFFAOYSA-N -1 3 358.405 3.527 20 0 FHADHM Cc1ccc(C(=O)Nc2cccc(-c3nn[n-]n3)c2C)cc1-n1cccc1 ZINC000822227306 607268462 /nfs/dbraw/zinc/26/84/62/607268462.db2.gz CTZPFSAGNURYMR-UHFFFAOYSA-N -1 3 358.405 3.527 20 0 FHADHM Cc1c(NC(=O)CCSc2ccccc2Cl)cccc1-c1nnn[n-]1 ZINC000822066665 607266890 /nfs/dbraw/zinc/26/68/90/607266890.db2.gz HACXBEWAGPNFDM-UHFFFAOYSA-N -1 3 373.869 3.949 20 0 FHADHM Cc1c(NC(=O)CCSc2ccccc2Cl)cccc1-c1nn[n-]n1 ZINC000822066665 607266891 /nfs/dbraw/zinc/26/68/91/607266891.db2.gz HACXBEWAGPNFDM-UHFFFAOYSA-N -1 3 373.869 3.949 20 0 FHADHM CCCC[C@H](CC)CNC(=S)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821039465 599238508 /nfs/dbraw/zinc/23/85/08/599238508.db2.gz CFNXGIJGUBQTEK-KBPBESRZSA-N -1 3 360.531 3.608 20 0 FHADHM CCCC[C@H](CC)CNC(=S)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821039465 599238510 /nfs/dbraw/zinc/23/85/10/599238510.db2.gz CFNXGIJGUBQTEK-KBPBESRZSA-N -1 3 360.531 3.608 20 0 FHADHM C[C@@H](NC(=S)Nc1ccc(Cl)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000820403973 599238617 /nfs/dbraw/zinc/23/86/17/599238617.db2.gz OFUSEIWXERRWHO-SNVBAGLBSA-N -1 3 358.858 3.568 20 0 FHADHM C[C@@H](NC(=S)Nc1ccc(Cl)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000820403973 599238619 /nfs/dbraw/zinc/23/86/19/599238619.db2.gz OFUSEIWXERRWHO-SNVBAGLBSA-N -1 3 358.858 3.568 20 0 FHADHM Cc1ccc(NC(=S)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1C ZINC000822254432 599239275 /nfs/dbraw/zinc/23/92/75/599239275.db2.gz JQNCTYXQFBZDTC-CYBMUJFWSA-N -1 3 352.467 3.531 20 0 FHADHM Cc1ccc(NC(=S)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1C ZINC000822254432 599239277 /nfs/dbraw/zinc/23/92/77/599239277.db2.gz JQNCTYXQFBZDTC-CYBMUJFWSA-N -1 3 352.467 3.531 20 0 FHADHM Cc1c(NC(=O)CSCc2cccc(Cl)c2)cccc1-c1nnn[n-]1 ZINC000822077132 607269900 /nfs/dbraw/zinc/26/99/00/607269900.db2.gz UEFMOMZGFSXRLC-UHFFFAOYSA-N -1 3 373.869 3.700 20 0 FHADHM Cc1c(NC(=O)CSCc2cccc(Cl)c2)cccc1-c1nn[n-]n1 ZINC000822077132 607269901 /nfs/dbraw/zinc/26/99/01/607269901.db2.gz UEFMOMZGFSXRLC-UHFFFAOYSA-N -1 3 373.869 3.700 20 0 FHADHM C[C@@H]1CN(C(=O)Nc2ccc(-c3nnn[n-]3)cc2)CC[C@@H]1c1ccccc1 ZINC000820742917 599240597 /nfs/dbraw/zinc/24/05/97/599240597.db2.gz NSTMVLFLSGJCAA-KDOFPFPSSA-N -1 3 362.437 3.524 20 0 FHADHM C[C@@H]1CN(C(=O)Nc2ccc(-c3nn[n-]n3)cc2)CC[C@@H]1c1ccccc1 ZINC000820742917 599240599 /nfs/dbraw/zinc/24/05/99/599240599.db2.gz NSTMVLFLSGJCAA-KDOFPFPSSA-N -1 3 362.437 3.524 20 0 FHADHM CC[C@H](Cc1ccc(C)cc1)N(C)C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000820916143 599245189 /nfs/dbraw/zinc/24/51/89/599245189.db2.gz ZLBLYCUYBFQUKO-GOSISDBHSA-N -1 3 364.453 3.660 20 0 FHADHM CC[C@H](Cc1ccc(C)cc1)N(C)C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000820916143 599245192 /nfs/dbraw/zinc/24/51/92/599245192.db2.gz ZLBLYCUYBFQUKO-GOSISDBHSA-N -1 3 364.453 3.660 20 0 FHADHM CCc1ccc([C@H]2CCCN2C(=S)Nc2ccccc2-c2nnn[n-]2)o1 ZINC000736688502 599246419 /nfs/dbraw/zinc/24/64/19/599246419.db2.gz WAUHJUFANLPREX-OAHLLOKOSA-N -1 3 368.466 3.556 20 0 FHADHM CCc1ccc([C@H]2CCCN2C(=S)Nc2ccccc2-c2nn[n-]n2)o1 ZINC000736688502 599246421 /nfs/dbraw/zinc/24/64/21/599246421.db2.gz WAUHJUFANLPREX-OAHLLOKOSA-N -1 3 368.466 3.556 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)/C=C\C1CCCCC1 ZINC000735830851 599247763 /nfs/dbraw/zinc/24/77/63/599247763.db2.gz KCKVFJITUGLGAG-RAXLEYEMSA-N -1 3 367.497 3.988 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)/C=C\C1CCCCC1 ZINC000735830851 599247766 /nfs/dbraw/zinc/24/77/66/599247766.db2.gz KCKVFJITUGLGAG-RAXLEYEMSA-N -1 3 367.497 3.988 20 0 FHADHM Cc1c(NC(=O)N[C@H]2CCc3cc(Cl)ccc32)cccc1-c1nnn[n-]1 ZINC000822088863 607284729 /nfs/dbraw/zinc/28/47/29/607284729.db2.gz AKYDUAGFKFXIIA-INIZCTEOSA-N -1 3 368.828 3.638 20 0 FHADHM Cc1c(NC(=O)N[C@H]2CCc3cc(Cl)ccc32)cccc1-c1nn[n-]n1 ZINC000822088863 607284730 /nfs/dbraw/zinc/28/47/30/607284730.db2.gz AKYDUAGFKFXIIA-INIZCTEOSA-N -1 3 368.828 3.638 20 0 FHADHM CC[C@@H](Cc1ccccc1)N(C)C(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000820915303 607289646 /nfs/dbraw/zinc/28/96/46/607289646.db2.gz VBYWJZAJAARTMQ-INIZCTEOSA-N -1 3 364.453 3.660 20 0 FHADHM CC[C@@H](Cc1ccccc1)N(C)C(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000820915303 607289647 /nfs/dbraw/zinc/28/96/47/607289647.db2.gz VBYWJZAJAARTMQ-INIZCTEOSA-N -1 3 364.453 3.660 20 0 FHADHM CC[C@H](c1ccncc1)N(CC)C(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000820945478 607291354 /nfs/dbraw/zinc/29/13/54/607291354.db2.gz ULTYTBVXNXPKMI-QGZVFWFLSA-N -1 3 365.441 3.575 20 0 FHADHM CC[C@H](c1ccncc1)N(CC)C(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000820945478 607291355 /nfs/dbraw/zinc/29/13/55/607291355.db2.gz ULTYTBVXNXPKMI-QGZVFWFLSA-N -1 3 365.441 3.575 20 0 FHADHM Cc1c(NC(=O)c2ccc(F)cc2C(F)(F)F)cccc1-c1nnn[n-]1 ZINC000822108991 607294403 /nfs/dbraw/zinc/29/44/03/607294403.db2.gz OBIUDMHXBFUUKM-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM Cc1c(NC(=O)c2ccc(F)cc2C(F)(F)F)cccc1-c1nn[n-]n1 ZINC000822108991 607294404 /nfs/dbraw/zinc/29/44/04/607294404.db2.gz OBIUDMHXBFUUKM-UHFFFAOYSA-N -1 3 365.290 3.585 20 0 FHADHM Cc1c(NC(=O)C2(c3cccc(F)c3)CCCC2)cccc1-c1nnn[n-]1 ZINC000822061378 607294858 /nfs/dbraw/zinc/29/48/58/607294858.db2.gz MWLNYVILANLLJT-UHFFFAOYSA-N -1 3 365.412 3.765 20 0 FHADHM Cc1c(NC(=O)C2(c3cccc(F)c3)CCCC2)cccc1-c1nn[n-]n1 ZINC000822061378 607294859 /nfs/dbraw/zinc/29/48/59/607294859.db2.gz MWLNYVILANLLJT-UHFFFAOYSA-N -1 3 365.412 3.765 20 0 FHADHM CC[C@@]1(C)CCCN(C(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(C)C)C1 ZINC000820950702 599264664 /nfs/dbraw/zinc/26/46/64/599264664.db2.gz QZMRMUZEGQAZSB-IBGZPJMESA-N -1 3 372.473 3.698 20 0 FHADHM CC[C@@]1(C)CCCN(C(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(C)C)C1 ZINC000820950702 599264665 /nfs/dbraw/zinc/26/46/65/599264665.db2.gz QZMRMUZEGQAZSB-IBGZPJMESA-N -1 3 372.473 3.698 20 0 FHADHM Clc1cc(NCc2cc(-c3nnn[n-]3)cs2)ccc1N1CCCC1 ZINC000822568608 607315200 /nfs/dbraw/zinc/31/52/00/607315200.db2.gz TVTNZNLMXFNTFE-UHFFFAOYSA-N -1 3 360.874 3.794 20 0 FHADHM Clc1cc(NCc2cc(-c3nn[n-]n3)cs2)ccc1N1CCCC1 ZINC000822568608 607315201 /nfs/dbraw/zinc/31/52/01/607315201.db2.gz TVTNZNLMXFNTFE-UHFFFAOYSA-N -1 3 360.874 3.794 20 0 FHADHM c1nc(COc2cccc(NCc3cccc(-c4nnn[n-]4)c3)c2)cs1 ZINC000823757053 607315486 /nfs/dbraw/zinc/31/54/86/607315486.db2.gz KGFAZQBFDZTGHX-UHFFFAOYSA-N -1 3 364.434 3.514 20 0 FHADHM c1nc(COc2cccc(NCc3cccc(-c4nn[n-]n4)c3)c2)cs1 ZINC000823757053 607315487 /nfs/dbraw/zinc/31/54/87/607315487.db2.gz KGFAZQBFDZTGHX-UHFFFAOYSA-N -1 3 364.434 3.514 20 0 FHADHM Cc1cccc(-c2ccc(CNc3nnc(C)c(C)c3-c3nnn[n-]3)cc2)c1 ZINC000737378559 599268618 /nfs/dbraw/zinc/26/86/18/599268618.db2.gz DGFZIERXJGJRNM-UHFFFAOYSA-N -1 3 371.448 3.861 20 0 FHADHM Cc1cccc(-c2ccc(CNc3nnc(C)c(C)c3-c3nn[n-]n3)cc2)c1 ZINC000737378559 599268619 /nfs/dbraw/zinc/26/86/19/599268619.db2.gz DGFZIERXJGJRNM-UHFFFAOYSA-N -1 3 371.448 3.861 20 0 FHADHM Cc1cc(N2CCCC[C@H]2C)ccc1NCc1ccc(-c2nnn[n-]2)o1 ZINC000822207340 607318603 /nfs/dbraw/zinc/31/86/03/607318603.db2.gz SFSGMIVEXBMBKR-CQSZACIVSA-N -1 3 352.442 3.759 20 0 FHADHM Cc1cc(N2CCCC[C@H]2C)ccc1NCc1ccc(-c2nn[n-]n2)o1 ZINC000822207340 607318604 /nfs/dbraw/zinc/31/86/04/607318604.db2.gz SFSGMIVEXBMBKR-CQSZACIVSA-N -1 3 352.442 3.759 20 0 FHADHM C[C@H](Sc1nnc(-c2ccccc2F)o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736193253 599287664 /nfs/dbraw/zinc/28/76/64/599287664.db2.gz QRPQBTHUFJMQCL-JTQLQIEISA-N -1 3 368.397 3.909 20 0 FHADHM C[C@H](Sc1nnc(-c2ccccc2F)o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736193253 599287666 /nfs/dbraw/zinc/28/76/66/599287666.db2.gz QRPQBTHUFJMQCL-JTQLQIEISA-N -1 3 368.397 3.909 20 0 FHADHM C[C@H](Sc1nnc(-c2cccs2)o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736192413 599287699 /nfs/dbraw/zinc/28/76/99/599287699.db2.gz MQBMUQNDFBJHMV-VIFPVBQESA-N -1 3 356.436 3.832 20 0 FHADHM C[C@H](Sc1nnc(-c2cccs2)o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736192413 599287701 /nfs/dbraw/zinc/28/77/01/599287701.db2.gz MQBMUQNDFBJHMV-VIFPVBQESA-N -1 3 356.436 3.832 20 0 FHADHM C[C@H](Sc1nnc(Cc2cccs2)o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736192766 599289582 /nfs/dbraw/zinc/28/95/82/599289582.db2.gz NKLBYGKWFWVPMK-JTQLQIEISA-N -1 3 370.463 3.755 20 0 FHADHM C[C@H](Sc1nnc(Cc2cccs2)o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736192766 599289584 /nfs/dbraw/zinc/28/95/84/599289584.db2.gz NKLBYGKWFWVPMK-JTQLQIEISA-N -1 3 370.463 3.755 20 0 FHADHM C[C@H](NC(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)C1CCCC1 ZINC000820372869 599290879 /nfs/dbraw/zinc/29/08/79/599290879.db2.gz CPWXSQCCRIUITG-VIFPVBQESA-N -1 3 368.363 3.586 20 0 FHADHM C[C@H](NC(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)C1CCCC1 ZINC000820372869 599290880 /nfs/dbraw/zinc/29/08/80/599290880.db2.gz CPWXSQCCRIUITG-VIFPVBQESA-N -1 3 368.363 3.586 20 0 FHADHM CCCC(C)(C)NC(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000821009427 599291780 /nfs/dbraw/zinc/29/17/80/599291780.db2.gz RCZNLQZZNNKTJJ-UHFFFAOYSA-N -1 3 356.352 3.586 20 0 FHADHM CCCC(C)(C)NC(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000821009427 599291782 /nfs/dbraw/zinc/29/17/82/599291782.db2.gz RCZNLQZZNNKTJJ-UHFFFAOYSA-N -1 3 356.352 3.586 20 0 FHADHM CCC(CC)n1ccc(CSCCOc2ccccc2-c2nnn[n-]2)n1 ZINC000820897379 607325832 /nfs/dbraw/zinc/32/58/32/607325832.db2.gz BUPVHQCVFCMCLB-UHFFFAOYSA-N -1 3 372.498 3.737 20 0 FHADHM CCC(CC)n1ccc(CSCCOc2ccccc2-c2nn[n-]n2)n1 ZINC000820897379 607325833 /nfs/dbraw/zinc/32/58/33/607325833.db2.gz BUPVHQCVFCMCLB-UHFFFAOYSA-N -1 3 372.498 3.737 20 0 FHADHM Clc1ccc(-c2oncc2CNc2cccc(-c3nnn[n-]3)c2)s1 ZINC000822573709 607332062 /nfs/dbraw/zinc/33/20/62/607332062.db2.gz FRNMEJMWZZESNG-UHFFFAOYSA-N -1 3 358.814 3.849 20 0 FHADHM Clc1ccc(-c2oncc2CNc2cccc(-c3nn[n-]n3)c2)s1 ZINC000822573709 607332063 /nfs/dbraw/zinc/33/20/63/607332063.db2.gz FRNMEJMWZZESNG-UHFFFAOYSA-N -1 3 358.814 3.849 20 0 FHADHM O=C(Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)[C@H]1CC=CCC1 ZINC000738183516 598231032 /nfs/dbraw/zinc/23/10/32/598231032.db2.gz IUADQHJDWGHQFQ-HNNXBMFYSA-N -1 3 361.405 3.954 20 0 FHADHM O=C(Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)[C@H]1CC=CCC1 ZINC000738183516 598231033 /nfs/dbraw/zinc/23/10/33/598231033.db2.gz IUADQHJDWGHQFQ-HNNXBMFYSA-N -1 3 361.405 3.954 20 0 FHADHM C/C(=C\C(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)C1CC1 ZINC000735448126 598231051 /nfs/dbraw/zinc/23/10/51/598231051.db2.gz PRBAJBQDVRNURL-ACCUITESSA-N -1 3 361.405 3.954 20 0 FHADHM C/C(=C\C(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)C1CC1 ZINC000735448126 598231053 /nfs/dbraw/zinc/23/10/53/598231053.db2.gz PRBAJBQDVRNURL-ACCUITESSA-N -1 3 361.405 3.954 20 0 FHADHM Fc1cccc(Sc2n[nH]c(-c3ccc(Cl)cc3)n2)c1-c1nnn[n-]1 ZINC000737664649 598237095 /nfs/dbraw/zinc/23/70/95/598237095.db2.gz MLTFTXJPUJYFRJ-UHFFFAOYSA-N -1 3 373.804 3.596 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1NCc1ccc(OCC(F)(F)F)cc1 ZINC000737645440 598237189 /nfs/dbraw/zinc/23/71/89/598237189.db2.gz YIMHTORWOBSBRH-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM CC(C)c1ccc(C(C)(C)NC(=O)Cc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000735923471 598239011 /nfs/dbraw/zinc/23/90/11/598239011.db2.gz UZSQSLBEPXJXOH-UHFFFAOYSA-N -1 3 363.465 3.584 20 0 FHADHM CC(C)c1ccc(C(C)(C)NC(=O)Cc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000735923471 598239013 /nfs/dbraw/zinc/23/90/13/598239013.db2.gz UZSQSLBEPXJXOH-UHFFFAOYSA-N -1 3 363.465 3.584 20 0 FHADHM Fc1cccc(N2CCC[C@@H](c3nc4ccccc4o3)C2)c1-c1nnn[n-]1 ZINC000737661023 598239164 /nfs/dbraw/zinc/23/91/64/598239164.db2.gz MMRGTLZHXDJPEK-GFCCVEGCSA-N -1 3 364.384 3.531 20 0 FHADHM Fc1cccc(N2CCC[C@@H](c3nc4ccccc4o3)C2)c1-c1nn[n-]n1 ZINC000737661023 598239166 /nfs/dbraw/zinc/23/91/66/598239166.db2.gz MMRGTLZHXDJPEK-GFCCVEGCSA-N -1 3 364.384 3.531 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1N[C@H]1CCc2cc(Br)ccc21 ZINC000737640788 598240638 /nfs/dbraw/zinc/24/06/38/598240638.db2.gz QJTHKCKPGCZVIE-AWEZNQCLSA-N -1 3 374.217 3.868 20 0 FHADHM CC[C@H](C)[C@H](C)N(C(=O)CSCc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000736334571 598240980 /nfs/dbraw/zinc/24/09/80/598240980.db2.gz XFJRPHUCCVEPDU-KBPBESRZSA-N -1 3 373.526 3.526 20 0 FHADHM CC[C@H](C)[C@H](C)N(C(=O)CSCc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000736334571 598240981 /nfs/dbraw/zinc/24/09/81/598240981.db2.gz XFJRPHUCCVEPDU-KBPBESRZSA-N -1 3 373.526 3.526 20 0 FHADHM O=C(Nc1cccnc1)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000738194432 598254852 /nfs/dbraw/zinc/25/48/52/598254852.db2.gz ALAIZWBOCKBSCV-UHFFFAOYSA-N -1 3 373.376 3.698 20 0 FHADHM O=C(CCSc1cccc(Cl)c1)Nc1sccc1-c1nnn[n-]1 ZINC000737849469 598294052 /nfs/dbraw/zinc/29/40/52/598294052.db2.gz FNMZVMZZDYSWHT-UHFFFAOYSA-N -1 3 365.871 3.703 20 0 FHADHM O=C(CCSc1cccc(Cl)c1)Nc1sccc1-c1nn[n-]n1 ZINC000737849469 598294053 /nfs/dbraw/zinc/29/40/53/598294053.db2.gz FNMZVMZZDYSWHT-UHFFFAOYSA-N -1 3 365.871 3.703 20 0 FHADHM CC(C)N(Cc1cccs1)C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736112089 598303701 /nfs/dbraw/zinc/30/37/01/598303701.db2.gz PMHKXXPTGMMNMO-CYBMUJFWSA-N -1 3 370.482 3.609 20 0 FHADHM CC(C)N(Cc1cccs1)C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736112089 598303702 /nfs/dbraw/zinc/30/37/02/598303702.db2.gz PMHKXXPTGMMNMO-CYBMUJFWSA-N -1 3 370.482 3.609 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1CNc1ncc(C(F)(F)F)cc1Cl ZINC000737639479 598310668 /nfs/dbraw/zinc/31/06/68/598310668.db2.gz CPDBZJYELAEIPY-UHFFFAOYSA-N -1 3 372.713 3.685 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CNc1ncc(C(F)(F)F)cc1Cl ZINC000737639479 598310670 /nfs/dbraw/zinc/31/06/70/598310670.db2.gz CPDBZJYELAEIPY-UHFFFAOYSA-N -1 3 372.713 3.685 20 0 FHADHM CN(C(=O)c1cc(Cl)cc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1F ZINC000736747662 598311917 /nfs/dbraw/zinc/31/19/17/598311917.db2.gz FRHATUJQDOXIJR-UHFFFAOYSA-N -1 3 366.183 3.589 20 0 FHADHM CN(C(=O)c1cc(Cl)cc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1F ZINC000736747662 598311918 /nfs/dbraw/zinc/31/19/18/598311918.db2.gz FRHATUJQDOXIJR-UHFFFAOYSA-N -1 3 366.183 3.589 20 0 FHADHM c1sc(-c2ccccn2)nc1CSCc1cccc(-c2nnn[n-]2)c1 ZINC000738422583 598314467 /nfs/dbraw/zinc/31/44/67/598314467.db2.gz JSMDKKGAIPQOOS-UHFFFAOYSA-N -1 3 366.475 3.819 20 0 FHADHM c1sc(-c2ccccn2)nc1CSCc1cccc(-c2nn[n-]n2)c1 ZINC000738422583 598314469 /nfs/dbraw/zinc/31/44/69/598314469.db2.gz JSMDKKGAIPQOOS-UHFFFAOYSA-N -1 3 366.475 3.819 20 0 FHADHM C[C@H]1Cc2ccccc2N1C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736295863 598315466 /nfs/dbraw/zinc/31/54/66/598315466.db2.gz AKIZOWIXYNULJA-JTQLQIEISA-N -1 3 370.869 3.668 20 0 FHADHM C[C@H]1Cc2ccccc2N1C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736295863 598315468 /nfs/dbraw/zinc/31/54/68/598315468.db2.gz AKIZOWIXYNULJA-JTQLQIEISA-N -1 3 370.869 3.668 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1CNCc1cccc(Cl)c1Cl ZINC000737638432 598315972 /nfs/dbraw/zinc/31/59/72/598315972.db2.gz GYNAMWZMISMTJS-UHFFFAOYSA-N -1 3 352.200 3.602 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CNCc1cccc(Cl)c1Cl ZINC000737638432 598315974 /nfs/dbraw/zinc/31/59/74/598315974.db2.gz GYNAMWZMISMTJS-UHFFFAOYSA-N -1 3 352.200 3.602 20 0 FHADHM S=C(NCCC1=CCCCC1)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000738400188 598317631 /nfs/dbraw/zinc/31/76/31/598317631.db2.gz AAYPJTKEFWZBNH-UHFFFAOYSA-N -1 3 362.890 3.697 20 0 FHADHM S=C(NCCC1=CCCCC1)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000738400188 598317633 /nfs/dbraw/zinc/31/76/33/598317633.db2.gz AAYPJTKEFWZBNH-UHFFFAOYSA-N -1 3 362.890 3.697 20 0 FHADHM CCC(CC)CN(CC)C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736336156 598320078 /nfs/dbraw/zinc/32/00/78/598320078.db2.gz ABMDHOOPAYHOQW-UHFFFAOYSA-N -1 3 366.922 3.975 20 0 FHADHM CCC(CC)CN(CC)C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736336156 598320080 /nfs/dbraw/zinc/32/00/80/598320080.db2.gz ABMDHOOPAYHOQW-UHFFFAOYSA-N -1 3 366.922 3.975 20 0 FHADHM CC1CCC(CNC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)CC1 ZINC000736236114 598322165 /nfs/dbraw/zinc/32/21/65/598322165.db2.gz HHCPEUGLYOJAEL-UHFFFAOYSA-N -1 3 364.906 3.633 20 0 FHADHM CC1CCC(CNC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)CC1 ZINC000736236114 598322167 /nfs/dbraw/zinc/32/21/67/598322167.db2.gz HHCPEUGLYOJAEL-UHFFFAOYSA-N -1 3 364.906 3.633 20 0 FHADHM Fc1cccc(NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c1F ZINC000737659218 598324237 /nfs/dbraw/zinc/32/42/37/598324237.db2.gz BBBFLNYTHHNKIB-UHFFFAOYSA-N -1 3 366.784 3.607 20 0 FHADHM Fc1cccc(NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c1F ZINC000737659218 598324240 /nfs/dbraw/zinc/32/42/40/598324240.db2.gz BBBFLNYTHHNKIB-UHFFFAOYSA-N -1 3 366.784 3.607 20 0 FHADHM CCC[C@@H](NC(=O)NCc1ccc(-c2nnn[n-]2)cc1F)C1CCCCC1 ZINC000736431382 598326706 /nfs/dbraw/zinc/32/67/06/598326706.db2.gz BQRWEZQMWXONIY-QGZVFWFLSA-N -1 3 374.464 3.554 20 0 FHADHM CCC[C@@H](NC(=O)NCc1ccc(-c2nn[n-]n2)cc1F)C1CCCCC1 ZINC000736431382 598326707 /nfs/dbraw/zinc/32/67/07/598326707.db2.gz BQRWEZQMWXONIY-QGZVFWFLSA-N -1 3 374.464 3.554 20 0 FHADHM CN(C(=O)[C@H]1CCCc2sccc21)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821569519 607352720 /nfs/dbraw/zinc/35/27/20/607352720.db2.gz MWNHNIBTQAXZSV-LBPRGKRZSA-N -1 3 373.869 3.665 20 0 FHADHM CN(C(=O)[C@H]1CCCc2sccc21)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821569519 607352721 /nfs/dbraw/zinc/35/27/21/607352721.db2.gz MWNHNIBTQAXZSV-LBPRGKRZSA-N -1 3 373.869 3.665 20 0 FHADHM C[C@@H](CC(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccccc1F ZINC000735975655 598364798 /nfs/dbraw/zinc/36/47/98/598364798.db2.gz NOLOJSDOLLMMRY-JTQLQIEISA-N -1 3 359.792 3.792 20 0 FHADHM C[C@@H](CC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccccc1F ZINC000735975655 598364799 /nfs/dbraw/zinc/36/47/99/598364799.db2.gz NOLOJSDOLLMMRY-JTQLQIEISA-N -1 3 359.792 3.792 20 0 FHADHM CN(Cc1ccc(Cl)cc1Cl)c1ncc(-c2nnn[n-]2)cc1Cl ZINC000736816662 598386361 /nfs/dbraw/zinc/38/63/61/598386361.db2.gz MOGAHPKWJBIBEH-UHFFFAOYSA-N -1 3 369.643 3.858 20 0 FHADHM CN(Cc1ccc(Cl)cc1Cl)c1ncc(-c2nn[n-]n2)cc1Cl ZINC000736816662 598386363 /nfs/dbraw/zinc/38/63/63/598386363.db2.gz MOGAHPKWJBIBEH-UHFFFAOYSA-N -1 3 369.643 3.858 20 0 FHADHM Fc1ccc(CNc2ncc(-c3nnn[n-]3)cc2Cl)c(C(F)(F)F)c1 ZINC000737650514 598390002 /nfs/dbraw/zinc/39/00/02/598390002.db2.gz SFKLEBOMMIOFGP-UHFFFAOYSA-N -1 3 372.713 3.685 20 0 FHADHM Fc1ccc(CNc2ncc(-c3nn[n-]n3)cc2Cl)c(C(F)(F)F)c1 ZINC000737650514 598390003 /nfs/dbraw/zinc/39/00/03/598390003.db2.gz SFKLEBOMMIOFGP-UHFFFAOYSA-N -1 3 372.713 3.685 20 0 FHADHM CN(Cc1cccc2ccccc21)c1ncc(-c2nnn[n-]2)cc1Cl ZINC000736828631 598390683 /nfs/dbraw/zinc/39/06/83/598390683.db2.gz PRCUMRQRERAUSZ-UHFFFAOYSA-N -1 3 350.813 3.705 20 0 FHADHM CN(Cc1cccc2ccccc21)c1ncc(-c2nn[n-]n2)cc1Cl ZINC000736828631 598390685 /nfs/dbraw/zinc/39/06/85/598390685.db2.gz PRCUMRQRERAUSZ-UHFFFAOYSA-N -1 3 350.813 3.705 20 0 FHADHM Cc1ccccc1C1CCN(C(=O)C=Cc2ccccc2-c2nnn[n-]2)CC1 ZINC000737422033 598397689 /nfs/dbraw/zinc/39/76/89/598397689.db2.gz KOIAGILEWCEPTN-KHPPLWFESA-N -1 3 373.460 3.595 20 0 FHADHM Cc1ccccc1C1CCN(C(=O)C=Cc2ccccc2-c2nn[n-]n2)CC1 ZINC000737422033 598397691 /nfs/dbraw/zinc/39/76/91/598397691.db2.gz KOIAGILEWCEPTN-KHPPLWFESA-N -1 3 373.460 3.595 20 0 FHADHM C[C@@H](Sc1ccc(-c2nnn[n-]2)cc1)C(=O)Nc1cccc(Cl)c1 ZINC000736194204 598414206 /nfs/dbraw/zinc/41/42/06/598414206.db2.gz XRXDBAQSHLAMCB-SNVBAGLBSA-N -1 3 359.842 3.639 20 0 FHADHM C[C@@H](Sc1ccc(-c2nn[n-]n2)cc1)C(=O)Nc1cccc(Cl)c1 ZINC000736194204 598414208 /nfs/dbraw/zinc/41/42/08/598414208.db2.gz XRXDBAQSHLAMCB-SNVBAGLBSA-N -1 3 359.842 3.639 20 0 FHADHM Cc1ccc(F)c(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CC[C@H](C)C3)c1 ZINC000737344826 598414497 /nfs/dbraw/zinc/41/44/97/598414497.db2.gz KYFXWSJNYPXIQS-JTQLQIEISA-N -1 3 371.441 3.753 20 0 FHADHM Cc1ccc(F)c(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CC[C@H](C)C3)c1 ZINC000737344826 598414499 /nfs/dbraw/zinc/41/44/99/598414499.db2.gz KYFXWSJNYPXIQS-JTQLQIEISA-N -1 3 371.441 3.753 20 0 FHADHM Cc1cc(C)cc(NC(=O)[C@H](C)Sc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737250875 598414619 /nfs/dbraw/zinc/41/46/19/598414619.db2.gz PXWAUDJBDYGXFW-ZDUSSCGKSA-N -1 3 353.451 3.603 20 0 FHADHM Cc1cc(C)cc(NC(=O)[C@H](C)Sc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737250875 598414621 /nfs/dbraw/zinc/41/46/21/598414621.db2.gz PXWAUDJBDYGXFW-ZDUSSCGKSA-N -1 3 353.451 3.603 20 0 FHADHM CCN(C(=O)c1cc(C)ccc1F)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736505422 598416920 /nfs/dbraw/zinc/41/69/20/598416920.db2.gz ILWJIAMIQHKHDQ-CYBMUJFWSA-N -1 3 353.401 3.538 20 0 FHADHM CCN(C(=O)c1cc(C)ccc1F)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736505422 598416922 /nfs/dbraw/zinc/41/69/22/598416922.db2.gz ILWJIAMIQHKHDQ-CYBMUJFWSA-N -1 3 353.401 3.538 20 0 FHADHM Cc1ccccc1[C@H](C)NC(=O)[C@@H](C)Sc1ccc(-c2nnn[n-]2)cc1 ZINC000737419924 598417107 /nfs/dbraw/zinc/41/71/07/598417107.db2.gz GMHUZQDILRGQCE-UONOGXRCSA-N -1 3 367.478 3.533 20 0 FHADHM Cc1ccccc1[C@H](C)NC(=O)[C@@H](C)Sc1ccc(-c2nn[n-]n2)cc1 ZINC000737419924 598417109 /nfs/dbraw/zinc/41/71/09/598417109.db2.gz GMHUZQDILRGQCE-UONOGXRCSA-N -1 3 367.478 3.533 20 0 FHADHM O=C(C[C@@H]1C=CCC1)Nc1ccccc1NCc1ccc(-c2nnn[n-]2)cc1 ZINC000737811400 598418377 /nfs/dbraw/zinc/41/83/77/598418377.db2.gz AXVUSDRGSJECEN-OAHLLOKOSA-N -1 3 374.448 3.774 20 0 FHADHM O=C(C[C@@H]1C=CCC1)Nc1ccccc1NCc1ccc(-c2nn[n-]n2)cc1 ZINC000737811400 598418379 /nfs/dbraw/zinc/41/83/79/598418379.db2.gz AXVUSDRGSJECEN-OAHLLOKOSA-N -1 3 374.448 3.774 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)[C@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000499756024 598419200 /nfs/dbraw/zinc/41/92/00/598419200.db2.gz JZBVGEKJHYPFRW-KBPBESRZSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)[C@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000499756024 598419202 /nfs/dbraw/zinc/41/92/02/598419202.db2.gz JZBVGEKJHYPFRW-KBPBESRZSA-N -1 3 374.231 3.916 20 0 FHADHM CC[C@@H]1CCCC[C@@H]1NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C(C)C ZINC000736399619 598430037 /nfs/dbraw/zinc/43/00/37/598430037.db2.gz JDBSSDHOKWRBAL-AEFFLSMTSA-N -1 3 370.501 3.756 20 0 FHADHM CC[C@@H]1CCCC[C@@H]1NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C(C)C ZINC000736399619 598430039 /nfs/dbraw/zinc/43/00/39/598430039.db2.gz JDBSSDHOKWRBAL-AEFFLSMTSA-N -1 3 370.501 3.756 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H](C)c2ccc(OC)cc2)c1-c1nnn[n-]1 ZINC000736669321 598452614 /nfs/dbraw/zinc/45/26/14/598452614.db2.gz DKVQCXOAZLOCAX-JTQLQIEISA-N -1 3 371.466 3.550 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H](C)c2ccc(OC)cc2)c1-c1nn[n-]n1 ZINC000736669321 598452615 /nfs/dbraw/zinc/45/26/15/598452615.db2.gz DKVQCXOAZLOCAX-JTQLQIEISA-N -1 3 371.466 3.550 20 0 FHADHM CC(=CC(=O)OCc1cccc(-c2nnn[n-]2)c1)c1ccccc1Cl ZINC000735448104 598473923 /nfs/dbraw/zinc/47/39/23/598473923.db2.gz OTWBXSWOULUGEB-XFXZXTDPSA-N -1 3 354.797 3.667 20 0 FHADHM CC(=CC(=O)OCc1cccc(-c2nn[n-]n2)c1)c1ccccc1Cl ZINC000735448104 598473924 /nfs/dbraw/zinc/47/39/24/598473924.db2.gz OTWBXSWOULUGEB-XFXZXTDPSA-N -1 3 354.797 3.667 20 0 FHADHM CCCCCC[C@H](C)NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000736444088 598476677 /nfs/dbraw/zinc/47/66/77/598476677.db2.gz CNMIFODLTDOZSU-HNNXBMFYSA-N -1 3 370.501 3.900 20 0 FHADHM CCCCCC[C@H](C)NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000736444088 598476679 /nfs/dbraw/zinc/47/66/79/598476679.db2.gz CNMIFODLTDOZSU-HNNXBMFYSA-N -1 3 370.501 3.900 20 0 FHADHM CC[C@H]1CCCC[C@H]1NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000736401419 598478386 /nfs/dbraw/zinc/47/83/86/598478386.db2.gz WLKGYDQKDVEZRL-MAUKXSAKSA-N -1 3 368.485 3.510 20 0 FHADHM CC[C@H]1CCCC[C@H]1NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000736401419 598478387 /nfs/dbraw/zinc/47/83/87/598478387.db2.gz WLKGYDQKDVEZRL-MAUKXSAKSA-N -1 3 368.485 3.510 20 0 FHADHM CC(C)Oc1cccc(CC(=O)O[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000735913839 598483999 /nfs/dbraw/zinc/48/39/99/598483999.db2.gz SIBSTCGNYWKRLH-CQSZACIVSA-N -1 3 366.421 3.501 20 0 FHADHM CC(C)Oc1cccc(CC(=O)O[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000735913839 598484000 /nfs/dbraw/zinc/48/40/00/598484000.db2.gz SIBSTCGNYWKRLH-CQSZACIVSA-N -1 3 366.421 3.501 20 0 FHADHM CCOc1ccccc1CCC(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000736654218 598486828 /nfs/dbraw/zinc/48/68/28/598486828.db2.gz SLXRWFZWUZYSBN-CQSZACIVSA-N -1 3 366.421 3.502 20 0 FHADHM CCOc1ccccc1CCC(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000736654218 598486830 /nfs/dbraw/zinc/48/68/30/598486830.db2.gz SLXRWFZWUZYSBN-CQSZACIVSA-N -1 3 366.421 3.502 20 0 FHADHM C[C@@H](OC(=O)CCc1c[nH]c2ccccc12)c1cccc(-c2nnn[n-]2)c1 ZINC000736150974 598491099 /nfs/dbraw/zinc/49/10/99/598491099.db2.gz PEZDADIMCXTNRK-CYBMUJFWSA-N -1 3 361.405 3.585 20 0 FHADHM C[C@@H](OC(=O)CCc1c[nH]c2ccccc12)c1cccc(-c2nn[n-]n2)c1 ZINC000736150974 598491101 /nfs/dbraw/zinc/49/11/01/598491101.db2.gz PEZDADIMCXTNRK-CYBMUJFWSA-N -1 3 361.405 3.585 20 0 FHADHM CC(C)C[C@H](C)CC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)CC(C)C ZINC000735761865 598494495 /nfs/dbraw/zinc/49/44/95/598494495.db2.gz QNKGSAWYKRDYAM-INIZCTEOSA-N -1 3 357.502 3.924 20 0 FHADHM CC(C)C[C@H](C)CC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)CC(C)C ZINC000735761865 598494498 /nfs/dbraw/zinc/49/44/98/598494498.db2.gz QNKGSAWYKRDYAM-INIZCTEOSA-N -1 3 357.502 3.924 20 0 FHADHM S=C(NCCCCCc1ccccc1)Nc1ccccc1-c1nnn[n-]1 ZINC000738400266 598495383 /nfs/dbraw/zinc/49/53/83/598495383.db2.gz CIJRXTGSECOCHE-UHFFFAOYSA-N -1 3 366.494 3.566 20 0 FHADHM S=C(NCCCCCc1ccccc1)Nc1ccccc1-c1nn[n-]n1 ZINC000738400266 598495384 /nfs/dbraw/zinc/49/53/84/598495384.db2.gz CIJRXTGSECOCHE-UHFFFAOYSA-N -1 3 366.494 3.566 20 0 FHADHM O=C(c1ccc(-c2nnn[n-]2)cc1)N1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000738254430 598496856 /nfs/dbraw/zinc/49/68/56/598496856.db2.gz NEDMBILBYCGQMU-LJQANCHMSA-N -1 3 372.432 3.715 20 0 FHADHM O=C(c1ccc(-c2nn[n-]n2)cc1)N1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000738254430 598496858 /nfs/dbraw/zinc/49/68/58/598496858.db2.gz NEDMBILBYCGQMU-LJQANCHMSA-N -1 3 372.432 3.715 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)ccc1OC(=O)[C@@H](C)c1ccc(CC)cc1 ZINC000736627056 598497969 /nfs/dbraw/zinc/49/79/69/598497969.db2.gz ILDNEPROJGOGCK-ZDUSSCGKSA-N -1 3 366.421 3.537 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)ccc1OC(=O)[C@@H](C)c1ccc(CC)cc1 ZINC000736627056 598497971 /nfs/dbraw/zinc/49/79/71/598497971.db2.gz ILDNEPROJGOGCK-ZDUSSCGKSA-N -1 3 366.421 3.537 20 0 FHADHM Cc1cccc(-c2noc(CSCc3ccc(-c4nnn[n-]4)cc3)n2)c1 ZINC000737381159 598511906 /nfs/dbraw/zinc/51/19/06/598511906.db2.gz VUILJINAJZNJSO-UHFFFAOYSA-N -1 3 364.434 3.659 20 0 FHADHM Cc1cccc(-c2noc(CSCc3ccc(-c4nn[n-]n4)cc3)n2)c1 ZINC000737381159 598511908 /nfs/dbraw/zinc/51/19/08/598511908.db2.gz VUILJINAJZNJSO-UHFFFAOYSA-N -1 3 364.434 3.659 20 0 FHADHM CCc1c(C)sc(NC(=O)CCCc2ccccc2)c1-c1nnn[n-]1 ZINC000736672107 598515996 /nfs/dbraw/zinc/51/59/96/598515996.db2.gz YPAGOGQBUIIGAX-UHFFFAOYSA-N -1 3 355.467 3.760 20 0 FHADHM CCc1c(C)sc(NC(=O)CCCc2ccccc2)c1-c1nn[n-]n1 ZINC000736672107 598515998 /nfs/dbraw/zinc/51/59/98/598515998.db2.gz YPAGOGQBUIIGAX-UHFFFAOYSA-N -1 3 355.467 3.760 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H](C)Oc2ccc(C)cc2)c1-c1nnn[n-]1 ZINC000736671314 598518772 /nfs/dbraw/zinc/51/87/72/598518772.db2.gz WRFVMYBCJJTGJI-NSHDSACASA-N -1 3 371.466 3.513 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H](C)Oc2ccc(C)cc2)c1-c1nn[n-]n1 ZINC000736671314 598518773 /nfs/dbraw/zinc/51/87/73/598518773.db2.gz WRFVMYBCJJTGJI-NSHDSACASA-N -1 3 371.466 3.513 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@@H]1NC(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000735796712 598528044 /nfs/dbraw/zinc/52/80/44/598528044.db2.gz HDQMGDLQECDLBF-HFTRVMKXSA-N -1 3 370.501 3.832 20 0 FHADHM CC(C)CC[C@@H]1CCC[C@@H]1NC(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000735796712 598528045 /nfs/dbraw/zinc/52/80/45/598528045.db2.gz HDQMGDLQECDLBF-HFTRVMKXSA-N -1 3 370.501 3.832 20 0 FHADHM O=C(CCc1ccc(-c2nnn[n-]2)cc1)O[C@H]1CCc2ccc(Cl)cc21 ZINC000737854693 598538249 /nfs/dbraw/zinc/53/82/49/598538249.db2.gz UIPCSMPDXKQFKK-KRWDZBQOSA-N -1 3 368.824 3.683 20 0 FHADHM O=C(CCc1ccc(-c2nn[n-]n2)cc1)O[C@H]1CCc2ccc(Cl)cc21 ZINC000737854693 598538251 /nfs/dbraw/zinc/53/82/51/598538251.db2.gz UIPCSMPDXKQFKK-KRWDZBQOSA-N -1 3 368.824 3.683 20 0 FHADHM O=C(Nc1sccc1-c1nnn[n-]1)c1ccc(SC(F)(F)F)cc1 ZINC000738212039 598540933 /nfs/dbraw/zinc/54/09/33/598540933.db2.gz VRPHFITXUYKXHX-UHFFFAOYSA-N -1 3 371.369 3.792 20 0 FHADHM O=C(Nc1sccc1-c1nn[n-]n1)c1ccc(SC(F)(F)F)cc1 ZINC000738212039 598540935 /nfs/dbraw/zinc/54/09/35/598540935.db2.gz VRPHFITXUYKXHX-UHFFFAOYSA-N -1 3 371.369 3.792 20 0 FHADHM CCCCC[C@H](NC(=O)Cc1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000736441568 598543282 /nfs/dbraw/zinc/54/32/82/598543282.db2.gz SJWJHDVBIBPHJI-IBGZPJMESA-N -1 3 363.465 3.847 20 0 FHADHM CCCCC[C@H](NC(=O)Cc1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000736441568 598543284 /nfs/dbraw/zinc/54/32/84/598543284.db2.gz SJWJHDVBIBPHJI-IBGZPJMESA-N -1 3 363.465 3.847 20 0 FHADHM Fc1cc(OCc2ncc(-c3cccc(Cl)c3)o2)ccc1-c1nnn[n-]1 ZINC000737650482 598547817 /nfs/dbraw/zinc/54/78/17/598547817.db2.gz IXOJZPODFRBQPC-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM Fc1cc(OCc2ncc(-c3cccc(Cl)c3)o2)ccc1-c1nn[n-]n1 ZINC000737650482 598547819 /nfs/dbraw/zinc/54/78/19/598547819.db2.gz IXOJZPODFRBQPC-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM Fc1cc(OCc2ncc(-c3ccc(Cl)cc3)o2)ccc1-c1nnn[n-]1 ZINC000737652768 598547829 /nfs/dbraw/zinc/54/78/29/598547829.db2.gz OVKXZNSFCZKOKX-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM Fc1cc(OCc2ncc(-c3ccc(Cl)cc3)o2)ccc1-c1nn[n-]n1 ZINC000737652768 598547830 /nfs/dbraw/zinc/54/78/30/598547830.db2.gz OVKXZNSFCZKOKX-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM Cc1oc(-c2ccsc2)nc1COc1ccc(-c2nnn[n-]2)c(F)c1 ZINC000737546022 598548193 /nfs/dbraw/zinc/54/81/93/598548193.db2.gz BJUTZMRUSYTBRH-UHFFFAOYSA-N -1 3 357.370 3.610 20 0 FHADHM Cc1oc(-c2ccsc2)nc1COc1ccc(-c2nn[n-]n2)c(F)c1 ZINC000737546022 598548194 /nfs/dbraw/zinc/54/81/94/598548194.db2.gz BJUTZMRUSYTBRH-UHFFFAOYSA-N -1 3 357.370 3.610 20 0 FHADHM Fc1cc(OCc2csc(-c3cccs3)n2)ccc1-c1nnn[n-]1 ZINC000737653826 598549086 /nfs/dbraw/zinc/54/90/86/598549086.db2.gz SHINBSPRKWVKSU-UHFFFAOYSA-N -1 3 359.411 3.770 20 0 FHADHM Fc1cc(OCc2csc(-c3cccs3)n2)ccc1-c1nn[n-]n1 ZINC000737653826 598549088 /nfs/dbraw/zinc/54/90/88/598549088.db2.gz SHINBSPRKWVKSU-UHFFFAOYSA-N -1 3 359.411 3.770 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccc(Cl)cc1F ZINC000738151221 598550652 /nfs/dbraw/zinc/55/06/52/598550652.db2.gz GZOBDYLCOXHMSU-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccc(Cl)cc1F ZINC000738151221 598550653 /nfs/dbraw/zinc/55/06/53/598550653.db2.gz GZOBDYLCOXHMSU-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@@H](C)c1ccccc1F ZINC000735904538 598552974 /nfs/dbraw/zinc/55/29/74/598552974.db2.gz PRZUEYNAXDADSZ-LBPRGKRZSA-N -1 3 369.400 3.535 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@@H](C)c1ccccc1F ZINC000735904538 598552975 /nfs/dbraw/zinc/55/29/75/598552975.db2.gz PRZUEYNAXDADSZ-LBPRGKRZSA-N -1 3 369.400 3.535 20 0 FHADHM CSC[C@H](C)C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000737180117 598555145 /nfs/dbraw/zinc/55/51/45/598555145.db2.gz PDDJVQBAFAKJHW-LBPRGKRZSA-N -1 3 369.450 3.597 20 0 FHADHM CSC[C@H](C)C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000737180117 598555147 /nfs/dbraw/zinc/55/51/47/598555147.db2.gz PDDJVQBAFAKJHW-LBPRGKRZSA-N -1 3 369.450 3.597 20 0 FHADHM O=C(Nc1ccccc1-c1nnn[n-]1)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000738192829 598572699 /nfs/dbraw/zinc/57/26/99/598572699.db2.gz XIIBVXKUVUMIHP-NWDGAFQWSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1ccccc1-c1nn[n-]n1)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000738192829 598572700 /nfs/dbraw/zinc/57/27/00/598572700.db2.gz XIIBVXKUVUMIHP-NWDGAFQWSA-N -1 3 374.231 3.916 20 0 FHADHM COc1ccc(C)cc1CNc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000737078212 598572722 /nfs/dbraw/zinc/57/27/22/598572722.db2.gz WKDKCTZYSOMNQW-UHFFFAOYSA-N -1 3 363.343 3.815 20 0 FHADHM COc1ccc(C)cc1CNc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000737078212 598572723 /nfs/dbraw/zinc/57/27/23/598572723.db2.gz WKDKCTZYSOMNQW-UHFFFAOYSA-N -1 3 363.343 3.815 20 0 FHADHM CC(=CC(=O)Nc1ccccc1-c1nnn[n-]1)c1ccc(C(F)(F)F)cc1 ZINC000735449085 598573032 /nfs/dbraw/zinc/57/30/32/598573032.db2.gz VKJUQNYEWLLANR-KHPPLWFESA-N -1 3 373.338 3.928 20 0 FHADHM CC(=CC(=O)Nc1ccccc1-c1nn[n-]n1)c1ccc(C(F)(F)F)cc1 ZINC000735449085 598573035 /nfs/dbraw/zinc/57/30/35/598573035.db2.gz VKJUQNYEWLLANR-KHPPLWFESA-N -1 3 373.338 3.928 20 0 FHADHM FC(F)(F)c1cc(NCc2ccc(Cl)nc2)ccc1-c1nnn[n-]1 ZINC000737632735 598576920 /nfs/dbraw/zinc/57/69/20/598576920.db2.gz MRXOKYXZODOAFI-UHFFFAOYSA-N -1 3 354.723 3.546 20 0 FHADHM FC(F)(F)c1cc(NCc2ccc(Cl)nc2)ccc1-c1nn[n-]n1 ZINC000737632735 598576922 /nfs/dbraw/zinc/57/69/22/598576922.db2.gz MRXOKYXZODOAFI-UHFFFAOYSA-N -1 3 354.723 3.546 20 0 FHADHM Fc1ccc(NC(=S)Nc2ccc(F)c(-c3nnn[n-]3)c2)cc1Cl ZINC000737657960 598580992 /nfs/dbraw/zinc/58/09/92/598580992.db2.gz ANGSDTNCICCGLH-UHFFFAOYSA-N -1 3 366.784 3.607 20 0 FHADHM Fc1ccc(NC(=S)Nc2ccc(F)c(-c3nn[n-]n3)c2)cc1Cl ZINC000737657960 598580993 /nfs/dbraw/zinc/58/09/93/598580993.db2.gz ANGSDTNCICCGLH-UHFFFAOYSA-N -1 3 366.784 3.607 20 0 FHADHM O=C(CCCCCc1cccs1)OCc1ccc(-c2nnn[n-]2)cc1 ZINC000737826143 598584126 /nfs/dbraw/zinc/58/41/26/598584126.db2.gz QKBVIIDGYLEVIR-UHFFFAOYSA-N -1 3 356.451 3.775 20 0 FHADHM O=C(CCCCCc1cccs1)OCc1ccc(-c2nn[n-]n2)cc1 ZINC000737826143 598584128 /nfs/dbraw/zinc/58/41/28/598584128.db2.gz QKBVIIDGYLEVIR-UHFFFAOYSA-N -1 3 356.451 3.775 20 0 FHADHM CCC[C@@H](NC(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1)C1CCCCC1 ZINC000736431994 598607071 /nfs/dbraw/zinc/60/70/71/598607071.db2.gz ZVBKHKIPQNCPDD-RDTXWAMCSA-N -1 3 370.501 3.976 20 0 FHADHM CCC[C@@H](NC(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1)C1CCCCC1 ZINC000736431994 598607073 /nfs/dbraw/zinc/60/70/73/598607073.db2.gz ZVBKHKIPQNCPDD-RDTXWAMCSA-N -1 3 370.501 3.976 20 0 FHADHM CCC[C@H](NC(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1)C1CCCCC1 ZINC000736431426 598607104 /nfs/dbraw/zinc/60/71/04/598607104.db2.gz FJBFMFRDXYLCQB-SFHVURJKSA-N -1 3 370.501 3.757 20 0 FHADHM CCC[C@H](NC(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1)C1CCCCC1 ZINC000736431426 598607105 /nfs/dbraw/zinc/60/71/05/598607105.db2.gz FJBFMFRDXYLCQB-SFHVURJKSA-N -1 3 370.501 3.757 20 0 FHADHM Clc1cccc(Cl)c1-c1noc(-c2cccc(-c3nnn[n-]3)c2)n1 ZINC000737574546 598609354 /nfs/dbraw/zinc/60/93/54/598609354.db2.gz LURUKZAXOFZWJH-UHFFFAOYSA-N -1 3 359.176 3.891 20 0 FHADHM Clc1cccc(Cl)c1-c1noc(-c2cccc(-c3nn[n-]n3)c2)n1 ZINC000737574546 598609356 /nfs/dbraw/zinc/60/93/56/598609356.db2.gz LURUKZAXOFZWJH-UHFFFAOYSA-N -1 3 359.176 3.891 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)N1CCC2(CCCCC2)CC1 ZINC000738162174 598626694 /nfs/dbraw/zinc/62/66/94/598626694.db2.gz JVVUXYHVGOZNLE-UHFFFAOYSA-N -1 3 358.421 3.584 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)N1CCC2(CCCCC2)CC1 ZINC000738162174 598626695 /nfs/dbraw/zinc/62/66/95/598626695.db2.gz JVVUXYHVGOZNLE-UHFFFAOYSA-N -1 3 358.421 3.584 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)N1CCC[C@@H]1CC1CCCCC1 ZINC000738160795 598627922 /nfs/dbraw/zinc/62/79/22/598627922.db2.gz BLYQHZOGPNPPFG-OAHLLOKOSA-N -1 3 372.448 3.973 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)N1CCC[C@@H]1CC1CCCCC1 ZINC000738160795 598627923 /nfs/dbraw/zinc/62/79/23/598627923.db2.gz BLYQHZOGPNPPFG-OAHLLOKOSA-N -1 3 372.448 3.973 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1NCC1(c2ccccc2)CCOCC1 ZINC000737573233 598633734 /nfs/dbraw/zinc/63/37/34/598633734.db2.gz CRUWDEZXJOYTGU-UHFFFAOYSA-N -1 3 369.856 3.680 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1NCC1(c2ccccc2)CCOCC1 ZINC000737573233 598633736 /nfs/dbraw/zinc/63/37/36/598633736.db2.gz CRUWDEZXJOYTGU-UHFFFAOYSA-N -1 3 369.856 3.680 20 0 FHADHM Fc1ccc2[nH]c3c(c2c1)CN(c1ccc(-c2nnn[n-]2)c(Cl)c1)CC3 ZINC000737657669 598639511 /nfs/dbraw/zinc/63/95/11/598639511.db2.gz YQORYKMHWSLPBV-UHFFFAOYSA-N -1 3 368.803 3.703 20 0 FHADHM Fc1ccc2[nH]c3c(c2c1)CN(c1ccc(-c2nn[n-]n2)c(Cl)c1)CC3 ZINC000737657669 598639513 /nfs/dbraw/zinc/63/95/13/598639513.db2.gz YQORYKMHWSLPBV-UHFFFAOYSA-N -1 3 368.803 3.703 20 0 FHADHM Cc1cc(Cl)cc(C)c1OC(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000737262663 598647241 /nfs/dbraw/zinc/64/72/41/598647241.db2.gz FLOCTSBXZJOPGD-UHFFFAOYSA-N -1 3 374.853 3.835 20 0 FHADHM Cc1cc(Cl)cc(C)c1OC(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000737262663 598647243 /nfs/dbraw/zinc/64/72/43/598647243.db2.gz FLOCTSBXZJOPGD-UHFFFAOYSA-N -1 3 374.853 3.835 20 0 FHADHM Cc1sc(NC(=O)[C@H](C)CSc2ccccc2)c(-c2nnn[n-]2)c1C ZINC000737563602 598647244 /nfs/dbraw/zinc/64/72/44/598647244.db2.gz QHRKKVVXIMINDB-SNVBAGLBSA-N -1 3 373.507 3.912 20 0 FHADHM Cc1sc(NC(=O)[C@H](C)CSc2ccccc2)c(-c2nn[n-]n2)c1C ZINC000737563602 598647246 /nfs/dbraw/zinc/64/72/46/598647246.db2.gz QHRKKVVXIMINDB-SNVBAGLBSA-N -1 3 373.507 3.912 20 0 FHADHM CCC1CCC(NC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)CC1 ZINC000736398245 598649726 /nfs/dbraw/zinc/64/97/26/598649726.db2.gz ZWMBEBBROAQQNO-UHFFFAOYSA-N -1 3 371.485 3.501 20 0 FHADHM CCC1CCC(NC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)CC1 ZINC000736398245 598649729 /nfs/dbraw/zinc/64/97/29/598649729.db2.gz ZWMBEBBROAQQNO-UHFFFAOYSA-N -1 3 371.485 3.501 20 0 FHADHM CC[C@H](Sc1ccccc1)C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736393412 598649949 /nfs/dbraw/zinc/64/99/49/598649949.db2.gz YIHZQLJYIKMBOZ-GUYCJALGSA-N -1 3 367.478 3.615 20 0 FHADHM CC[C@H](Sc1ccccc1)C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736393412 598649950 /nfs/dbraw/zinc/64/99/50/598649950.db2.gz YIHZQLJYIKMBOZ-GUYCJALGSA-N -1 3 367.478 3.615 20 0 FHADHM CCN(C(=O)CSc1ccc(-c2nnn[n-]2)cc1)c1cccc(C)c1C ZINC000736504990 598652138 /nfs/dbraw/zinc/65/21/38/598652138.db2.gz KAPPJZJXGCKKHG-UHFFFAOYSA-N -1 3 367.478 3.629 20 0 FHADHM CCN(C(=O)CSc1ccc(-c2nnn[n-]2)cc1)c1cc(C)cc(C)c1 ZINC000736505676 598652103 /nfs/dbraw/zinc/65/21/03/598652103.db2.gz QLHURVLZYZOGFS-UHFFFAOYSA-N -1 3 367.478 3.629 20 0 FHADHM CCN(C(=O)CSc1ccc(-c2nn[n-]n2)cc1)c1cc(C)cc(C)c1 ZINC000736505676 598652105 /nfs/dbraw/zinc/65/21/05/598652105.db2.gz QLHURVLZYZOGFS-UHFFFAOYSA-N -1 3 367.478 3.629 20 0 FHADHM CCN(C(=O)CSc1ccc(-c2nn[n-]n2)cc1)c1cccc(C)c1C ZINC000736504990 598652139 /nfs/dbraw/zinc/65/21/39/598652139.db2.gz KAPPJZJXGCKKHG-UHFFFAOYSA-N -1 3 367.478 3.629 20 0 FHADHM CCCc1ccccc1NC(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000736495924 598653178 /nfs/dbraw/zinc/65/31/78/598653178.db2.gz WCEVHRBEGBFDMS-UHFFFAOYSA-N -1 3 353.451 3.550 20 0 FHADHM CCCc1ccccc1NC(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000736495924 598653180 /nfs/dbraw/zinc/65/31/80/598653180.db2.gz WCEVHRBEGBFDMS-UHFFFAOYSA-N -1 3 353.451 3.550 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@@H](C)CSc2ccccc2)s1 ZINC000736679003 598654377 /nfs/dbraw/zinc/65/43/77/598654377.db2.gz IKGZNSVONIAXKG-NSHDSACASA-N -1 3 373.507 3.858 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@@H](C)CSc2ccccc2)s1 ZINC000736679003 598654379 /nfs/dbraw/zinc/65/43/79/598654379.db2.gz IKGZNSVONIAXKG-NSHDSACASA-N -1 3 373.507 3.858 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)c1ccc(-c2ccccc2)[nH]1 ZINC000736634073 598654662 /nfs/dbraw/zinc/65/46/62/598654662.db2.gz FLTWXZCCVGQAOQ-UHFFFAOYSA-N -1 3 374.404 3.513 20 0 FHADHM CCCC[C@@H](NC(=O)c1cccc(-c2nnn[n-]2)c1)c1ccc(OC)cc1 ZINC000736437726 598661442 /nfs/dbraw/zinc/66/14/42/598661442.db2.gz KPYHWAILAKXLCJ-GOSISDBHSA-N -1 3 365.437 3.537 20 0 FHADHM CCCC[C@@H](NC(=O)c1cccc(-c2nn[n-]n2)c1)c1ccc(OC)cc1 ZINC000736437726 598661444 /nfs/dbraw/zinc/66/14/44/598661444.db2.gz KPYHWAILAKXLCJ-GOSISDBHSA-N -1 3 365.437 3.537 20 0 FHADHM CCCN(CC1CCCCC1)C(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000736469914 598666173 /nfs/dbraw/zinc/66/61/73/598666173.db2.gz GGUOETVKDVZKKX-UHFFFAOYSA-N -1 3 373.526 3.778 20 0 FHADHM CCCN(CC1CCCCC1)C(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000736469914 598666175 /nfs/dbraw/zinc/66/61/75/598666175.db2.gz GGUOETVKDVZKKX-UHFFFAOYSA-N -1 3 373.526 3.778 20 0 FHADHM CC[C@@H](C)CN(C)C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736322078 598666730 /nfs/dbraw/zinc/66/67/30/598666730.db2.gz HTOXGJUNNSTDQC-CQSZACIVSA-N -1 3 365.437 3.777 20 0 FHADHM CC[C@@H](C)CN(C)C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736322078 598666732 /nfs/dbraw/zinc/66/67/32/598666732.db2.gz HTOXGJUNNSTDQC-CQSZACIVSA-N -1 3 365.437 3.777 20 0 FHADHM CCn1c(CCNc2ccc(-c3nnn[n-]3)c(Cl)c2)nc2ccccc21 ZINC000736720415 598666939 /nfs/dbraw/zinc/66/69/39/598666939.db2.gz PPLCXMDBLHCWKA-UHFFFAOYSA-N -1 3 367.844 3.544 20 0 FHADHM CCn1c(CCNc2ccc(-c3nn[n-]n3)c(Cl)c2)nc2ccccc21 ZINC000736720415 598666941 /nfs/dbraw/zinc/66/69/41/598666941.db2.gz PPLCXMDBLHCWKA-UHFFFAOYSA-N -1 3 367.844 3.544 20 0 FHADHM COc1ccc(COCCCNc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1 ZINC000737096422 598671097 /nfs/dbraw/zinc/67/10/97/598671097.db2.gz BMJUQPKGTHOTDP-UHFFFAOYSA-N -1 3 373.844 3.548 20 0 FHADHM COc1ccc(COCCCNc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1 ZINC000737096422 598671098 /nfs/dbraw/zinc/67/10/98/598671098.db2.gz BMJUQPKGTHOTDP-UHFFFAOYSA-N -1 3 373.844 3.548 20 0 FHADHM CC(C)(C)c1csc(CCNc2ccc(-c3nnn[n-]3)c(Cl)c2)n1 ZINC000735652675 598671385 /nfs/dbraw/zinc/67/13/85/598671385.db2.gz QUNZAOXYYATXSN-UHFFFAOYSA-N -1 3 362.890 3.929 20 0 FHADHM CC(C)(C)c1csc(CCNc2ccc(-c3nn[n-]n3)c(Cl)c2)n1 ZINC000735652675 598671387 /nfs/dbraw/zinc/67/13/87/598671387.db2.gz QUNZAOXYYATXSN-UHFFFAOYSA-N -1 3 362.890 3.929 20 0 FHADHM Fc1cccc(NCc2ccc(Br)cc2F)c1-c1nnn[n-]1 ZINC000737643984 598680550 /nfs/dbraw/zinc/68/05/50/598680550.db2.gz IUVXYMVPOTXVIP-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1cccc(NCc2ccc(Br)cc2F)c1-c1nn[n-]n1 ZINC000737643984 598680552 /nfs/dbraw/zinc/68/05/52/598680552.db2.gz IUVXYMVPOTXVIP-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM COc1ccc(OCCCSCc2ccc(F)cc2-c2nnn[n-]2)cc1 ZINC000737108763 598694844 /nfs/dbraw/zinc/69/48/44/598694844.db2.gz BQSGESYTNLCGEB-UHFFFAOYSA-N -1 3 374.441 3.717 20 0 FHADHM COc1ccc(OCCCSCc2ccc(F)cc2-c2nn[n-]n2)cc1 ZINC000737108763 598694846 /nfs/dbraw/zinc/69/48/46/598694846.db2.gz BQSGESYTNLCGEB-UHFFFAOYSA-N -1 3 374.441 3.717 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)N1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000738178903 598716601 /nfs/dbraw/zinc/71/66/01/598716601.db2.gz MYQMHVCYUNLJPB-CQSZACIVSA-N -1 3 368.828 3.542 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)N1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000738178903 598716604 /nfs/dbraw/zinc/71/66/04/598716604.db2.gz MYQMHVCYUNLJPB-CQSZACIVSA-N -1 3 368.828 3.542 20 0 FHADHM CC(C)Oc1ccc(Cn2ccc(-c3ccc(-c4nnn[n-]4)cc3)n2)cc1 ZINC000735914830 598722772 /nfs/dbraw/zinc/72/27/72/598722772.db2.gz KPDHZZZEVVOUII-UHFFFAOYSA-N -1 3 360.421 3.566 20 0 FHADHM CC(C)Oc1ccc(Cn2ccc(-c3ccc(-c4nn[n-]n4)cc3)n2)cc1 ZINC000735914830 598722773 /nfs/dbraw/zinc/72/27/73/598722773.db2.gz KPDHZZZEVVOUII-UHFFFAOYSA-N -1 3 360.421 3.566 20 0 FHADHM Cc1cc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CC[C@H](C)C3)ccc1F ZINC000737238929 598735297 /nfs/dbraw/zinc/73/52/97/598735297.db2.gz UYBNVOFHOJMBHF-VIFPVBQESA-N -1 3 371.441 3.753 20 0 FHADHM Cc1cc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CC[C@H](C)C3)ccc1F ZINC000737238929 598735299 /nfs/dbraw/zinc/73/52/99/598735299.db2.gz UYBNVOFHOJMBHF-VIFPVBQESA-N -1 3 371.441 3.753 20 0 FHADHM CCC(=CC(=O)Nc1sc(CC)cc1-c1nnn[n-]1)c1ccccc1 ZINC000736301771 598735474 /nfs/dbraw/zinc/73/54/74/598735474.db2.gz ATSDECYXCOUHMV-ZRDIBKRKSA-N -1 3 353.451 3.923 20 0 FHADHM CCC(=CC(=O)Nc1sc(CC)cc1-c1nn[n-]n1)c1ccccc1 ZINC000736301771 598735476 /nfs/dbraw/zinc/73/54/76/598735476.db2.gz ATSDECYXCOUHMV-ZRDIBKRKSA-N -1 3 353.451 3.923 20 0 FHADHM Cc1sc(NC(=O)C[C@H]2CCc3ccccc3C2)c(-c2nnn[n-]2)c1C ZINC000737561683 598742288 /nfs/dbraw/zinc/74/22/88/598742288.db2.gz JZMZHFHHNOCEGG-ZDUSSCGKSA-N -1 3 367.478 3.679 20 0 FHADHM Cc1sc(NC(=O)C[C@H]2CCc3ccccc3C2)c(-c2nn[n-]n2)c1C ZINC000737561683 598742289 /nfs/dbraw/zinc/74/22/89/598742289.db2.gz JZMZHFHHNOCEGG-ZDUSSCGKSA-N -1 3 367.478 3.679 20 0 FHADHM CC(C)CC(CC(C)C)NC(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000735762563 598748232 /nfs/dbraw/zinc/74/82/32/598748232.db2.gz YASGHAOSLQALQO-UHFFFAOYSA-N -1 3 361.515 3.536 20 0 FHADHM CC(C)CC(CC(C)C)NC(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000735762563 598748233 /nfs/dbraw/zinc/74/82/33/598748233.db2.gz YASGHAOSLQALQO-UHFFFAOYSA-N -1 3 361.515 3.536 20 0 FHADHM CCCN(C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)C1CC1 ZINC000736469608 598748235 /nfs/dbraw/zinc/74/82/35/598748235.db2.gz AOJPHULSMQPMKZ-UHFFFAOYSA-N -1 3 363.421 3.674 20 0 FHADHM CCCN(C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)C1CC1 ZINC000736469608 598748236 /nfs/dbraw/zinc/74/82/36/598748236.db2.gz AOJPHULSMQPMKZ-UHFFFAOYSA-N -1 3 363.421 3.674 20 0 FHADHM Cc1ccc(NC(=O)C(C)(C)C)cc1NCc1ccccc1-c1nnn[n-]1 ZINC000737356632 598749215 /nfs/dbraw/zinc/74/92/15/598749215.db2.gz QXDYVEKAENNAQX-UHFFFAOYSA-N -1 3 364.453 3.772 20 0 FHADHM Cc1ccc(NC(=O)C(C)(C)C)cc1NCc1ccccc1-c1nn[n-]n1 ZINC000737356632 598749216 /nfs/dbraw/zinc/74/92/16/598749216.db2.gz QXDYVEKAENNAQX-UHFFFAOYSA-N -1 3 364.453 3.772 20 0 FHADHM CCN(CC1CC1)C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736535523 598753221 /nfs/dbraw/zinc/75/32/21/598753221.db2.gz UXXHBFVXZJWMBP-UHFFFAOYSA-N -1 3 363.421 3.531 20 0 FHADHM CCN(CC1CC1)C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736535523 598753223 /nfs/dbraw/zinc/75/32/23/598753223.db2.gz UXXHBFVXZJWMBP-UHFFFAOYSA-N -1 3 363.421 3.531 20 0 FHADHM C[C@H](SCc1ccccc1)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736189171 598762095 /nfs/dbraw/zinc/76/20/95/598762095.db2.gz BDXVKFZDWILKQM-NSHDSACASA-N -1 3 373.869 3.781 20 0 FHADHM C[C@H](SCc1ccccc1)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736189171 598762097 /nfs/dbraw/zinc/76/20/97/598762097.db2.gz BDXVKFZDWILKQM-NSHDSACASA-N -1 3 373.869 3.781 20 0 FHADHM CC[C@H](Cc1ccccc1)C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000736354941 598763099 /nfs/dbraw/zinc/76/30/99/598763099.db2.gz WJEOCJOHRLMWGI-OAHLLOKOSA-N -1 3 366.469 3.631 20 0 FHADHM CC[C@H](Cc1ccccc1)C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000736354941 598763100 /nfs/dbraw/zinc/76/31/00/598763100.db2.gz WJEOCJOHRLMWGI-OAHLLOKOSA-N -1 3 366.469 3.631 20 0 FHADHM Cc1ccsc1CNc1c(-c2nnn[n-]2)cnc2c(F)cc(F)cc21 ZINC000737441618 598772230 /nfs/dbraw/zinc/77/22/30/598772230.db2.gz IDCZQDVXUMYYHZ-UHFFFAOYSA-N -1 3 358.377 3.675 20 0 FHADHM Cc1ccsc1CNc1c(-c2nn[n-]n2)cnc2c(F)cc(F)cc21 ZINC000737441618 598772231 /nfs/dbraw/zinc/77/22/31/598772231.db2.gz IDCZQDVXUMYYHZ-UHFFFAOYSA-N -1 3 358.377 3.675 20 0 FHADHM Cc1ccc(CN(C(=O)Nc2cc(-c3nnn[n-]3)ccc2C)C(C)C)s1 ZINC000737337777 598782453 /nfs/dbraw/zinc/78/24/53/598782453.db2.gz RAICYENDWKFVNF-UHFFFAOYSA-N -1 3 370.482 3.988 20 0 FHADHM Cc1ccc(CN(C(=O)Nc2cc(-c3nn[n-]n3)ccc2C)C(C)C)s1 ZINC000737337777 598782454 /nfs/dbraw/zinc/78/24/54/598782454.db2.gz RAICYENDWKFVNF-UHFFFAOYSA-N -1 3 370.482 3.988 20 0 FHADHM CC[C@H](C)NC(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1 ZINC000820875788 599296431 /nfs/dbraw/zinc/29/64/31/599296431.db2.gz FVJNPUNSSJXWMN-NSHDSACASA-N -1 3 370.388 3.718 20 0 FHADHM CC[C@H](C)NC(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1 ZINC000820875788 599296433 /nfs/dbraw/zinc/29/64/33/599296433.db2.gz FVJNPUNSSJXWMN-NSHDSACASA-N -1 3 370.388 3.718 20 0 FHADHM CCN(C(=O)c1ccc(Cl)cc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000736509358 599313154 /nfs/dbraw/zinc/31/31/54/599313154.db2.gz VSDAMXBAPVKACJ-UHFFFAOYSA-N -1 3 362.220 3.840 20 0 FHADHM CCN(C(=O)c1ccc(Cl)cc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000736509358 599313156 /nfs/dbraw/zinc/31/31/56/599313156.db2.gz VSDAMXBAPVKACJ-UHFFFAOYSA-N -1 3 362.220 3.840 20 0 FHADHM CC(=O)c1ccccc1OCCS[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000735505675 599325205 /nfs/dbraw/zinc/32/52/05/599325205.db2.gz UVBTYCRHZXCWOD-AWEZNQCLSA-N -1 3 368.462 3.943 20 0 FHADHM CC(=O)c1ccccc1OCCS[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000735505675 599325209 /nfs/dbraw/zinc/32/52/09/599325209.db2.gz UVBTYCRHZXCWOD-AWEZNQCLSA-N -1 3 368.462 3.943 20 0 FHADHM Clc1ccc(NCc2ccc(Br)s2)cc1-c1nnn[n-]1 ZINC000737573300 599325552 /nfs/dbraw/zinc/32/55/52/599325552.db2.gz FSVNQJIDZUAJJC-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM Clc1ccc(NCc2ccc(Br)s2)cc1-c1nn[n-]n1 ZINC000737573300 599325555 /nfs/dbraw/zinc/32/55/55/599325555.db2.gz FSVNQJIDZUAJJC-UHFFFAOYSA-N -1 3 370.663 3.956 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NCc1csc(Br)c1 ZINC000737296529 599328577 /nfs/dbraw/zinc/32/85/77/599328577.db2.gz JZIKALUJQGUSHW-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NCc1csc(Br)c1 ZINC000737296529 599328580 /nfs/dbraw/zinc/32/85/80/599328580.db2.gz JZIKALUJQGUSHW-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM Cc1ccc(NC(=O)CS[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c(C)c1 ZINC000737356880 599329723 /nfs/dbraw/zinc/32/97/23/599329723.db2.gz JBNINXPHXYNDFY-CQSZACIVSA-N -1 3 367.478 3.916 20 0 FHADHM Cc1ccc(NC(=O)CS[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c(C)c1 ZINC000737356880 599329726 /nfs/dbraw/zinc/32/97/26/599329726.db2.gz JBNINXPHXYNDFY-CQSZACIVSA-N -1 3 367.478 3.916 20 0 FHADHM Cc1ccc(NC(=O)CS[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000737357979 599332158 /nfs/dbraw/zinc/33/21/58/599332158.db2.gz VQBNFXLIQRCQDB-ZDUSSCGKSA-N -1 3 353.451 3.608 20 0 FHADHM Cc1ccc(NC(=O)CS[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000737357979 599332160 /nfs/dbraw/zinc/33/21/60/599332160.db2.gz VQBNFXLIQRCQDB-ZDUSSCGKSA-N -1 3 353.451 3.608 20 0 FHADHM Clc1cccc(-c2nnc(CSc3ccccc3-c3nnn[n-]3)o2)c1 ZINC000822582446 599343086 /nfs/dbraw/zinc/34/30/86/599343086.db2.gz UFYFXDSHLUTZDC-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1cccc(-c2nnc(CSc3ccccc3-c3nn[n-]n3)o2)c1 ZINC000822582446 599343088 /nfs/dbraw/zinc/34/30/88/599343088.db2.gz UFYFXDSHLUTZDC-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM CCC(C)(C)N(C)C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736316046 599345670 /nfs/dbraw/zinc/34/56/70/599345670.db2.gz XKHSNBUGEHDTKL-UHFFFAOYSA-N -1 3 365.437 3.920 20 0 FHADHM CCC(C)(C)N(C)C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736316046 599345673 /nfs/dbraw/zinc/34/56/73/599345673.db2.gz XKHSNBUGEHDTKL-UHFFFAOYSA-N -1 3 365.437 3.920 20 0 FHADHM CC(C)[C@H](Sc1ccccc1-c1nnn[n-]1)C(=O)N[C@@H]1CCCC[C@@H]1C ZINC000820033590 599348582 /nfs/dbraw/zinc/34/85/82/599348582.db2.gz XJHUDMJSFDVJMM-LXZKKBNFSA-N -1 3 373.526 3.678 20 0 FHADHM CC(C)[C@H](Sc1ccccc1-c1nn[n-]n1)C(=O)N[C@@H]1CCCC[C@@H]1C ZINC000820033590 599348584 /nfs/dbraw/zinc/34/85/84/599348584.db2.gz XJHUDMJSFDVJMM-LXZKKBNFSA-N -1 3 373.526 3.678 20 0 FHADHM c1sc(-c2ccccn2)nc1CSc1ccccc1-c1nnn[n-]1 ZINC000823767154 599351474 /nfs/dbraw/zinc/35/14/74/599351474.db2.gz NUOYTSJYUKYHER-UHFFFAOYSA-N -1 3 352.448 3.678 20 0 FHADHM c1sc(-c2ccccn2)nc1CSc1ccccc1-c1nn[n-]n1 ZINC000823767154 599351477 /nfs/dbraw/zinc/35/14/77/599351477.db2.gz NUOYTSJYUKYHER-UHFFFAOYSA-N -1 3 352.448 3.678 20 0 FHADHM CCN(C(=O)Nc1cc(F)cc(F)c1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736505727 599351808 /nfs/dbraw/zinc/35/18/08/599351808.db2.gz LIICGZVEQMUYMS-NSHDSACASA-N -1 3 372.379 3.760 20 0 FHADHM CCN(C(=O)Nc1cc(F)cc(F)c1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736505727 599351810 /nfs/dbraw/zinc/35/18/10/599351810.db2.gz LIICGZVEQMUYMS-NSHDSACASA-N -1 3 372.379 3.760 20 0 FHADHM C[C@@H](Nc1ncnc2c3ccccc3oc21)c1cccc(-c2nnn[n-]2)c1 ZINC000820462287 599356293 /nfs/dbraw/zinc/35/62/93/599356293.db2.gz XACMZVXPBWOXHN-LLVKDONJSA-N -1 3 357.377 3.729 20 0 FHADHM C[C@@H](Nc1ncnc2c3ccccc3oc21)c1cccc(-c2nn[n-]n2)c1 ZINC000820462287 599356296 /nfs/dbraw/zinc/35/62/96/599356296.db2.gz XACMZVXPBWOXHN-LLVKDONJSA-N -1 3 357.377 3.729 20 0 FHADHM C[C@@H](Nc1ncnc2sc3c(c21)CCC3)c1cccc(-c2nnn[n-]2)c1 ZINC000820461528 599356786 /nfs/dbraw/zinc/35/67/86/599356786.db2.gz LJVSVOCYSMXNHI-SNVBAGLBSA-N -1 3 363.450 3.533 20 0 FHADHM C[C@@H](Nc1ncnc2sc3c(c21)CCC3)c1cccc(-c2nn[n-]n2)c1 ZINC000820461528 599356791 /nfs/dbraw/zinc/35/67/91/599356791.db2.gz LJVSVOCYSMXNHI-SNVBAGLBSA-N -1 3 363.450 3.533 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1CNc1ccccc1OC(C)(C)C ZINC000821736702 607371106 /nfs/dbraw/zinc/37/11/06/607371106.db2.gz MRBIAHMUQBBZIV-UHFFFAOYSA-N -1 3 353.426 3.665 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CNc1ccccc1OC(C)(C)C ZINC000821736702 607371108 /nfs/dbraw/zinc/37/11/08/607371108.db2.gz MRBIAHMUQBBZIV-UHFFFAOYSA-N -1 3 353.426 3.665 20 0 FHADHM C[C@@H](OC(=O)c1ccccc1-c1ccccc1-c1nnn[n-]1)c1ccncc1 ZINC000736161044 599367645 /nfs/dbraw/zinc/36/76/45/599367645.db2.gz BNPOQUKADRIINC-CQSZACIVSA-N -1 3 371.400 3.847 20 0 FHADHM C[C@@H](OC(=O)c1ccccc1-c1ccccc1-c1nn[n-]n1)c1ccncc1 ZINC000736161044 599367647 /nfs/dbraw/zinc/36/76/47/599367647.db2.gz BNPOQUKADRIINC-CQSZACIVSA-N -1 3 371.400 3.847 20 0 FHADHM CCC[C@@H](NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000821021910 599404478 /nfs/dbraw/zinc/40/44/78/599404478.db2.gz PVGLEUTTYJRMJD-KBXCAEBGSA-N -1 3 364.453 3.768 20 0 FHADHM CCC[C@@H](NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000821021910 599404479 /nfs/dbraw/zinc/40/44/79/599404479.db2.gz PVGLEUTTYJRMJD-KBXCAEBGSA-N -1 3 364.453 3.768 20 0 FHADHM CCCn1ccc2ccc(NC(=O)CCc3ccc(-c4nnn[n-]4)cc3)cc21 ZINC000821147497 599411740 /nfs/dbraw/zinc/41/17/40/599411740.db2.gz HEISHRGVVAOGCC-UHFFFAOYSA-N -1 3 374.448 3.803 20 0 FHADHM CCCn1ccc2ccc(NC(=O)CCc3ccc(-c4nn[n-]n4)cc3)cc21 ZINC000821147497 599411744 /nfs/dbraw/zinc/41/17/44/599411744.db2.gz HEISHRGVVAOGCC-UHFFFAOYSA-N -1 3 374.448 3.803 20 0 FHADHM Cc1ccc([C@@H](C)NC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c(C)c1 ZINC000822229423 599418176 /nfs/dbraw/zinc/41/81/76/599418176.db2.gz UPAISJDMSPCKOP-LSDHHAIUSA-N -1 3 364.453 3.605 20 0 FHADHM Cc1ccc([C@@H](C)NC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c(C)c1 ZINC000822229423 599418178 /nfs/dbraw/zinc/41/81/78/599418178.db2.gz UPAISJDMSPCKOP-LSDHHAIUSA-N -1 3 364.453 3.605 20 0 FHADHM Fc1ccc2c(CCNc3cc(Cl)ccc3-c3nnn[n-]3)c[nH]c2c1 ZINC000737664144 599422852 /nfs/dbraw/zinc/42/28/52/599422852.db2.gz CAVYAHOXYQDHDB-UHFFFAOYSA-N -1 3 356.792 3.795 20 0 FHADHM Fc1ccc2c(CCNc3cc(Cl)ccc3-c3nn[n-]n3)c[nH]c2c1 ZINC000737664144 599422853 /nfs/dbraw/zinc/42/28/53/599422853.db2.gz CAVYAHOXYQDHDB-UHFFFAOYSA-N -1 3 356.792 3.795 20 0 FHADHM COc1ccccc1C1(CNc2cc(-c3nnn[n-]3)c3ccccc3n2)CC1 ZINC000737145676 599422896 /nfs/dbraw/zinc/42/28/96/599422896.db2.gz DZAQVQMBIJEAEA-UHFFFAOYSA-N -1 3 372.432 3.567 20 0 FHADHM COc1ccccc1C1(CNc2cc(-c3nn[n-]n3)c3ccccc3n2)CC1 ZINC000737145676 599422897 /nfs/dbraw/zinc/42/28/97/599422897.db2.gz DZAQVQMBIJEAEA-UHFFFAOYSA-N -1 3 372.432 3.567 20 0 FHADHM FC(F)COc1cccc(CNc2cc(Cl)ccc2-c2nnn[n-]2)c1 ZINC000737639097 599425109 /nfs/dbraw/zinc/42/51/09/599425109.db2.gz NQRFHPOUCJKAFC-UHFFFAOYSA-N -1 3 365.771 3.776 20 0 FHADHM FC(F)COc1cccc(CNc2cc(Cl)ccc2-c2nn[n-]n2)c1 ZINC000737639097 599425111 /nfs/dbraw/zinc/42/51/11/599425111.db2.gz NQRFHPOUCJKAFC-UHFFFAOYSA-N -1 3 365.771 3.776 20 0 FHADHM c1ccc([C@@H](Nc2cc(-c3nnn[n-]3)c3ccccc3n2)[C@@H]2CCCO2)cc1 ZINC000738426564 599426056 /nfs/dbraw/zinc/42/60/56/599426056.db2.gz FLNTUFWLTJBVJV-AZUAARDMSA-N -1 3 372.432 3.747 20 0 FHADHM c1ccc([C@@H](Nc2cc(-c3nn[n-]n3)c3ccccc3n2)[C@@H]2CCCO2)cc1 ZINC000738426564 599426058 /nfs/dbraw/zinc/42/60/58/599426058.db2.gz FLNTUFWLTJBVJV-AZUAARDMSA-N -1 3 372.432 3.747 20 0 FHADHM CCCC[C@@H]1CCC[C@H]1NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821043628 599434410 /nfs/dbraw/zinc/43/44/10/599434410.db2.gz QVYXKRYKJHGPHF-JJRVBVJISA-N -1 3 356.474 3.586 20 0 FHADHM CCCC[C@@H]1CCC[C@H]1NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821043628 599434412 /nfs/dbraw/zinc/43/44/12/599434412.db2.gz QVYXKRYKJHGPHF-JJRVBVJISA-N -1 3 356.474 3.586 20 0 FHADHM C[C@H](NC(=O)NCCCCC1CCCC1)c1cccc(-c2nnn[n-]2)c1 ZINC000820365237 599468262 /nfs/dbraw/zinc/46/82/62/599468262.db2.gz INWIMNATGCNXOP-AWEZNQCLSA-N -1 3 356.474 3.587 20 0 FHADHM C[C@H](NC(=O)NCCCCC1CCCC1)c1cccc(-c2nn[n-]n2)c1 ZINC000820365237 599468264 /nfs/dbraw/zinc/46/82/64/599468264.db2.gz INWIMNATGCNXOP-AWEZNQCLSA-N -1 3 356.474 3.587 20 0 FHADHM CCCCOc1ccc(CNc2ccc(F)cc2-c2nnn[n-]2)cc1OC ZINC000821077775 599473714 /nfs/dbraw/zinc/47/37/14/599473714.db2.gz SPKSMOPGWPIPCX-UHFFFAOYSA-N -1 3 371.416 3.805 20 0 FHADHM CCCCOc1ccc(CNc2ccc(F)cc2-c2nn[n-]n2)cc1OC ZINC000821077775 599473715 /nfs/dbraw/zinc/47/37/15/599473715.db2.gz SPKSMOPGWPIPCX-UHFFFAOYSA-N -1 3 371.416 3.805 20 0 FHADHM CCO[C@@H](C)c1nc(CN(C)[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cs1 ZINC000736616635 599475187 /nfs/dbraw/zinc/47/51/87/599475187.db2.gz OPKNQQNUHFTWGV-OLZOCXBDSA-N -1 3 372.498 3.614 20 0 FHADHM CCO[C@@H](C)c1nc(CN(C)[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cs1 ZINC000736616635 599475190 /nfs/dbraw/zinc/47/51/90/599475190.db2.gz OPKNQQNUHFTWGV-OLZOCXBDSA-N -1 3 372.498 3.614 20 0 FHADHM CCO[C@@H](C)c1nc(CSCc2cccc(-c3nnn[n-]3)c2)cs1 ZINC000736612604 599481029 /nfs/dbraw/zinc/48/10/29/599481029.db2.gz ANZFEZHTPODEOY-NSHDSACASA-N -1 3 361.496 3.854 20 0 FHADHM CCO[C@@H](C)c1nc(CSCc2cccc(-c3nn[n-]n3)c2)cs1 ZINC000736612604 599481031 /nfs/dbraw/zinc/48/10/31/599481031.db2.gz ANZFEZHTPODEOY-NSHDSACASA-N -1 3 361.496 3.854 20 0 FHADHM C[C@H](C[C@@H](O)c1ccc(F)cc1)Nc1c(Cl)cccc1-c1nnn[n-]1 ZINC000820231580 607381210 /nfs/dbraw/zinc/38/12/10/607381210.db2.gz BSIIOYXXDNBXMM-MEBBXXQBSA-N -1 3 361.808 3.583 20 0 FHADHM C[C@H](C[C@@H](O)c1ccc(F)cc1)Nc1c(Cl)cccc1-c1nn[n-]n1 ZINC000820231580 607381212 /nfs/dbraw/zinc/38/12/12/607381212.db2.gz BSIIOYXXDNBXMM-MEBBXXQBSA-N -1 3 361.808 3.583 20 0 FHADHM Fc1ccc(Br)c(CNc2ccc(F)cc2-c2nnn[n-]2)c1 ZINC000822761556 599486183 /nfs/dbraw/zinc/48/61/83/599486183.db2.gz PEQRETLIUCMTHU-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1ccc(Br)c(CNc2ccc(F)cc2-c2nn[n-]n2)c1 ZINC000822761556 599486184 /nfs/dbraw/zinc/48/61/84/599486184.db2.gz PEQRETLIUCMTHU-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)N1CCCCC[C@@H]1c1ccco1 ZINC000738151934 599493161 /nfs/dbraw/zinc/49/31/61/599493161.db2.gz KZUHZBGLFCJANA-OAHLLOKOSA-N -1 3 352.398 3.609 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)N1CCCCC[C@@H]1c1ccco1 ZINC000738151934 599493164 /nfs/dbraw/zinc/49/31/64/599493164.db2.gz KZUHZBGLFCJANA-OAHLLOKOSA-N -1 3 352.398 3.609 20 0 FHADHM C[C@@H](C[C@@H](O)c1ccc(F)cc1)Nc1ccc(Cl)cc1-c1nnn[n-]1 ZINC000820232148 607381592 /nfs/dbraw/zinc/38/15/92/607381592.db2.gz FCOBGOFULKQQFF-MGPLVRAMSA-N -1 3 361.808 3.583 20 0 FHADHM C[C@@H](C[C@@H](O)c1ccc(F)cc1)Nc1ccc(Cl)cc1-c1nn[n-]n1 ZINC000820232148 607381593 /nfs/dbraw/zinc/38/15/93/607381593.db2.gz FCOBGOFULKQQFF-MGPLVRAMSA-N -1 3 361.808 3.583 20 0 FHADHM Cc1ccc(C)n1C1CCN(c2c(Cl)cccc2-c2nnn[n-]2)CC1 ZINC000822231875 599508453 /nfs/dbraw/zinc/50/84/53/599508453.db2.gz KQROLVHRLFFWKR-UHFFFAOYSA-N -1 3 356.861 3.780 20 0 FHADHM Cc1ccc(C)n1C1CCN(c2c(Cl)cccc2-c2nn[n-]n2)CC1 ZINC000822231875 599508455 /nfs/dbraw/zinc/50/84/55/599508455.db2.gz KQROLVHRLFFWKR-UHFFFAOYSA-N -1 3 356.861 3.780 20 0 FHADHM C[C@@H](NC(=O)[C@@H](C)c1cccc(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820315226 599510480 /nfs/dbraw/zinc/51/04/80/599510480.db2.gz MHORDSRGJXUZGE-NWDGAFQWSA-N -1 3 355.829 3.501 20 0 FHADHM C[C@@H](NC(=O)[C@@H](C)c1cccc(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820315226 599510482 /nfs/dbraw/zinc/51/04/82/599510482.db2.gz MHORDSRGJXUZGE-NWDGAFQWSA-N -1 3 355.829 3.501 20 0 FHADHM COc1ccc([C@@H]2CCN(c3c(Cl)cccc3-c3nnn[n-]3)C2)cc1 ZINC000821787324 599510824 /nfs/dbraw/zinc/51/08/24/599510824.db2.gz RKJCJUGOAQXGCS-CYBMUJFWSA-N -1 3 355.829 3.523 20 0 FHADHM COc1ccc([C@@H]2CCN(c3c(Cl)cccc3-c3nn[n-]n3)C2)cc1 ZINC000821787324 599510826 /nfs/dbraw/zinc/51/08/26/599510826.db2.gz RKJCJUGOAQXGCS-CYBMUJFWSA-N -1 3 355.829 3.523 20 0 FHADHM CCCCc1ccc(CC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000821077760 599512531 /nfs/dbraw/zinc/51/25/31/599512531.db2.gz RZPXJRXCCLOVFX-HNNXBMFYSA-N -1 3 363.465 3.629 20 0 FHADHM CCCCc1ccc(CC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000821077760 599512533 /nfs/dbraw/zinc/51/25/33/599512533.db2.gz RZPXJRXCCLOVFX-HNNXBMFYSA-N -1 3 363.465 3.629 20 0 FHADHM FC(F)COc1cccc(CNc2c(Cl)cccc2-c2nnn[n-]2)c1 ZINC000822733001 599517311 /nfs/dbraw/zinc/51/73/11/599517311.db2.gz QBIMITCHZFXHOD-UHFFFAOYSA-N -1 3 365.771 3.776 20 0 FHADHM FC(F)COc1cccc(CNc2c(Cl)cccc2-c2nn[n-]n2)c1 ZINC000822733001 599517312 /nfs/dbraw/zinc/51/73/12/599517312.db2.gz QBIMITCHZFXHOD-UHFFFAOYSA-N -1 3 365.771 3.776 20 0 FHADHM C[C@H](S[C@@H]1CCN(c2ccc(-c3nnn[n-]3)cc2)C1=O)c1cccs1 ZINC000736188867 599524168 /nfs/dbraw/zinc/52/41/68/599524168.db2.gz MATZTVWVLOQNQO-XHDPSFHLSA-N -1 3 371.491 3.528 20 0 FHADHM C[C@H](S[C@@H]1CCN(c2ccc(-c3nn[n-]n3)cc2)C1=O)c1cccs1 ZINC000736188867 599524169 /nfs/dbraw/zinc/52/41/69/599524169.db2.gz MATZTVWVLOQNQO-XHDPSFHLSA-N -1 3 371.491 3.528 20 0 FHADHM Cc1ccc(SCCC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000822266784 599527718 /nfs/dbraw/zinc/52/77/18/599527718.db2.gz IOLVPJCMGOMFTO-CQSZACIVSA-N -1 3 367.478 3.535 20 0 FHADHM Cc1ccc(SCCC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000822266784 599527720 /nfs/dbraw/zinc/52/77/20/599527720.db2.gz IOLVPJCMGOMFTO-CQSZACIVSA-N -1 3 367.478 3.535 20 0 FHADHM Cc1ccccc1[C@@H]1C[C@@H](C)N(c2ncc(-c3nnn[n-]3)cc2Cl)C1 ZINC000737420230 599529606 /nfs/dbraw/zinc/52/96/06/599529606.db2.gz DLGCFQUUPFKDEC-TZMCWYRMSA-N -1 3 354.845 3.606 20 0 FHADHM Cc1ccccc1[C@@H]1C[C@@H](C)N(c2ncc(-c3nn[n-]n3)cc2Cl)C1 ZINC000737420230 599529611 /nfs/dbraw/zinc/52/96/11/599529611.db2.gz DLGCFQUUPFKDEC-TZMCWYRMSA-N -1 3 354.845 3.606 20 0 FHADHM Cc1cc(C)c(C=CC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1C ZINC000822194161 599532491 /nfs/dbraw/zinc/53/24/91/599532491.db2.gz LFJKRXYMTLVCAK-QWGSZXSUSA-N -1 3 361.449 3.683 20 0 FHADHM Cc1cc(C)c(C=CC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1C ZINC000822194161 599532492 /nfs/dbraw/zinc/53/24/92/599532492.db2.gz LFJKRXYMTLVCAK-QWGSZXSUSA-N -1 3 361.449 3.683 20 0 FHADHM CC(C)(C)CCC(=O)Nc1ncc(Cc2ccc(-c3nnn[n-]3)cc2)s1 ZINC000735602584 599541092 /nfs/dbraw/zinc/54/10/92/599541092.db2.gz DOMKEHWWZXAAAA-UHFFFAOYSA-N -1 3 370.482 3.679 20 0 FHADHM CC(C)(C)CCC(=O)Nc1ncc(Cc2ccc(-c3nn[n-]n3)cc2)s1 ZINC000735602584 599541094 /nfs/dbraw/zinc/54/10/94/599541094.db2.gz DOMKEHWWZXAAAA-UHFFFAOYSA-N -1 3 370.482 3.679 20 0 FHADHM CCc1ccc([C@H](C)CC(=O)N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000736684626 599542514 /nfs/dbraw/zinc/54/25/14/599542514.db2.gz BHLHVZOZODHXJE-HUUCEWRRSA-N -1 3 363.465 3.800 20 0 FHADHM CCc1ccc([C@H](C)CC(=O)N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000736684626 599542516 /nfs/dbraw/zinc/54/25/16/599542516.db2.gz BHLHVZOZODHXJE-HUUCEWRRSA-N -1 3 363.465 3.800 20 0 FHADHM Fc1ccccc1[C@H]1CCN(c2c(-c3nnn[n-]3)cnc3ccccc32)C1 ZINC000822791376 599545816 /nfs/dbraw/zinc/54/58/16/599545816.db2.gz IAJCPWWVIMIEBX-ZDUSSCGKSA-N -1 3 360.396 3.548 20 0 FHADHM Fc1ccccc1[C@H]1CCN(c2c(-c3nn[n-]n3)cnc3ccccc32)C1 ZINC000822791376 599545818 /nfs/dbraw/zinc/54/58/18/599545818.db2.gz IAJCPWWVIMIEBX-ZDUSSCGKSA-N -1 3 360.396 3.548 20 0 FHADHM CC(C)(NC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1cccc(Cl)c1 ZINC000735671881 599547239 /nfs/dbraw/zinc/54/72/39/599547239.db2.gz PXOVYKKMKRUJJF-ZHACJKMWSA-N -1 3 367.840 3.585 20 0 FHADHM CC(C)(NC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1cccc(Cl)c1 ZINC000735671881 599547241 /nfs/dbraw/zinc/54/72/41/599547241.db2.gz PXOVYKKMKRUJJF-ZHACJKMWSA-N -1 3 367.840 3.585 20 0 FHADHM Cc1ccc([C@H]2C[C@@H](C)CCN2C(=O)Nc2ccc(-c3nnn[n-]3)cc2)o1 ZINC000822232878 599556082 /nfs/dbraw/zinc/55/60/82/599556082.db2.gz CTRSZTAVWFOAGZ-BLLLJJGKSA-N -1 3 366.425 3.773 20 0 FHADHM Cc1ccc([C@H]2C[C@@H](C)CCN2C(=O)Nc2ccc(-c3nn[n-]n3)cc2)o1 ZINC000822232878 599556083 /nfs/dbraw/zinc/55/60/83/599556083.db2.gz CTRSZTAVWFOAGZ-BLLLJJGKSA-N -1 3 366.425 3.773 20 0 FHADHM Fc1ccc(C[C@H]2CCN(c3c(-c4nnn[n-]4)cnc4ccccc43)C2)cc1 ZINC000822766270 599565177 /nfs/dbraw/zinc/56/51/77/599565177.db2.gz HCAUTPHWVTZQST-OAHLLOKOSA-N -1 3 374.423 3.623 20 0 FHADHM Fc1ccc(C[C@H]2CCN(c3c(-c4nn[n-]n4)cnc4ccccc43)C2)cc1 ZINC000822766270 599565179 /nfs/dbraw/zinc/56/51/79/599565179.db2.gz HCAUTPHWVTZQST-OAHLLOKOSA-N -1 3 374.423 3.623 20 0 FHADHM CCCC(C)(C)NC(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736417445 599567558 /nfs/dbraw/zinc/56/75/58/599567558.db2.gz SFPXSNUFQBOBRK-UHFFFAOYSA-N -1 3 364.453 3.919 20 0 FHADHM O=C(Nc1ccsc1)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000738198315 599570675 /nfs/dbraw/zinc/57/06/75/599570675.db2.gz PTXMITMZQOOCMZ-UHFFFAOYSA-N -1 3 362.418 3.924 20 0 FHADHM Cc1cccc2c1ncc(-c1nnn[n-]1)c2N1CC[C@@H](Cc2ccccc2)C1 ZINC000822331931 599580050 /nfs/dbraw/zinc/58/00/50/599580050.db2.gz JOEZJBRPBGUSIM-KRWDZBQOSA-N -1 3 370.460 3.792 20 0 FHADHM Cc1cccc2c1ncc(-c1nn[n-]n1)c2N1CC[C@@H](Cc2ccccc2)C1 ZINC000822331931 599580052 /nfs/dbraw/zinc/58/00/52/599580052.db2.gz JOEZJBRPBGUSIM-KRWDZBQOSA-N -1 3 370.460 3.792 20 0 FHADHM CC[C@@H](c1ccncc1)N(C)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736394804 599608735 /nfs/dbraw/zinc/60/87/35/599608735.db2.gz FKCWHLGJKSISMW-HNNXBMFYSA-N -1 3 371.832 3.530 20 0 FHADHM CC[C@@H](c1ccncc1)N(C)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736394804 599608737 /nfs/dbraw/zinc/60/87/37/599608737.db2.gz FKCWHLGJKSISMW-HNNXBMFYSA-N -1 3 371.832 3.530 20 0 FHADHM CS[C@H]1CCCCN(c2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)C1 ZINC000821956723 607386112 /nfs/dbraw/zinc/38/61/12/607386112.db2.gz WLIQGCHJFNXEDJ-NSHDSACASA-N -1 3 357.405 3.607 20 0 FHADHM CS[C@H]1CCCCN(c2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)C1 ZINC000821956723 607386114 /nfs/dbraw/zinc/38/61/14/607386114.db2.gz WLIQGCHJFNXEDJ-NSHDSACASA-N -1 3 357.405 3.607 20 0 FHADHM Cc1cccc(C)c1C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCC2 ZINC000822293849 599628640 /nfs/dbraw/zinc/62/86/40/599628640.db2.gz OCLOUXHQJMDKOU-UHFFFAOYSA-N -1 3 353.451 3.676 20 0 FHADHM Cc1cccc(C)c1C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCC2 ZINC000822293849 599628641 /nfs/dbraw/zinc/62/86/41/599628641.db2.gz OCLOUXHQJMDKOU-UHFFFAOYSA-N -1 3 353.451 3.676 20 0 FHADHM Cc1ccc([C@@H](C)C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCCC3)o1 ZINC000822227433 599628877 /nfs/dbraw/zinc/62/88/77/599628877.db2.gz ILOKVSRIRLQRRM-LLVKDONJSA-N -1 3 371.466 3.841 20 0 FHADHM Cc1ccc([C@@H](C)C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCCC3)o1 ZINC000822227433 599628878 /nfs/dbraw/zinc/62/88/78/599628878.db2.gz ILOKVSRIRLQRRM-LLVKDONJSA-N -1 3 371.466 3.841 20 0 FHADHM Cc1sc(NC(=O)c2ccc(OC3CCC3)cc2)c(-c2nnn[n-]2)c1C ZINC000822563759 599629012 /nfs/dbraw/zinc/62/90/12/599629012.db2.gz NPRMIIVHPHWCFY-UHFFFAOYSA-N -1 3 369.450 3.729 20 0 FHADHM Cc1sc(NC(=O)c2ccc(OC3CCC3)cc2)c(-c2nn[n-]n2)c1C ZINC000822563759 599629013 /nfs/dbraw/zinc/62/90/13/599629013.db2.gz NPRMIIVHPHWCFY-UHFFFAOYSA-N -1 3 369.450 3.729 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCCCC2)C(F)(F)F ZINC000819875674 599630078 /nfs/dbraw/zinc/63/00/78/599630078.db2.gz BKEDZMRGZFXDHF-MRVPVSSYSA-N -1 3 373.404 3.724 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCCCC2)C(F)(F)F ZINC000819875674 599630079 /nfs/dbraw/zinc/63/00/79/599630079.db2.gz BKEDZMRGZFXDHF-MRVPVSSYSA-N -1 3 373.404 3.724 20 0 FHADHM CCC(CC)(C(=O)OCc1ccc(-c2nnn[n-]2)cc1F)c1ccccc1 ZINC000820882511 599671765 /nfs/dbraw/zinc/67/17/65/599671765.db2.gz SBVTVUMPJJMLQB-UHFFFAOYSA-N -1 3 368.412 3.807 20 0 FHADHM CCC(CC)(C(=O)OCc1ccc(-c2nn[n-]n2)cc1F)c1ccccc1 ZINC000820882511 599671766 /nfs/dbraw/zinc/67/17/66/599671766.db2.gz SBVTVUMPJJMLQB-UHFFFAOYSA-N -1 3 368.412 3.807 20 0 FHADHM C[C@@H](OC(=O)[C@@H](C)CCOc1ccccc1)c1cccc(-c2nnn[n-]2)c1 ZINC000820248588 599684251 /nfs/dbraw/zinc/68/42/51/599684251.db2.gz KTILHLGPXPRILS-LSDHHAIUSA-N -1 3 366.421 3.576 20 0 FHADHM C[C@@H](OC(=O)[C@@H](C)CCOc1ccccc1)c1cccc(-c2nn[n-]n2)c1 ZINC000820248588 599684252 /nfs/dbraw/zinc/68/42/52/599684252.db2.gz KTILHLGPXPRILS-LSDHHAIUSA-N -1 3 366.421 3.576 20 0 FHADHM Cc1ccc(-c2nc(CNc3ccc(-c4nn[n-]n4)cc3F)co2)cc1 ZINC000822214046 599688775 /nfs/dbraw/zinc/68/87/75/599688775.db2.gz MWCSATPJHIYOAM-UHFFFAOYSA-N -1 3 350.357 3.581 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cccc3cnccc32)c1-c1nnn[n-]1 ZINC000821465387 599689688 /nfs/dbraw/zinc/68/96/88/599689688.db2.gz GAJJKBAOMLOUQD-UHFFFAOYSA-N -1 3 364.434 3.600 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cccc3cnccc32)c1-c1nn[n-]n1 ZINC000821465387 599689689 /nfs/dbraw/zinc/68/96/89/599689689.db2.gz GAJJKBAOMLOUQD-UHFFFAOYSA-N -1 3 364.434 3.600 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@H](C)CCOc2ccccc2)s1 ZINC000821465946 599689697 /nfs/dbraw/zinc/68/96/97/599689697.db2.gz RRMXKYHOJSMAFF-GFCCVEGCSA-N -1 3 371.466 3.534 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@H](C)CCOc2ccccc2)s1 ZINC000821465946 599689698 /nfs/dbraw/zinc/68/96/98/599689698.db2.gz RRMXKYHOJSMAFF-GFCCVEGCSA-N -1 3 371.466 3.534 20 0 FHADHM COc1cc(CN(C)[C@H](C(=O)[O-])c2ccc(F)cc2)ccc1OC(F)F ZINC000572533149 599709159 /nfs/dbraw/zinc/70/91/59/599709159.db2.gz UPACOGQUEKHBBN-INIZCTEOSA-N -1 3 369.339 3.693 20 0 FHADHM CC[C@H](C)N(CC(=O)NCc1ccc(NC(=O)[O-])cc1)Cc1ccccc1 ZINC000736885522 599712695 /nfs/dbraw/zinc/71/26/95/599712695.db2.gz YBZMVSSPQPZNFO-INIZCTEOSA-N -1 3 369.465 3.693 20 0 FHADHM CC(C)Oc1ccc(NC(=O)[C@H](C)c2ccccc2F)cc1-c1nnn[n-]1 ZINC000820160597 607396927 /nfs/dbraw/zinc/39/69/27/607396927.db2.gz MNSLHUXOSGWXTM-GFCCVEGCSA-N -1 3 369.400 3.535 20 0 FHADHM CC(C)Oc1ccc(NC(=O)[C@H](C)c2ccccc2F)cc1-c1nn[n-]n1 ZINC000820160597 607396928 /nfs/dbraw/zinc/39/69/28/607396928.db2.gz MNSLHUXOSGWXTM-GFCCVEGCSA-N -1 3 369.400 3.535 20 0 FHADHM C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCCCN1Cc1cccc(C(=O)[O-])c1 ZINC000736649480 599849992 /nfs/dbraw/zinc/84/99/92/599849992.db2.gz GUQSPSYIHGVITN-YOEHRIQHSA-N -1 3 362.470 3.653 20 0 FHADHM O=C([O-])c1ccc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)o1 ZINC000581197234 599851632 /nfs/dbraw/zinc/85/16/32/599851632.db2.gz YYMDTUWJYVKTDE-ZDUSSCGKSA-N -1 3 371.368 3.547 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@@H]1C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000826316701 607402290 /nfs/dbraw/zinc/40/22/90/607402290.db2.gz WGUNUQLXQGIUOE-GLQYFDAESA-N -1 3 354.435 3.645 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@@H]1C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000826316701 607402291 /nfs/dbraw/zinc/40/22/91/607402291.db2.gz WGUNUQLXQGIUOE-GLQYFDAESA-N -1 3 354.435 3.645 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1COC(=O)[C@H](C)c1ccc(Cl)s1 ZINC000826252944 607406405 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C[C@@](NCc1ccc(F)c(F)c1)(C(=O)[O-])c1cccc(Br)c1 ZINC000736665105 600080115 /nfs/dbraw/zinc/08/01/15/600080115.db2.gz UKXYGHUCRAOZOQ-INIZCTEOSA-N -1 3 370.193 3.817 20 0 FHADHM Cc1sc(NC(=O)CN[C@@H](c2ccccc2)C(C)C)c(C(=O)[O-])c1C ZINC000738998092 600117144 /nfs/dbraw/zinc/11/71/44/600117144.db2.gz XGYLIMYVOYQRLO-QGZVFWFLSA-N -1 3 360.479 3.989 20 0 FHADHM Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2 ZINC000826316482 607428818 /nfs/dbraw/zinc/42/88/18/607428818.db2.gz POGCNDYUKXUGHJ-QWRGUYRKSA-N -1 3 371.491 3.529 20 0 FHADHM Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2 ZINC000826316482 607428819 /nfs/dbraw/zinc/42/88/19/607428819.db2.gz POGCNDYUKXUGHJ-QWRGUYRKSA-N -1 3 371.491 3.529 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1nc2ccc(Cl)cc2s1 ZINC000826251168 607428974 /nfs/dbraw/zinc/42/89/74/607428974.db2.gz HLWVJNRFWDUQGX-UHFFFAOYSA-N -1 3 370.825 3.691 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1nc2ccc(Cl)cc2s1 ZINC000826251168 607428976 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FHADHM C[C@H](N[C@@H](C(=O)[O-])c1cccc(Cl)c1)c1ccc2c(c1)CCC(=O)N2 ZINC000736661265 600423874 /nfs/dbraw/zinc/42/38/74/600423874.db2.gz DNUZQFPEDATECJ-BBATYDOGSA-N -1 3 358.825 3.701 20 0 FHADHM C[C@@H](N[C@H](C(=O)[O-])c1ccc(F)cc1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000736662056 600424096 /nfs/dbraw/zinc/42/40/96/600424096.db2.gz KXXOMVXXGOELCR-XIKOKIGWSA-N -1 3 371.412 3.586 20 0 FHADHM Cc1ccc(C(=O)[O-])cc1NC(=O)[C@@H](C)N1CCC[C@@]2(CC=CCC2)C1 ZINC000738518668 600448919 /nfs/dbraw/zinc/44/89/19/600448919.db2.gz MPAJSEOISUTNFZ-IERDGZPVSA-N -1 3 356.466 3.843 20 0 FHADHM Cc1ccccc1[C@H]1C[C@@H](C)N(CC(=O)N(C)c2ccccc2C(=O)[O-])C1 ZINC000738761806 600470668 /nfs/dbraw/zinc/47/06/68/600470668.db2.gz WQYLQJBJFKYBIP-SJORKVTESA-N -1 3 366.461 3.534 20 0 FHADHM Cc1cc(C)cc([C@H](C)N[C@H]2CCN(c3sccc3C(=O)[O-])C2=O)c1 ZINC000832875230 600694105 /nfs/dbraw/zinc/69/41/05/600694105.db2.gz QGVCBCFOWZXXAN-BBRMVZONSA-N -1 3 358.463 3.519 20 0 FHADHM CC(C)N(CC(=O)Nc1c(Cl)cc(Cl)cc1C(=O)[O-])C1CCC1 ZINC000736457254 600717188 /nfs/dbraw/zinc/71/71/88/600717188.db2.gz GGXSJJGXQIGFFP-UHFFFAOYSA-N -1 3 359.253 3.893 20 0 FHADHM O=C([O-])c1ccc(OCCN2CCC[C@@H]2c2ccc(O)cc2)c(Cl)c1 ZINC000833321517 600991592 /nfs/dbraw/zinc/99/15/92/600991592.db2.gz WGJAOYAFPRQBPQ-QGZVFWFLSA-N -1 3 361.825 3.960 20 0 FHADHM C[C@@](NCc1ccc(Cl)nc1)(C(=O)[O-])c1cccc(Br)c1 ZINC000827740860 601005885 /nfs/dbraw/zinc/00/58/85/601005885.db2.gz DMTCJPADSZDXCL-HNNXBMFYSA-N -1 3 369.646 3.587 20 0 FHADHM Cc1cc2oc(=O)cc(CN[C@@H](c3ccccc3)[C@H](C)C(=O)[O-])c2cc1C ZINC000832906848 601203599 /nfs/dbraw/zinc/20/35/99/601203599.db2.gz YTESCEMOVWOKSA-YCRPNKLZSA-N -1 3 365.429 3.961 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)CN[C@H](c2ccccc2)[C@H](C)C(=O)[O-])cc1C ZINC000832920474 601203637 /nfs/dbraw/zinc/20/36/37/601203637.db2.gz AZCLDKPCLJOHOK-FIKGOQFSSA-N -1 3 368.477 3.532 20 0 FHADHM CCCN(Cc1ccn(C(CC)CC)n1)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000825323002 607516608 /nfs/dbraw/zinc/51/66/08/607516608.db2.gz MVVKEYFIAUHWCX-UHFFFAOYSA-N -1 3 367.501 3.837 20 0 FHADHM Cc1sc(C(=O)[O-])cc1CN1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000833032511 601615272 /nfs/dbraw/zinc/61/52/72/601615272.db2.gz IJNREIFHFQVHKE-HNNXBMFYSA-N -1 3 359.447 3.863 20 0 FHADHM O=C([O-])c1ccc(CN2CCC[C@H](c3cc(C(F)(F)F)n[nH]3)C2)cc1F ZINC000833313090 601647679 /nfs/dbraw/zinc/64/76/79/601647679.db2.gz OOJPOHHLONZBEO-NSHDSACASA-N -1 3 371.334 3.645 20 0 FHADHM CCc1cccc(C)c1NC(=O)CN[C@@H](c1ccccc1)[C@H](C)C(=O)[O-] ZINC000830260126 601654892 /nfs/dbraw/zinc/65/48/92/601654892.db2.gz RREXETNROATUGO-MGPUTAFESA-N -1 3 354.450 3.548 20 0 FHADHM C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCCCN1Cc1ccsc1C(=O)[O-] ZINC000827688308 601811274 /nfs/dbraw/zinc/81/12/74/601811274.db2.gz UTKBDDNBPSANLK-OCCSQVGLSA-N -1 3 368.499 3.714 20 0 FHADHM CN(C[C@@H](O)c1cccc(Cl)c1)[C@H](C(=O)[O-])c1cc(F)c(F)c(F)c1 ZINC000830714818 601902577 /nfs/dbraw/zinc/90/25/77/601902577.db2.gz YXRGYSKBISPHNG-ZBFHGGJFSA-N -1 3 373.758 3.548 20 0 FHADHM C[C@H](c1nc(-c2cccc(C(F)(F)F)c2)no1)N1CC[C@@](C)(C(=O)[O-])C1 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3.683 20 0 FHADHM CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1ccc(NC(=O)[O-])cc1 ZINC000739614028 602600105 /nfs/dbraw/zinc/60/01/05/602600105.db2.gz QYCJLHLBTCNSRR-UHFFFAOYSA-N -1 3 374.416 3.511 20 0 FHADHM CC[C@@H](SC)C(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)cc1 ZINC000825159002 607577631 /nfs/dbraw/zinc/57/76/31/607577631.db2.gz GVTRUHRHIIHLPB-MRXNPFEDSA-N -1 3 369.450 3.739 20 0 FHADHM CC[C@@H](SC)C(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)cc1 ZINC000825159002 607577633 /nfs/dbraw/zinc/57/76/33/607577633.db2.gz GVTRUHRHIIHLPB-MRXNPFEDSA-N -1 3 369.450 3.739 20 0 FHADHM Cc1nn(-c2ccccc2)c(C)c1CNC[C@H](NC(=O)[O-])c1ccccc1 ZINC000830840410 603177814 /nfs/dbraw/zinc/17/78/14/603177814.db2.gz RPNXBJYWPVMESF-FQEVSTJZSA-N -1 3 364.449 3.588 20 0 FHADHM Cc1nn(-c2ccccc2)c(C)c1CNC[C@@H](NC(=O)[O-])c1ccccc1 ZINC000830840412 603178030 /nfs/dbraw/zinc/17/80/30/603178030.db2.gz RPNXBJYWPVMESF-HXUWFJFHSA-N -1 3 364.449 3.588 20 0 FHADHM O=C([O-])N[C@H](CNCc1cnc(-c2ccccc2)s1)c1ccccc1 ZINC000832141505 603178371 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Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1CC[C@H](C)Sc2ccccc21 ZINC000826244052 607654624 /nfs/dbraw/zinc/65/46/24/607654624.db2.gz FTWJCEMTHAHSCE-ZDUSSCGKSA-N -1 3 365.462 3.706 20 0 FHADHM CC[C@@H](NCc1cccc2c1N(C(=O)[O-])CC2)c1ccc2c(c1)OCCO2 ZINC000826621002 603853866 /nfs/dbraw/zinc/85/38/66/603853866.db2.gz WZVDPOIVMFORFA-QGZVFWFLSA-N -1 3 368.433 3.739 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1CCC(C2CCCCC2)CC1 ZINC000826244329 607665022 /nfs/dbraw/zinc/66/50/22/607665022.db2.gz OLUNHHPYTQWRQO-UHFFFAOYSA-N -1 3 353.470 3.608 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1CCC(C2CCCCC2)CC1 ZINC000826244329 607665024 /nfs/dbraw/zinc/66/50/24/607665024.db2.gz OLUNHHPYTQWRQO-UHFFFAOYSA-N -1 3 353.470 3.608 20 0 FHADHM Cc1ccc(CN(C)C)cc1NC(=O)CC[C@@H](NC(=O)[O-])c1ccccc1 ZINC000830307709 604084082 /nfs/dbraw/zinc/08/40/82/604084082.db2.gz DVMXMRBNLSAUPT-GOSISDBHSA-N -1 3 369.465 3.784 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1CC(C)(C)c2c1cccc2Cl ZINC000826244015 607675130 /nfs/dbraw/zinc/67/51/30/607675130.db2.gz DVMNACYYFSCEQS-UHFFFAOYSA-N -1 3 367.840 3.767 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1CC(C)(C)c2c1cccc2Cl ZINC000826244015 607675132 /nfs/dbraw/zinc/67/51/32/607675132.db2.gz DVMNACYYFSCEQS-UHFFFAOYSA-N -1 3 367.840 3.767 20 0 FHADHM CCCn1ccc2cc(NC(=O)c3ccc(-c4nnn[n-]4)cc3C)ccc21 ZINC000825362501 607676352 /nfs/dbraw/zinc/67/63/52/607676352.db2.gz MQWZXDHNXVITIR-UHFFFAOYSA-N -1 3 360.421 3.792 20 0 FHADHM CCCn1ccc2cc(NC(=O)c3ccc(-c4nn[n-]n4)cc3C)ccc21 ZINC000825362501 607676354 /nfs/dbraw/zinc/67/63/54/607676354.db2.gz MQWZXDHNXVITIR-UHFFFAOYSA-N -1 3 360.421 3.792 20 0 FHADHM FC(F)(F)c1csc(CNc2ccc(Cl)c(-c3nnn[n-]3)c2)n1 ZINC000826369148 607685077 /nfs/dbraw/zinc/68/50/77/607685077.db2.gz PCLVZYZBSHHVOT-UHFFFAOYSA-N -1 3 360.752 3.608 20 0 FHADHM FC(F)(F)c1csc(CNc2ccc(Cl)c(-c3nn[n-]n3)c2)n1 ZINC000826369148 607685079 /nfs/dbraw/zinc/68/50/79/607685079.db2.gz PCLVZYZBSHHVOT-UHFFFAOYSA-N -1 3 360.752 3.608 20 0 FHADHM CCCN(C(=O)c1ccc(-c2nnn[n-]2)cc1C)c1ccc(Cl)cc1 ZINC000825301850 607687467 /nfs/dbraw/zinc/68/74/67/607687467.db2.gz PZKMZHOASCOQAT-UHFFFAOYSA-N -1 3 355.829 3.885 20 0 FHADHM CCCN(C(=O)c1ccc(-c2nn[n-]n2)cc1C)c1ccc(Cl)cc1 ZINC000825301850 607687469 /nfs/dbraw/zinc/68/74/69/607687469.db2.gz PZKMZHOASCOQAT-UHFFFAOYSA-N -1 3 355.829 3.885 20 0 FHADHM Cc1cc([C@H](C)N2CCC(C(=O)Nc3ccccc3)CC2)oc1C(=O)[O-] ZINC000832871188 604382791 /nfs/dbraw/zinc/38/27/91/604382791.db2.gz QNOFAODSWSZCNF-AWEZNQCLSA-N -1 3 356.422 3.698 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1C[C@@H](C)C[C@@H]1c1cccc(F)c1 ZINC000826244534 607695923 /nfs/dbraw/zinc/69/59/23/607695923.db2.gz WMWKAUVKQJOKGF-KPZWWZAWSA-N -1 3 365.412 3.538 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1C[C@@H](C)C[C@@H]1c1cccc(F)c1 ZINC000826244534 607695924 /nfs/dbraw/zinc/69/59/24/607695924.db2.gz WMWKAUVKQJOKGF-KPZWWZAWSA-N -1 3 365.412 3.538 20 0 FHADHM C[C@@H](C(=O)[O-])[C@@H](NCc1ccc(OCC(F)(F)F)nc1)c1ccccc1 ZINC000826055013 604484481 /nfs/dbraw/zinc/48/44/81/604484481.db2.gz UPJOMULFOXIIKE-MLGOLLRUSA-N -1 3 368.355 3.574 20 0 FHADHM O=C([O-])[C@H](c1ccc(Cl)cc1Cl)N1CC[C@@]2(O)CCCC[C@H]2C1 ZINC000833170959 604499677 /nfs/dbraw/zinc/49/96/77/604499677.db2.gz KWMSQKKLODLDAH-KCTSRDHCSA-N -1 3 358.265 3.746 20 0 FHADHM C[C@@H](Oc1ccc(CN(C)Cc2ccc(OC(F)F)cc2)cc1)C(=O)[O-] ZINC000833539263 604519733 /nfs/dbraw/zinc/51/97/33/604519733.db2.gz XYNXSGAOXHTPED-CYBMUJFWSA-N -1 3 365.376 3.772 20 0 FHADHM CCOc1ccc([C@H]2CCCN2Cc2c(C)nn(CCC(=O)[O-])c2C)cc1 ZINC000833664111 604523968 /nfs/dbraw/zinc/52/39/68/604523968.db2.gz OPSUPQWMDMXPKJ-HXUWFJFHSA-N -1 3 371.481 3.710 20 0 FHADHM Cc1cc([C@@H](C)OC(=O)C2CCN(Cc3ccccc3)CC2)oc1C(=O)[O-] ZINC000832878350 604590969 /nfs/dbraw/zinc/59/09/69/604590969.db2.gz XJVWOEUCHZKBFA-OAHLLOKOSA-N -1 3 371.433 3.803 20 0 FHADHM C[C@H](Oc1ccc(CN(Cc2ccccc2)C[C@@H]2CCCO2)cc1)C(=O)[O-] ZINC000833538205 604608017 /nfs/dbraw/zinc/60/80/17/604608017.db2.gz RRJJRXCSOVFHII-UWJYYQICSA-N -1 3 369.461 3.720 20 0 FHADHM CC[C@@](C)(COc1ncccc1Cl)NCc1cc(C(=O)[O-])c(C)o1 ZINC000833639091 604719025 /nfs/dbraw/zinc/71/90/25/604719025.db2.gz YJRYGWGGKHPIIR-KRWDZBQOSA-N -1 3 352.818 3.672 20 0 FHADHM CC[C@@H](C)Sc1ccc(NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)c(C)c1 ZINC000825076117 607714901 /nfs/dbraw/zinc/71/49/01/607714901.db2.gz TURFDRBMOBXROG-LLVKDONJSA-N -1 3 356.455 3.646 20 0 FHADHM CC[C@@H](C)Sc1ccc(NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)c(C)c1 ZINC000825076117 607714903 /nfs/dbraw/zinc/71/49/03/607714903.db2.gz TURFDRBMOBXROG-LLVKDONJSA-N -1 3 356.455 3.646 20 0 FHADHM C[C@H](c1ccccc1)N1CC[C@@H](Nc2nc(Cl)c(C(=O)[O-])s2)C1 ZINC000833548502 604825933 /nfs/dbraw/zinc/82/59/33/604825933.db2.gz LDDLQNZJBVFFHH-ZYHUDNBSSA-N -1 3 351.859 3.742 20 0 FHADHM Cc1ccccc1-c1noc([C@@H](C)N2CCC[C@H](C(C)(C)C(=O)[O-])C2)n1 ZINC000652499839 604931372 /nfs/dbraw/zinc/93/13/72/604931372.db2.gz ORJASZSHVSIUPI-CABCVRRESA-N -1 3 357.454 3.929 20 0 FHADHM CN(C(=O)CN[C@H](c1ccc(F)cc1)C1CCC1)c1ccccc1C(=O)[O-] ZINC000833686552 604948462 /nfs/dbraw/zinc/94/84/62/604948462.db2.gz ZDXLNCDYJKMUBL-FQEVSTJZSA-N -1 3 370.424 3.618 20 0 FHADHM COCc1cccc(CN[C@@H](C(=O)[O-])c2ccccc2C(F)(F)F)c1 ZINC000833726219 604975386 /nfs/dbraw/zinc/97/53/86/604975386.db2.gz WZXYCOHAQRCNAP-MRXNPFEDSA-N -1 3 353.340 3.767 20 0 FHADHM COCc1cccc(CN(C)[C@@H](C(=O)[O-])c2cc(F)c(F)c(F)c2)c1 ZINC000833726087 604975613 /nfs/dbraw/zinc/97/56/13/604975613.db2.gz QVBKUULWFWLDDK-QGZVFWFLSA-N -1 3 353.340 3.508 20 0 FHADHM c1ccc([C@@H]2CN(c3nc4ccccc4cc3-c3nnn[n-]3)CCS2)cc1 ZINC000826520302 607729285 /nfs/dbraw/zinc/72/92/85/607729285.db2.gz FQSGDJUXALJLAS-SFHVURJKSA-N -1 3 374.473 3.709 20 0 FHADHM c1ccc([C@@H]2CN(c3nc4ccccc4cc3-c3nn[n-]n3)CCS2)cc1 ZINC000826520302 607729287 /nfs/dbraw/zinc/72/92/87/607729287.db2.gz FQSGDJUXALJLAS-SFHVURJKSA-N -1 3 374.473 3.709 20 0 FHADHM O=C(Nc1cccc(Sc2ccccc2)c1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC000826457358 607731725 /nfs/dbraw/zinc/73/17/25/607731725.db2.gz XZPPWVAFMYNDNH-UHFFFAOYSA-N -1 3 362.418 3.598 20 0 FHADHM O=C(Nc1cccc(Sc2ccccc2)c1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC000826457358 607731728 /nfs/dbraw/zinc/73/17/28/607731728.db2.gz XZPPWVAFMYNDNH-UHFFFAOYSA-N -1 3 362.418 3.598 20 0 FHADHM COc1ccc([C@H]2CCCN2Cc2ccccc2CC(=O)[O-])c(OC)c1 ZINC000833732994 605063182 /nfs/dbraw/zinc/06/31/82/605063182.db2.gz YWIYDOFKOSYTCX-LJQANCHMSA-N -1 3 355.434 3.668 20 0 FHADHM Cc1c([C@@H](C)NCCc2ccc(NC(=O)[O-])cc2)nnn1-c1ccccc1 ZINC000829859367 605113878 /nfs/dbraw/zinc/11/38/78/605113878.db2.gz MFHYVKDMNAATCZ-CQSZACIVSA-N -1 3 365.437 3.559 20 0 FHADHM C[C@@H](NC(=O)[O-])c1ccc(CN[C@@H](C)c2ccc([S@](C)=O)cc2)cc1 ZINC000825502878 605118794 /nfs/dbraw/zinc/11/87/94/605118794.db2.gz LZHVCDQXPKXBHO-ODZUORAKSA-N -1 3 360.479 3.603 20 0 FHADHM CCOc1cc(Cl)ccc1CNc1ncc(-c2nnn[n-]2)cc1Cl ZINC000825615862 607735976 /nfs/dbraw/zinc/73/59/76/607735976.db2.gz NQRUSTCUQBEUSU-UHFFFAOYSA-N -1 3 365.224 3.579 20 0 FHADHM CCOc1cc(Cl)ccc1CNc1ncc(-c2nn[n-]n2)cc1Cl ZINC000825615862 607735977 /nfs/dbraw/zinc/73/59/77/607735977.db2.gz NQRUSTCUQBEUSU-UHFFFAOYSA-N -1 3 365.224 3.579 20 0 FHADHM C[C@H]1CC(C)(C)C[C@](CO)(NCc2coc(-c3ccc(C(=O)[O-])cc3)n2)C1 ZINC000833588669 605214933 /nfs/dbraw/zinc/21/49/33/605214933.db2.gz ITTHVPHXURKRNB-LHSJRXKWSA-N -1 3 372.465 3.707 20 0 FHADHM C[C@H]1CC(C)(C)C[C@@](CO)(NCc2coc(-c3ccc(C(=O)[O-])cc3)n2)C1 ZINC000833588672 605215213 /nfs/dbraw/zinc/21/52/13/605215213.db2.gz ITTHVPHXURKRNB-QKKBWIMNSA-N -1 3 372.465 3.707 20 0 FHADHM COc1cc(F)cc(CN[C@H](C(=O)[O-])c2ccccc2C(F)(F)F)c1 ZINC000833730043 605262008 /nfs/dbraw/zinc/26/20/08/605262008.db2.gz ZNUMSHLMCHVYRZ-HNNXBMFYSA-N -1 3 357.303 3.769 20 0 FHADHM CC[C@@H](CSc1ccccc1)NC(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000825126942 607757340 /nfs/dbraw/zinc/75/73/40/607757340.db2.gz KGZJPBSIUOMMGB-AWEZNQCLSA-N -1 3 368.466 3.559 20 0 FHADHM CC[C@@H](CSc1ccccc1)NC(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000825126942 607757341 /nfs/dbraw/zinc/75/73/41/607757341.db2.gz KGZJPBSIUOMMGB-AWEZNQCLSA-N -1 3 368.466 3.559 20 0 FHADHM CC1([C@H]2CCCN([C@@H](C(=O)[O-])c3cccc(Cl)c3Cl)C2)OCCO1 ZINC000833564729 605444555 /nfs/dbraw/zinc/44/45/55/605444555.db2.gz PGFLWOXNXNPWBB-XHDPSFHLSA-N -1 3 374.264 3.594 20 0 FHADHM O=C(C=Cc1ccccc1)Nc1nc(-c2cccc(-c3nnn[n-]3)c2)cs1 ZINC000826400718 607769988 /nfs/dbraw/zinc/76/99/88/607769988.db2.gz GJIAWEPFQDUTDF-KTKRTIGZSA-N -1 3 374.429 3.642 20 0 FHADHM O=C(C=Cc1ccccc1)Nc1nc(-c2cccc(-c3nn[n-]n3)c2)cs1 ZINC000826400718 607769989 /nfs/dbraw/zinc/76/99/89/607769989.db2.gz GJIAWEPFQDUTDF-KTKRTIGZSA-N -1 3 374.429 3.642 20 0 FHADHM O=C([O-])N[C@@H]1C[C@H](NCc2ccnc(N3CCCCC3)c2)c2ccccc21 ZINC000834156480 605791494 /nfs/dbraw/zinc/79/14/94/605791494.db2.gz APWGTYWWDSOXSP-RBUKOAKNSA-N -1 3 366.465 3.615 20 0 FHADHM O=C([O-])N[C@@H]1C[C@@H](NCc2ccc(-n3ccnc3)c(F)c2)c2ccccc21 ZINC000834159856 605795719 /nfs/dbraw/zinc/79/57/19/605795719.db2.gz YYOUVQWVCUUYRN-QZTJIDSGSA-N -1 3 366.396 3.555 20 0 FHADHM CC[C@H]1CN(c2ncc(-c3nnn[n-]3)cc2Cl)CC[C@H]1c1ccccc1 ZINC000820995458 606038554 /nfs/dbraw/zinc/03/85/54/606038554.db2.gz ROKAIUYJZLVQBL-XJKSGUPXSA-N -1 3 368.872 3.935 20 0 FHADHM CC[C@H]1CN(c2ncc(-c3nn[n-]n3)cc2Cl)CC[C@H]1c1ccccc1 ZINC000820995458 606038559 /nfs/dbraw/zinc/03/85/59/606038559.db2.gz ROKAIUYJZLVQBL-XJKSGUPXSA-N -1 3 368.872 3.935 20 0 FHADHM CCOc1ccccc1[C@H](CC(C)C)Nc1ccc(-c2nnn[n-]2)cn1 ZINC000821431386 606042368 /nfs/dbraw/zinc/04/23/68/606042368.db2.gz SLTIZHDKMALXOL-INIZCTEOSA-N -1 3 352.442 3.860 20 0 FHADHM CCOc1ccccc1[C@H](CC(C)C)Nc1ccc(-c2nn[n-]n2)cn1 ZINC000821431386 606042372 /nfs/dbraw/zinc/04/23/72/606042372.db2.gz SLTIZHDKMALXOL-INIZCTEOSA-N -1 3 352.442 3.860 20 0 FHADHM Cc1ccccc1[C@@H]1CCN(c2nc3ccccc3cc2-c2nnn[n-]2)C1 ZINC000822351239 606068386 /nfs/dbraw/zinc/06/83/86/606068386.db2.gz MQLHOKFRVGVELX-MRXNPFEDSA-N -1 3 356.433 3.717 20 0 FHADHM Cc1ccccc1[C@@H]1CCN(c2nc3ccccc3cc2-c2nn[n-]n2)C1 ZINC000822351239 606068392 /nfs/dbraw/zinc/06/83/92/606068392.db2.gz MQLHOKFRVGVELX-MRXNPFEDSA-N -1 3 356.433 3.717 20 0 FHADHM C[C@H](C(=O)Nc1cccc(-c2nnn[n-]2)c1)c1ccc(Cl)c(Cl)c1 ZINC000471671498 606098923 /nfs/dbraw/zinc/09/89/23/606098923.db2.gz NUMLBGJYYYCUEI-VIFPVBQESA-N -1 3 362.220 3.916 20 0 FHADHM C[C@H](C(=O)Nc1cccc(-c2nn[n-]n2)c1)c1ccc(Cl)c(Cl)c1 ZINC000471671498 606098925 /nfs/dbraw/zinc/09/89/25/606098925.db2.gz NUMLBGJYYYCUEI-VIFPVBQESA-N -1 3 362.220 3.916 20 0 FHADHM C[C@H](C(=O)Nc1ccc(-c2nnn[n-]2)cc1)c1ccc(Cl)c(Cl)c1 ZINC000471905872 606099551 /nfs/dbraw/zinc/09/95/51/606099551.db2.gz NTYKQZSHJJJIIR-VIFPVBQESA-N -1 3 362.220 3.916 20 0 FHADHM C[C@H](C(=O)Nc1ccc(-c2nn[n-]n2)cc1)c1ccc(Cl)c(Cl)c1 ZINC000471905872 606099556 /nfs/dbraw/zinc/09/95/56/606099556.db2.gz NTYKQZSHJJJIIR-VIFPVBQESA-N -1 3 362.220 3.916 20 0 FHADHM CC[C@H](C)[C@H](C)N(C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)C1CC1 ZINC000820859355 606116830 /nfs/dbraw/zinc/11/68/30/606116830.db2.gz DIXQNXOEKQFXIX-MJBXVCDLSA-N -1 3 356.474 3.536 20 0 FHADHM CC[C@H](C)[C@H](C)N(C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)C1CC1 ZINC000820859355 606116832 /nfs/dbraw/zinc/11/68/32/606116832.db2.gz DIXQNXOEKQFXIX-MJBXVCDLSA-N -1 3 356.474 3.536 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)C(C)=Cc2ccc(F)cc2)s1 ZINC000821466236 606126739 /nfs/dbraw/zinc/12/67/39/606126739.db2.gz VGPIRUBDPJWECW-CSKARUKUSA-N -1 3 357.414 3.672 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)C(C)=Cc2ccc(F)cc2)s1 ZINC000821466236 606126740 /nfs/dbraw/zinc/12/67/40/606126740.db2.gz VGPIRUBDPJWECW-CSKARUKUSA-N -1 3 357.414 3.672 20 0 FHADHM CC[C@@H](C)Oc1ccc(NCc2ccc(OC)c(-c3nnn[n-]3)c2)cc1 ZINC000820875659 606132352 /nfs/dbraw/zinc/13/23/52/606132352.db2.gz BYOKEMRMCVVJBH-CYBMUJFWSA-N -1 3 353.426 3.665 20 0 FHADHM CC[C@@H](C)Oc1ccc(NCc2ccc(OC)c(-c3nn[n-]n3)c2)cc1 ZINC000820875659 606132353 /nfs/dbraw/zinc/13/23/53/606132353.db2.gz BYOKEMRMCVVJBH-CYBMUJFWSA-N -1 3 353.426 3.665 20 0 FHADHM Cc1sc(NC(=O)c2scnc2C(C)(C)C)c(-c2nnn[n-]2)c1C ZINC000822563475 606148457 /nfs/dbraw/zinc/14/84/57/606148457.db2.gz KLKSLTGBEULWHB-UHFFFAOYSA-N -1 3 362.484 3.551 20 0 FHADHM Cc1sc(NC(=O)c2scnc2C(C)(C)C)c(-c2nn[n-]n2)c1C ZINC000822563475 606148459 /nfs/dbraw/zinc/14/84/59/606148459.db2.gz KLKSLTGBEULWHB-UHFFFAOYSA-N -1 3 362.484 3.551 20 0 FHADHM O=C([C@H]1CC12CCCC2)N(Cc1ccco1)c1ccccc1-c1nnn[n-]1 ZINC000822917102 606148949 /nfs/dbraw/zinc/14/89/49/606148949.db2.gz NLKYTLZLXOTLJQ-MRXNPFEDSA-N -1 3 363.421 3.573 20 0 FHADHM O=C([C@H]1CC12CCCC2)N(Cc1ccco1)c1ccccc1-c1nn[n-]n1 ZINC000822917102 606148951 /nfs/dbraw/zinc/14/89/51/606148951.db2.gz NLKYTLZLXOTLJQ-MRXNPFEDSA-N -1 3 363.421 3.573 20 0 FHADHM C[C@H]1c2ccccc2CN1C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000820827561 606154359 /nfs/dbraw/zinc/15/43/59/606154359.db2.gz UAPGTHBMGLETJQ-LBPRGKRZSA-N -1 3 365.441 3.532 20 0 FHADHM C[C@H]1c2ccccc2CN1C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000820827561 606154360 /nfs/dbraw/zinc/15/43/60/606154360.db2.gz UAPGTHBMGLETJQ-LBPRGKRZSA-N -1 3 365.441 3.532 20 0 FHADHM Cc1ccc(CCCC(=O)Nc2sc(C)c(C)c2-c2nnn[n-]2)s1 ZINC000822235936 606183414 /nfs/dbraw/zinc/18/34/14/606183414.db2.gz CHDLMTVUZFNQJN-UHFFFAOYSA-N -1 3 361.496 3.876 20 0 FHADHM Cc1ccc(CCCC(=O)Nc2sc(C)c(C)c2-c2nn[n-]n2)s1 ZINC000822235936 606183416 /nfs/dbraw/zinc/18/34/16/606183416.db2.gz CHDLMTVUZFNQJN-UHFFFAOYSA-N -1 3 361.496 3.876 20 0 FHADHM Cc1ccc(CCCC(=O)O[C@@H](C)c2cccc(-c3nnn[n-]3)c2)s1 ZINC000822235912 606206073 /nfs/dbraw/zinc/20/60/73/606206073.db2.gz BLIZSTOPWBYSGT-ZDUSSCGKSA-N -1 3 356.451 3.864 20 0 FHADHM Cc1ccc(CCCC(=O)O[C@@H](C)c2cccc(-c3nn[n-]n3)c2)s1 ZINC000822235912 606206075 /nfs/dbraw/zinc/20/60/75/606206075.db2.gz BLIZSTOPWBYSGT-ZDUSSCGKSA-N -1 3 356.451 3.864 20 0 FHADHM O=C(Nc1sc2c(c1-c1nnn[n-]1)CCCCCC2)[C@H]1C[C@H]1C1CC1 ZINC000823387645 606233209 /nfs/dbraw/zinc/23/32/09/606233209.db2.gz SDKIRUGHVHZARF-STQMWFEESA-N -1 3 357.483 3.572 20 0 FHADHM O=C(Nc1sc2c(c1-c1nn[n-]n1)CCCCCC2)[C@H]1C[C@H]1C1CC1 ZINC000823387645 606233211 /nfs/dbraw/zinc/23/32/11/606233211.db2.gz SDKIRUGHVHZARF-STQMWFEESA-N -1 3 357.483 3.572 20 0 FHADHM O=C(Nc1ccc(Oc2ccccc2-c2nnn[n-]2)cc1)[C@H]1C[C@@H]1C1CC1 ZINC000823357658 606236986 /nfs/dbraw/zinc/23/69/86/606236986.db2.gz XDWHQLHNVUIIMA-SJORKVTESA-N -1 3 361.405 3.644 20 0 FHADHM O=C(Nc1ccc(Oc2ccccc2-c2nn[n-]n2)cc1)[C@H]1C[C@@H]1C1CC1 ZINC000823357658 606236988 /nfs/dbraw/zinc/23/69/88/606236988.db2.gz XDWHQLHNVUIIMA-SJORKVTESA-N -1 3 361.405 3.644 20 0 FHADHM C[C@@H](NC(=O)c1ccc(Sc2ccccc2-c2nnn[n-]2)cc1)C1CC1 ZINC000820396847 606247588 /nfs/dbraw/zinc/24/75/88/606247588.db2.gz IRBAWYCREKPKFM-GFCCVEGCSA-N -1 3 365.462 3.546 20 0 FHADHM C[C@@H](NC(=O)c1ccc(Sc2ccccc2-c2nn[n-]n2)cc1)C1CC1 ZINC000820396847 606247590 /nfs/dbraw/zinc/24/75/90/606247590.db2.gz IRBAWYCREKPKFM-GFCCVEGCSA-N -1 3 365.462 3.546 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)c1ccc(-c2ccc(F)cc2)o1 ZINC000823344065 606263780 /nfs/dbraw/zinc/26/37/80/606263780.db2.gz PPHPXGLEZGXISV-UHFFFAOYSA-N -1 3 367.315 3.657 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)c1ccc(-c2ccc(F)cc2)o1 ZINC000823344065 606263781 /nfs/dbraw/zinc/26/37/81/606263781.db2.gz PPHPXGLEZGXISV-UHFFFAOYSA-N -1 3 367.315 3.657 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)c1ccc2c(c1)-c1ccccc1C2 ZINC000823346290 606272229 /nfs/dbraw/zinc/27/22/29/606272229.db2.gz LDMAXMZTWYEHOV-UHFFFAOYSA-N -1 3 371.375 3.829 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)c1ccc2c(c1)-c1ccccc1C2 ZINC000823346290 606272231 /nfs/dbraw/zinc/27/22/31/606272231.db2.gz LDMAXMZTWYEHOV-UHFFFAOYSA-N -1 3 371.375 3.829 20 0 FHADHM C[C@@H](Sc1cccc(-c2nnn[n-]2)c1)c1nc(-c2cccs2)no1 ZINC000820554917 606324828 /nfs/dbraw/zinc/32/48/28/606324828.db2.gz BMXXNLBIZABKJY-SECBINFHSA-N -1 3 356.436 3.832 20 0 FHADHM C[C@@H](Sc1cccc(-c2nn[n-]n2)c1)c1nc(-c2cccs2)no1 ZINC000820554917 606324829 /nfs/dbraw/zinc/32/48/29/606324829.db2.gz BMXXNLBIZABKJY-SECBINFHSA-N -1 3 356.436 3.832 20 0 FHADHM C[C@@H](Oc1ccccc1Cl)C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820550202 606339080 /nfs/dbraw/zinc/33/90/80/606339080.db2.gz VTJUXLXKEWOKPB-NWDGAFQWSA-N -1 3 372.812 3.592 20 0 FHADHM C[C@@H](Oc1ccccc1Cl)C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820550202 606339082 /nfs/dbraw/zinc/33/90/82/606339082.db2.gz VTJUXLXKEWOKPB-NWDGAFQWSA-N -1 3 372.812 3.592 20 0 FHADHM COc1ccccc1C(C)=CC(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821882704 606341491 /nfs/dbraw/zinc/34/14/91/606341491.db2.gz INYHEXWFKJJMMR-DINCDJDBSA-N -1 3 364.405 3.583 20 0 FHADHM COc1ccccc1C(C)=CC(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821882704 606341492 /nfs/dbraw/zinc/34/14/92/606341492.db2.gz INYHEXWFKJJMMR-DINCDJDBSA-N -1 3 364.405 3.583 20 0 FHADHM CC(C)Oc1ccccc1C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820178052 606341509 /nfs/dbraw/zinc/34/15/09/606341509.db2.gz GDRSXWJDGGMHKP-ZDUSSCGKSA-N -1 3 352.394 3.572 20 0 FHADHM CC(C)Oc1ccccc1C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820178052 606341510 /nfs/dbraw/zinc/34/15/10/606341510.db2.gz GDRSXWJDGGMHKP-ZDUSSCGKSA-N -1 3 352.394 3.572 20 0 FHADHM COc1ccccc1[C@H](C)CC(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821882478 606341660 /nfs/dbraw/zinc/34/16/60/606341660.db2.gz BXWSRZVOQLMZLF-ZIAGYGMSSA-N -1 3 366.421 3.673 20 0 FHADHM COc1ccccc1[C@H](C)CC(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821882478 606341662 /nfs/dbraw/zinc/34/16/62/606341662.db2.gz BXWSRZVOQLMZLF-ZIAGYGMSSA-N -1 3 366.421 3.673 20 0 FHADHM C[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820678621 606342559 /nfs/dbraw/zinc/34/25/59/606342559.db2.gz WKOKPLBXFZHSDD-JRPNMDOOSA-N -1 3 360.849 3.705 20 0 FHADHM C[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820678621 606342561 /nfs/dbraw/zinc/34/25/61/606342561.db2.gz WKOKPLBXFZHSDD-JRPNMDOOSA-N -1 3 360.849 3.705 20 0 FHADHM C[C@@H](OC(=O)c1ccccc1Br)c1ccc(-c2nnn[n-]2)cc1 ZINC000820512902 606343024 /nfs/dbraw/zinc/34/30/24/606343024.db2.gz PFLISTBCADDPJF-SNVBAGLBSA-N -1 3 373.210 3.547 20 0 FHADHM C[C@@H](OC(=O)c1ccccc1Br)c1ccc(-c2nn[n-]n2)cc1 ZINC000820512902 606343026 /nfs/dbraw/zinc/34/30/26/606343026.db2.gz PFLISTBCADDPJF-SNVBAGLBSA-N -1 3 373.210 3.547 20 0 FHADHM CC(C)Oc1ccccc1CC(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820178100 606345391 /nfs/dbraw/zinc/34/53/91/606345391.db2.gz HORAMASAYQUFPN-CQSZACIVSA-N -1 3 366.421 3.501 20 0 FHADHM CC(C)Oc1ccccc1CC(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820178100 606345394 /nfs/dbraw/zinc/34/53/94/606345394.db2.gz HORAMASAYQUFPN-CQSZACIVSA-N -1 3 366.421 3.501 20 0 FHADHM C[C@@H](OC(=O)[C@@H](C)c1cccc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820481729 606347039 /nfs/dbraw/zinc/34/70/39/606347039.db2.gz ZGGDHHWVKXFKQF-NWDGAFQWSA-N -1 3 356.813 3.928 20 0 FHADHM C[C@@H](OC(=O)[C@@H](C)c1cccc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820481729 606347041 /nfs/dbraw/zinc/34/70/41/606347041.db2.gz ZGGDHHWVKXFKQF-NWDGAFQWSA-N -1 3 356.813 3.928 20 0 FHADHM C[C@H](CC(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccccc1F ZINC000820225476 606355832 /nfs/dbraw/zinc/35/58/32/606355832.db2.gz JORJMBMPLDOMBX-CHWSQXEVSA-N -1 3 354.385 3.804 20 0 FHADHM C[C@H](CC(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccccc1F ZINC000820225476 606355834 /nfs/dbraw/zinc/35/58/34/606355834.db2.gz JORJMBMPLDOMBX-CHWSQXEVSA-N -1 3 354.385 3.804 20 0 FHADHM Cc1ccccc1[C@H](C)N(C)C(=O)Nc1ccc(F)cc1-c1nnn[n-]1 ZINC000822345445 606356271 /nfs/dbraw/zinc/35/62/71/606356271.db2.gz JFNMZHFRKIOGON-LBPRGKRZSA-N -1 3 354.389 3.539 20 0 FHADHM Cc1ccccc1[C@H](C)N(C)C(=O)Nc1ccc(F)cc1-c1nn[n-]n1 ZINC000822345445 606356273 /nfs/dbraw/zinc/35/62/73/606356273.db2.gz JFNMZHFRKIOGON-LBPRGKRZSA-N -1 3 354.389 3.539 20 0 FHADHM C[C@H](OC(=O)c1csc(-c2ccoc2)n1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820518674 606359172 /nfs/dbraw/zinc/35/91/72/606359172.db2.gz ISZGILRINDTKHE-JTQLQIEISA-N -1 3 367.390 3.501 20 0 FHADHM C[C@H](OC(=O)c1csc(-c2ccoc2)n1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820518674 606359173 /nfs/dbraw/zinc/35/91/73/606359173.db2.gz ISZGILRINDTKHE-JTQLQIEISA-N -1 3 367.390 3.501 20 0 FHADHM C[C@H](C(=O)Oc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1)C1CC1 ZINC000819883134 606360678 /nfs/dbraw/zinc/36/06/78/606360678.db2.gz FEMFLDMKLBUWQJ-LBPRGKRZSA-N -1 3 350.378 3.611 20 0 FHADHM C[C@H](C(=O)Oc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1)C1CC1 ZINC000819883134 606360679 /nfs/dbraw/zinc/36/06/79/606360679.db2.gz FEMFLDMKLBUWQJ-LBPRGKRZSA-N -1 3 350.378 3.611 20 0 FHADHM Clc1ccc(-c2nc(COc3ccccc3-c3nnn[n-]3)co2)cc1 ZINC000822568470 606381197 /nfs/dbraw/zinc/38/11/97/606381197.db2.gz RSVFZEZKKNVIGA-UHFFFAOYSA-N -1 3 353.769 3.754 20 0 FHADHM Clc1ccc(-c2nc(COc3ccccc3-c3nn[n-]n3)co2)cc1 ZINC000822568470 606381199 /nfs/dbraw/zinc/38/11/99/606381199.db2.gz RSVFZEZKKNVIGA-UHFFFAOYSA-N -1 3 353.769 3.754 20 0 FHADHM C[C@H](Nc1ccc(-c2nn[n-]n2)cc1F)c1nc2ccccc2n1C(F)F ZINC000820457346 606444848 /nfs/dbraw/zinc/44/48/48/606444848.db2.gz ZYMLDDILYTYGMQ-VIFPVBQESA-N -1 3 373.342 3.924 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)cc1CNc1cccc(OCC(F)(F)F)c1 ZINC000822761330 606447449 /nfs/dbraw/zinc/44/74/49/606447449.db2.gz ITIPCVPBSMQQFL-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CNc1cccc(OCC(F)(F)F)c1 ZINC000822761330 606447451 /nfs/dbraw/zinc/44/74/51/606447451.db2.gz ITIPCVPBSMQQFL-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM Cc1oc(-c2cccs2)nc1CNc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000822535491 606457673 /nfs/dbraw/zinc/45/76/73/606457673.db2.gz UAMDRJSETRUYTI-UHFFFAOYSA-N -1 3 356.386 3.643 20 0 FHADHM Cc1oc(-c2cccs2)nc1CNc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000822535491 606457674 /nfs/dbraw/zinc/45/76/74/606457674.db2.gz UAMDRJSETRUYTI-UHFFFAOYSA-N -1 3 356.386 3.643 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)cc1CNc1cccc(CC(F)(F)F)c1 ZINC000822761624 606463412 /nfs/dbraw/zinc/46/34/12/606463412.db2.gz QFDZLHZCGHVMQM-UHFFFAOYSA-N -1 3 351.307 3.723 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CNc1cccc(CC(F)(F)F)c1 ZINC000822761624 606463414 /nfs/dbraw/zinc/46/34/14/606463414.db2.gz QFDZLHZCGHVMQM-UHFFFAOYSA-N -1 3 351.307 3.723 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)cc1CNc1ccccc1CC(F)(F)F ZINC000822761696 606463481 /nfs/dbraw/zinc/46/34/81/606463481.db2.gz QZJLQZCYXNOSDM-UHFFFAOYSA-N -1 3 351.307 3.723 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CNc1ccccc1CC(F)(F)F ZINC000822761696 606463483 /nfs/dbraw/zinc/46/34/83/606463483.db2.gz QZJLQZCYXNOSDM-UHFFFAOYSA-N -1 3 351.307 3.723 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)O[C@H](C1CCCC1)C(F)(F)F ZINC000822936486 606470583 /nfs/dbraw/zinc/47/05/83/606470583.db2.gz VGBBCIKZKAFASL-BOLDSZDNSA-N -1 3 366.343 3.544 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)O[C@H](C1CCCC1)C(F)(F)F ZINC000822936486 606470585 /nfs/dbraw/zinc/47/05/85/606470585.db2.gz VGBBCIKZKAFASL-BOLDSZDNSA-N -1 3 366.343 3.544 20 0 FHADHM CCSc1ccc(Cl)cc1C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000084258711 606476406 /nfs/dbraw/zinc/47/64/06/606476406.db2.gz FXYKHFSCSXDVHL-UHFFFAOYSA-N -1 3 359.842 3.884 20 0 FHADHM CCSc1ccc(Cl)cc1C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000084258711 606476408 /nfs/dbraw/zinc/47/64/08/606476408.db2.gz FXYKHFSCSXDVHL-UHFFFAOYSA-N -1 3 359.842 3.884 20 0 FHADHM Fc1ccc([C@H]2CCCCN2c2ncc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000822766175 606476421 /nfs/dbraw/zinc/47/64/21/606476421.db2.gz FLEVCPSHAAMMOC-OAHLLOKOSA-N -1 3 358.808 3.786 20 0 FHADHM Fc1ccc([C@H]2CCCCN2c2ncc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000822766175 606476423 /nfs/dbraw/zinc/47/64/23/606476423.db2.gz FLEVCPSHAAMMOC-OAHLLOKOSA-N -1 3 358.808 3.786 20 0 FHADHM O=C(Cc1cccc(-c2nnn[n-]2)c1)Nc1ccc2oc3ccccc3c2c1 ZINC000823108485 606488119 /nfs/dbraw/zinc/48/81/19/606488119.db2.gz ORFPYOINCLJPGY-UHFFFAOYSA-N -1 3 369.384 3.947 20 0 FHADHM O=C(Cc1cccc(-c2nn[n-]n2)c1)Nc1ccc2oc3ccccc3c2c1 ZINC000823108485 606488121 /nfs/dbraw/zinc/48/81/21/606488121.db2.gz ORFPYOINCLJPGY-UHFFFAOYSA-N -1 3 369.384 3.947 20 0 FHADHM O=C(Cc1cccc(-c2nnn[n-]2)c1)Nc1cccc(Oc2ccccc2)c1 ZINC000823108418 606488237 /nfs/dbraw/zinc/48/82/37/606488237.db2.gz MYSTUFIQQWFLMS-UHFFFAOYSA-N -1 3 371.400 3.840 20 0 FHADHM O=C(Cc1cccc(-c2nn[n-]n2)c1)Nc1cccc(Oc2ccccc2)c1 ZINC000823108418 606488239 /nfs/dbraw/zinc/48/82/39/606488239.db2.gz MYSTUFIQQWFLMS-UHFFFAOYSA-N -1 3 371.400 3.840 20 0 FHADHM CC(C)(C)[C@@H](NC(=O)c1cc(-c2nnn[n-]2)cs1)c1ccc(F)cc1 ZINC000819899292 606493826 /nfs/dbraw/zinc/49/38/26/606493826.db2.gz QKOAJOGPMLNTDL-AWEZNQCLSA-N -1 3 359.430 3.585 20 0 FHADHM CC(C)(C)[C@@H](NC(=O)c1cc(-c2nn[n-]n2)cs1)c1ccc(F)cc1 ZINC000819899292 606493827 /nfs/dbraw/zinc/49/38/27/606493827.db2.gz QKOAJOGPMLNTDL-AWEZNQCLSA-N -1 3 359.430 3.585 20 0 FHADHM CCCOc1ccc(NC(=O)c2cc(-c3nnn[n-]3)cs2)cc1Cl ZINC000821134478 606495623 /nfs/dbraw/zinc/49/56/23/606495623.db2.gz WYRNCJLAILPKRP-UHFFFAOYSA-N -1 3 363.830 3.623 20 0 FHADHM CCCOc1ccc(NC(=O)c2cc(-c3nn[n-]n3)cs2)cc1Cl ZINC000821134478 606495624 /nfs/dbraw/zinc/49/56/24/606495624.db2.gz WYRNCJLAILPKRP-UHFFFAOYSA-N -1 3 363.830 3.623 20 0 FHADHM CCCn1ccc2cc(NC(=O)c3cc(-c4nnn[n-]4)cs3)ccc21 ZINC000821148758 606500157 /nfs/dbraw/zinc/50/01/57/606500157.db2.gz PFNCFVINMZIWKH-UHFFFAOYSA-N -1 3 352.423 3.545 20 0 FHADHM CCCn1ccc2cc(NC(=O)c3cc(-c4nn[n-]n4)cs3)ccc21 ZINC000821148758 606500159 /nfs/dbraw/zinc/50/01/59/606500159.db2.gz PFNCFVINMZIWKH-UHFFFAOYSA-N -1 3 352.423 3.545 20 0 FHADHM CCCN(C(=O)Cc1cccc(-c2nnn[n-]2)c1)[C@H](CC)c1ccccc1 ZINC000821083439 606505441 /nfs/dbraw/zinc/50/54/41/606505441.db2.gz YZUXVMIVACSNDI-LJQANCHMSA-N -1 3 363.465 3.799 20 0 FHADHM CCCN(C(=O)Cc1cccc(-c2nn[n-]n2)c1)[C@H](CC)c1ccccc1 ZINC000821083439 606505442 /nfs/dbraw/zinc/50/54/42/606505442.db2.gz YZUXVMIVACSNDI-LJQANCHMSA-N -1 3 363.465 3.799 20 0 FHADHM CCc1ccc([C@H]2CCCCCN2C(=O)c2cc(-c3nnn[n-]3)cs2)o1 ZINC000821481574 606516139 /nfs/dbraw/zinc/51/61/39/606516139.db2.gz LJDCQXWNELCPMV-CQSZACIVSA-N -1 3 371.466 3.841 20 0 FHADHM CCc1ccc([C@H]2CCCCCN2C(=O)c2cc(-c3nn[n-]n3)cs2)o1 ZINC000821481574 606516141 /nfs/dbraw/zinc/51/61/41/606516141.db2.gz LJDCQXWNELCPMV-CQSZACIVSA-N -1 3 371.466 3.841 20 0 FHADHM CC[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)cs2)CC[C@@H]1c1ccccc1 ZINC000820989259 606524137 /nfs/dbraw/zinc/52/41/37/606524137.db2.gz PJBJTZYRTDSCCY-CJNGLKHVSA-N -1 3 367.478 3.584 20 0 FHADHM CC[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)cs2)CC[C@@H]1c1ccccc1 ZINC000820989259 606524139 /nfs/dbraw/zinc/52/41/39/606524139.db2.gz PJBJTZYRTDSCCY-CJNGLKHVSA-N -1 3 367.478 3.584 20 0 FHADHM CC1CC(NC(=O)Nc2ccc(Oc3ccc(-c4nnn[n-]4)cc3)cc2)C1 ZINC000820658578 606574111 /nfs/dbraw/zinc/57/41/11/606574111.db2.gz UBDYQQAFEPHABY-UHFFFAOYSA-N -1 3 364.409 3.579 20 0 FHADHM CC1CC(NC(=O)Nc2ccc(Oc3ccc(-c4nn[n-]n4)cc3)cc2)C1 ZINC000820658578 606574112 /nfs/dbraw/zinc/57/41/12/606574112.db2.gz UBDYQQAFEPHABY-UHFFFAOYSA-N -1 3 364.409 3.579 20 0 FHADHM C[C@@H]1CCCN1C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000820709525 606577728 /nfs/dbraw/zinc/57/77/28/606577728.db2.gz JXVIAHDGZXVEEA-CYBMUJFWSA-N -1 3 364.409 3.675 20 0 FHADHM C[C@@H]1CCCN1C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000820709525 606577730 /nfs/dbraw/zinc/57/77/30/606577730.db2.gz JXVIAHDGZXVEEA-CYBMUJFWSA-N -1 3 364.409 3.675 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)/C=C1\CC[C@H](C)C1 ZINC000820087737 606618465 /nfs/dbraw/zinc/61/84/65/606618465.db2.gz YPSVPSYWJZFGPB-VUVCFOEZSA-N -1 3 353.470 3.598 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)/C=C1\CC[C@H](C)C1 ZINC000820087737 606618467 /nfs/dbraw/zinc/61/84/67/606618467.db2.gz YPSVPSYWJZFGPB-VUVCFOEZSA-N -1 3 353.470 3.598 20 0 FHADHM CC1CC(C(=O)Nc2ccc(Oc3ccccc3-c3nnn[n-]3)c(F)c2)C1 ZINC000820649316 606620401 /nfs/dbraw/zinc/62/04/01/606620401.db2.gz KPMTVEVFJSVFAU-UHFFFAOYSA-N -1 3 367.384 3.783 20 0 FHADHM CC1CC(C(=O)Nc2ccc(Oc3ccccc3-c3nn[n-]n3)c(F)c2)C1 ZINC000820649316 606620402 /nfs/dbraw/zinc/62/04/02/606620402.db2.gz KPMTVEVFJSVFAU-UHFFFAOYSA-N -1 3 367.384 3.783 20 0 FHADHM CC1CC(C(=O)Nc2sc3c(c2-c2nnn[n-]2)-c2ccccc2CC3)C1 ZINC000820649552 606621889 /nfs/dbraw/zinc/62/18/89/606621889.db2.gz MNPBPHGIAXRGHJ-UHFFFAOYSA-N -1 3 365.462 3.678 20 0 FHADHM CC1CC(C(=O)Nc2sc3c(c2-c2nn[n-]n2)-c2ccccc2CC3)C1 ZINC000820649552 606621890 /nfs/dbraw/zinc/62/18/90/606621890.db2.gz MNPBPHGIAXRGHJ-UHFFFAOYSA-N -1 3 365.462 3.678 20 0 FHADHM O=C(c1ccc(-c2nnn[n-]2)cc1)N1CCCCC[C@@H]1/C=C\c1ccccc1 ZINC000823478790 606626871 /nfs/dbraw/zinc/62/68/71/606626871.db2.gz SPEHDSZVOIKFQQ-CKOFDZGGSA-N -1 3 373.460 3.965 20 0 FHADHM O=C(c1ccc(-c2nn[n-]n2)cc1)N1CCCCC[C@@H]1/C=C\c1ccccc1 ZINC000823478790 606626872 /nfs/dbraw/zinc/62/68/72/606626872.db2.gz SPEHDSZVOIKFQQ-CKOFDZGGSA-N -1 3 373.460 3.965 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)Nc1cccc(NC2CCCC2)c1 ZINC000823309435 606632164 /nfs/dbraw/zinc/63/21/64/606632164.db2.gz YWYGRCWRSNLIHE-UHFFFAOYSA-N -1 3 363.425 3.865 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)Nc1cccc(NC2CCCC2)c1 ZINC000823309435 606632165 /nfs/dbraw/zinc/63/21/65/606632165.db2.gz YWYGRCWRSNLIHE-UHFFFAOYSA-N -1 3 363.425 3.865 20 0 FHADHM COCC[C@H](C)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)cc1C ZINC000821685364 606661235 /nfs/dbraw/zinc/66/12/35/606661235.db2.gz AVMCMXUAFWDIST-HNNXBMFYSA-N -1 3 367.453 3.591 20 0 FHADHM COCC[C@H](C)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)cc1C ZINC000821685364 606661236 /nfs/dbraw/zinc/66/12/36/606661236.db2.gz AVMCMXUAFWDIST-HNNXBMFYSA-N -1 3 367.453 3.591 20 0 FHADHM CC[C@H](c1ccccc1)N(CC)C(=O)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000820938459 606670240 /nfs/dbraw/zinc/67/02/40/606670240.db2.gz JCYASWHLPJJVIC-MRXNPFEDSA-N -1 3 371.391 3.758 20 0 FHADHM CC[C@H](c1ccccc1)N(CC)C(=O)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000820938459 606670241 /nfs/dbraw/zinc/67/02/41/606670241.db2.gz JCYASWHLPJJVIC-MRXNPFEDSA-N -1 3 371.391 3.758 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H]2C[C@@H]2Cc2ccccc2)c1-c1nnn[n-]1 ZINC000821465749 606676918 /nfs/dbraw/zinc/67/69/18/606676918.db2.gz NTFQBURRYHYBEZ-DZGCQCFKSA-N -1 3 367.478 3.616 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H]2C[C@@H]2Cc2ccccc2)c1-c1nn[n-]n1 ZINC000821465749 606676919 /nfs/dbraw/zinc/67/69/19/606676919.db2.gz NTFQBURRYHYBEZ-DZGCQCFKSA-N -1 3 367.478 3.616 20 0 FHADHM O=C(O[C@H]1CCCc2cc(F)ccc21)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000823393451 606685452 /nfs/dbraw/zinc/68/54/52/606685452.db2.gz XVOHWWTZRONOLP-HNNXBMFYSA-N -1 3 374.322 3.518 20 0 FHADHM O=C(O[C@H]1CCCc2cc(F)ccc21)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000823393451 606685453 /nfs/dbraw/zinc/68/54/53/606685453.db2.gz XVOHWWTZRONOLP-HNNXBMFYSA-N -1 3 374.322 3.518 20 0 FHADHM CC(C)[C@H]1CCN(C(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)C1 ZINC000820037765 606689299 /nfs/dbraw/zinc/68/92/99/606689299.db2.gz HNOCFPBLYDOLEH-HNNXBMFYSA-N -1 3 361.449 3.652 20 0 FHADHM CC(C)[C@H]1CCN(C(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)C1 ZINC000820037765 606689300 /nfs/dbraw/zinc/68/93/00/606689300.db2.gz HNOCFPBLYDOLEH-HNNXBMFYSA-N -1 3 361.449 3.652 20 0 FHADHM O=C(N[C@@H](c1ccccc1)c1cccc(F)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000823139741 606693703 /nfs/dbraw/zinc/69/37/03/606693703.db2.gz LBRQCXOKDQKSJV-IBGZPJMESA-N -1 3 373.391 3.525 20 0 FHADHM O=C(N[C@@H](c1ccccc1)c1cccc(F)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000823139741 606693704 /nfs/dbraw/zinc/69/37/04/606693704.db2.gz LBRQCXOKDQKSJV-IBGZPJMESA-N -1 3 373.391 3.525 20 0 FHADHM O=C(N[C@H](c1ccccc1F)C1CCCC1)c1cc(-c2nnn[n-]2)cs1 ZINC000823139254 606693843 /nfs/dbraw/zinc/69/38/43/606693843.db2.gz AJXAQWMHQNACTH-INIZCTEOSA-N -1 3 371.441 3.729 20 0 FHADHM O=C(N[C@H](c1ccccc1F)C1CCCC1)c1cc(-c2nn[n-]n2)cs1 ZINC000823139254 606693844 /nfs/dbraw/zinc/69/38/44/606693844.db2.gz AJXAQWMHQNACTH-INIZCTEOSA-N -1 3 371.441 3.729 20 0 FHADHM O=C(N[C@H](c1ccccc1F)C1CCCC1)c1sccc1-c1nnn[n-]1 ZINC000823140375 606693921 /nfs/dbraw/zinc/69/39/21/606693921.db2.gz UMGKQGHIGGURBC-HNNXBMFYSA-N -1 3 371.441 3.729 20 0 FHADHM O=C(N[C@H](c1ccccc1F)C1CCCC1)c1sccc1-c1nn[n-]n1 ZINC000823140375 606693922 /nfs/dbraw/zinc/69/39/22/606693922.db2.gz UMGKQGHIGGURBC-HNNXBMFYSA-N -1 3 371.441 3.729 20 0 FHADHM C[C@H]1CN(C(=S)Nc2ccccc2-c2nnn[n-]2)c2ccccc2S1 ZINC000820742879 606694674 /nfs/dbraw/zinc/69/46/74/606694674.db2.gz NEGJHMQFVUHRJD-NSHDSACASA-N -1 3 368.491 3.564 20 0 FHADHM C[C@H]1CN(C(=S)Nc2ccccc2-c2nn[n-]n2)c2ccccc2S1 ZINC000820742879 606694675 /nfs/dbraw/zinc/69/46/75/606694675.db2.gz NEGJHMQFVUHRJD-NSHDSACASA-N -1 3 368.491 3.564 20 0 FHADHM O=C(O[C@@H]1CC[C@H]2CCCC[C@H]2C1)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000823391827 606748442 /nfs/dbraw/zinc/74/84/42/606748442.db2.gz GPDBPQZETNJKBH-NTZNESFSSA-N -1 3 362.380 3.661 20 0 FHADHM O=C(O[C@@H]1CC[C@H]2CCCC[C@H]2C1)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000823391827 606748443 /nfs/dbraw/zinc/74/84/43/606748443.db2.gz GPDBPQZETNJKBH-NTZNESFSSA-N -1 3 362.380 3.661 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(Oc2ccnc(-c3ccccc3)n2)c1 ZINC000822574460 606789732 /nfs/dbraw/zinc/78/97/32/606789732.db2.gz VBLMEBCOKMLPLX-UHFFFAOYSA-N -1 3 350.769 3.769 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(Oc2ccnc(-c3ccccc3)n2)c1 ZINC000822574460 606789733 /nfs/dbraw/zinc/78/97/33/606789733.db2.gz VBLMEBCOKMLPLX-UHFFFAOYSA-N -1 3 350.769 3.769 20 0 FHADHM Clc1ccc2c(c1)ncnc2Oc1cc(Cl)ccc1-c1nnn[n-]1 ZINC000822574216 606789942 /nfs/dbraw/zinc/78/99/42/606789942.db2.gz QSNLTTFFSNCSMF-UHFFFAOYSA-N -1 3 359.176 3.909 20 0 FHADHM Clc1ccc2c(c1)ncnc2Oc1cc(Cl)ccc1-c1nn[n-]n1 ZINC000822574216 606789944 /nfs/dbraw/zinc/78/99/44/606789944.db2.gz QSNLTTFFSNCSMF-UHFFFAOYSA-N -1 3 359.176 3.909 20 0 FHADHM FC(F)(F)c1ccccc1C1CCN(c2ncccc2-c2nnn[n-]2)CC1 ZINC000822728703 606790448 /nfs/dbraw/zinc/79/04/48/606790448.db2.gz KBEBTKFEQYUSQT-UHFFFAOYSA-N -1 3 374.370 3.665 20 0 FHADHM FC(F)(F)c1ccccc1C1CCN(c2ncccc2-c2nn[n-]n2)CC1 ZINC000822728703 606790450 /nfs/dbraw/zinc/79/04/50/606790450.db2.gz KBEBTKFEQYUSQT-UHFFFAOYSA-N -1 3 374.370 3.665 20 0 FHADHM CCN(C(=O)c1cccc(C(C)C)n1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821160447 606800055 /nfs/dbraw/zinc/80/00/55/606800055.db2.gz KWEBSAKCNPGTJT-CQSZACIVSA-N -1 3 364.453 3.608 20 0 FHADHM CCN(C(=O)c1cccc(C(C)C)n1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821160447 606800057 /nfs/dbraw/zinc/80/00/57/606800057.db2.gz KWEBSAKCNPGTJT-CQSZACIVSA-N -1 3 364.453 3.608 20 0 FHADHM CC(C)c1cccc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCC3)n1 ZINC000820191921 606808968 /nfs/dbraw/zinc/80/89/68/606808968.db2.gz ASSOLHRKOXBHEB-UHFFFAOYSA-N -1 3 368.466 3.578 20 0 FHADHM CC(C)c1cccc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCC3)n1 ZINC000820191921 606808970 /nfs/dbraw/zinc/80/89/70/606808970.db2.gz ASSOLHRKOXBHEB-UHFFFAOYSA-N -1 3 368.466 3.578 20 0 FHADHM CCCCc1noc(CSc2ccc(-c3nnn[n-]3)cc2Cl)n1 ZINC000821082133 606851812 /nfs/dbraw/zinc/85/18/12/606851812.db2.gz GYPQAMMZJTVORF-UHFFFAOYSA-N -1 3 350.835 3.538 20 0 FHADHM CCCCc1noc(CSc2ccc(-c3nn[n-]n3)cc2Cl)n1 ZINC000821082133 606851813 /nfs/dbraw/zinc/85/18/13/606851813.db2.gz GYPQAMMZJTVORF-UHFFFAOYSA-N -1 3 350.835 3.538 20 0 FHADHM C[C@@H](OC(=O)c1cncc(-c2ccccc2)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820518431 606867157 /nfs/dbraw/zinc/86/71/57/606867157.db2.gz DMSSEWMRAYXVPJ-CQSZACIVSA-N -1 3 371.400 3.847 20 0 FHADHM C[C@@H](OC(=O)c1cncc(-c2ccccc2)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820518431 606867159 /nfs/dbraw/zinc/86/71/59/606867159.db2.gz DMSSEWMRAYXVPJ-CQSZACIVSA-N -1 3 371.400 3.847 20 0 FHADHM c1cnc2c(c1)cccc2SCCCOc1cccc(-c2nnn[n-]2)c1 ZINC000823762081 606868045 /nfs/dbraw/zinc/86/80/45/606868045.db2.gz HSMRTCDGCIDAML-UHFFFAOYSA-N -1 3 363.446 3.976 20 0 FHADHM c1cnc2c(c1)cccc2SCCCOc1cccc(-c2nn[n-]n2)c1 ZINC000823762081 606868046 /nfs/dbraw/zinc/86/80/46/606868046.db2.gz HSMRTCDGCIDAML-UHFFFAOYSA-N -1 3 363.446 3.976 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@H]1CCCCC1(C)C ZINC000820120637 606873869 /nfs/dbraw/zinc/87/38/69/606873869.db2.gz HDOAOAITRNLVQU-KRWDZBQOSA-N -1 3 370.501 3.756 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@H]1CCCCC1(C)C ZINC000820120637 606873871 /nfs/dbraw/zinc/87/38/71/606873871.db2.gz HDOAOAITRNLVQU-KRWDZBQOSA-N -1 3 370.501 3.756 20 0 FHADHM FC(F)(F)c1ccccc1C1=CCN(c2ccc(-c3nnn[n-]3)nc2)CC1 ZINC000822727879 606881060 /nfs/dbraw/zinc/88/10/60/606881060.db2.gz AGMLHCUXESQACL-UHFFFAOYSA-N -1 3 372.354 3.574 20 0 FHADHM FC(F)(F)c1ccccc1C1=CCN(c2ccc(-c3nn[n-]n3)nc2)CC1 ZINC000822727879 606881062 /nfs/dbraw/zinc/88/10/62/606881062.db2.gz AGMLHCUXESQACL-UHFFFAOYSA-N -1 3 372.354 3.574 20 0 FHADHM CC(C)COC1CCN(c2ccc(C(F)(F)F)cc2-c2nnn[n-]2)CC1 ZINC000820103368 606922250 /nfs/dbraw/zinc/92/22/50/606922250.db2.gz WVVACLQTDWYXBL-UHFFFAOYSA-N -1 3 369.391 3.527 20 0 FHADHM CC(C)COC1CCN(c2ccc(C(F)(F)F)cc2-c2nn[n-]n2)CC1 ZINC000820103368 606922252 /nfs/dbraw/zinc/92/22/52/606922252.db2.gz WVVACLQTDWYXBL-UHFFFAOYSA-N -1 3 369.391 3.527 20 0 FHADHM Fc1ccc(CNc2ccccc2OCC(F)(F)F)cc1-c1nnn[n-]1 ZINC000822772419 606928084 /nfs/dbraw/zinc/92/80/84/606928084.db2.gz YDWNYMMHMQSYPG-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM Fc1ccc(CNc2ccccc2OCC(F)(F)F)cc1-c1nn[n-]n1 ZINC000822772419 606928085 /nfs/dbraw/zinc/92/80/85/606928085.db2.gz YDWNYMMHMQSYPG-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM CCc1nc2c(s1)[C@@H](N(C)Cc1ccc(-c3nnn[n-]3)cc1F)CCC2 ZINC000821509655 606933441 /nfs/dbraw/zinc/93/34/41/606933441.db2.gz KMXZDQUHQXOICI-HNNXBMFYSA-N -1 3 372.473 3.534 20 0 FHADHM CCc1nc2c(s1)[C@@H](N(C)Cc1ccc(-c3nn[n-]n3)cc1F)CCC2 ZINC000821509655 606933443 /nfs/dbraw/zinc/93/34/43/606933443.db2.gz KMXZDQUHQXOICI-HNNXBMFYSA-N -1 3 372.473 3.534 20 0 FHADHM CN(C(=O)c1cc(F)cc(Cl)c1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821573228 606963002 /nfs/dbraw/zinc/96/30/02/606963002.db2.gz GUAZZSQDRDVAGN-UHFFFAOYSA-N -1 3 366.183 3.589 20 0 FHADHM CN(C(=O)c1cc(F)cc(Cl)c1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821573228 606963003 /nfs/dbraw/zinc/96/30/03/606963003.db2.gz GUAZZSQDRDVAGN-UHFFFAOYSA-N -1 3 366.183 3.589 20 0 FHADHM CCCNc1ccc(Cl)cc1NC(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000821128610 606968997 /nfs/dbraw/zinc/96/89/97/606968997.db2.gz XOEBULPZYFGYLI-UHFFFAOYSA-N -1 3 356.817 3.594 20 0 FHADHM CCCNc1ccc(Cl)cc1NC(=O)c1cccc(-c2nn[n-]n2)c1 ZINC000821128610 606968999 /nfs/dbraw/zinc/96/89/99/606968999.db2.gz XOEBULPZYFGYLI-UHFFFAOYSA-N -1 3 356.817 3.594 20 0 FHADHM CSc1ccc(NC(=O)[C@@H](C)Sc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000821984323 607017068 /nfs/dbraw/zinc/01/70/68/607017068.db2.gz MNMIQRNMCWATGH-LLVKDONJSA-N -1 3 371.491 3.708 20 0 FHADHM CSc1ccc(NC(=O)[C@@H](C)Sc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000821984323 607017070 /nfs/dbraw/zinc/01/70/70/607017070.db2.gz MNMIQRNMCWATGH-LLVKDONJSA-N -1 3 371.491 3.708 20 0 FHADHM CC(C)(Oc1ccc(-c2nnn[n-]2)cc1)C(=O)Nc1cccc(C(F)F)c1 ZINC000820001703 607019968 /nfs/dbraw/zinc/01/99/68/607019968.db2.gz ZHBDYYKOCWJTDW-UHFFFAOYSA-N -1 3 373.363 3.600 20 0 FHADHM CC(C)(Oc1ccc(-c2nn[n-]n2)cc1)C(=O)Nc1cccc(C(F)F)c1 ZINC000820001703 607019969 /nfs/dbraw/zinc/01/99/69/607019969.db2.gz ZHBDYYKOCWJTDW-UHFFFAOYSA-N -1 3 373.363 3.600 20 0 FHADHM C[C@H](NC(=O)c1ccc(-c2ccco2)s1)c1cccc(-c2nnn[n-]2)c1 ZINC000820391976 607024006 /nfs/dbraw/zinc/02/40/06/607024006.db2.gz SGCQBCSUMVCZII-NSHDSACASA-N -1 3 365.418 3.679 20 0 FHADHM C[C@H](NC(=O)c1ccc(-c2ccco2)s1)c1cccc(-c2nn[n-]n2)c1 ZINC000820391976 607024008 /nfs/dbraw/zinc/02/40/08/607024008.db2.gz SGCQBCSUMVCZII-NSHDSACASA-N -1 3 365.418 3.679 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)c(CSCc2ccn(-c3ccccc3)n2)c1 ZINC000822758394 607035896 /nfs/dbraw/zinc/03/58/96/607035896.db2.gz NPUYGFZQSWARED-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)c(CSCc2ccn(-c3ccccc3)n2)c1 ZINC000822758394 607035898 /nfs/dbraw/zinc/03/58/98/607035898.db2.gz NPUYGFZQSWARED-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM CCC(=CC(=O)Nc1nc(-c2ccc(-c3nnn[n-]3)cc2)cs1)CC ZINC000820832185 607052038 /nfs/dbraw/zinc/05/20/38/607052038.db2.gz HXDSEOPJTHMXKI-UHFFFAOYSA-N -1 3 354.439 3.675 20 0 FHADHM CCC(=CC(=O)Nc1nc(-c2ccc(-c3nn[n-]n3)cc2)cs1)CC ZINC000820832185 607052039 /nfs/dbraw/zinc/05/20/39/607052039.db2.gz HXDSEOPJTHMXKI-UHFFFAOYSA-N -1 3 354.439 3.675 20 0 FHADHM CC1(C)C[C@@H](NCc2ccc(-c3nn[n-]n3)cc2F)c2ccc(F)cc2O1 ZINC000820590498 607057096 /nfs/dbraw/zinc/05/70/96/607057096.db2.gz VCHFFYNSPPTADM-MRXNPFEDSA-N -1 3 371.391 3.537 20 0 FHADHM Cc1sc(NC(=O)c2cc(C)c(F)cc2Cl)c(-c2nnn[n-]2)c1C ZINC000822183832 607142448 /nfs/dbraw/zinc/14/24/48/607142448.db2.gz KAIIKQJHKUAOHZ-UHFFFAOYSA-N -1 3 365.821 3.898 20 0 FHADHM Cc1sc(NC(=O)c2cc(C)c(F)cc2Cl)c(-c2nn[n-]n2)c1C ZINC000822183832 607142450 /nfs/dbraw/zinc/14/24/50/607142450.db2.gz KAIIKQJHKUAOHZ-UHFFFAOYSA-N -1 3 365.821 3.898 20 0 FHADHM CC[C@@H](OC1CCCCC1)C(=O)Nc1sc(C)c(C)c1-c1nnn[n-]1 ZINC000820939030 607150105 /nfs/dbraw/zinc/15/01/05/607150105.db2.gz PAWIUGFBESBXJJ-CYBMUJFWSA-N -1 3 363.487 3.611 20 0 FHADHM CC[C@@H](OC1CCCCC1)C(=O)Nc1sc(C)c(C)c1-c1nn[n-]n1 ZINC000820939030 607150108 /nfs/dbraw/zinc/15/01/08/607150108.db2.gz PAWIUGFBESBXJJ-CYBMUJFWSA-N -1 3 363.487 3.611 20 0 FHADHM CC[C@H](OC1CCCCC1)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000820939476 607150162 /nfs/dbraw/zinc/15/01/62/607150162.db2.gz VNBOUSJWJCTFGR-HNNXBMFYSA-N -1 3 363.849 3.587 20 0 FHADHM CC[C@H](OC1CCCCC1)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000820939476 607150163 /nfs/dbraw/zinc/15/01/63/607150163.db2.gz VNBOUSJWJCTFGR-HNNXBMFYSA-N -1 3 363.849 3.587 20 0 FHADHM FC(F)(F)c1ccc2oc(COc3ccc(-c4nn[n-]n4)cc3)nc2c1 ZINC000822728702 607150456 /nfs/dbraw/zinc/15/04/56/607150456.db2.gz KAYQSLQTUSXTGB-UHFFFAOYSA-N -1 3 361.283 3.606 20 0 FHADHM Cc1cccc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCCC3)c1F ZINC000822283661 607150881 /nfs/dbraw/zinc/15/08/81/607150881.db2.gz ACZLMBKGGFACJR-UHFFFAOYSA-N -1 3 371.441 3.897 20 0 FHADHM Cc1cccc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCCC3)c1F ZINC000822283661 607150882 /nfs/dbraw/zinc/15/08/82/607150882.db2.gz ACZLMBKGGFACJR-UHFFFAOYSA-N -1 3 371.441 3.897 20 0 FHADHM CC[C@H](OC1CCCCC1)C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000820938674 607151928 /nfs/dbraw/zinc/15/19/28/607151928.db2.gz LOMODSVTLRYBBV-HNNXBMFYSA-N -1 3 363.849 3.587 20 0 FHADHM CC[C@H](OC1CCCCC1)C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000820938674 607151929 /nfs/dbraw/zinc/15/19/29/607151929.db2.gz LOMODSVTLRYBBV-HNNXBMFYSA-N -1 3 363.849 3.587 20 0 FHADHM CCCCC[C@@H]1CCCN1C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821050913 607153511 /nfs/dbraw/zinc/15/35/11/607153511.db2.gz VNJYKXMJHNGGGT-RHSMWYFYSA-N -1 3 356.474 3.682 20 0 FHADHM CCCCC[C@@H]1CCCN1C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821050913 607153512 /nfs/dbraw/zinc/15/35/12/607153512.db2.gz VNJYKXMJHNGGGT-RHSMWYFYSA-N -1 3 356.474 3.682 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1OCc1csc(-c2ccsc2)n1 ZINC000822748308 607170633 /nfs/dbraw/zinc/17/06/33/607170633.db2.gz SRXBQNDUOIXEEA-UHFFFAOYSA-N -1 3 359.411 3.770 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1OCc1csc(-c2ccsc2)n1 ZINC000822748308 607170634 /nfs/dbraw/zinc/17/06/34/607170634.db2.gz SRXBQNDUOIXEEA-UHFFFAOYSA-N -1 3 359.411 3.770 20 0 FHADHM CC(C)n1cc([C@@H](C)Nc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)cn1 ZINC000820457304 607173474 /nfs/dbraw/zinc/17/34/74/607173474.db2.gz ZNXUFETXOMGCLS-SNVBAGLBSA-N -1 3 365.363 3.836 20 0 FHADHM CC(C)n1cc([C@@H](C)Nc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)cn1 ZINC000820457304 607173475 /nfs/dbraw/zinc/17/34/75/607173475.db2.gz ZNXUFETXOMGCLS-SNVBAGLBSA-N -1 3 365.363 3.836 20 0 FHADHM Cc1ccc(SCC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000822267514 607190136 /nfs/dbraw/zinc/19/01/36/607190136.db2.gz YCBMXAOSEBOZKP-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1ccc(SCC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000822267514 607190137 /nfs/dbraw/zinc/19/01/37/607190137.db2.gz YCBMXAOSEBOZKP-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM CC(C)C[C@@H]1CCCN(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)C1 ZINC000820068593 607195564 /nfs/dbraw/zinc/19/55/64/607195564.db2.gz SUCYSIGXNRNWQN-LBPRGKRZSA-N -1 3 362.865 3.810 20 0 FHADHM CC(C)C[C@@H]1CCCN(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)C1 ZINC000820068593 607195565 /nfs/dbraw/zinc/19/55/65/607195565.db2.gz SUCYSIGXNRNWQN-LBPRGKRZSA-N -1 3 362.865 3.810 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N(Cc1ccccc1)C1CC1 ZINC000823313459 607196965 /nfs/dbraw/zinc/19/69/65/607196965.db2.gz BQWVOYWIPLRJRG-UHFFFAOYSA-N -1 3 368.828 3.717 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N(Cc1ccccc1)C1CC1 ZINC000823313459 607196966 /nfs/dbraw/zinc/19/69/66/607196966.db2.gz BQWVOYWIPLRJRG-UHFFFAOYSA-N -1 3 368.828 3.717 20 0 FHADHM CN(CCC1CCCCC1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000821599439 607198161 /nfs/dbraw/zinc/19/81/61/607198161.db2.gz UJAGNTZNZFRYRA-UHFFFAOYSA-N -1 3 362.865 3.954 20 0 FHADHM CN(CCC1CCCCC1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000821599439 607198162 /nfs/dbraw/zinc/19/81/62/607198162.db2.gz UJAGNTZNZFRYRA-UHFFFAOYSA-N -1 3 362.865 3.954 20 0 FHADHM CSc1ccc(CNC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000821979454 607198371 /nfs/dbraw/zinc/19/83/71/607198371.db2.gz SGPMZPNXBCZYPI-UHFFFAOYSA-N -1 3 374.857 3.564 20 0 FHADHM CSc1ccc(CNC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000821979454 607198372 /nfs/dbraw/zinc/19/83/72/607198372.db2.gz SGPMZPNXBCZYPI-UHFFFAOYSA-N -1 3 374.857 3.564 20 0 FHADHM CCC[C@H]1[C@H](C)CCCN1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000821034803 607199062 /nfs/dbraw/zinc/19/90/62/607199062.db2.gz UIFOYZFAQWGTEP-ABAIWWIYSA-N -1 3 362.865 3.953 20 0 FHADHM CCC[C@H]1[C@H](C)CCCN1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000821034803 607199063 /nfs/dbraw/zinc/19/90/63/607199063.db2.gz UIFOYZFAQWGTEP-ABAIWWIYSA-N -1 3 362.865 3.953 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)s1 ZINC000822229558 607199266 /nfs/dbraw/zinc/19/92/66/607199266.db2.gz XELUHRREHJOQON-VIFPVBQESA-N -1 3 362.846 3.773 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)s1 ZINC000822229558 607199267 /nfs/dbraw/zinc/19/92/67/607199267.db2.gz XELUHRREHJOQON-VIFPVBQESA-N -1 3 362.846 3.773 20 0 FHADHM Cc1cccc2c1CC[C@@H]2NC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822341401 607201252 /nfs/dbraw/zinc/20/12/52/607201252.db2.gz XBLQAXFHYYQXCN-HNNXBMFYSA-N -1 3 368.828 3.638 20 0 FHADHM Cc1cccc2c1CC[C@@H]2NC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822341401 607201253 /nfs/dbraw/zinc/20/12/53/607201253.db2.gz XBLQAXFHYYQXCN-HNNXBMFYSA-N -1 3 368.828 3.638 20 0 FHADHM CCN(C(=O)C1CCC(C)(C)CC1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821149188 607209534 /nfs/dbraw/zinc/20/95/34/607209534.db2.gz ULRNMQYFWKARRE-AWEZNQCLSA-N -1 3 355.486 3.993 20 0 FHADHM CCN(C(=O)C1CCC(C)(C)CC1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821149188 607209535 /nfs/dbraw/zinc/20/95/35/607209535.db2.gz ULRNMQYFWKARRE-AWEZNQCLSA-N -1 3 355.486 3.993 20 0 FHADHM C[C@H](OC1CCCCCC1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820519198 607241961 /nfs/dbraw/zinc/24/19/61/607241961.db2.gz QKAQJKMHBCUOJR-NSHDSACASA-N -1 3 363.849 3.587 20 0 FHADHM C[C@H](OC1CCCCCC1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820519198 607241962 /nfs/dbraw/zinc/24/19/62/607241962.db2.gz QKAQJKMHBCUOJR-NSHDSACASA-N -1 3 363.849 3.587 20 0 FHADHM CCc1ccc(C(C)(C)C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000821477096 607242012 /nfs/dbraw/zinc/24/20/12/607242012.db2.gz YGPNBOYHWZLQOR-UHFFFAOYSA-N -1 3 369.856 3.999 20 0 FHADHM CCc1ccc(C(C)(C)C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000821477096 607242013 /nfs/dbraw/zinc/24/20/13/607242013.db2.gz YGPNBOYHWZLQOR-UHFFFAOYSA-N -1 3 369.856 3.999 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)c1csc2ccccc12 ZINC000823318344 607242727 /nfs/dbraw/zinc/24/27/27/607242727.db2.gz CQQWGENLPJFKLF-UHFFFAOYSA-N -1 3 355.810 3.987 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)c1csc2ccccc12 ZINC000823318344 607242728 /nfs/dbraw/zinc/24/27/28/607242728.db2.gz CQQWGENLPJFKLF-UHFFFAOYSA-N -1 3 355.810 3.987 20 0 FHADHM COc1cccc(C(C)=CC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)c1 ZINC000821858301 607243626 /nfs/dbraw/zinc/24/36/26/607243626.db2.gz DTPWXGWKMOGXMC-FLIBITNWSA-N -1 3 369.812 3.571 20 0 FHADHM COc1cccc(C(C)=CC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)c1 ZINC000821858301 607243627 /nfs/dbraw/zinc/24/36/27/607243627.db2.gz DTPWXGWKMOGXMC-FLIBITNWSA-N -1 3 369.812 3.571 20 0 FHADHM CC(C)c1cccc(O[C@H](C)C(=O)Oc2ccc(-c3nnn[n-]3)cc2F)c1 ZINC000820535669 607245962 /nfs/dbraw/zinc/24/59/62/607245962.db2.gz PTWSLWVANSAKGR-GFCCVEGCSA-N -1 3 370.384 3.502 20 0 FHADHM CC(C)c1cccc(O[C@H](C)C(=O)Oc2ccc(-c3nn[n-]n3)cc2F)c1 ZINC000820535669 607245963 /nfs/dbraw/zinc/24/59/63/607245963.db2.gz PTWSLWVANSAKGR-GFCCVEGCSA-N -1 3 370.384 3.502 20 0 FHADHM Cc1c(NC(=S)Nc2ccc(OC(C)C)cc2)cccc1-c1nnn[n-]1 ZINC000822115359 607252014 /nfs/dbraw/zinc/25/20/14/607252014.db2.gz DFJVKUHHDPVBAG-UHFFFAOYSA-N -1 3 368.466 3.771 20 0 FHADHM Cc1c(NC(=S)Nc2ccc(OC(C)C)cc2)cccc1-c1nn[n-]n1 ZINC000822115359 607252015 /nfs/dbraw/zinc/25/20/15/607252015.db2.gz DFJVKUHHDPVBAG-UHFFFAOYSA-N -1 3 368.466 3.771 20 0 FHADHM c1c(-c2ccccc2)oc2ncnc(NCc3ccc(-c4nnn[n-]4)cc3)c12 ZINC000826519330 607781106 /nfs/dbraw/zinc/78/11/06/607781106.db2.gz UNWHKJLKECBPQF-UHFFFAOYSA-N -1 3 369.388 3.682 20 0 FHADHM c1c(-c2ccccc2)oc2ncnc(NCc3ccc(-c4nn[n-]n4)cc3)c12 ZINC000826519330 607781107 /nfs/dbraw/zinc/78/11/07/607781107.db2.gz UNWHKJLKECBPQF-UHFFFAOYSA-N -1 3 369.388 3.682 20 0 FHADHM C[C@H](Sc1ccc(Cl)cc1)C(=O)N(C)c1ccccc1-c1nnn[n-]1 ZINC000824753146 607788849 /nfs/dbraw/zinc/78/88/49/607788849.db2.gz CPOLNORZXAIVCB-NSHDSACASA-N -1 3 373.869 3.664 20 0 FHADHM C[C@H](Sc1ccc(Cl)cc1)C(=O)N(C)c1ccccc1-c1nn[n-]n1 ZINC000824753146 607788850 /nfs/dbraw/zinc/78/88/50/607788850.db2.gz CPOLNORZXAIVCB-NSHDSACASA-N -1 3 373.869 3.664 20 0 FHADHM CN(C(=O)[C@@H]1C[C@H]1c1cccc2ccccc21)c1ccccc1-c1nnn[n-]1 ZINC000825811735 607789780 /nfs/dbraw/zinc/78/97/80/607789780.db2.gz AHEGTEFFBAFXJM-RBUKOAKNSA-N -1 3 369.428 3.786 20 0 FHADHM CN(C(=O)[C@@H]1C[C@H]1c1cccc2ccccc21)c1ccccc1-c1nn[n-]n1 ZINC000825811735 607789781 /nfs/dbraw/zinc/78/97/81/607789781.db2.gz AHEGTEFFBAFXJM-RBUKOAKNSA-N -1 3 369.428 3.786 20 0 FHADHM CCN(C(=O)CCCc1c[nH]c2ccccc12)c1ccc(-c2nnn[n-]2)cc1 ZINC000825371326 607795541 /nfs/dbraw/zinc/79/55/41/607795541.db2.gz FFHFZHWIVHAFJU-UHFFFAOYSA-N -1 3 374.448 3.724 20 0 FHADHM CCN(C(=O)CCCc1c[nH]c2ccccc12)c1ccc(-c2nn[n-]n2)cc1 ZINC000825371326 607795542 /nfs/dbraw/zinc/79/55/42/607795542.db2.gz FFHFZHWIVHAFJU-UHFFFAOYSA-N -1 3 374.448 3.724 20 0 FHADHM CCN(C(=O)c1cc2ccccc2cc1OC)c1ccc(-c2nnn[n-]2)cc1 ZINC000825379537 607797502 /nfs/dbraw/zinc/79/75/02/607797502.db2.gz HRJFNQQJJSFCAG-UHFFFAOYSA-N -1 3 373.416 3.695 20 0 FHADHM CCN(C(=O)c1cc2ccccc2cc1OC)c1ccc(-c2nn[n-]n2)cc1 ZINC000825379537 607797503 /nfs/dbraw/zinc/79/75/03/607797503.db2.gz HRJFNQQJJSFCAG-UHFFFAOYSA-N -1 3 373.416 3.695 20 0 FHADHM CCN(C(=O)c1cc2cc(C)c(C)cc2o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825381115 607797803 /nfs/dbraw/zinc/79/78/03/607797803.db2.gz ZQKGVCCJVCYQAE-UHFFFAOYSA-N -1 3 361.405 3.896 20 0 FHADHM CCN(C(=O)c1cc2cc(C)c(C)cc2o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825381115 607797804 /nfs/dbraw/zinc/79/78/04/607797804.db2.gz ZQKGVCCJVCYQAE-UHFFFAOYSA-N -1 3 361.405 3.896 20 0 FHADHM C[C@H](OC(=O)c1sccc1-c1nnn[n-]1)c1ccc(C(F)(F)F)cc1 ZINC000736164364 607800931 /nfs/dbraw/zinc/80/09/31/607800931.db2.gz NFJRCTJUKWGTQA-QMMMGPOBSA-N -1 3 368.340 3.865 20 0 FHADHM Cc1ccc(CC(=O)Oc2ccc(-c3ccc(-c4nnn[n-]4)cc3)cc2)o1 ZINC000826286655 607813965 /nfs/dbraw/zinc/81/39/65/607813965.db2.gz KYVMSENHVDCRGF-UHFFFAOYSA-N -1 3 360.373 3.583 20 0 FHADHM Cc1ccc(CC(=O)Oc2ccc(-c3ccc(-c4nn[n-]n4)cc3)cc2)o1 ZINC000826286655 607813966 /nfs/dbraw/zinc/81/39/66/607813966.db2.gz KYVMSENHVDCRGF-UHFFFAOYSA-N -1 3 360.373 3.583 20 0 FHADHM Cc1ccc(N(C)C(=O)c2c(Cl)cc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000826290097 607834346 /nfs/dbraw/zinc/83/43/46/607834346.db2.gz ZYAWRJYLAXUUKG-UHFFFAOYSA-N -1 3 362.220 3.759 20 0 FHADHM Cc1ccc(N(C)C(=O)c2c(Cl)cc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000826290097 607834347 /nfs/dbraw/zinc/83/43/47/607834347.db2.gz ZYAWRJYLAXUUKG-UHFFFAOYSA-N -1 3 362.220 3.759 20 0 FHADHM O[C@@H](CSc1ccc(-c2nnn[n-]2)cc1Cl)c1ccc(F)cc1F ZINC000826504830 607843210 /nfs/dbraw/zinc/84/32/10/607843210.db2.gz FTRHWXJBLJQIAK-ZDUSSCGKSA-N -1 3 368.796 3.624 20 0 FHADHM O[C@@H](CSc1ccc(-c2nn[n-]n2)cc1Cl)c1ccc(F)cc1F ZINC000826504830 607843211 /nfs/dbraw/zinc/84/32/11/607843211.db2.gz FTRHWXJBLJQIAK-ZDUSSCGKSA-N -1 3 368.796 3.624 20 0 FHADHM O[C@H](CSc1ccc(-c2nnn[n-]2)cc1Cl)c1ccc(F)c(F)c1 ZINC000826505308 607843291 /nfs/dbraw/zinc/84/32/91/607843291.db2.gz RUTVLBXYWGUAKU-CYBMUJFWSA-N -1 3 368.796 3.624 20 0 FHADHM O[C@H](CSc1ccc(-c2nn[n-]n2)cc1Cl)c1ccc(F)c(F)c1 ZINC000826505308 607843292 /nfs/dbraw/zinc/84/32/92/607843292.db2.gz RUTVLBXYWGUAKU-CYBMUJFWSA-N -1 3 368.796 3.624 20 0 FHADHM Cc1cccc(NC(=O)[C@H](C)Sc2ccc(-c3nnn[n-]3)cc2Cl)c1 ZINC000826299058 607844802 /nfs/dbraw/zinc/84/48/02/607844802.db2.gz PHKRNLREONCOIO-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM Cc1cccc(NC(=O)[C@H](C)Sc2ccc(-c3nn[n-]n3)cc2Cl)c1 ZINC000826299058 607844803 /nfs/dbraw/zinc/84/48/03/607844803.db2.gz PHKRNLREONCOIO-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM O=C(CSc1ccc(-c2nnn[n-]2)cc1Cl)c1ccc2c(c1)COC2 ZINC000826420838 607845213 /nfs/dbraw/zinc/84/52/13/607845213.db2.gz FFRZTRAFAFHSFI-UHFFFAOYSA-N -1 3 372.837 3.525 20 0 FHADHM O=C(CSc1ccc(-c2nn[n-]n2)cc1Cl)c1ccc2c(c1)COC2 ZINC000826420838 607845214 /nfs/dbraw/zinc/84/52/14/607845214.db2.gz FFRZTRAFAFHSFI-UHFFFAOYSA-N -1 3 372.837 3.525 20 0 FHADHM O[C@H](COc1ccc(Cl)c2ccccc12)c1ccc(-c2nnn[n-]2)cc1 ZINC000826504845 607869848 /nfs/dbraw/zinc/86/98/48/607869848.db2.gz GGNNKIIFEAUKDP-QGZVFWFLSA-N -1 3 366.808 3.786 20 0 FHADHM O[C@H](COc1ccc(Cl)c2ccccc12)c1ccc(-c2nn[n-]n2)cc1 ZINC000826504845 607869849 /nfs/dbraw/zinc/86/98/49/607869849.db2.gz GGNNKIIFEAUKDP-QGZVFWFLSA-N -1 3 366.808 3.786 20 0 FHADHM O[C@@H](COc1ccc2oc3ccccc3c2c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000826505560 607870496 /nfs/dbraw/zinc/87/04/96/607870496.db2.gz YWQMMFLYGLKYOO-SFHVURJKSA-N -1 3 372.384 3.879 20 0 FHADHM O[C@@H](COc1ccc2oc3ccccc3c2c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000826505560 607870497 /nfs/dbraw/zinc/87/04/97/607870497.db2.gz YWQMMFLYGLKYOO-SFHVURJKSA-N -1 3 372.384 3.879 20 0 FHADHM C[C@H](NC(=O)[C@@H]1CC[C@H]2CCCC[C@H]2C1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824472994 607881090 /nfs/dbraw/zinc/88/10/90/607881090.db2.gz YAQPSRUFAPJCJY-UNQWWWNPSA-N -1 3 353.470 3.650 20 0 FHADHM C[C@H](NC(=O)[C@@H]1CC[C@H]2CCCC[C@H]2C1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824472994 607881091 /nfs/dbraw/zinc/88/10/91/607881091.db2.gz YAQPSRUFAPJCJY-UNQWWWNPSA-N -1 3 353.470 3.650 20 0 FHADHM C[C@@H](NC(=O)[C@@H](C)Cc1cccc(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824457518 607881156 /nfs/dbraw/zinc/88/11/56/607881156.db2.gz OOXDTHCLLSQCGJ-QWHCGFSZSA-N -1 3 369.856 3.576 20 0 FHADHM C[C@@H](NC(=O)[C@@H](C)Cc1cccc(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824457518 607881157 /nfs/dbraw/zinc/88/11/57/607881157.db2.gz OOXDTHCLLSQCGJ-QWHCGFSZSA-N -1 3 369.856 3.576 20 0 FHADHM Cc1cn(Cc2coc(-c3ccc(C(F)(F)F)cc3)n2)cc1-c1nnn[n-]1 ZINC000826317309 607890412 /nfs/dbraw/zinc/89/04/12/607890412.db2.gz XENKKABBKBRHAQ-UHFFFAOYSA-N -1 3 374.326 3.699 20 0 FHADHM Cc1cn(Cc2coc(-c3ccc(C(F)(F)F)cc3)n2)cc1-c1nn[n-]n1 ZINC000826317309 607890413 /nfs/dbraw/zinc/89/04/13/607890413.db2.gz XENKKABBKBRHAQ-UHFFFAOYSA-N -1 3 374.326 3.699 20 0 FHADHM CC(C)[C@H](C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccc(F)cc1 ZINC000824183979 607893535 /nfs/dbraw/zinc/89/35/35/607893535.db2.gz ABVAGPSZQQWKRG-INIZCTEOSA-N -1 3 357.364 3.523 20 0 FHADHM CC(C)[C@H](C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccc(F)cc1 ZINC000824183979 607893536 /nfs/dbraw/zinc/89/35/36/607893536.db2.gz ABVAGPSZQQWKRG-INIZCTEOSA-N -1 3 357.364 3.523 20 0 FHADHM CS[C@H](C)CC(=O)Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000826224942 607934281 /nfs/dbraw/zinc/93/42/81/607934281.db2.gz POKICAMXXMMSKZ-GFCCVEGCSA-N -1 3 369.450 3.739 20 0 FHADHM CS[C@H](C)CC(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000826224942 607934282 /nfs/dbraw/zinc/93/42/82/607934282.db2.gz POKICAMXXMMSKZ-GFCCVEGCSA-N -1 3 369.450 3.739 20 0 FHADHM CC(C)(CCC(=O)N1CCc2ccc(-c3nnn[n-]3)cc21)c1ccccc1 ZINC000824152362 607947760 /nfs/dbraw/zinc/94/77/60/607947760.db2.gz BZSVMVWIAFZTCQ-UHFFFAOYSA-N -1 3 361.449 3.514 20 0 FHADHM CC(C)(CCC(=O)N1CCc2ccc(-c3nn[n-]n3)cc21)c1ccccc1 ZINC000824152362 607947761 /nfs/dbraw/zinc/94/77/61/607947761.db2.gz BZSVMVWIAFZTCQ-UHFFFAOYSA-N -1 3 361.449 3.514 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@@H]2C(=O)N2CCc3ccc(-c4nnn[n-]4)cc32)cc1 ZINC000824347839 607947972 /nfs/dbraw/zinc/94/79/72/607947972.db2.gz PGERBONHADNMTK-MOPGFXCFSA-N -1 3 373.460 3.683 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@@H]2C(=O)N2CCc3ccc(-c4nn[n-]n4)cc32)cc1 ZINC000824347839 607947973 /nfs/dbraw/zinc/94/79/73/607947973.db2.gz PGERBONHADNMTK-MOPGFXCFSA-N -1 3 373.460 3.683 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1 ZINC000823943734 607970329 /nfs/dbraw/zinc/97/03/29/607970329.db2.gz RWYNAXOTJXEPDZ-RAXLEYEMSA-N -1 3 367.840 3.582 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1 ZINC000823943734 607970330 /nfs/dbraw/zinc/97/03/30/607970330.db2.gz RWYNAXOTJXEPDZ-RAXLEYEMSA-N -1 3 367.840 3.582 20 0 FHADHM CCn1c2ccc(-c3nnn[n-]3)cc2nc1-c1ccc(SC)c(OC)c1 ZINC000825782640 607975367 /nfs/dbraw/zinc/97/53/67/607975367.db2.gz JZGFONXQSPRWCU-UHFFFAOYSA-N -1 3 366.450 3.634 20 0 FHADHM CCn1c2ccc(-c3nn[n-]n3)cc2nc1-c1ccc(SC)c(OC)c1 ZINC000825782640 607975368 /nfs/dbraw/zinc/97/53/68/607975368.db2.gz JZGFONXQSPRWCU-UHFFFAOYSA-N -1 3 366.450 3.634 20 0 FHADHM Cc1cc([C@@H](NC(=O)Nc2cccc(-c3nnn[n-]3)c2)C2CC2)ccc1F ZINC000826262604 607977575 /nfs/dbraw/zinc/97/75/75/607977575.db2.gz SYJJKTKRLQWJFW-KRWDZBQOSA-N -1 3 366.400 3.587 20 0 FHADHM Cc1cc([C@@H](NC(=O)Nc2cccc(-c3nn[n-]n3)c2)C2CC2)ccc1F ZINC000826262604 607977576 /nfs/dbraw/zinc/97/75/76/607977576.db2.gz SYJJKTKRLQWJFW-KRWDZBQOSA-N -1 3 366.400 3.587 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000823942810 607985997 /nfs/dbraw/zinc/98/59/97/607985997.db2.gz JOIBKDNQUWCGMZ-SRXBQZRASA-N -1 3 367.840 3.801 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000823942810 607985998 /nfs/dbraw/zinc/98/59/98/607985998.db2.gz JOIBKDNQUWCGMZ-SRXBQZRASA-N -1 3 367.840 3.801 20 0 FHADHM O=C(Nc1sc2c(c1-c1nnn[n-]1)CCCC2)C1CCC(F)(F)CC1 ZINC000826460902 608000287 /nfs/dbraw/zinc/00/02/87/608000287.db2.gz XJDMTARWSASLHR-UHFFFAOYSA-N -1 3 367.425 3.571 20 0 FHADHM O=C(Nc1sc2c(c1-c1nn[n-]n1)CCCC2)C1CCC(F)(F)CC1 ZINC000826460902 608000288 /nfs/dbraw/zinc/00/02/88/608000288.db2.gz XJDMTARWSASLHR-UHFFFAOYSA-N -1 3 367.425 3.571 20 0 FHADHM CC(C)(C)C1=CCN(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)CC1 ZINC000824072186 608007389 /nfs/dbraw/zinc/00/73/89/608007389.db2.gz SNLAUNFGOAUHNK-UHFFFAOYSA-N -1 3 360.849 3.730 20 0 FHADHM CC(C)(C)C1=CCN(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)CC1 ZINC000824072186 608007390 /nfs/dbraw/zinc/00/73/90/608007390.db2.gz SNLAUNFGOAUHNK-UHFFFAOYSA-N -1 3 360.849 3.730 20 0 FHADHM Cc1csc([C@@H](C)Nc2ccc(-c3nn[n-]n3)cc2Br)n1 ZINC000826320098 608048903 /nfs/dbraw/zinc/04/89/03/608048903.db2.gz GJOVGSKWRUQERM-MRVPVSSYSA-N -1 3 365.260 3.567 20 0 FHADHM Cc1ccc(Br)c(NCc2cc(-c3nnn[n-]3)ccc2F)c1 ZINC000826281545 608048979 /nfs/dbraw/zinc/04/89/79/608048979.db2.gz YHDULOWWRBQBPQ-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Cc1ccc(Br)c(NCc2cc(-c3nn[n-]n3)ccc2F)c1 ZINC000826281545 608048980 /nfs/dbraw/zinc/04/89/80/608048980.db2.gz YHDULOWWRBQBPQ-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Brc1cc(-c2nn[n-]n2)ccc1N1CCC[C@H]1c1ccco1 ZINC000823826538 608049953 /nfs/dbraw/zinc/04/99/53/608049953.db2.gz KYZCJLBFNZLHII-ZDUSSCGKSA-N -1 3 360.215 3.564 20 0 FHADHM CC[C@H](C)n1ncc(NC(=O)Nc2cccc(-c3nnn[n-]3)c2)c1C1CC1 ZINC000825081185 608100298 /nfs/dbraw/zinc/10/02/98/608100298.db2.gz HGJKQAQWJURTKT-NSHDSACASA-N -1 3 366.429 3.556 20 0 FHADHM CC[C@H](C)n1ncc(NC(=O)Nc2cccc(-c3nn[n-]n3)c2)c1C1CC1 ZINC000825081185 608100299 /nfs/dbraw/zinc/10/02/99/608100299.db2.gz HGJKQAQWJURTKT-NSHDSACASA-N -1 3 366.429 3.556 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N[C@@H]1c2ccccc2CC[C@H]1C ZINC000826278120 608105657 /nfs/dbraw/zinc/10/56/57/608105657.db2.gz RMDJRQGRCCHYGR-ACJLOTCBSA-N -1 3 362.437 3.620 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N[C@@H]1c2ccccc2CC[C@H]1C ZINC000826278120 608105658 /nfs/dbraw/zinc/10/56/58/608105658.db2.gz RMDJRQGRCCHYGR-ACJLOTCBSA-N -1 3 362.437 3.620 20 0 FHADHM C[C@H](C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1)c1c(F)cccc1F ZINC000824044887 608113573 /nfs/dbraw/zinc/11/35/73/608113573.db2.gz AHVKGMVFMNCQKN-QMMMGPOBSA-N -1 3 363.755 3.541 20 0 FHADHM C[C@H](C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1)c1c(F)cccc1F ZINC000824044887 608113574 /nfs/dbraw/zinc/11/35/74/608113574.db2.gz AHVKGMVFMNCQKN-QMMMGPOBSA-N -1 3 363.755 3.541 20 0 FHADHM Cc1cc(C)cc([C@@H]2CCN(C(=O)C=Cc3ccccc3-c3nnn[n-]3)C2)c1 ZINC000826264426 608131724 /nfs/dbraw/zinc/13/17/24/608131724.db2.gz NZEXDIPUGDZQSM-JTHGQSKGSA-N -1 3 373.460 3.513 20 0 FHADHM Cc1cc(C)cc([C@@H]2CCN(C(=O)C=Cc3ccccc3-c3nn[n-]n3)C2)c1 ZINC000826264426 608131725 /nfs/dbraw/zinc/13/17/25/608131725.db2.gz NZEXDIPUGDZQSM-JTHGQSKGSA-N -1 3 373.460 3.513 20 0 FHADHM CCN(C(=O)c1cc(C)c(F)c(C)c1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825379672 608151467 /nfs/dbraw/zinc/15/14/67/608151467.db2.gz JROLLTQWRXBDOU-CQSZACIVSA-N -1 3 367.428 3.846 20 0 FHADHM CCN(C(=O)c1cc(C)c(F)c(C)c1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825379672 608151469 /nfs/dbraw/zinc/15/14/69/608151469.db2.gz JROLLTQWRXBDOU-CQSZACIVSA-N -1 3 367.428 3.846 20 0 FHADHM Cc1cc([C@@H]2CN(c3ccc(Cl)cc3-c3nnn[n-]3)CCO2)ccc1F ZINC000826266209 608151481 /nfs/dbraw/zinc/15/14/81/608151481.db2.gz GUZUTCRPSBIQPF-KRWDZBQOSA-N -1 3 373.819 3.546 20 0 FHADHM Cc1cc([C@@H]2CN(c3ccc(Cl)cc3-c3nn[n-]n3)CCO2)ccc1F ZINC000826266209 608151482 /nfs/dbraw/zinc/15/14/82/608151482.db2.gz GUZUTCRPSBIQPF-KRWDZBQOSA-N -1 3 373.819 3.546 20 0 FHADHM O=C(Oc1ccc(-c2nnn[n-]2)cc1F)C1(Cc2ccc(Cl)cc2)CC1 ZINC000826468589 608162209 /nfs/dbraw/zinc/16/22/09/608162209.db2.gz YXAXFWPTVNJGRX-UHFFFAOYSA-N -1 3 372.787 3.588 20 0 FHADHM O=C(Oc1ccc(-c2nn[n-]n2)cc1F)C1(Cc2ccc(Cl)cc2)CC1 ZINC000826468589 608162211 /nfs/dbraw/zinc/16/22/11/608162211.db2.gz YXAXFWPTVNJGRX-UHFFFAOYSA-N -1 3 372.787 3.588 20 0 FHADHM C[C@@H](OC(=O)C(C)(C)c1ccc(F)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000824706379 608181100 /nfs/dbraw/zinc/18/11/00/608181100.db2.gz IDTPHQRQLHTINJ-GFCCVEGCSA-N -1 3 354.385 3.588 20 0 FHADHM C[C@@H](OC(=O)C(C)(C)c1ccc(F)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000824706379 608181102 /nfs/dbraw/zinc/18/11/02/608181102.db2.gz IDTPHQRQLHTINJ-GFCCVEGCSA-N -1 3 354.385 3.588 20 0 FHADHM C[C@H](OC(=O)C(C)(C)c1ccc(F)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000824706381 608181428 /nfs/dbraw/zinc/18/14/28/608181428.db2.gz IDTPHQRQLHTINJ-LBPRGKRZSA-N -1 3 354.385 3.588 20 0 FHADHM C[C@H](OC(=O)C(C)(C)c1ccc(F)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000824706381 608181431 /nfs/dbraw/zinc/18/14/31/608181431.db2.gz IDTPHQRQLHTINJ-LBPRGKRZSA-N -1 3 354.385 3.588 20 0 FHADHM CS[C@@H](C(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000826224675 608186326 /nfs/dbraw/zinc/18/63/26/608186326.db2.gz JYBGDJANOSJVNZ-MLGOLLRUSA-N -1 3 354.435 3.575 20 0 FHADHM CS[C@@H](C(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000826224675 608186327 /nfs/dbraw/zinc/18/63/27/608186327.db2.gz JYBGDJANOSJVNZ-MLGOLLRUSA-N -1 3 354.435 3.575 20 0 FHADHM Clc1cccc(SCc2noc(-c3ccccc3)n2)c1-c1nnn[n-]1 ZINC000826353512 608206455 /nfs/dbraw/zinc/20/64/55/608206455.db2.gz SFEBWDNFUWNLPH-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1cccc(SCc2noc(-c3ccccc3)n2)c1-c1nn[n-]n1 ZINC000826353512 608206456 /nfs/dbraw/zinc/20/64/56/608206456.db2.gz SFEBWDNFUWNLPH-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM CCCCC[C@@H](C)NC(=O)CSc1cccc(Cl)c1-c1nnn[n-]1 ZINC000825267261 608207210 /nfs/dbraw/zinc/20/72/10/608207210.db2.gz KEWLVNXTXWCHAW-LLVKDONJSA-N -1 3 367.906 3.697 20 0 FHADHM CCCCC[C@@H](C)NC(=O)CSc1cccc(Cl)c1-c1nn[n-]n1 ZINC000825267261 608207211 /nfs/dbraw/zinc/20/72/11/608207211.db2.gz KEWLVNXTXWCHAW-LLVKDONJSA-N -1 3 367.906 3.697 20 0 FHADHM C[C@@H](CC(=O)N(C)c1cccc(-c2nnn[n-]2)c1)Cc1ccc(Cl)cc1 ZINC000824385420 608219518 /nfs/dbraw/zinc/21/95/18/608219518.db2.gz SPNBXVDLGAYZIO-CYBMUJFWSA-N -1 3 369.856 3.752 20 0 FHADHM C[C@@H](CC(=O)N(C)c1cccc(-c2nn[n-]n2)c1)Cc1ccc(Cl)cc1 ZINC000824385420 608219519 /nfs/dbraw/zinc/21/95/19/608219519.db2.gz SPNBXVDLGAYZIO-CYBMUJFWSA-N -1 3 369.856 3.752 20 0 FHADHM COc1ccc([C@H](C)Nc2ccc3cc(-c4nnn[n-]4)ccc3n2)cc1F ZINC000826189095 608221641 /nfs/dbraw/zinc/22/16/41/608221641.db2.gz NEAMFKJWWBJKQG-NSHDSACASA-N -1 3 364.384 3.736 20 0 FHADHM COc1ccc([C@H](C)Nc2ccc3cc(-c4nn[n-]n4)ccc3n2)cc1F ZINC000826189095 608221643 /nfs/dbraw/zinc/22/16/43/608221643.db2.gz NEAMFKJWWBJKQG-NSHDSACASA-N -1 3 364.384 3.736 20 0 FHADHM c1ccc([C@H](Nc2ccc3cc(-c4nnn[n-]4)ccc3n2)[C@@H]2CCCO2)cc1 ZINC000826521055 608225863 /nfs/dbraw/zinc/22/58/63/608225863.db2.gz YGTCFVDESOJLHJ-ICSRJNTNSA-N -1 3 372.432 3.747 20 0 FHADHM c1ccc([C@H](Nc2ccc3cc(-c4nn[n-]n4)ccc3n2)[C@@H]2CCCO2)cc1 ZINC000826521055 608225865 /nfs/dbraw/zinc/22/58/65/608225865.db2.gz YGTCFVDESOJLHJ-ICSRJNTNSA-N -1 3 372.432 3.747 20 0 FHADHM C[C@H](CC(=O)Nc1ccccc1-c1nnn[n-]1)Cc1ccc(Cl)cc1 ZINC000824385221 608258090 /nfs/dbraw/zinc/25/80/90/608258090.db2.gz OHYBYGAAYXEGQG-LBPRGKRZSA-N -1 3 355.829 3.728 20 0 FHADHM C[C@H](CC(=O)Nc1ccccc1-c1nn[n-]n1)Cc1ccc(Cl)cc1 ZINC000824385221 608258091 /nfs/dbraw/zinc/25/80/91/608258091.db2.gz OHYBYGAAYXEGQG-LBPRGKRZSA-N -1 3 355.829 3.728 20 0 FHADHM C[C@@H]1CCC[C@@H](OCCCCCC(=O)Nc2ccccc2-c2nnn[n-]2)C1 ZINC000824930060 608261688 /nfs/dbraw/zinc/26/16/88/608261688.db2.gz ZXLSGAQKMQIAPO-HZPDHXFCSA-N -1 3 371.485 3.961 20 0 FHADHM C[C@@H]1CCC[C@@H](OCCCCCC(=O)Nc2ccccc2-c2nn[n-]n2)C1 ZINC000824930060 608261689 /nfs/dbraw/zinc/26/16/89/608261689.db2.gz ZXLSGAQKMQIAPO-HZPDHXFCSA-N -1 3 371.485 3.961 20 0 FHADHM Cc1cc(C)nc(NCc2ccc(-c3ccccc3-c3nnn[n-]3)cc2)n1 ZINC000826265649 608293766 /nfs/dbraw/zinc/29/37/66/608293766.db2.gz IDWICJBTLQWCIY-UHFFFAOYSA-N -1 3 357.421 3.553 20 0 FHADHM Cc1cc(C)nc(NCc2ccc(-c3ccccc3-c3nn[n-]n3)cc2)n1 ZINC000826265649 608293768 /nfs/dbraw/zinc/29/37/68/608293768.db2.gz IDWICJBTLQWCIY-UHFFFAOYSA-N -1 3 357.421 3.553 20 0 FHADHM c1ccc(-c2ccc(CNc3ccnc(C4CC4)n3)cc2)c(-c2nnn[n-]2)c1 ZINC000826519853 608296936 /nfs/dbraw/zinc/29/69/36/608296936.db2.gz QUPBCFBZTPHTQL-UHFFFAOYSA-N -1 3 369.432 3.813 20 0 FHADHM c1ccc(-c2ccc(CNc3ccnc(C4CC4)n3)cc2)c(-c2nn[n-]n2)c1 ZINC000826519853 608296938 /nfs/dbraw/zinc/29/69/38/608296938.db2.gz QUPBCFBZTPHTQL-UHFFFAOYSA-N -1 3 369.432 3.813 20 0 FHADHM CN(C(=O)c1ccc(Cl)c(F)c1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000825830789 608309090 /nfs/dbraw/zinc/30/90/90/608309090.db2.gz XSSUFODGUQXWTH-UHFFFAOYSA-N -1 3 366.183 3.589 20 0 FHADHM CN(C(=O)c1ccc(Cl)c(F)c1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000825830789 608309092 /nfs/dbraw/zinc/30/90/92/608309092.db2.gz XSSUFODGUQXWTH-UHFFFAOYSA-N -1 3 366.183 3.589 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CNc1cccc(Oc2ccccn2)c1 ZINC000826170914 608321374 /nfs/dbraw/zinc/32/13/74/608321374.db2.gz VEXSUWWRWAOPPB-UHFFFAOYSA-N -1 3 374.404 3.675 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CNc1cccc(Oc2ccccn2)c1 ZINC000826170914 608321376 /nfs/dbraw/zinc/32/13/76/608321376.db2.gz VEXSUWWRWAOPPB-UHFFFAOYSA-N -1 3 374.404 3.675 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CNc1cccc(Br)c1C ZINC000826170932 608321572 /nfs/dbraw/zinc/32/15/72/608321572.db2.gz VXJGJXICUNAZBW-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CNc1cccc(Br)c1C ZINC000826170932 608321573 /nfs/dbraw/zinc/32/15/73/608321573.db2.gz VXJGJXICUNAZBW-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM CCC(CC)n1ccc(CSCc2ccc(-c3nnn[n-]3)cc2OC)n1 ZINC000825113581 608321867 /nfs/dbraw/zinc/32/18/67/608321867.db2.gz CARZGKZIPHCJEW-UHFFFAOYSA-N -1 3 372.498 3.866 20 0 FHADHM CCC(CC)n1ccc(CSCc2ccc(-c3nn[n-]n3)cc2OC)n1 ZINC000825113581 608321868 /nfs/dbraw/zinc/32/18/68/608321868.db2.gz CARZGKZIPHCJEW-UHFFFAOYSA-N -1 3 372.498 3.866 20 0 FHADHM Cc1scc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CC[C@H](C)C3)c1C ZINC000826350206 608339761 /nfs/dbraw/zinc/33/97/61/608339761.db2.gz MESHXUZMBNKEQH-QMMMGPOBSA-N -1 3 373.507 3.984 20 0 FHADHM Cc1scc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CC[C@H](C)C3)c1C ZINC000826350206 608339763 /nfs/dbraw/zinc/33/97/63/608339763.db2.gz MESHXUZMBNKEQH-QMMMGPOBSA-N -1 3 373.507 3.984 20 0 FHADHM CCN(C(=O)c1cccc(C(C)C)n1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825385483 608347146 /nfs/dbraw/zinc/34/71/46/608347146.db2.gz HKFLYTWXCZKXIG-UHFFFAOYSA-N -1 3 370.844 3.705 20 0 FHADHM CCN(C(=O)c1cccc(C(C)C)n1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825385483 608347148 /nfs/dbraw/zinc/34/71/48/608347148.db2.gz HKFLYTWXCZKXIG-UHFFFAOYSA-N -1 3 370.844 3.705 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1NCc1nc(-c2ccccc2)c[nH]1 ZINC000826352929 608376282 /nfs/dbraw/zinc/37/62/82/608376282.db2.gz UAWURIMMLORCEM-UHFFFAOYSA-N -1 3 351.801 3.522 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1NCc1nc(-c2ccccc2)c[nH]1 ZINC000826352929 608376284 /nfs/dbraw/zinc/37/62/84/608376284.db2.gz UAWURIMMLORCEM-UHFFFAOYSA-N -1 3 351.801 3.522 20 0 FHADHM c1cc2nccc(N3CC=C(c4ccc(-c5nn[n-]n5)cc4)CC3)c2s1 ZINC000823867599 608443211 /nfs/dbraw/zinc/44/32/11/608443211.db2.gz CWLQWQINKPNPPL-UHFFFAOYSA-N -1 3 360.446 3.770 20 0 FHADHM C[C@@H](NCc1ncc(-c2ccc(F)cc2)o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824632531 608461016 /nfs/dbraw/zinc/46/10/16/608461016.db2.gz AYSVVKYLAGDFFY-GFCCVEGCSA-N -1 3 364.384 3.512 20 0 FHADHM C[C@@H](NCc1ncc(-c2ccc(F)cc2)o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824632531 608461017 /nfs/dbraw/zinc/46/10/17/608461017.db2.gz AYSVVKYLAGDFFY-GFCCVEGCSA-N -1 3 364.384 3.512 20 0 FHADHM C[C@@H](NCc1csc(C2CCCC2)n1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824626689 608462857 /nfs/dbraw/zinc/46/28/57/608462857.db2.gz ROTFOURMZVGYDE-GFCCVEGCSA-N -1 3 354.483 3.832 20 0 FHADHM C[C@H](NCc1coc(-c2cccc(F)c2)n1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824627261 608465632 /nfs/dbraw/zinc/46/56/32/608465632.db2.gz VMLFITLREGFDIW-LBPRGKRZSA-N -1 3 364.384 3.512 20 0 FHADHM CC1(C)CCC(C(=O)N2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)CC1 ZINC000824795849 608479847 /nfs/dbraw/zinc/47/98/47/608479847.db2.gz GWNGEKVDRZUUFX-UHFFFAOYSA-N -1 3 365.481 3.699 20 0 FHADHM CC1(C)CCC(C(=O)N2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)CC1 ZINC000824795849 608479848 /nfs/dbraw/zinc/47/98/48/608479848.db2.gz GWNGEKVDRZUUFX-UHFFFAOYSA-N -1 3 365.481 3.699 20 0 FHADHM C[C@@H](CC(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1)CC(C)(C)C ZINC000824384338 608481291 /nfs/dbraw/zinc/48/12/91/608481291.db2.gz ANQVIWOUWRRSDI-HNNXBMFYSA-N -1 3 367.497 3.945 20 0 FHADHM C[C@@H](CC(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1)CC(C)(C)C ZINC000824384338 608481294 /nfs/dbraw/zinc/48/12/94/608481294.db2.gz ANQVIWOUWRRSDI-HNNXBMFYSA-N -1 3 367.497 3.945 20 0 FHADHM CC[C@H](OC(=O)c1c(F)cc(-c2nnn[n-]2)cc1F)c1ccc(C)cc1 ZINC000825153568 608498139 /nfs/dbraw/zinc/49/81/39/608498139.db2.gz ILRKWNFSDMXOSB-HNNXBMFYSA-N -1 3 358.348 3.761 20 0 FHADHM CC[C@H](OC(=O)c1c(F)cc(-c2nn[n-]n2)cc1F)c1ccc(C)cc1 ZINC000825153568 608498140 /nfs/dbraw/zinc/49/81/40/608498140.db2.gz ILRKWNFSDMXOSB-HNNXBMFYSA-N -1 3 358.348 3.761 20 0 FHADHM C[C@@H]1C[C@@H]1c1ccc(CN(Cc2cc(-c3nnn[n-]3)cs2)C2CC2)o1 ZINC000824897812 608517983 /nfs/dbraw/zinc/51/79/83/608517983.db2.gz BHMRZSHWBRMUPN-BZNIZROVSA-N -1 3 355.467 3.809 20 0 FHADHM C[C@@H]1C[C@@H]1c1ccc(CN(Cc2cc(-c3nn[n-]n3)cs2)C2CC2)o1 ZINC000824897812 608517985 /nfs/dbraw/zinc/51/79/85/608517985.db2.gz BHMRZSHWBRMUPN-BZNIZROVSA-N -1 3 355.467 3.809 20 0 FHADHM CC(C)(C)c1ncc(CN(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)s1 ZINC000824141619 608518582 /nfs/dbraw/zinc/51/85/82/608518582.db2.gz KYHHAUFFGOWTJO-UHFFFAOYSA-N -1 3 368.510 3.785 20 0 FHADHM CN(Cc1ccc(-c2nn[n-]n2)cc1)Cc1ccc(-c2ccncc2)cc1F ZINC000825961731 608524633 /nfs/dbraw/zinc/52/46/33/608524633.db2.gz MDWLIPMFHDKKCO-UHFFFAOYSA-N -1 3 374.423 3.700 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)c1ccc(C(F)(F)F)cc1Cl ZINC000540472031 608538698 /nfs/dbraw/zinc/53/86/98/608538698.db2.gz RCHGRHHGPNYAEP-UHFFFAOYSA-N -1 3 367.718 3.791 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)c1ccc(C(F)(F)F)cc1Cl ZINC000540472031 608538700 /nfs/dbraw/zinc/53/87/00/608538700.db2.gz RCHGRHHGPNYAEP-UHFFFAOYSA-N -1 3 367.718 3.791 20 0 FHADHM O=C(Nc1cc(Cl)ccc1F)c1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000826451535 608574097 /nfs/dbraw/zinc/57/40/97/608574097.db2.gz KVMHPQXRTXVXFD-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1cc(Cl)ccc1F)c1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000826451535 608574099 /nfs/dbraw/zinc/57/40/99/608574099.db2.gz KVMHPQXRTXVXFD-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM CN(Cc1ccc(-c2nnn[n-]2)s1)Cc1cc(Cl)cc(Cl)c1 ZINC000825953370 608598430 /nfs/dbraw/zinc/59/84/30/608598430.db2.gz HILAFHXBRVPACF-UHFFFAOYSA-N -1 3 354.266 3.867 20 0 FHADHM CCCOc1ccc(NC(=O)N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000825339123 608600675 /nfs/dbraw/zinc/60/06/75/608600675.db2.gz NXLINZIAMMWMDI-ZDUSSCGKSA-N -1 3 366.425 3.538 20 0 FHADHM CCCOc1ccc(NC(=O)N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000825339123 608600676 /nfs/dbraw/zinc/60/06/76/608600676.db2.gz NXLINZIAMMWMDI-ZDUSSCGKSA-N -1 3 366.425 3.538 20 0 FHADHM O=C(c1cc(-c2nnn[n-]2)cs1)N1CC=C(c2ccccc2Cl)CC1 ZINC000826470086 608601166 /nfs/dbraw/zinc/60/11/66/608601166.db2.gz BHRMSHCUNZAMOQ-UHFFFAOYSA-N -1 3 371.853 3.511 20 0 FHADHM O=C(c1cc(-c2nn[n-]n2)cs1)N1CC=C(c2ccccc2Cl)CC1 ZINC000826470086 608601167 /nfs/dbraw/zinc/60/11/67/608601167.db2.gz BHRMSHCUNZAMOQ-UHFFFAOYSA-N -1 3 371.853 3.511 20 0 FHADHM Fc1c(CN(Cc2ccco2)Cc2cccs2)cccc1-c1nnn[n-]1 ZINC000826370573 608642657 /nfs/dbraw/zinc/64/26/57/608642657.db2.gz ZEFRUVWFJQBSFB-UHFFFAOYSA-N -1 3 369.425 3.863 20 0 FHADHM Fc1c(CN(Cc2ccco2)Cc2cccs2)cccc1-c1nn[n-]n1 ZINC000826370573 608642660 /nfs/dbraw/zinc/64/26/60/608642660.db2.gz ZEFRUVWFJQBSFB-UHFFFAOYSA-N -1 3 369.425 3.863 20 0 FHADHM Cc1ccc([C@H]2CSCCN2Cc2ccc(-c3nnn[n-]3)s2)cc1 ZINC000826285910 608710436 /nfs/dbraw/zinc/71/04/36/608710436.db2.gz NLSLXKGWORWYFR-OAHLLOKOSA-N -1 3 357.508 3.527 20 0 FHADHM Cc1ccc(CCN(Cc2ccco2)Cc2ccc(-c3nnn[n-]3)o2)cc1 ZINC000826287427 608728901 /nfs/dbraw/zinc/72/89/01/608728901.db2.gz ONLGFNJFAGVOQE-UHFFFAOYSA-N -1 3 363.421 3.606 20 0 FHADHM Cc1ccc(C)c([C@@H]2CN(Cc3cc(-c4nnn[n-]4)cs3)[C@@H](C)CO2)c1 ZINC000826284977 608729475 /nfs/dbraw/zinc/72/94/75/608729475.db2.gz MKTCKUXHVAYNKS-KSSFIOAISA-N -1 3 369.494 3.507 20 0 FHADHM Cc1ccc(C)c([C@@H]2CN(Cc3cc(-c4nn[n-]n4)cs3)[C@@H](C)CO2)c1 ZINC000826284977 608729478 /nfs/dbraw/zinc/72/94/78/608729478.db2.gz MKTCKUXHVAYNKS-KSSFIOAISA-N -1 3 369.494 3.507 20 0 FHADHM Clc1cccc(-c2n[nH]cc2CNc2cccc(-c3nnn[n-]3)c2)c1 ZINC000826352625 608868293 /nfs/dbraw/zinc/86/82/93/608868293.db2.gz IFZLSGCRKLWYAQ-UHFFFAOYSA-N -1 3 351.801 3.522 20 0 FHADHM Clc1cccc(-c2n[nH]cc2CNc2cccc(-c3nn[n-]n3)c2)c1 ZINC000826352625 608868295 /nfs/dbraw/zinc/86/82/95/608868295.db2.gz IFZLSGCRKLWYAQ-UHFFFAOYSA-N -1 3 351.801 3.522 20 0 FHADHM FC(F)Oc1ccc(CNc2cccc(-c3nnn[n-]3)c2)cc1Cl ZINC000826369687 608869540 /nfs/dbraw/zinc/86/95/40/608869540.db2.gz MLXGNRCTLUZGST-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM FC(F)Oc1ccc(CNc2cccc(-c3nn[n-]n3)c2)cc1Cl ZINC000826369687 608869545 /nfs/dbraw/zinc/86/95/45/608869545.db2.gz MLXGNRCTLUZGST-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM COc1cc(C)c(N[C@H]2CCCc3cc(-c4nnn[n-]4)ccc32)cc1OC ZINC000826178420 609158466 /nfs/dbraw/zinc/15/84/66/609158466.db2.gz XKADMLOGWMRTJW-INIZCTEOSA-N -1 3 365.437 3.682 20 0 FHADHM COc1cc(C)c(N[C@H]2CCCc3cc(-c4nn[n-]n4)ccc32)cc1OC ZINC000826178420 609158468 /nfs/dbraw/zinc/15/84/68/609158468.db2.gz XKADMLOGWMRTJW-INIZCTEOSA-N -1 3 365.437 3.682 20 0 FHADHM CCOc1ccc(N[C@@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)cc1OCC ZINC000825643808 609162685 /nfs/dbraw/zinc/16/26/85/609162685.db2.gz VYSJOIYNUNMSOE-LBPRGKRZSA-N -1 3 371.416 3.976 20 0 FHADHM CCOc1ccc(N[C@@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)cc1OCC ZINC000825643808 609162687 /nfs/dbraw/zinc/16/26/87/609162687.db2.gz VYSJOIYNUNMSOE-LBPRGKRZSA-N -1 3 371.416 3.976 20 0 FHADHM C[C@@H](Nc1ccc(OCC(F)(F)F)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000824656247 609163716 /nfs/dbraw/zinc/16/37/16/609163716.db2.gz JOUQHHLSLORHJX-LLVKDONJSA-N -1 3 363.343 3.981 20 0 FHADHM C[C@@H](Nc1ccc(OCC(F)(F)F)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000824656247 609163717 /nfs/dbraw/zinc/16/37/17/609163717.db2.gz JOUQHHLSLORHJX-LLVKDONJSA-N -1 3 363.343 3.981 20 0 FHADHM C[C@H](Nc1ccc(NC(=O)c2ccco2)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000824656753 609163851 /nfs/dbraw/zinc/16/38/51/609163851.db2.gz MFHZREOCPPNDIE-ZDUSSCGKSA-N -1 3 374.404 3.885 20 0 FHADHM C[C@H](Nc1ccc(NC(=O)c2ccco2)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000824656753 609163854 /nfs/dbraw/zinc/16/38/54/609163854.db2.gz MFHZREOCPPNDIE-ZDUSSCGKSA-N -1 3 374.404 3.885 20 0 FHADHM CC(C)C[C@H]1C[C@H](Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)CCO1 ZINC000824243624 609170959 /nfs/dbraw/zinc/17/09/59/609170959.db2.gz KSHWWBSCVWTGAT-OLZOCXBDSA-N -1 3 369.391 3.891 20 0 FHADHM CC(C)C[C@H]1C[C@H](Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)CCO1 ZINC000824243624 609170961 /nfs/dbraw/zinc/17/09/61/609170961.db2.gz KSHWWBSCVWTGAT-OLZOCXBDSA-N -1 3 369.391 3.891 20 0 FHADHM C[C@H](Nc1cccc(N2CCCCC2=O)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824662678 609175295 /nfs/dbraw/zinc/17/52/95/609175295.db2.gz PIFFJFZSXRFLOV-AWEZNQCLSA-N -1 3 362.437 3.557 20 0 FHADHM C[C@H](Nc1cccc(N2CCCCC2=O)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824662678 609175296 /nfs/dbraw/zinc/17/52/96/609175296.db2.gz PIFFJFZSXRFLOV-AWEZNQCLSA-N -1 3 362.437 3.557 20 0 FHADHM CCOCCOCc1cccc(N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000825599992 609175726 /nfs/dbraw/zinc/17/57/26/609175726.db2.gz VUAUCDVWLXVCCH-HNNXBMFYSA-N -1 3 367.453 3.593 20 0 FHADHM CCOCCOCc1cccc(N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000825599992 609175728 /nfs/dbraw/zinc/17/57/28/609175728.db2.gz VUAUCDVWLXVCCH-HNNXBMFYSA-N -1 3 367.453 3.593 20 0 FHADHM C[C@H](Nc1cc(F)c(N2CCCC2)c(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824648417 609180272 /nfs/dbraw/zinc/18/02/72/609180272.db2.gz FVSOCQQHGSNFBR-LBPRGKRZSA-N -1 3 370.407 3.918 20 0 FHADHM C[C@H](Nc1cc(F)c(N2CCCC2)c(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824648417 609180274 /nfs/dbraw/zinc/18/02/74/609180274.db2.gz FVSOCQQHGSNFBR-LBPRGKRZSA-N -1 3 370.407 3.918 20 0 FHADHM C[C@H](Nc1cc(F)c(N2CCCC2)c(F)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824648950 609180425 /nfs/dbraw/zinc/18/04/25/609180425.db2.gz JWVBAJKJFSCFGW-LBPRGKRZSA-N -1 3 370.407 3.918 20 0 FHADHM C[C@H](Nc1cc(F)c(N2CCCC2)c(F)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824648950 609180426 /nfs/dbraw/zinc/18/04/26/609180426.db2.gz JWVBAJKJFSCFGW-LBPRGKRZSA-N -1 3 370.407 3.918 20 0 FHADHM Cc1ccc(-c2n[nH]cc2CNc2ccc(Cl)c(-c3nnn[n-]3)c2)cc1 ZINC000826273495 609199384 /nfs/dbraw/zinc/19/93/84/609199384.db2.gz GZZDRSRPWORASS-UHFFFAOYSA-N -1 3 365.828 3.831 20 0 FHADHM Cc1ccc(-c2n[nH]cc2CNc2ccc(Cl)c(-c3nn[n-]n3)c2)cc1 ZINC000826273495 609199385 /nfs/dbraw/zinc/19/93/85/609199385.db2.gz GZZDRSRPWORASS-UHFFFAOYSA-N -1 3 365.828 3.831 20 0 FHADHM CCCN(C(=O)c1c[nH]c(-c2nnn[n-]2)c1)[C@@H](C)c1cc2ccccc2o1 ZINC000825301623 609201000 /nfs/dbraw/zinc/20/10/00/609201000.db2.gz NUAYTBGPPBFGJA-LBPRGKRZSA-N -1 3 364.409 3.554 20 0 FHADHM CCCN(C(=O)c1c[nH]c(-c2nn[n-]n2)c1)[C@@H](C)c1cc2ccccc2o1 ZINC000825301623 609201001 /nfs/dbraw/zinc/20/10/01/609201001.db2.gz NUAYTBGPPBFGJA-LBPRGKRZSA-N -1 3 364.409 3.554 20 0 FHADHM C[C@H](Nc1ccn(-c2ccccc2Cl)n1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824662745 609254846 /nfs/dbraw/zinc/25/48/46/609254846.db2.gz QVHJZLOOUAUPKK-LBPRGKRZSA-N -1 3 365.828 3.879 20 0 FHADHM C[C@H](Nc1ccn(-c2ccccc2Cl)n1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824662745 609254849 /nfs/dbraw/zinc/25/48/49/609254849.db2.gz QVHJZLOOUAUPKK-LBPRGKRZSA-N -1 3 365.828 3.879 20 0 FHADHM COc1ccc(OC(F)F)c(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000826211135 609275604 /nfs/dbraw/zinc/27/56/04/609275604.db2.gz QNVBHCGUPDZXPA-JTQLQIEISA-N -1 3 361.352 3.650 20 0 FHADHM COc1ccc(OC(F)F)c(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000826211135 609275605 /nfs/dbraw/zinc/27/56/05/609275605.db2.gz QNVBHCGUPDZXPA-JTQLQIEISA-N -1 3 361.352 3.650 20 0 FHADHM C[C@@H](Nc1ccc(N(C)C)c(Cl)c1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824656483 609276143 /nfs/dbraw/zinc/27/61/43/609276143.db2.gz KLNWBXYXEYFWMB-SNVBAGLBSA-N -1 3 360.824 3.898 20 0 FHADHM C[C@@H](Nc1ccc(N(C)C)c(Cl)c1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824656483 609276144 /nfs/dbraw/zinc/27/61/44/609276144.db2.gz KLNWBXYXEYFWMB-SNVBAGLBSA-N -1 3 360.824 3.898 20 0 FHADHM CCn1ncc2ccc(N[C@@H](C)c3ccc(-c4nnn[n-]4)c(F)c3)cc21 ZINC000825806940 609277112 /nfs/dbraw/zinc/27/71/12/609277112.db2.gz KPFOQAHSLOAOFK-NSHDSACASA-N -1 3 351.389 3.549 20 0 FHADHM CCn1ncc2ccc(N[C@@H](C)c3ccc(-c4nn[n-]n4)c(F)c3)cc21 ZINC000825806940 609277114 /nfs/dbraw/zinc/27/71/14/609277114.db2.gz KPFOQAHSLOAOFK-NSHDSACASA-N -1 3 351.389 3.549 20 0 FHADHM COc1ccc(OC(C)C)c(N[C@@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)c1 ZINC000826210103 609278659 /nfs/dbraw/zinc/27/86/59/609278659.db2.gz DOPBXIBHHNNAEY-LBPRGKRZSA-N -1 3 371.416 3.975 20 0 FHADHM COc1ccc(OC(C)C)c(N[C@@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)c1 ZINC000826210103 609278661 /nfs/dbraw/zinc/27/86/61/609278661.db2.gz DOPBXIBHHNNAEY-LBPRGKRZSA-N -1 3 371.416 3.975 20 0 FHADHM C[C@@H](Nc1ccc(F)c(Br)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824655143 609278978 /nfs/dbraw/zinc/27/89/78/609278978.db2.gz BOJVBTBJLUYNQG-SECBINFHSA-N -1 3 362.206 3.941 20 0 FHADHM C[C@@H](Nc1ccc(F)c(Br)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824655143 609278979 /nfs/dbraw/zinc/27/89/79/609278979.db2.gz BOJVBTBJLUYNQG-SECBINFHSA-N -1 3 362.206 3.941 20 0 FHADHM COc1cc(OC)c(N[C@H]2CCCc3cc(-c4nnn[n-]4)ccc32)cc1F ZINC000826181348 609279921 /nfs/dbraw/zinc/27/99/21/609279921.db2.gz VVJVVRHVURKGJN-HNNXBMFYSA-N -1 3 369.400 3.513 20 0 FHADHM COc1cc(OC)c(N[C@H]2CCCc3cc(-c4nn[n-]n4)ccc32)cc1F ZINC000826181348 609279923 /nfs/dbraw/zinc/27/99/23/609279923.db2.gz VVJVVRHVURKGJN-HNNXBMFYSA-N -1 3 369.400 3.513 20 0 FHADHM Cc1cc(N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)nn1-c1cccc(F)c1 ZINC000826270480 609281549 /nfs/dbraw/zinc/28/15/49/609281549.db2.gz BQMJXBBYLGYVJA-ZDUSSCGKSA-N -1 3 363.400 3.673 20 0 FHADHM Cc1cc(N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)nn1-c1cccc(F)c1 ZINC000826270480 609281551 /nfs/dbraw/zinc/28/15/51/609281551.db2.gz BQMJXBBYLGYVJA-ZDUSSCGKSA-N -1 3 363.400 3.673 20 0 FHADHM Cc1cc2cc(NC(=O)c3ccc(Cl)c(-c4nnn[n-]4)c3)ccc2[nH]1 ZINC000826273167 609288786 /nfs/dbraw/zinc/28/87/86/609288786.db2.gz SAWHCFKSVJQMGA-UHFFFAOYSA-N -1 3 352.785 3.562 20 0 FHADHM Cc1cc2cc(NC(=O)c3ccc(Cl)c(-c4nn[n-]n4)c3)ccc2[nH]1 ZINC000826273167 609288788 /nfs/dbraw/zinc/28/87/88/609288788.db2.gz SAWHCFKSVJQMGA-UHFFFAOYSA-N -1 3 352.785 3.562 20 0 FHADHM Cc1ccc2cccc(NC(=O)c3ccc(Cl)c(-c4nnn[n-]4)c3)c2n1 ZINC000826295264 609299162 /nfs/dbraw/zinc/29/91/62/609299162.db2.gz ZJIFXYQBDLXJHX-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1ccc2cccc(NC(=O)c3ccc(Cl)c(-c4nn[n-]n4)c3)c2n1 ZINC000826295264 609299164 /nfs/dbraw/zinc/29/91/64/609299164.db2.gz ZJIFXYQBDLXJHX-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM CC[C@H](c1ccncc1)N(CC)C(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000825159508 609299305 /nfs/dbraw/zinc/29/93/05/609299305.db2.gz PAQBNARMZNKVQE-MRXNPFEDSA-N -1 3 370.844 3.529 20 0 FHADHM CC[C@H](c1ccncc1)N(CC)C(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000825159508 609299306 /nfs/dbraw/zinc/29/93/06/609299306.db2.gz PAQBNARMZNKVQE-MRXNPFEDSA-N -1 3 370.844 3.529 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1N[C@@H](C)c1nc2ccccc2o1 ZINC000824324390 609301888 /nfs/dbraw/zinc/30/18/88/609301888.db2.gz NNMWINPRPIUEPO-LBPRGKRZSA-N -1 3 364.409 3.968 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1N[C@@H](C)c1nc2ccccc2o1 ZINC000824324390 609301890 /nfs/dbraw/zinc/30/18/90/609301890.db2.gz NNMWINPRPIUEPO-LBPRGKRZSA-N -1 3 364.409 3.968 20 0 FHADHM CCC(CC)NC(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000825107493 609302328 /nfs/dbraw/zinc/30/23/28/609302328.db2.gz PJALTUUOBDAEMC-UHFFFAOYSA-N -1 3 351.410 3.577 20 0 FHADHM CCC(CC)NC(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000825107493 609302330 /nfs/dbraw/zinc/30/23/30/609302330.db2.gz PJALTUUOBDAEMC-UHFFFAOYSA-N -1 3 351.410 3.577 20 0 FHADHM Cc1ccc(NC(=O)c2ccccc2Oc2ccccc2-c2nnn[n-]2)nc1 ZINC000826291709 609307800 /nfs/dbraw/zinc/30/78/00/609307800.db2.gz RSUQAIBITGTOBO-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccc(NC(=O)c2ccccc2Oc2ccccc2-c2nn[n-]n2)nc1 ZINC000826291709 609307802 /nfs/dbraw/zinc/30/78/02/609307802.db2.gz RSUQAIBITGTOBO-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM CC(C)(C)C[C@H](NC(=S)Nc1ccccc1-c1nnn[n-]1)C(F)(F)F ZINC000824086895 609308251 /nfs/dbraw/zinc/30/82/51/609308251.db2.gz PQRFASJAPAXHMH-NSHDSACASA-N -1 3 372.420 3.520 20 0 FHADHM CC(C)(C)C[C@H](NC(=S)Nc1ccccc1-c1nn[n-]n1)C(F)(F)F ZINC000824086895 609308253 /nfs/dbraw/zinc/30/82/53/609308253.db2.gz PQRFASJAPAXHMH-NSHDSACASA-N -1 3 372.420 3.520 20 0 FHADHM CCCN(CCC)C(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000825313773 609310684 /nfs/dbraw/zinc/31/06/84/609310684.db2.gz QUOGDOVPRWEHHG-UHFFFAOYSA-N -1 3 365.437 3.921 20 0 FHADHM CCCN(CCC)C(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000825313773 609310686 /nfs/dbraw/zinc/31/06/86/609310686.db2.gz QUOGDOVPRWEHHG-UHFFFAOYSA-N -1 3 365.437 3.921 20 0 FHADHM CCC(CC)[C@H]1C[C@@H](Nc2ccc3cc(-c4nnn[n-]4)ccc3n2)CCO1 ZINC000825108338 609322413 /nfs/dbraw/zinc/32/24/13/609322413.db2.gz VYMBRFKHRDXHSQ-FUHWJXTLSA-N -1 3 366.469 3.811 20 0 FHADHM CCC(CC)[C@H]1C[C@@H](Nc2ccc3cc(-c4nn[n-]n4)ccc3n2)CCO1 ZINC000825108338 609322415 /nfs/dbraw/zinc/32/24/15/609322415.db2.gz VYMBRFKHRDXHSQ-FUHWJXTLSA-N -1 3 366.469 3.811 20 0 FHADHM C[C@@H](N[C@@H](c1ccccc1)c1cccnc1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824540297 609332843 /nfs/dbraw/zinc/33/28/43/609332843.db2.gz VNACIGQTNPVRIV-VLIAUNLRSA-N -1 3 374.423 3.841 20 0 FHADHM C[C@@H](N[C@@H](c1ccccc1)c1cccnc1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824540297 609332845 /nfs/dbraw/zinc/33/28/45/609332845.db2.gz VNACIGQTNPVRIV-VLIAUNLRSA-N -1 3 374.423 3.841 20 0 FHADHM CC(C)C(=O)Nc1cccc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2F)c1 ZINC000824184019 609345696 /nfs/dbraw/zinc/34/56/96/609345696.db2.gz BQXNPYOMSAXDPB-LBPRGKRZSA-N -1 3 368.416 3.773 20 0 FHADHM CC(C)C(=O)Nc1cccc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2F)c1 ZINC000824184019 609345697 /nfs/dbraw/zinc/34/56/97/609345697.db2.gz BQXNPYOMSAXDPB-LBPRGKRZSA-N -1 3 368.416 3.773 20 0 FHADHM CCc1nc2cc(N[C@@H](C)c3ccc(-c4nnn[n-]4)cc3F)ccc2o1 ZINC000825750275 609346143 /nfs/dbraw/zinc/34/61/43/609346143.db2.gz OWQLCNRCTCBIEP-JTQLQIEISA-N -1 3 352.373 3.883 20 0 FHADHM CCc1nc2cc(N[C@@H](C)c3ccc(-c4nn[n-]n4)cc3F)ccc2o1 ZINC000825750275 609346145 /nfs/dbraw/zinc/34/61/45/609346145.db2.gz OWQLCNRCTCBIEP-JTQLQIEISA-N -1 3 352.373 3.883 20 0 FHADHM C[C@H](Nc1cc2c(cc1Cl)OCO2)c1ccc(-c2nnn[n-]2)cc1F ZINC000824649022 609347341 /nfs/dbraw/zinc/34/73/41/609347341.db2.gz KKSMRMCIRHNZFW-QMMMGPOBSA-N -1 3 361.764 3.561 20 0 FHADHM C[C@H](Nc1cc2c(cc1Cl)OCO2)c1ccc(-c2nn[n-]n2)cc1F ZINC000824649022 609347342 /nfs/dbraw/zinc/34/73/42/609347342.db2.gz KKSMRMCIRHNZFW-QMMMGPOBSA-N -1 3 361.764 3.561 20 0 FHADHM CCOc1ccc(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2F)cc1OC ZINC000825643489 609349716 /nfs/dbraw/zinc/34/97/16/609349716.db2.gz ORFMVQAQARVNSF-LLVKDONJSA-N -1 3 357.389 3.586 20 0 FHADHM CCOc1ccc(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2F)cc1OC ZINC000825643489 609349718 /nfs/dbraw/zinc/34/97/18/609349718.db2.gz ORFMVQAQARVNSF-LLVKDONJSA-N -1 3 357.389 3.586 20 0 FHADHM Cc1ccc(-c2ccc(C(=O)Nc3ccc(F)cc3-c3nnn[n-]3)s2)o1 ZINC000826273583 609395145 /nfs/dbraw/zinc/39/51/45/609395145.db2.gz KTANJVVDHGRZAU-UHFFFAOYSA-N -1 3 369.381 3.888 20 0 FHADHM Cc1ccc(-c2ccc(C(=O)Nc3ccc(F)cc3-c3nn[n-]n3)s2)o1 ZINC000826273583 609395147 /nfs/dbraw/zinc/39/51/47/609395147.db2.gz KTANJVVDHGRZAU-UHFFFAOYSA-N -1 3 369.381 3.888 20 0 FHADHM c1[nH]c(-c2nnn[n-]2)cc1-c1nc(-c2cccc(Oc3ccccc3)c2)no1 ZINC000826523052 609412020 /nfs/dbraw/zinc/41/20/20/609412020.db2.gz YUVWQIIWFGIYQR-UHFFFAOYSA-N -1 3 371.360 3.704 20 0 FHADHM c1[nH]c(-c2nn[n-]n2)cc1-c1nc(-c2cccc(Oc3ccccc3)c2)no1 ZINC000826523052 609412022 /nfs/dbraw/zinc/41/20/22/609412022.db2.gz YUVWQIIWFGIYQR-UHFFFAOYSA-N -1 3 371.360 3.704 20 0 FHADHM CC(=O)c1ccc(-c2nnn[n-]2)cc1N[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000824019799 609421101 /nfs/dbraw/zinc/42/11/01/609421101.db2.gz OXAKYSBQJDUYEO-RYUDHWBXSA-N -1 3 353.348 3.602 20 0 FHADHM CC(=O)c1ccc(-c2nn[n-]n2)cc1N[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000824019799 609421103 /nfs/dbraw/zinc/42/11/03/609421103.db2.gz OXAKYSBQJDUYEO-RYUDHWBXSA-N -1 3 353.348 3.602 20 0 FHADHM CC(=O)c1ccc(-c2nnn[n-]2)cc1NCc1coc(-c2ccc(C)cc2)n1 ZINC000824019936 609422849 /nfs/dbraw/zinc/42/28/49/609422849.db2.gz VLLXLEHCAPDKAA-UHFFFAOYSA-N -1 3 374.404 3.645 20 0 FHADHM CC(=O)c1ccc(-c2nn[n-]n2)cc1NCc1coc(-c2ccc(C)cc2)n1 ZINC000824019936 609422852 /nfs/dbraw/zinc/42/28/52/609422852.db2.gz VLLXLEHCAPDKAA-UHFFFAOYSA-N -1 3 374.404 3.645 20 0 FHADHM FC(F)(F)c1cc(SCCc2cccnc2)ccc1-c1nnn[n-]1 ZINC000826368655 609451508 /nfs/dbraw/zinc/45/15/08/609451508.db2.gz XWFXHVZZNJFGBB-UHFFFAOYSA-N -1 3 351.357 3.615 20 0 FHADHM FC(F)(F)c1cc(SCCc2cccnc2)ccc1-c1nn[n-]n1 ZINC000826368655 609451511 /nfs/dbraw/zinc/45/15/11/609451511.db2.gz XWFXHVZZNJFGBB-UHFFFAOYSA-N -1 3 351.357 3.615 20 0 FHADHM OCc1ccc(CSc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)cc1 ZINC000826510546 609451869 /nfs/dbraw/zinc/45/18/69/609451869.db2.gz WZUQRCHBNPPHJR-UHFFFAOYSA-N -1 3 366.368 3.670 20 0 FHADHM OCc1ccc(CSc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)cc1 ZINC000826510546 609451870 /nfs/dbraw/zinc/45/18/70/609451870.db2.gz WZUQRCHBNPPHJR-UHFFFAOYSA-N -1 3 366.368 3.670 20 0 FHADHM CC(C)Sc1ccc(Cl)cc1NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC000824338253 609456372 /nfs/dbraw/zinc/45/63/72/609456372.db2.gz VIFCGSCWXZPSKA-UHFFFAOYSA-N -1 3 362.846 3.601 20 0 FHADHM CC(C)Sc1ccc(Cl)cc1NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC000824338253 609456374 /nfs/dbraw/zinc/45/63/74/609456374.db2.gz VIFCGSCWXZPSKA-UHFFFAOYSA-N -1 3 362.846 3.601 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NCc1cc2cc(OC)ccc2o1 ZINC000825632639 609474874 /nfs/dbraw/zinc/47/48/74/609474874.db2.gz YRZRIAOJUWHXII-UHFFFAOYSA-N -1 3 365.393 3.632 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NCc1cc2cc(OC)ccc2o1 ZINC000825632639 609474876 /nfs/dbraw/zinc/47/48/76/609474876.db2.gz YRZRIAOJUWHXII-UHFFFAOYSA-N -1 3 365.393 3.632 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NCc1ccc2ncccc2c1 ZINC000824324346 609478327 /nfs/dbraw/zinc/47/83/27/609478327.db2.gz LOWRHZSSEQOVQR-UHFFFAOYSA-N -1 3 360.421 3.814 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NCc1cccc(OCc2ccccn2)c1 ZINC000826278728 609479686 /nfs/dbraw/zinc/47/96/86/609479686.db2.gz PQAXQARINUGFEK-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NCc1cccc(OCc2ccccn2)c1 ZINC000826278728 609479687 /nfs/dbraw/zinc/47/96/87/609479687.db2.gz PQAXQARINUGFEK-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM CC(C)(C)Oc1cc(F)ccc1NCc1cccc(-c2nnn[n-]2)c1F ZINC000824119660 609480060 /nfs/dbraw/zinc/48/00/60/609480060.db2.gz NEISLZDHHZJCPT-UHFFFAOYSA-N -1 3 359.380 3.934 20 0 FHADHM CC(C)(C)Oc1cc(F)ccc1NCc1cccc(-c2nn[n-]n2)c1F ZINC000824119660 609480064 /nfs/dbraw/zinc/48/00/64/609480064.db2.gz NEISLZDHHZJCPT-UHFFFAOYSA-N -1 3 359.380 3.934 20 0 FHADHM CSc1c(F)cc(NCc2cccc(-c3nnn[n-]3)c2F)cc1F ZINC000826229938 609481781 /nfs/dbraw/zinc/48/17/81/609481781.db2.gz XFXXLISTAKKPBA-UHFFFAOYSA-N -1 3 351.357 3.618 20 0 FHADHM CSc1c(F)cc(NCc2cccc(-c3nn[n-]n3)c2F)cc1F ZINC000826229938 609481783 /nfs/dbraw/zinc/48/17/83/609481783.db2.gz XFXXLISTAKKPBA-UHFFFAOYSA-N -1 3 351.357 3.618 20 0 FHADHM C[C@H]1CCC[C@H]1C(=O)N(Cc1ccccc1)c1ccccc1-c1nnn[n-]1 ZINC000824927271 609483055 /nfs/dbraw/zinc/48/30/55/609483055.db2.gz NKSLJHNLLQGDLQ-DOTOQJQBSA-N -1 3 361.449 3.836 20 0 FHADHM C[C@H]1CCC[C@H]1C(=O)N(Cc1ccccc1)c1ccccc1-c1nn[n-]n1 ZINC000824927271 609483057 /nfs/dbraw/zinc/48/30/57/609483057.db2.gz NKSLJHNLLQGDLQ-DOTOQJQBSA-N -1 3 361.449 3.836 20 0 FHADHM CCOC(=O)Nc1ccc(NCc2ccc(CC)cc2)cc1-c1nnn[n-]1 ZINC000825553515 609488346 /nfs/dbraw/zinc/48/83/46/609488346.db2.gz RXKUMUPRXFRZDH-UHFFFAOYSA-N -1 3 366.425 3.610 20 0 FHADHM CCOC(=O)Nc1ccc(NCc2ccc(CC)cc2)cc1-c1nn[n-]n1 ZINC000825553515 609488347 /nfs/dbraw/zinc/48/83/47/609488347.db2.gz RXKUMUPRXFRZDH-UHFFFAOYSA-N -1 3 366.425 3.610 20 0 FHADHM C[C@@H]1CCC[C@H]1C(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000824930048 609501619 /nfs/dbraw/zinc/50/16/19/609501619.db2.gz ZVNDRGNRNPPAKQ-IUODEOHRSA-N -1 3 367.478 3.648 20 0 FHADHM Cc1c(Cl)cnc(N[C@H](C)c2ccc(F)cc2F)c1-c1nnn[n-]1 ZINC000826238391 609520019 /nfs/dbraw/zinc/52/00/19/609520019.db2.gz FLKAINAYFSNKNV-MRVPVSSYSA-N -1 3 350.760 3.675 20 0 FHADHM Cc1c(Cl)cnc(N[C@H](C)c2ccc(F)cc2F)c1-c1nn[n-]n1 ZINC000826238391 609520021 /nfs/dbraw/zinc/52/00/21/609520021.db2.gz FLKAINAYFSNKNV-MRVPVSSYSA-N -1 3 350.760 3.675 20 0 FHADHM COc1ccc([C@H]2CCCN2c2ncc(Cl)c(C)c2-c2nnn[n-]2)cc1 ZINC000826189762 609521711 /nfs/dbraw/zinc/52/17/11/609521711.db2.gz DNEKXSYFCICLIF-OAHLLOKOSA-N -1 3 370.844 3.574 20 0 FHADHM COc1ccc([C@H]2CCCN2c2ncc(Cl)c(C)c2-c2nn[n-]n2)cc1 ZINC000826189762 609521712 /nfs/dbraw/zinc/52/17/12/609521712.db2.gz DNEKXSYFCICLIF-OAHLLOKOSA-N -1 3 370.844 3.574 20 0 FHADHM CCN(C(=O)C1C[C@H](C)C[C@@H](C)C1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825366512 609523807 /nfs/dbraw/zinc/52/38/07/609523807.db2.gz ATVMSVGNPMEJCR-RBSFLKMASA-N -1 3 355.486 3.849 20 0 FHADHM CCN(C(=O)C1C[C@H](C)C[C@@H](C)C1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825366512 609523808 /nfs/dbraw/zinc/52/38/08/609523808.db2.gz ATVMSVGNPMEJCR-RBSFLKMASA-N -1 3 355.486 3.849 20 0 FHADHM Cc1c(Cl)cnc(N2CC=C(c3ccc(F)cc3)CC2)c1-c1nnn[n-]1 ZINC000826237084 609523934 /nfs/dbraw/zinc/52/39/34/609523934.db2.gz NNRVSEBPAKDJGR-UHFFFAOYSA-N -1 3 370.819 3.656 20 0 FHADHM Cc1c(Cl)cnc(N2CC=C(c3ccc(F)cc3)CC2)c1-c1nn[n-]n1 ZINC000826237084 609523935 /nfs/dbraw/zinc/52/39/35/609523935.db2.gz NNRVSEBPAKDJGR-UHFFFAOYSA-N -1 3 370.819 3.656 20 0 FHADHM CCOc1ccc([C@@H](C)Nc2ncc(Cl)c(C)c2-c2nnn[n-]2)cc1 ZINC000825639548 609526170 /nfs/dbraw/zinc/52/61/70/609526170.db2.gz ZLTSXNOSPBSICQ-LLVKDONJSA-N -1 3 358.833 3.795 20 0 FHADHM CCOc1ccc([C@@H](C)Nc2ncc(Cl)c(C)c2-c2nn[n-]n2)cc1 ZINC000825639548 609526172 /nfs/dbraw/zinc/52/61/72/609526172.db2.gz ZLTSXNOSPBSICQ-LLVKDONJSA-N -1 3 358.833 3.795 20 0 FHADHM Cc1ccnc(N[C@@H](c2ccccc2)c2ccc(F)cc2)c1-c1nnn[n-]1 ZINC000826311477 609535140 /nfs/dbraw/zinc/53/51/40/609535140.db2.gz FXELQSBKCBVRMH-SFHVURJKSA-N -1 3 360.396 3.911 20 0 FHADHM Cc1ccnc(N[C@@H](c2ccccc2)c2ccc(F)cc2)c1-c1nn[n-]n1 ZINC000826311477 609535141 /nfs/dbraw/zinc/53/51/41/609535141.db2.gz FXELQSBKCBVRMH-SFHVURJKSA-N -1 3 360.396 3.911 20 0 FHADHM Cc1ccnc(N2CCC[C@H]2c2ccccc2C(F)(F)F)c1-c1nnn[n-]1 ZINC000826310780 609547679 /nfs/dbraw/zinc/54/76/79/609547679.db2.gz ICJJWOQNAYQFMR-AWEZNQCLSA-N -1 3 374.370 3.930 20 0 FHADHM Cc1ccnc(N2CCC[C@H]2c2ccccc2C(F)(F)F)c1-c1nn[n-]n1 ZINC000826310780 609547680 /nfs/dbraw/zinc/54/76/80/609547680.db2.gz ICJJWOQNAYQFMR-AWEZNQCLSA-N -1 3 374.370 3.930 20 0 FHADHM Clc1cc(-c2nnn[n-]2)cnc1N1CCC[C@@H]1/C=C\c1ccccc1 ZINC000826350953 609580043 /nfs/dbraw/zinc/58/00/43/609580043.db2.gz RGEIDWWYJJXXRZ-WHLNPGIBSA-N -1 3 352.829 3.597 20 0 FHADHM 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O=C([O-])[C@H](c1c(F)cccc1Cl)N1CCC[C@H]([C@@H]2CCCCO2)C1 ZINC000656769413 932405283 /nfs/dbraw/zinc/40/52/83/932405283.db2.gz PJHVFGLOVDGOQI-NUTKFTJISA-N -1 3 355.837 3.886 20 0 FHADHM C[C@@H](NCc1nc2c3ccccc3oc2c(=O)[n-]1)c1nc2c(s1)CCC2 ZINC000656798683 932436290 /nfs/dbraw/zinc/43/62/90/932436290.db2.gz GAAVQLDFXRGHTQ-SNVBAGLBSA-N -1 3 366.446 3.878 20 0 FHADHM Cc1nc(-c2ccc([C@@H](C)NC(=O)NCc3ncccc3[O-])cc2)cs1 ZINC000471681558 932585773 /nfs/dbraw/zinc/58/57/73/932585773.db2.gz XPZPVHXKJYMELT-GFCCVEGCSA-N -1 3 368.462 3.780 20 0 FHADHM C[C@H]1CCCCCN1C(=O)c1cc(=O)c2cc(Br)ccc2[n-]1 ZINC000548277000 932795355 /nfs/dbraw/zinc/79/53/55/932795355.db2.gz HYHSOYHODDCFEZ-NSHDSACASA-N -1 3 363.255 3.695 20 0 FHADHM Cc1ccc(-c2nc(C(=O)Nc3nnc(C(F)(F)F)[n-]3)cs2)cc1 ZINC000036714240 932951827 /nfs/dbraw/zinc/95/18/27/932951827.db2.gz UIYAKEQXXWMULH-UHFFFAOYSA-N -1 3 353.329 3.508 20 0 FHADHM Cc1ccc(-c2nc(C(=O)Nc3nc(C(F)(F)F)n[n-]3)cs2)cc1 ZINC000036714240 932951831 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C[C@@H](CC(=O)c1ccccc1)[N-]S(=O)(=O)c1c(Cl)cccc1Cl ZINC000431072511 933782441 /nfs/dbraw/zinc/78/24/41/933782441.db2.gz SJNXHLBLKGJACL-NSHDSACASA-N -1 3 372.273 3.933 20 0 FHADHM CCOC(=O)c1csc([C@@H]2CCCN2C(=O)c2ccc(CC)cc2[O-])n1 ZINC000276923009 934002293 /nfs/dbraw/zinc/00/22/93/934002293.db2.gz WRIYLPCLSFXMFI-HNNXBMFYSA-N -1 3 374.462 3.565 20 0 FHADHM Cc1nc([C@@H](NC(=O)c2ccc(C)cc2[O-])c2ccc(Cl)cc2)no1 ZINC000092527421 934080220 /nfs/dbraw/zinc/08/02/20/934080220.db2.gz PAFJXYHMPUGHQD-INIZCTEOSA-N -1 3 357.797 3.565 20 0 FHADHM O=C(Nc1cnccc1Oc1ccccc1)c1c[n-]c2ccccc2c1=O ZINC001125552673 934112262 /nfs/dbraw/zinc/11/22/62/934112262.db2.gz LVEWVCFCJIOVFC-UHFFFAOYSA-N -1 3 357.369 3.968 20 0 FHADHM Cc1c(C(=O)[O-])cnn1C1CCN(c2c(C)cnc3c(C)cccc32)CC1 ZINC000582006087 934175271 /nfs/dbraw/zinc/17/52/71/934175271.db2.gz YXHMTBRIGUQOCB-UHFFFAOYSA-N -1 3 364.449 3.896 20 0 FHADHM CC(C)Cn1cc(NC(=O)c2c[n-]c3ccccc3c2=O)c(C(F)F)n1 ZINC000535668518 934235831 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CS[C@@H]1CCCCN(C(=O)Nc2ccc(-c3cc(=O)[n-]c(C)n3)cc2)C1 ZINC000610928563 934629409 /nfs/dbraw/zinc/62/94/09/934629409.db2.gz NCLQXCNOXOSSJP-MRXNPFEDSA-N -1 3 372.494 3.907 20 0 FHADHM O=C([O-])[C@@H](CN1CCCCC1)NCc1ccc(-c2ccccc2Cl)o1 ZINC000277267276 934854660 /nfs/dbraw/zinc/85/46/60/934854660.db2.gz LDRHTSJPMZKRHJ-QGZVFWFLSA-N -1 3 362.857 3.629 20 0 FHADHM Cc1nn(Cc2ccc(F)cc2)c(Cl)c1CNCCC[C@@H](C)C(=O)[O-] ZINC000277269681 934856828 /nfs/dbraw/zinc/85/68/28/934856828.db2.gz LGZFDVIXRYPQCT-GFCCVEGCSA-N -1 3 367.852 3.623 20 0 FHADHM Cc1conc1[N-]C(=O)c1csc(-c2cnn(-c3ccccc3)c2)n1 ZINC000123684792 934856833 /nfs/dbraw/zinc/85/68/33/934856833.db2.gz KHZDACIKONOFNV-UHFFFAOYSA-N -1 3 351.391 3.545 20 0 FHADHM NC(=O)CCSc1ccccc1[N-]C(=O)c1coc(-c2ccccc2)n1 ZINC000119584865 934899858 /nfs/dbraw/zinc/89/98/58/934899858.db2.gz VKXWMVSGJXPJCY-UHFFFAOYSA-N -1 3 367.430 3.561 20 0 FHADHM Cc1ccc(CC(=O)[N-]OCC(=O)Nc2c(C)cccc2C(C)C)cc1 ZINC000156847595 934963885 /nfs/dbraw/zinc/96/38/85/934963885.db2.gz 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ZINC000737454976 945073198 /nfs/dbraw/zinc/07/31/98/945073198.db2.gz KWGJEOOLWKLTMJ-MRVPVSSYSA-N -1 3 354.361 3.824 20 0 FHADHM Cc1csc([C@@H](C)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)n1 ZINC000737454976 945073211 /nfs/dbraw/zinc/07/32/11/945073211.db2.gz KWGJEOOLWKLTMJ-MRVPVSSYSA-N -1 3 354.361 3.824 20 0 FHADHM C[C@H](Cc1c(Cl)cccc1Cl)NC(=O)NCc1ncccc1[O-] ZINC000472112823 935060912 /nfs/dbraw/zinc/06/09/12/935060912.db2.gz MBMULPOQBTXZRA-SNVBAGLBSA-N -1 3 354.237 3.524 20 0 FHADHM COc1ccc([C@H](CC(=O)[O-])NCc2ccc(Cl)c(F)c2)cc1OC ZINC000277403786 935106227 /nfs/dbraw/zinc/10/62/27/935106227.db2.gz SABKXZMWZCWSJP-HNNXBMFYSA-N -1 3 367.804 3.802 20 0 FHADHM O=C(Nc1nnc(C(F)(F)F)[n-]1)c1c(Cl)cccc1OCC1CC1 ZINC000892151645 935136346 /nfs/dbraw/zinc/13/63/46/935136346.db2.gz AOFIDYITYCHKJG-UHFFFAOYSA-N -1 3 360.723 3.518 20 0 FHADHM O=C(Nc1nc(C(F)(F)F)n[n-]1)c1c(Cl)cccc1OCC1CC1 ZINC000892151645 935136347 /nfs/dbraw/zinc/13/63/47/935136347.db2.gz AOFIDYITYCHKJG-UHFFFAOYSA-N -1 3 360.723 3.518 20 0 FHADHM Cc1cccc(CN(C)C(=O)Nc2ccc(-c3cc(=O)[n-]c(C)n3)cc2)n1 ZINC000437174583 945081498 /nfs/dbraw/zinc/08/14/98/945081498.db2.gz XMBOMBRGKMYBAL-UHFFFAOYSA-N -1 3 363.421 3.525 20 0 FHADHM CCc1ccc(C(=O)N2CCC[C@@H](Cn3cnc4ccccc43)C2)c([O-])c1 ZINC000684751711 935267583 /nfs/dbraw/zinc/26/75/83/935267583.db2.gz NLPGEOSJVAXIDT-QGZVFWFLSA-N -1 3 363.461 3.857 20 0 FHADHM O=[S@@](Cc1csc(COc2ccc(F)cc2)n1)c1ccc([O-])cc1 ZINC000108085497 935314844 /nfs/dbraw/zinc/31/48/44/935314844.db2.gz COHFKXUVEUKNEO-XMMPIXPASA-N -1 3 363.435 3.875 20 0 FHADHM Clc1ccc2ncc(-c3nnn[n-]3)c(N3CCc4ccccc4C3)c2c1 ZINC000737574730 945097043 /nfs/dbraw/zinc/09/70/43/945097043.db2.gz RZIOEAASTMHALT-UHFFFAOYSA-N -1 3 362.824 3.631 20 0 FHADHM Clc1ccc2ncc(-c3nn[n-]n3)c(N3CCc4ccccc4C3)c2c1 ZINC000737574730 945097054 /nfs/dbraw/zinc/09/70/54/945097054.db2.gz RZIOEAASTMHALT-UHFFFAOYSA-N -1 3 362.824 3.631 20 0 FHADHM Cc1ccnc(C[N-]S(=O)(=O)c2c(Cl)cccc2C(F)(F)F)c1 ZINC000582193925 935392086 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CCSc1ccc(C(=O)NCc2ccc([O-])c(Br)c2)cn1 ZINC000151609386 938601135 /nfs/dbraw/zinc/60/11/35/938601135.db2.gz XTWGEUFHTIFDPB-UHFFFAOYSA-N -1 3 367.268 3.592 20 0 FHADHM O=C(CSc1ccc(F)cc1)NCc1ccc([O-])c(Br)c1 ZINC000151634992 938611927 /nfs/dbraw/zinc/61/19/27/938611927.db2.gz IIEKRRISRHDHSM-UHFFFAOYSA-N -1 3 370.243 3.702 20 0 FHADHM Cn1c2ccccc2nc1-c1cccc(NC(=O)c2cccc3n[n-]nc32)c1 ZINC000584210547 938641432 /nfs/dbraw/zinc/64/14/32/938641432.db2.gz GEZTUIUVRFCMMA-UHFFFAOYSA-N -1 3 368.400 3.764 20 0 FHADHM CC(C)(C[N-]S(=O)(=O)c1ccc(Cl)nc1Cl)c1ccccc1 ZINC000725823517 938649102 /nfs/dbraw/zinc/64/91/02/938649102.db2.gz SITOFRVFPYOADY-UHFFFAOYSA-N -1 3 359.278 3.645 20 0 FHADHM CC[C@@H]([N-]S(=O)(=O)c1oc2ccc(F)cc2c1C)c1nccs1 ZINC000472317967 938693012 /nfs/dbraw/zinc/69/30/12/938693012.db2.gz YXOIGMPHQGUBCV-GFCCVEGCSA-N -1 3 354.428 3.766 20 0 FHADHM CCN(C[C@H]1CCN(C(=O)c2ccc(C(C)C)cc2[O-])C1)CC(F)(F)F ZINC000081468085 938790083 /nfs/dbraw/zinc/79/00/83/938790083.db2.gz 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938979524 /nfs/dbraw/zinc/97/95/24/938979524.db2.gz HQQLAYGYXSRDJF-UHFFFAOYSA-N -1 3 364.630 3.733 20 0 FHADHM O=C(NC[C@H]1CCN(c2ccc(Cl)cc2)C1)c1cc([O-])ccc1Cl ZINC000685650155 939008422 /nfs/dbraw/zinc/00/84/22/939008422.db2.gz UBRDBEOTJIJYFN-GFCCVEGCSA-N -1 3 365.260 3.955 20 0 FHADHM O=C1[N-]C(=O)C(=CNc2ccc(CCC(F)(F)F)cc2)c2ccccc21 ZINC000176940344 939009182 /nfs/dbraw/zinc/00/91/82/939009182.db2.gz FFVCNZVCWSQIRN-LFIBNONCSA-N -1 3 360.335 3.905 20 0 FHADHM COc1cc(CNCc2c([O-])ccc(Cl)c2F)cc(OC)c1OC ZINC000190698387 939017375 /nfs/dbraw/zinc/01/73/75/939017375.db2.gz BQEHPXLURVUWKM-UHFFFAOYSA-N -1 3 355.793 3.500 20 0 FHADHM CC1(C(=O)[O-])CCN(Cc2cccc(C(=O)Nc3ccccc3)c2)CC1 ZINC000647375392 939069957 /nfs/dbraw/zinc/06/99/57/939069957.db2.gz YHGTWQYRCXJRPN-UHFFFAOYSA-N -1 3 352.434 3.626 20 0 FHADHM CC1(C(=O)[O-])CCN(Cc2cc(Br)cc3cccnc32)CC1 ZINC000647375711 939077033 /nfs/dbraw/zinc/07/70/33/939077033.db2.gz DBHHUWVBRAHDNA-UHFFFAOYSA-N -1 3 363.255 3.684 20 0 FHADHM O=C([O-])[C@]1(C(F)(F)F)CCN(CCOc2cc(Cl)cc(Cl)c2)C1 ZINC000516777811 945246234 /nfs/dbraw/zinc/24/62/34/945246234.db2.gz RJDDMGYMUCWGLY-ZDUSSCGKSA-N -1 3 372.170 3.711 20 0 FHADHM COc1nc(C(=O)Nc2ccc(Br)cc2[O-])cc2ccccc21 ZINC000519267374 945260497 /nfs/dbraw/zinc/26/04/97/945260497.db2.gz SXYSWBDDWGQPNB-UHFFFAOYSA-N -1 3 373.206 3.964 20 0 FHADHM CCn1c(COC(=O)c2cc(-c3ccc(C)o3)[n-]n2)nc2c1cccc2F ZINC000728622580 940219792 /nfs/dbraw/zinc/21/97/92/940219792.db2.gz RKAHCKKGCLVZBC-UHFFFAOYSA-N -1 3 368.368 3.844 20 0 FHADHM CCn1c(COC(=O)c2cc(-c3ccc(C)o3)n[n-]2)nc2c1cccc2F ZINC000728622580 940219795 /nfs/dbraw/zinc/21/97/95/940219795.db2.gz RKAHCKKGCLVZBC-UHFFFAOYSA-N -1 3 368.368 3.844 20 0 FHADHM CC(C)C[C@@H](C(=O)N1CCc2nc[n-]c(=O)c2C1)c1ccc(Cl)cc1 ZINC000612809076 940286685 /nfs/dbraw/zinc/28/66/85/940286685.db2.gz BNEHLUIUGCTCSQ-OAHLLOKOSA-N -1 3 359.857 3.550 20 0 FHADHM O=C(c1ccccc1[O-])N1CCO[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000183988435 945309582 /nfs/dbraw/zinc/30/95/82/945309582.db2.gz DOKLECNXLAJDBR-INIZCTEOSA-N -1 3 351.324 3.625 20 0 FHADHM Cc1ccccc1OCCCC(=O)OCc1noc(-c2ccccc2[O-])n1 ZINC000782660398 940320378 /nfs/dbraw/zinc/32/03/78/940320378.db2.gz QWZIHTMHISWWQX-UHFFFAOYSA-N -1 3 368.389 3.653 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)N(C)Cc3ccsc3)cc2)cc(=O)[n-]1 ZINC000613042089 940412842 /nfs/dbraw/zinc/41/28/42/940412842.db2.gz HWIYWOHKYJSKFT-UHFFFAOYSA-N -1 3 354.435 3.883 20 0 FHADHM CC(C)Oc1ccc(CC[C@H](C)NC(=O)c2cc(F)cc3n[n-]nc32)cc1 ZINC000431730309 940433292 /nfs/dbraw/zinc/43/32/92/940433292.db2.gz GWUDZDLTFXRSCP-ZDUSSCGKSA-N -1 3 370.428 3.635 20 0 FHADHM Cc1ccc([N-]S(=O)(=O)/C=C\c2cccc(Br)c2)nc1 ZINC000255881376 940444209 /nfs/dbraw/zinc/44/42/09/940444209.db2.gz KLUZTLHVFMAQPO-FPLPWBNLSA-N -1 3 353.241 3.565 20 0 FHADHM COC(=O)c1ccc(-c2nc(C(C)(C)c3ccc(Cl)cc3F)no2)[n-]1 ZINC000426600865 945324517 /nfs/dbraw/zinc/32/45/17/945324517.db2.gz NALZMUHTZLMMFV-UHFFFAOYSA-N -1 3 363.776 3.970 20 0 FHADHM CCCc1cc(=O)[n-]c(C(=Cc2ccc(S(C)(=O)=O)s2)CC)n1 ZINC000414083532 940488640 /nfs/dbraw/zinc/48/86/40/940488640.db2.gz WGZZEBBXZQNZJN-LUAWRHEFSA-N -1 3 352.481 3.550 20 0 FHADHM CCOC(=O)c1ncc(NC(=O)c2ccc(-c3ccccc3Cl)o2)[n-]1 ZINC000617872270 940495524 /nfs/dbraw/zinc/49/55/24/940495524.db2.gz PEBYZESELVIMTL-UHFFFAOYSA-N -1 3 359.769 3.752 20 0 FHADHM COc1cc(C(=O)N(C)[C@H](C)Cc2ccc(Cl)cc2)cc(OC)c1[O-] ZINC000163529398 940687738 /nfs/dbraw/zinc/68/77/38/940687738.db2.gz IYHFXHHTHPIQIW-GFCCVEGCSA-N -1 3 363.841 3.766 20 0 FHADHM C/C(=C/C(=O)Nc1ccccc1[N-]S(C)(=O)=O)c1ccccc1Cl ZINC000066606513 940716323 /nfs/dbraw/zinc/71/63/23/940716323.db2.gz RNHJJCQAMBAIFO-QXMHVHEDSA-N -1 3 364.854 3.754 20 0 FHADHM Cc1cc(=NC(=O)CCCc2ccc([O-])c(F)c2)[nH]n1C1CCCCC1 ZINC000461198804 940789266 /nfs/dbraw/zinc/78/92/66/940789266.db2.gz SQRJTDDHTGKRHF-UHFFFAOYSA-N -1 3 359.445 3.925 20 0 FHADHM O=C(CCC(=O)c1cccs1)Nc1ccc(Br)cc1[O-] ZINC000642323991 945357598 /nfs/dbraw/zinc/35/75/98/945357598.db2.gz 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O=C([O-])CC[C@H]1CCCCN1CC(=O)N[C@@H](c1ccccc1)C1CCCC1 ZINC000424266578 943813863 /nfs/dbraw/zinc/81/38/63/943813863.db2.gz XCXHXGWSRQLGJB-KNQAVFIVSA-N -1 3 372.509 3.753 20 0 FHADHM CCOc1c(Cl)cc([N-]S(=O)(=O)C[C@@H](OC)C2CC2)cc1Cl ZINC000578192986 943939766 /nfs/dbraw/zinc/93/97/66/943939766.db2.gz IXXALQRWKORJCA-CYBMUJFWSA-N -1 3 368.282 3.559 20 0 FHADHM COC(C)(C)c1nc(C)c(C(=O)[N-]c2ncn(C3CCCCC3)n2)s1 ZINC000517061636 943960740 /nfs/dbraw/zinc/96/07/40/943960740.db2.gz FAQWGAIFKYDBBU-UHFFFAOYSA-N -1 3 363.487 3.682 20 0 FHADHM O=S(=O)([N-]c1ccc(OC(F)F)c(F)c1)C1=Cc2ccccc2OC1 ZINC000190244289 944002441 /nfs/dbraw/zinc/00/24/41/944002441.db2.gz UAXPEDLZWNXUOZ-UHFFFAOYSA-N -1 3 371.336 3.602 20 0 FHADHM CCn1cc(C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)c(C(F)(F)F)n1 ZINC000436149920 944058404 /nfs/dbraw/zinc/05/84/04/944058404.db2.gz SCJAQIOAFTWBHO-UHFFFAOYSA-N -1 3 367.249 3.899 20 0 FHADHM COc1ccc(C(=O)NCc2cccc(COCc3ccco3)c2)c([O-])c1 ZINC000031961949 944160985 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CCC(CC)c1nnc([N-]C(=O)c2cn(-c3cc(C)cc(F)c3)nn2)s1 ZINC000436424588 944289574 /nfs/dbraw/zinc/28/95/74/944289574.db2.gz GKWLLNBHTBXCEI-UHFFFAOYSA-N -1 3 374.445 3.722 20 0 FHADHM CC(C)(C)[C@H]1CCC[C@@H](NC(=O)NCc2nc(C(F)(F)F)n[n-]2)CC1 ZINC000436420763 944293593 /nfs/dbraw/zinc/29/35/93/944293593.db2.gz GCVMFEJJMYJDRU-WDEREUQCSA-N -1 3 361.412 3.618 20 0 FHADHM C[C@]1(c2ccccc2)C[C@H]1[N-]S(=O)(=O)c1ccc(Br)s1 ZINC000608031445 944312937 /nfs/dbraw/zinc/31/29/37/944312937.db2.gz OQHDBAUHCCRRNO-BXUZGUMPSA-N -1 3 372.309 3.519 20 0 FHADHM CCC[C@H](C)NC(=O)N1CCC(C(=O)Nc2cc(Cl)ccc2[O-])CC1 ZINC000043001417 944349165 /nfs/dbraw/zinc/34/91/65/944349165.db2.gz LBCQNTKHMZPCSK-LBPRGKRZSA-N -1 3 367.877 3.594 20 0 FHADHM O=C(N=c1cc(-c2ccncc2)[n-][nH]1)c1ccccc1OC1CCCCC1 ZINC000439145311 944377399 /nfs/dbraw/zinc/37/73/99/944377399.db2.gz WYVJQOSQTMGLOS-UHFFFAOYSA-N -1 3 362.433 3.857 20 0 FHADHM O=C(N=c1cc(-c2ccncc2)[n-][nH]1)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1 ZINC000439145807 944378176 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Cc1cccc(C(=O)Nc2ccc(CS(=O)(=O)C(C)(C)C)cc2)c1[O-] ZINC000436541980 944418520 /nfs/dbraw/zinc/41/85/20/944418520.db2.gz BJIYXHJDYBVKEK-UHFFFAOYSA-N -1 3 361.463 3.666 20 0 FHADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1CCC(c2ncc[nH]2)CC1 ZINC000436544792 944422012 /nfs/dbraw/zinc/42/20/12/944422012.db2.gz QBAHVEOOTQCDDS-UHFFFAOYSA-N -1 3 363.417 3.927 20 0 FHADHM Cc1cccc(N2CCC(NC(=O)c3ccc(C(C)C)cc3[O-])CC2)n1 ZINC000436545118 944423825 /nfs/dbraw/zinc/42/38/25/944423825.db2.gz RBTRDACFHCDSPY-UHFFFAOYSA-N -1 3 353.466 3.618 20 0 FHADHM CCCOc1ccc(CN(CCC)C(=O)c2ccc(O)cc2[O-])cc1OC ZINC000436565357 944430194 /nfs/dbraw/zinc/43/01/94/944430194.db2.gz JBIUJXXDFVDMET-UHFFFAOYSA-N -1 3 373.449 3.948 20 0 FHADHM CC[C@@H](c1ccc(F)cc1F)N1CCN(C(=O)c2ccc(C)cc2[O-])CC1 ZINC000436567450 944432021 /nfs/dbraw/zinc/43/20/21/944432021.db2.gz OFEGFDBRQPBEFE-IBGZPJMESA-N -1 3 374.431 3.888 20 0 FHADHM [O-]c1cc2ccccc2cc1-c1nc(-c2ncccc2-n2cccn2)no1 ZINC000436570444 944434436 /nfs/dbraw/zinc/43/44/36/944434436.db2.gz QIJUCZALHIUTNT-UHFFFAOYSA-N -1 3 355.357 3.843 20 0 FHADHM CCc1c(NC(=O)c2cc(OC)ccc2[O-])cnn1-c1cccc(C)c1 ZINC000436593153 944439032 /nfs/dbraw/zinc/43/90/32/944439032.db2.gz CMRARIQHBHTLJM-UHFFFAOYSA-N -1 3 351.406 3.710 20 0 FHADHM COc1ccc(C(=O)N2CCc3c(Cl)cc(Cl)cc3C2)c([O-])c1 ZINC000436594010 944439278 /nfs/dbraw/zinc/43/92/78/944439278.db2.gz DCCUIRFIBBEUAW-UHFFFAOYSA-N -1 3 352.217 3.906 20 0 FHADHM CCS[C@@H](C)c1noc(CN(C)C(=O)c2ccc(C(C)C)cc2[O-])n1 ZINC000436595060 944439894 /nfs/dbraw/zinc/43/98/94/944439894.db2.gz HNDKSUSWGZYLOS-LBPRGKRZSA-N -1 3 363.483 3.985 20 0 FHADHM CC(=O)c1ccc(C(=O)Nc2cccc(OCc3cccnc3)c2)cc1[O-] ZINC000436596946 944441024 /nfs/dbraw/zinc/44/10/24/944441024.db2.gz SMIRSFNSZAYLDM-UHFFFAOYSA-N -1 3 362.385 3.821 20 0 FHADHM Cc1cc(C[C@H](C)NC(=O)c2cc(CCc3ccccc3)ccc2[O-])[nH]n1 ZINC000436598319 944442962 /nfs/dbraw/zinc/44/29/62/944442962.db2.gz YLYJGZQDIUSRHC-HNNXBMFYSA-N -1 3 363.461 3.570 20 0 FHADHM O=C(NCCCOC1CCOCC1)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436581523 944445593 /nfs/dbraw/zinc/44/55/93/944445593.db2.gz GAAMJHFMEYTQNV-UHFFFAOYSA-N -1 3 371.433 3.500 20 0 FHADHM Cc1nn(C)c(C)c1[C@H](NC(=O)c1ccc(C(C)C)cc1[O-])C(F)(F)F ZINC000436584114 944448100 /nfs/dbraw/zinc/44/81/00/944448100.db2.gz GINUIALDQZGPJS-INIZCTEOSA-N -1 3 369.387 3.899 20 0 FHADHM CC(C)c1ccc(C(=O)NCc2cccc(NC(=O)N(C)C)c2)c([O-])c1 ZINC000436586261 944448874 /nfs/dbraw/zinc/44/88/74/944448874.db2.gz BBSQLQGUZABAKH-UHFFFAOYSA-N -1 3 355.438 3.539 20 0 FHADHM CC(C)OC(=O)[C@@H](C)N(C)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436586079 944449902 /nfs/dbraw/zinc/44/99/02/944449902.db2.gz LEHOCHCLMVNUTK-CQSZACIVSA-N -1 3 357.406 3.597 20 0 FHADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CC[C@@H]([C@H]2CCOC2)C1 ZINC000436605614 944456729 /nfs/dbraw/zinc/45/67/29/944456729.db2.gz PJURFBFEUJQMBV-UXHICEINSA-N -1 3 365.473 3.676 20 0 FHADHM COc1ccccc1C1(CNC(=O)c2ccc(C(C)=O)c([O-])c2)CCCC1 ZINC000436612918 944461046 /nfs/dbraw/zinc/46/10/46/944461046.db2.gz ZYXQHJYDJRHXPJ-UHFFFAOYSA-N -1 3 367.445 3.845 20 0 FHADHM COc1ccc(C(=O)N[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)c([O-])c1 ZINC000436624407 944465102 /nfs/dbraw/zinc/46/51/02/944465102.db2.gz LHVCHNCFFBOMSJ-DZGCQCFKSA-N -1 3 351.324 3.706 20 0 FHADHM COc1ccc(C(=O)N[C@@H]2C[C@@H]2c2ccccc2C(F)(F)F)c([O-])c1 ZINC000436624410 944465146 /nfs/dbraw/zinc/46/51/46/944465146.db2.gz LHVCHNCFFBOMSJ-UKRRQHHQSA-N -1 3 351.324 3.706 20 0 FHADHM Cc1ccccc1CN1CCN(C(=O)c2ccc(C(C)C)cc2[O-])CC1 ZINC000436621775 944479022 /nfs/dbraw/zinc/47/90/22/944479022.db2.gz DVVVLXSUUHIUJN-UHFFFAOYSA-N -1 3 352.478 3.782 20 0 FHADHM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2ccc(N3CCOCC3)cc2)cc1 ZINC000007055415 944479488 /nfs/dbraw/zinc/47/94/88/944479488.db2.gz OXFRBLWUBJUTOD-MRXNPFEDSA-N -1 3 374.506 3.838 20 0 FHADHM COc1ccc(-c2csc(CNC(=O)c3ccc(O)cc3[O-])c2)cc1 ZINC000436623165 944479818 /nfs/dbraw/zinc/47/98/18/944479818.db2.gz GDGJRCMUPNISKB-UHFFFAOYSA-N -1 3 355.415 3.765 20 0 FHADHM Cc1ccc(C(=O)NCCC(=O)N([C@H](C)c2ccccc2)C2CC2)c([O-])c1 ZINC000436649153 944480827 /nfs/dbraw/zinc/48/08/27/944480827.db2.gz SXBQCIFCITUQFT-MRXNPFEDSA-N -1 3 366.461 3.573 20 0 FHADHM O=C(Nc1ccc2cccc(Br)c2n1)c1c([O-])cccc1O ZINC000436645343 944493829 /nfs/dbraw/zinc/49/38/29/944493829.db2.gz CASFXWRVLALYKC-UHFFFAOYSA-N -1 3 359.179 3.661 20 0 FHADHM [O-]c1ccc(CNc2ncccc2Br)cc1Br ZINC000436645399 944494019 /nfs/dbraw/zinc/49/40/19/944494019.db2.gz AONOKQDWASHABB-UHFFFAOYSA-N -1 3 358.033 3.924 20 0 FHADHM O=C(NC1CCN(Cc2ccc(F)cc2)CC1)c1cc(Cl)ccc1[O-] ZINC000436666195 944501663 /nfs/dbraw/zinc/50/16/63/944501663.db2.gz RLHDRSLPKSFWJB-UHFFFAOYSA-N -1 3 362.832 3.579 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N2C[C@H](C)CC[C@H]2c2ccccc2)c1 ZINC000436661646 944512346 /nfs/dbraw/zinc/51/23/46/944512346.db2.gz ZHVFMXITPFXPAC-KUHUBIRLSA-N -1 3 352.434 3.964 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N2C[C@@H](C)CC[C@@H]2c2ccccc2)c1 ZINC000436661644 944512633 /nfs/dbraw/zinc/51/26/33/944512633.db2.gz ZHVFMXITPFXPAC-IFXJQAMLSA-N -1 3 352.434 3.964 20 0 FHADHM CCC(=O)Nc1ccc(NC(=O)c2ccc3c(c2[O-])OC(C)(C)C3)cc1 ZINC000436678335 944516724 /nfs/dbraw/zinc/51/67/24/944516724.db2.gz BIPHKCLGPJIMLA-UHFFFAOYSA-N -1 3 354.406 3.707 20 0 FHADHM CC1(C)Cc2ccc(C(=O)Nc3nccn3Cc3ccccc3)c([O-])c2O1 ZINC000436683088 944521574 /nfs/dbraw/zinc/52/15/74/944521574.db2.gz SNFJTTHDIPTJON-UHFFFAOYSA-N -1 3 363.417 3.603 20 0 FHADHM O=C(c1ccccc1[O-])N1CCN(C/C=C/c2ccc(Cl)cc2)CC1 ZINC000436693834 944532869 /nfs/dbraw/zinc/53/28/69/944532869.db2.gz DMRHYQAMRXHMMO-ONEGZZNKSA-N -1 3 356.853 3.517 20 0 FHADHM CCc1ccc([C@H]2CCCN(C(=O)c3cc(NC(C)=O)ccc3[O-])C2)cc1 ZINC000436699872 944538975 /nfs/dbraw/zinc/53/89/75/944538975.db2.gz WLNHJVWGKPLMRG-SFHVURJKSA-N -1 3 366.461 3.933 20 0 FHADHM COc1cccc(C(=O)Nc2nnc(-c3cc(C)cc(C)c3)s2)c1[O-] ZINC000436710967 944550229 /nfs/dbraw/zinc/55/02/29/944550229.db2.gz BQPKDFKFQVMJPT-UHFFFAOYSA-N -1 3 355.419 3.788 20 0 FHADHM Cc1ccc(C(=O)N[C@@H](c2cncc(Br)c2)C2CC2)c([O-])c1 ZINC000436713329 944552991 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CN(C)C(=O)c1cccc(NC(=O)c2cc(Cc3ccccc3)ccc2[O-])c1 ZINC000436757820 944580692 /nfs/dbraw/zinc/58/06/92/944580692.db2.gz XLTOJQXIVWKQLD-UHFFFAOYSA-N -1 3 374.440 3.937 20 0 FHADHM COCCOc1cc(NC(=O)c2cc3c(cc2[O-])CCCC3)ccc1OC ZINC000436760673 944582986 /nfs/dbraw/zinc/58/29/86/944582986.db2.gz RKHYUGPJAGJBMY-UHFFFAOYSA-N -1 3 371.433 3.557 20 0 FHADHM O=S(=O)(Cc1ccc(Cl)cc1)c1nc(CCC2CCCC2)n[n-]1 ZINC000518672192 944583587 /nfs/dbraw/zinc/58/35/87/944583587.db2.gz YLXXRONFBKHSMJ-UHFFFAOYSA-N -1 3 353.875 3.555 20 0 FHADHM O=S(=O)(Cc1ccc(Cl)cc1)c1nnc(CCC2CCCC2)[n-]1 ZINC000518672192 944583592 /nfs/dbraw/zinc/58/35/92/944583592.db2.gz YLXXRONFBKHSMJ-UHFFFAOYSA-N -1 3 353.875 3.555 20 0 FHADHM COCCN(Cc1ccco1)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436761593 944583913 /nfs/dbraw/zinc/58/39/13/944583913.db2.gz LSUABFIWQVMFIK-UHFFFAOYSA-N -1 3 365.429 3.865 20 0 FHADHM C[C@H](NC(=O)c1cc(Oc2ccccc2)ccc1[O-])c1nnc2ccccn21 ZINC000436753136 944593353 /nfs/dbraw/zinc/59/33/53/944593353.db2.gz 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Cc1c(N[C@@H](C)C(C)C)cccc1C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000474707897 944633968 /nfs/dbraw/zinc/63/39/68/944633968.db2.gz PBRLAFLCWVJNDJ-AWEZNQCLSA-N -1 3 364.453 3.884 20 0 FHADHM Cc1c(N[C@@H](C)C(C)C)cccc1C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000474707897 944633979 /nfs/dbraw/zinc/63/39/79/944633979.db2.gz PBRLAFLCWVJNDJ-AWEZNQCLSA-N -1 3 364.453 3.884 20 0 FHADHM COCc1ccc([N-]S(=O)(=O)c2ccc(OC(F)(F)F)cc2)cc1 ZINC000194241544 944635399 /nfs/dbraw/zinc/63/53/99/944635399.db2.gz ZUQIWHZLRHSNGK-UHFFFAOYSA-N -1 3 361.341 3.532 20 0 FHADHM C[C@H]1C[C@@H]1N1CCN(C(=O)c2c([O-])cc(Cl)cc2Cl)C[C@@H](C)C1 ZINC000436790233 944637568 /nfs/dbraw/zinc/63/75/68/944637568.db2.gz GDYMLJLDVBDQMF-MJVIPROJSA-N -1 3 357.281 3.501 20 0 FHADHM CC[C@@H](NC(=O)c1cc(NC(C)=O)ccc1[O-])C(C)(C)c1ccccc1 ZINC000436791798 944642334 /nfs/dbraw/zinc/64/23/34/944642334.db2.gz UHQPLARPUDOWLQ-LJQANCHMSA-N -1 3 354.450 3.837 20 0 FHADHM CC1(C)CC[C@H]1NC(=O)C[C@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436793503 944645750 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FHADHM Cn1ncc(NC(=O)c2ccc3c(c2[O-])OC(C)(C)C3)c1-c1ccccc1 ZINC000436810953 944667238 /nfs/dbraw/zinc/66/72/38/944667238.db2.gz TXGRNSQXZCEVTJ-UHFFFAOYSA-N -1 3 363.417 3.759 20 0 FHADHM Cc1nnc(N(C)C(=O)c2cc(CCc3ccccc3)ccc2[O-])s1 ZINC000436814787 944671881 /nfs/dbraw/zinc/67/18/81/944671881.db2.gz LXBGXIDAFWYZBC-UHFFFAOYSA-N -1 3 353.447 3.614 20 0 FHADHM CCc1ccc(C(=O)N2CC[C@H](OCCCc3ccccc3)C2)c([O-])c1 ZINC000436833215 944678376 /nfs/dbraw/zinc/67/83/76/944678376.db2.gz UTQZXKQYTFGEMD-IBGZPJMESA-N -1 3 353.462 3.819 20 0 FHADHM CCSc1nccnc1-c1noc(-c2ccc3c(c2[O-])OC(C)(C)C3)n1 ZINC000519582548 944679690 /nfs/dbraw/zinc/67/96/90/944679690.db2.gz XRSYDYBFZIGOFZ-UHFFFAOYSA-N -1 3 370.434 3.725 20 0 FHADHM CCc1ccc(C(=O)N[C@H](C)c2nc(-c3cccc(F)c3)no2)c([O-])c1 ZINC000436835187 944682817 /nfs/dbraw/zinc/68/28/17/944682817.db2.gz UOUSWMSUWLHPEH-LLVKDONJSA-N -1 3 355.369 3.635 20 0 FHADHM CCc1ccc(C(=O)N(Cc2ccnc(OC(C)C)c2)C2CC2)c([O-])c1 ZINC000436835424 944685485 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945752072 /nfs/dbraw/zinc/75/20/72/945752072.db2.gz NSWCUQIOGXZTKD-XJKSGUPXSA-N -1 3 359.397 3.615 20 0 FHADHM COC(=O)c1ccc(CS[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)s1 ZINC000821669436 945790185 /nfs/dbraw/zinc/79/01/85/945790185.db2.gz LRBWIKBVAUANFZ-JTQLQIEISA-N -1 3 360.464 3.709 20 0 FHADHM COC(=O)c1ccc(CS[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)s1 ZINC000821669436 945790190 /nfs/dbraw/zinc/79/01/90/945790190.db2.gz LRBWIKBVAUANFZ-JTQLQIEISA-N -1 3 360.464 3.709 20 0 FHADHM CCn1ccnc1[C@@H]1CCCCN1C(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000281690007 945805716 /nfs/dbraw/zinc/80/57/16/945805716.db2.gz GIJXWAIYUQBEPF-KRWDZBQOSA-N -1 3 350.422 3.524 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@@H]3CCCO[C@H]3C(C)C)nc2)n1 ZINC000301518551 945825949 /nfs/dbraw/zinc/82/59/49/945825949.db2.gz HBBOXJLQQWJBJZ-LIRRHRJNSA-N -1 3 356.470 3.670 20 0 FHADHM COc1ccc([C@@H](C)CC(=O)Nc2sc(C)c(C)c2-c2nnn[n-]2)cc1 ZINC000821777686 945859301 /nfs/dbraw/zinc/85/93/01/945859301.db2.gz LFVRJQVBRIHFJC-JTQLQIEISA-N -1 3 371.466 3.686 20 0 FHADHM COc1ccc([C@@H](C)CC(=O)Nc2sc(C)c(C)c2-c2nn[n-]n2)cc1 ZINC000821777686 945859318 /nfs/dbraw/zinc/85/93/18/945859318.db2.gz LFVRJQVBRIHFJC-JTQLQIEISA-N -1 3 371.466 3.686 20 0 FHADHM O=S(=O)([N-]Cc1c(Cl)cccc1Cl)c1ccc(F)cc1F ZINC000519891636 945861912 /nfs/dbraw/zinc/86/19/12/945861912.db2.gz KREURMXUNXWOBC-UHFFFAOYSA-N -1 3 352.189 3.750 20 0 FHADHM Cc1c(Nc2[n-]c(=O)c(Cl)cc2Cl)c(=O)n(-c2ccccc2)n1C ZINC001167972917 945919391 /nfs/dbraw/zinc/91/93/91/945919391.db2.gz CZLIJJRZAJTVDG-UHFFFAOYSA-N -1 3 365.220 3.635 20 0 FHADHM C=CC(=O)Nc1ccc([O-])c(C(=O)N[C@@]2(c3ccccc3)CC2(C)C)c1 ZINC001167973038 945923319 /nfs/dbraw/zinc/92/33/19/945923319.db2.gz QJZUDBRRIXECGP-OAQYLSRUSA-N -1 3 350.418 3.572 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H](C)C[C@@H](O)c3ccccc3)nc2)n1 ZINC000301748222 945947538 /nfs/dbraw/zinc/94/75/38/945947538.db2.gz RTLAUCMFCJILME-RDTXWAMCSA-N -1 3 364.449 3.731 20 0 FHADHM Cc1ccc([C@@H](C)Oc2cccc([O-])c2I)cn1 ZINC001227381061 945948398 /nfs/dbraw/zinc/94/83/98/945948398.db2.gz NJEPBMSXDFBXTI-SNVBAGLBSA-N -1 3 355.175 3.840 20 0 FHADHM Cc1ccc([C@H](C)N(C)C(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000822229571 946012664 /nfs/dbraw/zinc/01/26/64/946012664.db2.gz XIUYWSINJUAPGZ-CABCVRRESA-N -1 3 364.453 3.639 20 0 FHADHM Cc1ccc([C@H](C)N(C)C(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000822229571 946012672 /nfs/dbraw/zinc/01/26/72/946012672.db2.gz XIUYWSINJUAPGZ-CABCVRRESA-N -1 3 364.453 3.639 20 0 FHADHM Clc1cccc2c1CCN(c1nc3ccccc3cc1-c1nnn[n-]1)C2 ZINC000822585669 946131547 /nfs/dbraw/zinc/13/15/47/946131547.db2.gz JZXUJUMKAVAVCT-UHFFFAOYSA-N -1 3 362.824 3.631 20 0 FHADHM Clc1cccc2c1CCN(c1nc3ccccc3cc1-c1nn[n-]n1)C2 ZINC000822585669 946131553 /nfs/dbraw/zinc/13/15/53/946131553.db2.gz JZXUJUMKAVAVCT-UHFFFAOYSA-N -1 3 362.824 3.631 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N3C[C@H](C)C[C@@H]3c3cccnc3)nc2)n1 ZINC000302145767 946143884 /nfs/dbraw/zinc/14/38/84/946143884.db2.gz RARWQZUKHUWCJL-RDTXWAMCSA-N -1 3 361.449 3.789 20 0 FHADHM Cc1ccccc1-c1cc(=NC(=O)c2cccc(Oc3cnccn3)c2)[nH][n-]1 ZINC000522980521 946184235 /nfs/dbraw/zinc/18/42/35/946184235.db2.gz LCYJZHGXLWUHAA-UHFFFAOYSA-N -1 3 371.400 3.642 20 0 FHADHM CC(C)[C@H](CC(=O)Nc1ccccc1[N-]S(C)(=O)=O)c1ccccc1 ZINC000103067152 946217526 /nfs/dbraw/zinc/21/75/26/946217526.db2.gz UEFLNXLWCLMRJX-INIZCTEOSA-N -1 3 360.479 3.827 20 0 FHADHM CC[C@H]1CCCC[C@@H]1[N-]S(=O)(=O)c1ccc(Br)s1 ZINC000042254304 946225789 /nfs/dbraw/zinc/22/57/89/946225789.db2.gz TXBVFWZPMMGDCP-UWVGGRQHSA-N -1 3 352.319 3.758 20 0 FHADHM CC[C@H]1CCCC[C@H]1[N-]S(=O)(=O)c1ccc(Br)s1 ZINC000042254312 946226475 /nfs/dbraw/zinc/22/64/75/946226475.db2.gz TXBVFWZPMMGDCP-VHSXEESVSA-N -1 3 352.319 3.758 20 0 FHADHM CC1(CNC(=O)C[C@@H](NC(=O)c2ccc([O-])cc2)c2ccccc2)CCC1 ZINC000184141516 946228699 /nfs/dbraw/zinc/22/86/99/946228699.db2.gz FGIVPYIGGLQGAH-LJQANCHMSA-N -1 3 366.461 3.560 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N3CC4(CCCC4)OC(C)(C)C3)nc2)n1 ZINC000302614789 946263672 /nfs/dbraw/zinc/26/36/72/946263672.db2.gz CFNJPJVMDBDGSZ-UHFFFAOYSA-N -1 3 368.481 3.735 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H]3CCOc4c(F)cccc43)nc2)n1 ZINC000302700954 946286070 /nfs/dbraw/zinc/28/60/70/946286070.db2.gz XIRVEEYHWQBDLB-INIZCTEOSA-N -1 3 366.396 3.881 20 0 FHADHM O=C(Nc1cc(Cl)c([O-])cc1F)C(C[C@H]1CCCO1)C(F)(F)F ZINC000652163807 946417536 /nfs/dbraw/zinc/41/75/36/946417536.db2.gz YOXWQIJBZCSGPE-HTQZYQBOSA-N -1 3 355.715 3.871 20 0 FHADHM CC(=O)c1ccc(-c2nnn[n-]2)c(NCCCO[C@H](C)c2ccccc2)c1 ZINC000824014055 946544013 /nfs/dbraw/zinc/54/40/13/946544013.db2.gz CEORTXYDNRZVMV-OAHLLOKOSA-N -1 3 365.437 3.649 20 0 FHADHM CC(=O)c1ccc(-c2nn[n-]n2)c(NCCCO[C@H](C)c2ccccc2)c1 ZINC000824014055 946544024 /nfs/dbraw/zinc/54/40/24/946544024.db2.gz CEORTXYDNRZVMV-OAHLLOKOSA-N -1 3 365.437 3.649 20 0 FHADHM C[C@H](C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1c(F)cccc1F ZINC000824046667 946566811 /nfs/dbraw/zinc/56/68/11/946566811.db2.gz UVNUEXWHCGYYHJ-QMMMGPOBSA-N -1 3 363.755 3.541 20 0 FHADHM C[C@H](C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1c(F)cccc1F ZINC000824046667 946566821 /nfs/dbraw/zinc/56/68/21/946566821.db2.gz UVNUEXWHCGYYHJ-QMMMGPOBSA-N -1 3 363.755 3.541 20 0 FHADHM O=C(N[C@H]1CCCN(Cc2cc([O-])cc(F)c2)C1)c1cc2ccccc2o1 ZINC000473144264 946618006 /nfs/dbraw/zinc/61/80/06/946618006.db2.gz ORXJYORGODWINI-KRWDZBQOSA-N -1 3 368.408 3.672 20 0 FHADHM CC(C)COC[C@H](N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccco1 ZINC000824266456 946638982 /nfs/dbraw/zinc/63/89/82/946638982.db2.gz LZXFMOQGEUNFCT-YOEHRIQHSA-N -1 3 355.442 3.524 20 0 FHADHM Cc1cc(S(=O)(=O)[N-][C@H]2CCCOc3ccccc32)sc1Cl ZINC000473916191 946651610 /nfs/dbraw/zinc/65/16/10/946651610.db2.gz ZXOHGXCBAIGKGI-LBPRGKRZSA-N -1 3 357.884 3.902 20 0 FHADHM CCc1ccc([C@@H]2CCCCN2C(=O)c2cc(NC(C)=O)ccc2[O-])o1 ZINC000122761345 946660821 /nfs/dbraw/zinc/66/08/21/946660821.db2.gz AOTVHKSSTSOTKL-KRWDZBQOSA-N -1 3 356.422 3.873 20 0 FHADHM C[C@@H](NC(=O)[C@H]1CC1(C)C)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824470740 946723515 /nfs/dbraw/zinc/72/35/15/946723515.db2.gz LPUAVADFLRANHR-FZKQIMNGSA-N -1 3 361.449 3.757 20 0 FHADHM C[C@@H](NC(=O)[C@H]1CC1(C)C)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824470740 946723520 /nfs/dbraw/zinc/72/35/20/946723520.db2.gz LPUAVADFLRANHR-FZKQIMNGSA-N -1 3 361.449 3.757 20 0 FHADHM C[C@@H](NC(=O)[C@@H]1CC12CCC2)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824471765 946724386 /nfs/dbraw/zinc/72/43/86/946724386.db2.gz SIBQEXFWIJUNFZ-KUHUBIRLSA-N -1 3 373.460 3.901 20 0 FHADHM C[C@@H](NC(=O)[C@@H]1CC12CCC2)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824471765 946724393 /nfs/dbraw/zinc/72/43/93/946724393.db2.gz SIBQEXFWIJUNFZ-KUHUBIRLSA-N -1 3 373.460 3.901 20 0 FHADHM C[C@H](NC(=O)CC1CCC1)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824480199 946733532 /nfs/dbraw/zinc/73/35/32/946733532.db2.gz UOWYDPBFRCJPOK-AWEZNQCLSA-N -1 3 361.449 3.901 20 0 FHADHM C[C@H](NC(=O)CC1CCC1)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824480199 946733538 /nfs/dbraw/zinc/73/35/38/946733538.db2.gz UOWYDPBFRCJPOK-AWEZNQCLSA-N -1 3 361.449 3.901 20 0 FHADHM C[C@@H]1CCN(Cc2nc(=O)c3c(-c4ccco4)csc3[n-]2)C[C@H](C)O1 ZINC000661853333 946764353 /nfs/dbraw/zinc/76/43/53/946764353.db2.gz CLUQGOFDALSMFH-NEPJUHHUSA-N -1 3 359.451 3.656 20 0 FHADHM C[C@H](N[C@@H](CCc1ccccc1)C(F)F)c1ccc(-c2nnn[n-]2)cc1 ZINC000824532499 946770701 /nfs/dbraw/zinc/77/07/01/946770701.db2.gz UWNFLVIOMAEBNJ-GUYCJALGSA-N -1 3 357.408 3.784 20 0 FHADHM C[C@H](N[C@@H](CCc1ccccc1)C(F)F)c1ccc(-c2nn[n-]n2)cc1 ZINC000824532499 946770712 /nfs/dbraw/zinc/77/07/12/946770712.db2.gz UWNFLVIOMAEBNJ-GUYCJALGSA-N -1 3 357.408 3.784 20 0 FHADHM C[C@@H](N[C@@H](c1nccs1)c1ccccc1)c1cccc(-c2nnn[n-]2)c1 ZINC000824537628 946774897 /nfs/dbraw/zinc/77/48/97/946774897.db2.gz FGRQKKHVVRAHKQ-CXAGYDPISA-N -1 3 362.462 3.763 20 0 FHADHM C[C@@H](N[C@@H](c1nccs1)c1ccccc1)c1cccc(-c2nn[n-]n2)c1 ZINC000824537628 946774901 /nfs/dbraw/zinc/77/49/01/946774901.db2.gz FGRQKKHVVRAHKQ-CXAGYDPISA-N -1 3 362.462 3.763 20 0 FHADHM C[C@@H](N[C@H](c1cccc(F)c1)c1ccccn1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824540083 946779466 /nfs/dbraw/zinc/77/94/66/946779466.db2.gz RKCHRFYCGKTBHV-JLTOFOAXSA-N -1 3 374.423 3.841 20 0 FHADHM O=C(Nc1ccc(Cl)cc1[O-])c1cccc(I)c1 ZINC000535420061 946845107 /nfs/dbraw/zinc/84/51/07/946845107.db2.gz LBYJXQOJMOZMOK-UHFFFAOYSA-N -1 3 373.577 3.903 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)N3CCc4ccc(F)cc43)cc2)cc(=O)[n-]1 ZINC000582254750 946855663 /nfs/dbraw/zinc/85/56/63/946855663.db2.gz REWBPUGDGVADSK-UHFFFAOYSA-N -1 3 364.380 3.891 20 0 FHADHM CCOc1ccc([N-]S(=O)(=O)c2ccc(Br)cc2)c(C)c1 ZINC000040446712 946858496 /nfs/dbraw/zinc/85/84/96/946858496.db2.gz VRSFSTNQBXGTQP-UHFFFAOYSA-N -1 3 370.268 3.957 20 0 FHADHM COC1CCC(CC[N-]S(=O)(=O)c2cc(C)c(Cl)s2)CC1 ZINC000473953289 946862417 /nfs/dbraw/zinc/86/24/17/946862417.db2.gz YVIVWFFKJQUJNG-UHFFFAOYSA-N -1 3 351.921 3.584 20 0 FHADHM COc1ccc(C(=O)N2C[C@@H](c3ccccc3Cl)OC[C@@H]2C)c([O-])c1 ZINC000110515932 946871319 /nfs/dbraw/zinc/87/13/19/946871319.db2.gz XSOBGTZHBRMNQU-SGTLLEGYSA-N -1 3 361.825 3.656 20 0 FHADHM C[C@@H](NCc1nccs1)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824633990 946879943 /nfs/dbraw/zinc/87/99/43/946879943.db2.gz SQRQTYSERTTZNX-CYBMUJFWSA-N -1 3 362.462 3.841 20 0 FHADHM C[C@@H]1CC[C@@H](NC(=O)C[C@@H](NC(=O)c2ccc([O-])cc2)c2ccccc2)C1 ZINC000444467579 946889718 /nfs/dbraw/zinc/88/97/18/946889718.db2.gz OCSVUADHWFLBCT-XFQXTVEOSA-N -1 3 366.461 3.558 20 0 FHADHM O=c1[n-]c(-c2cn(Cc3ccccc3)nn2)nc2cc(Cl)c(Cl)cc12 ZINC000487502006 946916882 /nfs/dbraw/zinc/91/68/82/946916882.db2.gz MVQGLPMVDGXWJU-UHFFFAOYSA-N -1 3 372.215 3.537 20 0 FHADHM CC(=O)c1ccc(OCc2cn3ccccc3c2-c2nnn[n-]2)cc1Cl ZINC001573556295 946927116 /nfs/dbraw/zinc/92/71/16/946927116.db2.gz OBTSPZZQDDAOED-UHFFFAOYSA-N -1 3 367.796 3.554 20 0 FHADHM CC(=O)c1ccc(OCc2cn3ccccc3c2-c2nn[n-]n2)cc1Cl ZINC001573556295 946927122 /nfs/dbraw/zinc/92/71/22/946927122.db2.gz OBTSPZZQDDAOED-UHFFFAOYSA-N -1 3 367.796 3.554 20 0 FHADHM C[C@@H](C1CCC1)N(C)C(=O)c1c[n-]c2c(OC(F)(F)F)cccc2c1=O ZINC000444340623 946943718 /nfs/dbraw/zinc/94/37/18/946943718.db2.gz JGMWXFFSLHOFTF-JTQLQIEISA-N -1 3 368.355 3.687 20 0 FHADHM C[C@@H](NC(=O)NCc1ccc([O-])c(Br)c1)C1CCC(F)CC1 ZINC000661959686 946963898 /nfs/dbraw/zinc/96/38/98/946963898.db2.gz FMCGFUCNMCUSJP-QFWMXSHPSA-N -1 3 373.266 3.871 20 0 FHADHM C[C@@H]1CC[C@H](C(=O)N(Cc2ccccc2)c2ccccc2-c2nnn[n-]2)C1 ZINC000824899418 946980502 /nfs/dbraw/zinc/98/05/02/946980502.db2.gz JNVYMHNQLMTVRR-WBVHZDCISA-N -1 3 361.449 3.836 20 0 FHADHM C[C@@H]1CC[C@H](C(=O)N(Cc2ccccc2)c2ccccc2-c2nn[n-]n2)C1 ZINC000824899418 946980504 /nfs/dbraw/zinc/98/05/04/946980504.db2.gz JNVYMHNQLMTVRR-WBVHZDCISA-N -1 3 361.449 3.836 20 0 FHADHM CCC(CC)c1nnc([N-]C(=O)c2ccc(C(=O)OC)cc2F)s1 ZINC000475607622 947003928 /nfs/dbraw/zinc/00/39/28/947003928.db2.gz LVODRMNFZWDBNH-UHFFFAOYSA-N -1 3 351.403 3.620 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)c3cc(C)sc3C)c2)n1 ZINC000049302295 947035812 /nfs/dbraw/zinc/03/58/12/947035812.db2.gz SHSSOBGYJMWUQC-UHFFFAOYSA-N -1 3 353.447 3.930 20 0 FHADHM O=C([O-])C1(C(=O)NC[C@H]2CCCCN2Cc2ccccc2)CCCCCC1 ZINC000663102161 947036470 /nfs/dbraw/zinc/03/64/70/947036470.db2.gz NOSCWWUQBOXMGU-LJQANCHMSA-N -1 3 372.509 3.583 20 0 FHADHM CC[C@@H](C)NC(=O)[C@H](Sc1cccc(Cl)c1-c1nnn[n-]1)C(C)C ZINC000825069264 947067414 /nfs/dbraw/zinc/06/74/14/947067414.db2.gz ZJQCLHKKPVPBEM-QMTHXVAHSA-N -1 3 367.906 3.552 20 0 FHADHM CC[C@@H](C)NC(=O)[C@H](Sc1cccc(Cl)c1-c1nn[n-]n1)C(C)C ZINC000825069264 947067424 /nfs/dbraw/zinc/06/74/24/947067424.db2.gz ZJQCLHKKPVPBEM-QMTHXVAHSA-N -1 3 367.906 3.552 20 0 FHADHM CCC(CC)n1nc(C(=O)Nc2ccc(Cl)c(-c3nnn[n-]3)c2)cc1C ZINC000825114476 947083088 /nfs/dbraw/zinc/08/30/88/947083088.db2.gz NCDKJTHPZNBLAJ-UHFFFAOYSA-N -1 3 373.848 3.638 20 0 FHADHM CCC(CC)n1nc(C(=O)Nc2ccc(Cl)c(-c3nn[n-]n3)c2)cc1C ZINC000825114476 947083101 /nfs/dbraw/zinc/08/31/01/947083101.db2.gz NCDKJTHPZNBLAJ-UHFFFAOYSA-N -1 3 373.848 3.638 20 0 FHADHM CCCCC[C@@H](CC)C(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000825268644 947140419 /nfs/dbraw/zinc/14/04/19/947140419.db2.gz XDXLMBUAXOWMKR-MRXNPFEDSA-N -1 3 355.486 3.964 20 0 FHADHM CCCCC[C@@H](CC)C(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000825268644 947140424 /nfs/dbraw/zinc/14/04/24/947140424.db2.gz XDXLMBUAXOWMKR-MRXNPFEDSA-N -1 3 355.486 3.964 20 0 FHADHM O=C([N-]c1nncs1)c1ccc(-c2ccccc2OC(F)(F)F)o1 ZINC000188469985 947144888 /nfs/dbraw/zinc/14/48/88/947144888.db2.gz YVGVLNQGHLCWLA-UHFFFAOYSA-N -1 3 355.297 3.949 20 0 FHADHM CCN(C(=O)Cc1ccc(C)c(C)c1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825376103 947168747 /nfs/dbraw/zinc/16/87/47/947168747.db2.gz CCBWHABFACSHIS-UHFFFAOYSA-N -1 3 369.856 3.733 20 0 FHADHM CCN(C(=O)Cc1ccc(C)c(C)c1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825376103 947168748 /nfs/dbraw/zinc/16/87/48/947168748.db2.gz CCBWHABFACSHIS-UHFFFAOYSA-N -1 3 369.856 3.733 20 0 FHADHM Cc1noc(C)c1S(=O)(=O)[N-]CC1(c2cccc(Cl)c2)CCCC1 ZINC000511959239 947170660 /nfs/dbraw/zinc/17/06/60/947170660.db2.gz YDGZYQLAAAMNKY-UHFFFAOYSA-N -1 3 368.886 3.735 20 0 FHADHM Cc1cc(C)c(CN(CCC(=O)[O-])C(C)C)c(OCc2ccccc2)n1 ZINC000652478513 947208414 /nfs/dbraw/zinc/20/84/14/947208414.db2.gz HVFJTYSANKPMPD-UHFFFAOYSA-N -1 3 356.466 3.963 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NCCc3c[nH]c4ccccc34)nc2)n1 ZINC000301184926 947221798 /nfs/dbraw/zinc/22/17/98/947221798.db2.gz RFPOHOHPKAZQAG-UHFFFAOYSA-N -1 3 359.433 3.943 20 0 FHADHM CC(=O)c1c(C)cc(C)c(CN2CCC([C@@H]3OCC[C@@H]3C(=O)[O-])CC2)c1C ZINC000652505524 947244102 /nfs/dbraw/zinc/24/41/02/947244102.db2.gz AJEJYIKMLQJFPZ-RXVVDRJESA-N -1 3 373.493 3.516 20 0 FHADHM CCOc1cc(CNc2cccc(-c3nnn[n-]3)c2)cc(Cl)c1OC ZINC000825615566 947258784 /nfs/dbraw/zinc/25/87/84/947258784.db2.gz AKTKHVFYMJINFI-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM CCOc1cc(CNc2cccc(-c3nn[n-]n3)c2)cc(Cl)c1OC ZINC000825615566 947258792 /nfs/dbraw/zinc/25/87/92/947258792.db2.gz AKTKHVFYMJINFI-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM CC(C)(CNC(=O)NCc1ccc([O-])c(F)c1)c1ccccc1Cl ZINC000523463488 947285872 /nfs/dbraw/zinc/28/58/72/947285872.db2.gz PQPQEERXPAEHEO-UHFFFAOYSA-N -1 3 350.821 3.962 20 0 FHADHM CCOC(=O)c1ccc(NC(=O)[C@H]2C[C@H]2c2cc(F)ccc2F)c([O-])c1 ZINC000536336931 947533117 /nfs/dbraw/zinc/53/31/17/947533117.db2.gz QUWSRGCEMGLYFA-JSGCOSHPSA-N -1 3 361.344 3.589 20 0 FHADHM C[C@H]1CC[C@@H](C(=O)[O-])CN1Cc1oc2ccccc2c1Br ZINC000662210907 947534501 /nfs/dbraw/zinc/53/45/01/947534501.db2.gz AYWUXQVIOSVULM-WDEREUQCSA-N -1 3 352.228 3.880 20 0 FHADHM C[C@H](C(=O)N(c1cccc(-c2nnn[n-]2)c1)C1CCC1)c1ccccc1F ZINC001573607522 947550033 /nfs/dbraw/zinc/55/00/33/947550033.db2.gz OHXBZUJLLCCZTA-ZDUSSCGKSA-N -1 3 365.412 3.695 20 0 FHADHM C[C@H](C(=O)N(c1cccc(-c2nn[n-]n2)c1)C1CCC1)c1ccccc1F ZINC001573607522 947550043 /nfs/dbraw/zinc/55/00/43/947550043.db2.gz OHXBZUJLLCCZTA-ZDUSSCGKSA-N -1 3 365.412 3.695 20 0 FHADHM Cc1ccc(CNC[C@H](CCC(=O)[O-])C(F)(F)F)c(Br)c1 ZINC000663260549 947581522 /nfs/dbraw/zinc/58/15/22/947581522.db2.gz AQYJKJYVJNANFY-NSHDSACASA-N -1 3 368.193 3.890 20 0 FHADHM COCc1cccc(CN[C@H](C(=O)[O-])c2cccc(C(F)(F)F)c2)c1 ZINC000663260901 947589512 /nfs/dbraw/zinc/58/95/12/947589512.db2.gz DXJFEEZDJNTNHR-INIZCTEOSA-N -1 3 353.340 3.767 20 0 FHADHM Nc1c(Cl)c(Cl)nc(C(=O)[N-]N=Cc2ccccc2F)c1Cl ZINC000254696963 947591420 /nfs/dbraw/zinc/59/14/20/947591420.db2.gz GUJCPLNIILDZQS-UHFFFAOYSA-N -1 3 361.591 3.527 20 0 FHADHM O=C([O-])CC[C@H](CNCc1ccccc1OC(F)(F)F)C(F)(F)F ZINC000663262579 947594255 /nfs/dbraw/zinc/59/42/55/947594255.db2.gz ULINRVASTMQBFZ-SNVBAGLBSA-N -1 3 359.266 3.718 20 0 FHADHM CSc1ccc(C)c(NC(=O)N(C)Cc2cccc(-c3nnn[n-]3)c2)c1 ZINC000826230555 947675058 /nfs/dbraw/zinc/67/50/58/947675058.db2.gz YTCHIABOUGAMTK-UHFFFAOYSA-N -1 3 368.466 3.561 20 0 FHADHM CSc1ccc(C)c(NC(=O)N(C)Cc2cccc(-c3nn[n-]n3)c2)c1 ZINC000826230555 947675069 /nfs/dbraw/zinc/67/50/69/947675069.db2.gz YTCHIABOUGAMTK-UHFFFAOYSA-N -1 3 368.466 3.561 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCC2)c1ccccc1 ZINC000826231826 947677612 /nfs/dbraw/zinc/67/76/12/947677612.db2.gz CTNOYDYHJRTKIV-LLVKDONJSA-N -1 3 353.451 3.549 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCC2)c1ccccc1 ZINC000826231826 947677616 /nfs/dbraw/zinc/67/76/16/947677616.db2.gz CTNOYDYHJRTKIV-LLVKDONJSA-N -1 3 353.451 3.549 20 0 FHADHM CN(CC1=CCSC1)Cc1nc(=O)c2c(-c3ccco3)csc2[n-]1 ZINC000662268197 947688843 /nfs/dbraw/zinc/68/88/43/947688843.db2.gz RZJRTBDIMQRDEG-UHFFFAOYSA-N -1 3 359.476 3.762 20 0 FHADHM CC(=CC(=O)Nc1cc(-c2nnn[n-]2)ccc1C)c1cccc(Cl)c1 ZINC001573362074 947700947 /nfs/dbraw/zinc/70/09/47/947700947.db2.gz INYKTDNTOGNSAU-WQLSENKSSA-N -1 3 353.813 3.871 20 0 FHADHM CC(=CC(=O)Nc1cc(-c2nn[n-]n2)ccc1C)c1cccc(Cl)c1 ZINC001573362074 947700953 /nfs/dbraw/zinc/70/09/53/947700953.db2.gz INYKTDNTOGNSAU-WQLSENKSSA-N -1 3 353.813 3.871 20 0 FHADHM Cc1c(Cl)cnc(N[C@@H]2CCCOc3ccc(F)cc32)c1-c1nnn[n-]1 ZINC000826238781 947703568 /nfs/dbraw/zinc/70/35/68/947703568.db2.gz PHRFENJWKOIHSE-CYBMUJFWSA-N -1 3 374.807 3.688 20 0 FHADHM Cc1c(Cl)cnc(N[C@@H]2CCCOc3ccc(F)cc32)c1-c1nn[n-]n1 ZINC000826238781 947703574 /nfs/dbraw/zinc/70/35/74/947703574.db2.gz PHRFENJWKOIHSE-CYBMUJFWSA-N -1 3 374.807 3.688 20 0 FHADHM O=C1NCCN1c1cccc(-c2noc(-c3cc4ccccc4cc3[O-])n2)c1 ZINC000445299695 947706116 /nfs/dbraw/zinc/70/61/16/947706116.db2.gz MUFWWZMXYTVNRR-UHFFFAOYSA-N -1 3 372.384 3.792 20 0 FHADHM Cc1c(N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cnn1-c1ccccc1F ZINC000826242401 947719553 /nfs/dbraw/zinc/71/95/53/947719553.db2.gz NDIUERQQGKBEEH-LBPRGKRZSA-N -1 3 363.400 3.673 20 0 FHADHM Cc1c(N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cnn1-c1ccccc1F ZINC000826242401 947719568 /nfs/dbraw/zinc/71/95/68/947719568.db2.gz NDIUERQQGKBEEH-LBPRGKRZSA-N -1 3 363.400 3.673 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)N(C)c1ccc(-c2nnn[n-]2)cc1 ZINC001573364706 947724086 /nfs/dbraw/zinc/72/40/86/947724086.db2.gz IXFMYAXIIIZKCL-ZRDIBKRKSA-N -1 3 353.813 3.586 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)N(C)c1ccc(-c2nn[n-]n2)cc1 ZINC001573364706 947724089 /nfs/dbraw/zinc/72/40/89/947724089.db2.gz IXFMYAXIIIZKCL-ZRDIBKRKSA-N -1 3 353.813 3.586 20 0 FHADHM CC(=CC(=O)N1CCc2ccc(-c3nnn[n-]3)cc21)c1ccccc1Cl ZINC001573365628 947731269 /nfs/dbraw/zinc/73/12/69/947731269.db2.gz TYVLKXNRFKIBDI-ZRDIBKRKSA-N -1 3 365.824 3.513 20 0 FHADHM CC(=CC(=O)N1CCc2ccc(-c3nn[n-]n3)cc21)c1ccccc1Cl ZINC001573365628 947731280 /nfs/dbraw/zinc/73/12/80/947731280.db2.gz TYVLKXNRFKIBDI-ZRDIBKRKSA-N -1 3 365.824 3.513 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC001573366824 947748254 /nfs/dbraw/zinc/74/82/54/947748254.db2.gz TWXBAGKORDEZNK-NTMALXAHSA-N -1 3 357.776 3.701 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC001573366824 947748259 /nfs/dbraw/zinc/74/82/59/947748259.db2.gz TWXBAGKORDEZNK-NTMALXAHSA-N -1 3 357.776 3.701 20 0 FHADHM CCSc1ccc([C@@H](C)N/C=C2/C(=O)[N-]C(=O)c3ccccc32)cc1 ZINC000728853999 947778684 /nfs/dbraw/zinc/77/86/84/947778684.db2.gz FFJZQGIBWOKDBD-RNEAKCBISA-N -1 3 352.459 3.760 20 0 FHADHM Cc1ccc(C(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c(Cl)c1C ZINC000826281689 947808351 /nfs/dbraw/zinc/80/83/51/947808351.db2.gz FZTWYTKWNMFHTN-LBPRGKRZSA-N -1 3 355.829 3.628 20 0 FHADHM Cc1ccc(C(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c(Cl)c1C ZINC000826281689 947808359 /nfs/dbraw/zinc/80/83/59/947808359.db2.gz FZTWYTKWNMFHTN-LBPRGKRZSA-N -1 3 355.829 3.628 20 0 FHADHM Cc1ccc(Cl)cc1NC(=O)C[C@H](C)Nc1cccc(-c2nnn[n-]2)c1 ZINC000826289283 947841620 /nfs/dbraw/zinc/84/16/20/947841620.db2.gz TZFQJJHLXBAXEK-LBPRGKRZSA-N -1 3 370.844 3.658 20 0 FHADHM Cc1ccc(Cl)cc1NC(=O)C[C@H](C)Nc1cccc(-c2nn[n-]n2)c1 ZINC000826289283 947841632 /nfs/dbraw/zinc/84/16/32/947841632.db2.gz TZFQJJHLXBAXEK-LBPRGKRZSA-N -1 3 370.844 3.658 20 0 FHADHM Cc1cccc2c(=O)[nH]c(C(Cl)=Cc3ccccc3-c3nnn[n-]3)nc12 ZINC000826304797 947873919 /nfs/dbraw/zinc/87/39/19/947873919.db2.gz YMYOOHMQZYKZJY-ZROIWOOFSA-N -1 3 364.796 3.561 20 0 FHADHM Cc1cccc2c(=O)[nH]c(C(Cl)=Cc3ccccc3-c3nn[n-]n3)nc12 ZINC000826304797 947873925 /nfs/dbraw/zinc/87/39/25/947873925.db2.gz YMYOOHMQZYKZJY-ZROIWOOFSA-N -1 3 364.796 3.561 20 0 FHADHM Cc1ccnc(N[C@@H](C)c2ccc(OCC3CC3)c(F)c2)c1-c1nnn[n-]1 ZINC000826311753 947901763 /nfs/dbraw/zinc/90/17/63/947901763.db2.gz MPMPXPRQRINPFF-LBPRGKRZSA-N -1 3 368.416 3.671 20 0 FHADHM Cc1ccnc(N[C@@H](C)c2ccc(OCC3CC3)c(F)c2)c1-c1nn[n-]n1 ZINC000826311753 947901768 /nfs/dbraw/zinc/90/17/68/947901768.db2.gz MPMPXPRQRINPFF-LBPRGKRZSA-N -1 3 368.416 3.671 20 0 FHADHM Cc1ccnc(N[C@@H]2CCCOc3cc(Cl)ccc32)c1-c1nnn[n-]1 ZINC000826313106 947910307 /nfs/dbraw/zinc/91/03/07/947910307.db2.gz WIRSPWBRCUTULI-CYBMUJFWSA-N -1 3 356.817 3.549 20 0 FHADHM Cc1ccnc(N[C@@H]2CCCOc3cc(Cl)ccc32)c1-c1nn[n-]n1 ZINC000826313106 947910312 /nfs/dbraw/zinc/91/03/12/947910312.db2.gz WIRSPWBRCUTULI-CYBMUJFWSA-N -1 3 356.817 3.549 20 0 FHADHM Cc1ccoc1C(=O)N[C@H](C)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000826315610 947920832 /nfs/dbraw/zinc/92/08/32/947920832.db2.gz NPZXVIQKZPPWJS-CQSZACIVSA-N -1 3 373.416 3.926 20 0 FHADHM Cc1ccoc1C(=O)N[C@H](C)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000826315610 947920840 /nfs/dbraw/zinc/92/08/40/947920840.db2.gz NPZXVIQKZPPWJS-CQSZACIVSA-N -1 3 373.416 3.926 20 0 FHADHM C[C@@H](C(=O)NC(C)(C)Cc1ccc(-c2nnn[n-]2)cc1)[C@H](C)C(C)(C)C ZINC001573652493 947940052 /nfs/dbraw/zinc/94/00/52/947940052.db2.gz CUUJADNLBBAFNQ-KGLIPLIRSA-N -1 3 357.502 3.622 20 0 FHADHM C[C@@H](C(=O)NC(C)(C)Cc1ccc(-c2nn[n-]n2)cc1)[C@H](C)C(C)(C)C ZINC001573652493 947940058 /nfs/dbraw/zinc/94/00/58/947940058.db2.gz CUUJADNLBBAFNQ-KGLIPLIRSA-N -1 3 357.502 3.622 20 0 FHADHM Cc1occc1C(=O)N[C@@H](C)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000826342321 947984782 /nfs/dbraw/zinc/98/47/82/947984782.db2.gz GFUDDIALSGCFAX-ZDUSSCGKSA-N -1 3 373.416 3.926 20 0 FHADHM Cc1occc1C(=O)N[C@@H](C)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000826342321 947984789 /nfs/dbraw/zinc/98/47/89/947984789.db2.gz GFUDDIALSGCFAX-ZDUSSCGKSA-N -1 3 373.416 3.926 20 0 FHADHM CN(C(=O)Nc1ccc2c(c1)C(=O)[N-]C2=O)C1CCC(C(C)(C)C)CC1 ZINC000520489478 948056132 /nfs/dbraw/zinc/05/61/32/948056132.db2.gz NRKXQXXNFOTXOO-UHFFFAOYSA-N -1 3 357.454 3.639 20 0 FHADHM O=C(Nc1nc(-c2cccc(F)c2)cs1)c1cc2c(cc1[O-])OCO2 ZINC000436667075 948092684 /nfs/dbraw/zinc/09/26/84/948092684.db2.gz WMQSXWTTYSUGFM-UHFFFAOYSA-N -1 3 358.350 3.636 20 0 FHADHM Cc1sc(NC(=O)CCc2ccc3[nH]ccc3c2)c(-c2nnn[n-]2)c1C ZINC000826349370 948093409 /nfs/dbraw/zinc/09/34/09/948093409.db2.gz FWHHEEHNXHZFHZ-UHFFFAOYSA-N -1 3 366.450 3.598 20 0 FHADHM Cc1sc(NC(=O)CCc2ccc3[nH]ccc3c2)c(-c2nn[n-]n2)c1C ZINC000826349370 948093416 /nfs/dbraw/zinc/09/34/16/948093416.db2.gz FWHHEEHNXHZFHZ-UHFFFAOYSA-N -1 3 366.450 3.598 20 0 FHADHM Clc1cccc(SCc2ccc3c(c2)OCCO3)c1-c1nnn[n-]1 ZINC000826353249 948104531 /nfs/dbraw/zinc/10/45/31/948104531.db2.gz HRZONCDRDSPZOT-UHFFFAOYSA-N -1 3 360.826 3.584 20 0 FHADHM Clc1cccc(SCc2ccc3c(c2)OCCO3)c1-c1nn[n-]n1 ZINC000826353249 948104537 /nfs/dbraw/zinc/10/45/37/948104537.db2.gz HRZONCDRDSPZOT-UHFFFAOYSA-N -1 3 360.826 3.584 20 0 FHADHM FC1(F)CCC(Nc2ccc(Br)cc2-c2nnn[n-]2)CC1 ZINC000826370438 948154467 /nfs/dbraw/zinc/15/44/67/948154467.db2.gz SLHLNBXPSISCTM-UHFFFAOYSA-N -1 3 358.190 3.619 20 0 FHADHM FC1(F)CCC(Nc2ccc(Br)cc2-c2nn[n-]n2)CC1 ZINC000826370438 948154469 /nfs/dbraw/zinc/15/44/69/948154469.db2.gz SLHLNBXPSISCTM-UHFFFAOYSA-N -1 3 358.190 3.619 20 0 FHADHM CCCc1csc(CNC[C@H](Cc2ccccc2Cl)C(=O)[O-])n1 ZINC000417549585 948178320 /nfs/dbraw/zinc/17/83/20/948178320.db2.gz TZPWFASFYVVCPX-ZDUSSCGKSA-N -1 3 352.887 3.782 20 0 FHADHM CSCc1cnc(CNC[C@@H](Cc2cccc(Cl)c2)C(=O)[O-])s1 ZINC000417550444 948205591 /nfs/dbraw/zinc/20/55/91/948205591.db2.gz VNGOTKVNSLJUAG-GFCCVEGCSA-N -1 3 370.927 3.693 20 0 FHADHM Cc1cnn(C)c1CN[C@@H](CCC(=O)[O-])c1ccc(Cl)c(Cl)c1 ZINC000417565640 948261466 /nfs/dbraw/zinc/26/14/66/948261466.db2.gz HCBQDJOKISPBQR-AWEZNQCLSA-N -1 3 356.253 3.731 20 0 FHADHM COc1cccc([C@@H](CC(=O)[O-])NCc2ccc3nc(C)sc3c2)c1 ZINC000417590628 948300687 /nfs/dbraw/zinc/30/06/87/948300687.db2.gz XHDDSMXFSFXHOZ-QGZVFWFLSA-N -1 3 356.447 3.919 20 0 FHADHM O=C(Nc1csc2ccccc12)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000826454497 948325752 /nfs/dbraw/zinc/32/57/52/948325752.db2.gz YWNIMHYFPXZHFK-UHFFFAOYSA-N -1 3 354.370 3.865 20 0 FHADHM O=C(Nc1csc2ccccc12)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000826454497 948325762 /nfs/dbraw/zinc/32/57/62/948325762.db2.gz YWNIMHYFPXZHFK-UHFFFAOYSA-N -1 3 354.370 3.865 20 0 FHADHM O=C([O-])C[C@@H](CNCc1ccc(Br)cc1Cl)C(F)(F)F ZINC000417635200 948381911 /nfs/dbraw/zinc/38/19/11/948381911.db2.gz WCBMIFSNIUBEFS-QMMMGPOBSA-N -1 3 374.584 3.845 20 0 FHADHM Cc1ccc([N-]S(=O)(=O)c2cccc3c2OC(C)(C)C3)c(CN(C)C)c1 ZINC000192618922 948423949 /nfs/dbraw/zinc/42/39/49/948423949.db2.gz QADJMVFUCOJGOO-UHFFFAOYSA-N -1 3 374.506 3.571 20 0 FHADHM c1cc(-c2nnn[n-]2)c(NCc2ccc(OC3CCCCC3)cc2)cn1 ZINC000826512734 948435914 /nfs/dbraw/zinc/43/59/14/948435914.db2.gz LXGQXLGACOLMRW-UHFFFAOYSA-N -1 3 350.426 3.585 20 0 FHADHM c1cc(-c2nn[n-]n2)c(NCc2ccc(OC3CCCCC3)cc2)cn1 ZINC000826512734 948435920 /nfs/dbraw/zinc/43/59/20/948435920.db2.gz LXGQXLGACOLMRW-UHFFFAOYSA-N -1 3 350.426 3.585 20 0 FHADHM O=C(C[C@@H]1C=CCCC1)Nc1cc(I)ccc1[O-] ZINC000614635216 948484708 /nfs/dbraw/zinc/48/47/08/948484708.db2.gz SXGDMZOECZKOCL-SNVBAGLBSA-N -1 3 357.191 3.682 20 0 FHADHM Cc1cccc(Oc2ccc(C(=O)Nc3ccccc3-c3nnn[n-]3)nc2)c1 ZINC001301884800 948502409 /nfs/dbraw/zinc/50/24/09/948502409.db2.gz LCJUZLMSNXTRJS-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1cccc(Oc2ccc(C(=O)Nc3ccccc3-c3nn[n-]n3)nc2)c1 ZINC001301884800 948502417 /nfs/dbraw/zinc/50/24/17/948502417.db2.gz LCJUZLMSNXTRJS-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM CN(C)[C@@H]1CCOc2c([N-]S(=O)(=O)c3ccc(Cl)cc3)cccc21 ZINC000432488343 948566238 /nfs/dbraw/zinc/56/62/38/948566238.db2.gz DPRKPNUYYRFFIA-MRXNPFEDSA-N -1 3 366.870 3.526 20 0 FHADHM C[C@H](c1ccc(OC(F)(F)F)cc1)N1CC[C@@](C(=O)[O-])(C(F)(F)F)C1 ZINC000327135831 948572200 /nfs/dbraw/zinc/57/22/00/948572200.db2.gz UHMFINCIFRPDAH-NOZJJQNGSA-N -1 3 371.277 3.985 20 0 FHADHM CCOC(=O)c1nc([C@H](CC(C)C)NCc2cscc2Cl)n[n-]1 ZINC000895103721 948573822 /nfs/dbraw/zinc/57/38/22/948573822.db2.gz BLIHMCCKJDYRLB-LBPRGKRZSA-N -1 3 356.879 3.573 20 0 FHADHM CCOC(=O)c1nnc([C@H](CC(C)C)NCc2cscc2Cl)[n-]1 ZINC000895103721 948573828 /nfs/dbraw/zinc/57/38/28/948573828.db2.gz BLIHMCCKJDYRLB-LBPRGKRZSA-N -1 3 356.879 3.573 20 0 FHADHM CCOC(=O)c1n[n-]c([C@H](CC(C)C)NCc2cscc2Cl)n1 ZINC000895103721 948573833 /nfs/dbraw/zinc/57/38/33/948573833.db2.gz BLIHMCCKJDYRLB-LBPRGKRZSA-N -1 3 356.879 3.573 20 0 FHADHM CC(C)OC(=O)Cc1nc(=O)c2c(-c3ccc(Cl)cc3)csc2[n-]1 ZINC000046438700 948617348 /nfs/dbraw/zinc/61/73/48/948617348.db2.gz RLNZDQHBEVEIPK-UHFFFAOYSA-N -1 3 362.838 3.799 20 0 FHADHM COC(=O)c1cc([O-])c(F)cc1NC(=O)CCCCC(=O)c1ccccc1 ZINC001143529594 948639451 /nfs/dbraw/zinc/63/94/51/948639451.db2.gz JABFOCHTFDYISQ-UHFFFAOYSA-N -1 3 373.380 3.700 20 0 FHADHM CC(=O)c1ccc(NC(=O)NCc2ccc([O-])c(Br)c2)cc1 ZINC000153777913 948677663 /nfs/dbraw/zinc/67/76/63/948677663.db2.gz UXDGTTMEJXCPJZ-UHFFFAOYSA-N -1 3 363.211 3.679 20 0 FHADHM CC(=O)c1ccc(C(=O)N(Cc2ccc(F)cc2)C2CCOCC2)cc1[O-] ZINC000613976109 948812650 /nfs/dbraw/zinc/81/26/50/948812650.db2.gz HSYQSQMXTRNUHE-UHFFFAOYSA-N -1 3 371.408 3.555 20 0 FHADHM O=S(=O)([N-][C@@H](c1ccccc1)c1ccccn1)c1ccc(Cl)s1 ZINC000069093623 221321220 /nfs/dbraw/zinc/32/12/20/221321220.db2.gz KKWJJSLSRPXXJC-INIZCTEOSA-N -1 3 364.879 3.864 20 0 FHADHM C[C@@H]1CCC[C@@H]1[N-]S(=O)(=O)c1ccc(Br)cc1Cl ZINC000071211053 221337380 /nfs/dbraw/zinc/33/73/80/221337380.db2.gz JVAKGTOUUKFGEG-KCJUWKMLSA-N -1 3 352.681 3.569 20 0 FHADHM CC(C)Cc1n[n-]c(=NC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)s1 ZINC000508899323 514945730 /nfs/dbraw/zinc/94/57/30/514945730.db2.gz OIXDRNRZQWXGQU-BBRMVZONSA-N -1 3 361.515 3.550 20 0 FHADHM CC(C)Oc1ccc(=NC(=O)c2ccc(CN3CCCCC3)cc2)[n-]n1 ZINC000485709832 515155051 /nfs/dbraw/zinc/15/50/51/515155051.db2.gz FVBGNVUQOJLLAL-UHFFFAOYSA-N -1 3 354.454 3.502 20 0 FHADHM C[C@@H](CSc1ccc(F)cc1)C(=O)N=c1cc(OC(F)F)n(C)[n-]1 ZINC000490944413 515339498 /nfs/dbraw/zinc/33/94/98/515339498.db2.gz VOHCQHVZTHRKKG-VIFPVBQESA-N -1 3 359.373 3.528 20 0 FHADHM CCN=c1[n-]c(C(=O)NCc2cc(Cl)c(OCC)c(OC)c2)cs1 ZINC000478250274 515753370 /nfs/dbraw/zinc/75/33/70/515753370.db2.gz CAHNHCHCZOOTOA-UHFFFAOYSA-N -1 3 369.874 3.566 20 0 FHADHM CCN=c1[n-]c(C(=O)N2CCC(Oc3ccc(F)cc3F)CC2)cs1 ZINC000495186194 516094148 /nfs/dbraw/zinc/09/41/48/516094148.db2.gz BGYNOQLEZQQWDR-UHFFFAOYSA-N -1 3 367.421 3.537 20 0 FHADHM Cc1c(C(=O)N=c2cc(-c3ccncc3)[n-][nH]2)cnn1-c1cccc(C)c1 ZINC000512302616 516231502 /nfs/dbraw/zinc/23/15/02/516231502.db2.gz NXFHBKWWVOSYJB-UHFFFAOYSA-N -1 3 358.405 3.527 20 0 FHADHM CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)N=c1cc(-c2ccccc2)[n-][nH]1 ZINC000497564121 516326689 /nfs/dbraw/zinc/32/66/89/516326689.db2.gz POTLISDSHKJIIM-FQEVSTJZSA-N -1 3 374.444 3.551 20 0 FHADHM COc1ccc(Cl)cc1-c1cc(=NC(=O)Cc2c(C)noc2C)[nH][n-]1 ZINC000512848251 516385084 /nfs/dbraw/zinc/38/50/84/516385084.db2.gz BWZZTCCVWZLLCA-UHFFFAOYSA-N -1 3 360.801 3.525 20 0 FHADHM CCN(Cc1ccc(C(=O)N=c2[n-]ncn2-c2ccccc2)cc1)C1CC1 ZINC000537310401 517137360 /nfs/dbraw/zinc/13/73/60/517137360.db2.gz GLPQYVIPRSAUAX-UHFFFAOYSA-N -1 3 361.449 3.504 20 0 FHADHM O=C(N=c1cc([C@@H]2CCCO2)[n-][nH]1)c1ccccc1OCc1cscn1 ZINC000527209149 517561888 /nfs/dbraw/zinc/56/18/88/517561888.db2.gz BYDSXXSWXDIHRC-INIZCTEOSA-N -1 3 370.434 3.549 20 0 FHADHM Cc1[n-][nH]c(=NC(=O)c2cnc(OCC3CC3)cn2)c1-c1ccc(C)cc1 ZINC000530272008 517671591 /nfs/dbraw/zinc/67/15/91/517671591.db2.gz IQLQMHSIYHVTST-UHFFFAOYSA-N -1 3 363.421 3.525 20 0 FHADHM Cc1[n-][nH]c(=NC(=O)c2cnn3c2C[C@@H](C)CC3)c1-c1ccc(F)cc1 ZINC000530277472 517674359 /nfs/dbraw/zinc/67/43/59/517674359.db2.gz SRBWBPFVUGYPHA-NSHDSACASA-N -1 3 353.401 3.555 20 0 FHADHM CC[C@@H](c1n[n-]c(=NC(=O)NCCN(CC)CC)s1)c1ccccc1 ZINC000521855706 517874119 /nfs/dbraw/zinc/87/41/19/517874119.db2.gz WXYOXEOIOPMLEP-OAHLLOKOSA-N -1 3 361.515 3.543 20 0 FHADHM Cc1cnn(CC(=O)N=c2cc(-c3cc(Cl)cc(Cl)c3)[n-][nH]2)c1 ZINC000530798529 517981766 /nfs/dbraw/zinc/98/17/66/517981766.db2.gz KIYTYMUOFCXMDY-UHFFFAOYSA-N -1 3 350.209 3.527 20 0 FHADHM COc1ccc([C@@H]2CCN(C(=O)N=c3cc4ccccn4[n-]3)C2)cc1F ZINC000626562235 522286824 /nfs/dbraw/zinc/28/68/24/522286824.db2.gz SNUQVHXZIDIIBO-CQSZACIVSA-N -1 3 354.385 3.503 20 0 FHADHM COCc1nc(C)c(C(=O)N=c2[nH][n-]c(C)c2-c2cccc(OC)c2)s1 ZINC000629693920 522396575 /nfs/dbraw/zinc/39/65/75/522396575.db2.gz OTAYWAWVKZVYPJ-UHFFFAOYSA-N -1 3 372.450 3.557 20 0 FHADHM Cc1coc2ccc(NC(=O)[C@@H]3CCCN3C(=O)c3ccccc3[O-])cc12 ZINC000185779999 567863374 /nfs/dbraw/zinc/86/33/74/567863374.db2.gz FQLAYDNWHGFDFD-KRWDZBQOSA-N -1 3 364.401 3.690 20 0 FHADHM CN(C(=O)Cc1nc(=O)c2c3ccccc3sc2[n-]1)C1CCCCC1 ZINC000602331983 567969287 /nfs/dbraw/zinc/96/92/87/567969287.db2.gz BBEMTWIEDMFILM-UHFFFAOYSA-N -1 3 355.463 3.884 20 0 FHADHM CCOC(=O)c1ccc(Cl)c(OC)c1[N-]C(=O)c1ocnc1C(F)F ZINC000602360930 567972520 /nfs/dbraw/zinc/97/25/20/567972520.db2.gz YDVGKALNHRBKAI-UHFFFAOYSA-N -1 3 374.727 3.703 20 0 FHADHM CC[C@H](NC(=O)c1cc(=O)c2cc(Br)ccc2[n-]1)C(C)(C)C ZINC000602768087 568027414 /nfs/dbraw/zinc/02/74/14/568027414.db2.gz UALFVGSKZUYHCY-HNNXBMFYSA-N -1 3 365.271 3.845 20 0 FHADHM Cc1cccnc1NC(=O)c1n[n-]c(-c2ccccc2)c1Br ZINC000065107708 568042726 /nfs/dbraw/zinc/04/27/26/568042726.db2.gz QCQBJPGWHKTQRY-UHFFFAOYSA-N -1 3 357.211 3.795 20 0 FHADHM Cc1cccnc1NC(=O)c1[n-]nc(-c2ccccc2)c1Br ZINC000065107708 568042727 /nfs/dbraw/zinc/04/27/27/568042727.db2.gz QCQBJPGWHKTQRY-UHFFFAOYSA-N -1 3 357.211 3.795 20 0 FHADHM O=C(c1cc([O-])cc(Br)c1)N1CCC(c2ccccn2)CC1 ZINC000626257756 568050932 /nfs/dbraw/zinc/05/09/32/568050932.db2.gz RDFICFMSHBXXAK-UHFFFAOYSA-N -1 3 361.239 3.570 20 0 FHADHM Cc1[n-][nH]c(=NC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2F)c1-c1ccccc1 ZINC000603547287 568117985 /nfs/dbraw/zinc/11/79/85/568117985.db2.gz LFWHGTROCADZKU-JKSUJKDBSA-N -1 3 353.372 3.827 20 0 FHADHM CC[S@@](=O)c1ccccc1C(=O)Nc1ccc(Br)cc1[O-] ZINC000603626664 568127330 /nfs/dbraw/zinc/12/73/30/568127330.db2.gz QMVXJCUVLKXNEG-OAQYLSRUSA-N -1 3 368.252 3.535 20 0 FHADHM CC[C@@H]([N-]S(=O)(=O)c1ccsc1C(=O)OC)c1cccc(Cl)c1 ZINC000603640186 568129333 /nfs/dbraw/zinc/12/93/33/568129333.db2.gz FKUYSQFABZRAGI-GFCCVEGCSA-N -1 3 373.883 3.618 20 0 FHADHM C[C@@H](SCC(=O)N(C)C)c1nc(=O)c2c(-c3ccccc3)csc2[n-]1 ZINC000603773121 568155994 /nfs/dbraw/zinc/15/59/94/568155994.db2.gz RHMNTMWVALGHIC-LLVKDONJSA-N -1 3 373.503 3.946 20 0 FHADHM C[C@@H]([N-]S(=O)(=O)c1cccnc1C(F)(F)F)[C@@H](C)c1ccccc1 ZINC000672388628 568171560 /nfs/dbraw/zinc/17/15/60/568171560.db2.gz DFQRMHHQIVLPSQ-VXGBXAGGSA-N -1 3 358.385 3.571 20 0 FHADHM CCCS(=O)(=O)[N-]c1cc(NC(=O)[C@@H](C)C(C)(C)C)c(F)cc1F ZINC000604323488 568249403 /nfs/dbraw/zinc/24/94/03/568249403.db2.gz STVMRTPBOFNGJJ-SNVBAGLBSA-N -1 3 362.442 3.737 20 0 FHADHM CC(C)(C)c1ccc([N-]S(=O)(=O)c2ccc(N3CCCC3=O)cc2)cc1 ZINC000007708276 568253649 /nfs/dbraw/zinc/25/36/49/568253649.db2.gz JUIRBEPEVPREDX-UHFFFAOYSA-N -1 3 372.490 3.912 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)C[C@@H](C)n3cccc3)c2)n1 ZINC000604862205 568379504 /nfs/dbraw/zinc/37/95/04/568379504.db2.gz HSSNEJWSQOKHET-CQSZACIVSA-N -1 3 350.422 3.803 20 0 FHADHM O=C([O-])[C@H](NCc1ccc(Br)c2cccnc12)c1ccccc1 ZINC000321830864 568380855 /nfs/dbraw/zinc/38/08/55/568380855.db2.gz FRMMMAUMGSWDDD-QGZVFWFLSA-N -1 3 371.234 3.913 20 0 FHADHM Cc1cc(Cl)cc(NC(=O)[C@@H](C)NC(=O)CC2CCCCC2)c1[O-] ZINC000604901889 568385003 /nfs/dbraw/zinc/38/50/03/568385003.db2.gz AUMBGVISEWYXEG-GFCCVEGCSA-N -1 3 352.862 3.768 20 0 FHADHM CCN(C(=O)c1csc(=O)[n-]1)[C@@H](c1cccnc1)c1ccc(F)c(C)c1 ZINC000365297921 568442057 /nfs/dbraw/zinc/44/20/57/568442057.db2.gz JPEQMTMLEOACGT-QGZVFWFLSA-N -1 3 371.437 3.943 20 0 FHADHM CCOc1ccc([N-]S(=O)(=O)c2ccc(OC)c(C)c2C)cc1OC ZINC000604971550 568462857 /nfs/dbraw/zinc/46/28/57/568462857.db2.gz ZLWRDHRGSLPWGB-UHFFFAOYSA-N -1 3 365.451 3.520 20 0 FHADHM O=C(NC1CCC(O)(c2cccnc2)CC1)c1cc([O-])c2ccccc2c1 ZINC000365317984 568500133 /nfs/dbraw/zinc/50/01/33/568500133.db2.gz NNUGHEMLUSFEAL-UHFFFAOYSA-N -1 3 362.429 3.501 20 0 FHADHM Cc1cc(OCC(=O)[N-]c2nncn2Cc2ccccc2)ccc1C(C)C ZINC000605117328 568573008 /nfs/dbraw/zinc/57/30/08/568573008.db2.gz WZXASQXOZYNPRN-UHFFFAOYSA-N -1 3 364.449 3.776 20 0 FHADHM Cc1c(-c2ccncc2)[n-][nH]c1=NC(=O)c1c(Cl)cc(F)cc1Cl ZINC000365377614 568576258 /nfs/dbraw/zinc/57/62/58/568576258.db2.gz RBHSTZZAVSKXKK-UHFFFAOYSA-N -1 3 365.195 3.900 20 0 FHADHM O=C(NCc1ccc([O-])c(F)c1)N[C@H](c1ccc(F)cc1)c1cccnc1 ZINC000365454535 568726177 /nfs/dbraw/zinc/72/61/77/568726177.db2.gz IVEXMXHEKZDUJW-LJQANCHMSA-N -1 3 369.371 3.654 20 0 FHADHM C[C@@H]1CC(NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)C[C@@H](C)C1 ZINC000736223231 598827164 /nfs/dbraw/zinc/82/71/64/598827164.db2.gz ILXXTOYAYDFKGS-UWVGGRQHSA-N -1 3 364.906 3.631 20 0 FHADHM C[C@@H]1CC(NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)C[C@@H](C)C1 ZINC000736223231 598827166 /nfs/dbraw/zinc/82/71/66/598827166.db2.gz ILXXTOYAYDFKGS-UWVGGRQHSA-N -1 3 364.906 3.631 20 0 FHADHM CCCN(CC1CC1)C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000821094394 599294591 /nfs/dbraw/zinc/29/45/91/599294591.db2.gz IJPUTIRJQTVCSK-UHFFFAOYSA-N -1 3 368.363 3.539 20 0 FHADHM CS[C@H](C(=O)Nc1sc(C)c(C)c1-c1nnn[n-]1)c1ccccc1 ZINC000737173143 598829644 /nfs/dbraw/zinc/82/96/44/598829644.db2.gz WYSXEXFGSLXPPD-ZDUSSCGKSA-N -1 3 359.480 3.588 20 0 FHADHM CS[C@H](C(=O)Nc1sc(C)c(C)c1-c1nn[n-]n1)c1ccccc1 ZINC000737173143 598829645 /nfs/dbraw/zinc/82/96/45/598829645.db2.gz WYSXEXFGSLXPPD-ZDUSSCGKSA-N -1 3 359.480 3.588 20 0 FHADHM CSCCCCC(=O)N(Cc1ccco1)c1ccccc1-c1nnn[n-]1 ZINC000737180711 598831013 /nfs/dbraw/zinc/83/10/13/598831013.db2.gz BXBGGHOSIQKILQ-UHFFFAOYSA-N -1 3 371.466 3.526 20 0 FHADHM CSCCCCC(=O)N(Cc1ccco1)c1ccccc1-c1nn[n-]n1 ZINC000737180711 598831015 /nfs/dbraw/zinc/83/10/15/598831015.db2.gz BXBGGHOSIQKILQ-UHFFFAOYSA-N -1 3 371.466 3.526 20 0 FHADHM O=C(C=C1CCCC1)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000737793786 598834105 /nfs/dbraw/zinc/83/41/05/598834105.db2.gz ZVRXAIKRZHVFRC-UHFFFAOYSA-N -1 3 365.462 3.712 20 0 FHADHM CCc1ccc([C@@H]2CCCCCN2C(=O)c2cccc(-c3nnn[n-]3)c2)o1 ZINC000736683556 598835434 /nfs/dbraw/zinc/83/54/34/598835434.db2.gz DWPHCOWUQUZGEL-KRWDZBQOSA-N -1 3 365.437 3.780 20 0 FHADHM CCc1ccc([C@@H]2CCCCCN2C(=O)c2cccc(-c3nn[n-]n3)c2)o1 ZINC000736683556 598835435 /nfs/dbraw/zinc/83/54/35/598835435.db2.gz DWPHCOWUQUZGEL-KRWDZBQOSA-N -1 3 365.437 3.780 20 0 FHADHM Cc1cc(C)c([C@@H](C)OC(=O)CNc2ccc(-c3nn[n-]n3)cc2)c(C)c1 ZINC000737246612 598843634 /nfs/dbraw/zinc/84/36/34/598843634.db2.gz MGHWUSFXCYNGRI-OAHLLOKOSA-N -1 3 365.437 3.508 20 0 FHADHM COc1ccc([C@H](C)OC(=O)c2sccc2-c2nnn[n-]2)cc1Cl ZINC000737076855 598843858 /nfs/dbraw/zinc/84/38/58/598843858.db2.gz RZUJFGFWOYJAIM-QMMMGPOBSA-N -1 3 364.814 3.508 20 0 FHADHM CC(C)c1noc(NCc2cccc(-c3ccc(-c4nnn[n-]4)s3)c2)n1 ZINC000735952929 598854158 /nfs/dbraw/zinc/85/41/58/598854158.db2.gz CHKATHBXKSYBCP-UHFFFAOYSA-N -1 3 367.438 3.714 20 0 FHADHM CCSc1cccc(NC(=O)C=Cc2ccccc2-c2nnn[n-]2)c1 ZINC000736666586 598865573 /nfs/dbraw/zinc/86/55/73/598865573.db2.gz MDCVRWICVLZXAA-KHPPLWFESA-N -1 3 351.435 3.631 20 0 FHADHM CCSc1cccc(NC(=O)C=Cc2ccccc2-c2nn[n-]n2)c1 ZINC000736666586 598865575 /nfs/dbraw/zinc/86/55/75/598865575.db2.gz MDCVRWICVLZXAA-KHPPLWFESA-N -1 3 351.435 3.631 20 0 FHADHM Fc1ccc(NCc2ccccc2-c2nnn[n-]2)c(OCC(F)(F)F)c1 ZINC000737656869 598872076 /nfs/dbraw/zinc/87/20/76/598872076.db2.gz QGGRLRFKXUBNGL-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM Fc1ccc(NCc2ccccc2-c2nn[n-]n2)c(OCC(F)(F)F)c1 ZINC000737656869 598872078 /nfs/dbraw/zinc/87/20/78/598872078.db2.gz QGGRLRFKXUBNGL-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM c1ccc(Oc2ccc(NCCOc3ccc(-c4nn[n-]n4)cc3)cc2)nc1 ZINC000738432876 598872239 /nfs/dbraw/zinc/87/22/39/598872239.db2.gz KBJQVQGYELPJBL-UHFFFAOYSA-N -1 3 374.404 3.545 20 0 FHADHM CC[C@@H](CC1CCCCC1)C(=O)Nc1cc(-c2nnn[n-]2)ccc1OC ZINC000736351079 598904595 /nfs/dbraw/zinc/90/45/95/598904595.db2.gz QETAMAYOABDWCD-AWEZNQCLSA-N -1 3 357.458 3.810 20 0 FHADHM CC[C@@H](CC1CCCCC1)C(=O)Nc1cc(-c2nn[n-]n2)ccc1OC ZINC000736351079 598904597 /nfs/dbraw/zinc/90/45/97/598904597.db2.gz QETAMAYOABDWCD-AWEZNQCLSA-N -1 3 357.458 3.810 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)NCCCC(C)(C)C ZINC000735874095 598907805 /nfs/dbraw/zinc/90/78/05/598907805.db2.gz HTUUFLIGJDONTE-UHFFFAOYSA-N -1 3 358.490 3.613 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)NCCCC(C)(C)C ZINC000735874095 598907806 /nfs/dbraw/zinc/90/78/06/598907806.db2.gz HTUUFLIGJDONTE-UHFFFAOYSA-N -1 3 358.490 3.613 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@H]1C[C@H](C)C[C@H](C)C1 ZINC000736222523 598908219 /nfs/dbraw/zinc/90/82/19/598908219.db2.gz CSIWKZCJHCZFOQ-HWWDLCQESA-N -1 3 370.501 3.611 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@H]1C[C@H](C)C[C@H](C)C1 ZINC000736222523 598908221 /nfs/dbraw/zinc/90/82/21/598908221.db2.gz CSIWKZCJHCZFOQ-HWWDLCQESA-N -1 3 370.501 3.611 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@@H]2C(=O)Nc2sccc2-c2nnn[n-]2)cc1 ZINC000735922036 598911237 /nfs/dbraw/zinc/91/12/37/598911237.db2.gz AHMULZLEZMHDFL-GJZGRUSLSA-N -1 3 353.451 3.794 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@@H]2C(=O)Nc2sccc2-c2nn[n-]n2)cc1 ZINC000735922036 598911238 /nfs/dbraw/zinc/91/12/38/598911238.db2.gz AHMULZLEZMHDFL-GJZGRUSLSA-N -1 3 353.451 3.794 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@@H]2C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)cc1 ZINC000735924113 598911864 /nfs/dbraw/zinc/91/18/64/598911864.db2.gz QJOIXURNZJRYKK-CVEARBPZSA-N -1 3 365.412 3.871 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@@H]2C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)cc1 ZINC000735924113 598911867 /nfs/dbraw/zinc/91/18/67/598911867.db2.gz QJOIXURNZJRYKK-CVEARBPZSA-N -1 3 365.412 3.871 20 0 FHADHM C[C@H](c1cc2ccccc2o1)N(C)c1ncc(-c2nnn[n-]2)cc1Cl ZINC000736198349 598936690 /nfs/dbraw/zinc/93/66/90/598936690.db2.gz SKOZDDKURDKIHT-SNVBAGLBSA-N -1 3 354.801 3.859 20 0 FHADHM C[C@H](c1cc2ccccc2o1)N(C)c1ncc(-c2nn[n-]n2)cc1Cl ZINC000736198349 598936691 /nfs/dbraw/zinc/93/66/91/598936691.db2.gz SKOZDDKURDKIHT-SNVBAGLBSA-N -1 3 354.801 3.859 20 0 FHADHM CC[C@H]1CCC[C@@H](NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)C1 ZINC000736401138 598939488 /nfs/dbraw/zinc/93/94/88/598939488.db2.gz VWWCODCSNWFYQC-WDEREUQCSA-N -1 3 364.906 3.775 20 0 FHADHM CC[C@H]1CCC[C@@H](NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)C1 ZINC000736401138 598939490 /nfs/dbraw/zinc/93/94/90/598939490.db2.gz VWWCODCSNWFYQC-WDEREUQCSA-N -1 3 364.906 3.775 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1OCCS[C@@H](C)c1ccc(F)cc1 ZINC000737033615 598940082 /nfs/dbraw/zinc/94/00/82/598940082.db2.gz ZIHQWWZLDBEOQH-LBPRGKRZSA-N -1 3 374.441 3.888 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1OCCS[C@@H](C)c1ccc(F)cc1 ZINC000737033615 598940084 /nfs/dbraw/zinc/94/00/84/598940084.db2.gz ZIHQWWZLDBEOQH-LBPRGKRZSA-N -1 3 374.441 3.888 20 0 FHADHM O=C(Nc1sc2c(c1-c1nnn[n-]1)-c1ccccc1CC2)C1CC=CC1 ZINC000738209163 598942018 /nfs/dbraw/zinc/94/20/18/598942018.db2.gz MQIAHQFSOKCWTB-UHFFFAOYSA-N -1 3 363.446 3.599 20 0 FHADHM O=C(Nc1sc2c(c1-c1nn[n-]n1)-c1ccccc1CC2)C1CC=CC1 ZINC000738209163 598942020 /nfs/dbraw/zinc/94/20/20/598942020.db2.gz MQIAHQFSOKCWTB-UHFFFAOYSA-N -1 3 363.446 3.599 20 0 FHADHM C[C@H](c1ccccc1)N(CC1CCC1)C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000736204551 598944468 /nfs/dbraw/zinc/94/44/68/598944468.db2.gz RNDRAPCSGXMTOO-OAHLLOKOSA-N -1 3 361.449 3.870 20 0 FHADHM C[C@H](c1ccccc1)N(CC1CCC1)C(=O)c1cccc(-c2nn[n-]n2)c1 ZINC000736204551 598944469 /nfs/dbraw/zinc/94/44/69/598944469.db2.gz RNDRAPCSGXMTOO-OAHLLOKOSA-N -1 3 361.449 3.870 20 0 FHADHM C[C@H](c1ccccc1)N(CC1CCC1)C(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000736201750 598944617 /nfs/dbraw/zinc/94/46/17/598944617.db2.gz HJLFCCOBDRXNHB-OAHLLOKOSA-N -1 3 361.449 3.870 20 0 FHADHM C[C@H](c1ccccc1)N(CC1CCC1)C(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC000736201750 598944619 /nfs/dbraw/zinc/94/46/19/598944619.db2.gz HJLFCCOBDRXNHB-OAHLLOKOSA-N -1 3 361.449 3.870 20 0 FHADHM Fc1cccc(Cl)c1[C@@H]1C[C@H]1Nc1ncc(-c2nnn[n-]2)cc1Cl ZINC000737659968 598972142 /nfs/dbraw/zinc/97/21/42/598972142.db2.gz GWECQIHHLVGQEL-PRHODGIISA-N -1 3 365.199 3.676 20 0 FHADHM Fc1cccc(Cl)c1[C@@H]1C[C@H]1Nc1ncc(-c2nn[n-]n2)cc1Cl ZINC000737659968 598972144 /nfs/dbraw/zinc/97/21/44/598972144.db2.gz GWECQIHHLVGQEL-PRHODGIISA-N -1 3 365.199 3.676 20 0 FHADHM Cc1ccc(C(=O)Oc2ccc(-c3nn[n-]n3)cc2)cc1Oc1ccncc1 ZINC000737318522 598979534 /nfs/dbraw/zinc/97/95/34/598979534.db2.gz VYSALCYGTRYTFN-UHFFFAOYSA-N -1 3 373.372 3.582 20 0 FHADHM Fc1ccc(NCc2cccc(-c3nnn[n-]3)c2)c(OC2CCCC2)c1 ZINC000822782911 607256176 /nfs/dbraw/zinc/25/61/76/607256176.db2.gz LUFJLAKGWIVMAN-UHFFFAOYSA-N -1 3 353.401 3.939 20 0 FHADHM Fc1ccc(NCc2cccc(-c3nn[n-]n3)c2)c(OC2CCCC2)c1 ZINC000822782911 607256177 /nfs/dbraw/zinc/25/61/77/607256177.db2.gz LUFJLAKGWIVMAN-UHFFFAOYSA-N -1 3 353.401 3.939 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1OCCS[C@@H](C)c1cccc(F)c1 ZINC000737031842 599010005 /nfs/dbraw/zinc/01/00/05/599010005.db2.gz FHVBCUUISZTZMZ-LBPRGKRZSA-N -1 3 374.441 3.888 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1OCCS[C@@H](C)c1cccc(F)c1 ZINC000737031842 599010007 /nfs/dbraw/zinc/01/00/07/599010007.db2.gz FHVBCUUISZTZMZ-LBPRGKRZSA-N -1 3 374.441 3.888 20 0 FHADHM CC(C)CC[C@@H](NC(=O)CCc1ccc(-c2nnn[n-]2)cc1)C(C)(C)C ZINC000735796853 599016916 /nfs/dbraw/zinc/01/69/16/599016916.db2.gz IVLSAQVLPMGWHT-QGZVFWFLSA-N -1 3 357.502 3.766 20 0 FHADHM CC(C)CC[C@@H](NC(=O)CCc1ccc(-c2nn[n-]n2)cc1)C(C)(C)C ZINC000735796853 599016919 /nfs/dbraw/zinc/01/69/19/599016919.db2.gz IVLSAQVLPMGWHT-QGZVFWFLSA-N -1 3 357.502 3.766 20 0 FHADHM CC(C)C[C@H](C(=O)OCc1cc(-c2nnn[n-]2)ccc1F)c1ccccc1 ZINC000735755524 599019178 /nfs/dbraw/zinc/01/91/78/599019178.db2.gz GISXVYKWFJHAAO-KRWDZBQOSA-N -1 3 368.412 3.879 20 0 FHADHM CC(C)C[C@H](C(=O)OCc1cc(-c2nn[n-]n2)ccc1F)c1ccccc1 ZINC000735755524 599019180 /nfs/dbraw/zinc/01/91/80/599019180.db2.gz GISXVYKWFJHAAO-KRWDZBQOSA-N -1 3 368.412 3.879 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CCCCC[C@@H]1CC(C)C ZINC000737063588 599021358 /nfs/dbraw/zinc/02/13/58/599021358.db2.gz QCBNNPRYZSMQFH-OAHLLOKOSA-N -1 3 372.473 3.698 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CCCCC[C@@H]1CC(C)C ZINC000737063588 599021359 /nfs/dbraw/zinc/02/13/59/599021359.db2.gz QCBNNPRYZSMQFH-OAHLLOKOSA-N -1 3 372.473 3.698 20 0 FHADHM Cc1cc2oc(=O)cc(CNc3cccc(-c4nnn[n-]4)c3C)c2cc1C ZINC000822212645 607257130 /nfs/dbraw/zinc/25/71/30/607257130.db2.gz ALHFYMUKJVCMRG-UHFFFAOYSA-N -1 3 361.405 3.510 20 0 FHADHM Cc1cc2oc(=O)cc(CNc3cccc(-c4nn[n-]n4)c3C)c2cc1C ZINC000822212645 607257131 /nfs/dbraw/zinc/25/71/31/607257131.db2.gz ALHFYMUKJVCMRG-UHFFFAOYSA-N -1 3 361.405 3.510 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N2CCC[C@H]2c2ccsc2)n1 ZINC000737631026 599044597 /nfs/dbraw/zinc/04/45/97/599044597.db2.gz BMFHSMRLWAUKEN-NSHDSACASA-N -1 3 366.372 3.684 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N2CCC[C@H]2c2ccsc2)n1 ZINC000737631026 599044600 /nfs/dbraw/zinc/04/46/00/599044600.db2.gz BMFHSMRLWAUKEN-NSHDSACASA-N -1 3 366.372 3.684 20 0 FHADHM C[C@H](c1cccs1)N(C)c1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000736204367 599046055 /nfs/dbraw/zinc/04/60/55/599046055.db2.gz QTVQVRMVHABAQN-MRVPVSSYSA-N -1 3 354.361 3.539 20 0 FHADHM C[C@H](c1cccs1)N(C)c1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000736204367 599046058 /nfs/dbraw/zinc/04/60/58/599046058.db2.gz QTVQVRMVHABAQN-MRVPVSSYSA-N -1 3 354.361 3.539 20 0 FHADHM C[C@@H]1C[C@H]1c1ccc(CNc2nc(C(F)(F)F)ccc2-c2nnn[n-]2)o1 ZINC000736240399 599046245 /nfs/dbraw/zinc/04/62/45/599046245.db2.gz UTLJHRIDKYCIIC-LDYMZIIASA-N -1 3 364.331 3.609 20 0 FHADHM C[C@@H]1C[C@H]1c1ccc(CNc2nc(C(F)(F)F)ccc2-c2nn[n-]n2)o1 ZINC000736240399 599046248 /nfs/dbraw/zinc/04/62/48/599046248.db2.gz UTLJHRIDKYCIIC-LDYMZIIASA-N -1 3 364.331 3.609 20 0 FHADHM Cc1cccc([C@H](C)CNc2nc(C(F)(F)F)ccc2-c2nnn[n-]2)c1 ZINC000737386048 599046642 /nfs/dbraw/zinc/04/66/42/599046642.db2.gz AHKBFQZGIWZKGL-LLVKDONJSA-N -1 3 362.359 3.805 20 0 FHADHM Cc1cccc([C@H](C)CNc2nc(C(F)(F)F)ccc2-c2nn[n-]n2)c1 ZINC000737386048 599046646 /nfs/dbraw/zinc/04/66/46/599046646.db2.gz AHKBFQZGIWZKGL-LLVKDONJSA-N -1 3 362.359 3.805 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N[C@@H]2CC[C@H]3CCC[C@H]3C2)n1 ZINC000822723871 599055849 /nfs/dbraw/zinc/05/58/49/599055849.db2.gz RPWNDTREHNDGJE-OUAUKWLOSA-N -1 3 352.364 3.661 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N[C@@H]2CC[C@H]3CCC[C@H]3C2)n1 ZINC000822723871 599055852 /nfs/dbraw/zinc/05/58/52/599055852.db2.gz RPWNDTREHNDGJE-OUAUKWLOSA-N -1 3 352.364 3.661 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N2CCC[C@]3(CC=CCC3)C2)n1 ZINC000737631003 599057647 /nfs/dbraw/zinc/05/76/47/599057647.db2.gz AWAMNQVMGQULDS-MRXNPFEDSA-N -1 3 364.375 3.607 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N2CCC[C@]3(CC=CCC3)C2)n1 ZINC000737631003 599057649 /nfs/dbraw/zinc/05/76/49/599057649.db2.gz AWAMNQVMGQULDS-MRXNPFEDSA-N -1 3 364.375 3.607 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(N2CC[C@H](COCc3ccccc3)C2)c1 ZINC000822568051 599063413 /nfs/dbraw/zinc/06/34/13/599063413.db2.gz LADWEFIPGKHHQT-HNNXBMFYSA-N -1 3 369.856 3.563 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(N2CC[C@H](COCc3ccccc3)C2)c1 ZINC000822568051 599063414 /nfs/dbraw/zinc/06/34/14/599063414.db2.gz LADWEFIPGKHHQT-HNNXBMFYSA-N -1 3 369.856 3.563 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1N[C@H]1COc2c1ccc(Cl)c2Cl ZINC000822743885 599077043 /nfs/dbraw/zinc/07/70/43/599077043.db2.gz HVPFXDSDFPEKDT-LBPRGKRZSA-N -1 3 366.183 3.858 20 0 FHADHM C[C@H]1C[C@H](c2ccccc2F)N(c2ncc(-c3nnn[n-]3)cc2Cl)C1 ZINC000820668474 599077312 /nfs/dbraw/zinc/07/73/12/599077312.db2.gz SZJCAYCHJGWQAA-ZUZCIYMTSA-N -1 3 358.808 3.642 20 0 FHADHM C[C@H]1C[C@H](c2ccccc2F)N(c2ncc(-c3nn[n-]n3)cc2Cl)C1 ZINC000820668474 599077315 /nfs/dbraw/zinc/07/73/15/599077315.db2.gz SZJCAYCHJGWQAA-ZUZCIYMTSA-N -1 3 358.808 3.642 20 0 FHADHM C[C@@H]1C[C@@H](c2ccccc2F)N(c2ncc(-c3nnn[n-]3)cc2Cl)C1 ZINC000820668471 599077814 /nfs/dbraw/zinc/07/78/14/599077814.db2.gz SZJCAYCHJGWQAA-BMIGLBTASA-N -1 3 358.808 3.642 20 0 FHADHM C[C@@H]1C[C@@H](c2ccccc2F)N(c2ncc(-c3nn[n-]n3)cc2Cl)C1 ZINC000820668471 599077816 /nfs/dbraw/zinc/07/78/16/599077816.db2.gz SZJCAYCHJGWQAA-BMIGLBTASA-N -1 3 358.808 3.642 20 0 FHADHM CCc1cnc(CCNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)s1 ZINC000821497692 599083200 /nfs/dbraw/zinc/08/32/00/599083200.db2.gz XDPNRWYOIGPAOX-UHFFFAOYSA-N -1 3 368.388 3.559 20 0 FHADHM CCc1cnc(CCNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)s1 ZINC000821497692 599083203 /nfs/dbraw/zinc/08/32/03/599083203.db2.gz XDPNRWYOIGPAOX-UHFFFAOYSA-N -1 3 368.388 3.559 20 0 FHADHM Fc1cccc(N2CC[C@@H](CSc3ccccc3)C2)c1-c1nnn[n-]1 ZINC000822792450 599088765 /nfs/dbraw/zinc/08/87/65/599088765.db2.gz WWTHQARCMSTHNY-CYBMUJFWSA-N -1 3 355.442 3.624 20 0 FHADHM Fc1cccc(N2CC[C@@H](CSc3ccccc3)C2)c1-c1nn[n-]n1 ZINC000822792450 599088767 /nfs/dbraw/zinc/08/87/67/599088767.db2.gz WWTHQARCMSTHNY-CYBMUJFWSA-N -1 3 355.442 3.624 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1N1CC[C@@H](CSc2ccccc2)C1 ZINC000822743709 599089040 /nfs/dbraw/zinc/08/90/40/599089040.db2.gz DZFORBICFQHDQJ-CYBMUJFWSA-N -1 3 355.442 3.624 20 0 FHADHM CO[C@@H](CNc1c(Cl)cccc1-c1nnn[n-]1)c1cccc(Cl)c1 ZINC000821677249 599090383 /nfs/dbraw/zinc/09/03/83/599090383.db2.gz SBBFSYATFJEVDS-AWEZNQCLSA-N -1 3 364.236 3.973 20 0 FHADHM CO[C@@H](CNc1c(Cl)cccc1-c1nn[n-]n1)c1cccc(Cl)c1 ZINC000821677249 599090384 /nfs/dbraw/zinc/09/03/84/599090384.db2.gz SBBFSYATFJEVDS-AWEZNQCLSA-N -1 3 364.236 3.973 20 0 FHADHM Cc1ccc2c(CNc3cccc(-c4nnn[n-]4)c3C)cc(=O)oc2c1C ZINC000822274746 607258584 /nfs/dbraw/zinc/25/85/84/607258584.db2.gz ICAJKEIWUBKMDY-UHFFFAOYSA-N -1 3 361.405 3.510 20 0 FHADHM CCN(CC)C(=O)[C@@H](Sc1ccccc1-c1nnn[n-]1)c1ccccc1 ZINC000736520799 599109990 /nfs/dbraw/zinc/10/99/90/599109990.db2.gz CJNVGPVEGFOTIA-KRWDZBQOSA-N -1 3 367.478 3.569 20 0 FHADHM CCN(CC)C(=O)[C@@H](Sc1ccccc1-c1nn[n-]n1)c1ccccc1 ZINC000736520799 599109993 /nfs/dbraw/zinc/10/99/93/599109993.db2.gz CJNVGPVEGFOTIA-KRWDZBQOSA-N -1 3 367.478 3.569 20 0 FHADHM Cc1cc(C)c(NC(=O)CSc2ccccc2-c2nnn[n-]2)c(Cl)c1 ZINC000737249414 599110020 /nfs/dbraw/zinc/11/00/20/599110020.db2.gz YIQXMFJZFDNBTC-UHFFFAOYSA-N -1 3 373.869 3.868 20 0 FHADHM Cc1cc(C)c(NC(=O)CSc2ccccc2-c2nn[n-]n2)c(Cl)c1 ZINC000737249414 599110022 /nfs/dbraw/zinc/11/00/22/599110022.db2.gz YIQXMFJZFDNBTC-UHFFFAOYSA-N -1 3 373.869 3.868 20 0 FHADHM Cc1ccc2c(CNc3cccc(-c4nn[n-]n4)c3C)cc(=O)oc2c1C ZINC000822274746 607258585 /nfs/dbraw/zinc/25/85/85/607258585.db2.gz ICAJKEIWUBKMDY-UHFFFAOYSA-N -1 3 361.405 3.510 20 0 FHADHM CC(C)[C@H](C)S[C@H](C)C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2 ZINC000820549097 599130620 /nfs/dbraw/zinc/13/06/20/599130620.db2.gz KDLZCSFWTVVWBR-VHSXEESVSA-N -1 3 365.528 3.522 20 0 FHADHM CC(C)[C@H](C)S[C@H](C)C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2 ZINC000820549097 599130621 /nfs/dbraw/zinc/13/06/21/599130621.db2.gz KDLZCSFWTVVWBR-VHSXEESVSA-N -1 3 365.528 3.522 20 0 FHADHM CCN(C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)[C@H](C)c1cccnc1 ZINC000736506333 599145425 /nfs/dbraw/zinc/14/54/25/599145425.db2.gz UTPYTXZOFNHTAZ-LLVKDONJSA-N -1 3 371.832 3.530 20 0 FHADHM CCN(C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)[C@H](C)c1cccnc1 ZINC000736506333 599145428 /nfs/dbraw/zinc/14/54/28/599145428.db2.gz UTPYTXZOFNHTAZ-LLVKDONJSA-N -1 3 371.832 3.530 20 0 FHADHM Cc1ccc(OC(F)F)c([C@H](C)OC(=O)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000737365112 599156519 /nfs/dbraw/zinc/15/65/19/599156519.db2.gz PRGFNHKBFSCLBQ-NSHDSACASA-N -1 3 374.347 3.695 20 0 FHADHM Cc1ccc(OC(F)F)c([C@H](C)OC(=O)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000737365112 599156522 /nfs/dbraw/zinc/15/65/22/599156522.db2.gz PRGFNHKBFSCLBQ-NSHDSACASA-N -1 3 374.347 3.695 20 0 FHADHM C[C@H](CC(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2)c1cccc(F)c1 ZINC000735977754 599157435 /nfs/dbraw/zinc/15/74/35/599157435.db2.gz RHEPEBKIRHMDAK-SNVBAGLBSA-N -1 3 371.441 3.688 20 0 FHADHM C[C@H](CC(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2)c1cccc(F)c1 ZINC000735977754 599157438 /nfs/dbraw/zinc/15/74/38/599157438.db2.gz RHEPEBKIRHMDAK-SNVBAGLBSA-N -1 3 371.441 3.688 20 0 FHADHM Cc1ccc(C)c(SCc2nnc(-c3cccc(-c4nnn[n-]4)c3)o2)c1 ZINC000737327307 599159185 /nfs/dbraw/zinc/15/91/85/599159185.db2.gz YVWQWIVJGVQMMG-UHFFFAOYSA-N -1 3 364.434 3.826 20 0 FHADHM Cc1ccc(C)c(SCc2nnc(-c3cccc(-c4nn[n-]n4)c3)o2)c1 ZINC000737327307 599159186 /nfs/dbraw/zinc/15/91/86/599159186.db2.gz YVWQWIVJGVQMMG-UHFFFAOYSA-N -1 3 364.434 3.826 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)C[C@@H](C)c2ccccc2C)s1 ZINC000736679435 599160771 /nfs/dbraw/zinc/16/07/71/599160771.db2.gz UAFMJUQPNAPTFP-GFCCVEGCSA-N -1 3 355.467 3.931 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)C[C@@H](C)c2ccccc2C)s1 ZINC000736679435 599160773 /nfs/dbraw/zinc/16/07/73/599160773.db2.gz UAFMJUQPNAPTFP-GFCCVEGCSA-N -1 3 355.467 3.931 20 0 FHADHM Cc1ccccc1[C@@H](C)CC(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000737421339 599161468 /nfs/dbraw/zinc/16/14/68/599161468.db2.gz LOLSVTRYYSHAPA-LBPRGKRZSA-N -1 3 355.829 3.961 20 0 FHADHM Cc1ccccc1[C@@H](C)CC(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000737421339 599161470 /nfs/dbraw/zinc/16/14/70/599161470.db2.gz LOLSVTRYYSHAPA-LBPRGKRZSA-N -1 3 355.829 3.961 20 0 FHADHM CC(C)(C)[C@@H]1CCCN(C(=O)CSc2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000735598392 599162000 /nfs/dbraw/zinc/16/20/00/599162000.db2.gz ZHKXEVIMMHOYGP-OAHLLOKOSA-N -1 3 373.526 3.634 20 0 FHADHM CC(C)(C)[C@@H]1CCCN(C(=O)CSc2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000735598392 599162001 /nfs/dbraw/zinc/16/20/01/599162001.db2.gz ZHKXEVIMMHOYGP-OAHLLOKOSA-N -1 3 373.526 3.634 20 0 FHADHM Cc1cnc(CSc2nc(-c3ccccc3)ccc2-c2nnn[n-]2)o1 ZINC000737445478 599167254 /nfs/dbraw/zinc/16/72/54/599167254.db2.gz IIVQHLUQOQZDCT-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM Cc1cnc(CSc2nc(-c3ccccc3)ccc2-c2nn[n-]n2)o1 ZINC000737445478 599167257 /nfs/dbraw/zinc/16/72/57/599167257.db2.gz IIVQHLUQOQZDCT-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM CC(=CC(=O)Nc1cccc(-c2nnn[n-]2)c1)c1ccccc1C(F)(F)F ZINC000735446610 599177290 /nfs/dbraw/zinc/17/72/90/599177290.db2.gz BRCVWHQFIVWKBA-LUAWRHEFSA-N -1 3 373.338 3.928 20 0 FHADHM CC(=CC(=O)Nc1cccc(-c2nn[n-]n2)c1)c1ccccc1C(F)(F)F ZINC000735446610 599177292 /nfs/dbraw/zinc/17/72/92/599177292.db2.gz BRCVWHQFIVWKBA-LUAWRHEFSA-N -1 3 373.338 3.928 20 0 FHADHM COc1ccc2sc(C(=O)Nc3sccc3-c3nnn[n-]3)c(C)c2c1 ZINC000737120376 599178124 /nfs/dbraw/zinc/17/81/24/599178124.db2.gz NCHFTJUPRBALEM-UHFFFAOYSA-N -1 3 371.447 3.712 20 0 FHADHM COc1ccc2sc(C(=O)Nc3sccc3-c3nn[n-]n3)c(C)c2c1 ZINC000737120376 599178127 /nfs/dbraw/zinc/17/81/27/599178127.db2.gz NCHFTJUPRBALEM-UHFFFAOYSA-N -1 3 371.447 3.712 20 0 FHADHM CCN(C(=O)[C@@H](C)c1cccc(F)c1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736503353 599182796 /nfs/dbraw/zinc/18/27/96/599182796.db2.gz VPOSXCUOUZCBGA-KBPBESRZSA-N -1 3 367.428 3.719 20 0 FHADHM CCN(C(=O)[C@@H](C)c1cccc(F)c1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736503353 599182799 /nfs/dbraw/zinc/18/27/99/599182799.db2.gz VPOSXCUOUZCBGA-KBPBESRZSA-N -1 3 367.428 3.719 20 0 FHADHM Cc1ccc([C@@H]2CCCN2C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)o1 ZINC000737328753 599188821 /nfs/dbraw/zinc/18/88/21/599188821.db2.gz CTWBXBCYQQDKJD-AWEZNQCLSA-N -1 3 372.816 3.791 20 0 FHADHM Cc1ccc([C@@H]2CCCN2C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)o1 ZINC000737328753 599188822 /nfs/dbraw/zinc/18/88/22/599188822.db2.gz CTWBXBCYQQDKJD-AWEZNQCLSA-N -1 3 372.816 3.791 20 0 FHADHM O=C(Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1)[C@@H]1Cc2ccccc21 ZINC000738209660 599186779 /nfs/dbraw/zinc/18/67/79/599186779.db2.gz QDXJHOWNRLHKGT-OAHLLOKOSA-N -1 3 373.441 3.874 20 0 FHADHM O=C(Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1)[C@@H]1Cc2ccccc21 ZINC000738209660 599186782 /nfs/dbraw/zinc/18/67/82/599186782.db2.gz QDXJHOWNRLHKGT-OAHLLOKOSA-N -1 3 373.441 3.874 20 0 FHADHM CC[C@H](C)NC(=O)c1cccc(Oc2cccc(Cl)c2-c2nnn[n-]2)c1 ZINC000736326598 599192739 /nfs/dbraw/zinc/19/27/39/599192739.db2.gz OOTUUZJRVCSHNF-NSHDSACASA-N -1 3 371.828 3.841 20 0 FHADHM CC[C@H](OC(=O)Cc1ccc(-c2nnn[n-]2)cc1)C(C)(C)c1ccccc1 ZINC000736384672 599201560 /nfs/dbraw/zinc/20/15/60/599201560.db2.gz YDNIROFTAOOUOH-SFHVURJKSA-N -1 3 364.449 3.709 20 0 FHADHM CC[C@H](OC(=O)Cc1ccc(-c2nn[n-]n2)cc1)C(C)(C)c1ccccc1 ZINC000736384672 599201562 /nfs/dbraw/zinc/20/15/62/599201562.db2.gz YDNIROFTAOOUOH-SFHVURJKSA-N -1 3 364.449 3.709 20 0 FHADHM CCc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)c2ccc(-c3nnn[n-]3)cc2)o1 ZINC000821482002 599221249 /nfs/dbraw/zinc/22/12/49/599221249.db2.gz PDINWDCGTPJKHA-GUYCJALGSA-N -1 3 365.437 3.636 20 0 FHADHM CCc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)c2ccc(-c3nn[n-]n3)cc2)o1 ZINC000821482002 599221251 /nfs/dbraw/zinc/22/12/51/599221251.db2.gz PDINWDCGTPJKHA-GUYCJALGSA-N -1 3 365.437 3.636 20 0 FHADHM CC[C@H]1CCCN(C(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)CC1 ZINC000736402563 599221483 /nfs/dbraw/zinc/22/14/83/599221483.db2.gz NYXKPVCXROPCSI-NSHDSACASA-N -1 3 364.906 3.729 20 0 FHADHM CC[C@H]1CCCN(C(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)CC1 ZINC000736402563 599221485 /nfs/dbraw/zinc/22/14/85/599221485.db2.gz NYXKPVCXROPCSI-NSHDSACASA-N -1 3 364.906 3.729 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)N[C@H](CC1CC1)c1ccccc1 ZINC000737795582 599225114 /nfs/dbraw/zinc/22/51/14/599225114.db2.gz ASURKNCXVSFSBG-SYGIOELKSA-N -1 3 359.433 3.538 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)N[C@H](CC1CC1)c1ccccc1 ZINC000737795582 599225117 /nfs/dbraw/zinc/22/51/17/599225117.db2.gz ASURKNCXVSFSBG-SYGIOELKSA-N -1 3 359.433 3.538 20 0 FHADHM C[C@H](CCSc1ccccc1)OC(=O)c1sccc1-c1nnn[n-]1 ZINC000820248151 607261813 /nfs/dbraw/zinc/26/18/13/607261813.db2.gz CZIMDFLVNWOTTQ-LLVKDONJSA-N -1 3 360.464 3.656 20 0 FHADHM Cc1c(NC(=O)c2ccc(OC3CCCC3)cc2)cccc1-c1nnn[n-]1 ZINC000822107667 607267443 /nfs/dbraw/zinc/26/74/43/607267443.db2.gz BFYFLNQANDLEAX-UHFFFAOYSA-N -1 3 363.421 3.749 20 0 FHADHM Cc1c(NC(=O)c2ccc(OC3CCCC3)cc2)cccc1-c1nn[n-]n1 ZINC000822107667 607267444 /nfs/dbraw/zinc/26/74/44/607267444.db2.gz BFYFLNQANDLEAX-UHFFFAOYSA-N -1 3 363.421 3.749 20 0 FHADHM CCCOc1ccc(CCC(=O)Nc2cccc(-c3nnn[n-]3)c2C)cc1 ZINC000821134047 607267491 /nfs/dbraw/zinc/26/74/91/607267491.db2.gz LVSXPGIOXSQANI-UHFFFAOYSA-N -1 3 365.437 3.535 20 0 FHADHM CCCOc1ccc(CCC(=O)Nc2cccc(-c3nn[n-]n3)c2C)cc1 ZINC000821134047 607267492 /nfs/dbraw/zinc/26/74/92/607267492.db2.gz LVSXPGIOXSQANI-UHFFFAOYSA-N -1 3 365.437 3.535 20 0 FHADHM Cc1cc2occ(CC(=O)Nc3cccc(-c4nnn[n-]4)c3C)c2cc1C ZINC000822213211 607269927 /nfs/dbraw/zinc/26/99/27/607269927.db2.gz ZFMCUNILJKDIBC-UHFFFAOYSA-N -1 3 361.405 3.719 20 0 FHADHM Cc1cc2occ(CC(=O)Nc3cccc(-c4nn[n-]n4)c3C)c2cc1C ZINC000822213211 607269928 /nfs/dbraw/zinc/26/99/28/607269928.db2.gz ZFMCUNILJKDIBC-UHFFFAOYSA-N -1 3 361.405 3.719 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)N1CCCC2(C1)CCCCCC2 ZINC000823309001 599242475 /nfs/dbraw/zinc/24/24/75/599242475.db2.gz OVWIBWNMOKANHU-UHFFFAOYSA-N -1 3 354.458 3.835 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)N1CCCC2(C1)CCCCCC2 ZINC000823309001 599242478 /nfs/dbraw/zinc/24/24/78/599242478.db2.gz OVWIBWNMOKANHU-UHFFFAOYSA-N -1 3 354.458 3.835 20 0 FHADHM Cc1c(NC(=O)CSc2ccccc2Cl)cccc1-c1nnn[n-]1 ZINC000822077867 607269197 /nfs/dbraw/zinc/26/91/97/607269197.db2.gz ZQIBZVKNSFXGJG-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1c(NC(=O)CSc2ccccc2Cl)cccc1-c1nn[n-]n1 ZINC000822077867 607269198 /nfs/dbraw/zinc/26/91/98/607269198.db2.gz ZQIBZVKNSFXGJG-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1ccc2c(CCC(=O)Nc3cccc(-c4nnn[n-]4)c3C)c[nH]c2c1 ZINC000822275386 607269236 /nfs/dbraw/zinc/26/92/36/607269236.db2.gz SOIKWCDKKWDFKF-UHFFFAOYSA-N -1 3 360.421 3.536 20 0 FHADHM Cc1ccc2c(CCC(=O)Nc3cccc(-c4nn[n-]n4)c3C)c[nH]c2c1 ZINC000822275386 607269237 /nfs/dbraw/zinc/26/92/37/607269237.db2.gz SOIKWCDKKWDFKF-UHFFFAOYSA-N -1 3 360.421 3.536 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1cc2cc(F)ccc2o1 ZINC000738152185 599247152 /nfs/dbraw/zinc/24/71/52/599247152.db2.gz QMGQYGGRBQMHAK-UHFFFAOYSA-N -1 3 357.732 3.658 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1cc2cc(F)ccc2o1 ZINC000738152185 599247154 /nfs/dbraw/zinc/24/71/54/599247154.db2.gz QMGQYGGRBQMHAK-UHFFFAOYSA-N -1 3 357.732 3.658 20 0 FHADHM O=C(C=CC1CCCCC1)Nc1sc2c(c1-c1nn[n-]n1)CCCC2 ZINC000737795413 599247279 /nfs/dbraw/zinc/24/72/79/599247279.db2.gz KKPHRWJJFFKVSN-ZHACJKMWSA-N -1 3 357.483 3.882 20 0 FHADHM O=C(/C=C/C1CCCCC1)Nc1sc2c(c1-c1nn[n-]n1)CCCC2 ZINC000737795413 599247282 /nfs/dbraw/zinc/24/72/82/599247282.db2.gz KKPHRWJJFFKVSN-ZHACJKMWSA-N -1 3 357.483 3.882 20 0 FHADHM CCC[C@@H]1[C@H](C)CCCN1C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000821034357 599249961 /nfs/dbraw/zinc/24/99/61/599249961.db2.gz KUMUUCZGPHUTLQ-IAQYHMDHSA-N -1 3 362.865 3.953 20 0 FHADHM CCC[C@@H]1[C@H](C)CCCN1C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000821034357 599249965 /nfs/dbraw/zinc/24/99/65/599249965.db2.gz KUMUUCZGPHUTLQ-IAQYHMDHSA-N -1 3 362.865 3.953 20 0 FHADHM CC[C@@](C)(NC(=O)Nc1cccc(-c2nnn[n-]2)c1C)c1ccccc1 ZINC000820852704 607280455 /nfs/dbraw/zinc/28/04/55/607280455.db2.gz FNIHSKZNEOEEBG-LJQANCHMSA-N -1 3 350.426 3.622 20 0 FHADHM CC[C@@](C)(NC(=O)Nc1cccc(-c2nn[n-]n2)c1C)c1ccccc1 ZINC000820852704 607280456 /nfs/dbraw/zinc/28/04/56/607280456.db2.gz FNIHSKZNEOEEBG-LJQANCHMSA-N -1 3 350.426 3.622 20 0 FHADHM Cc1c(NC(=O)NC2(c3cccc(Cl)c3)CC2)cccc1-c1nnn[n-]1 ZINC000822089530 607280548 /nfs/dbraw/zinc/28/05/48/607280548.db2.gz DQDIMWCTRRLIAH-UHFFFAOYSA-N -1 3 368.828 3.639 20 0 FHADHM Cc1c(NC(=O)NC2(c3cccc(Cl)c3)CC2)cccc1-c1nn[n-]n1 ZINC000822089530 607280549 /nfs/dbraw/zinc/28/05/49/607280549.db2.gz DQDIMWCTRRLIAH-UHFFFAOYSA-N -1 3 368.828 3.639 20 0 FHADHM Cc1cc(C)cc([C@@H](C)NC(=O)Nc2cccc(-c3nnn[n-]3)c2C)c1 ZINC000822196476 607283597 /nfs/dbraw/zinc/28/35/97/607283597.db2.gz KVYHDEFTIUSTFU-CQSZACIVSA-N -1 3 350.426 3.675 20 0 FHADHM Cc1cc(C)cc([C@@H](C)NC(=O)Nc2cccc(-c3nn[n-]n3)c2C)c1 ZINC000822196476 607283598 /nfs/dbraw/zinc/28/35/98/607283598.db2.gz KVYHDEFTIUSTFU-CQSZACIVSA-N -1 3 350.426 3.675 20 0 FHADHM Cc1cc(F)cc2c1ncc(-c1nnn[n-]1)c2N1Cc2ccccc2[C@@H](C)C1 ZINC000737264519 599257689 /nfs/dbraw/zinc/25/76/89/599257689.db2.gz SCCWBTQPMGWDKS-ZDUSSCGKSA-N -1 3 374.423 3.986 20 0 FHADHM Cc1cc(F)cc2c1ncc(-c1nn[n-]n1)c2N1Cc2ccccc2[C@@H](C)C1 ZINC000737264519 599257691 /nfs/dbraw/zinc/25/76/91/599257691.db2.gz SCCWBTQPMGWDKS-ZDUSSCGKSA-N -1 3 374.423 3.986 20 0 FHADHM Cc1c(NC(=O)N2C[C@H](c3ccccc3)C[C@H]2C)cccc1-c1nnn[n-]1 ZINC000822085171 607286262 /nfs/dbraw/zinc/28/62/62/607286262.db2.gz WPTICRQEOLBCJA-CZUORRHYSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1c(NC(=O)N2C[C@H](c3ccccc3)C[C@H]2C)cccc1-c1nn[n-]n1 ZINC000822085171 607286263 /nfs/dbraw/zinc/28/62/63/607286263.db2.gz WPTICRQEOLBCJA-CZUORRHYSA-N -1 3 362.437 3.585 20 0 FHADHM CCN(Cc1ccccc1Cl)C(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000821231226 607287000 /nfs/dbraw/zinc/28/70/00/607287000.db2.gz ZKPBSEZHHFXTOR-UHFFFAOYSA-N -1 3 370.844 3.883 20 0 FHADHM CCN(Cc1ccccc1Cl)C(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000821231226 607287001 /nfs/dbraw/zinc/28/70/01/607287001.db2.gz ZKPBSEZHHFXTOR-UHFFFAOYSA-N -1 3 370.844 3.883 20 0 FHADHM Cc1cccc([C@@H]2CCCCCN2C(=O)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737389696 599262190 /nfs/dbraw/zinc/26/21/90/599262190.db2.gz NMGFQHSXPBUIPS-IBGZPJMESA-N -1 3 361.449 3.933 20 0 FHADHM Cc1cccc([C@@H]2CCCCCN2C(=O)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737389696 599262192 /nfs/dbraw/zinc/26/21/92/599262192.db2.gz NMGFQHSXPBUIPS-IBGZPJMESA-N -1 3 361.449 3.933 20 0 FHADHM Cc1c(NC(=O)N(Cc2ccc(F)cc2)C2CC2)cccc1-c1nnn[n-]1 ZINC000822084294 607290733 /nfs/dbraw/zinc/29/07/33/607290733.db2.gz IFBDCNYQMQQGAY-UHFFFAOYSA-N -1 3 366.400 3.511 20 0 FHADHM Cc1c(NC(=O)N(Cc2ccc(F)cc2)C2CC2)cccc1-c1nn[n-]n1 ZINC000822084294 607290734 /nfs/dbraw/zinc/29/07/34/607290734.db2.gz IFBDCNYQMQQGAY-UHFFFAOYSA-N -1 3 366.400 3.511 20 0 FHADHM CN(Cc1ccc(Cl)s1)c1c(-c2nnn[n-]2)cnc2ccccc21 ZINC000736816937 599259742 /nfs/dbraw/zinc/25/97/42/599259742.db2.gz QAFWZVXJEDUUKR-UHFFFAOYSA-N -1 3 356.842 3.766 20 0 FHADHM CN(Cc1ccc(Cl)s1)c1c(-c2nn[n-]n2)cnc2ccccc21 ZINC000736816937 599259744 /nfs/dbraw/zinc/25/97/44/599259744.db2.gz QAFWZVXJEDUUKR-UHFFFAOYSA-N -1 3 356.842 3.766 20 0 FHADHM Cc1c(NC(=O)[C@H](C)Sc2ccccc2Cl)cccc1-c1nnn[n-]1 ZINC000822061669 607296573 /nfs/dbraw/zinc/29/65/73/607296573.db2.gz UJIHNVIHJNSJNY-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM Cc1c(NC(=O)[C@H](C)Sc2ccccc2Cl)cccc1-c1nn[n-]n1 ZINC000822061669 607296574 /nfs/dbraw/zinc/29/65/74/607296574.db2.gz UJIHNVIHJNSJNY-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM CCN(c1ccc(NCc2ccc(OC)c(-c3nnn[n-]3)c2)cc1)C(C)C ZINC000821239628 607307824 /nfs/dbraw/zinc/30/78/24/607307824.db2.gz BTYSFDPYPOSISX-UHFFFAOYSA-N -1 3 366.469 3.722 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CCC(C(C)C)CC1 ZINC000820151644 599263949 /nfs/dbraw/zinc/26/39/49/599263949.db2.gz LCQSPNQAQZWSLF-UHFFFAOYSA-N -1 3 372.473 3.554 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CCC(C(C)C)CC1 ZINC000820151644 599263951 /nfs/dbraw/zinc/26/39/51/599263951.db2.gz LCQSPNQAQZWSLF-UHFFFAOYSA-N -1 3 372.473 3.554 20 0 FHADHM c1cc(-c2nnn[n-]2)sc1CNc1ccc2c(c1)OC1(CCCCC1)O2 ZINC000823766929 607311192 /nfs/dbraw/zinc/31/11/92/607311192.db2.gz MMPDMQMUHDFQAB-UHFFFAOYSA-N -1 3 369.450 3.972 20 0 FHADHM CN(C(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)cc1)C1CCC1 ZINC000821571744 599265473 /nfs/dbraw/zinc/26/54/73/599265473.db2.gz CRPFQWQYYFRWOK-UHFFFAOYSA-N -1 3 364.409 3.675 20 0 FHADHM CN(C(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)cc1)C1CCC1 ZINC000821571744 599265474 /nfs/dbraw/zinc/26/54/74/599265474.db2.gz CRPFQWQYYFRWOK-UHFFFAOYSA-N -1 3 364.409 3.675 20 0 FHADHM FC(F)(F)c1csc(N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)n1 ZINC000822729215 607304894 /nfs/dbraw/zinc/30/48/94/607304894.db2.gz WJJWPPKBWLVYNE-UHFFFAOYSA-N -1 3 366.372 3.511 20 0 FHADHM FC(F)(F)c1csc(N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)n1 ZINC000822729215 607304895 /nfs/dbraw/zinc/30/48/95/607304895.db2.gz WJJWPPKBWLVYNE-UHFFFAOYSA-N -1 3 366.372 3.511 20 0 FHADHM CCC[C@H]1[C@@H](C)CCCN1C(=O)Nc1cc(-c2nnn[n-]2)ccc1OCC ZINC000821034403 599266336 /nfs/dbraw/zinc/26/63/36/599266336.db2.gz LVNCDYYIWJAQMP-BBRMVZONSA-N -1 3 372.473 3.698 20 0 FHADHM CCC[C@H]1[C@@H](C)CCCN1C(=O)Nc1cc(-c2nn[n-]n2)ccc1OCC ZINC000821034403 599266338 /nfs/dbraw/zinc/26/63/38/599266338.db2.gz LVNCDYYIWJAQMP-BBRMVZONSA-N -1 3 372.473 3.698 20 0 FHADHM Clc1cc(N2CCC[C@@H]2c2ccc3c(c2)OCO3)ccc1-c1nnn[n-]1 ZINC000737565645 599266848 /nfs/dbraw/zinc/26/68/48/599266848.db2.gz NRLLPKTYRQDVAF-OAHLLOKOSA-N -1 3 369.812 3.590 20 0 FHADHM Clc1cc(N2CCC[C@@H]2c2ccc3c(c2)OCO3)ccc1-c1nn[n-]n1 ZINC000737565645 599266849 /nfs/dbraw/zinc/26/68/49/599266849.db2.gz NRLLPKTYRQDVAF-OAHLLOKOSA-N -1 3 369.812 3.590 20 0 FHADHM CC[C@@H](Cc1ccccc1)N(C)C(=O)Nc1cc(-c2nnn[n-]2)ccc1C ZINC000820914925 599269286 /nfs/dbraw/zinc/26/92/86/599269286.db2.gz SBNAMFLDWHUBAQ-KRWDZBQOSA-N -1 3 364.453 3.660 20 0 FHADHM CC[C@@H](Cc1ccccc1)N(C)C(=O)Nc1cc(-c2nn[n-]n2)ccc1C ZINC000820914925 599269288 /nfs/dbraw/zinc/26/92/88/599269288.db2.gz SBNAMFLDWHUBAQ-KRWDZBQOSA-N -1 3 364.453 3.660 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1sccc1CC ZINC000736487990 599275587 /nfs/dbraw/zinc/27/55/87/599275587.db2.gz MXXFHFZMULOQQA-UHFFFAOYSA-N -1 3 356.455 3.565 20 0 FHADHM C[C@H](NC(=O)Nc1cccc(-n2cccc2)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820380112 599276405 /nfs/dbraw/zinc/27/64/05/599276405.db2.gz LOKPYAQTERUOSC-AWEZNQCLSA-N -1 3 373.420 3.540 20 0 FHADHM C[C@H](NC(=O)Nc1cccc(-n2cccc2)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820380112 599276406 /nfs/dbraw/zinc/27/64/06/599276406.db2.gz LOKPYAQTERUOSC-AWEZNQCLSA-N -1 3 373.420 3.540 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1ccc(Cl)cc1 ZINC000736487494 599276895 /nfs/dbraw/zinc/27/68/95/599276895.db2.gz GRQXHQSSVUVCNP-UHFFFAOYSA-N -1 3 356.817 3.594 20 0 FHADHM CSCc1cccc(NC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000821971161 599281904 /nfs/dbraw/zinc/28/19/04/599281904.db2.gz YBJRVRITUVSCAV-GFCCVEGCSA-N -1 3 368.466 3.612 20 0 FHADHM CSCc1cccc(NC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000821971161 599281906 /nfs/dbraw/zinc/28/19/06/599281906.db2.gz YBJRVRITUVSCAV-GFCCVEGCSA-N -1 3 368.466 3.612 20 0 FHADHM CC(C)CNc1nnc(S[C@H](C)c2ccc(-c3nnn[n-]3)cc2)s1 ZINC000735838827 599286434 /nfs/dbraw/zinc/28/64/34/599286434.db2.gz ISQXQTXESMBSCH-SNVBAGLBSA-N -1 3 361.500 3.639 20 0 FHADHM CC(C)CNc1nnc(S[C@H](C)c2ccc(-c3nn[n-]n3)cc2)s1 ZINC000735838827 599286438 /nfs/dbraw/zinc/28/64/38/599286438.db2.gz ISQXQTXESMBSCH-SNVBAGLBSA-N -1 3 361.500 3.639 20 0 FHADHM C[C@@H]1CCC[C@@H](NC(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)C1 ZINC000820697916 599288565 /nfs/dbraw/zinc/28/85/65/599288565.db2.gz NXVSKBAMNHZYOB-NXEZZACHSA-N -1 3 368.363 3.586 20 0 FHADHM C[C@@H]1CCC[C@@H](NC(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)C1 ZINC000820697916 599288568 /nfs/dbraw/zinc/28/85/68/599288568.db2.gz NXVSKBAMNHZYOB-NXEZZACHSA-N -1 3 368.363 3.586 20 0 FHADHM Cc1c(NC(=O)c2cc(C3CC3)nc3ccccc32)cccc1-c1nnn[n-]1 ZINC000822109011 607321168 /nfs/dbraw/zinc/32/11/68/607321168.db2.gz OMJUBVUPDFJXBR-UHFFFAOYSA-N -1 3 370.416 3.853 20 0 FHADHM Cc1c(NC(=O)c2cc(C3CC3)nc3ccccc32)cccc1-c1nn[n-]n1 ZINC000822109011 607321169 /nfs/dbraw/zinc/32/11/69/607321169.db2.gz OMJUBVUPDFJXBR-UHFFFAOYSA-N -1 3 370.416 3.853 20 0 FHADHM Cc1c(NC(=O)c2ccc(Cl)c3cccnc23)cccc1-c1nnn[n-]1 ZINC000822110169 607321432 /nfs/dbraw/zinc/32/14/32/607321432.db2.gz YMBZNRZYCDGOKL-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1c(NC(=O)c2ccc(Cl)c3cccnc23)cccc1-c1nn[n-]n1 ZINC000822110169 607321433 /nfs/dbraw/zinc/32/14/33/607321433.db2.gz YMBZNRZYCDGOKL-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM COC(=O)c1cccc(CS[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736948676 599290549 /nfs/dbraw/zinc/29/05/49/599290549.db2.gz OHVGEOOTQGOVDZ-LBPRGKRZSA-N -1 3 354.435 3.648 20 0 FHADHM COC(=O)c1cccc(CS[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736948676 599290551 /nfs/dbraw/zinc/29/05/51/599290551.db2.gz OHVGEOOTQGOVDZ-LBPRGKRZSA-N -1 3 354.435 3.648 20 0 FHADHM CC(C)CN(C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)C1CC1 ZINC000820081810 599291172 /nfs/dbraw/zinc/29/11/72/599291172.db2.gz WSBCXBGJZDGRBJ-UHFFFAOYSA-N -1 3 368.363 3.538 20 0 FHADHM CC(C)CN(C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)C1CC1 ZINC000820081810 599291174 /nfs/dbraw/zinc/29/11/74/599291174.db2.gz WSBCXBGJZDGRBJ-UHFFFAOYSA-N -1 3 368.363 3.538 20 0 FHADHM CC(C)N(C(=O)Cc1ccc(-c2nnn[n-]2)cc1)c1ccc(F)cc1Cl ZINC000735850384 599291393 /nfs/dbraw/zinc/29/13/93/599291393.db2.gz DCJANVBNQMUVKE-UHFFFAOYSA-N -1 3 373.819 3.643 20 0 FHADHM CC(C)N(C(=O)Cc1ccc(-c2nn[n-]n2)cc1)c1ccc(F)cc1Cl ZINC000735850384 599291395 /nfs/dbraw/zinc/29/13/95/599291395.db2.gz DCJANVBNQMUVKE-UHFFFAOYSA-N -1 3 373.819 3.643 20 0 FHADHM CCN(C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)[C@H](C)C(C)C ZINC000821154528 599291592 /nfs/dbraw/zinc/29/15/92/599291592.db2.gz OLUKZHYESVLKAU-SNVBAGLBSA-N -1 3 370.379 3.784 20 0 FHADHM CCN(C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)[C@H](C)C(C)C ZINC000821154528 599291594 /nfs/dbraw/zinc/29/15/94/599291594.db2.gz OLUKZHYESVLKAU-SNVBAGLBSA-N -1 3 370.379 3.784 20 0 FHADHM Cc1nn(C)c(Cl)c1CSc1ccc(-c2nn[n-]n2)cc1Cl ZINC000826333989 607844822 /nfs/dbraw/zinc/84/48/22/607844822.db2.gz CFKDXAYSPVCWFI-UHFFFAOYSA-N -1 3 355.254 3.508 20 0 FHADHM Cc1cc(C(=O)Nc2cccc(Oc3ccc(-c4nnn[n-]4)cc3)c2)c(C)[nH]1 ZINC000737237575 598232587 /nfs/dbraw/zinc/23/25/87/598232587.db2.gz ABTYBPSBDXFOTP-UHFFFAOYSA-N -1 3 374.404 3.856 20 0 FHADHM Cc1cc(C(=O)Nc2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)c(C)[nH]1 ZINC000737237575 598232588 /nfs/dbraw/zinc/23/25/88/598232588.db2.gz ABTYBPSBDXFOTP-UHFFFAOYSA-N -1 3 374.404 3.856 20 0 FHADHM Cn1c2ccc(Cl)cc2nc1Sc1cccc(F)c1-c1nnn[n-]1 ZINC000737592118 598239509 /nfs/dbraw/zinc/23/95/09/598239509.db2.gz JYODLDZIEJSOGC-UHFFFAOYSA-N -1 3 360.805 3.697 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1NCc1ccnc(OC2CCCCC2)c1 ZINC000737645274 598243418 /nfs/dbraw/zinc/24/34/18/598243418.db2.gz VKHRJKBWTZDREA-UHFFFAOYSA-N -1 3 368.416 3.724 20 0 FHADHM Clc1ccc2[nH]c3c(c2c1)CN(Cc1ccc(-c2nnn[n-]2)cc1)CC3 ZINC000737575609 598252790 /nfs/dbraw/zinc/25/27/90/598252790.db2.gz YXCHLFJAUFEIIS-UHFFFAOYSA-N -1 3 364.840 3.560 20 0 FHADHM Clc1ccc2[nH]c3c(c2c1)CN(Cc1ccc(-c2nn[n-]n2)cc1)CC3 ZINC000737575609 598252791 /nfs/dbraw/zinc/25/27/91/598252791.db2.gz YXCHLFJAUFEIIS-UHFFFAOYSA-N -1 3 364.840 3.560 20 0 FHADHM C[C@@H](NC(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)C1CC1 ZINC000736119350 598266245 /nfs/dbraw/zinc/26/62/45/598266245.db2.gz XXHQHRCPEVPFJQ-GFCCVEGCSA-N -1 3 364.409 3.579 20 0 FHADHM C[C@@H](NC(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)C1CC1 ZINC000736119350 598266247 /nfs/dbraw/zinc/26/62/47/598266247.db2.gz XXHQHRCPEVPFJQ-GFCCVEGCSA-N -1 3 364.409 3.579 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)N[C@@H](c1ccccc1)C1CCC1 ZINC000738167709 598267583 /nfs/dbraw/zinc/26/75/83/598267583.db2.gz RNDLIEFDTQSXNL-KRWDZBQOSA-N -1 3 366.400 3.669 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)N[C@@H](c1ccccc1)C1CCC1 ZINC000738167709 598267584 /nfs/dbraw/zinc/26/75/84/598267584.db2.gz RNDLIEFDTQSXNL-KRWDZBQOSA-N -1 3 366.400 3.669 20 0 FHADHM O=C(NCC1CCC1)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000738043306 598267877 /nfs/dbraw/zinc/26/78/77/598267877.db2.gz CDRDLHWTOYMYFT-UHFFFAOYSA-N -1 3 364.409 3.581 20 0 FHADHM O=C(NCC1CCC1)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000738043306 598267879 /nfs/dbraw/zinc/26/78/79/598267879.db2.gz CDRDLHWTOYMYFT-UHFFFAOYSA-N -1 3 364.409 3.581 20 0 FHADHM CC(C)(C)CCCCNC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000735602279 598269793 /nfs/dbraw/zinc/26/97/93/598269793.db2.gz CCZDBAUJMOQGJR-UHFFFAOYSA-N -1 3 370.501 3.757 20 0 FHADHM CC(C)(C)CCCCNC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000735602279 598269794 /nfs/dbraw/zinc/26/97/94/598269794.db2.gz CCZDBAUJMOQGJR-UHFFFAOYSA-N -1 3 370.501 3.757 20 0 FHADHM FC(F)(F)c1cc(N2CCC[C@H](C(F)(F)F)C2)ccc1-c1nnn[n-]1 ZINC000737632874 598274026 /nfs/dbraw/zinc/27/40/26/598274026.db2.gz NVPNGXGWSCKGKK-QMMMGPOBSA-N -1 3 365.281 3.664 20 0 FHADHM FC(F)(F)c1cc(N2CCC[C@H](C(F)(F)F)C2)ccc1-c1nn[n-]n1 ZINC000737632874 598274027 /nfs/dbraw/zinc/27/40/27/598274027.db2.gz NVPNGXGWSCKGKK-QMMMGPOBSA-N -1 3 365.281 3.664 20 0 FHADHM CCN(Cc1cccs1)C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000736555054 598276533 /nfs/dbraw/zinc/27/65/33/598276533.db2.gz CPVIYSWEKVSVEZ-UHFFFAOYSA-N -1 3 373.486 3.539 20 0 FHADHM CCN(Cc1cccs1)C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000736555054 598276535 /nfs/dbraw/zinc/27/65/35/598276535.db2.gz CPVIYSWEKVSVEZ-UHFFFAOYSA-N -1 3 373.486 3.539 20 0 FHADHM C[C@@H](Sc1cccc(Cl)c1)C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000736189424 598294376 /nfs/dbraw/zinc/29/43/76/598294376.db2.gz CEDLIUWQUKAVTD-SNVBAGLBSA-N -1 3 359.842 3.639 20 0 FHADHM C[C@@H](Sc1cccc(Cl)c1)C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000736189424 598294377 /nfs/dbraw/zinc/29/43/77/598294377.db2.gz CEDLIUWQUKAVTD-SNVBAGLBSA-N -1 3 359.842 3.639 20 0 FHADHM CC(C)CC[C@H](C)NC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000735796677 598316690 /nfs/dbraw/zinc/31/66/90/598316690.db2.gz GLYYSTRUVRUHCF-JTQLQIEISA-N -1 3 352.895 3.631 20 0 FHADHM CC(C)CC[C@H](C)NC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000735796677 598316692 /nfs/dbraw/zinc/31/66/92/598316692.db2.gz GLYYSTRUVRUHCF-JTQLQIEISA-N -1 3 352.895 3.631 20 0 FHADHM Cc1cc(F)ccc1NC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000737270141 598317812 /nfs/dbraw/zinc/31/78/12/598317812.db2.gz JTNUKRSLARNSOL-UHFFFAOYSA-N -1 3 362.821 3.777 20 0 FHADHM Cc1cc(F)ccc1NC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000737270141 598317814 /nfs/dbraw/zinc/31/78/14/598317814.db2.gz JTNUKRSLARNSOL-UHFFFAOYSA-N -1 3 362.821 3.777 20 0 FHADHM CC(C)CCN(C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)C1CC1 ZINC000735796931 598318282 /nfs/dbraw/zinc/31/82/82/598318282.db2.gz KDKXSKPAUUVIEW-UHFFFAOYSA-N -1 3 364.906 3.727 20 0 FHADHM CC(C)CCN(C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)C1CC1 ZINC000735796931 598318283 /nfs/dbraw/zinc/31/82/83/598318283.db2.gz KDKXSKPAUUVIEW-UHFFFAOYSA-N -1 3 364.906 3.727 20 0 FHADHM C[C@H]1CCC[C@H](N(C)C(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)C1 ZINC000736247111 598318301 /nfs/dbraw/zinc/31/83/01/598318301.db2.gz AALYXPLVBKMRAZ-JQWIXIFHSA-N -1 3 364.906 3.727 20 0 FHADHM C[C@H]1CCC[C@H](N(C)C(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)C1 ZINC000736247111 598318302 /nfs/dbraw/zinc/31/83/02/598318302.db2.gz AALYXPLVBKMRAZ-JQWIXIFHSA-N -1 3 364.906 3.727 20 0 FHADHM Cc1ccc(CNC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c(C)c1 ZINC000737342744 598320910 /nfs/dbraw/zinc/32/09/10/598320910.db2.gz OSYHOCNQPBBQMM-UHFFFAOYSA-N -1 3 372.885 3.624 20 0 FHADHM Cc1ccc(CNC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c(C)c1 ZINC000737342744 598320913 /nfs/dbraw/zinc/32/09/13/598320913.db2.gz OSYHOCNQPBBQMM-UHFFFAOYSA-N -1 3 372.885 3.624 20 0 FHADHM Cc1cc(C)c(NC(=O)NCc2ccc(-c3nnn[n-]3)cc2F)c(Cl)c1 ZINC000737248073 598322277 /nfs/dbraw/zinc/32/22/77/598322277.db2.gz DMDIYJIAYDXFKC-UHFFFAOYSA-N -1 3 374.807 3.598 20 0 FHADHM Cc1cc(C)c(NC(=O)NCc2ccc(-c3nn[n-]n3)cc2F)c(Cl)c1 ZINC000737248073 598322278 /nfs/dbraw/zinc/32/22/78/598322278.db2.gz DMDIYJIAYDXFKC-UHFFFAOYSA-N -1 3 374.807 3.598 20 0 FHADHM CC(C)(C)c1nc(C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)cs1 ZINC000735656007 598324912 /nfs/dbraw/zinc/32/49/12/598324912.db2.gz FKINNSVBNALMAD-UHFFFAOYSA-N -1 3 362.846 3.526 20 0 FHADHM CC(C)(C)c1nc(C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)cs1 ZINC000735656007 598324913 /nfs/dbraw/zinc/32/49/13/598324913.db2.gz FKINNSVBNALMAD-UHFFFAOYSA-N -1 3 362.846 3.526 20 0 FHADHM Fc1cccc(CC2CCN(c3ncc(-c4nnn[n-]4)cc3Cl)CC2)c1 ZINC000737667257 598391438 /nfs/dbraw/zinc/39/14/38/598391438.db2.gz OIRZZGLJYQIRDW-UHFFFAOYSA-N -1 3 372.835 3.513 20 0 FHADHM Fc1cccc(CC2CCN(c3ncc(-c4nn[n-]n4)cc3Cl)CC2)c1 ZINC000737667257 598391440 /nfs/dbraw/zinc/39/14/40/598391440.db2.gz OIRZZGLJYQIRDW-UHFFFAOYSA-N -1 3 372.835 3.513 20 0 FHADHM CCCOc1ccc([C@H](C)Nc2ncc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000736489903 598391908 /nfs/dbraw/zinc/39/19/08/598391908.db2.gz DPZPBCMRDMUMPU-NSHDSACASA-N -1 3 358.833 3.877 20 0 FHADHM CCCOc1ccc([C@H](C)Nc2ncc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000736489903 598391910 /nfs/dbraw/zinc/39/19/10/598391910.db2.gz DPZPBCMRDMUMPU-NSHDSACASA-N -1 3 358.833 3.877 20 0 FHADHM C[C@H](Sc1ccc(-c2nnn[n-]2)cc1)C(=O)Nc1cccc(Cl)c1 ZINC000736194203 598414284 /nfs/dbraw/zinc/41/42/84/598414284.db2.gz XRXDBAQSHLAMCB-JTQLQIEISA-N -1 3 359.842 3.639 20 0 FHADHM C[C@H](Sc1ccc(-c2nn[n-]n2)cc1)C(=O)Nc1cccc(Cl)c1 ZINC000736194203 598414286 /nfs/dbraw/zinc/41/42/86/598414286.db2.gz XRXDBAQSHLAMCB-JTQLQIEISA-N -1 3 359.842 3.639 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)[C@H]1CCCc2sccc21 ZINC000823314844 607354623 /nfs/dbraw/zinc/35/46/23/607354623.db2.gz SIAYNVZEUSMOTG-NSHDSACASA-N -1 3 359.842 3.640 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)[C@H]1CCCc2sccc21 ZINC000823314844 607354625 /nfs/dbraw/zinc/35/46/25/607354625.db2.gz SIAYNVZEUSMOTG-NSHDSACASA-N -1 3 359.842 3.640 20 0 FHADHM CSc1ccsc1C(=O)Nc1sc(C)c(C)c1-c1nnn[n-]1 ZINC000737193075 598419542 /nfs/dbraw/zinc/41/95/42/598419542.db2.gz WAZYCHRPGVYIAB-UHFFFAOYSA-N -1 3 351.482 3.581 20 0 FHADHM CSc1ccsc1C(=O)Nc1sc(C)c(C)c1-c1nn[n-]n1 ZINC000737193075 598419544 /nfs/dbraw/zinc/41/95/44/598419544.db2.gz WAZYCHRPGVYIAB-UHFFFAOYSA-N -1 3 351.482 3.581 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)Nc1cc(F)ccc1F ZINC000735873998 598425442 /nfs/dbraw/zinc/42/54/42/598425442.db2.gz KYNCINMVPHEOBM-UHFFFAOYSA-N -1 3 372.379 3.587 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)Nc1cc(F)ccc1F ZINC000735873998 598425443 /nfs/dbraw/zinc/42/54/43/598425443.db2.gz KYNCINMVPHEOBM-UHFFFAOYSA-N -1 3 372.379 3.587 20 0 FHADHM Cc1ccc(NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)c(F)c1 ZINC000737357418 598426840 /nfs/dbraw/zinc/42/68/40/598426840.db2.gz QAENYWONPNHXSU-UHFFFAOYSA-N -1 3 368.416 3.757 20 0 FHADHM Cc1ccc(NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)c(F)c1 ZINC000737357418 598426841 /nfs/dbraw/zinc/42/68/41/598426841.db2.gz QAENYWONPNHXSU-UHFFFAOYSA-N -1 3 368.416 3.757 20 0 FHADHM CCCCN(C)c1ccc(NC(=O)Nc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000736453919 598428719 /nfs/dbraw/zinc/42/87/19/598428719.db2.gz TVOHMHUBVYNAMF-UHFFFAOYSA-N -1 3 365.441 3.747 20 0 FHADHM CCCCN(C)c1ccc(NC(=O)Nc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000736453919 598428720 /nfs/dbraw/zinc/42/87/20/598428720.db2.gz TVOHMHUBVYNAMF-UHFFFAOYSA-N -1 3 365.441 3.747 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NC(=O)N[C@H](C)c1ccccc1 ZINC000735906762 598430842 /nfs/dbraw/zinc/43/08/42/598430842.db2.gz WHFTURCKHHBZJQ-CYBMUJFWSA-N -1 3 366.425 3.537 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NC(=O)N[C@H](C)c1ccccc1 ZINC000735906762 598430844 /nfs/dbraw/zinc/43/08/44/598430844.db2.gz WHFTURCKHHBZJQ-CYBMUJFWSA-N -1 3 366.425 3.537 20 0 FHADHM CC(C)[C@H](CCc1ccccc1)OC(=O)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000735711256 598431002 /nfs/dbraw/zinc/43/10/02/598431002.db2.gz XKIGIYMMZZPYRK-IBGZPJMESA-N -1 3 364.449 3.610 20 0 FHADHM CC(C)[C@H](CCc1ccccc1)OC(=O)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000735711256 598431005 /nfs/dbraw/zinc/43/10/05/598431005.db2.gz XKIGIYMMZZPYRK-IBGZPJMESA-N -1 3 364.449 3.610 20 0 FHADHM Cc1ccc(-c2nnc(SCc3cccc(-c4nnn[n-]4)c3)o2)c(C)c1 ZINC000737287718 598439915 /nfs/dbraw/zinc/43/99/15/598439915.db2.gz GSNGFQSUYBFIHU-UHFFFAOYSA-N -1 3 364.434 3.826 20 0 FHADHM Cc1ccc(-c2nnc(SCc3cccc(-c4nn[n-]n4)c3)o2)c(C)c1 ZINC000737287718 598439917 /nfs/dbraw/zinc/43/99/17/598439917.db2.gz GSNGFQSUYBFIHU-UHFFFAOYSA-N -1 3 364.434 3.826 20 0 FHADHM Cc1ccc(-c2nnc(SCc3ccccc3-c3nnn[n-]3)o2)c(C)c1 ZINC000737288557 598439937 /nfs/dbraw/zinc/43/99/37/598439937.db2.gz LLPQJVBYOHFOPE-UHFFFAOYSA-N -1 3 364.434 3.826 20 0 FHADHM Cc1ccc(-c2nnc(SCc3ccccc3-c3nn[n-]n3)o2)c(C)c1 ZINC000737288557 598439940 /nfs/dbraw/zinc/43/99/40/598439940.db2.gz LLPQJVBYOHFOPE-UHFFFAOYSA-N -1 3 364.434 3.826 20 0 FHADHM COc1ccc(CCCCCC(=O)Nc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000591176423 598440364 /nfs/dbraw/zinc/44/03/64/598440364.db2.gz UYOPMWPFMSVCTP-UHFFFAOYSA-N -1 3 365.437 3.617 20 0 FHADHM COc1ccc(CCCCCC(=O)Nc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000591176423 598440365 /nfs/dbraw/zinc/44/03/65/598440365.db2.gz UYOPMWPFMSVCTP-UHFFFAOYSA-N -1 3 365.437 3.617 20 0 FHADHM COc1ccccc1C(C)=CC(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000737143768 598441574 /nfs/dbraw/zinc/44/15/74/598441574.db2.gz ZIOZBWGZJFUBHD-PKNBQFBNSA-N -1 3 369.812 3.571 20 0 FHADHM COc1ccccc1C(C)=CC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000737143768 598441575 /nfs/dbraw/zinc/44/15/75/598441575.db2.gz ZIOZBWGZJFUBHD-PKNBQFBNSA-N -1 3 369.812 3.571 20 0 FHADHM C[C@@H]1C[C@H](CC(=O)N(C)Cc2cccc(-c3nnn[n-]3)c2)CC(C)(C)C1 ZINC000736227574 598442113 /nfs/dbraw/zinc/44/21/13/598442113.db2.gz LNKATRZDDZPTAD-GDBMZVCRSA-N -1 3 355.486 3.678 20 0 FHADHM C[C@@H]1C[C@H](CC(=O)N(C)Cc2cccc(-c3nn[n-]n3)c2)CC(C)(C)C1 ZINC000736227574 598442114 /nfs/dbraw/zinc/44/21/14/598442114.db2.gz LNKATRZDDZPTAD-GDBMZVCRSA-N -1 3 355.486 3.678 20 0 FHADHM C[C@H]1C[C@H](CC(=O)N(C)Cc2cccc(-c3nnn[n-]3)c2)CC(C)(C)C1 ZINC000736227576 598442165 /nfs/dbraw/zinc/44/21/65/598442165.db2.gz LNKATRZDDZPTAD-GOEBONIOSA-N -1 3 355.486 3.678 20 0 FHADHM C[C@H]1C[C@H](CC(=O)N(C)Cc2cccc(-c3nn[n-]n3)c2)CC(C)(C)C1 ZINC000736227576 598442166 /nfs/dbraw/zinc/44/21/66/598442166.db2.gz LNKATRZDDZPTAD-GOEBONIOSA-N -1 3 355.486 3.678 20 0 FHADHM CCN(C(=O)CSCc1ccc(-c2nnn[n-]2)cc1)[C@@H]1CCCC[C@H]1C ZINC000736506195 598445082 /nfs/dbraw/zinc/44/50/82/598445082.db2.gz XQACSMNLKSZXBD-RHSMWYFYSA-N -1 3 373.526 3.527 20 0 FHADHM CCN(C(=O)CSCc1ccc(-c2nn[n-]n2)cc1)[C@@H]1CCCC[C@H]1C ZINC000736506195 598445083 /nfs/dbraw/zinc/44/50/83/598445083.db2.gz XQACSMNLKSZXBD-RHSMWYFYSA-N -1 3 373.526 3.527 20 0 FHADHM Cc1cccc(C2(NC(=O)C=Cc3ccccc3-c3nnn[n-]3)CCCC2)c1 ZINC000737391074 598447831 /nfs/dbraw/zinc/44/78/31/598447831.db2.gz XRABKPXQTJKJQW-QXMHVHEDSA-N -1 3 373.460 3.774 20 0 FHADHM Cc1cccc(C2(NC(=O)C=Cc3ccccc3-c3nn[n-]n3)CCCC2)c1 ZINC000737391074 598447833 /nfs/dbraw/zinc/44/78/33/598447833.db2.gz XRABKPXQTJKJQW-QXMHVHEDSA-N -1 3 373.460 3.774 20 0 FHADHM Cc1ccccc1CN(C(=O)Nc1cc(-c2nnn[n-]2)ccc1C)C1CC1 ZINC000737426026 598477154 /nfs/dbraw/zinc/47/71/54/598477154.db2.gz HKXFUGLQALVCSC-UHFFFAOYSA-N -1 3 362.437 3.680 20 0 FHADHM Cc1ccccc1CN(C(=O)Nc1cc(-c2nn[n-]n2)ccc1C)C1CC1 ZINC000737426026 598477155 /nfs/dbraw/zinc/47/71/55/598477155.db2.gz HKXFUGLQALVCSC-UHFFFAOYSA-N -1 3 362.437 3.680 20 0 FHADHM CC[C@@](C)(NC(=O)Nc1cc(-c2nnn[n-]2)ccc1C)c1ccccc1 ZINC000736316373 598483892 /nfs/dbraw/zinc/48/38/92/598483892.db2.gz WLKXZYRJFOIISL-LJQANCHMSA-N -1 3 350.426 3.622 20 0 FHADHM CC[C@@](C)(NC(=O)Nc1cc(-c2nn[n-]n2)ccc1C)c1ccccc1 ZINC000736316373 598483893 /nfs/dbraw/zinc/48/38/93/598483893.db2.gz WLKXZYRJFOIISL-LJQANCHMSA-N -1 3 350.426 3.622 20 0 FHADHM C[C@H](OC(=O)Cc1csc2ccccc12)c1cccc(-c2nnn[n-]2)c1 ZINC000736162023 598487738 /nfs/dbraw/zinc/48/77/38/598487738.db2.gz ZGOGRHOUDYVZFJ-LBPRGKRZSA-N -1 3 364.430 3.928 20 0 FHADHM C[C@H](OC(=O)Cc1csc2ccccc12)c1cccc(-c2nn[n-]n2)c1 ZINC000736162023 598487740 /nfs/dbraw/zinc/48/77/40/598487740.db2.gz ZGOGRHOUDYVZFJ-LBPRGKRZSA-N -1 3 364.430 3.928 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)c1csc2ccccc12 ZINC000735660593 598490383 /nfs/dbraw/zinc/49/03/83/598490383.db2.gz DSHQWCSTGICFFD-UHFFFAOYSA-N -1 3 366.450 3.890 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)c1csc2ccccc12 ZINC000735660593 598490384 /nfs/dbraw/zinc/49/03/84/598490384.db2.gz DSHQWCSTGICFFD-UHFFFAOYSA-N -1 3 366.450 3.890 20 0 FHADHM C[C@H](OC(=O)Cc1ccc2c(c1)CCCC2)c1cccc(-c2nnn[n-]2)c1 ZINC000736154710 598492003 /nfs/dbraw/zinc/49/20/03/598492003.db2.gz AOEPSGXYCRXYSQ-AWEZNQCLSA-N -1 3 362.433 3.592 20 0 FHADHM C[C@H](OC(=O)Cc1ccc2c(c1)CCCC2)c1cccc(-c2nn[n-]n2)c1 ZINC000736154710 598492006 /nfs/dbraw/zinc/49/20/06/598492006.db2.gz AOEPSGXYCRXYSQ-AWEZNQCLSA-N -1 3 362.433 3.592 20 0 FHADHM C[C@@H](Oc1cccc(Cl)c1)C(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000736180423 598492043 /nfs/dbraw/zinc/49/20/43/598492043.db2.gz ILEPSSISNIGYIT-VXGBXAGGSA-N -1 3 372.812 3.592 20 0 FHADHM C[C@@H](Oc1cccc(Cl)c1)C(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000736180423 598492044 /nfs/dbraw/zinc/49/20/44/598492044.db2.gz ILEPSSISNIGYIT-VXGBXAGGSA-N -1 3 372.812 3.592 20 0 FHADHM Cc1cc(C)c(-c2nnn[n-]2)c(SCc2csc(-c3ccoc3)n2)n1 ZINC000737241632 598492718 /nfs/dbraw/zinc/49/27/18/598492718.db2.gz SRQRJPJRDGWKKB-UHFFFAOYSA-N -1 3 370.463 3.887 20 0 FHADHM Cc1cc(C)c(-c2nn[n-]n2)c(SCc2csc(-c3ccoc3)n2)n1 ZINC000737241632 598492719 /nfs/dbraw/zinc/49/27/19/598492719.db2.gz SRQRJPJRDGWKKB-UHFFFAOYSA-N -1 3 370.463 3.887 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)C[C@@H](C)CC(C)C ZINC000736629075 598494860 /nfs/dbraw/zinc/49/48/60/598494860.db2.gz TUIHBWBYPPNEEA-NSHDSACASA-N -1 3 366.849 3.897 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)C[C@@H](C)CC(C)C ZINC000736629075 598494861 /nfs/dbraw/zinc/49/48/61/598494861.db2.gz TUIHBWBYPPNEEA-NSHDSACASA-N -1 3 366.849 3.897 20 0 FHADHM Clc1cc(N2CCC(COc3ccccc3)CC2)ccc1-c1nnn[n-]1 ZINC000737562965 598508548 /nfs/dbraw/zinc/50/85/48/598508548.db2.gz BLKPWMXWUPJFQR-UHFFFAOYSA-N -1 3 369.856 3.816 20 0 FHADHM Clc1cc(N2CCC(COc3ccccc3)CC2)ccc1-c1nn[n-]n1 ZINC000737562965 598508549 /nfs/dbraw/zinc/50/85/49/598508549.db2.gz BLKPWMXWUPJFQR-UHFFFAOYSA-N -1 3 369.856 3.816 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H](C)c2cccc(OC)c2)c1-c1nnn[n-]1 ZINC000736669344 598513905 /nfs/dbraw/zinc/51/39/05/598513905.db2.gz FLUCSFRUZQSWFW-JTQLQIEISA-N -1 3 371.466 3.550 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H](C)c2cccc(OC)c2)c1-c1nn[n-]n1 ZINC000736669344 598513907 /nfs/dbraw/zinc/51/39/07/598513907.db2.gz FLUCSFRUZQSWFW-JTQLQIEISA-N -1 3 371.466 3.550 20 0 FHADHM CCc1c(C)sc(NC(=O)CCc2ccc(C)cc2)c1-c1nnn[n-]1 ZINC000736669811 598516935 /nfs/dbraw/zinc/51/69/35/598516935.db2.gz LVFDQTUQELYIDW-UHFFFAOYSA-N -1 3 355.467 3.679 20 0 FHADHM CCc1c(C)sc(NC(=O)CCc2ccc(C)cc2)c1-c1nn[n-]n1 ZINC000736669811 598516937 /nfs/dbraw/zinc/51/69/37/598516937.db2.gz LVFDQTUQELYIDW-UHFFFAOYSA-N -1 3 355.467 3.679 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H]2C[C@@H]2c2ccc(F)cc2)c1-c1nnn[n-]1 ZINC000736670805 598517080 /nfs/dbraw/zinc/51/70/80/598517080.db2.gz SHEHMMSNJBCALZ-KGLIPLIRSA-N -1 3 371.441 3.680 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H]2C[C@@H]2c2ccc(F)cc2)c1-c1nn[n-]n1 ZINC000736670805 598517082 /nfs/dbraw/zinc/51/70/82/598517082.db2.gz SHEHMMSNJBCALZ-KGLIPLIRSA-N -1 3 371.441 3.680 20 0 FHADHM CCc1c(C)sc(NC(=O)Cc2ccc(C)c(C)c2)c1-c1nnn[n-]1 ZINC000736674136 598518757 /nfs/dbraw/zinc/51/87/57/598518757.db2.gz ABXLXMNVBAXJIF-UHFFFAOYSA-N -1 3 355.467 3.597 20 0 FHADHM CCc1c(C)sc(NC(=O)Cc2ccc(C)c(C)c2)c1-c1nn[n-]n1 ZINC000736674136 598518759 /nfs/dbraw/zinc/51/87/59/598518759.db2.gz ABXLXMNVBAXJIF-UHFFFAOYSA-N -1 3 355.467 3.597 20 0 FHADHM Cc1nc(-c2ccccc2)c(C(=O)Nc2ccc(-c3nnn[n-]3)cc2)s1 ZINC000519100738 598530587 /nfs/dbraw/zinc/53/05/87/598530587.db2.gz YQUBLNXYWXFDHS-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1nc(-c2ccccc2)c(C(=O)Nc2ccc(-c3nn[n-]n3)cc2)s1 ZINC000519100738 598530588 /nfs/dbraw/zinc/53/05/88/598530588.db2.gz YQUBLNXYWXFDHS-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM C[C@H](CC(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(F)F)c1ccccc1 ZINC000735974015 598546453 /nfs/dbraw/zinc/54/64/53/598546453.db2.gz DRBNTLXEAJYOQK-LLVKDONJSA-N -1 3 373.363 3.600 20 0 FHADHM C[C@H](CC(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(F)F)c1ccccc1 ZINC000735974015 598546455 /nfs/dbraw/zinc/54/64/55/598546455.db2.gz DRBNTLXEAJYOQK-LLVKDONJSA-N -1 3 373.363 3.600 20 0 FHADHM Fc1cc(OCCOc2cccc3ccccc32)ccc1-c1nnn[n-]1 ZINC000737653799 598547977 /nfs/dbraw/zinc/54/79/77/598547977.db2.gz SBPQBFGMSUAJBF-UHFFFAOYSA-N -1 3 350.353 3.617 20 0 FHADHM Fc1cc(OCCOc2cccc3ccccc32)ccc1-c1nn[n-]n1 ZINC000737653799 598547979 /nfs/dbraw/zinc/54/79/79/598547979.db2.gz 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ZINC000735670636 598555496 /nfs/dbraw/zinc/55/54/96/598555496.db2.gz TTZNOCZRDHMEJG-UHFFFAOYSA-N -1 3 370.844 3.619 20 0 FHADHM Cc1cc(C(=O)Nc2ccc(Oc3cccc(-c4nnn[n-]4)c3)cc2)c(C)[nH]1 ZINC000737239061 598555599 /nfs/dbraw/zinc/55/55/99/598555599.db2.gz ZJXQTPVLENFJGA-UHFFFAOYSA-N -1 3 374.404 3.856 20 0 FHADHM Cc1cc(C(=O)Nc2ccc(Oc3cccc(-c4nn[n-]n4)c3)cc2)c(C)[nH]1 ZINC000737239061 598555601 /nfs/dbraw/zinc/55/56/01/598555601.db2.gz ZJXQTPVLENFJGA-UHFFFAOYSA-N -1 3 374.404 3.856 20 0 FHADHM CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)CCCCCc1cccs1 ZINC000736814706 598568469 /nfs/dbraw/zinc/56/84/69/598568469.db2.gz SIIZNYAPRJWQRU-UHFFFAOYSA-N -1 3 369.494 3.690 20 0 FHADHM CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)CCCCCc1cccs1 ZINC000736814706 598568471 /nfs/dbraw/zinc/56/84/71/598568471.db2.gz SIIZNYAPRJWQRU-UHFFFAOYSA-N -1 3 369.494 3.690 20 0 FHADHM C[C@H](Cc1cccs1)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000736066853 598572202 /nfs/dbraw/zinc/57/22/02/598572202.db2.gz QXYRVSGCXKGBID-SECBINFHSA-N -1 3 353.373 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598588773 /nfs/dbraw/zinc/58/87/73/598588773.db2.gz GDGUBLGVJAANFJ-UHFFFAOYSA-N -1 3 357.414 3.759 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)C1(c2ccc(F)cc2)CCCC1 ZINC000738163686 598592502 /nfs/dbraw/zinc/59/25/02/598592502.db2.gz SMXJNXJPZVOIOF-UHFFFAOYSA-N -1 3 369.375 3.595 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)C1(c2ccc(F)cc2)CCCC1 ZINC000738163686 598592504 /nfs/dbraw/zinc/59/25/04/598592504.db2.gz SMXJNXJPZVOIOF-UHFFFAOYSA-N -1 3 369.375 3.595 20 0 FHADHM CC[C@H](OC(=O)c1ccc(-c2nnn[n-]2)cn1)c1ccc(C(C)(C)C)cc1 ZINC000736382590 598606512 /nfs/dbraw/zinc/60/65/12/598606512.db2.gz MNZSCOIYVHVSAY-KRWDZBQOSA-N -1 3 365.437 3.867 20 0 FHADHM CC[C@H](OC(=O)c1ccc(-c2nn[n-]n2)cn1)c1ccc(C(C)(C)C)cc1 ZINC000736382590 598606513 /nfs/dbraw/zinc/60/65/13/598606513.db2.gz MNZSCOIYVHVSAY-KRWDZBQOSA-N -1 3 365.437 3.867 20 0 FHADHM FC(F)(F)c1cccc(-c2noc(-c3cccc(-c4nnn[n-]4)c3)n2)c1 ZINC000737635452 598608867 /nfs/dbraw/zinc/60/88/67/598608867.db2.gz GMLBTFLDWUQQRC-UHFFFAOYSA-N -1 3 358.283 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CCn1c2ccccc2nc1SCc1ccc(F)cc1-c1nnn[n-]1 ZINC000736712811 598642878 /nfs/dbraw/zinc/64/28/78/598642878.db2.gz CWPJRFUMRXUGFS-UHFFFAOYSA-N -1 3 354.414 3.668 20 0 FHADHM CCn1c2ccccc2nc1SCc1ccc(F)cc1-c1nn[n-]n1 ZINC000736712811 598642879 /nfs/dbraw/zinc/64/28/79/598642879.db2.gz CWPJRFUMRXUGFS-UHFFFAOYSA-N -1 3 354.414 3.668 20 0 FHADHM Cc1ccc(F)c(NC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)c1 ZINC000737345723 598645126 /nfs/dbraw/zinc/64/51/26/598645126.db2.gz VZXNJDZMLOBOMA-UHFFFAOYSA-N -1 3 369.400 3.502 20 0 FHADHM Cc1ccc(F)c(NC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)c1 ZINC000737345723 598645128 /nfs/dbraw/zinc/64/51/28/598645128.db2.gz VZXNJDZMLOBOMA-UHFFFAOYSA-N -1 3 369.400 3.502 20 0 FHADHM Cc1ccc(C(C)(C)C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1 ZINC000737318851 598648922 /nfs/dbraw/zinc/64/89/22/598648922.db2.gz YGTBALMHRARACA-UHFFFAOYSA-N -1 3 355.829 3.745 20 0 FHADHM Cc1ccc(C(C)(C)C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1 ZINC000737318851 598648924 /nfs/dbraw/zinc/64/89/24/598648924.db2.gz 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C[C@H]1Cc2ccccc2[C@@H]1NC(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736298459 598727692 /nfs/dbraw/zinc/72/76/92/598727692.db2.gz QAQANYJRVJNDCP-MGPLVRAMSA-N -1 3 368.828 3.575 20 0 FHADHM C[C@H]1Cc2ccccc2[C@@H]1NC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736298459 598727693 /nfs/dbraw/zinc/72/76/93/598727693.db2.gz QAQANYJRVJNDCP-MGPLVRAMSA-N -1 3 368.828 3.575 20 0 FHADHM C[C@H]1Cc2ccccc2[C@H]1NC(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736298461 598727733 /nfs/dbraw/zinc/72/77/33/598727733.db2.gz QAQANYJRVJNDCP-QFYYESIMSA-N -1 3 368.828 3.575 20 0 FHADHM C[C@H]1Cc2ccccc2[C@H]1NC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736298461 598727734 /nfs/dbraw/zinc/72/77/34/598727734.db2.gz QAQANYJRVJNDCP-QFYYESIMSA-N -1 3 368.828 3.575 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)ccc1OC(=O)C[C@H](CC)c1ccccc1 ZINC000736629600 598734564 /nfs/dbraw/zinc/73/45/64/598734564.db2.gz XIVWZOOVKMDJQE-AWEZNQCLSA-N -1 3 366.421 3.755 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)ccc1OC(=O)C[C@H](CC)c1ccccc1 ZINC000736629600 598734565 /nfs/dbraw/zinc/73/45/65/598734565.db2.gz XIVWZOOVKMDJQE-AWEZNQCLSA-N -1 3 366.421 3.755 20 0 FHADHM CCC(=CC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1)c1ccccc1 ZINC000736301827 598734712 /nfs/dbraw/zinc/73/47/12/598734712.db2.gz CCJQSVDUCOMOLU-SAPNQHFASA-N -1 3 373.460 3.851 20 0 FHADHM CCC(=CC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1)c1ccccc1 ZINC000736301827 598734714 /nfs/dbraw/zinc/73/47/14/598734714.db2.gz CCJQSVDUCOMOLU-SAPNQHFASA-N -1 3 373.460 3.851 20 0 FHADHM C[C@@H](CSc1ccccc1)C(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000736047902 598734847 /nfs/dbraw/zinc/73/48/47/598734847.db2.gz TTZYIEXOBMFODI-UONOGXRCSA-N -1 3 368.462 3.899 20 0 FHADHM C[C@@H](CSc1ccccc1)C(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000736047902 598734848 /nfs/dbraw/zinc/73/48/48/598734848.db2.gz TTZYIEXOBMFODI-UONOGXRCSA-N -1 3 368.462 3.899 20 0 FHADHM COc1ccc([C@@H](C)Nc2cc(-c3nnn[n-]3)ccc2OC)cc1Cl ZINC000737074003 598767958 /nfs/dbraw/zinc/76/79/58/598767958.db2.gz HBUKLXCFKNGJJG-SNVBAGLBSA-N -1 3 359.817 3.710 20 0 FHADHM COc1ccc([C@@H](C)Nc2cc(-c3nn[n-]n3)ccc2OC)cc1Cl ZINC000737074003 598767959 /nfs/dbraw/zinc/76/79/59/598767959.db2.gz HBUKLXCFKNGJJG-SNVBAGLBSA-N -1 3 359.817 3.710 20 0 FHADHM Fc1cc(F)c2ncc(-c3nnn[n-]3)c(NCc3ccccc3Cl)c2c1 ZINC000737654017 598769381 /nfs/dbraw/zinc/76/93/81/598769381.db2.gz VTJHFRPDFDCOCV-UHFFFAOYSA-N -1 3 372.766 3.959 20 0 FHADHM Fc1cc(F)c2ncc(-c3nn[n-]n3)c(NCc3ccccc3Cl)c2c1 ZINC000737654017 598769382 /nfs/dbraw/zinc/76/93/82/598769382.db2.gz VTJHFRPDFDCOCV-UHFFFAOYSA-N -1 3 372.766 3.959 20 0 FHADHM CCSc1ccc([C@H](C)NC(=O)Nc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736668455 598769432 /nfs/dbraw/zinc/76/94/32/598769432.db2.gz ZSENUSLGYNADEI-LBPRGKRZSA-N -1 3 368.466 3.861 20 0 FHADHM CCSc1ccc([C@H](C)NC(=O)Nc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736668455 598769434 /nfs/dbraw/zinc/76/94/34/598769434.db2.gz ZSENUSLGYNADEI-LBPRGKRZSA-N -1 3 368.466 3.861 20 0 FHADHM O=C(Nc1sc2c(c1-c1nnn[n-]1)CCC2)c1cccc(C(F)F)c1 ZINC000738212549 598791434 /nfs/dbraw/zinc/79/14/34/598791434.db2.gz WSBKXIULDSDIGD-UHFFFAOYSA-N -1 3 361.377 3.607 20 0 FHADHM O=C(Nc1sc2c(c1-c1nn[n-]n1)CCC2)c1cccc(C(F)F)c1 ZINC000738212549 598791435 /nfs/dbraw/zinc/79/14/35/598791435.db2.gz WSBKXIULDSDIGD-UHFFFAOYSA-N -1 3 361.377 3.607 20 0 FHADHM COc1cc(CNc2ccc(Cl)cc2-c2nnn[n-]2)ccc1OC(C)C ZINC000737047641 598793117 /nfs/dbraw/zinc/79/31/17/598793117.db2.gz OBRBWEXFCRHZRS-UHFFFAOYSA-N -1 3 373.844 3.928 20 0 FHADHM COc1cc(CNc2ccc(Cl)cc2-c2nn[n-]n2)ccc1OC(C)C ZINC000737047641 598793118 /nfs/dbraw/zinc/79/31/18/598793118.db2.gz OBRBWEXFCRHZRS-UHFFFAOYSA-N -1 3 373.844 3.928 20 0 FHADHM Clc1ccc(NCCCOCCc2ccccc2)c(-c2nnn[n-]2)c1 ZINC000737573006 598794726 /nfs/dbraw/zinc/79/47/26/598794726.db2.gz CWISEGPYRIRWGF-UHFFFAOYSA-N -1 3 357.845 3.581 20 0 FHADHM Clc1ccc(NCCCOCCc2ccccc2)c(-c2nn[n-]n2)c1 ZINC000737573006 598794727 /nfs/dbraw/zinc/79/47/27/598794727.db2.gz CWISEGPYRIRWGF-UHFFFAOYSA-N -1 3 357.845 3.581 20 0 FHADHM CC(C)Oc1ccc(NC(=S)N[C@H]2CCCC[C@H]2C)cc1-c1nnn[n-]1 ZINC000820173556 607367063 /nfs/dbraw/zinc/36/70/63/607367063.db2.gz HTLVHDMYSWNFCH-DOMZBBRYSA-N -1 3 374.514 3.519 20 0 FHADHM CC(C)Oc1ccc(NC(=S)N[C@H]2CCCC[C@H]2C)cc1-c1nn[n-]n1 ZINC000820173556 607367065 /nfs/dbraw/zinc/36/70/65/607367065.db2.gz HTLVHDMYSWNFCH-DOMZBBRYSA-N -1 3 374.514 3.519 20 0 FHADHM CC(C)[C@H](C)C(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)cc1 ZINC000735700423 598803666 /nfs/dbraw/zinc/80/36/66/598803666.db2.gz GLPSNSKLUWIBBM-ZDUSSCGKSA-N -1 3 351.410 3.890 20 0 FHADHM CC(C)[C@H](C)C(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)cc1 ZINC000735700423 598803667 /nfs/dbraw/zinc/80/36/67/598803667.db2.gz GLPSNSKLUWIBBM-ZDUSSCGKSA-N -1 3 351.410 3.890 20 0 FHADHM CC(C)[C@@H](C)C(=O)Nc1cccc(OCc2cccc(-c3nnn[n-]3)c2)c1 ZINC000735699641 598803721 /nfs/dbraw/zinc/80/37/21/598803721.db2.gz CFTVLNOUKZNXAJ-CQSZACIVSA-N -1 3 365.437 3.676 20 0 FHADHM CC(C)[C@@H](C)C(=O)Nc1cccc(OCc2cccc(-c3nn[n-]n3)c2)c1 ZINC000735699641 598803722 /nfs/dbraw/zinc/80/37/22/598803722.db2.gz CFTVLNOUKZNXAJ-CQSZACIVSA-N -1 3 365.437 3.676 20 0 FHADHM Cc1ccc(N(C)C(=S)Nc2ccccc2-c2nnn[n-]2)cc1Cl ZINC000737346456 598822153 /nfs/dbraw/zinc/82/21/53/598822153.db2.gz FWOQEXKNIDVBPA-UHFFFAOYSA-N -1 3 358.858 3.662 20 0 FHADHM Cc1ccc(N(C)C(=S)Nc2ccccc2-c2nn[n-]n2)cc1Cl ZINC000737346456 598822154 /nfs/dbraw/zinc/82/21/54/598822154.db2.gz FWOQEXKNIDVBPA-UHFFFAOYSA-N -1 3 358.858 3.662 20 0 FHADHM CCC[C@@H](CC1CCCC1)C(=O)Nc1cc(-c2nnn[n-]2)ccc1OC ZINC000736421880 598822443 /nfs/dbraw/zinc/82/24/43/598822443.db2.gz FAIYOVYFKOTMIT-HNNXBMFYSA-N -1 3 357.458 3.810 20 0 FHADHM CCC[C@@H](CC1CCCC1)C(=O)Nc1cc(-c2nn[n-]n2)ccc1OC ZINC000736421880 598822444 /nfs/dbraw/zinc/82/24/44/598822444.db2.gz FAIYOVYFKOTMIT-HNNXBMFYSA-N -1 3 357.458 3.810 20 0 FHADHM Cc1ccc(N(C)C(=O)CSc2ccc(-c3nnn[n-]3)cc2)cc1Cl ZINC000737346462 598822617 /nfs/dbraw/zinc/82/26/17/598822617.db2.gz GBDOCZMDAAYFID-UHFFFAOYSA-N -1 3 373.869 3.584 20 0 FHADHM Cc1ccc(N(C)C(=O)CSc2ccc(-c3nn[n-]n3)cc2)cc1Cl ZINC000737346462 598822618 /nfs/dbraw/zinc/82/26/18/598822618.db2.gz GBDOCZMDAAYFID-UHFFFAOYSA-N -1 3 373.869 3.584 20 0 FHADHM CCCN(CC1CC1)C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000821094394 599294589 /nfs/dbraw/zinc/29/45/89/599294589.db2.gz IJPUTIRJQTVCSK-UHFFFAOYSA-N -1 3 368.363 3.539 20 0 FHADHM CCN(C(=O)c1cc2cc(Cl)ccc2o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736505110 599309195 /nfs/dbraw/zinc/30/91/95/599309195.db2.gz HAHKVEHJUSNUAM-UHFFFAOYSA-N -1 3 367.796 3.933 20 0 FHADHM CCN(C(=O)c1cc2cc(Cl)ccc2o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736505110 599309198 /nfs/dbraw/zinc/30/91/98/599309198.db2.gz HAHKVEHJUSNUAM-UHFFFAOYSA-N -1 3 367.796 3.933 20 0 FHADHM CCN(C(=O)c1ccccc1C(F)(F)F)c1ccc(-c2nnn[n-]2)cc1 ZINC000736509156 599309927 /nfs/dbraw/zinc/30/99/27/599309927.db2.gz TWHYUUBDWGMNSD-UHFFFAOYSA-N -1 3 361.327 3.552 20 0 FHADHM CCN(C(=O)c1ccccc1C(F)(F)F)c1ccc(-c2nn[n-]n2)cc1 ZINC000736509156 599309929 /nfs/dbraw/zinc/30/99/29/599309929.db2.gz TWHYUUBDWGMNSD-UHFFFAOYSA-N -1 3 361.327 3.552 20 0 FHADHM CCN(C(=O)c1cc(SC)ccc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000736505046 599312186 /nfs/dbraw/zinc/31/21/86/599312186.db2.gz GFVFAWCITUWWPL-UHFFFAOYSA-N -1 3 373.869 3.909 20 0 FHADHM CCN(C(=O)c1cc(SC)ccc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000736505046 599312188 /nfs/dbraw/zinc/31/21/88/599312188.db2.gz GFVFAWCITUWWPL-UHFFFAOYSA-N -1 3 373.869 3.909 20 0 FHADHM C[C@H](SC[C@@H]1OCCc2ccccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000736187427 599325655 /nfs/dbraw/zinc/32/56/55/599325655.db2.gz AIXDRRRFUXBIPB-UGSOOPFHSA-N -1 3 352.463 3.975 20 0 FHADHM C[C@H](SC[C@@H]1OCCc2ccccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000736187427 599325658 /nfs/dbraw/zinc/32/56/58/599325658.db2.gz AIXDRRRFUXBIPB-UGSOOPFHSA-N -1 3 352.463 3.975 20 0 FHADHM C[C@@H](S[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)C(=O)Nc1ccccc1 ZINC000736188004 599327582 /nfs/dbraw/zinc/32/75/82/599327582.db2.gz GIYSBZQJOCOVOI-QWHCGFSZSA-N -1 3 353.451 3.688 20 0 FHADHM C[C@@H](S[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)C(=O)Nc1ccccc1 ZINC000736188004 599327583 /nfs/dbraw/zinc/32/75/83/599327583.db2.gz GIYSBZQJOCOVOI-QWHCGFSZSA-N -1 3 353.451 3.688 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NCc1ccc(OCC(F)(F)F)cc1 ZINC000737296583 599328680 /nfs/dbraw/zinc/32/86/80/599328680.db2.gz LPQLJVKKJLQPRV-UHFFFAOYSA-N -1 3 363.343 3.728 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NCc1ccc(OCC(F)(F)F)cc1 ZINC000737296583 599328683 /nfs/dbraw/zinc/32/86/83/599328683.db2.gz LPQLJVKKJLQPRV-UHFFFAOYSA-N -1 3 363.343 3.728 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NCc1cc(Br)cs1 ZINC000737296539 599328738 /nfs/dbraw/zinc/32/87/38/599328738.db2.gz KCWSXKFTICBWCI-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NCc1cc(Br)cs1 ZINC000737296539 599328740 /nfs/dbraw/zinc/32/87/40/599328740.db2.gz KCWSXKFTICBWCI-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM C[C@@H](S[C@H](C)c1ccc(-c2nnn[n-]2)cc1)C(=O)NCC1CCCCC1 ZINC000736190356 599328990 /nfs/dbraw/zinc/32/89/90/599328990.db2.gz RKASBGPRBUJSEB-ZIAGYGMSSA-N -1 3 373.526 3.746 20 0 FHADHM C[C@@H](S[C@H](C)c1ccc(-c2nn[n-]n2)cc1)C(=O)NCC1CCCCC1 ZINC000736190356 599328993 /nfs/dbraw/zinc/32/89/93/599328993.db2.gz RKASBGPRBUJSEB-ZIAGYGMSSA-N -1 3 373.526 3.746 20 0 FHADHM Cc1ccc(-c2cc(CNc3ccc(F)c(-c4nnn[n-]4)c3)on2)cc1 ZINC000737288479 599330073 /nfs/dbraw/zinc/33/00/73/599330073.db2.gz PAYBFABUBVZLJN-UHFFFAOYSA-N -1 3 350.357 3.581 20 0 FHADHM Cc1ccc(-c2cc(CNc3ccc(F)c(-c4nn[n-]n4)c3)on2)cc1 ZINC000737288479 599330075 /nfs/dbraw/zinc/33/00/75/599330075.db2.gz PAYBFABUBVZLJN-UHFFFAOYSA-N -1 3 350.357 3.581 20 0 FHADHM Cc1ccc(-c2nc(CNc3ccc(F)c(-c4nnn[n-]4)c3)cs2)o1 ZINC000737286984 599330453 /nfs/dbraw/zinc/33/04/53/599330453.db2.gz BGMFHADYONXSMC-UHFFFAOYSA-N -1 3 356.386 3.643 20 0 FHADHM Cc1ccc(-c2nc(CNc3ccc(F)c(-c4nn[n-]n4)c3)cs2)o1 ZINC000737286984 599330455 /nfs/dbraw/zinc/33/04/55/599330455.db2.gz BGMFHADYONXSMC-UHFFFAOYSA-N -1 3 356.386 3.643 20 0 FHADHM Cc1ccc(NC(=O)CS[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1C ZINC000737357647 599331775 /nfs/dbraw/zinc/33/17/75/599331775.db2.gz QKDQKQQMRWRKQG-CQSZACIVSA-N -1 3 367.478 3.916 20 0 FHADHM Cc1ccc(NC(=O)CS[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1C ZINC000737357647 599331777 /nfs/dbraw/zinc/33/17/77/599331777.db2.gz QKDQKQQMRWRKQG-CQSZACIVSA-N -1 3 367.478 3.916 20 0 FHADHM O=C(CSc1ccccc1-c1nnn[n-]1)Nc1ccc2ccccc2c1 ZINC000823071022 599345960 /nfs/dbraw/zinc/34/59/60/599345960.db2.gz XUAUUMSTJXDTMH-UHFFFAOYSA-N -1 3 361.430 3.751 20 0 FHADHM O=C(CSc1ccccc1-c1nn[n-]n1)Nc1ccc2ccccc2c1 ZINC000823071022 599345963 /nfs/dbraw/zinc/34/59/63/599345963.db2.gz XUAUUMSTJXDTMH-UHFFFAOYSA-N -1 3 361.430 3.751 20 0 FHADHM CCc1ccccc1NC(=O)[C@@H](C)Sc1ccccc1-c1nnn[n-]1 ZINC000821496893 599350117 /nfs/dbraw/zinc/35/01/17/599350117.db2.gz KVGGPOJMLDZZAU-GFCCVEGCSA-N -1 3 353.451 3.548 20 0 FHADHM CCc1ccccc1NC(=O)[C@@H](C)Sc1ccccc1-c1nn[n-]n1 ZINC000821496893 599350119 /nfs/dbraw/zinc/35/01/19/599350119.db2.gz KVGGPOJMLDZZAU-GFCCVEGCSA-N -1 3 353.451 3.548 20 0 FHADHM CCC[C@H](NC(=O)CSc1ccccc1-c1nnn[n-]1)c1ccccc1 ZINC000821020620 599350223 /nfs/dbraw/zinc/35/02/23/599350223.db2.gz FYINDPUEIJQYKJ-INIZCTEOSA-N -1 3 367.478 3.616 20 0 FHADHM CCC[C@H](NC(=O)CSc1ccccc1-c1nn[n-]n1)c1ccccc1 ZINC000821020620 599350226 /nfs/dbraw/zinc/35/02/26/599350226.db2.gz FYINDPUEIJQYKJ-INIZCTEOSA-N -1 3 367.478 3.616 20 0 FHADHM Cc1cc2nc(N[C@H](C)c3cccc(-c4nnn[n-]4)c3)c3ccccc3n2n1 ZINC000822213114 599357867 /nfs/dbraw/zinc/35/78/67/599357867.db2.gz VLGZZPLASBOLIZ-CYBMUJFWSA-N -1 3 370.420 3.544 20 0 FHADHM Cc1cc2nc(N[C@H](C)c3cccc(-c4nn[n-]n4)c3)c3ccccc3n2n1 ZINC000822213114 599357869 /nfs/dbraw/zinc/35/78/69/599357869.db2.gz VLGZZPLASBOLIZ-CYBMUJFWSA-N -1 3 370.420 3.544 20 0 FHADHM C[C@H](Sc1ncccc1Br)c1ccc(-c2nnn[n-]2)cc1 ZINC000736189818 599369329 /nfs/dbraw/zinc/36/93/29/599369329.db2.gz CDRKPGDUORMHBO-VIFPVBQESA-N -1 3 362.256 3.878 20 0 FHADHM C[C@H](Sc1ncccc1Br)c1ccc(-c2nn[n-]n2)cc1 ZINC000736189818 599369331 /nfs/dbraw/zinc/36/93/31/599369331.db2.gz CDRKPGDUORMHBO-VIFPVBQESA-N -1 3 362.256 3.878 20 0 FHADHM Cc1ccc(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1OCC(F)F ZINC000822254172 599375093 /nfs/dbraw/zinc/37/50/93/599375093.db2.gz BPXUBMUZALWPRA-GFCCVEGCSA-N -1 3 359.380 3.992 20 0 FHADHM Cc1ccc(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1OCC(F)F ZINC000822254172 599375096 /nfs/dbraw/zinc/37/50/96/599375096.db2.gz BPXUBMUZALWPRA-GFCCVEGCSA-N -1 3 359.380 3.992 20 0 FHADHM C[C@@H](NCc1cc(-c2nnn[n-]2)ccc1F)c1ncc(-c2ccccc2)o1 ZINC000820427003 599384413 /nfs/dbraw/zinc/38/44/13/599384413.db2.gz OPAMHIBWQRDKFO-GFCCVEGCSA-N -1 3 364.384 3.512 20 0 FHADHM C[C@@H](NCc1cc(-c2nn[n-]n2)ccc1F)c1ncc(-c2ccccc2)o1 ZINC000820427003 599384414 /nfs/dbraw/zinc/38/44/14/599384414.db2.gz OPAMHIBWQRDKFO-GFCCVEGCSA-N -1 3 364.384 3.512 20 0 FHADHM Cc1cc(-c2nn[n-]n2)cc(C)c1OCC(=O)Nc1ccc(C(C)C)cc1 ZINC000822128420 599386569 /nfs/dbraw/zinc/38/65/69/599386569.db2.gz CCTPQRUVJKZKCF-UHFFFAOYSA-N -1 3 365.437 3.624 20 0 FHADHM C[C@@H](N[C@@H](C)c1ncc(-c2ccccc2)o1)c1cccc(-c2nn[n-]n2)c1 ZINC000820410072 599391122 /nfs/dbraw/zinc/39/11/22/599391122.db2.gz CQBBJUCARLFYCY-KGLIPLIRSA-N -1 3 360.421 3.934 20 0 FHADHM CN(Cc1nc2ccccc2s1)c1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000736831769 599397835 /nfs/dbraw/zinc/39/78/35/599397835.db2.gz UTMVIDSXXHSPOO-UHFFFAOYSA-N -1 3 373.445 3.661 20 0 FHADHM CN(Cc1nc2ccccc2s1)c1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000736831769 599397836 /nfs/dbraw/zinc/39/78/36/599397836.db2.gz UTMVIDSXXHSPOO-UHFFFAOYSA-N -1 3 373.445 3.661 20 0 FHADHM COc1ccc([C@H]2CCCN2c2cc(-c3nnn[n-]3)c3ccccc3n2)cc1 ZINC000737075510 599397846 /nfs/dbraw/zinc/39/78/46/599397846.db2.gz KPDLIALIESODSM-LJQANCHMSA-N -1 3 372.432 3.765 20 0 FHADHM COc1ccc([C@H]2CCCN2c2cc(-c3nn[n-]n3)c3ccccc3n2)cc1 ZINC000737075510 599397851 /nfs/dbraw/zinc/39/78/51/599397851.db2.gz KPDLIALIESODSM-LJQANCHMSA-N -1 3 372.432 3.765 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c(C)c1 ZINC000822229420 599418190 /nfs/dbraw/zinc/41/81/90/599418190.db2.gz UPAISJDMSPCKOP-CABCVRRESA-N -1 3 364.453 3.605 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c(C)c1 ZINC000822229420 599418192 /nfs/dbraw/zinc/41/81/92/599418192.db2.gz UPAISJDMSPCKOP-CABCVRRESA-N -1 3 364.453 3.605 20 0 FHADHM CC(C)(NCc1ccc(-c2nnn[n-]2)o1)c1cccc(C(F)(F)F)c1 ZINC000819987788 599424542 /nfs/dbraw/zinc/42/45/42/599424542.db2.gz LWZLCKLZUUHHDG-UHFFFAOYSA-N -1 3 351.332 3.503 20 0 FHADHM Fc1ccc(CNc2cc(-c3nnn[n-]3)c3ccccc3n2)cc1Cl ZINC000737651514 599425478 /nfs/dbraw/zinc/42/54/78/599425478.db2.gz XKLSALNYLNBBOH-UHFFFAOYSA-N -1 3 354.776 3.820 20 0 FHADHM Fc1ccc(CNc2cc(-c3nn[n-]n3)c3ccccc3n2)cc1Cl ZINC000737651514 599425482 /nfs/dbraw/zinc/42/54/82/599425482.db2.gz XKLSALNYLNBBOH-UHFFFAOYSA-N -1 3 354.776 3.820 20 0 FHADHM CC[C@@H](NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)C1CCCCC1 ZINC000820919773 599430932 /nfs/dbraw/zinc/43/09/32/599430932.db2.gz GLPJEOWXBKFSQQ-SUMWQHHRSA-N -1 3 356.474 3.586 20 0 FHADHM CC[C@@H](NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)C1CCCCC1 ZINC000820919773 599430934 /nfs/dbraw/zinc/43/09/34/599430934.db2.gz GLPJEOWXBKFSQQ-SUMWQHHRSA-N -1 3 356.474 3.586 20 0 FHADHM Cc1ccc(Oc2ccccc2CNCc2ccc(-c3nnn[n-]3)o2)cc1 ZINC000822267432 599431720 /nfs/dbraw/zinc/43/17/20/599431720.db2.gz SWSPTMKRQQVVHE-UHFFFAOYSA-N -1 3 361.405 3.850 20 0 FHADHM Cc1ccc(Oc2ccccc2CNCc2ccc(-c3nn[n-]n3)o2)cc1 ZINC000822267432 599431722 /nfs/dbraw/zinc/43/17/22/599431722.db2.gz SWSPTMKRQQVVHE-UHFFFAOYSA-N -1 3 361.405 3.850 20 0 FHADHM Cc1ccc2nc(C=Cc3cnc4ccc(-c5nnn[n-]5)cn34)ccc2c1 ZINC000737373104 599461252 /nfs/dbraw/zinc/46/12/52/599461252.db2.gz CZKCYDVBTFWOQM-VOTSOKGWSA-N -1 3 353.389 3.541 20 0 FHADHM Cc1ccc2nc(C=Cc3cnc4ccc(-c5nn[n-]n5)cn34)ccc2c1 ZINC000737373104 599461254 /nfs/dbraw/zinc/46/12/54/599461254.db2.gz CZKCYDVBTFWOQM-VOTSOKGWSA-N -1 3 353.389 3.541 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1NCc1coc(-c2cccs2)n1 ZINC000822585954 599468100 /nfs/dbraw/zinc/46/81/00/599468100.db2.gz PDPUDYAKNFLXBG-UHFFFAOYSA-N -1 3 358.814 3.849 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1NCc1coc(-c2cccs2)n1 ZINC000822585954 599468102 /nfs/dbraw/zinc/46/81/02/599468102.db2.gz PDPUDYAKNFLXBG-UHFFFAOYSA-N -1 3 358.814 3.849 20 0 FHADHM CCOc1ccc(CNc2c(Cl)cccc2-c2nnn[n-]2)cc1OC ZINC000821421769 599473690 /nfs/dbraw/zinc/47/36/90/599473690.db2.gz FCANVTZFORNHPU-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM CCOc1ccc(CNc2c(Cl)cccc2-c2nn[n-]n2)cc1OC ZINC000821421769 599473691 /nfs/dbraw/zinc/47/36/91/599473691.db2.gz FCANVTZFORNHPU-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM CC[C@H](NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(C)cc1 ZINC000820921131 599473765 /nfs/dbraw/zinc/47/37/65/599473765.db2.gz WFBDMDKUZJBLKP-KDOFPFPSSA-N -1 3 364.453 3.687 20 0 FHADHM CC[C@H](NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(C)cc1 ZINC000820921131 599473766 /nfs/dbraw/zinc/47/37/66/599473766.db2.gz WFBDMDKUZJBLKP-KDOFPFPSSA-N -1 3 364.453 3.687 20 0 FHADHM C[C@H](C[C@H](O)c1ccc(F)cc1)Nc1c(Cl)cccc1-c1nnn[n-]1 ZINC000820231578 607381394 /nfs/dbraw/zinc/38/13/94/607381394.db2.gz BSIIOYXXDNBXMM-BMIGLBTASA-N -1 3 361.808 3.583 20 0 FHADHM C[C@H](C[C@H](O)c1ccc(F)cc1)Nc1c(Cl)cccc1-c1nn[n-]n1 ZINC000820231578 607381396 /nfs/dbraw/zinc/38/13/96/607381396.db2.gz BSIIOYXXDNBXMM-BMIGLBTASA-N -1 3 361.808 3.583 20 0 FHADHM O=C(OCCCc1cccc2ccccc21)c1sccc1-c1nnn[n-]1 ZINC000738221506 599498509 /nfs/dbraw/zinc/49/85/09/599498509.db2.gz KDTMXJVXZALKBG-UHFFFAOYSA-N -1 3 364.430 3.871 20 0 FHADHM C[C@@H](NC(=O)Cc1csc2ccccc12)c1cccc(-c2nnn[n-]2)c1 ZINC000820335465 599507110 /nfs/dbraw/zinc/50/71/10/599507110.db2.gz YRQACYUNMSNWHP-GFCCVEGCSA-N -1 3 363.446 3.501 20 0 FHADHM C[C@@H](NC(=O)Cc1csc2ccccc12)c1cccc(-c2nn[n-]n2)c1 ZINC000820335465 599507115 /nfs/dbraw/zinc/50/71/15/599507115.db2.gz YRQACYUNMSNWHP-GFCCVEGCSA-N -1 3 363.446 3.501 20 0 FHADHM Cc1nc([C@@H]2CCCN(c3ccc(Cl)cc3-c3nnn[n-]3)C2)sc1C ZINC000822435855 599509559 /nfs/dbraw/zinc/50/95/59/599509559.db2.gz CQXKUUHXAMSHHI-GFCCVEGCSA-N -1 3 374.901 3.977 20 0 FHADHM Cc1nc([C@@H]2CCCN(c3ccc(Cl)cc3-c3nn[n-]n3)C2)sc1C ZINC000822435855 599509561 /nfs/dbraw/zinc/50/95/61/599509561.db2.gz CQXKUUHXAMSHHI-GFCCVEGCSA-N -1 3 374.901 3.977 20 0 FHADHM C[C@H](NC(=O)c1ccc(Cl)cc1Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000820396911 599512720 /nfs/dbraw/zinc/51/27/20/599512720.db2.gz JODHKCDMENJLJR-VIFPVBQESA-N -1 3 362.220 3.665 20 0 FHADHM C[C@H](NC(=O)c1ccc(Cl)cc1Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000820396911 599512722 /nfs/dbraw/zinc/51/27/22/599512722.db2.gz JODHKCDMENJLJR-VIFPVBQESA-N -1 3 362.220 3.665 20 0 FHADHM C[C@@H](C[C@@H](O)c1ccc(F)cc1)Nc1cc(Cl)ccc1-c1nnn[n-]1 ZINC000820232974 607381985 /nfs/dbraw/zinc/38/19/85/607381985.db2.gz ISNLEXPAKVPVAS-MGPLVRAMSA-N -1 3 361.808 3.583 20 0 FHADHM C[C@@H](C[C@@H](O)c1ccc(F)cc1)Nc1cc(Cl)ccc1-c1nn[n-]n1 ZINC000820232974 607381987 /nfs/dbraw/zinc/38/19/87/607381987.db2.gz ISNLEXPAKVPVAS-MGPLVRAMSA-N -1 3 361.808 3.583 20 0 FHADHM COc1cc(CNc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)ccc1C ZINC000737048154 599520761 /nfs/dbraw/zinc/52/07/61/599520761.db2.gz XAYMTMUQZPDDKK-UHFFFAOYSA-N -1 3 363.343 3.815 20 0 FHADHM Cc1cc([C@H]2CCCN2c2ccc(-c3nn[n-]n3)cc2C(F)(F)F)no1 ZINC000737264223 599521254 /nfs/dbraw/zinc/52/12/54/599521254.db2.gz NRHZAZNEFMRBRS-CQSZACIVSA-N -1 3 364.331 3.523 20 0 FHADHM C[C@H](NC(=O)c1cc2c(s1)CC[C@@H](C)C2)c1cccc(-c2nnn[n-]2)c1 ZINC000820735592 599522228 /nfs/dbraw/zinc/52/22/28/599522228.db2.gz TXPYEGYXHBXJJD-NEPJUHHUSA-N -1 3 367.478 3.544 20 0 FHADHM C[C@H](NC(=O)c1cc2c(s1)CC[C@@H](C)C2)c1cccc(-c2nn[n-]n2)c1 ZINC000820735592 599522229 /nfs/dbraw/zinc/52/22/29/599522229.db2.gz TXPYEGYXHBXJJD-NEPJUHHUSA-N -1 3 367.478 3.544 20 0 FHADHM C[C@H](NC(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820321775 599526153 /nfs/dbraw/zinc/52/61/53/599526153.db2.gz MGWLCLONKTTWFC-YMRXKLBXSA-N -1 3 367.840 3.501 20 0 FHADHM C[C@H](NC(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820321775 599526156 /nfs/dbraw/zinc/52/61/56/599526156.db2.gz MGWLCLONKTTWFC-YMRXKLBXSA-N -1 3 367.840 3.501 20 0 FHADHM Cc1cc2cc(C(=O)N[C@H](C)c3cccc(-c4nnn[n-]4)c3)oc2cc1C ZINC000822212721 599535524 /nfs/dbraw/zinc/53/55/24/599535524.db2.gz DXTSFJHHKVQUMX-CYBMUJFWSA-N -1 3 361.405 3.721 20 0 FHADHM Cc1cc2cc(C(=O)N[C@H](C)c3cccc(-c4nn[n-]n4)c3)oc2cc1C ZINC000822212721 599535526 /nfs/dbraw/zinc/53/55/26/599535526.db2.gz DXTSFJHHKVQUMX-CYBMUJFWSA-N -1 3 361.405 3.721 20 0 FHADHM CC[C@@H](NC(=S)Nc1ccccc1-c1nnn[n-]1)c1ccc(F)cc1F ZINC000736370710 599536372 /nfs/dbraw/zinc/53/63/72/599536372.db2.gz OBOOJCRXYVSBHP-CQSZACIVSA-N -1 3 374.420 3.583 20 0 FHADHM CC[C@@H](NC(=S)Nc1ccccc1-c1nn[n-]n1)c1ccc(F)cc1F ZINC000736370710 599536376 /nfs/dbraw/zinc/53/63/76/599536376.db2.gz OBOOJCRXYVSBHP-CQSZACIVSA-N -1 3 374.420 3.583 20 0 FHADHM CC[C@@H](CC(=O)Oc1ccc(-c2nnn[n-]2)cc1OC)c1ccc(C)cc1 ZINC000736335080 599538935 /nfs/dbraw/zinc/53/89/35/599538935.db2.gz PHWGMZUIYBAREZ-AWEZNQCLSA-N -1 3 366.421 3.673 20 0 FHADHM CC[C@@H](CC(=O)Oc1ccc(-c2nn[n-]n2)cc1OC)c1ccc(C)cc1 ZINC000736335080 599538938 /nfs/dbraw/zinc/53/89/38/599538938.db2.gz PHWGMZUIYBAREZ-AWEZNQCLSA-N -1 3 366.421 3.673 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CC[C@@H](C)C2)c1ccsc1 ZINC000736282016 599539546 /nfs/dbraw/zinc/53/95/46/599539546.db2.gz ZQWVBORVHLLDCG-ZJUUUORDSA-N -1 3 373.507 3.857 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CC[C@@H](C)C2)c1ccsc1 ZINC000736282016 599539547 /nfs/dbraw/zinc/53/95/47/599539547.db2.gz ZQWVBORVHLLDCG-ZJUUUORDSA-N -1 3 373.507 3.857 20 0 FHADHM CC(C)CN(C(=O)[C@H](C)c1cccs1)c1ccc(-c2nnn[n-]2)cc1 ZINC000735818655 599541023 /nfs/dbraw/zinc/54/10/23/599541023.db2.gz QIAFSFIJUSLAFE-CYBMUJFWSA-N -1 3 355.467 3.721 20 0 FHADHM CC(C)CN(C(=O)[C@H](C)c1cccs1)c1ccc(-c2nn[n-]n2)cc1 ZINC000735818655 599541026 /nfs/dbraw/zinc/54/10/26/599541026.db2.gz QIAFSFIJUSLAFE-CYBMUJFWSA-N -1 3 355.467 3.721 20 0 FHADHM C[C@H](NC(=O)c1cc(Cl)ccc1Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000820392678 599541410 /nfs/dbraw/zinc/54/14/10/599541410.db2.gz YNOMRICXAWIQOT-VIFPVBQESA-N -1 3 362.220 3.665 20 0 FHADHM C[C@H](NC(=O)c1cc(Cl)ccc1Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000820392678 599541412 /nfs/dbraw/zinc/54/14/12/599541412.db2.gz YNOMRICXAWIQOT-VIFPVBQESA-N -1 3 362.220 3.665 20 0 FHADHM Fc1ccccc1[C@@H]1CCN(c2c(-c3nnn[n-]3)cnc3ccccc32)C1 ZINC000822791374 599545949 /nfs/dbraw/zinc/54/59/49/599545949.db2.gz IAJCPWWVIMIEBX-CYBMUJFWSA-N -1 3 360.396 3.548 20 0 FHADHM Fc1ccccc1[C@@H]1CCN(c2c(-c3nn[n-]n3)cnc3ccccc32)C1 ZINC000822791374 599545952 /nfs/dbraw/zinc/54/59/52/599545952.db2.gz IAJCPWWVIMIEBX-CYBMUJFWSA-N -1 3 360.396 3.548 20 0 FHADHM CC(C)(NC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1cccc(Cl)c1 ZINC000735671880 599547161 /nfs/dbraw/zinc/54/71/61/599547161.db2.gz PXOVYKKMKRUJJF-KHPPLWFESA-N -1 3 367.840 3.585 20 0 FHADHM CC(C)(NC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1cccc(Cl)c1 ZINC000735671880 599547164 /nfs/dbraw/zinc/54/71/64/599547164.db2.gz PXOVYKKMKRUJJF-KHPPLWFESA-N -1 3 367.840 3.585 20 0 FHADHM CCN(C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)C1CCC1 ZINC000736507238 599547890 /nfs/dbraw/zinc/54/78/90/599547890.db2.gz CBPNGXCNAJKYHB-UHFFFAOYSA-N -1 3 363.421 3.674 20 0 FHADHM CCN(C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)C1CCC1 ZINC000736507238 599547891 /nfs/dbraw/zinc/54/78/91/599547891.db2.gz CBPNGXCNAJKYHB-UHFFFAOYSA-N -1 3 363.421 3.674 20 0 FHADHM CC[C@H](C)[C@H]1CCCCN1C(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000736326625 599547984 /nfs/dbraw/zinc/54/79/84/599547984.db2.gz BVECNAYVZKCXOA-WMLDXEAASA-N -1 3 373.526 3.527 20 0 FHADHM CC[C@H](C)[C@H]1CCCCN1C(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000736326625 599547985 /nfs/dbraw/zinc/54/79/85/599547985.db2.gz BVECNAYVZKCXOA-WMLDXEAASA-N -1 3 373.526 3.527 20 0 FHADHM O[C@@H](CNc1c(Cl)cccc1-c1nnn[n-]1)c1ccc2ccccc2c1 ZINC000823690424 599548268 /nfs/dbraw/zinc/54/82/68/599548268.db2.gz OMIPLGCMWNTUAM-KRWDZBQOSA-N -1 3 365.824 3.819 20 0 FHADHM O[C@@H](CNc1c(Cl)cccc1-c1nn[n-]n1)c1ccc2ccccc2c1 ZINC000823690424 599548270 /nfs/dbraw/zinc/54/82/70/599548270.db2.gz OMIPLGCMWNTUAM-KRWDZBQOSA-N -1 3 365.824 3.819 20 0 FHADHM CCCN(CCC)C(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736473293 599561811 /nfs/dbraw/zinc/56/18/11/599561811.db2.gz NFXNUWJEHZCGTH-UHFFFAOYSA-N -1 3 364.453 3.873 20 0 FHADHM COC[C@@H](Nc1ccc(-c2nn[n-]n2)cc1)c1cccc(C(F)(F)F)c1 ZINC000821683798 599564277 /nfs/dbraw/zinc/56/42/77/599564277.db2.gz KJUVWCNZYPGHKV-OAHLLOKOSA-N -1 3 363.343 3.685 20 0 FHADHM Cc1ccnc(NC(=O)c2cccc(Nc3ccc(-c4nn[n-]n4)cc3)c2)c1 ZINC000737438160 599565473 /nfs/dbraw/zinc/56/54/73/599565473.db2.gz ZDNTZCBCFHECCN-UHFFFAOYSA-N -1 3 371.404 3.566 20 0 FHADHM O=C(NC[C@H]1CC=CCC1)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000738046679 599568088 /nfs/dbraw/zinc/56/80/88/599568088.db2.gz VXBPQDWOUHFQSW-HNNXBMFYSA-N -1 3 374.448 3.696 20 0 FHADHM O=C(NCCCC1CC1)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000738056952 599570824 /nfs/dbraw/zinc/57/08/24/599570824.db2.gz XPVIAQTVAAKQMD-UHFFFAOYSA-N -1 3 362.437 3.530 20 0 FHADHM O=C(CC/C=C\c1ccccc1)OCc1ccc(F)cc1-c1nnn[n-]1 ZINC000737824891 599606170 /nfs/dbraw/zinc/60/61/70/599606170.db2.gz JJOVDXSIZGGXAD-YWEYNIOJSA-N -1 3 352.369 3.543 20 0 FHADHM O=C(CC/C=C\c1ccccc1)OCc1ccc(F)cc1-c1nn[n-]n1 ZINC000737824891 599606172 /nfs/dbraw/zinc/60/61/72/599606172.db2.gz JJOVDXSIZGGXAD-YWEYNIOJSA-N -1 3 352.369 3.543 20 0 FHADHM O=C(OCc1ccc(-c2nnn[n-]2)cc1)C1(c2cccs2)CCCCC1 ZINC000738236695 599606429 /nfs/dbraw/zinc/60/64/29/599606429.db2.gz PRGFZYUMAWLWCK-UHFFFAOYSA-N -1 3 368.462 3.874 20 0 FHADHM O=C(OCc1ccc(-c2nn[n-]n2)cc1)C1(c2cccs2)CCCCC1 ZINC000738236695 599606430 /nfs/dbraw/zinc/60/64/30/599606430.db2.gz PRGFZYUMAWLWCK-UHFFFAOYSA-N -1 3 368.462 3.874 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)N1CCCC[C@H]1[C@@H](C)CC ZINC000736633868 599610144 /nfs/dbraw/zinc/61/01/44/599610144.db2.gz FVGGJSCRDZALDF-BBRMVZONSA-N -1 3 372.473 3.698 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)N1CCCC[C@H]1[C@@H](C)CC ZINC000736633868 599610145 /nfs/dbraw/zinc/61/01/45/599610145.db2.gz FVGGJSCRDZALDF-BBRMVZONSA-N -1 3 372.473 3.698 20 0 FHADHM CS[C@@H]1CCCCN(c2ccc(C(F)(F)F)cc2-c2nn[n-]n2)C1 ZINC000821956698 607386278 /nfs/dbraw/zinc/38/62/78/607386278.db2.gz VUFCHFAFXQAGSO-LLVKDONJSA-N -1 3 357.405 3.607 20 0 FHADHM Cc1nc(C2CCCC2)sc1C(=O)OCc1ccc(-c2nnn[n-]2)cc1 ZINC000822432102 599623198 /nfs/dbraw/zinc/62/31/98/599623198.db2.gz WZSGNWQWLCCPGK-UHFFFAOYSA-N -1 3 369.450 3.646 20 0 FHADHM Cc1nc(C2CCCC2)sc1C(=O)OCc1ccc(-c2nn[n-]n2)cc1 ZINC000822432102 599623199 /nfs/dbraw/zinc/62/31/99/599623199.db2.gz WZSGNWQWLCCPGK-UHFFFAOYSA-N -1 3 369.450 3.646 20 0 FHADHM Cc1sc(NC(=O)[C@@H](C)CCc2ccccc2F)c(-c2nnn[n-]2)c1C ZINC000822557182 599628907 /nfs/dbraw/zinc/62/89/07/599628907.db2.gz HIKIDJBZUYOEBE-JTQLQIEISA-N -1 3 373.457 3.892 20 0 FHADHM Cc1sc(NC(=O)[C@@H](C)CCc2ccccc2F)c(-c2nn[n-]n2)c1C ZINC000822557182 599628908 /nfs/dbraw/zinc/62/89/08/599628908.db2.gz HIKIDJBZUYOEBE-JTQLQIEISA-N -1 3 373.457 3.892 20 0 FHADHM COc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)CCCC1CCCC1 ZINC000821699672 599629518 /nfs/dbraw/zinc/62/95/18/599629518.db2.gz YXIUWIQKYWSAEV-UHFFFAOYSA-N -1 3 364.833 3.795 20 0 FHADHM COc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)CCCC1CCCC1 ZINC000821699672 599629519 /nfs/dbraw/zinc/62/95/19/599629519.db2.gz YXIUWIQKYWSAEV-UHFFFAOYSA-N -1 3 364.833 3.795 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)C1CCCCCC1 ZINC000823303700 599632442 /nfs/dbraw/zinc/63/24/42/599632442.db2.gz RNMJSTFCDMDWMA-UHFFFAOYSA-N -1 3 353.348 3.794 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)C1CCCCCC1 ZINC000823303700 599632443 /nfs/dbraw/zinc/63/24/43/599632443.db2.gz RNMJSTFCDMDWMA-UHFFFAOYSA-N -1 3 353.348 3.794 20 0 FHADHM C[C@@H]1CCC[C@@H](C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)C1 ZINC000820691855 599632697 /nfs/dbraw/zinc/63/26/97/599632697.db2.gz ZVBIVUNECWCRQP-NXEZZACHSA-N -1 3 353.348 3.650 20 0 FHADHM C[C@@H]1CCC[C@@H](C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)C1 ZINC000820691855 599632698 /nfs/dbraw/zinc/63/26/98/599632698.db2.gz ZVBIVUNECWCRQP-NXEZZACHSA-N -1 3 353.348 3.650 20 0 FHADHM CCC(=CC(=O)NCc1cccc(-c2nn[n-]n2)c1)c1cccc(Cl)c1 ZINC000820831862 599647857 /nfs/dbraw/zinc/64/78/57/599647857.db2.gz DKLDWTGXSCOYND-KAMYIIQDSA-N -1 3 367.840 3.630 20 0 FHADHM CCC(=CC(=O)NCc1cccc(-c2nnn[n-]2)c1)c1cccc(Cl)c1 ZINC000820831862 599647856 /nfs/dbraw/zinc/64/78/56/599647856.db2.gz DKLDWTGXSCOYND-KAMYIIQDSA-N -1 3 367.840 3.630 20 0 FHADHM CS[C@@H]1CCCCN(c2ccc(C(F)(F)F)cc2-c2nnn[n-]2)C1 ZINC000821956698 607386277 /nfs/dbraw/zinc/38/62/77/607386277.db2.gz VUFCHFAFXQAGSO-LLVKDONJSA-N -1 3 357.405 3.607 20 0 FHADHM CC(C)C[C@H]1CCCCCN1C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820062521 599680639 /nfs/dbraw/zinc/68/06/39/599680639.db2.gz NMECKGATCYSMOQ-CRAIPNDOSA-N -1 3 370.501 3.928 20 0 FHADHM CC(C)C[C@H]1CCCCCN1C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820062521 599680640 /nfs/dbraw/zinc/68/06/40/599680640.db2.gz NMECKGATCYSMOQ-CRAIPNDOSA-N -1 3 370.501 3.928 20 0 FHADHM FC(F)(F)C1CCC(CNc2nc3c(cc2-c2nnn[n-]2)CCC3)CC1 ZINC000822715007 599689534 /nfs/dbraw/zinc/68/95/34/599689534.db2.gz ZBSGIOKWTKYHFW-UHFFFAOYSA-N -1 3 366.391 3.531 20 0 FHADHM FC(F)(F)C1CCC(CNc2nc3c(cc2-c2nn[n-]n2)CCC3)CC1 ZINC000822715007 599689535 /nfs/dbraw/zinc/68/95/35/599689535.db2.gz ZBSGIOKWTKYHFW-UHFFFAOYSA-N -1 3 366.391 3.531 20 0 FHADHM COc1ccc(CN(C)[C@@H](C(=O)[O-])c2ccc(F)cc2)cc1OC(F)F ZINC000579132407 599710103 /nfs/dbraw/zinc/71/01/03/599710103.db2.gz CTJCBAYWICKNKU-MRXNPFEDSA-N -1 3 369.339 3.693 20 0 FHADHM C[C@@H](c1ccc(C(=O)[O-])o1)N1CCC(C(=O)Nc2cccc(F)c2)CC1 ZINC000736715933 599716982 /nfs/dbraw/zinc/71/69/82/599716982.db2.gz VZYIVSVLYTVXIK-LBPRGKRZSA-N -1 3 360.385 3.529 20 0 FHADHM C[C@H](c1ccc(C(=O)[O-])o1)N1CCC(C(=O)Nc2ccc(F)cc2)CC1 ZINC000736713423 599784594 /nfs/dbraw/zinc/78/45/94/599784594.db2.gz BLPZYENRMJHEGL-GFCCVEGCSA-N -1 3 360.385 3.529 20 0 FHADHM CCCN(Cc1cc(C(=O)[O-])oc1C)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000737019343 599793942 /nfs/dbraw/zinc/79/39/42/599793942.db2.gz GWEGYZLISJBBKV-OAHLLOKOSA-N -1 3 366.458 3.508 20 0 FHADHM O=C([O-])C[C@@H]1CCCCN1Cn1c2ccccc2nc1SC(F)F ZINC000739638760 599840497 /nfs/dbraw/zinc/84/04/97/599840497.db2.gz AGWKWOMKFVQUPD-NSHDSACASA-N -1 3 355.410 3.638 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)O[C@H](C)c1nc2ccccc2s1 ZINC000826251490 607400102 /nfs/dbraw/zinc/40/01/02/607400102.db2.gz RFFRDENBGDUJHM-LLVKDONJSA-N -1 3 365.418 3.703 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)O[C@H](C)c1nc2ccccc2s1 ZINC000826251490 607400103 /nfs/dbraw/zinc/40/01/03/607400103.db2.gz RFFRDENBGDUJHM-LLVKDONJSA-N -1 3 365.418 3.703 20 0 FHADHM CC(C)Oc1ccc(NC(=O)c2coc3ccccc23)cc1-c1nnn[n-]1 ZINC000820173830 607402016 /nfs/dbraw/zinc/40/20/16/607402016.db2.gz KYKZVVQLXYDEEY-UHFFFAOYSA-N -1 3 363.377 3.652 20 0 FHADHM CC(C)Oc1ccc(NC(=O)c2coc3ccccc23)cc1-c1nn[n-]n1 ZINC000820173830 607402017 /nfs/dbraw/zinc/40/20/17/607402017.db2.gz KYKZVVQLXYDEEY-UHFFFAOYSA-N -1 3 363.377 3.652 20 0 FHADHM Cc1cc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)ccc1C(=O)[O-] ZINC000237816211 599948526 /nfs/dbraw/zinc/94/85/26/599948526.db2.gz IHVOSAKQVKGTIA-MRXNPFEDSA-N -1 3 370.424 3.683 20 0 FHADHM COc1cc2c(cc1CN[C@H](CCC(=O)[O-])c1ccccc1)O[C@@H](C)C2 ZINC000580292792 599992852 /nfs/dbraw/zinc/99/28/52/599992852.db2.gz MJSISJQIABVUAQ-KBXCAEBGSA-N -1 3 355.434 3.714 20 0 FHADHM Cc1ccc(COC(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)nc1 ZINC000822238800 607411095 /nfs/dbraw/zinc/41/10/95/607411095.db2.gz VJXARSMZYDIKQI-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM Cc1ccc(COC(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)nc1 ZINC000822238800 607411096 /nfs/dbraw/zinc/41/10/96/607411096.db2.gz VJXARSMZYDIKQI-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM O=C([O-])c1ccc(OC(=O)C2CCN(Cc3ccccc3)CC2)c(Cl)c1 ZINC000740159750 600061797 /nfs/dbraw/zinc/06/17/97/600061797.db2.gz CBGQEJDSZIQTQC-UHFFFAOYSA-N -1 3 373.836 3.856 20 0 FHADHM Cc1ccc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)c(C(=O)[O-])c1 ZINC000738614033 600073237 /nfs/dbraw/zinc/07/32/37/600073237.db2.gz GCBJDHXRNDVWTB-INIZCTEOSA-N -1 3 370.424 3.683 20 0 FHADHM COc1cc(CN(CC(=O)[O-])Cc2ccc(F)c(F)c2)ccc1SC ZINC000652475370 600076967 /nfs/dbraw/zinc/07/69/67/600076967.db2.gz NTSADTDVEVMNEH-UHFFFAOYSA-N -1 3 367.417 3.782 20 0 FHADHM Cc1oc(CN(C)CCc2ccc(Br)cc2)cc1C(=O)[O-] ZINC000652408983 600090036 /nfs/dbraw/zinc/09/00/36/600090036.db2.gz ZESZTTNNRJPKEU-UHFFFAOYSA-N -1 3 352.228 3.723 20 0 FHADHM CCC[C@](C)(NCc1csc(COc2ccc(F)cc2)n1)C(=O)[O-] ZINC000736963466 600156653 /nfs/dbraw/zinc/15/66/53/600156653.db2.gz ZQPPTRXYLKGOHA-KRWDZBQOSA-N -1 3 352.431 3.594 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@@H]1C(=O)Nc1sc(C)c(C)c1-c1nnn[n-]1 ZINC000826316515 607428687 /nfs/dbraw/zinc/42/86/87/607428687.db2.gz QWQBOTYUZIEWPX-MNOVXSKESA-N -1 3 359.480 3.657 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@@H]1C(=O)Nc1sc(C)c(C)c1-c1nn[n-]n1 ZINC000826316515 607428688 /nfs/dbraw/zinc/42/86/88/607428688.db2.gz QWQBOTYUZIEWPX-MNOVXSKESA-N -1 3 359.480 3.657 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H]2C[C@@H]2c2sccc2C)c1-c1nnn[n-]1 ZINC000825688255 607431772 /nfs/dbraw/zinc/43/17/72/607431772.db2.gz VPOZMCOKIBQDSN-NWDGAFQWSA-N -1 3 373.507 3.911 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H]2C[C@@H]2c2sccc2C)c1-c1nn[n-]n1 ZINC000825688255 607431773 /nfs/dbraw/zinc/43/17/73/607431773.db2.gz VPOZMCOKIBQDSN-NWDGAFQWSA-N -1 3 373.507 3.911 20 0 FHADHM Cc1cc2oc(=O)cc(CN3CCC4(C[C@@H]4C(=O)[O-])CC3)c2cc1C(C)C ZINC000738486614 600311715 /nfs/dbraw/zinc/31/17/15/600311715.db2.gz CACMCYFOMDUPRU-GOSISDBHSA-N -1 3 369.461 3.912 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@H]2C(=O)N(C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000824347795 607437882 /nfs/dbraw/zinc/43/78/82/607437882.db2.gz NXQRPRBYWXPFRL-RTBURBONSA-N -1 3 361.449 3.757 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@H]2C(=O)N(C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000824347795 607437883 /nfs/dbraw/zinc/43/78/83/607437883.db2.gz NXQRPRBYWXPFRL-RTBURBONSA-N -1 3 361.449 3.757 20 0 FHADHM CC(C)c1nc([C@H]2CCCN([C@@H](C(=O)[O-])c3cccc(Cl)c3)C2)no1 ZINC000581374927 600402037 /nfs/dbraw/zinc/40/20/37/600402037.db2.gz HXJZMHAWCPIMQZ-DZGCQCFKSA-N -1 3 363.845 3.852 20 0 FHADHM CC(C)c1nc([C@@H]2CCCN([C@@H](C(=O)[O-])c3cccc(Cl)c3)C2)no1 ZINC000581374929 600402161 /nfs/dbraw/zinc/40/21/61/600402161.db2.gz HXJZMHAWCPIMQZ-UKRRQHHQSA-N -1 3 363.845 3.852 20 0 FHADHM Cc1cc(NC(=O)c2oc3ccccc3c2CN(C)C)ccc1C(=O)[O-] ZINC000237047274 600408451 /nfs/dbraw/zinc/40/84/51/600408451.db2.gz REXHQMYRKAYORJ-UHFFFAOYSA-N -1 3 352.390 3.753 20 0 FHADHM CN(C)Cc1c2ccccc2oc1C(=O)Nc1ccc(CCC(=O)[O-])cc1 ZINC000737368838 600409456 /nfs/dbraw/zinc/40/94/56/600409456.db2.gz WCQGYYOUMXEPFT-UHFFFAOYSA-N -1 3 366.417 3.764 20 0 FHADHM CCN(CC)C(=O)c1ccc(CN[C@H](C(=O)[O-])c2cccc(Cl)c2)cc1 ZINC000737083891 600422256 /nfs/dbraw/zinc/42/22/56/600422256.db2.gz BEIHRQRAWSAKHW-SFHVURJKSA-N -1 3 374.868 3.738 20 0 FHADHM CCOc1c(Cl)cc(CN[C@H](C(=O)[O-])c2ccc(F)cc2)cc1OC ZINC000426773111 600426201 /nfs/dbraw/zinc/42/62/01/600426201.db2.gz IGTGJEOQRBNCRV-INIZCTEOSA-N -1 3 367.804 3.802 20 0 FHADHM O=C([O-])[C@H](NCc1cccc(Cn2cccn2)c1)c1cccc(Cl)c1 ZINC000739500586 600428064 /nfs/dbraw/zinc/42/80/64/600428064.db2.gz PWLHCKHRYVYQOL-GOSISDBHSA-N -1 3 355.825 3.500 20 0 FHADHM Cc1[nH]c(C(=O)CN2C[C@@H](c3ccccc3C)C[C@H]2C)c(C)c1C(=O)[O-] ZINC000738761181 600434306 /nfs/dbraw/zinc/43/43/06/600434306.db2.gz PAVJAHKVRDFXNI-CJNGLKHVSA-N -1 3 354.450 3.699 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@@H]1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000826316786 607444818 /nfs/dbraw/zinc/44/48/18/607444818.db2.gz YPLOPNPLMZQIRF-MNOVXSKESA-N -1 3 359.842 3.632 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@@H]1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000826316786 607444820 /nfs/dbraw/zinc/44/48/20/607444820.db2.gz YPLOPNPLMZQIRF-MNOVXSKESA-N -1 3 359.842 3.632 20 0 FHADHM Cc1[nH]c(C(=O)CN2CCC[C@@H]2Cc2ccccc2C)c(C)c1C(=O)[O-] ZINC000738769359 600509192 /nfs/dbraw/zinc/50/91/92/600509192.db2.gz VFDYYUHEAPQYOU-QGZVFWFLSA-N -1 3 354.450 3.528 20 0 FHADHM Cc1ccc(C(=O)[O-])cc1NC(=O)[C@H](C)N1C[C@H](c2ccccc2)C[C@H]1C ZINC000738518147 600630203 /nfs/dbraw/zinc/63/02/03/600630203.db2.gz ILVNGTYXRFVWFA-JTDSTZFVSA-N -1 3 366.461 3.898 20 0 FHADHM Cc1cccnc1[C@@H](NCc1cc(C)c(OCC(=O)[O-])c(C)c1)C(C)C ZINC000738785053 600640248 /nfs/dbraw/zinc/64/02/48/600640248.db2.gz GQRNCJHVQALLSU-IBGZPJMESA-N -1 3 356.466 3.957 20 0 FHADHM O=C([O-])[C@@H](NCCOc1ccc(F)cc1)c1ccc(Cl)cc1Cl ZINC000833166194 600737450 /nfs/dbraw/zinc/73/74/50/600737450.db2.gz OAAFJEGEPWCQNZ-HNNXBMFYSA-N -1 3 358.196 3.927 20 0 FHADHM C[C@H](NCc1cccc(OCC(=O)[O-])c1)c1ccc(OC(F)F)cc1 ZINC000827740953 600749957 /nfs/dbraw/zinc/74/99/57/600749957.db2.gz GGVFZYYDFYYJRN-LBPRGKRZSA-N -1 3 351.349 3.602 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1CNc1cccc(COCC2CC2)c1 ZINC000822744386 607477862 /nfs/dbraw/zinc/47/78/62/607477862.db2.gz RIJXGIZYYCDZKM-UHFFFAOYSA-N -1 3 353.401 3.545 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CNc1cccc(COCC2CC2)c1 ZINC000822744386 607477863 /nfs/dbraw/zinc/47/78/63/607477863.db2.gz RIJXGIZYYCDZKM-UHFFFAOYSA-N -1 3 353.401 3.545 20 0 FHADHM Cc1ccc(C(=O)[O-])cc1NC(=O)[C@@H](C)N1CC[C@H](Cc2ccccc2)C1 ZINC000738518445 600967944 /nfs/dbraw/zinc/96/79/44/600967944.db2.gz LHQBVVOUWYPYEE-SJLPKXTDSA-N -1 3 366.461 3.585 20 0 FHADHM O=C([O-])[C@H]1CCCN([C@@H](C(=O)c2c[nH]c3ccccc23)c2ccccc2)C1 ZINC000263573523 601031981 /nfs/dbraw/zinc/03/19/81/601031981.db2.gz MLVHHGBPDCQWEI-OXJNMPFZSA-N -1 3 362.429 3.889 20 0 FHADHM CCCCN(C)c1ccc(NCc2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000821060319 607488540 /nfs/dbraw/zinc/48/85/40/607488540.db2.gz AJXJBCFSNFTHKQ-UHFFFAOYSA-N -1 3 354.433 3.854 20 0 FHADHM CC(C)n1ncc2cc(NCc3ccc(-c4nnn[n-]4)cc3F)ccc21 ZINC000820214545 607489757 /nfs/dbraw/zinc/48/97/57/607489757.db2.gz HXBXLDIWOOJDGX-UHFFFAOYSA-N -1 3 351.389 3.549 20 0 FHADHM CC(C)n1ncc2cc(NCc3ccc(-c4nn[n-]n4)cc3F)ccc21 ZINC000820214545 607489758 /nfs/dbraw/zinc/48/97/58/607489758.db2.gz HXBXLDIWOOJDGX-UHFFFAOYSA-N -1 3 351.389 3.549 20 0 FHADHM C/C(=C\CN(C)[C@H]1CCSc2ccc(Br)cc21)C(=O)[O-] ZINC000825730622 601163120 /nfs/dbraw/zinc/16/31/20/601163120.db2.gz ZNYXWESCQURADM-KADSFNECSA-N -1 3 356.285 3.949 20 0 FHADHM Cc1ccc(NC(=O)CN[C@H](c2ccccc2)[C@@H](C)C(=O)[O-])c(Cl)c1 ZINC000832943561 601206497 /nfs/dbraw/zinc/20/64/97/601206497.db2.gz GUXDXHWMVRHMKU-ACJLOTCBSA-N -1 3 360.841 3.639 20 0 FHADHM O=C([O-])[C@H](c1ccc(Cl)cc1Cl)N1CCC[C@H](c2ncc[nH]2)C1 ZINC000833172076 601381884 /nfs/dbraw/zinc/38/18/84/601381884.db2.gz RFIBJEPJMQJWEO-HZMBPMFUSA-N -1 3 354.237 3.722 20 0 FHADHM CCc1oc(C(=O)[O-])cc1CN1CCC([C@@H](O)c2ccc(F)cc2)CC1 ZINC000830363254 601418096 /nfs/dbraw/zinc/41/80/96/601418096.db2.gz PKVXJZZFUYRSQP-IBGZPJMESA-N -1 3 361.413 3.625 20 0 FHADHM COc1ccc(CN(C)Cc2c3ccccc3sc2C(=O)[O-])cc1O ZINC000832311212 601421101 /nfs/dbraw/zinc/42/11/01/601421101.db2.gz VHYUPDPYKNDSQV-UHFFFAOYSA-N -1 3 357.431 3.946 20 0 FHADHM COc1cc(NC2CCN([C@H](C)c3ccc(C(=O)[O-])o3)CC2)cc(OC)c1 ZINC000832027400 601598390 /nfs/dbraw/zinc/59/83/90/601598390.db2.gz ZQYWGOZQZMCPGS-CYBMUJFWSA-N -1 3 374.437 3.633 20 0 FHADHM C[C@@H](NCC(C)(C)C(=O)[O-])c1nc(-c2cccc(C(F)(F)F)c2)no1 ZINC000827734156 601646785 /nfs/dbraw/zinc/64/67/85/601646785.db2.gz DTHSEODVGWZKFW-SECBINFHSA-N -1 3 357.332 3.517 20 0 FHADHM C[C@@H](C(=O)[O-])[C@H](NCC(=O)Nc1ccccc1C(C)(C)C)c1ccccc1 ZINC000826052605 601650164 /nfs/dbraw/zinc/65/01/64/601650164.db2.gz GXGGENYOAXFYKC-QRWLVFNGSA-N -1 3 368.477 3.974 20 0 FHADHM Cc1cc(Cl)ccc1NC(=O)CN[C@@H](c1ccccc1)[C@H](C)C(=O)[O-] ZINC000832886452 601657358 /nfs/dbraw/zinc/65/73/58/601657358.db2.gz NXVBBKKKHSQVED-SCLBCKFNSA-N -1 3 360.841 3.639 20 0 FHADHM CN(C[C@H]1CCCN(Cc2ccsc2C(=O)[O-])C1)C(=O)OC(C)(C)C ZINC000830718813 601811978 /nfs/dbraw/zinc/81/19/78/601811978.db2.gz ZHQXIJIHLBDJDV-CYBMUJFWSA-N -1 3 368.499 3.525 20 0 FHADHM CCC[C@@H](NC(=O)[C@H](C)N1CCC(CCC(=O)[O-])CC1)c1ccccc1 ZINC000662218875 601840591 /nfs/dbraw/zinc/84/05/91/601840591.db2.gz VTLSLXAMQCBJCM-QFBILLFUSA-N -1 3 360.498 3.609 20 0 FHADHM CN(C)C(=O)Sc1cccc(CN2CCC(CCC(=O)[O-])CC2)c1 ZINC000830569322 601841815 /nfs/dbraw/zinc/84/18/15/601841815.db2.gz MKXJZUPYIFYXCO-UHFFFAOYSA-N -1 3 350.484 3.537 20 0 FHADHM O=C([O-])C[C@H]1CSCCN1CCOC(c1ccccc1)c1ccccc1 ZINC000574697112 601887469 /nfs/dbraw/zinc/88/74/69/601887469.db2.gz KGPFBPFEZMKMBE-IBGZPJMESA-N -1 3 371.502 3.685 20 0 FHADHM CN(C[C@H](O)c1cccc(Cl)c1)[C@@H](C(=O)[O-])c1cc(F)c(F)c(F)c1 ZINC000830714815 601902684 /nfs/dbraw/zinc/90/26/84/601902684.db2.gz YXRGYSKBISPHNG-GOEBONIOSA-N -1 3 373.758 3.548 20 0 FHADHM C[C@H](c1nnc(-c2ccc(Cl)cc2Cl)o1)N1CC[C@](C)(C(=O)[O-])C1 ZINC000827966703 601919262 /nfs/dbraw/zinc/91/92/62/601919262.db2.gz UEDICSLEMRFLIX-ABKXIKBNSA-N -1 3 370.236 3.901 20 0 FHADHM CSc1ccc2cc(CN3CC[C@](C)(C(=O)[O-])C3)c(Cl)nc2c1 ZINC000823659571 601947070 /nfs/dbraw/zinc/94/70/70/601947070.db2.gz GZAIYZSVDBUNCF-KRWDZBQOSA-N -1 3 350.871 3.907 20 0 FHADHM COC(=O)c1ccc(CN[C@H](C(=O)[O-])c2cc(Cl)cc(Cl)c2)cc1 ZINC000831385364 601971071 /nfs/dbraw/zinc/97/10/71/601971071.db2.gz SKLIXUNHDLXQLQ-HNNXBMFYSA-N -1 3 368.216 3.696 20 0 FHADHM O=C([O-])NCCc1ccc(CNCc2cccc(C(F)(F)F)c2)cc1 ZINC000740672597 602003548 /nfs/dbraw/zinc/00/35/48/602003548.db2.gz LOLXHAUHXVNJOF-UHFFFAOYSA-N -1 3 352.356 3.805 20 0 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607577328 /nfs/dbraw/zinc/57/73/28/607577328.db2.gz LVWGIVMQMHNKTN-OWBHPGMISA-N -1 3 363.421 3.616 20 0 FHADHM CCC(=CC(=O)Nc1cc(-c2nn[n-]n2)ccc1C)c1ccc(OC)cc1 ZINC000825029029 607577330 /nfs/dbraw/zinc/57/73/30/607577330.db2.gz LVWGIVMQMHNKTN-OWBHPGMISA-N -1 3 363.421 3.616 20 0 FHADHM CC[C@@H](SC)C(=O)Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1 ZINC000825159390 607577915 /nfs/dbraw/zinc/57/79/15/607577915.db2.gz OJFZFJLMRYXKJJ-GFCCVEGCSA-N -1 3 359.480 3.675 20 0 FHADHM CC[C@@H](SC)C(=O)Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1 ZINC000825159390 607577917 /nfs/dbraw/zinc/57/79/17/607577917.db2.gz OJFZFJLMRYXKJJ-GFCCVEGCSA-N -1 3 359.480 3.675 20 0 FHADHM Cc1cc(C)nc(NC(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)c1 ZINC000826265458 607594048 /nfs/dbraw/zinc/59/40/48/607594048.db2.gz AANDNAQNGNLUHI-UHFFFAOYSA-N -1 3 370.416 3.798 20 0 FHADHM Cc1cc(C)nc(NC(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)c1 ZINC000826265458 607594050 /nfs/dbraw/zinc/59/40/50/607594050.db2.gz AANDNAQNGNLUHI-UHFFFAOYSA-N -1 3 370.416 3.798 20 0 FHADHM CC(C)[C@](C)(CNC(=O)[O-])NCC(=O)Nc1ccccc1-c1ccccc1 ZINC000738769846 603078527 /nfs/dbraw/zinc/07/85/27/603078527.db2.gz GPKHEFQPOOZFLS-NRFANRHFSA-N -1 3 369.465 3.564 20 0 FHADHM CC[C@@H](SC)C(=O)OCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000825159104 607635061 /nfs/dbraw/zinc/63/50/61/607635061.db2.gz IWLSVAVGGXFJSD-QGZVFWFLSA-N -1 3 368.462 3.719 20 0 FHADHM CC[C@@H](SC)C(=O)OCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000825159104 607635062 /nfs/dbraw/zinc/63/50/62/607635062.db2.gz IWLSVAVGGXFJSD-QGZVFWFLSA-N -1 3 368.462 3.719 20 0 FHADHM C[C@H](NCc1ccc(NC(=O)[O-])nc1)c1ccc(OCC(F)(F)F)cc1 ZINC000825501711 603540036 /nfs/dbraw/zinc/54/00/36/603540036.db2.gz DSEIDBBIAPPYEA-NSHDSACASA-N -1 3 369.343 3.963 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1ncc(-c2ccccc2)s1 ZINC000826251387 607667180 /nfs/dbraw/zinc/66/71/80/607667180.db2.gz OABQQTRIMUIWCH-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1ncc(-c2ccccc2)s1 ZINC000826251387 607667181 /nfs/dbraw/zinc/66/71/81/607667181.db2.gz OABQQTRIMUIWCH-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1cc(OC(C)C)ccc1NC(=O)c1ccc(-c2nnn[n-]2)cc1C ZINC000826271898 607667788 /nfs/dbraw/zinc/66/77/88/607667788.db2.gz LYLYDKCGBULZSH-UHFFFAOYSA-N -1 3 351.410 3.523 20 0 FHADHM Cc1cc(OC(C)C)ccc1NC(=O)c1ccc(-c2nn[n-]n2)cc1C ZINC000826271898 607667791 /nfs/dbraw/zinc/66/77/91/607667791.db2.gz LYLYDKCGBULZSH-UHFFFAOYSA-N -1 3 351.410 3.523 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1ccc(Oc2ccncc2)cc1 ZINC000826249901 607677339 /nfs/dbraw/zinc/67/73/39/607677339.db2.gz AKGNGBOFKUBDMI-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1ccc(Oc2ccncc2)cc1 ZINC000826249901 607677341 /nfs/dbraw/zinc/67/73/41/607677341.db2.gz AKGNGBOFKUBDMI-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1c([C@H](C)N[C@H]2CCCN(C(=O)[O-])C2)cnn1-c1cc(C)ccc1C ZINC000832923694 604286824 /nfs/dbraw/zinc/28/68/24/604286824.db2.gz AOXMBNBSPMCDCP-RDJZCZTQSA-N -1 3 356.470 3.591 20 0 FHADHM Cc1cc([C@@H](C)N2CCC(CNC(=O)OC(C)(C)C)CC2)oc1C(=O)[O-] ZINC000832871160 604384575 /nfs/dbraw/zinc/38/45/75/604384575.db2.gz PGEBPCQVWKDWIE-CYBMUJFWSA-N -1 3 366.458 3.584 20 0 FHADHM C[C@@H](NC(=O)[O-])c1ccc(CNCc2cnc(-c3ccncc3)s2)cc1 ZINC000825402126 604413325 /nfs/dbraw/zinc/41/33/25/604413325.db2.gz HYTFZZSVNSVQOU-CYBMUJFWSA-N -1 3 368.462 3.824 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1CCCCC[C@@H]1c1ccco1 ZINC000826245222 607694125 /nfs/dbraw/zinc/69/41/25/607694125.db2.gz QVYWCXAJDWUPJZ-MRXNPFEDSA-N -1 3 351.410 3.526 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1CCCCC[C@@H]1c1ccco1 ZINC000826245222 607694126 /nfs/dbraw/zinc/69/41/26/607694126.db2.gz QVYWCXAJDWUPJZ-MRXNPFEDSA-N -1 3 351.410 3.526 20 0 FHADHM O=C([O-])[C@H](c1cc(Cl)cc(Cl)c1)N1CC[C@]2(O)CCCC[C@@H]2C1 ZINC000833172410 604501113 /nfs/dbraw/zinc/50/11/13/604501113.db2.gz UZZFPMGZQWBLDK-ISTRZQFTSA-N -1 3 358.265 3.746 20 0 FHADHM C[C@H](Oc1ccc(CN2CCC(OCc3ccccc3)CC2)cc1)C(=O)[O-] ZINC000833539891 604523062 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C[C@H](C(=O)[O-])[C@@H](NC[C@@H]1CC(c2ccc(Cl)cc2)=NO1)c1ccccc1 ZINC000833406109 604716927 /nfs/dbraw/zinc/71/69/27/604716927.db2.gz ATGJZWWPDSNRJL-SOVGHPHASA-N -1 3 372.852 3.885 20 0 FHADHM CC[C@](C)(COc1ncccc1Cl)NCc1cc(C(=O)[O-])c(C)o1 ZINC000833639092 604719049 /nfs/dbraw/zinc/71/90/49/604719049.db2.gz YJRYGWGGKHPIIR-QGZVFWFLSA-N -1 3 352.818 3.672 20 0 FHADHM CCc1oc(C(=O)[O-])cc1CN1CCC(OCc2ccccc2OC)CC1 ZINC000563283485 604721838 /nfs/dbraw/zinc/72/18/38/604721838.db2.gz YTIQQUCQJDVKQS-UHFFFAOYSA-N -1 3 373.449 3.730 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)C[C@@H](C)c1ccc(F)cc1F ZINC000826277776 607711721 /nfs/dbraw/zinc/71/17/21/607711721.db2.gz GMIIARMOTURRCL-LLVKDONJSA-N -1 3 357.364 3.586 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)C[C@@H](C)c1ccc(F)cc1F ZINC000826277776 607711723 /nfs/dbraw/zinc/71/17/23/607711723.db2.gz GMIIARMOTURRCL-LLVKDONJSA-N -1 3 357.364 3.586 20 0 FHADHM COc1ccccc1[C@H](CN[C@H](C)c1cnc2ccsc2c1)NC(=O)[O-] ZINC000829600293 604760845 /nfs/dbraw/zinc/76/08/45/604760845.db2.gz ZBKJINDAJNESBW-WBMJQRKESA-N -1 3 371.462 3.964 20 0 FHADHM C[C@H](NCc1ccc(CCNC(=O)[O-])cc1)c1cnc2ccsc2c1 ZINC000825503947 604942433 /nfs/dbraw/zinc/94/24/33/604942433.db2.gz ZOBDVQWKGBPYPB-ZDUSSCGKSA-N -1 3 355.463 3.957 20 0 FHADHM COCc1cccc(CN(C)[C@H](C(=O)[O-])c2cc(F)c(F)c(F)c2)c1 ZINC000833726086 604976027 /nfs/dbraw/zinc/97/60/27/604976027.db2.gz QVBKUULWFWLDDK-KRWDZBQOSA-N -1 3 353.340 3.508 20 0 FHADHM Cc1cccc(COc2ccc(CN[C@H](C(=O)[O-])c3cccnc3)cc2)c1 ZINC000832967245 604991582 /nfs/dbraw/zinc/99/15/82/604991582.db2.gz WJOWYNNISPWUNM-NRFANRHFSA-N -1 3 362.429 3.885 20 0 FHADHM O=C([O-])[C@H](NCc1cccc(COCc2ccccc2)c1)c1cccnc1 ZINC000833169854 604993669 /nfs/dbraw/zinc/99/36/69/604993669.db2.gz LUBSAMRJRXGRPQ-OAQYLSRUSA-N -1 3 362.429 3.714 20 0 FHADHM c1ccc([C@@H]2CN(c3c(-c4nnn[n-]4)cnc4ccccc43)CCS2)cc1 ZINC000826521111 607729577 /nfs/dbraw/zinc/72/95/77/607729577.db2.gz ZTFKSTNNMNZKNI-SFHVURJKSA-N -1 3 374.473 3.709 20 0 FHADHM c1ccc([C@@H]2CN(c3c(-c4nn[n-]n4)cnc4ccccc43)CCS2)cc1 ZINC000826521111 607729579 /nfs/dbraw/zinc/72/95/79/607729579.db2.gz ZTFKSTNNMNZKNI-SFHVURJKSA-N -1 3 374.473 3.709 20 0 FHADHM C[C@@]1(NCc2coc(-c3ccc(F)c(F)c3)n2)CCCC[C@H]1C(=O)[O-] ZINC000833570947 605069586 /nfs/dbraw/zinc/06/95/86/605069586.db2.gz WXUFWCAXYITTSE-SCLBCKFNSA-N -1 3 350.365 3.743 20 0 FHADHM CC(=O)Nc1cccc([C@H](C)NCc2ccc([C@@H](C)NC(=O)[O-])cc2)c1 ZINC000823618626 605114731 /nfs/dbraw/zinc/11/47/31/605114731.db2.gz YNZFDLGDIPWXPM-UONOGXRCSA-N -1 3 355.438 3.824 20 0 FHADHM C[C@@H](Oc1ccc(CN[C@@H]2CC(C)(C)Oc3ccccc32)cc1)C(=O)[O-] ZINC000833541616 605117579 /nfs/dbraw/zinc/11/75/79/605117579.db2.gz RVHUEFMIXVMQLB-RDTXWAMCSA-N -1 3 355.434 3.931 20 0 FHADHM C[C@@H](NCc1ccc([C@H](C)NC(=O)[O-])cc1)c1ccc2c(c1)CCC(=O)N2 ZINC000825503881 605118836 /nfs/dbraw/zinc/11/88/36/605118836.db2.gz YZOADYTUJNMOMP-KGLIPLIRSA-N -1 3 367.449 3.751 20 0 FHADHM COc1ccc([C@@H]2CCCN2CCOc2ccccc2C(=O)[O-])cc1OC ZINC000376883986 605201306 /nfs/dbraw/zinc/20/13/06/605201306.db2.gz QMQPNJSNEBIZDS-KRWDZBQOSA-N -1 3 371.433 3.618 20 0 FHADHM COc1ccc([C@@H]2CCCN2CCOc2ccccc2C(=O)[O-])c(OC)c1 ZINC000364307710 605201689 /nfs/dbraw/zinc/20/16/89/605201689.db2.gz KLXMKFJVZVMDFX-SFHVURJKSA-N -1 3 371.433 3.618 20 0 FHADHM Cc1c(CN2CCSCC2)cccc1NCc1ccc(NC(=O)[O-])nc1 ZINC000829859019 605251372 /nfs/dbraw/zinc/25/13/72/605251372.db2.gz HJQSVGGLIUKVTO-UHFFFAOYSA-N -1 3 372.494 3.641 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)Nc1cccc2ccsc21 ZINC000826186249 607762549 /nfs/dbraw/zinc/76/25/49/607762549.db2.gz KVCYUASUDROABO-UHFFFAOYSA-N -1 3 366.406 3.734 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)Nc1cccc2ccsc21 ZINC000826186249 607762550 /nfs/dbraw/zinc/76/25/50/607762550.db2.gz KVCYUASUDROABO-UHFFFAOYSA-N -1 3 366.406 3.734 20 0 FHADHM O=C([O-])Nc1ccc2c(c1)CC[C@H]2NCc1ccc(N2CCCC2)nc1 ZINC000834261864 605577233 /nfs/dbraw/zinc/57/72/33/605577233.db2.gz GBNCYYVOQRSRAK-GOSISDBHSA-N -1 3 352.438 3.549 20 0 FHADHM C[C@H](NC(=O)[O-])[C@@H]1CCCN(Cc2ccc(-c3ccncc3)cc2F)C1 ZINC000833811551 605595735 /nfs/dbraw/zinc/59/57/35/605595735.db2.gz CPHNOKRDEYGQHH-WMLDXEAASA-N -1 3 357.429 3.756 20 0 FHADHM O=C([O-])Nc1cccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)c1 ZINC000834268210 605603474 /nfs/dbraw/zinc/60/34/74/605603474.db2.gz GWUUDYBLMJFKPJ-UHFFFAOYSA-N -1 3 368.437 3.563 20 0 FHADHM Cn1cc([C@@H](NCCc2ccc(NC(=O)[O-])cc2)c2cccc(F)c2)cn1 ZINC000833948283 605625478 /nfs/dbraw/zinc/62/54/78/605625478.db2.gz XJQOLAWXZFWOBY-IBGZPJMESA-N -1 3 368.412 3.571 20 0 FHADHM O=C([O-])N1CC[C@@]2(C1)C[C@H](N[C@H]1CCCc3[nH]ccc31)c1ccccc1O2 ZINC000834082906 605638881 /nfs/dbraw/zinc/63/88/81/605638881.db2.gz FWJPRGDKQPSIHH-WFXMLNOXSA-N -1 3 367.449 3.628 20 0 FHADHM CCC1(C(=O)Nc2nc(-c3cccc(-c4nnn[n-]4)c3)cs2)CCC1 ZINC000825165344 607769366 /nfs/dbraw/zinc/76/93/66/607769366.db2.gz ZNSIEAHJCZNNKS-UHFFFAOYSA-N -1 3 354.439 3.509 20 0 FHADHM CCC1(C(=O)Nc2nc(-c3cccc(-c4nn[n-]n4)c3)cs2)CCC1 ZINC000825165344 607769367 /nfs/dbraw/zinc/76/93/67/607769367.db2.gz ZNSIEAHJCZNNKS-UHFFFAOYSA-N -1 3 354.439 3.509 20 0 FHADHM O=C([O-])Nc1ccc(CN2CCCCC[C@H]2C[C@H](O)c2ccco2)cn1 ZINC000834260851 605675370 /nfs/dbraw/zinc/67/53/70/605675370.db2.gz ZSJSBECSPUYXGE-HOTGVXAUSA-N -1 3 359.426 3.633 20 0 FHADHM O=C([O-])Nc1cccc(CN2CCC[C@@H](n3ccc(C(F)(F)F)n3)C2)c1 ZINC000834269110 605970244 /nfs/dbraw/zinc/97/02/44/605970244.db2.gz PAZGDLDEOPOHSN-CQSZACIVSA-N -1 3 368.359 3.829 20 0 FHADHM Cc1ccc(C(F)(F)F)cc1NC(=O)c1sccc1-c1nnn[n-]1 ZINC000822230345 606032775 /nfs/dbraw/zinc/03/27/75/606032775.db2.gz DCZAYQMRRDFEAZ-UHFFFAOYSA-N -1 3 353.329 3.508 20 0 FHADHM Cc1ccc(C(F)(F)F)cc1NC(=O)c1sccc1-c1nn[n-]n1 ZINC000822230345 606032779 /nfs/dbraw/zinc/03/27/79/606032779.db2.gz DCZAYQMRRDFEAZ-UHFFFAOYSA-N -1 3 353.329 3.508 20 0 FHADHM CC[C@H](Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)C1CCOCC1 ZINC000820924927 606043106 /nfs/dbraw/zinc/04/31/06/606043106.db2.gz CIFHZWFGDUCRFK-AWEZNQCLSA-N -1 3 355.364 3.503 20 0 FHADHM CC[C@H](Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)C1CCOCC1 ZINC000820924927 606043111 /nfs/dbraw/zinc/04/31/11/606043111.db2.gz CIFHZWFGDUCRFK-AWEZNQCLSA-N -1 3 355.364 3.503 20 0 FHADHM C[C@@H](Nc1nc2ccccc2cc1-c1nnn[n-]1)c1c(F)cccc1F ZINC000820461097 606050076 /nfs/dbraw/zinc/05/00/76/606050076.db2.gz FEQGERDVINEYDP-SNVBAGLBSA-N -1 3 352.348 3.866 20 0 FHADHM C[C@@H](Nc1nc2ccccc2cc1-c1nn[n-]n1)c1c(F)cccc1F ZINC000820461097 606050080 /nfs/dbraw/zinc/05/00/80/606050080.db2.gz FEQGERDVINEYDP-SNVBAGLBSA-N -1 3 352.348 3.866 20 0 FHADHM CCCCOc1ccc([C@H](C)Nc2ccc(-c3nnn[n-]3)nc2)cc1OC ZINC000821077728 606050105 /nfs/dbraw/zinc/05/01/05/606050105.db2.gz RHMXIRQISXEHKH-ZDUSSCGKSA-N -1 3 368.441 3.622 20 0 FHADHM CCCCOc1ccc([C@H](C)Nc2ccc(-c3nn[n-]n3)nc2)cc1OC ZINC000821077728 606050110 /nfs/dbraw/zinc/05/01/10/606050110.db2.gz RHMXIRQISXEHKH-ZDUSSCGKSA-N -1 3 368.441 3.622 20 0 FHADHM Fc1ccccc1[C@@H]1CCN(c2nc3ccccc3cc2-c2nnn[n-]2)C1 ZINC000822796788 606080538 /nfs/dbraw/zinc/08/05/38/606080538.db2.gz YSYTVDNQUSHSEN-CQSZACIVSA-N -1 3 360.396 3.548 20 0 FHADHM Fc1ccccc1[C@@H]1CCN(c2nc3ccccc3cc2-c2nn[n-]n2)C1 ZINC000822796788 606080543 /nfs/dbraw/zinc/08/05/43/606080543.db2.gz YSYTVDNQUSHSEN-CQSZACIVSA-N -1 3 360.396 3.548 20 0 FHADHM Cc1ccc(OCCCC(=O)Nc2cc(-c3nnn[n-]3)ccc2C)cc1C ZINC000822263070 606103399 /nfs/dbraw/zinc/10/33/99/606103399.db2.gz IXLAHKSXJBJAIK-UHFFFAOYSA-N -1 3 365.437 3.590 20 0 FHADHM Cc1ccc(OCCCC(=O)Nc2cc(-c3nn[n-]n3)ccc2C)cc1C ZINC000822263070 606103401 /nfs/dbraw/zinc/10/34/01/606103401.db2.gz IXLAHKSXJBJAIK-UHFFFAOYSA-N -1 3 365.437 3.590 20 0 FHADHM C[C@H](C(=O)Nc1nc(-c2ccc(-c3nnn[n-]3)cc2)cs1)C1CCCC1 ZINC000819877063 606121413 /nfs/dbraw/zinc/12/14/13/606121413.db2.gz NWRCZSWYJSSZRI-NSHDSACASA-N -1 3 368.466 3.755 20 0 FHADHM C[C@H](C(=O)Nc1nc(-c2ccc(-c3nn[n-]n3)cc2)cs1)C1CCCC1 ZINC000819877063 606121415 /nfs/dbraw/zinc/12/14/15/606121415.db2.gz NWRCZSWYJSSZRI-NSHDSACASA-N -1 3 368.466 3.755 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2 ZINC000819773527 606121616 /nfs/dbraw/zinc/12/16/16/606121616.db2.gz SWPPXKPWRJNRHA-MDZDMXLPSA-N -1 3 369.425 3.598 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2 ZINC000819773527 606121618 /nfs/dbraw/zinc/12/16/18/606121618.db2.gz SWPPXKPWRJNRHA-MDZDMXLPSA-N -1 3 369.425 3.598 20 0 FHADHM Cc1sc(NC(=O)C/C=C\c2cccc(F)c2)c(-c2nnn[n-]2)c1C ZINC000822558085 606122380 /nfs/dbraw/zinc/12/23/80/606122380.db2.gz MJQJVWOISWZWJG-XQRVVYSFSA-N -1 3 357.414 3.726 20 0 FHADHM Cc1sc(NC(=O)C/C=C\c2cccc(F)c2)c(-c2nn[n-]n2)c1C ZINC000822558085 606122382 /nfs/dbraw/zinc/12/23/82/606122382.db2.gz MJQJVWOISWZWJG-XQRVVYSFSA-N -1 3 357.414 3.726 20 0 FHADHM C[C@@H](OC(=O)[C@H](C)c1ccc(Cl)s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820480884 606127374 /nfs/dbraw/zinc/12/73/74/606127374.db2.gz QEEKDTWJKCCHSL-NXEZZACHSA-N -1 3 362.842 3.990 20 0 FHADHM C[C@@H](OC(=O)[C@H](C)c1ccc(Cl)s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820480884 606127375 /nfs/dbraw/zinc/12/73/75/606127375.db2.gz QEEKDTWJKCCHSL-NXEZZACHSA-N -1 3 362.842 3.990 20 0 FHADHM Cc1cc(F)cc2c1ncc(-c1nnn[n-]1)c2N1Cc2ccccc2[C@@H]1C ZINC000822204451 606137524 /nfs/dbraw/zinc/13/75/24/606137524.db2.gz PAYYZQOWGDTKQV-LBPRGKRZSA-N -1 3 360.396 3.944 20 0 FHADHM Cc1cc(F)cc2c1ncc(-c1nn[n-]n1)c2N1Cc2ccccc2[C@@H]1C ZINC000822204451 606137526 /nfs/dbraw/zinc/13/75/26/606137526.db2.gz PAYYZQOWGDTKQV-LBPRGKRZSA-N -1 3 360.396 3.944 20 0 FHADHM O=C(Nc1nc(-c2ccc(-c3nnn[n-]3)cc2)cs1)[C@@H]1CC12CCCC2 ZINC000823375691 606146840 /nfs/dbraw/zinc/14/68/40/606146840.db2.gz FRQHYXRKRHTHNV-ZDUSSCGKSA-N -1 3 366.450 3.509 20 0 FHADHM O=C(Nc1nc(-c2ccc(-c3nn[n-]n3)cc2)cs1)[C@@H]1CC12CCCC2 ZINC000823375691 606146841 /nfs/dbraw/zinc/14/68/41/606146841.db2.gz FRQHYXRKRHTHNV-ZDUSSCGKSA-N -1 3 366.450 3.509 20 0 FHADHM CCC(CC)N(C(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(C)C)C1CC1 ZINC000820893717 606151048 /nfs/dbraw/zinc/15/10/48/606151048.db2.gz UFUFNZMAWIESJA-UHFFFAOYSA-N -1 3 372.473 3.839 20 0 FHADHM CCC(CC)N(C(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(C)C)C1CC1 ZINC000820893717 606151051 /nfs/dbraw/zinc/15/10/51/606151051.db2.gz UFUFNZMAWIESJA-UHFFFAOYSA-N -1 3 372.473 3.839 20 0 FHADHM FC(F)(F)c1ccc(N2CCc3sccc3C2)c(-c2nnn[n-]2)c1 ZINC000822723779 606174941 /nfs/dbraw/zinc/17/49/41/606174941.db2.gz OHKPEXPFJMJUFK-UHFFFAOYSA-N -1 3 351.357 3.510 20 0 FHADHM FC(F)(F)c1ccc(N2CCc3sccc3C2)c(-c2nn[n-]n2)c1 ZINC000822723779 606174942 /nfs/dbraw/zinc/17/49/42/606174942.db2.gz OHKPEXPFJMJUFK-UHFFFAOYSA-N -1 3 351.357 3.510 20 0 FHADHM Fc1ccc(CSCc2ccc(-n3ccnc3)cc2)c(-c2nnn[n-]2)c1 ZINC000822775363 606180368 /nfs/dbraw/zinc/18/03/68/606180368.db2.gz WKVHOQFJDDVJPV-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM Fc1ccc(CSCc2ccc(-n3ccnc3)cc2)c(-c2nn[n-]n2)c1 ZINC000822775363 606180369 /nfs/dbraw/zinc/18/03/69/606180369.db2.gz WKVHOQFJDDVJPV-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM Cc1sc(NC(=O)c2ccc(OC(C)(C)C)cc2)c(-c2nnn[n-]2)c1C ZINC000822564312 606183344 /nfs/dbraw/zinc/18/33/44/606183344.db2.gz ZFTHYPYIYQRUGC-UHFFFAOYSA-N -1 3 371.466 3.975 20 0 FHADHM Cc1sc(NC(=O)c2ccc(OC(C)(C)C)cc2)c(-c2nn[n-]n2)c1C ZINC000822564312 606183346 /nfs/dbraw/zinc/18/33/46/606183346.db2.gz ZFTHYPYIYQRUGC-UHFFFAOYSA-N -1 3 371.466 3.975 20 0 FHADHM O=C(Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1)[C@H]1C[C@@H]1C1CC1 ZINC000823383803 606231468 /nfs/dbraw/zinc/23/14/68/606231468.db2.gz ZZHJIGXTTTWXRA-OLZOCXBDSA-N -1 3 351.435 3.580 20 0 FHADHM O=C(Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1)[C@H]1C[C@@H]1C1CC1 ZINC000823383803 606231470 /nfs/dbraw/zinc/23/14/70/606231470.db2.gz ZZHJIGXTTTWXRA-OLZOCXBDSA-N -1 3 351.435 3.580 20 0 FHADHM O=C(Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1)[C@H]1C[C@H]1C1CC1 ZINC000823350528 606237772 /nfs/dbraw/zinc/23/77/72/606237772.db2.gz QIVLLZYZMZAIKY-ROUUACIJSA-N -1 3 361.405 3.644 20 0 FHADHM O=C(Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1)[C@H]1C[C@H]1C1CC1 ZINC000823350528 606237773 /nfs/dbraw/zinc/23/77/73/606237773.db2.gz QIVLLZYZMZAIKY-ROUUACIJSA-N -1 3 361.405 3.644 20 0 FHADHM O=C(Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)[C@@H]1C[C@@H]1C1CC1 ZINC000823368304 606247833 /nfs/dbraw/zinc/24/78/33/606247833.db2.gz UBJYFTPLHMLQRS-QZTJIDSGSA-N -1 3 361.405 3.644 20 0 FHADHM O=C(Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)[C@@H]1C[C@@H]1C1CC1 ZINC000823368304 606247835 /nfs/dbraw/zinc/24/78/35/606247835.db2.gz UBJYFTPLHMLQRS-QZTJIDSGSA-N -1 3 361.405 3.644 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1)[C@@H]1C[C@@H]1C1CC1 ZINC000823350385 606252783 /nfs/dbraw/zinc/25/27/83/606252783.db2.gz LDKPQDDNTMGTMN-QZTJIDSGSA-N -1 3 361.405 3.644 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1)[C@@H]1C[C@@H]1C1CC1 ZINC000823350385 606252785 /nfs/dbraw/zinc/25/27/85/606252785.db2.gz LDKPQDDNTMGTMN-QZTJIDSGSA-N -1 3 361.405 3.644 20 0 FHADHM CCCN(CC)C(=O)c1ccc(Sc2ccccc2-c2nnn[n-]2)cc1 ZINC000821094920 606254685 /nfs/dbraw/zinc/25/46/85/606254685.db2.gz UFZXITNFXVVJNF-UHFFFAOYSA-N -1 3 367.478 3.890 20 0 FHADHM CCCN(CC)C(=O)c1ccc(Sc2ccccc2-c2nn[n-]n2)cc1 ZINC000821094920 606254686 /nfs/dbraw/zinc/25/46/86/606254686.db2.gz UFZXITNFXVVJNF-UHFFFAOYSA-N -1 3 367.478 3.890 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)c1ccc(OC2CCCC2)cc1 ZINC000823346912 606266322 /nfs/dbraw/zinc/26/63/22/606266322.db2.gz SQCQILOPCCOPNL-UHFFFAOYSA-N -1 3 367.384 3.580 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)c1ccc(OC2CCCC2)cc1 ZINC000823346912 606266324 /nfs/dbraw/zinc/26/63/24/606266324.db2.gz SQCQILOPCCOPNL-UHFFFAOYSA-N -1 3 367.384 3.580 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)c1cccc(OC2CCCC2)c1 ZINC000823346078 606267181 /nfs/dbraw/zinc/26/71/81/606267181.db2.gz HZYWMWGJPSXAAA-UHFFFAOYSA-N -1 3 367.384 3.580 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)c1cccc(OC2CCCC2)c1 ZINC000823346078 606267182 /nfs/dbraw/zinc/26/71/82/606267182.db2.gz HZYWMWGJPSXAAA-UHFFFAOYSA-N -1 3 367.384 3.580 20 0 FHADHM Cc1ccc(SCCC(=O)Nc2ccc(F)cc2-c2nnn[n-]2)cc1C ZINC000822267227 606272671 /nfs/dbraw/zinc/27/26/71/606272671.db2.gz OZXFYFQQXYVUNF-UHFFFAOYSA-N -1 3 371.441 3.744 20 0 FHADHM Cc1ccc(SCCC(=O)Nc2ccc(F)cc2-c2nn[n-]n2)cc1C ZINC000822267227 606272673 /nfs/dbraw/zinc/27/26/73/606272673.db2.gz OZXFYFQQXYVUNF-UHFFFAOYSA-N -1 3 371.441 3.744 20 0 FHADHM O=C(CCc1ccc(-c2nnn[n-]2)cc1)N1CC2(CCCC2)c2ccccc21 ZINC000822974193 606276402 /nfs/dbraw/zinc/27/64/02/606276402.db2.gz AHSFOSQLCVZAIL-UHFFFAOYSA-N -1 3 373.460 3.658 20 0 FHADHM O=C(CCc1ccc(-c2nn[n-]n2)cc1)N1CC2(CCCC2)c2ccccc21 ZINC000822974193 606276404 /nfs/dbraw/zinc/27/64/04/606276404.db2.gz AHSFOSQLCVZAIL-UHFFFAOYSA-N -1 3 373.460 3.658 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@@H](C)c1cccc(C)c1 ZINC000821118396 606281381 /nfs/dbraw/zinc/28/13/81/606281381.db2.gz LYHJXPAEQJRTOF-AWEZNQCLSA-N -1 3 364.453 3.739 20 0 FHADHM C[C@H](Oc1ccccc1NC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1ccccc1 ZINC000820550615 606321172 /nfs/dbraw/zinc/32/11/72/606321172.db2.gz XPYUVNNUIODKGP-ZDUSSCGKSA-N -1 3 374.404 3.587 20 0 FHADHM C[C@H](Oc1ccccc1NC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1ccccc1 ZINC000820550615 606321174 /nfs/dbraw/zinc/32/11/74/606321174.db2.gz XPYUVNNUIODKGP-ZDUSSCGKSA-N -1 3 374.404 3.587 20 0 FHADHM C[C@@H](Sc1cccc(-c2nnn[n-]2)c1)c1nnc(-c2ccccc2)o1 ZINC000820555397 606323558 /nfs/dbraw/zinc/32/35/58/606323558.db2.gz KXSMGVUPHAGREL-LLVKDONJSA-N -1 3 350.407 3.770 20 0 FHADHM C[C@@H](Sc1cccc(-c2nn[n-]n2)c1)c1nnc(-c2ccccc2)o1 ZINC000820555397 606323560 /nfs/dbraw/zinc/32/35/60/606323560.db2.gz KXSMGVUPHAGREL-LLVKDONJSA-N -1 3 350.407 3.770 20 0 FHADHM CCN(CC)C(=O)[C@H](Sc1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000821169979 606328332 /nfs/dbraw/zinc/32/83/32/606328332.db2.gz KCZGKIOGMODXLL-QGZVFWFLSA-N -1 3 367.478 3.569 20 0 FHADHM CCN(CC)C(=O)[C@H](Sc1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000821169979 606328333 /nfs/dbraw/zinc/32/83/33/606328333.db2.gz KCZGKIOGMODXLL-QGZVFWFLSA-N -1 3 367.478 3.569 20 0 FHADHM Cc1ccc(Cl)cc1NC(=O)[C@H](C)Sc1cccc(-c2nnn[n-]2)c1 ZINC000822239984 606329025 /nfs/dbraw/zinc/32/90/25/606329025.db2.gz NFBGHFTXUXBEKW-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM Cc1ccc(Cl)cc1NC(=O)[C@H](C)Sc1cccc(-c2nn[n-]n2)c1 ZINC000822239984 606329026 /nfs/dbraw/zinc/32/90/26/606329026.db2.gz NFBGHFTXUXBEKW-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM Cc1ccc(Cl)cc1NC(=O)[C@@H](C)Sc1cccc(-c2nnn[n-]2)c1 ZINC000822239983 606329380 /nfs/dbraw/zinc/32/93/80/606329380.db2.gz NFBGHFTXUXBEKW-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM Cc1ccc(Cl)cc1NC(=O)[C@@H](C)Sc1cccc(-c2nn[n-]n2)c1 ZINC000822239983 606329382 /nfs/dbraw/zinc/32/93/82/606329382.db2.gz NFBGHFTXUXBEKW-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM C[C@H](OC(=O)c1cc(F)c(F)cc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000820507592 606345709 /nfs/dbraw/zinc/34/57/09/606345709.db2.gz IKRNDBKPADBZSG-QMMMGPOBSA-N -1 3 364.739 3.716 20 0 FHADHM C[C@H](OC(=O)c1cc(F)c(F)cc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000820507592 606345711 /nfs/dbraw/zinc/34/57/11/606345711.db2.gz IKRNDBKPADBZSG-QMMMGPOBSA-N -1 3 364.739 3.716 20 0 FHADHM C[C@H](OC(=O)[C@@H]1C[C@@H]1c1cccc(F)c1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000820487219 606345856 /nfs/dbraw/zinc/34/58/56/606345856.db2.gz FUSVVPGVJIUERH-COLVAYQJSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@@H]1C[C@@H]1c1cccc(F)c1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000820487219 606345859 /nfs/dbraw/zinc/34/58/59/606345859.db2.gz FUSVVPGVJIUERH-COLVAYQJSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@@H](OC(=O)[C@H]1CCSc2ccccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488468 606345916 /nfs/dbraw/zinc/34/59/16/606345916.db2.gz OKGDRZPNRCUYFX-WBMJQRKESA-N -1 3 366.446 3.751 20 0 FHADHM C[C@@H](OC(=O)[C@H]1CCSc2ccccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488468 606345918 /nfs/dbraw/zinc/34/59/18/606345918.db2.gz OKGDRZPNRCUYFX-WBMJQRKESA-N -1 3 366.446 3.751 20 0 FHADHM C[C@H](OC(=O)COc1ccc2ccccc2c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820495290 606346036 /nfs/dbraw/zinc/34/60/36/606346036.db2.gz GTUJIQIWJNECFR-AWEZNQCLSA-N -1 3 374.400 3.703 20 0 FHADHM C[C@H](OC(=O)COc1ccc2ccccc2c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820495290 606346038 /nfs/dbraw/zinc/34/60/38/606346038.db2.gz GTUJIQIWJNECFR-AWEZNQCLSA-N -1 3 374.400 3.703 20 0 FHADHM Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccc(F)cc2-c2nnn[n-]2)c1 ZINC000822299561 606346609 /nfs/dbraw/zinc/34/66/09/606346609.db2.gz MXZPALMADBEIOP-KRWDZBQOSA-N -1 3 366.400 3.683 20 0 FHADHM Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccc(F)cc2-c2nn[n-]n2)c1 ZINC000822299561 606346611 /nfs/dbraw/zinc/34/66/11/606346611.db2.gz MXZPALMADBEIOP-KRWDZBQOSA-N -1 3 366.400 3.683 20 0 FHADHM Cc1cccc(OCCC(=O)O[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1C ZINC000822327310 606348189 /nfs/dbraw/zinc/34/81/89/606348189.db2.gz FZDCULYGBALWQW-HNNXBMFYSA-N -1 3 366.421 3.557 20 0 FHADHM Cc1cccc(OCCC(=O)O[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1C ZINC000822327310 606348191 /nfs/dbraw/zinc/34/81/91/606348191.db2.gz FZDCULYGBALWQW-HNNXBMFYSA-N -1 3 366.421 3.557 20 0 FHADHM CC(C)OCc1cccc(NC(=O)Nc2ccc(F)cc2-c2nnn[n-]2)c1 ZINC000820145576 606350332 /nfs/dbraw/zinc/35/03/32/606350332.db2.gz AWWZRMROYMQEBA-UHFFFAOYSA-N -1 3 370.388 3.575 20 0 FHADHM CC(C)OCc1cccc(NC(=O)Nc2ccc(F)cc2-c2nn[n-]n2)c1 ZINC000820145576 606350333 /nfs/dbraw/zinc/35/03/33/606350333.db2.gz AWWZRMROYMQEBA-UHFFFAOYSA-N -1 3 370.388 3.575 20 0 FHADHM Cc1cccc([C@H](C)NC(=O)Nc2ccc(F)cc2-c2nnn[n-]2)c1C ZINC000822288609 606351548 /nfs/dbraw/zinc/35/15/48/606351548.db2.gz CWYATFIQRXHCJF-LBPRGKRZSA-N -1 3 354.389 3.505 20 0 FHADHM Cc1cccc([C@H](C)NC(=O)Nc2ccc(F)cc2-c2nn[n-]n2)c1C ZINC000822288609 606351550 /nfs/dbraw/zinc/35/15/50/606351550.db2.gz CWYATFIQRXHCJF-LBPRGKRZSA-N -1 3 354.389 3.505 20 0 FHADHM Cc1cc(C(=O)O[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c2ccccc2n1 ZINC000822183819 606351757 /nfs/dbraw/zinc/35/17/57/606351757.db2.gz JSHRGYOBSABJKP-CYBMUJFWSA-N -1 3 359.389 3.641 20 0 FHADHM Cc1cc(C(=O)O[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c2ccccc2n1 ZINC000822183819 606351759 /nfs/dbraw/zinc/35/17/59/606351759.db2.gz JSHRGYOBSABJKP-CYBMUJFWSA-N -1 3 359.389 3.641 20 0 FHADHM C[C@@H](CC(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccc(F)cc1 ZINC000820225109 606352310 /nfs/dbraw/zinc/35/23/10/606352310.db2.gz AWQBLNMLWFLDPT-STQMWFEESA-N -1 3 354.385 3.804 20 0 FHADHM C[C@@H](CC(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccc(F)cc1 ZINC000820225109 606352311 /nfs/dbraw/zinc/35/23/11/606352311.db2.gz AWQBLNMLWFLDPT-STQMWFEESA-N -1 3 354.385 3.804 20 0 FHADHM C[C@@H](OC(=O)C[C@H](C)c1ccc(F)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820225108 606352334 /nfs/dbraw/zinc/35/23/34/606352334.db2.gz AWQBLNMLWFLDPT-QWHCGFSZSA-N -1 3 354.385 3.804 20 0 FHADHM C[C@@H](OC(=O)C[C@H](C)c1ccc(F)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820225108 606352335 /nfs/dbraw/zinc/35/23/35/606352335.db2.gz AWQBLNMLWFLDPT-QWHCGFSZSA-N -1 3 354.385 3.804 20 0 FHADHM C[C@@H](CSc1ccccc1)C(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820292826 606354160 /nfs/dbraw/zinc/35/41/60/606354160.db2.gz HSAQASXFPOXTLN-UONOGXRCSA-N -1 3 368.462 3.899 20 0 FHADHM C[C@@H](CSc1ccccc1)C(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820292826 606354161 /nfs/dbraw/zinc/35/41/61/606354161.db2.gz HSAQASXFPOXTLN-UONOGXRCSA-N -1 3 368.462 3.899 20 0 FHADHM Cc1ccccc1OCCCC(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000822366334 606356911 /nfs/dbraw/zinc/35/69/11/606356911.db2.gz IBNWWOBJRCGECV-OAHLLOKOSA-N -1 3 366.421 3.639 20 0 FHADHM Cc1ccccc1OCCCC(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000822366334 606356913 /nfs/dbraw/zinc/35/69/13/606356913.db2.gz IBNWWOBJRCGECV-OAHLLOKOSA-N -1 3 366.421 3.639 20 0 FHADHM CC(=O)c1ccc2cc(OCCOc3ccc(-c4nn[n-]n4)cc3)ccc2c1 ZINC000819833611 606366807 /nfs/dbraw/zinc/36/68/07/606366807.db2.gz IPIWOEAMTGKPON-UHFFFAOYSA-N -1 3 374.400 3.680 20 0 FHADHM CC[C@H](Sc1ccccc1)C(=O)OCc1cc(-c2nnn[n-]2)ccc1F ZINC000820938904 606373918 /nfs/dbraw/zinc/37/39/18/606373918.db2.gz OIXLXOAUORMVKZ-INIZCTEOSA-N -1 3 372.425 3.620 20 0 FHADHM CC[C@H](Sc1ccccc1)C(=O)OCc1cc(-c2nn[n-]n2)ccc1F ZINC000820938904 606373920 /nfs/dbraw/zinc/37/39/20/606373920.db2.gz OIXLXOAUORMVKZ-INIZCTEOSA-N -1 3 372.425 3.620 20 0 FHADHM O=C(Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1)[C@H]1[C@@H]2CCC[C@@H]21 ZINC000823350438 606379350 /nfs/dbraw/zinc/37/93/50/606379350.db2.gz NAUBCSCDQQDCQL-PIIMJCKOSA-N -1 3 361.405 3.644 20 0 FHADHM O=C(Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1)[C@H]1[C@@H]2CCC[C@@H]21 ZINC000823350438 606379352 /nfs/dbraw/zinc/37/93/52/606379352.db2.gz NAUBCSCDQQDCQL-PIIMJCKOSA-N -1 3 361.405 3.644 20 0 FHADHM C[C@H](OC(=O)c1[nH]c2ccccc2c1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000820499886 606396600 /nfs/dbraw/zinc/39/66/00/606396600.db2.gz AANNOHKJUHAXDK-JTQLQIEISA-N -1 3 367.796 3.919 20 0 FHADHM C[C@H](OC(=O)c1[nH]c2ccccc2c1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000820499886 606396602 /nfs/dbraw/zinc/39/66/02/606396602.db2.gz AANNOHKJUHAXDK-JTQLQIEISA-N -1 3 367.796 3.919 20 0 FHADHM c1csc(CN(Cc2cccs2)c2ccc(-c3nnn[n-]3)cn2)c1 ZINC000823815268 606402166 /nfs/dbraw/zinc/40/21/66/606402166.db2.gz CDKNXHURGOTMNM-UHFFFAOYSA-N -1 3 354.464 3.592 20 0 FHADHM c1csc(CN(Cc2cccs2)c2ccc(-c3nn[n-]n3)cn2)c1 ZINC000823815268 606402168 /nfs/dbraw/zinc/40/21/68/606402168.db2.gz CDKNXHURGOTMNM-UHFFFAOYSA-N -1 3 354.464 3.592 20 0 FHADHM C[C@H](NCc1ccc(-c2nnn[n-]2)s1)c1ccccc1Br ZINC000820432988 606405759 /nfs/dbraw/zinc/40/57/59/606405759.db2.gz UUQKEKVRTZOXBW-VIFPVBQESA-N -1 3 364.272 3.542 20 0 FHADHM COc1cccc(C(C)=CC(=O)O[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000821859204 606409563 /nfs/dbraw/zinc/40/95/63/606409563.db2.gz MIOJAESWQDJIME-UELRPHRMSA-N -1 3 364.405 3.583 20 0 FHADHM COc1cccc(C(C)=CC(=O)O[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000821859204 606409565 /nfs/dbraw/zinc/40/95/65/606409565.db2.gz MIOJAESWQDJIME-UELRPHRMSA-N -1 3 364.405 3.583 20 0 FHADHM CN(C(=O)CCCc1cccs1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821569773 606413735 /nfs/dbraw/zinc/41/37/35/606413735.db2.gz VIGFUGYMNGMROH-UHFFFAOYSA-N -1 3 361.858 3.567 20 0 FHADHM CN(C(=O)CCCc1cccs1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821569773 606413738 /nfs/dbraw/zinc/41/37/38/606413738.db2.gz VIGFUGYMNGMROH-UHFFFAOYSA-N -1 3 361.858 3.567 20 0 FHADHM Cc1cc([C@@H](C)Nc2nc(C(F)(F)F)ccc2-c2nnn[n-]2)ccc1F ZINC000822191824 606430773 /nfs/dbraw/zinc/43/07/73/606430773.db2.gz RTZAJNGSJPDEKZ-SECBINFHSA-N -1 3 366.322 3.901 20 0 FHADHM Cc1cc([C@@H](C)Nc2nc(C(F)(F)F)ccc2-c2nn[n-]n2)ccc1F ZINC000822191824 606430774 /nfs/dbraw/zinc/43/07/74/606430774.db2.gz RTZAJNGSJPDEKZ-SECBINFHSA-N -1 3 366.322 3.901 20 0 FHADHM Fc1cc(F)c(F)c(CNc2ccc(Cl)cc2-c2nnn[n-]2)c1F ZINC000822754022 606431610 /nfs/dbraw/zinc/43/16/10/606431610.db2.gz WDEVLXKKXKRCTK-UHFFFAOYSA-N -1 3 357.698 3.689 20 0 FHADHM Fc1cc(F)c(F)c(CNc2ccc(Cl)cc2-c2nn[n-]n2)c1F ZINC000822754022 606431612 /nfs/dbraw/zinc/43/16/12/606431612.db2.gz WDEVLXKKXKRCTK-UHFFFAOYSA-N -1 3 357.698 3.689 20 0 FHADHM C[C@H]1CCCN1C(=O)c1ccccc1Sc1ccccc1-c1nnn[n-]1 ZINC000820709729 606438166 /nfs/dbraw/zinc/43/81/66/606438166.db2.gz LMEUMFSFEHKVFJ-ZDUSSCGKSA-N -1 3 365.462 3.642 20 0 FHADHM C[C@H]1CCCN1C(=O)c1ccccc1Sc1ccccc1-c1nn[n-]n1 ZINC000820709729 606438167 /nfs/dbraw/zinc/43/81/67/606438167.db2.gz LMEUMFSFEHKVFJ-ZDUSSCGKSA-N -1 3 365.462 3.642 20 0 FHADHM C[C@@H](Nc1ccc(-c2nn[n-]n2)cc1F)c1nc2ccccc2n1C(F)F ZINC000820457344 606444509 /nfs/dbraw/zinc/44/45/09/606444509.db2.gz ZYMLDDILYTYGMQ-SECBINFHSA-N -1 3 373.342 3.924 20 0 FHADHM CC(C)CC(C)(C)CNC(=O)CCCCOc1cccc(-c2nnn[n-]2)c1 ZINC000820051749 606449255 /nfs/dbraw/zinc/44/92/55/606449255.db2.gz VHFWPOWGPVGDDT-UHFFFAOYSA-N -1 3 373.501 3.604 20 0 FHADHM CC(C)CC(C)(C)CNC(=O)CCCCOc1cccc(-c2nn[n-]n2)c1 ZINC000820051749 606449257 /nfs/dbraw/zinc/44/92/57/606449257.db2.gz VHFWPOWGPVGDDT-UHFFFAOYSA-N -1 3 373.501 3.604 20 0 FHADHM Cc1cnc([C@H](Nc2cc(-c3nnn[n-]3)c3ccccc3n2)C2CC2)s1 ZINC000822389280 606469362 /nfs/dbraw/zinc/46/93/62/606469362.db2.gz QTUPUVOIVBCRHN-MRXNPFEDSA-N -1 3 363.450 3.743 20 0 FHADHM Cc1cnc([C@H](Nc2cc(-c3nn[n-]n3)c3ccccc3n2)C2CC2)s1 ZINC000822389280 606469364 /nfs/dbraw/zinc/46/93/64/606469364.db2.gz QTUPUVOIVBCRHN-MRXNPFEDSA-N -1 3 363.450 3.743 20 0 FHADHM FC(F)(F)c1cccc(-c2noc(-c3cc(-c4nnn[n-]4)cs3)n2)c1 ZINC000822728309 606470615 /nfs/dbraw/zinc/47/06/15/606470615.db2.gz GJHDKIMTQAODEX-UHFFFAOYSA-N -1 3 364.312 3.664 20 0 FHADHM FC(F)(F)c1cccc(-c2noc(-c3cc(-c4nn[n-]n4)cs3)n2)c1 ZINC000822728309 606470616 /nfs/dbraw/zinc/47/06/16/606470616.db2.gz GJHDKIMTQAODEX-UHFFFAOYSA-N -1 3 364.312 3.664 20 0 FHADHM Cc1sc(NC(=O)C2(Cc3ccccc3)CC2)c(-c2nnn[n-]2)c1C ZINC000822557941 606478773 /nfs/dbraw/zinc/47/87/73/606478773.db2.gz KYRSNLMCVOXMMR-UHFFFAOYSA-N -1 3 353.451 3.506 20 0 FHADHM Cc1sc(NC(=O)C2(Cc3ccccc3)CC2)c(-c2nn[n-]n2)c1C ZINC000822557941 606478775 /nfs/dbraw/zinc/47/87/75/606478775.db2.gz KYRSNLMCVOXMMR-UHFFFAOYSA-N -1 3 353.451 3.506 20 0 FHADHM CC(C)(C)CN(Cc1ccccc1)C(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000819913869 606507187 /nfs/dbraw/zinc/50/71/87/606507187.db2.gz FZZJOUNTIJCJEE-UHFFFAOYSA-N -1 3 355.467 3.617 20 0 FHADHM CC(C)(C)CN(Cc1ccccc1)C(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000819913869 606507189 /nfs/dbraw/zinc/50/71/89/606507189.db2.gz FZZJOUNTIJCJEE-UHFFFAOYSA-N -1 3 355.467 3.617 20 0 FHADHM C[C@H](NC(=O)c1cc(-c2nnn[n-]2)cs1)c1csc2ccccc21 ZINC000820390558 606508778 /nfs/dbraw/zinc/50/87/78/606508778.db2.gz IJMLLJCXNXARSK-VIFPVBQESA-N -1 3 355.448 3.634 20 0 FHADHM C[C@H](NC(=O)c1cc(-c2nn[n-]n2)cs1)c1csc2ccccc21 ZINC000820390558 606508780 /nfs/dbraw/zinc/50/87/80/606508780.db2.gz IJMLLJCXNXARSK-VIFPVBQESA-N -1 3 355.448 3.634 20 0 FHADHM CC(C)(C)C[C@@H](NC(=O)Cc1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000819906092 606509483 /nfs/dbraw/zinc/50/94/83/606509483.db2.gz CMTLJOWPWKASIR-GOSISDBHSA-N -1 3 363.465 3.703 20 0 FHADHM CC(C)(C)C[C@@H](NC(=O)Cc1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000819906092 606509485 /nfs/dbraw/zinc/50/94/85/606509485.db2.gz CMTLJOWPWKASIR-GOSISDBHSA-N -1 3 363.465 3.703 20 0 FHADHM O=C(CCC1CCC1)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)nc1 ZINC000822950266 606512613 /nfs/dbraw/zinc/51/26/13/606512613.db2.gz HTLYKLWRLOCPAM-UHFFFAOYSA-N -1 3 364.409 3.573 20 0 FHADHM O=C(Cc1cccc(-c2nnn[n-]2)c1)N1CCCCC[C@H]1c1ccccc1 ZINC000823087198 606515323 /nfs/dbraw/zinc/51/53/23/606515323.db2.gz KHVQXJGQIWIREA-IBGZPJMESA-N -1 3 361.449 3.553 20 0 FHADHM O=C(Cc1cccc(-c2nn[n-]n2)c1)N1CCCCC[C@H]1c1ccccc1 ZINC000823087198 606515324 /nfs/dbraw/zinc/51/53/24/606515324.db2.gz KHVQXJGQIWIREA-IBGZPJMESA-N -1 3 361.449 3.553 20 0 FHADHM CCc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)c2cc(-c3nnn[n-]3)cs2)o1 ZINC000821480846 606520330 /nfs/dbraw/zinc/52/03/30/606520330.db2.gz FLUQDBGTVWXJQG-FZMZJTMJSA-N -1 3 371.466 3.697 20 0 FHADHM CCc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)c2cc(-c3nn[n-]n3)cs2)o1 ZINC000821480846 606520332 /nfs/dbraw/zinc/52/03/32/606520332.db2.gz FLUQDBGTVWXJQG-FZMZJTMJSA-N -1 3 371.466 3.697 20 0 FHADHM Cc1cccc([C@H]2CCCCN2C(=O)c2cc(-c3nnn[n-]3)cs2)c1C ZINC000822299346 606521987 /nfs/dbraw/zinc/52/19/87/606521987.db2.gz GEMWLYFMSXANJH-MRXNPFEDSA-N -1 3 367.478 3.912 20 0 FHADHM Cc1cccc([C@H]2CCCCN2C(=O)c2cc(-c3nn[n-]n3)cs2)c1C ZINC000822299346 606521988 /nfs/dbraw/zinc/52/19/88/606521988.db2.gz GEMWLYFMSXANJH-MRXNPFEDSA-N -1 3 367.478 3.912 20 0 FHADHM CC1(CNC(=O)c2ccccc2Sc2ccccc2-c2nnn[n-]2)CC1 ZINC000820618821 606530352 /nfs/dbraw/zinc/53/03/52/606530352.db2.gz POJIPCAEORTUQN-UHFFFAOYSA-N -1 3 365.462 3.548 20 0 FHADHM CC1(CNC(=O)c2ccccc2Sc2ccccc2-c2nn[n-]n2)CC1 ZINC000820618821 606530353 /nfs/dbraw/zinc/53/03/53/606530353.db2.gz POJIPCAEORTUQN-UHFFFAOYSA-N -1 3 365.462 3.548 20 0 FHADHM CN(C(=O)c1cc(-c2nnn[n-]2)cs1)C1c2ccccc2-c2ccccc21 ZINC000821573422 606530734 /nfs/dbraw/zinc/53/07/34/606530734.db2.gz POJXYXFLHFYULO-UHFFFAOYSA-N -1 3 373.441 3.770 20 0 FHADHM CN(C(=O)c1cc(-c2nn[n-]n2)cs1)C1c2ccccc2-c2ccccc21 ZINC000821573422 606530736 /nfs/dbraw/zinc/53/07/36/606530736.db2.gz POJXYXFLHFYULO-UHFFFAOYSA-N -1 3 373.441 3.770 20 0 FHADHM O=C(Nc1ccc(N2CCCCCC2)cc1)c1cc(-c2nnn[n-]2)cs1 ZINC000823350736 606571376 /nfs/dbraw/zinc/57/13/76/606571376.db2.gz ZGDJGLNPSVZPLN-UHFFFAOYSA-N -1 3 368.466 3.561 20 0 FHADHM O=C(Nc1ccc(N2CCCCCC2)cc1)c1cc(-c2nn[n-]n2)cs1 ZINC000823350736 606571377 /nfs/dbraw/zinc/57/13/77/606571377.db2.gz ZGDJGLNPSVZPLN-UHFFFAOYSA-N -1 3 368.466 3.561 20 0 FHADHM CN(C)C(=O)Sc1ccc(CSc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000821578089 606591091 /nfs/dbraw/zinc/59/10/91/606591091.db2.gz NGWYISCRYCRWBB-UHFFFAOYSA-N -1 3 371.491 3.933 20 0 FHADHM CN(C)C(=O)Sc1ccc(CSc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000821578089 606591093 /nfs/dbraw/zinc/59/10/93/606591093.db2.gz NGWYISCRYCRWBB-UHFFFAOYSA-N -1 3 371.491 3.933 20 0 FHADHM FC(F)(F)[C@@H]1CCC[C@H](CNc2nc3c(cc2-c2nnn[n-]2)CCC3)C1 ZINC000822714954 606595630 /nfs/dbraw/zinc/59/56/30/606595630.db2.gz XOZKOSRAQWBJPG-CMPLNLGQSA-N -1 3 366.391 3.531 20 0 FHADHM FC(F)(F)[C@@H]1CCC[C@H](CNc2nc3c(cc2-c2nn[n-]n2)CCC3)C1 ZINC000822714954 606595632 /nfs/dbraw/zinc/59/56/32/606595632.db2.gz XOZKOSRAQWBJPG-CMPLNLGQSA-N -1 3 366.391 3.531 20 0 FHADHM Cc1cc(CCCC(=O)N(C)c2ccc(-c3nnn[n-]3)cc2F)c(C)s1 ZINC000822200048 606602943 /nfs/dbraw/zinc/60/29/43/606602943.db2.gz SAUAJMVVJFTGJJ-UHFFFAOYSA-N -1 3 373.457 3.670 20 0 FHADHM Cc1cc(CCCC(=O)N(C)c2ccc(-c3nn[n-]n3)cc2F)c(C)s1 ZINC000822200048 606602945 /nfs/dbraw/zinc/60/29/45/606602945.db2.gz SAUAJMVVJFTGJJ-UHFFFAOYSA-N -1 3 373.457 3.670 20 0 FHADHM C[C@@H](OC(=O)C/C=C\c1ccc(F)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000820486781 606626683 /nfs/dbraw/zinc/62/66/83/606626683.db2.gz CUIIUJSLAKSWDH-QDOCKXBDSA-N -1 3 352.369 3.714 20 0 FHADHM C[C@@H](OC(=O)C/C=C\c1ccc(F)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000820486781 606626685 /nfs/dbraw/zinc/62/66/85/606626685.db2.gz CUIIUJSLAKSWDH-QDOCKXBDSA-N -1 3 352.369 3.714 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)N(CCC(C)C)C1CCCC1 ZINC000821762862 606657365 /nfs/dbraw/zinc/65/73/65/606657365.db2.gz RFDHITVRQHDNLR-UHFFFAOYSA-N -1 3 372.473 3.698 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)N(CCC(C)C)C1CCCC1 ZINC000821762862 606657366 /nfs/dbraw/zinc/65/73/66/606657366.db2.gz RFDHITVRQHDNLR-UHFFFAOYSA-N -1 3 372.473 3.698 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)NC1[C@H](C)CCC[C@H]1C ZINC000820691393 606658855 /nfs/dbraw/zinc/65/88/55/606658855.db2.gz WYGVCIIOSBFYTI-HUUCEWRRSA-N -1 3 370.501 3.611 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)NC1[C@H](C)CCC[C@H]1C ZINC000820691393 606658856 /nfs/dbraw/zinc/65/88/56/606658856.db2.gz WYGVCIIOSBFYTI-HUUCEWRRSA-N -1 3 370.501 3.611 20 0 FHADHM CC(C)(C)c1ccccc1NC(=O)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000819959003 606663467 /nfs/dbraw/zinc/66/34/67/606663467.db2.gz UFWBKDHVLYTVEW-UHFFFAOYSA-N -1 3 357.364 3.695 20 0 FHADHM CC(C)(C)c1ccccc1NC(=O)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000819959003 606663468 /nfs/dbraw/zinc/66/34/68/606663468.db2.gz UFWBKDHVLYTVEW-UHFFFAOYSA-N -1 3 357.364 3.695 20 0 FHADHM C[C@H](c1ccccc1)N(C(=O)c1c(F)cc(-c2nnn[n-]2)cc1F)C1CC1 ZINC000820563518 606669267 /nfs/dbraw/zinc/66/92/67/606669267.db2.gz ROTRJAQRCLRBIK-LLVKDONJSA-N -1 3 369.375 3.511 20 0 FHADHM C[C@H](c1ccccc1)N(C(=O)c1c(F)cc(-c2nn[n-]n2)cc1F)C1CC1 ZINC000820563518 606669268 /nfs/dbraw/zinc/66/92/68/606669268.db2.gz ROTRJAQRCLRBIK-LLVKDONJSA-N -1 3 369.375 3.511 20 0 FHADHM FC(F)Oc1ccc(NCc2ccc(-c3nnn[n-]3)cc2)cc1Cl ZINC000822733314 606674508 /nfs/dbraw/zinc/67/45/08/606674508.db2.gz XIINNNHEFIRYHK-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM FC(F)Oc1ccc(NCc2ccc(-c3nn[n-]n3)cc2)cc1Cl ZINC000822733314 606674509 /nfs/dbraw/zinc/67/45/09/606674509.db2.gz XIINNNHEFIRYHK-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM CC(C)[C@H](c1ccccc1)N(C)C(=O)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000820032343 606678807 /nfs/dbraw/zinc/67/88/07/606678807.db2.gz MFIVOJWZHXHRRF-QGZVFWFLSA-N -1 3 371.391 3.614 20 0 FHADHM CC(C)[C@H](c1ccccc1)N(C)C(=O)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000820032343 606678808 /nfs/dbraw/zinc/67/88/08/606678808.db2.gz MFIVOJWZHXHRRF-QGZVFWFLSA-N -1 3 371.391 3.614 20 0 FHADHM FC(F)(F)c1cc(-c2nn[n-]n2)ccc1NCCc1ccc(Cl)nc1 ZINC000822718270 606721846 /nfs/dbraw/zinc/72/18/46/606721846.db2.gz GFQGYRUSDLBCMO-UHFFFAOYSA-N -1 3 368.750 3.589 20 0 FHADHM CC(C)(C)c1cnc(SCCCOc2ccc(-c3nn[n-]n3)cc2)o1 ZINC000819965433 606786038 /nfs/dbraw/zinc/78/60/38/606786038.db2.gz GZRTUWPDDFWOGR-UHFFFAOYSA-N -1 3 359.455 3.713 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1Oc1ccc(C(=O)N(C)C2CCC2)cc1 ZINC000822136312 606796940 /nfs/dbraw/zinc/79/69/40/606796940.db2.gz LGMGUMQFLRGBMB-UHFFFAOYSA-N -1 3 363.421 3.592 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1Oc1ccc(C(=O)N(C)C2CCC2)cc1 ZINC000822136312 606796941 /nfs/dbraw/zinc/79/69/41/606796941.db2.gz LGMGUMQFLRGBMB-UHFFFAOYSA-N -1 3 363.421 3.592 20 0 FHADHM COc1ccc2cc([C@H](C)C(=O)Nc3ccccc3-c3nnn[n-]3)ccc2c1 ZINC000821854791 606807590 /nfs/dbraw/zinc/80/75/90/606807590.db2.gz VLBCFIOPEIGACT-ZDUSSCGKSA-N -1 3 373.416 3.771 20 0 FHADHM COc1ccc2cc([C@H](C)C(=O)Nc3ccccc3-c3nn[n-]n3)ccc2c1 ZINC000821854791 606807591 /nfs/dbraw/zinc/80/75/91/606807591.db2.gz VLBCFIOPEIGACT-ZDUSSCGKSA-N -1 3 373.416 3.771 20 0 FHADHM CC(C)CN(C(=O)Cc1ccc(-c2nnn[n-]2)cc1)c1ccc(Cl)cc1 ZINC000820081739 606812197 /nfs/dbraw/zinc/81/21/97/606812197.db2.gz TWJWDBNQRBTSDQ-UHFFFAOYSA-N -1 3 369.856 3.752 20 0 FHADHM CC(C)CN(C(=O)Cc1ccc(-c2nn[n-]n2)cc1)c1ccc(Cl)cc1 ZINC000820081739 606812199 /nfs/dbraw/zinc/81/21/99/606812199.db2.gz TWJWDBNQRBTSDQ-UHFFFAOYSA-N -1 3 369.856 3.752 20 0 FHADHM Cc1ccccc1NC(=O)[C@@H](C)Sc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822361487 606851486 /nfs/dbraw/zinc/85/14/86/606851486.db2.gz CHROUGAXUHTEOK-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM Cc1ccccc1NC(=O)[C@@H](C)Sc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822361487 606851488 /nfs/dbraw/zinc/85/14/88/606851488.db2.gz CHROUGAXUHTEOK-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM O[C@H](CSc1ccc(Cl)c(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000823697026 606863153 /nfs/dbraw/zinc/86/31/53/606863153.db2.gz IBQVKJSPIKBOIM-CQSZACIVSA-N -1 3 367.261 3.999 20 0 FHADHM O[C@H](CSc1ccc(Cl)c(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000823697026 606863154 /nfs/dbraw/zinc/86/31/54/606863154.db2.gz IBQVKJSPIKBOIM-CQSZACIVSA-N -1 3 367.261 3.999 20 0 FHADHM CC(C)C[C@@H]1CCCCN1C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820063785 606863635 /nfs/dbraw/zinc/86/36/35/606863635.db2.gz ZCAKTWUPELTIQM-PBHICJAKSA-N -1 3 356.474 3.538 20 0 FHADHM CC(C)C[C@@H]1CCCCN1C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820063785 606863637 /nfs/dbraw/zinc/86/36/37/606863637.db2.gz ZCAKTWUPELTIQM-PBHICJAKSA-N -1 3 356.474 3.538 20 0 FHADHM CC(C)C[C@H]1CCCCN1C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820063786 606863836 /nfs/dbraw/zinc/86/38/36/606863836.db2.gz ZCAKTWUPELTIQM-RHSMWYFYSA-N -1 3 356.474 3.538 20 0 FHADHM CC(C)C[C@H]1CCCCN1C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820063786 606863838 /nfs/dbraw/zinc/86/38/38/606863838.db2.gz ZCAKTWUPELTIQM-RHSMWYFYSA-N -1 3 356.474 3.538 20 0 FHADHM CC[C@@H](SCC(=O)Nc1sccc1-c1nnn[n-]1)c1ccccc1 ZINC000820938000 606874031 /nfs/dbraw/zinc/87/40/31/606874031.db2.gz GKUSOAWNVBKNRN-CYBMUJFWSA-N -1 3 359.480 3.751 20 0 FHADHM CC[C@@H](SCC(=O)Nc1sccc1-c1nn[n-]n1)c1ccccc1 ZINC000820938000 606874033 /nfs/dbraw/zinc/87/40/33/606874033.db2.gz GKUSOAWNVBKNRN-CYBMUJFWSA-N -1 3 359.480 3.751 20 0 FHADHM Fc1cccc(N[C@@H]2CC3(CCC3)Oc3ccccc32)c1-c1nnn[n-]1 ZINC000822791558 606879983 /nfs/dbraw/zinc/87/99/83/606879983.db2.gz JHPWGDKBHAXONY-OAHLLOKOSA-N -1 3 351.385 3.864 20 0 FHADHM Fc1cccc(N[C@@H]2CC3(CCC3)Oc3ccccc32)c1-c1nn[n-]n1 ZINC000822791558 606879984 /nfs/dbraw/zinc/87/99/84/606879984.db2.gz JHPWGDKBHAXONY-OAHLLOKOSA-N -1 3 351.385 3.864 20 0 FHADHM CCN(Cc1ccn(C2CCCC2)n1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821230568 606886695 /nfs/dbraw/zinc/88/66/95/606886695.db2.gz NNTJQDCWKBWULX-HNNXBMFYSA-N -1 3 365.485 3.761 20 0 FHADHM Cc1cc(Br)cnc1N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000822162260 606921510 /nfs/dbraw/zinc/92/15/10/606921510.db2.gz ZNCAIMPSPNBTTQ-JTQLQIEISA-N -1 3 359.231 3.506 20 0 FHADHM Cc1cc(Br)cnc1N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000822162260 606921511 /nfs/dbraw/zinc/92/15/11/606921511.db2.gz ZNCAIMPSPNBTTQ-JTQLQIEISA-N -1 3 359.231 3.506 20 0 FHADHM Cc1nc(C)c(CCNc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)s1 ZINC000822432163 606934741 /nfs/dbraw/zinc/93/47/41/606934741.db2.gz ZOZYAOHCXWVNFQ-UHFFFAOYSA-N -1 3 368.388 3.613 20 0 FHADHM Cc1nc(C)c(CCNc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)s1 ZINC000822432163 606934743 /nfs/dbraw/zinc/93/47/43/606934743.db2.gz ZOZYAOHCXWVNFQ-UHFFFAOYSA-N -1 3 368.388 3.613 20 0 FHADHM C[C@@H](c1nc2ccccc2s1)N(C)Cc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000820570866 606958812 /nfs/dbraw/zinc/95/88/12/606958812.db2.gz SBAVBZYHKCMARY-NSHDSACASA-N -1 3 368.441 3.809 20 0 FHADHM C[C@@H](c1nc2ccccc2s1)N(C)Cc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000820570866 606958814 /nfs/dbraw/zinc/95/88/14/606958814.db2.gz SBAVBZYHKCMARY-NSHDSACASA-N -1 3 368.441 3.809 20 0 FHADHM CN(C(=O)c1cccc(F)c1Cl)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821574560 606959151 /nfs/dbraw/zinc/95/91/51/606959151.db2.gz LZILOBOVANRPQJ-UHFFFAOYSA-N -1 3 366.183 3.589 20 0 FHADHM CN(C(=O)c1cccc(F)c1Cl)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821574560 606959153 /nfs/dbraw/zinc/95/91/53/606959153.db2.gz LZILOBOVANRPQJ-UHFFFAOYSA-N -1 3 366.183 3.589 20 0 FHADHM CN(C(=O)[C@@H]1C[C@H]1C1CCCCC1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821569529 606959198 /nfs/dbraw/zinc/95/91/98/606959198.db2.gz NDXKLGINPXKTDB-LSDHHAIUSA-N -1 3 359.861 3.699 20 0 FHADHM CN(C(=O)[C@@H]1C[C@H]1C1CCCCC1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821569529 606959200 /nfs/dbraw/zinc/95/92/00/606959200.db2.gz NDXKLGINPXKTDB-LSDHHAIUSA-N -1 3 359.861 3.699 20 0 FHADHM CSCc1ccc(C(=O)N(C)c2cc(Cl)ccc2-c2nnn[n-]2)cc1 ZINC000821970158 606959504 /nfs/dbraw/zinc/95/95/04/606959504.db2.gz JJKZFCLFDSZYHK-UHFFFAOYSA-N -1 3 373.869 3.660 20 0 FHADHM CSCc1ccc(C(=O)N(C)c2cc(Cl)ccc2-c2nn[n-]n2)cc1 ZINC000821970158 606959505 /nfs/dbraw/zinc/95/95/05/606959505.db2.gz JJKZFCLFDSZYHK-UHFFFAOYSA-N -1 3 373.869 3.660 20 0 FHADHM Fc1ccc(CN(Cc2ccco2)Cc2ccccc2)cc1-c1nnn[n-]1 ZINC000822766453 606960182 /nfs/dbraw/zinc/96/01/82/606960182.db2.gz JLQGHWGBBKACDZ-UHFFFAOYSA-N -1 3 363.396 3.801 20 0 FHADHM Fc1ccc(CN(Cc2ccco2)Cc2ccccc2)cc1-c1nn[n-]n1 ZINC000822766453 606960184 /nfs/dbraw/zinc/96/01/84/606960184.db2.gz JLQGHWGBBKACDZ-UHFFFAOYSA-N -1 3 363.396 3.801 20 0 FHADHM CN(C(=O)C12CC3CC(CC(C3)C1)C2)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821569337 606962919 /nfs/dbraw/zinc/96/29/19/606962919.db2.gz GNMNLXXFCLGJLY-UHFFFAOYSA-N -1 3 371.872 3.699 20 0 FHADHM CN(C(=O)C12CC3CC(CC(C3)C1)C2)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821569337 606962921 /nfs/dbraw/zinc/96/29/21/606962921.db2.gz GNMNLXXFCLGJLY-UHFFFAOYSA-N -1 3 371.872 3.699 20 0 FHADHM CCCNc1ccc(Cl)cc1NC(=O)c1sccc1-c1nnn[n-]1 ZINC000821128165 606969351 /nfs/dbraw/zinc/96/93/51/606969351.db2.gz QSWRMAUXALPXJZ-UHFFFAOYSA-N -1 3 362.846 3.656 20 0 FHADHM CCCNc1ccc(Cl)cc1NC(=O)c1sccc1-c1nn[n-]n1 ZINC000821128165 606969353 /nfs/dbraw/zinc/96/93/53/606969353.db2.gz QSWRMAUXALPXJZ-UHFFFAOYSA-N -1 3 362.846 3.656 20 0 FHADHM CN(C(=O)C(c1ccccc1)c1ccccc1)c1ccccc1-c1nnn[n-]1 ZINC000821569899 606975465 /nfs/dbraw/zinc/97/54/65/606975465.db2.gz ZYLQPCJWZCQEFT-UHFFFAOYSA-N -1 3 369.428 3.662 20 0 FHADHM CN(C(=O)C(c1ccccc1)c1ccccc1)c1ccccc1-c1nn[n-]n1 ZINC000821569899 606975468 /nfs/dbraw/zinc/97/54/68/606975468.db2.gz ZYLQPCJWZCQEFT-UHFFFAOYSA-N -1 3 369.428 3.662 20 0 FHADHM CC(C)(Oc1ccc(-c2nnn[n-]2)cc1)C(=O)Nc1ccc2ccccc2c1 ZINC000820001374 606976345 /nfs/dbraw/zinc/97/63/45/606976345.db2.gz JWXDGSRZAWSVCL-UHFFFAOYSA-N -1 3 373.416 3.816 20 0 FHADHM CC(C)(Oc1ccc(-c2nn[n-]n2)cc1)C(=O)Nc1ccc2ccccc2c1 ZINC000820001374 606976347 /nfs/dbraw/zinc/97/63/47/606976347.db2.gz JWXDGSRZAWSVCL-UHFFFAOYSA-N -1 3 373.416 3.816 20 0 FHADHM Cc1cccc(-c2nnc(SCc3ccc(F)c(-c4nnn[n-]4)c3)o2)c1 ZINC000822284321 607005652 /nfs/dbraw/zinc/00/56/52/607005652.db2.gz OQHHQPGUITXYJA-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM Cc1cccc(-c2nnc(SCc3ccc(F)c(-c4nn[n-]n4)c3)o2)c1 ZINC000822284321 607005654 /nfs/dbraw/zinc/00/56/54/607005654.db2.gz OQHHQPGUITXYJA-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM COc1ccc(-c2cc(CSc3cccc(-c4nnn[n-]4)c3)on2)cc1 ZINC000821727603 607012429 /nfs/dbraw/zinc/01/24/29/607012429.db2.gz KXYVKQMLTWUKSD-UHFFFAOYSA-N -1 3 365.418 3.823 20 0 FHADHM COc1ccc(-c2cc(CSc3cccc(-c4nn[n-]n4)c3)on2)cc1 ZINC000821727603 607012431 /nfs/dbraw/zinc/01/24/31/607012431.db2.gz KXYVKQMLTWUKSD-UHFFFAOYSA-N -1 3 365.418 3.823 20 0 FHADHM CN(C)C(=O)Sc1ccc(CSc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000821578226 607013288 /nfs/dbraw/zinc/01/32/88/607013288.db2.gz UCDLXOUKKVPGHN-UHFFFAOYSA-N -1 3 371.491 3.933 20 0 FHADHM CN(C)C(=O)Sc1ccc(CSc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000821578226 607013289 /nfs/dbraw/zinc/01/32/89/607013289.db2.gz UCDLXOUKKVPGHN-UHFFFAOYSA-N -1 3 371.491 3.933 20 0 FHADHM Clc1cccc(-c2nnc(CSc3cccc(-c4nnn[n-]4)c3)o2)c1 ZINC000822582433 607014057 /nfs/dbraw/zinc/01/40/57/607014057.db2.gz TUWWBKJJUGAUQX-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1cccc(-c2nnc(CSc3cccc(-c4nn[n-]n4)c3)o2)c1 ZINC000822582433 607014059 /nfs/dbraw/zinc/01/40/59/607014059.db2.gz TUWWBKJJUGAUQX-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM CSc1ccccc1NC(=O)[C@H](C)Sc1cccc(-c2nnn[n-]2)c1 ZINC000821983052 607017156 /nfs/dbraw/zinc/01/71/56/607017156.db2.gz CXKBBXYUMZRDTG-NSHDSACASA-N -1 3 371.491 3.708 20 0 FHADHM CSc1ccccc1NC(=O)[C@H](C)Sc1cccc(-c2nn[n-]n2)c1 ZINC000821983052 607017158 /nfs/dbraw/zinc/01/71/58/607017158.db2.gz CXKBBXYUMZRDTG-NSHDSACASA-N -1 3 371.491 3.708 20 0 FHADHM Cc1ccc(OCCCC(=O)Nc2cc(-c3nnn[n-]3)ccc2C)c(C)c1 ZINC000822262630 607017550 /nfs/dbraw/zinc/01/75/50/607017550.db2.gz CEFVUWRSNYYNPW-UHFFFAOYSA-N -1 3 365.437 3.590 20 0 FHADHM Cc1ccc(OCCCC(=O)Nc2cc(-c3nn[n-]n3)ccc2C)c(C)c1 ZINC000822262630 607017552 /nfs/dbraw/zinc/01/75/52/607017552.db2.gz CEFVUWRSNYYNPW-UHFFFAOYSA-N -1 3 365.437 3.590 20 0 FHADHM Fc1ccc(CSCc2cnn(-c3ccccc3)c2)c(-c2nnn[n-]2)c1 ZINC000822774558 607033618 /nfs/dbraw/zinc/03/36/18/607033618.db2.gz LZKCJKDJDHSCIG-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM Fc1ccc(CSCc2cnn(-c3ccccc3)c2)c(-c2nn[n-]n2)c1 ZINC000822774558 607033620 /nfs/dbraw/zinc/03/36/20/607033620.db2.gz LZKCJKDJDHSCIG-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)C[C@@H]1CC[C@H](C)C1 ZINC000820087755 607033971 /nfs/dbraw/zinc/03/39/71/607033971.db2.gz ZEPJXLBIXGRJQR-DOTOQJQBSA-N -1 3 355.486 3.678 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)C[C@@H]1CC[C@H](C)C1 ZINC000820087755 607033973 /nfs/dbraw/zinc/03/39/73/607033973.db2.gz ZEPJXLBIXGRJQR-DOTOQJQBSA-N -1 3 355.486 3.678 20 0 FHADHM CC[C@@H](Cc1ccccc1)N(CC)C(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000820915257 607036198 /nfs/dbraw/zinc/03/61/98/607036198.db2.gz UNXSJZSAGDHNLK-SFHVURJKSA-N -1 3 364.453 3.742 20 0 FHADHM CC[C@@H](Cc1ccccc1)N(CC)C(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000820915257 607036200 /nfs/dbraw/zinc/03/62/00/607036200.db2.gz UNXSJZSAGDHNLK-SFHVURJKSA-N -1 3 364.453 3.742 20 0 FHADHM Cc1nc2ccccc2c(SCc2cc(F)ccc2-c2nnn[n-]2)n1 ZINC000822454373 607038129 /nfs/dbraw/zinc/03/81/29/607038129.db2.gz WJCBZPGLIINEMD-UHFFFAOYSA-N -1 3 352.398 3.550 20 0 FHADHM Cc1nc2ccccc2c(SCc2cc(F)ccc2-c2nn[n-]n2)n1 ZINC000822454373 607038130 /nfs/dbraw/zinc/03/81/30/607038130.db2.gz WJCBZPGLIINEMD-UHFFFAOYSA-N -1 3 352.398 3.550 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)O[C@H]1CCc2sc(Cl)cc21 ZINC000822935217 607094352 /nfs/dbraw/zinc/09/43/52/607094352.db2.gz HFZQDNYUCMCTSZ-LJLILKBBSA-N -1 3 372.837 3.826 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)O[C@H]1CCc2sc(Cl)cc21 ZINC000822935217 607094354 /nfs/dbraw/zinc/09/43/54/607094354.db2.gz HFZQDNYUCMCTSZ-LJLILKBBSA-N -1 3 372.837 3.826 20 0 FHADHM Cc1cc(C(=O)Nc2ccc(Cl)c(-c3nnn[n-]3)c2)c(Cl)cc1F ZINC000822175999 607112893 /nfs/dbraw/zinc/11/28/93/607112893.db2.gz DCNZQUCHGTYDIG-UHFFFAOYSA-N -1 3 366.183 3.873 20 0 FHADHM Cc1cc(C(=O)Nc2ccc(Cl)c(-c3nn[n-]n3)c2)c(Cl)cc1F ZINC000822175999 607112895 /nfs/dbraw/zinc/11/28/95/607112895.db2.gz DCNZQUCHGTYDIG-UHFFFAOYSA-N -1 3 366.183 3.873 20 0 FHADHM O=C(Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1)[C@H]1CC12CCC2 ZINC000823350267 607123182 /nfs/dbraw/zinc/12/31/82/607123182.db2.gz GONMCCBDCUAURH-QGZVFWFLSA-N -1 3 361.405 3.788 20 0 FHADHM O=C(Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1)[C@H]1CC12CCC2 ZINC000823350267 607123183 /nfs/dbraw/zinc/12/31/83/607123183.db2.gz GONMCCBDCUAURH-QGZVFWFLSA-N -1 3 361.405 3.788 20 0 FHADHM Clc1cc(-c2nn[n-]n2)ccc1NCc1ncc(-c2cccs2)o1 ZINC000822563163 607125029 /nfs/dbraw/zinc/12/50/29/607125029.db2.gz FUFHIIGBWBQTRY-UHFFFAOYSA-N -1 3 358.814 3.849 20 0 FHADHM FC(F)(F)c1cc(-c2nn[n-]n2)ccc1N[C@H]1CCOC2(CCCC2)C1 ZINC000822719013 607130144 /nfs/dbraw/zinc/13/01/44/607130144.db2.gz XPMXJVYKLDIQDF-LBPRGKRZSA-N -1 3 367.375 3.789 20 0 FHADHM C[C@@H](OC(=O)/C=C\SCc1ccco1)c1cccc(-c2nnn[n-]2)c1 ZINC000820489094 607130387 /nfs/dbraw/zinc/13/03/87/607130387.db2.gz ZELIJTBEJHMNKG-ZVTBTPLYSA-N -1 3 356.407 3.511 20 0 FHADHM C[C@@H](OC(=O)/C=C\SCc1ccco1)c1cccc(-c2nn[n-]n2)c1 ZINC000820489094 607130388 /nfs/dbraw/zinc/13/03/88/607130388.db2.gz ZELIJTBEJHMNKG-ZVTBTPLYSA-N -1 3 356.407 3.511 20 0 FHADHM CCC[C@@H](C)[C@H]1CCCN1C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000821016408 607140578 /nfs/dbraw/zinc/14/05/78/607140578.db2.gz WFAXCVYFNKHEKV-UKRRQHHQSA-N -1 3 373.505 3.856 20 0 FHADHM CCC[C@@H](C)[C@H]1CCCN1C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000821016408 607140579 /nfs/dbraw/zinc/14/05/79/607140579.db2.gz WFAXCVYFNKHEKV-UKRRQHHQSA-N -1 3 373.505 3.856 20 0 FHADHM CCC[C@@H](C)[C@@H]1CCCN1C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000821016407 607140709 /nfs/dbraw/zinc/14/07/09/607140709.db2.gz WFAXCVYFNKHEKV-HIFRSBDPSA-N -1 3 373.505 3.856 20 0 FHADHM CCC[C@@H](C)[C@@H]1CCCN1C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000821016407 607140711 /nfs/dbraw/zinc/14/07/11/607140711.db2.gz WFAXCVYFNKHEKV-HIFRSBDPSA-N -1 3 373.505 3.856 20 0 FHADHM CCCCC[C@@H]1CCCN1C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821050916 607153182 /nfs/dbraw/zinc/15/31/82/607153182.db2.gz VNJYKXMJHNGGGT-WMLDXEAASA-N -1 3 356.474 3.682 20 0 FHADHM CCCCC[C@@H]1CCCN1C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821050916 607153184 /nfs/dbraw/zinc/15/31/84/607153184.db2.gz VNJYKXMJHNGGGT-WMLDXEAASA-N -1 3 356.474 3.682 20 0 FHADHM Cc1ccccc1[C@@H](C)OC(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000822345725 607158437 /nfs/dbraw/zinc/15/84/37/607158437.db2.gz QAOBAZQFIYPHHM-CQSZACIVSA-N -1 3 368.462 3.713 20 0 FHADHM Cc1ccccc1[C@@H](C)OC(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000822345725 607158439 /nfs/dbraw/zinc/15/84/39/607158439.db2.gz QAOBAZQFIYPHHM-CQSZACIVSA-N -1 3 368.462 3.713 20 0 FHADHM C[C@@H](Sc1ccc(-c2nnn[n-]2)cn1)c1cccc(Br)c1 ZINC000820550602 607160875 /nfs/dbraw/zinc/16/08/75/607160875.db2.gz XIYSXNVJABPFKK-SECBINFHSA-N -1 3 362.256 3.878 20 0 FHADHM C[C@@H](Sc1ccc(-c2nn[n-]n2)cn1)c1cccc(Br)c1 ZINC000820550602 607160877 /nfs/dbraw/zinc/16/08/77/607160877.db2.gz XIYSXNVJABPFKK-SECBINFHSA-N -1 3 362.256 3.878 20 0 FHADHM O=C(c1cc(-c2nnn[n-]2)cs1)N1CCC[C@H]1CCC1CCCCC1 ZINC000823472703 607163847 /nfs/dbraw/zinc/16/38/47/607163847.db2.gz WAXDLFYYAPDKRY-HNNXBMFYSA-N -1 3 359.499 3.893 20 0 FHADHM O=C(c1cc(-c2nn[n-]n2)cs1)N1CCC[C@H]1CCC1CCCCC1 ZINC000823472703 607163849 /nfs/dbraw/zinc/16/38/49/607163849.db2.gz WAXDLFYYAPDKRY-HNNXBMFYSA-N -1 3 359.499 3.893 20 0 FHADHM CC1(c2ccccc2)CCC(NC(=O)c2cc(-c3nnn[n-]3)cs2)CC1 ZINC000820634370 607168809 /nfs/dbraw/zinc/16/88/09/607168809.db2.gz GUWKAEIGCXRFFK-UHFFFAOYSA-N -1 3 367.478 3.559 20 0 FHADHM CC1(c2ccccc2)CCC(NC(=O)c2cc(-c3nn[n-]n3)cs2)CC1 ZINC000820634370 607168810 /nfs/dbraw/zinc/16/88/10/607168810.db2.gz GUWKAEIGCXRFFK-UHFFFAOYSA-N -1 3 367.478 3.559 20 0 FHADHM COC[C@H](Nc1ccc(C(F)(F)F)cc1-c1nnn[n-]1)c1ccc(C)o1 ZINC000821684116 607173624 /nfs/dbraw/zinc/17/36/24/607173624.db2.gz SBYMIVXOHNNXMC-ZDUSSCGKSA-N -1 3 367.331 3.587 20 0 FHADHM COC[C@H](Nc1ccc(C(F)(F)F)cc1-c1nn[n-]n1)c1ccc(C)o1 ZINC000821684116 607173625 /nfs/dbraw/zinc/17/36/25/607173625.db2.gz SBYMIVXOHNNXMC-ZDUSSCGKSA-N -1 3 367.331 3.587 20 0 FHADHM CCc1ccc(CCC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000821481510 607189672 /nfs/dbraw/zinc/18/96/72/607189672.db2.gz KREAMWXGYFTVOF-UHFFFAOYSA-N -1 3 355.829 3.654 20 0 FHADHM CCc1ccc(CCC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000821481510 607189673 /nfs/dbraw/zinc/18/96/73/607189673.db2.gz KREAMWXGYFTVOF-UHFFFAOYSA-N -1 3 355.829 3.654 20 0 FHADHM C[C@@H](CCc1cccc(F)c1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820253521 607189753 /nfs/dbraw/zinc/18/97/53/607189753.db2.gz JKAOTLHBMLZAKG-NSHDSACASA-N -1 3 373.819 3.867 20 0 FHADHM C[C@@H](CCc1cccc(F)c1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820253521 607189754 /nfs/dbraw/zinc/18/97/54/607189754.db2.gz JKAOTLHBMLZAKG-NSHDSACASA-N -1 3 373.819 3.867 20 0 FHADHM C[C@H](CCc1ccccc1F)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820254409 607189849 /nfs/dbraw/zinc/18/98/49/607189849.db2.gz PFUJDYYTGPWHEX-LLVKDONJSA-N -1 3 373.819 3.867 20 0 FHADHM C[C@H](CCc1ccccc1F)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820254409 607189850 /nfs/dbraw/zinc/18/98/50/607189850.db2.gz PFUJDYYTGPWHEX-LLVKDONJSA-N -1 3 373.819 3.867 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)[C@@H]1C[C@H]1c1cccc(Cl)c1 ZINC000823314986 607191157 /nfs/dbraw/zinc/19/11/57/607191157.db2.gz VYUMGQXXSGJEIW-QWHCGFSZSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)[C@@H]1C[C@H]1c1cccc(Cl)c1 ZINC000823314986 607191158 /nfs/dbraw/zinc/19/11/58/607191158.db2.gz VYUMGQXXSGJEIW-QWHCGFSZSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)[C@H]1C[C@@H]1c1cccc(Cl)c1 ZINC000823314985 607191298 /nfs/dbraw/zinc/19/12/98/607191298.db2.gz VYUMGQXXSGJEIW-OLZOCXBDSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)[C@H]1C[C@@H]1c1cccc(Cl)c1 ZINC000823314985 607191299 /nfs/dbraw/zinc/19/12/99/607191299.db2.gz VYUMGQXXSGJEIW-OLZOCXBDSA-N -1 3 374.231 3.916 20 0 FHADHM C[C@H](SCc1ccccc1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820550539 607191450 /nfs/dbraw/zinc/19/14/50/607191450.db2.gz WRRNLWLHWQBBAA-NSHDSACASA-N -1 3 373.869 3.781 20 0 FHADHM C[C@H](SCc1ccccc1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820550539 607191451 /nfs/dbraw/zinc/19/14/51/607191451.db2.gz WRRNLWLHWQBBAA-NSHDSACASA-N -1 3 373.869 3.781 20 0 FHADHM Cc1ccc([C@@H]2CCCN2C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)o1 ZINC000822233591 607194859 /nfs/dbraw/zinc/19/48/59/607194859.db2.gz RRULZCHNDXLWTQ-AWEZNQCLSA-N -1 3 372.816 3.791 20 0 FHADHM Cc1ccc([C@@H]2CCCN2C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)o1 ZINC000822233591 607194860 /nfs/dbraw/zinc/19/48/60/607194860.db2.gz RRULZCHNDXLWTQ-AWEZNQCLSA-N -1 3 372.816 3.791 20 0 FHADHM Cc1cc([C@@H](C)NC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)ccc1F ZINC000822191317 607196805 /nfs/dbraw/zinc/19/68/05/607196805.db2.gz IEEGXEBIDNYRQO-SNVBAGLBSA-N -1 3 374.807 3.850 20 0 FHADHM Cc1cc([C@@H](C)NC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)ccc1F ZINC000822191317 607196806 /nfs/dbraw/zinc/19/68/06/607196806.db2.gz IEEGXEBIDNYRQO-SNVBAGLBSA-N -1 3 374.807 3.850 20 0 FHADHM Cc1ccccc1[C@H](C)NC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822344926 607198570 /nfs/dbraw/zinc/19/85/70/607198570.db2.gz CYWKASZPQFAZHV-NSHDSACASA-N -1 3 356.817 3.711 20 0 FHADHM Cc1ccccc1[C@H](C)NC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822344926 607198571 /nfs/dbraw/zinc/19/85/71/607198571.db2.gz CYWKASZPQFAZHV-NSHDSACASA-N -1 3 356.817 3.711 20 0 FHADHM CC(C)[C@H]1CCCN(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)CC1 ZINC000820037554 607203165 /nfs/dbraw/zinc/20/31/65/607203165.db2.gz DJYYNHRBGNMGSP-LBPRGKRZSA-N -1 3 362.865 3.810 20 0 FHADHM CC(C)[C@H]1CCCN(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)CC1 ZINC000820037554 607203166 /nfs/dbraw/zinc/20/31/66/607203166.db2.gz DJYYNHRBGNMGSP-LBPRGKRZSA-N -1 3 362.865 3.810 20 0 FHADHM O=C(CCc1cc(Cl)cs1)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822974360 607240837 /nfs/dbraw/zinc/24/08/37/607240837.db2.gz IUPLTXYWRTXLKG-UHFFFAOYSA-N -1 3 368.249 3.806 20 0 FHADHM O=C(CCc1cc(Cl)cs1)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822974360 607240838 /nfs/dbraw/zinc/24/08/38/607240838.db2.gz IUPLTXYWRTXLKG-UHFFFAOYSA-N -1 3 368.249 3.806 20 0 FHADHM CC[C@@H](Cc1ccccc1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820914605 607241350 /nfs/dbraw/zinc/24/13/50/607241350.db2.gz PWEDGGKOMVFITG-ZDUSSCGKSA-N -1 3 355.829 3.728 20 0 FHADHM CC[C@@H](Cc1ccccc1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820914605 607241351 /nfs/dbraw/zinc/24/13/51/607241351.db2.gz PWEDGGKOMVFITG-ZDUSSCGKSA-N -1 3 355.829 3.728 20 0 FHADHM COc1ccc([C@@H](C)CC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000821777626 607241469 /nfs/dbraw/zinc/24/14/69/607241469.db2.gz JSMVPGFLNNMRTO-NSHDSACASA-N -1 3 371.828 3.661 20 0 FHADHM COc1ccc([C@@H](C)CC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000821777626 607241470 /nfs/dbraw/zinc/24/14/70/607241470.db2.gz JSMVPGFLNNMRTO-NSHDSACASA-N -1 3 371.828 3.661 20 0 FHADHM Cc1ccc(/C=C\CC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000822233520 607241547 /nfs/dbraw/zinc/24/15/47/607241547.db2.gz QQOPTKHAGJBGMR-IHWYPQMZSA-N -1 3 353.813 3.871 20 0 FHADHM Cc1ccc(/C=C\CC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000822233520 607241548 /nfs/dbraw/zinc/24/15/48/607241548.db2.gz QQOPTKHAGJBGMR-IHWYPQMZSA-N -1 3 353.813 3.871 20 0 FHADHM COc1ccc([C@H](C)CC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000821777625 607241633 /nfs/dbraw/zinc/24/16/33/607241633.db2.gz JSMVPGFLNNMRTO-LLVKDONJSA-N -1 3 371.828 3.661 20 0 FHADHM COc1ccc([C@H](C)CC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000821777625 607241634 /nfs/dbraw/zinc/24/16/34/607241634.db2.gz JSMVPGFLNNMRTO-LLVKDONJSA-N -1 3 371.828 3.661 20 0 FHADHM O=C(C[C@H]1CCc2ccccc2C1)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822945353 607241746 /nfs/dbraw/zinc/24/17/46/607241746.db2.gz BTCDZZWHZFEUTL-LBPRGKRZSA-N -1 3 367.840 3.654 20 0 FHADHM O=C(C[C@H]1CCc2ccccc2C1)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822945353 607241747 /nfs/dbraw/zinc/24/17/47/607241747.db2.gz BTCDZZWHZFEUTL-LBPRGKRZSA-N -1 3 367.840 3.654 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)[C@@H]1CCSc2ccccc21 ZINC000823315499 607241779 /nfs/dbraw/zinc/24/17/79/607241779.db2.gz YRMOHNKANNXIGH-GFCCVEGCSA-N -1 3 371.853 3.738 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)[C@@H]1CCSc2ccccc21 ZINC000823315499 607241780 /nfs/dbraw/zinc/24/17/80/607241780.db2.gz YRMOHNKANNXIGH-GFCCVEGCSA-N -1 3 371.853 3.738 20 0 FHADHM Cc1cccc(CSCC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)c1 ZINC000822304166 607242252 /nfs/dbraw/zinc/24/22/52/607242252.db2.gz RFZOZJADQVUJFE-UHFFFAOYSA-N -1 3 373.869 3.700 20 0 FHADHM Cc1cccc(CSCC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)c1 ZINC000822304166 607242253 /nfs/dbraw/zinc/24/22/53/607242253.db2.gz RFZOZJADQVUJFE-UHFFFAOYSA-N -1 3 373.869 3.700 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1cccc(Cl)c1 ZINC000819867916 607242739 /nfs/dbraw/zinc/24/27/39/607242739.db2.gz VHTVHDUJWSCANA-SECBINFHSA-N -1 3 362.220 3.916 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1cccc(Cl)c1 ZINC000819867916 607242740 /nfs/dbraw/zinc/24/27/40/607242740.db2.gz VHTVHDUJWSCANA-SECBINFHSA-N -1 3 362.220 3.916 20 0 FHADHM CC[C@H](NC(=S)Nc1cccc(-c2nnn[n-]2)c1C)c1cccs1 ZINC000820919712 607251493 /nfs/dbraw/zinc/25/14/93/607251493.db2.gz FYBJZZSSASUXNJ-LBPRGKRZSA-N -1 3 358.496 3.674 20 0 FHADHM CC[C@H](NC(=S)Nc1cccc(-c2nn[n-]n2)c1C)c1cccs1 ZINC000820919712 607251494 /nfs/dbraw/zinc/25/14/94/607251494.db2.gz FYBJZZSSASUXNJ-LBPRGKRZSA-N -1 3 358.496 3.674 20 0 FHADHM CCC1(CC)CN(C(=O)c2sccc2-c2nnn[n-]2)c2ccccc21 ZINC000825171916 607773652 /nfs/dbraw/zinc/77/36/52/607773652.db2.gz WIXFEFYFAXFVOL-UHFFFAOYSA-N -1 3 353.451 3.646 20 0 FHADHM CCC1(CC)CN(C(=O)c2sccc2-c2nn[n-]n2)c2ccccc21 ZINC000825171916 607773653 /nfs/dbraw/zinc/77/36/53/607773653.db2.gz WIXFEFYFAXFVOL-UHFFFAOYSA-N -1 3 353.451 3.646 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@@H](CC)c2ccccc2)cc1-c1nnn[n-]1 ZINC000825553783 607784090 /nfs/dbraw/zinc/78/40/90/607784090.db2.gz WFDZARYVPZWRBD-INIZCTEOSA-N -1 3 366.425 3.998 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@@H](CC)c2ccccc2)cc1-c1nn[n-]n1 ZINC000825553783 607784091 /nfs/dbraw/zinc/78/40/91/607784091.db2.gz WFDZARYVPZWRBD-INIZCTEOSA-N -1 3 366.425 3.998 20 0 FHADHM CN(C(=O)C1CCC(c2ccccc2)CC1)c1ccccc1-c1nnn[n-]1 ZINC000825811768 607789060 /nfs/dbraw/zinc/78/90/60/607789060.db2.gz BJYMOJIBDATMNO-UHFFFAOYSA-N -1 3 361.449 3.804 20 0 FHADHM CN(C(=O)C1CCC(c2ccccc2)CC1)c1ccccc1-c1nn[n-]n1 ZINC000825811768 607789061 /nfs/dbraw/zinc/78/90/61/607789061.db2.gz BJYMOJIBDATMNO-UHFFFAOYSA-N -1 3 361.449 3.804 20 0 FHADHM CC(C)[C@H]1CC[C@H](C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)CC1 ZINC000824342224 607792800 /nfs/dbraw/zinc/79/28/00/607792800.db2.gz NLRZYLGXYVKKCY-SAABIXHNSA-N -1 3 367.497 3.820 20 0 FHADHM CC(C)[C@H]1CC[C@H](C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)CC1 ZINC000824342224 607792801 /nfs/dbraw/zinc/79/28/01/607792801.db2.gz NLRZYLGXYVKKCY-SAABIXHNSA-N -1 3 367.497 3.820 20 0 FHADHM CC1(CC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)CCCCC1 ZINC000824818147 607793773 /nfs/dbraw/zinc/79/37/73/607793773.db2.gz SATOEEHMGVTKLH-UHFFFAOYSA-N -1 3 353.470 3.718 20 0 FHADHM CC1(CC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)CCCCC1 ZINC000824818147 607793774 /nfs/dbraw/zinc/79/37/74/607793774.db2.gz SATOEEHMGVTKLH-UHFFFAOYSA-N -1 3 353.470 3.718 20 0 FHADHM Cc1ccc(C(=O)Nc2sc(-c3ccccc3)cc2-c2nnn[n-]2)nc1 ZINC000826282329 607793997 /nfs/dbraw/zinc/79/39/97/607793997.db2.gz JAKLAIDMHWRADH-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM Cc1ccc(C(=O)Nc2sc(-c3ccccc3)cc2-c2nn[n-]n2)nc1 ZINC000826282329 607793998 /nfs/dbraw/zinc/79/39/98/607793998.db2.gz JAKLAIDMHWRADH-UHFFFAOYSA-N -1 3 362.418 3.551 20 0 FHADHM CCN(C(=O)c1cc(Cl)ccc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000825379587 607799204 /nfs/dbraw/zinc/79/92/04/607799204.db2.gz ISACZAGJDPAWDO-UHFFFAOYSA-N -1 3 362.220 3.840 20 0 FHADHM CCN(C(=O)c1cc(Cl)ccc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000825379587 607799203 /nfs/dbraw/zinc/79/92/03/607799203.db2.gz ISACZAGJDPAWDO-UHFFFAOYSA-N -1 3 362.220 3.840 20 0 FHADHM Fc1cccc(N[C@H](C[C@@H]2CCOC2)c2ccccc2)c1-c1nnn[n-]1 ZINC000826377276 607811162 /nfs/dbraw/zinc/81/11/62/607811162.db2.gz LGSVYXROKUUYGT-SUMWQHHRSA-N -1 3 353.401 3.586 20 0 FHADHM Fc1cccc(N[C@H](C[C@@H]2CCOC2)c2ccccc2)c1-c1nn[n-]n1 ZINC000826377276 607811163 /nfs/dbraw/zinc/81/11/63/607811163.db2.gz LGSVYXROKUUYGT-SUMWQHHRSA-N -1 3 353.401 3.586 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CNCc1cc(Cl)ccc1Cl ZINC000826373471 607813146 /nfs/dbraw/zinc/81/31/46/607813146.db2.gz NJINFTPKMQUIHG-UHFFFAOYSA-N -1 3 352.200 3.602 20 0 FHADHM C[C@H](Cc1ccccc1Cl)C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000824456904 607815877 /nfs/dbraw/zinc/81/58/77/607815877.db2.gz AHWCKRAIXHJDDY-OLZOCXBDSA-N -1 3 369.856 3.576 20 0 FHADHM C[C@H](Cc1ccccc1Cl)C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000824456904 607815876 /nfs/dbraw/zinc/81/58/76/607815876.db2.gz AHWCKRAIXHJDDY-OLZOCXBDSA-N -1 3 369.856 3.576 20 0 FHADHM C[C@@H](NC(=O)[C@@H](C)Cc1ccccc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000824456905 607816052 /nfs/dbraw/zinc/81/60/52/607816052.db2.gz AHWCKRAIXHJDDY-QWHCGFSZSA-N -1 3 369.856 3.576 20 0 FHADHM C[C@@H](NC(=O)[C@@H](C)Cc1ccccc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000824456905 607816053 /nfs/dbraw/zinc/81/60/53/607816053.db2.gz AHWCKRAIXHJDDY-QWHCGFSZSA-N -1 3 369.856 3.576 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)CCC(C)(C)c1ccccc1 ZINC000826185391 607817905 /nfs/dbraw/zinc/81/79/05/607817905.db2.gz JBCXLRYMXOQGKW-UHFFFAOYSA-N -1 3 365.437 3.572 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)CCC(C)(C)c1ccccc1 ZINC000826185391 607817906 /nfs/dbraw/zinc/81/79/06/607817906.db2.gz JBCXLRYMXOQGKW-UHFFFAOYSA-N -1 3 365.437 3.572 20 0 FHADHM FC(F)(F)c1cc(-c2nn[n-]n2)ccc1N1CCC(c2ccccn2)CC1 ZINC000826368708 607820528 /nfs/dbraw/zinc/82/05/28/607820528.db2.gz ZCANITICGKSKTF-UHFFFAOYSA-N -1 3 374.370 3.665 20 0 FHADHM CCN(C(=O)CCC(C)(C)c1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825371935 607829837 /nfs/dbraw/zinc/82/98/37/607829837.db2.gz NLORJLPIOYZOCE-UHFFFAOYSA-N -1 3 363.465 3.978 20 0 FHADHM CCN(C(=O)CCC(C)(C)c1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825371935 607829838 /nfs/dbraw/zinc/82/98/38/607829838.db2.gz NLORJLPIOYZOCE-UHFFFAOYSA-N -1 3 363.465 3.978 20 0 FHADHM Cc1ccc(F)c(NC(=O)c2c(Cl)cc(-c3nnn[n-]3)cc2Cl)c1 ZINC000826289041 607833431 /nfs/dbraw/zinc/83/34/31/607833431.db2.gz IBZMHURAZVUJMQ-UHFFFAOYSA-N -1 3 366.183 3.873 20 0 FHADHM Cc1ccc(F)c(NC(=O)c2c(Cl)cc(-c3nn[n-]n3)cc2Cl)c1 ZINC000826289041 607833432 /nfs/dbraw/zinc/83/34/32/607833432.db2.gz IBZMHURAZVUJMQ-UHFFFAOYSA-N -1 3 366.183 3.873 20 0 FHADHM CN(Cc1nc2ccccc2s1)c1ccc2cc(-c3nnn[n-]3)ccc2n1 ZINC000825992258 607838692 /nfs/dbraw/zinc/83/86/92/607838692.db2.gz RMJIKJUWLAYIGT-UHFFFAOYSA-N -1 3 373.445 3.661 20 0 FHADHM CN(Cc1nc2ccccc2s1)c1ccc2cc(-c3nn[n-]n3)ccc2n1 ZINC000825992258 607838693 /nfs/dbraw/zinc/83/86/93/607838693.db2.gz RMJIKJUWLAYIGT-UHFFFAOYSA-N -1 3 373.445 3.661 20 0 FHADHM O[C@@H](CSc1ccc(-c2nnn[n-]2)cc1Cl)c1ccc(F)c(F)c1 ZINC000826505309 607843273 /nfs/dbraw/zinc/84/32/73/607843273.db2.gz RUTVLBXYWGUAKU-ZDUSSCGKSA-N -1 3 368.796 3.624 20 0 FHADHM O[C@@H](CSc1ccc(-c2nn[n-]n2)cc1Cl)c1ccc(F)c(F)c1 ZINC000826505309 607843274 /nfs/dbraw/zinc/84/32/74/607843274.db2.gz RUTVLBXYWGUAKU-ZDUSSCGKSA-N -1 3 368.796 3.624 20 0 FHADHM CC(=O)Oc1ccc(CSc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000824009928 607844098 /nfs/dbraw/zinc/84/40/98/607844098.db2.gz FOOVLTTYWJQOGF-UHFFFAOYSA-N -1 3 360.826 3.738 20 0 FHADHM CC(=O)Oc1ccc(CSc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000824009928 607844099 /nfs/dbraw/zinc/84/40/99/607844099.db2.gz FOOVLTTYWJQOGF-UHFFFAOYSA-N -1 3 360.826 3.738 20 0 FHADHM Cc1nn(C)c(Cl)c1CSc1ccc(-c2nnn[n-]2)cc1Cl ZINC000826333989 607844821 /nfs/dbraw/zinc/84/48/21/607844821.db2.gz CFKDXAYSPVCWFI-UHFFFAOYSA-N -1 3 355.254 3.508 20 0 FHADHM O[C@H](COc1ccc2oc3ccccc3c2c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000826505559 607870543 /nfs/dbraw/zinc/87/05/43/607870543.db2.gz YWQMMFLYGLKYOO-GOSISDBHSA-N -1 3 372.384 3.879 20 0 FHADHM O[C@H](COc1ccc2oc3ccccc3c2c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000826505559 607870544 /nfs/dbraw/zinc/87/05/44/607870544.db2.gz YWQMMFLYGLKYOO-GOSISDBHSA-N -1 3 372.384 3.879 20 0 FHADHM CCN(C(=O)c1ccccc1Cl)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825385266 607878018 /nfs/dbraw/zinc/87/80/18/607878018.db2.gz AYEZTUGMNNJZSN-UHFFFAOYSA-N -1 3 362.220 3.840 20 0 FHADHM CCN(C(=O)c1ccccc1Cl)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825385266 607878019 /nfs/dbraw/zinc/87/80/19/607878019.db2.gz AYEZTUGMNNJZSN-UHFFFAOYSA-N -1 3 362.220 3.840 20 0 FHADHM CC(C)c1ccc(-c2ncc(Cn3ccc(-c4nnn[n-]4)c3)s2)cc1 ZINC000824347588 607890834 /nfs/dbraw/zinc/89/08/34/607890834.db2.gz FUVYFMDWWZHMBD-UHFFFAOYSA-N -1 3 350.451 3.963 20 0 FHADHM CC(C)c1ccc(-c2ncc(Cn3ccc(-c4nn[n-]n4)c3)s2)cc1 ZINC000824347588 607890835 /nfs/dbraw/zinc/89/08/35/607890835.db2.gz FUVYFMDWWZHMBD-UHFFFAOYSA-N -1 3 350.451 3.963 20 0 FHADHM Cc1c(NC(=O)[C@H](c2ccc(F)cc2)C(C)C)cccc1-c1nnn[n-]1 ZINC000826241172 607908838 /nfs/dbraw/zinc/90/88/38/607908838.db2.gz UBDQKSUTLIFDCR-KRWDZBQOSA-N -1 3 353.401 3.693 20 0 FHADHM Cc1c(NC(=O)[C@H](c2ccc(F)cc2)C(C)C)cccc1-c1nn[n-]n1 ZINC000826241172 607908839 /nfs/dbraw/zinc/90/88/39/607908839.db2.gz UBDQKSUTLIFDCR-KRWDZBQOSA-N -1 3 353.401 3.693 20 0 FHADHM CS[C@@H](C)CC(=O)Oc1ccc(-c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000826225321 607931228 /nfs/dbraw/zinc/93/12/28/607931228.db2.gz YUIZVUABKMIYLO-LBPRGKRZSA-N -1 3 354.435 3.581 20 0 FHADHM CS[C@@H](C)CC(=O)Oc1ccc(-c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000826225321 607931229 /nfs/dbraw/zinc/93/12/29/607931229.db2.gz YUIZVUABKMIYLO-LBPRGKRZSA-N -1 3 354.435 3.581 20 0 FHADHM O=C(CCc1ccc2ccccc2c1)N1CCc2ccc(-c3nnn[n-]3)cc21 ZINC000826409345 607952118 /nfs/dbraw/zinc/95/21/18/607952118.db2.gz SXHXZEDBIJCRDI-UHFFFAOYSA-N -1 3 369.428 3.542 20 0 FHADHM O=C(CCc1ccc2ccccc2c1)N1CCc2ccc(-c3nn[n-]n3)cc21 ZINC000826409345 607952119 /nfs/dbraw/zinc/95/21/19/607952119.db2.gz SXHXZEDBIJCRDI-UHFFFAOYSA-N -1 3 369.428 3.542 20 0 FHADHM CC(C)Sc1ccc(C(=O)N2CCc3ccc(-c4nnn[n-]4)cc32)cc1 ZINC000824337966 607953057 /nfs/dbraw/zinc/95/30/57/607953057.db2.gz LRTWMFXGJGAOCY-UHFFFAOYSA-N -1 3 365.462 3.570 20 0 FHADHM CC(C)Sc1ccc(C(=O)N2CCc3ccc(-c4nn[n-]n4)cc32)cc1 ZINC000824337966 607953058 /nfs/dbraw/zinc/95/30/58/607953058.db2.gz LRTWMFXGJGAOCY-UHFFFAOYSA-N -1 3 365.462 3.570 20 0 FHADHM Cc1nnc(SCc2ccc(-c3nnn[n-]3)cc2)n1[C@H]1CCC[C@@H](C)C1 ZINC000826337429 607966082 /nfs/dbraw/zinc/96/60/82/607966082.db2.gz NVUWJHGTSNKFTI-WBMJQRKESA-N -1 3 369.498 3.810 20 0 FHADHM Cc1nnc(SCc2ccc(-c3nn[n-]n3)cc2)n1[C@H]1CCC[C@@H](C)C1 ZINC000826337429 607966083 /nfs/dbraw/zinc/96/60/83/607966083.db2.gz NVUWJHGTSNKFTI-WBMJQRKESA-N -1 3 369.498 3.810 20 0 FHADHM Cn1cc(-c2ccccc2CNc2ccc(Cl)cc2-c2nnn[n-]2)cn1 ZINC000826356643 607966650 /nfs/dbraw/zinc/96/66/50/607966650.db2.gz ZRMQKUNSJMUNGY-UHFFFAOYSA-N -1 3 365.828 3.533 20 0 FHADHM Cn1cc(-c2ccccc2CNc2ccc(Cl)cc2-c2nn[n-]n2)cn1 ZINC000826356643 607966651 /nfs/dbraw/zinc/96/66/51/607966651.db2.gz ZRMQKUNSJMUNGY-UHFFFAOYSA-N -1 3 365.828 3.533 20 0 FHADHM Cc1cc([C@H](Nc2ncc(-c3nnn[n-]3)cc2Cl)C2CC2)ccc1F ZINC000826262671 607968808 /nfs/dbraw/zinc/96/88/08/607968808.db2.gz VDPOYLFLUPOABF-OAHLLOKOSA-N -1 3 358.808 3.926 20 0 FHADHM Cc1cc([C@H](Nc2ncc(-c3nn[n-]n3)cc2Cl)C2CC2)ccc1F ZINC000826262671 607968809 /nfs/dbraw/zinc/96/88/09/607968809.db2.gz VDPOYLFLUPOABF-OAHLLOKOSA-N -1 3 358.808 3.926 20 0 FHADHM Clc1ccc(N2CCc3c4ccccc4[nH]c3C2)c(-c2nnn[n-]2)c1 ZINC000826352096 607968849 /nfs/dbraw/zinc/96/88/49/607968849.db2.gz NDXRPNOVVPHJKX-UHFFFAOYSA-N -1 3 350.813 3.564 20 0 FHADHM Clc1ccc(N2CCc3c4ccccc4[nH]c3C2)c(-c2nn[n-]n2)c1 ZINC000826352096 607968850 /nfs/dbraw/zinc/96/88/50/607968850.db2.gz NDXRPNOVVPHJKX-UHFFFAOYSA-N -1 3 350.813 3.564 20 0 FHADHM CCn1c2ccc(-c3nnn[n-]3)cc2nc1-c1ccc(OC(F)F)c(F)c1 ZINC000825782798 607975921 /nfs/dbraw/zinc/97/59/21/607975921.db2.gz PVMXYDRPWJIPEV-UHFFFAOYSA-N -1 3 374.326 3.644 20 0 FHADHM CCn1c2ccc(-c3nn[n-]n3)cc2nc1-c1ccc(OC(F)F)c(F)c1 ZINC000825782798 607975922 /nfs/dbraw/zinc/97/59/22/607975922.db2.gz PVMXYDRPWJIPEV-UHFFFAOYSA-N -1 3 374.326 3.644 20 0 FHADHM Cc1cc([C@@H](NC(=O)Nc2ccc(-c3nnn[n-]3)cc2)C2CC2)ccc1F ZINC000826262679 607977605 /nfs/dbraw/zinc/97/76/05/607977605.db2.gz VLHCJIDEAHVDTD-KRWDZBQOSA-N -1 3 366.400 3.587 20 0 FHADHM Cc1cc([C@@H](NC(=O)Nc2ccc(-c3nn[n-]n3)cc2)C2CC2)ccc1F ZINC000826262679 607977606 /nfs/dbraw/zinc/97/76/06/607977606.db2.gz VLHCJIDEAHVDTD-KRWDZBQOSA-N -1 3 366.400 3.587 20 0 FHADHM COc1ccc([C@@H](C)Nc2ccc(-c3nn[n-]n3)cc2Br)cc1 ZINC000826188772 608048568 /nfs/dbraw/zinc/04/85/68/608048568.db2.gz GFEBUYCILQKXBV-SNVBAGLBSA-N -1 3 374.242 3.811 20 0 FHADHM Cc1cnc([C@H](C)Nc2ccc(-c3nn[n-]n3)cc2Br)s1 ZINC000826317759 608050798 /nfs/dbraw/zinc/05/07/98/608050798.db2.gz MQYFYBIDTJBLKK-QMMMGPOBSA-N -1 3 365.260 3.567 20 0 FHADHM Clc1ccc2c(c1)CN(c1cc(-c3nnn[n-]3)c3ccccc3n1)CC2 ZINC000826353064 608052049 /nfs/dbraw/zinc/05/20/49/608052049.db2.gz ZNKYSLZLORMTJQ-UHFFFAOYSA-N -1 3 362.824 3.631 20 0 FHADHM Clc1ccc2c(c1)CN(c1cc(-c3nn[n-]n3)c3ccccc3n1)CC2 ZINC000826353064 608052050 /nfs/dbraw/zinc/05/20/50/608052050.db2.gz ZNKYSLZLORMTJQ-UHFFFAOYSA-N -1 3 362.824 3.631 20 0 FHADHM C[C@@H](OC(=O)CCCc1cc(F)ccc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000824715302 608067126 /nfs/dbraw/zinc/06/71/26/608067126.db2.gz RDCRXDXKXBMNOM-GFCCVEGCSA-N -1 3 372.375 3.772 20 0 FHADHM C[C@@H](OC(=O)CCCc1cc(F)ccc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000824715302 608067127 /nfs/dbraw/zinc/06/71/27/608067127.db2.gz RDCRXDXKXBMNOM-GFCCVEGCSA-N -1 3 372.375 3.772 20 0 FHADHM C[C@@H](c1ccc(Cl)cc1)N1CCO[C@@H](c2cccc(-c3nnn[n-]3)c2)C1 ZINC000824763502 608071543 /nfs/dbraw/zinc/07/15/43/608071543.db2.gz MYKSRWKEQBOMMP-SCLBCKFNSA-N -1 3 369.856 3.655 20 0 FHADHM C[C@@H](c1ccc(Cl)cc1)N1CCO[C@@H](c2cccc(-c3nn[n-]n3)c2)C1 ZINC000824763502 608071544 /nfs/dbraw/zinc/07/15/44/608071544.db2.gz MYKSRWKEQBOMMP-SCLBCKFNSA-N -1 3 369.856 3.655 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1cc(F)c(Cl)cc1F ZINC000826452011 608122984 /nfs/dbraw/zinc/12/29/84/608122984.db2.gz FIQRGWDYGFLACM-UHFFFAOYSA-N -1 3 370.146 3.704 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1cc(F)c(Cl)cc1F ZINC000826452011 608122985 /nfs/dbraw/zinc/12/29/85/608122985.db2.gz FIQRGWDYGFLACM-UHFFFAOYSA-N -1 3 370.146 3.704 20 0 FHADHM CC(C)c1ccc(/C=C/CC(=O)NCc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000495130204 608151022 /nfs/dbraw/zinc/15/10/22/608151022.db2.gz HHYGTZPRJCLMQJ-ONEGZZNKSA-N -1 3 361.449 3.710 20 0 FHADHM CC(C)c1ccc(/C=C/CC(=O)NCc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000495130204 608151024 /nfs/dbraw/zinc/15/10/24/608151024.db2.gz HHYGTZPRJCLMQJ-ONEGZZNKSA-N -1 3 361.449 3.710 20 0 FHADHM C[C@H](OC(=O)[C@@H]1SCCc2ccccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000824716662 608181778 /nfs/dbraw/zinc/18/17/78/608181778.db2.gz ZWJPTLYZKUATET-YVEFUNNKSA-N -1 3 366.446 3.502 20 0 FHADHM C[C@H](OC(=O)[C@@H]1SCCc2ccccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000824716662 608181779 /nfs/dbraw/zinc/18/17/79/608181779.db2.gz ZWJPTLYZKUATET-YVEFUNNKSA-N -1 3 366.446 3.502 20 0 FHADHM C[C@@H](OC(=O)C1(c2ccc(Cl)cc2)CC1)c1cccc(-c2nnn[n-]2)c1 ZINC000824713910 608183174 /nfs/dbraw/zinc/18/31/74/608183174.db2.gz LGXCGENWBUQQSA-GFCCVEGCSA-N -1 3 368.824 3.856 20 0 FHADHM C[C@@H](OC(=O)C1(c2ccc(Cl)cc2)CC1)c1cccc(-c2nn[n-]n2)c1 ZINC000824713910 608183176 /nfs/dbraw/zinc/18/31/76/608183176.db2.gz LGXCGENWBUQQSA-GFCCVEGCSA-N -1 3 368.824 3.856 20 0 FHADHM CC[C@@H](Oc1ccccc1C)C(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000825159128 608184037 /nfs/dbraw/zinc/18/40/37/608184037.db2.gz JLNWHLLMCABLGU-RHSMWYFYSA-N -1 3 366.421 3.637 20 0 FHADHM CC[C@@H](Oc1ccccc1C)C(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000825159128 608184038 /nfs/dbraw/zinc/18/40/38/608184038.db2.gz JLNWHLLMCABLGU-RHSMWYFYSA-N -1 3 366.421 3.637 20 0 FHADHM Cc1ccc(NC(=O)CSc2cccc(Cl)c2-c2nnn[n-]2)c(C)c1 ZINC000826290893 608206502 /nfs/dbraw/zinc/20/65/02/608206502.db2.gz FUGZGXSFSOWYHV-UHFFFAOYSA-N -1 3 373.869 3.868 20 0 FHADHM Cc1ccc(NC(=O)CSc2cccc(Cl)c2-c2nn[n-]n2)c(C)c1 ZINC000826290893 608206503 /nfs/dbraw/zinc/20/65/03/608206503.db2.gz FUGZGXSFSOWYHV-UHFFFAOYSA-N -1 3 373.869 3.868 20 0 FHADHM Cc1cnc(CSc2nc(C)cc(C(F)(F)F)c2-c2nnn[n-]2)s1 ZINC000826262808 608218743 /nfs/dbraw/zinc/21/87/43/608218743.db2.gz ZIIIQSMNCBOKFD-UHFFFAOYSA-N -1 3 372.401 3.646 20 0 FHADHM O[C@@H](CSc1ccc(-c2nnn[n-]2)cc1Cl)c1ccc(Cl)cc1 ZINC000826510750 608220427 /nfs/dbraw/zinc/22/04/27/608220427.db2.gz ISMOSCHSRKCMQZ-ZDUSSCGKSA-N -1 3 367.261 3.999 20 0 FHADHM O[C@@H](CSc1ccc(-c2nn[n-]n2)cc1Cl)c1ccc(Cl)cc1 ZINC000826510750 608220428 /nfs/dbraw/zinc/22/04/28/608220428.db2.gz ISMOSCHSRKCMQZ-ZDUSSCGKSA-N -1 3 367.261 3.999 20 0 FHADHM FC(F)(F)[C@H]1CCC[C@@H](Nc2ccc3cc(-c4nnn[n-]4)ccc3n2)C1 ZINC000826367039 608221949 /nfs/dbraw/zinc/22/19/49/608221949.db2.gz JETVVBCQQQPTLI-QWHCGFSZSA-N -1 3 362.359 3.948 20 0 FHADHM FC(F)(F)[C@H]1CCC[C@@H](Nc2ccc3cc(-c4nn[n-]n4)ccc3n2)C1 ZINC000826367039 608221950 /nfs/dbraw/zinc/22/19/50/608221950.db2.gz JETVVBCQQQPTLI-QWHCGFSZSA-N -1 3 362.359 3.948 20 0 FHADHM Cc1cccc([C@H](Nc2ccc(-c3nn[n-]n3)cc2F)c2ccccn2)c1 ZINC000826297240 608230982 /nfs/dbraw/zinc/23/09/82/608230982.db2.gz ZLVGPBQKCJYRIH-IBGZPJMESA-N -1 3 360.396 3.911 20 0 FHADHM Fc1ccc([C@@H]2CCN(c3ccc4cc(-c5nnn[n-]5)ccc4n3)C2)cc1 ZINC000826373925 608232426 /nfs/dbraw/zinc/23/24/26/608232426.db2.gz FIIAFCKSLUXVPF-MRXNPFEDSA-N -1 3 360.396 3.548 20 0 FHADHM Fc1ccc([C@@H]2CCN(c3ccc4cc(-c5nn[n-]n5)ccc4n3)C2)cc1 ZINC000826373925 608232428 /nfs/dbraw/zinc/23/24/28/608232428.db2.gz FIIAFCKSLUXVPF-MRXNPFEDSA-N -1 3 360.396 3.548 20 0 FHADHM Fc1cc(Br)c(NCc2ccc(-c3nnn[n-]3)cc2)cc1F ZINC000826372320 608237111 /nfs/dbraw/zinc/23/71/11/608237111.db2.gz RJCXKVXEWRPVNR-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1cc(Br)c(NCc2ccc(-c3nn[n-]n3)cc2)cc1F ZINC000826372320 608237113 /nfs/dbraw/zinc/23/71/13/608237113.db2.gz RJCXKVXEWRPVNR-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM COc1ccc([C@@H](OC)[C@H](C)Nc2cc(Cl)ccc2-c2nnn[n-]2)cc1 ZINC000826190165 608240016 /nfs/dbraw/zinc/24/00/16/608240016.db2.gz RRCQHELBMUDSBF-GTNSWQLSSA-N -1 3 373.844 3.717 20 0 FHADHM COc1ccc([C@@H](OC)[C@H](C)Nc2cc(Cl)ccc2-c2nn[n-]n2)cc1 ZINC000826190165 608240018 /nfs/dbraw/zinc/24/00/18/608240018.db2.gz RRCQHELBMUDSBF-GTNSWQLSSA-N -1 3 373.844 3.717 20 0 FHADHM CN(Cc1cccc(-c2nnn[n-]2)c1)C(=O)NCC(C)(C)C1CCCCC1 ZINC000825972179 608241132 /nfs/dbraw/zinc/24/11/32/608241132.db2.gz VVSKJYLTWUPWNT-UHFFFAOYSA-N -1 3 370.501 3.615 20 0 FHADHM CN(Cc1cccc(-c2nn[n-]n2)c1)C(=O)NCC(C)(C)C1CCCCC1 ZINC000825972179 608241134 /nfs/dbraw/zinc/24/11/34/608241134.db2.gz VVSKJYLTWUPWNT-UHFFFAOYSA-N -1 3 370.501 3.615 20 0 FHADHM CN(C(=O)C=Cc1ccccc1-c1nnn[n-]1)c1c(Cl)cccc1Cl ZINC000825812587 608265471 /nfs/dbraw/zinc/26/54/71/608265471.db2.gz NUHQBRFQAIQQFY-MDZDMXLPSA-N -1 3 374.231 3.850 20 0 FHADHM CN(C(=O)C=Cc1ccccc1-c1nn[n-]n1)c1c(Cl)cccc1Cl ZINC000825812587 608265472 /nfs/dbraw/zinc/26/54/72/608265472.db2.gz NUHQBRFQAIQQFY-MDZDMXLPSA-N -1 3 374.231 3.850 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N(C)c1c(Cl)cccc1Cl ZINC000826243348 608265968 /nfs/dbraw/zinc/26/59/68/608265968.db2.gz FCLDWPVULMMYED-UHFFFAOYSA-N -1 3 362.220 3.759 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N(C)c1c(Cl)cccc1Cl ZINC000826243348 608265970 /nfs/dbraw/zinc/26/59/70/608265970.db2.gz FCLDWPVULMMYED-UHFFFAOYSA-N -1 3 362.220 3.759 20 0 FHADHM CCOc1cccc2cc([C@@H](C)Nc3nc(C)ccc3-c3nnn[n-]3)oc21 ZINC000825653365 608270519 /nfs/dbraw/zinc/27/05/19/608270519.db2.gz BYFFYHXXKSOCBK-GFCCVEGCSA-N -1 3 364.409 3.888 20 0 FHADHM CCOc1cccc2cc([C@@H](C)Nc3nc(C)ccc3-c3nn[n-]n3)oc21 ZINC000825653365 608270520 /nfs/dbraw/zinc/27/05/20/608270520.db2.gz BYFFYHXXKSOCBK-GFCCVEGCSA-N -1 3 364.409 3.888 20 0 FHADHM CC(C)Cn1ncc(Nc2ncc(-c3nnn[n-]3)cc2Cl)c1C(C)C ZINC000824285020 608302747 /nfs/dbraw/zinc/30/27/47/608302747.db2.gz SQSDKNMYSFLFTN-UHFFFAOYSA-N -1 3 360.853 3.635 20 0 FHADHM CC(C)Cn1ncc(Nc2ncc(-c3nn[n-]n3)cc2Cl)c1C(C)C ZINC000824285020 608302748 /nfs/dbraw/zinc/30/27/48/608302748.db2.gz SQSDKNMYSFLFTN-UHFFFAOYSA-N -1 3 360.853 3.635 20 0 FHADHM O=C(NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1)c1cccc(F)c1 ZINC000826441200 608304520 /nfs/dbraw/zinc/30/45/20/608304520.db2.gz STMCWWZLLQJBJZ-UHFFFAOYSA-N -1 3 373.391 3.603 20 0 FHADHM O=C(NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1)c1cccc(F)c1 ZINC000826441200 608304522 /nfs/dbraw/zinc/30/45/22/608304522.db2.gz STMCWWZLLQJBJZ-UHFFFAOYSA-N -1 3 373.391 3.603 20 0 FHADHM O=C(C=Cc1ccc2[nH]ccc2c1)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000826401003 608311579 /nfs/dbraw/zinc/31/15/79/608311579.db2.gz MYLOIVMWHMTBJH-QHHAFSJGSA-N -1 3 364.796 3.653 20 0 FHADHM O=C(C=Cc1ccc2[nH]ccc2c1)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000826401003 608311581 /nfs/dbraw/zinc/31/15/81/608311581.db2.gz MYLOIVMWHMTBJH-QHHAFSJGSA-N -1 3 364.796 3.653 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CNc1cc(Cl)ccc1SC ZINC000826170768 608320742 /nfs/dbraw/zinc/32/07/42/608320742.db2.gz OZILVBSKZZVSBE-UHFFFAOYSA-N -1 3 361.858 3.863 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CNc1cc(Cl)ccc1SC ZINC000826170768 608320744 /nfs/dbraw/zinc/32/07/44/608320744.db2.gz OZILVBSKZZVSBE-UHFFFAOYSA-N -1 3 361.858 3.863 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CNc1ccccc1SC(C)C ZINC000826170957 608321116 /nfs/dbraw/zinc/32/11/16/608321116.db2.gz WVMLAHXULFOMMJ-UHFFFAOYSA-N -1 3 355.467 3.988 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CNc1ccccc1SC(C)C ZINC000826170957 608321118 /nfs/dbraw/zinc/32/11/18/608321118.db2.gz WVMLAHXULFOMMJ-UHFFFAOYSA-N -1 3 355.467 3.988 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cc(C)c(OC)c(C)c2)c1-c1nnn[n-]1 ZINC000825688140 608340760 /nfs/dbraw/zinc/34/07/60/608340760.db2.gz QYQMKCOTMFTWLK-UHFFFAOYSA-N -1 3 371.466 3.677 20 0 FHADHM CCc1c(C)sc(NC(=O)c2cc(C)c(OC)c(C)c2)c1-c1nn[n-]n1 ZINC000825688140 608340762 /nfs/dbraw/zinc/34/07/62/608340762.db2.gz QYQMKCOTMFTWLK-UHFFFAOYSA-N -1 3 371.466 3.677 20 0 FHADHM CCCCSCCC(=O)N(CC)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825296252 608344263 /nfs/dbraw/zinc/34/42/63/608344263.db2.gz ALHXAKZHFWCMDA-UHFFFAOYSA-N -1 3 367.906 3.796 20 0 FHADHM CCCCSCCC(=O)N(CC)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825296252 608344265 /nfs/dbraw/zinc/34/42/65/608344265.db2.gz ALHXAKZHFWCMDA-UHFFFAOYSA-N -1 3 367.906 3.796 20 0 FHADHM CCN(C(=O)[C@H](C)c1ccc(C)o1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825363221 608346996 /nfs/dbraw/zinc/34/69/96/608346996.db2.gz VVDJNBKEMSYBOQ-LLVKDONJSA-N -1 3 359.817 3.578 20 0 FHADHM CCN(C(=O)[C@H](C)c1ccc(C)o1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825363221 608346998 /nfs/dbraw/zinc/34/69/98/608346998.db2.gz VVDJNBKEMSYBOQ-LLVKDONJSA-N -1 3 359.817 3.578 20 0 FHADHM Fc1cc(NCc2cccc(-c3nnn[n-]3)c2)cc(F)c1Br ZINC000826372787 608389402 /nfs/dbraw/zinc/38/94/02/608389402.db2.gz LQIDWGPWSKRZFW-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1cc(NCc2cccc(-c3nn[n-]n3)c2)cc(F)c1Br ZINC000826372787 608389403 /nfs/dbraw/zinc/38/94/03/608389403.db2.gz LQIDWGPWSKRZFW-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM C[C@@H](NC(=O)N[C@@H](C)c1ccccc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000824505234 608405594 /nfs/dbraw/zinc/40/55/94/608405594.db2.gz ADAOXKODDWNMNX-NEPJUHHUSA-N -1 3 370.844 3.642 20 0 FHADHM C[C@@H](NC(=O)N[C@@H](C)c1ccccc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000824505234 608405595 /nfs/dbraw/zinc/40/55/95/608405595.db2.gz ADAOXKODDWNMNX-NEPJUHHUSA-N -1 3 370.844 3.642 20 0 FHADHM C[C@@H](NC(=O)N[C@@H](C)c1ccccc1Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000820352345 608417927 /nfs/dbraw/zinc/41/79/27/608417927.db2.gz UWPJJDUWTJOOHB-NEPJUHHUSA-N -1 3 370.844 3.642 20 0 FHADHM C[C@@H](NC(=O)N[C@@H](C)c1ccccc1Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000820352345 608417928 /nfs/dbraw/zinc/41/79/28/608417928.db2.gz UWPJJDUWTJOOHB-NEPJUHHUSA-N -1 3 370.844 3.642 20 0 FHADHM CSc1cccc(NC(=O)CSc2ccc(-c3nnn[n-]3)cc2)c1C ZINC000826231136 608432211 /nfs/dbraw/zinc/43/22/11/608432211.db2.gz YPGREPWPBOZHJK-UHFFFAOYSA-N -1 3 371.491 3.628 20 0 FHADHM CSc1cccc(NC(=O)CSc2ccc(-c3nn[n-]n3)cc2)c1C ZINC000826231136 608432213 /nfs/dbraw/zinc/43/22/13/608432213.db2.gz YPGREPWPBOZHJK-UHFFFAOYSA-N -1 3 371.491 3.628 20 0 FHADHM c1ccc2nc(N3CC=C(c4ccc(-c5nnn[n-]5)cc4)CC3)ccc2c1 ZINC000823868013 608441220 /nfs/dbraw/zinc/44/12/20/608441220.db2.gz MVPCIBVXRDOZGQ-UHFFFAOYSA-N -1 3 354.417 3.709 20 0 FHADHM c1ccc2nc(N3CC=C(c4ccc(-c5nn[n-]n5)cc4)CC3)ccc2c1 ZINC000823868013 608441221 /nfs/dbraw/zinc/44/12/21/608441221.db2.gz MVPCIBVXRDOZGQ-UHFFFAOYSA-N -1 3 354.417 3.709 20 0 FHADHM Cc1ccc(NC(=O)N2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)cc1C ZINC000826290818 608469275 /nfs/dbraw/zinc/46/92/75/608469275.db2.gz BBVVUPZZEMBEGI-UHFFFAOYSA-N -1 3 374.448 3.805 20 0 FHADHM Cc1ccc(NC(=O)N2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)cc1C ZINC000826290818 608469276 /nfs/dbraw/zinc/46/92/76/608469276.db2.gz BBVVUPZZEMBEGI-UHFFFAOYSA-N -1 3 374.448 3.805 20 0 FHADHM C[C@@H](NCc1csc(C2CCCC2)n1)c1cccc(-c2nn[n-]n2)c1 ZINC000824626713 608484672 /nfs/dbraw/zinc/48/46/72/608484672.db2.gz SDYKOUYKDWQIBB-GFCCVEGCSA-N -1 3 354.483 3.832 20 0 FHADHM CC(C)(C)c1nc(CN[C@H]2CCCc3cc(-c4nn[n-]n4)ccc32)cs1 ZINC000824142061 608506478 /nfs/dbraw/zinc/50/64/78/608506478.db2.gz RRZBXZZMABZSAM-INIZCTEOSA-N -1 3 368.510 3.788 20 0 FHADHM CN(Cc1cnc(C2CCCC2)s1)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000825961651 608524651 /nfs/dbraw/zinc/52/46/51/608524651.db2.gz KMSREXHHONPYSQ-UHFFFAOYSA-N -1 3 354.483 3.613 20 0 FHADHM CN(Cc1ccc(-c2nn[n-]n2)cc1)Cc1cc(C(F)(F)F)ccc1F ZINC000825958225 608525849 /nfs/dbraw/zinc/52/58/49/608525849.db2.gz OHDQNJFSSJQJQT-UHFFFAOYSA-N -1 3 365.334 3.657 20 0 FHADHM CN(Cc1ccc(-c2nnn[n-]2)s1)Cc1c(Cl)cccc1Cl ZINC000825962154 608532702 /nfs/dbraw/zinc/53/27/02/608532702.db2.gz SRYICZYUAYPSGU-UHFFFAOYSA-N -1 3 354.266 3.867 20 0 FHADHM CCN(Cc1cc(F)c(F)cc1F)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825428420 608551855 /nfs/dbraw/zinc/55/18/55/608551855.db2.gz MKLCCAUIFFYFPO-LLVKDONJSA-N -1 3 361.371 3.867 20 0 FHADHM Cc1cc(F)c2c(c1)CCCN2C(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000826267905 608575758 /nfs/dbraw/zinc/57/57/58/608575758.db2.gz BNBZSNKZCKDXJL-UHFFFAOYSA-N -1 3 371.803 3.561 20 0 FHADHM Cc1cc(F)c2c(c1)CCCN2C(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000826267905 608575759 /nfs/dbraw/zinc/57/57/59/608575759.db2.gz BNBZSNKZCKDXJL-UHFFFAOYSA-N -1 3 371.803 3.561 20 0 FHADHM O=C(c1ccc(Cl)c(-c2nnn[n-]2)c1)N1CCCc2cc(Cl)ccc21 ZINC000826473483 608576214 /nfs/dbraw/zinc/57/62/14/608576214.db2.gz ZVWGBQQGDHIISK-UHFFFAOYSA-N -1 3 374.231 3.767 20 0 FHADHM O=C(c1ccc(Cl)c(-c2nn[n-]n2)c1)N1CCCc2cc(Cl)ccc21 ZINC000826473483 608576215 /nfs/dbraw/zinc/57/62/15/608576215.db2.gz ZVWGBQQGDHIISK-UHFFFAOYSA-N -1 3 374.231 3.767 20 0 FHADHM CC(C)[C@H](OC(=O)Cc1ccc(-c2nnn[n-]2)cc1)c1ccc(F)c(F)c1 ZINC000824207277 608596222 /nfs/dbraw/zinc/59/62/22/608596222.db2.gz SOCKRDWESCCLCL-SFHVURJKSA-N -1 3 372.375 3.628 20 0 FHADHM CC(C)[C@H](OC(=O)Cc1ccc(-c2nn[n-]n2)cc1)c1ccc(F)c(F)c1 ZINC000824207277 608596224 /nfs/dbraw/zinc/59/62/24/608596224.db2.gz SOCKRDWESCCLCL-SFHVURJKSA-N -1 3 372.375 3.628 20 0 FHADHM Cc1ccc(C)c([C@@H]2CN(Cc3ccc(-c4nnn[n-]4)s3)[C@@H](C)CO2)c1 ZINC000826284844 608728923 /nfs/dbraw/zinc/72/89/23/608728923.db2.gz HTRGOZBZPLNXKP-YOEHRIQHSA-N -1 3 369.494 3.507 20 0 FHADHM Cc1ccc(C)c([C@@H]2CN(Cc3ccc(-c4nn[n-]n4)s3)[C@@H](C)CO2)c1 ZINC000826284844 608728924 /nfs/dbraw/zinc/72/89/24/608728924.db2.gz HTRGOZBZPLNXKP-YOEHRIQHSA-N -1 3 369.494 3.507 20 0 FHADHM FC(F)(F)c1cccc([C@@H](Nc2ccc(-c3nnn[n-]3)cn2)C2CC2)c1 ZINC000826369142 608800072 /nfs/dbraw/zinc/80/00/72/608800072.db2.gz ORDDIZOGCRKRBJ-HNNXBMFYSA-N -1 3 360.343 3.844 20 0 FHADHM FC(F)(F)c1cccc([C@@H](Nc2ccc(-c3nn[n-]n3)cn2)C2CC2)c1 ZINC000826369142 608800074 /nfs/dbraw/zinc/80/00/74/608800074.db2.gz ORDDIZOGCRKRBJ-HNNXBMFYSA-N -1 3 360.343 3.844 20 0 FHADHM COc1cccc(C=C2CCN(Cc3ccc(-c4nnn[n-]4)s3)CC2)c1 ZINC000826215232 608843495 /nfs/dbraw/zinc/84/34/95/608843495.db2.gz JRGUUTMVLKRXHP-UHFFFAOYSA-N -1 3 367.478 3.616 20 0 FHADHM C[C@H](N[C@H]1CCOc2c(Cl)cccc21)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824553539 609138028 /nfs/dbraw/zinc/13/80/28/609138028.db2.gz CKNPJNHICLAOPS-QFYYESIMSA-N -1 3 373.819 3.834 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)N1CCC[C@@H]1/C=C\c1ccccc1 ZINC000826402068 609138310 /nfs/dbraw/zinc/13/83/10/609138310.db2.gz MKMMEYHKTIXCBR-JITOXWKNSA-N -1 3 371.444 3.584 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)N1CCC[C@@H]1/C=C\c1ccccc1 ZINC000826402068 609138311 /nfs/dbraw/zinc/13/83/11/609138311.db2.gz MKMMEYHKTIXCBR-JITOXWKNSA-N -1 3 371.444 3.584 20 0 FHADHM C[C@H](NCc1csc(-c2ccco2)n1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824624782 609149607 /nfs/dbraw/zinc/14/96/07/609149607.db2.gz CFBWSECKVZUZDN-JTQLQIEISA-N -1 3 370.413 3.573 20 0 FHADHM C[C@H](NCc1csc(-c2ccco2)n1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824624782 609149608 /nfs/dbraw/zinc/14/96/08/609149608.db2.gz CFBWSECKVZUZDN-JTQLQIEISA-N -1 3 370.413 3.573 20 0 FHADHM Cc1ccc(NC(=O)C(C)C)cc1N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000826290279 609158286 /nfs/dbraw/zinc/15/82/86/609158286.db2.gz HTYDYJZREWQOFV-CQSZACIVSA-N -1 3 364.453 3.943 20 0 FHADHM Cc1ccc(NC(=O)C(C)C)cc1N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000826290279 609158287 /nfs/dbraw/zinc/15/82/87/609158287.db2.gz HTYDYJZREWQOFV-CQSZACIVSA-N -1 3 364.453 3.943 20 0 FHADHM CC(C)=C(C)C(=O)Nc1c(-c2nnn[n-]2)c(C)c(C)n1-c1ccccc1 ZINC000824178407 609165992 /nfs/dbraw/zinc/16/59/92/609165992.db2.gz ROEAJKXWTXOXRG-UHFFFAOYSA-N -1 3 350.426 3.569 20 0 FHADHM CC(C)=C(C)C(=O)Nc1c(-c2nn[n-]n2)c(C)c(C)n1-c1ccccc1 ZINC000824178407 609165994 /nfs/dbraw/zinc/16/59/94/609165994.db2.gz ROEAJKXWTXOXRG-UHFFFAOYSA-N -1 3 350.426 3.569 20 0 FHADHM Cc1cc(NCc2cccc(-c3nnn[n-]3)c2)nn1-c1ccccc1Cl ZINC000826271339 609180816 /nfs/dbraw/zinc/18/08/16/609180816.db2.gz NOKJOGAGZYLKPF-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM Cc1cc(NCc2cccc(-c3nn[n-]n3)c2)nn1-c1ccccc1Cl ZINC000826271339 609180818 /nfs/dbraw/zinc/18/08/18/609180818.db2.gz NOKJOGAGZYLKPF-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM C[C@@H](Nc1ccc(OCC2CC2)cc1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824657924 609235180 /nfs/dbraw/zinc/23/51/80/609235180.db2.gz SPEVCQZPCOBPPX-GFCCVEGCSA-N -1 3 353.401 3.968 20 0 FHADHM C[C@@H](Nc1ccc(OCC2CC2)cc1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824657924 609235181 /nfs/dbraw/zinc/23/51/81/609235181.db2.gz SPEVCQZPCOBPPX-GFCCVEGCSA-N -1 3 353.401 3.968 20 0 FHADHM CC(C)CCn1ccc(N[C@@H]2CCCc3cc(-c4nnn[n-]4)ccc32)n1 ZINC000824249349 609248180 /nfs/dbraw/zinc/24/81/80/609248180.db2.gz MFSQTCZETQELCM-QGZVFWFLSA-N -1 3 351.458 3.599 20 0 FHADHM CC(C)CCn1ccc(N[C@@H]2CCCc3cc(-c4nn[n-]n4)ccc32)n1 ZINC000824249349 609248181 /nfs/dbraw/zinc/24/81/81/609248181.db2.gz MFSQTCZETQELCM-QGZVFWFLSA-N -1 3 351.458 3.599 20 0 FHADHM CC(=O)Nc1ccc(N[C@H]2CCCc3cc(-c4nnn[n-]4)ccc32)cc1C ZINC000823999516 609267136 /nfs/dbraw/zinc/26/71/36/609267136.db2.gz DOLFSRLDYIXQQX-IBGZPJMESA-N -1 3 362.437 3.623 20 0 FHADHM CC(=O)Nc1ccc(N[C@H]2CCCc3cc(-c4nn[n-]n4)ccc32)cc1C ZINC000823999516 609267137 /nfs/dbraw/zinc/26/71/37/609267137.db2.gz DOLFSRLDYIXQQX-IBGZPJMESA-N -1 3 362.437 3.623 20 0 FHADHM CCOc1ccc(N[C@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)cc1OC ZINC000825643815 609270772 /nfs/dbraw/zinc/27/07/72/609270772.db2.gz WHZKNALTBPTLMF-LLVKDONJSA-N -1 3 357.389 3.586 20 0 FHADHM CCOc1ccc(N[C@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)cc1OC ZINC000825643815 609270774 /nfs/dbraw/zinc/27/07/74/609270774.db2.gz WHZKNALTBPTLMF-LLVKDONJSA-N -1 3 357.389 3.586 20 0 FHADHM CCOc1ccc(OCC)c(N[C@@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)c1 ZINC000825642876 609272212 /nfs/dbraw/zinc/27/22/12/609272212.db2.gz CPJQUGZFOZMWQW-LBPRGKRZSA-N -1 3 371.416 3.976 20 0 FHADHM CCOc1ccc(OCC)c(N[C@@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)c1 ZINC000825642876 609272213 /nfs/dbraw/zinc/27/22/13/609272213.db2.gz CPJQUGZFOZMWQW-LBPRGKRZSA-N -1 3 371.416 3.976 20 0 FHADHM CCOc1ccc(OCC)c(N[C@H](C)c2ccc(-c3nnn[n-]3)c(F)c2)c1 ZINC000825642873 609272272 /nfs/dbraw/zinc/27/22/72/609272272.db2.gz CPJQUGZFOZMWQW-GFCCVEGCSA-N -1 3 371.416 3.976 20 0 FHADHM CCOc1ccc(OCC)c(N[C@H](C)c2ccc(-c3nn[n-]n3)c(F)c2)c1 ZINC000825642873 609272274 /nfs/dbraw/zinc/27/22/74/609272274.db2.gz CPJQUGZFOZMWQW-GFCCVEGCSA-N -1 3 371.416 3.976 20 0 FHADHM CCOc1ccc(OC)cc1N[C@@H]1CCCc2cc(-c3nnn[n-]3)ccc21 ZINC000825643104 609278140 /nfs/dbraw/zinc/27/81/40/609278140.db2.gz ITQSJLKXIIKXNU-QGZVFWFLSA-N -1 3 365.437 3.764 20 0 FHADHM CCOc1ccc(OC)cc1N[C@@H]1CCCc2cc(-c3nn[n-]n3)ccc21 ZINC000825643104 609278142 /nfs/dbraw/zinc/27/81/42/609278142.db2.gz ITQSJLKXIIKXNU-QGZVFWFLSA-N -1 3 365.437 3.764 20 0 FHADHM COc1cc(OC)c(N[C@@H]2CCCc3cc(-c4nnn[n-]4)ccc32)cc1F ZINC000826181349 609279672 /nfs/dbraw/zinc/27/96/72/609279672.db2.gz VVJVVRHVURKGJN-OAHLLOKOSA-N -1 3 369.400 3.513 20 0 FHADHM COc1cc(OC)c(N[C@@H]2CCCc3cc(-c4nn[n-]n4)ccc32)cc1F ZINC000826181349 609279673 /nfs/dbraw/zinc/27/96/73/609279673.db2.gz VVJVVRHVURKGJN-OAHLLOKOSA-N -1 3 369.400 3.513 20 0 FHADHM COc1cc(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c(OC)cc1Cl ZINC000826180510 609279726 /nfs/dbraw/zinc/27/97/26/609279726.db2.gz KVHFAMSHZDOSRN-SNVBAGLBSA-N -1 3 359.817 3.710 20 0 FHADHM COc1cc(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c(OC)cc1Cl ZINC000826180510 609279728 /nfs/dbraw/zinc/27/97/28/609279728.db2.gz KVHFAMSHZDOSRN-SNVBAGLBSA-N -1 3 359.817 3.710 20 0 FHADHM COc1cc(Br)cc(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000826177030 609281952 /nfs/dbraw/zinc/28/19/52/609281952.db2.gz OTDSDBCENFBLDL-SNVBAGLBSA-N -1 3 374.242 3.811 20 0 FHADHM COc1cc(Br)cc(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000826177030 609281954 /nfs/dbraw/zinc/28/19/54/609281954.db2.gz OTDSDBCENFBLDL-SNVBAGLBSA-N -1 3 374.242 3.811 20 0 FHADHM Cc1ccccc1[C@@H]1CCCN1C(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000826306666 609290600 /nfs/dbraw/zinc/29/06/00/609290600.db2.gz HLXINMCOVDZBMA-KRWDZBQOSA-N -1 3 367.840 3.806 20 0 FHADHM Cc1ccccc1[C@@H]1CCCN1C(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000826306666 609290602 /nfs/dbraw/zinc/29/06/02/609290602.db2.gz HLXINMCOVDZBMA-KRWDZBQOSA-N -1 3 367.840 3.806 20 0 FHADHM O=C(NC1CCCCC1)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000826429827 609303348 /nfs/dbraw/zinc/30/33/48/609303348.db2.gz NWQGATKZYMSQEA-UHFFFAOYSA-N -1 3 363.421 3.722 20 0 FHADHM O=C(NC1CCCCC1)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000826429827 609303350 /nfs/dbraw/zinc/30/33/50/609303350.db2.gz NWQGATKZYMSQEA-UHFFFAOYSA-N -1 3 363.421 3.722 20 0 FHADHM O=C(Nc1ccccc1)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000826457277 609303606 /nfs/dbraw/zinc/30/36/06/609303606.db2.gz UTEUPTXAMMFZTO-UHFFFAOYSA-N -1 3 357.373 3.911 20 0 FHADHM O=C(Nc1ccccc1)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000826457277 609303608 /nfs/dbraw/zinc/30/36/08/609303608.db2.gz UTEUPTXAMMFZTO-UHFFFAOYSA-N -1 3 357.373 3.911 20 0 FHADHM COCC[C@H](Nc1cc(-c2nnn[n-]2)c2ccccc2n1)c1ccc(C)o1 ZINC000826155123 609322751 /nfs/dbraw/zinc/32/27/51/609322751.db2.gz HBXJRINCOUPLFI-INIZCTEOSA-N -1 3 364.409 3.506 20 0 FHADHM COCC[C@H](Nc1cc(-c2nn[n-]n2)c2ccccc2n1)c1ccc(C)o1 ZINC000826155123 609322753 /nfs/dbraw/zinc/32/27/53/609322753.db2.gz HBXJRINCOUPLFI-INIZCTEOSA-N -1 3 364.409 3.506 20 0 FHADHM COCC[C@@H](Nc1ccc2cc(-c3nnn[n-]3)ccc2n1)c1ccc(C)o1 ZINC000826155221 609322879 /nfs/dbraw/zinc/32/28/79/609322879.db2.gz JZFJDENFCQFFOO-MRXNPFEDSA-N -1 3 364.409 3.506 20 0 FHADHM COCC[C@@H](Nc1ccc2cc(-c3nn[n-]n3)ccc2n1)c1ccc(C)o1 ZINC000826155221 609322881 /nfs/dbraw/zinc/32/28/81/609322881.db2.gz JZFJDENFCQFFOO-MRXNPFEDSA-N -1 3 364.409 3.506 20 0 FHADHM C[C@H](N[C@H](c1ccccc1)c1ccncc1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824540170 609330013 /nfs/dbraw/zinc/33/00/13/609330013.db2.gz SJDOXSVDEZDBQQ-VBKZILBWSA-N -1 3 374.423 3.841 20 0 FHADHM C[C@H](N[C@H](c1ccccc1)c1ccncc1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824540170 609330014 /nfs/dbraw/zinc/33/00/14/609330014.db2.gz SJDOXSVDEZDBQQ-VBKZILBWSA-N -1 3 374.423 3.841 20 0 FHADHM C[C@@H](N[C@@H]1CCCOc2ccc(F)cc21)c1ccc(-c2nn[n-]n2)cc1F ZINC000824545958 609330310 /nfs/dbraw/zinc/33/03/10/609330310.db2.gz FOVUITPBPMLCLF-PIGZYNQJSA-N -1 3 371.391 3.709 20 0 FHADHM COc1cccc(F)c1[C@H](C)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1F ZINC000826217140 609337494 /nfs/dbraw/zinc/33/74/94/609337494.db2.gz ZOWZLFAXTZDXEY-MNOVXSKESA-N -1 3 359.380 3.565 20 0 FHADHM COc1cccc(F)c1[C@H](C)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000826217140 609337495 /nfs/dbraw/zinc/33/74/95/609337495.db2.gz ZOWZLFAXTZDXEY-MNOVXSKESA-N -1 3 359.380 3.565 20 0 FHADHM Cc1ccsc1COC(=O)CCCCOc1cccc(-c2nnn[n-]2)c1 ZINC000826316592 609339996 /nfs/dbraw/zinc/33/99/96/609339996.db2.gz SIIXBZCQNFHTPC-UHFFFAOYSA-N -1 3 372.450 3.529 20 0 FHADHM Cc1ccsc1COC(=O)CCCCOc1cccc(-c2nn[n-]n2)c1 ZINC000826316592 609339998 /nfs/dbraw/zinc/33/99/98/609339998.db2.gz SIIXBZCQNFHTPC-UHFFFAOYSA-N -1 3 372.450 3.529 20 0 FHADHM C[C@@H](Nc1cccc(Br)c1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824662390 609346270 /nfs/dbraw/zinc/34/62/70/609346270.db2.gz JDHLRXUJFLGMBE-SECBINFHSA-N -1 3 362.206 3.941 20 0 FHADHM C[C@@H](Nc1cccc(Br)c1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824662390 609346273 /nfs/dbraw/zinc/34/62/73/609346273.db2.gz JDHLRXUJFLGMBE-SECBINFHSA-N -1 3 362.206 3.941 20 0 FHADHM COc1cc(C)c(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2F)cc1OC ZINC000826178426 609346686 /nfs/dbraw/zinc/34/66/86/609346686.db2.gz XNVSEFNVMIAJDK-NSHDSACASA-N -1 3 357.389 3.505 20 0 FHADHM COc1cc(C)c(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2F)cc1OC ZINC000826178426 609346687 /nfs/dbraw/zinc/34/66/87/609346687.db2.gz XNVSEFNVMIAJDK-NSHDSACASA-N -1 3 357.389 3.505 20 0 FHADHM C[C@H](Nc1cc(F)ccc1OC(F)F)c1ccc(-c2nnn[n-]2)cc1F ZINC000824648453 609347189 /nfs/dbraw/zinc/34/71/89/609347189.db2.gz GQXVTOGQVZAOTF-QMMMGPOBSA-N -1 3 367.306 3.919 20 0 FHADHM C[C@H](Nc1cc(F)ccc1OC(F)F)c1ccc(-c2nn[n-]n2)cc1F ZINC000824648453 609347191 /nfs/dbraw/zinc/34/71/91/609347191.db2.gz GQXVTOGQVZAOTF-QMMMGPOBSA-N -1 3 367.306 3.919 20 0 FHADHM Cc1nn(-c2ccccc2)cc1N[C@H](C)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000826332959 609351934 /nfs/dbraw/zinc/35/19/34/609351934.db2.gz OGHSRHNKFRPOSF-GFCCVEGCSA-N -1 3 363.400 3.673 20 0 FHADHM Cc1nn(-c2ccccc2)cc1N[C@H](C)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000826332959 609351936 /nfs/dbraw/zinc/35/19/36/609351936.db2.gz OGHSRHNKFRPOSF-GFCCVEGCSA-N -1 3 363.400 3.673 20 0 FHADHM CC(C)S[C@@H]1CCCC[C@@H]1OC(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000824337548 609364954 /nfs/dbraw/zinc/36/49/54/609364954.db2.gz AFTHHQCSUHKTTK-NWDGAFQWSA-N -1 3 352.485 3.538 20 0 FHADHM CC(C)S[C@@H]1CCCC[C@@H]1OC(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000824337548 609364955 /nfs/dbraw/zinc/36/49/55/609364955.db2.gz AFTHHQCSUHKTTK-NWDGAFQWSA-N -1 3 352.485 3.538 20 0 FHADHM CCc1cc(NC(=O)N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)ccc1C ZINC000825700681 609384220 /nfs/dbraw/zinc/38/42/20/609384220.db2.gz PDKDEKAZHSOECL-ZDUSSCGKSA-N -1 3 350.426 3.620 20 0 FHADHM CCc1cc(NC(=O)N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)ccc1C ZINC000825700681 609384222 /nfs/dbraw/zinc/38/42/22/609384222.db2.gz PDKDEKAZHSOECL-ZDUSSCGKSA-N -1 3 350.426 3.620 20 0 FHADHM c1csc(CCNc2ccccc2Oc2ncccc2-c2nnn[n-]2)c1 ZINC000826525853 609438636 /nfs/dbraw/zinc/43/86/36/609438636.db2.gz BMASXHBDFMTLOE-UHFFFAOYSA-N -1 3 364.434 3.770 20 0 FHADHM COc1cc(CSc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)ccn1 ZINC000826180144 609452707 /nfs/dbraw/zinc/45/27/07/609452707.db2.gz ULYSPBOFQOEXGI-UHFFFAOYSA-N -1 3 367.356 3.581 20 0 FHADHM COc1cc(CSc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)ccn1 ZINC000826180144 609452710 /nfs/dbraw/zinc/45/27/10/609452710.db2.gz ULYSPBOFQOEXGI-UHFFFAOYSA-N -1 3 367.356 3.581 20 0 FHADHM Clc1ccc([C@@H](Nc2nc3ccccn3c2-c2nnn[n-]2)C2CC2)cc1 ZINC000826351238 609458080 /nfs/dbraw/zinc/45/80/80/609458080.db2.gz DZFKWPMGSOXDBM-HNNXBMFYSA-N -1 3 365.828 3.731 20 0 FHADHM Clc1ccc([C@@H](Nc2nc3ccccn3c2-c2nn[n-]n2)C2CC2)cc1 ZINC000826351238 609458082 /nfs/dbraw/zinc/45/80/82/609458082.db2.gz DZFKWPMGSOXDBM-HNNXBMFYSA-N -1 3 365.828 3.731 20 0 FHADHM Cc1[nH]c2c(cc(C)cc2CNc2nc3ccccn3c2-c2nnn[n-]2)c1C ZINC000826266838 609466661 /nfs/dbraw/zinc/46/66/61/609466661.db2.gz DLXKGQVDJIXKPP-UHFFFAOYSA-N -1 3 372.436 3.533 20 0 FHADHM Cc1[nH]c2c(cc(C)cc2CNc2nc3ccccn3c2-c2nn[n-]n2)c1C ZINC000826266838 609466663 /nfs/dbraw/zinc/46/66/63/609466663.db2.gz DLXKGQVDJIXKPP-UHFFFAOYSA-N -1 3 372.436 3.533 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NCc1ccc(SC)c(OC)c1 ZINC000825632307 609477268 /nfs/dbraw/zinc/47/72/68/609477268.db2.gz OINMMXIXSCMAJB-UHFFFAOYSA-N -1 3 371.466 3.608 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NCc1ccc(SC)c(OC)c1 ZINC000825632307 609477269 /nfs/dbraw/zinc/47/72/69/609477269.db2.gz OINMMXIXSCMAJB-UHFFFAOYSA-N -1 3 371.466 3.608 20 0 FHADHM CCOc1cc(CNc2cc(-c3nnn[n-]3)ccc2C)cc(Cl)c1OC ZINC000825615857 609478763 /nfs/dbraw/zinc/47/87/63/609478763.db2.gz NOXGMPAUUZGSPN-UHFFFAOYSA-N -1 3 373.844 3.848 20 0 FHADHM CCOc1cc(CNc2cc(-c3nn[n-]n3)ccc2C)cc(Cl)c1OC ZINC000825615857 609478765 /nfs/dbraw/zinc/47/87/65/609478765.db2.gz NOXGMPAUUZGSPN-UHFFFAOYSA-N -1 3 373.844 3.848 20 0 FHADHM Fc1ccc(Br)c(NCc2cccc(-c3nnn[n-]3)c2F)c1 ZINC000826373134 609481911 /nfs/dbraw/zinc/48/19/11/609481911.db2.gz AJXYIOCTDRFKRG-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1ccc(Br)c(NCc2cccc(-c3nn[n-]n3)c2F)c1 ZINC000826373134 609481914 /nfs/dbraw/zinc/48/19/14/609481914.db2.gz AJXYIOCTDRFKRG-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NCc1nc(-c2ccccc2)cs1 ZINC000826186846 609482275 /nfs/dbraw/zinc/48/22/75/609482275.db2.gz MRAYKYLWCXKTGW-UHFFFAOYSA-N -1 3 364.434 3.611 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NCc1cccc(-c2cccnc2)c1 ZINC000826186844 609483385 /nfs/dbraw/zinc/48/33/85/609483385.db2.gz MNQBCTGKDSUQAJ-UHFFFAOYSA-N -1 3 358.405 3.549 20 0 FHADHM C[C@@H](C(=O)N(Cc1ccco1)c1ccccc1-c1nnn[n-]1)c1ccccc1 ZINC000826231536 609484397 /nfs/dbraw/zinc/48/43/97/609484397.db2.gz PDOUWIDYEKJGML-OAHLLOKOSA-N -1 3 373.416 3.797 20 0 FHADHM C[C@@H](C(=O)N(Cc1ccco1)c1ccccc1-c1nn[n-]n1)c1ccccc1 ZINC000826231536 609484401 /nfs/dbraw/zinc/48/44/01/609484401.db2.gz PDOUWIDYEKJGML-OAHLLOKOSA-N -1 3 373.416 3.797 20 0 FHADHM C[C@H]1CCC[C@@H]1C(=O)Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1 ZINC000824929119 609489240 /nfs/dbraw/zinc/48/92/40/609489240.db2.gz WCQHWTHPLZJVIO-AAEUAGOBSA-N -1 3 353.451 3.970 20 0 FHADHM C[C@H]1CCC[C@@H]1C(=O)Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1 ZINC000824929119 609489242 /nfs/dbraw/zinc/48/92/42/609489242.db2.gz WCQHWTHPLZJVIO-AAEUAGOBSA-N -1 3 353.451 3.970 20 0 FHADHM C[C@H]1CCC[C@H]1C(=O)Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1 ZINC000824929121 609489638 /nfs/dbraw/zinc/48/96/38/609489638.db2.gz WCQHWTHPLZJVIO-WCQYABFASA-N -1 3 353.451 3.970 20 0 FHADHM C[C@H]1CCC[C@H]1C(=O)Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1 ZINC000824929121 609489639 /nfs/dbraw/zinc/48/96/39/609489639.db2.gz WCQHWTHPLZJVIO-WCQYABFASA-N -1 3 353.451 3.970 20 0 FHADHM CCOC(=O)Nc1ccc(NCc2cc(C)sc2C)cc1-c1nnn[n-]1 ZINC000825553736 609490627 /nfs/dbraw/zinc/49/06/27/609490627.db2.gz VRWOTDVZKSSGKH-UHFFFAOYSA-N -1 3 372.454 3.726 20 0 FHADHM CCOC(=O)Nc1ccc(NCc2cc(C)sc2C)cc1-c1nn[n-]n1 ZINC000825553736 609490629 /nfs/dbraw/zinc/49/06/29/609490629.db2.gz VRWOTDVZKSSGKH-UHFFFAOYSA-N -1 3 372.454 3.726 20 0 FHADHM CC(C)Oc1c(F)cc(NC(=O)Nc2ccc(-c3nnn[n-]3)cc2)cc1F ZINC000824314756 609491909 /nfs/dbraw/zinc/49/19/09/609491909.db2.gz FKKCOXATBXKZQS-UHFFFAOYSA-N -1 3 374.351 3.576 20 0 FHADHM CC(C)Oc1c(F)cc(NC(=O)Nc2ccc(-c3nn[n-]n3)cc2)cc1F ZINC000824314756 609491910 /nfs/dbraw/zinc/49/19/10/609491910.db2.gz FKKCOXATBXKZQS-UHFFFAOYSA-N -1 3 374.351 3.576 20 0 FHADHM Cc1cc(C)cc([C@H]2CCN(C(=O)Nc3cccc(-c4nnn[n-]4)c3)C2)c1 ZINC000826264209 609497162 /nfs/dbraw/zinc/49/71/62/609497162.db2.gz GBALPFLJIDLYRO-INIZCTEOSA-N -1 3 362.437 3.505 20 0 FHADHM Cc1cc(C)cc([C@H]2CCN(C(=O)Nc3cccc(-c4nn[n-]n4)c3)C2)c1 ZINC000826264209 609497164 /nfs/dbraw/zinc/49/71/64/609497164.db2.gz GBALPFLJIDLYRO-INIZCTEOSA-N -1 3 362.437 3.505 20 0 FHADHM CCN(C(=O)[C@H](C)c1ccccc1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825376874 609509561 /nfs/dbraw/zinc/50/95/61/609509561.db2.gz OSDKEHAAJUJYQC-GFCCVEGCSA-N -1 3 355.829 3.677 20 0 FHADHM CCN(C(=O)[C@H](C)c1ccccc1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825376874 609509562 /nfs/dbraw/zinc/50/95/62/609509562.db2.gz OSDKEHAAJUJYQC-GFCCVEGCSA-N -1 3 355.829 3.677 20 0 FHADHM Cc1ccnc(SCc2ccc(Br)cc2)c1-c1nnn[n-]1 ZINC000826315076 609521428 /nfs/dbraw/zinc/52/14/28/609521428.db2.gz XUXNQZPZDFFZDN-UHFFFAOYSA-N -1 3 362.256 3.625 20 0 FHADHM Cc1ccnc(SCc2ccc(Br)cc2)c1-c1nn[n-]n1 ZINC000826315076 609521431 /nfs/dbraw/zinc/52/14/31/609521431.db2.gz XUXNQZPZDFFZDN-UHFFFAOYSA-N -1 3 362.256 3.625 20 0 FHADHM c1ccc(-c2ccc(CS[C@@H]3CCCOC3)cc2)c(-c2nnn[n-]2)c1 ZINC000826519549 609527568 /nfs/dbraw/zinc/52/75/68/609527568.db2.gz CORHMBWHDMKWMQ-MRXNPFEDSA-N -1 3 352.463 3.946 20 0 FHADHM c1ccc(-c2ccc(CS[C@@H]3CCCOC3)cc2)c(-c2nn[n-]n2)c1 ZINC000826519549 609527570 /nfs/dbraw/zinc/52/75/70/609527570.db2.gz CORHMBWHDMKWMQ-MRXNPFEDSA-N -1 3 352.463 3.946 20 0 FHADHM COc1cc([C@@H](C)Nc2nccc(C)c2-c2nnn[n-]2)ccc1OC(C)C ZINC000826177757 609532940 /nfs/dbraw/zinc/53/29/40/609532940.db2.gz UHTHTTAPBNWHKS-CYBMUJFWSA-N -1 3 368.441 3.539 20 0 FHADHM COc1cc([C@@H](C)Nc2nccc(C)c2-c2nn[n-]n2)ccc1OC(C)C ZINC000826177757 609532941 /nfs/dbraw/zinc/53/29/41/609532941.db2.gz UHTHTTAPBNWHKS-CYBMUJFWSA-N -1 3 368.441 3.539 20 0 FHADHM COc1cccc([C@@H]2C[C@H](C)CN2c2cccc(F)c2-c2nnn[n-]2)c1 ZINC000826215188 609592818 /nfs/dbraw/zinc/59/28/18/609592818.db2.gz ITHPBXHFDUTPPJ-SJCJKPOMSA-N -1 3 353.401 3.602 20 0 FHADHM COc1cccc([C@@H]2C[C@H](C)CN2c2cccc(F)c2-c2nn[n-]n2)c1 ZINC000826215188 609592820 /nfs/dbraw/zinc/59/28/20/609592820.db2.gz ITHPBXHFDUTPPJ-SJCJKPOMSA-N -1 3 353.401 3.602 20 0 FHADHM C[C@H]1C[C@@H](CCNc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)CCO1 ZINC000824885324 609596706 /nfs/dbraw/zinc/59/67/06/609596706.db2.gz RTSXFRYQOHXFNI-QWRGUYRKSA-N -1 3 355.364 3.503 20 0 FHADHM C[C@H]1C[C@@H](CCNc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)CCO1 ZINC000824885324 609596708 /nfs/dbraw/zinc/59/67/08/609596708.db2.gz RTSXFRYQOHXFNI-QWRGUYRKSA-N -1 3 355.364 3.503 20 0 FHADHM 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928775147 /nfs/dbraw/zinc/77/51/47/928775147.db2.gz VDCQLJCYRVRYFF-CQSZACIVSA-N -1 3 369.393 3.752 20 0 FHADHM COc1cc(C(=O)N2CCC[C@@H]2CCc2ccccc2)cc(OC)c1[O-] ZINC000179552233 928824269 /nfs/dbraw/zinc/82/42/69/928824269.db2.gz ZPNYKBPAUSQZIC-QGZVFWFLSA-N -1 3 355.434 3.647 20 0 FHADHM Nc1ccc2c(c1)CCC[C@@H]2[N-]S(=O)(=O)c1c(Cl)ccc(F)c1F ZINC000647284048 937313165 /nfs/dbraw/zinc/31/31/65/937313165.db2.gz ZEXDQACPJDKQDU-AWEZNQCLSA-N -1 3 372.824 3.556 20 0 FHADHM CC(C)(C)/C=C\C(=O)Nc1cc(C(F)(F)F)ccc1[N-]S(C)(=O)=O ZINC000255025622 929239759 /nfs/dbraw/zinc/23/97/59/929239759.db2.gz VXWALZALWNEXOO-FPLPWBNLSA-N -1 3 364.389 3.618 20 0 FHADHM CCc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)CCCC(=O)N3)cc1CC ZINC000535990151 937332185 /nfs/dbraw/zinc/33/21/85/937332185.db2.gz UEBBINDOFAHCKU-UHFFFAOYSA-N -1 3 372.490 3.887 20 0 FHADHM Cc1cc(Cl)c2ccccc2c1[N-]S(=O)(=O)CCOCC1CC1 ZINC000583316597 937343943 /nfs/dbraw/zinc/34/39/43/937343943.db2.gz ATONRMFSHKTNRX-UHFFFAOYSA-N -1 3 353.871 3.970 20 0 FHADHM COc1ccccc1[C@@H]1CC[C@H](C)CN1C(=O)c1cc(=O)[n-]c(C2CC2)n1 ZINC000579970967 929708422 /nfs/dbraw/zinc/70/84/22/929708422.db2.gz QFRYTNXFUIZWFE-GUYCJALGSA-N -1 3 367.449 3.682 20 0 FHADHM CCc1c(C(=O)Nc2cc(F)ccc2[O-])cnn1-c1ccccc1OC ZINC000187718499 929777700 /nfs/dbraw/zinc/77/77/00/929777700.db2.gz JUWZACWQSBGJLX-UHFFFAOYSA-N -1 3 355.369 3.540 20 0 FHADHM O=C(Nc1ccc(Br)cc1[O-])c1noc2c1CCCCC2 ZINC000548033250 930088076 /nfs/dbraw/zinc/08/80/76/930088076.db2.gz LJFGZOSHDGWRQJ-UHFFFAOYSA-N -1 3 351.200 3.664 20 0 FHADHM O=C(CCc1ncc(-c2ccc(F)cc2F)o1)[N-]OCCC(F)(F)F ZINC000162964266 937397988 /nfs/dbraw/zinc/39/79/88/937397988.db2.gz UEYXUPLMBXOTHB-UHFFFAOYSA-N -1 3 364.270 3.553 20 0 FHADHM O=C(Nc1ccc(Br)cc1[O-])[C@@H]1CCCN1c1ccccc1 ZINC000683821729 930299514 /nfs/dbraw/zinc/29/95/14/930299514.db2.gz ZLWGRORWSIOMHX-HNNXBMFYSA-N -1 3 361.239 3.762 20 0 FHADHM CC(=O)c1ccc(Cl)c([N-]S(=O)(=O)c2cnc(Cl)c(C)c2)c1 ZINC000177718746 930303920 /nfs/dbraw/zinc/30/39/20/930303920.db2.gz 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/nfs/dbraw/zinc/91/41/94/930914194.db2.gz LILLIKDPOORXIO-UHFFFAOYSA-N -1 3 371.759 3.738 20 0 FHADHM O=C(CCC(=O)c1cccs1)[N-]OCc1ccc(C(F)(F)F)cc1 ZINC000160622122 931110036 /nfs/dbraw/zinc/11/00/36/931110036.db2.gz LTDKYXDNAPIONM-UHFFFAOYSA-N -1 3 357.353 3.978 20 0 FHADHM Cc1cc(=O)[n-]c([C@H](C)N2CCc3c(F)cc(Br)cc3C2)n1 ZINC000684093254 931253355 /nfs/dbraw/zinc/25/33/55/931253355.db2.gz NHDPLYNQICRFLI-JTQLQIEISA-N -1 3 366.234 3.512 20 0 FHADHM COC(=O)c1[n-]cnc1NC(=O)c1cc(C)c(-c2ccc(F)cc2)s1 ZINC000564623714 931272583 /nfs/dbraw/zinc/27/25/83/931272583.db2.gz MXHOYXSCQHMEBL-UHFFFAOYSA-N -1 3 359.382 3.625 20 0 FHADHM COC(=O)c1nc[n-]c1NC(=O)c1cc(C)c(-c2ccc(F)cc2)s1 ZINC000564623714 931272593 /nfs/dbraw/zinc/27/25/93/931272593.db2.gz MXHOYXSCQHMEBL-UHFFFAOYSA-N -1 3 359.382 3.625 20 0 FHADHM O=C(Nc1cccc(Cl)c1OCC(F)F)c1cccc2n[n-]nc21 ZINC000581107639 931571565 /nfs/dbraw/zinc/57/15/65/931571565.db2.gz OIWUBAIJSWJOJY-UHFFFAOYSA-N -1 3 352.728 3.508 20 0 FHADHM CC(=O)c1cc(C(=O)Nc2n[n-]c(-c3ccc(C)o3)n2)ccc1OC(C)C ZINC000656395516 931586950 /nfs/dbraw/zinc/58/69/50/931586950.db2.gz RNWVRWCVFUOFGP-UHFFFAOYSA-N -1 3 368.393 3.615 20 0 FHADHM CCOc1cc(CN(C)CC(=O)N(C)C2CCCCC2)cc(Cl)c1[O-] ZINC000656411938 931605570 /nfs/dbraw/zinc/60/55/70/931605570.db2.gz CHOUBXPXBWTTMV-UHFFFAOYSA-N -1 3 368.905 3.667 20 0 FHADHM O=C(N[C@H](c1cccc(F)c1)C1CCCC1)c1cc(=O)[n-]c(C2CC2)n1 ZINC000581140590 931609534 /nfs/dbraw/zinc/60/95/34/931609534.db2.gz NJQXXSOPIRVRSU-SFHVURJKSA-N -1 3 355.413 3.860 20 0 FHADHM O=C([O-])[C@@]1(C(F)(F)F)CCN(Cc2cc(Cl)cc3cccnc32)C1 ZINC000581195767 931656559 /nfs/dbraw/zinc/65/65/59/931656559.db2.gz HOPNAQXOJZYVSG-OAHLLOKOSA-N -1 3 358.747 3.727 20 0 FHADHM O=C(NNc1ncccc1Cl)c1cn[n-]c1-c1ccc(Cl)s1 ZINC000188282286 931790150 /nfs/dbraw/zinc/79/01/50/931790150.db2.gz JUWUVDCBFSSGFP-UHFFFAOYSA-N -1 3 354.222 3.597 20 0 FHADHM O=C(NNc1ncccc1Cl)c1c[n-]nc1-c1ccc(Cl)s1 ZINC000188282286 931790158 /nfs/dbraw/zinc/79/01/58/931790158.db2.gz 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FHADHM Cc1ccc(SCCN2C[C@H](C(=O)[O-])C[C@H](C(F)(F)F)C2)cc1C ZINC000656758189 932392219 /nfs/dbraw/zinc/39/22/19/932392219.db2.gz XPWPHNXYDJLJMW-KGLIPLIRSA-N -1 3 361.429 3.981 20 0 FHADHM O=C([O-])c1nc(-c2ccccc2)oc1CN1CCC([C@H]2CCCCO2)CC1 ZINC000656770025 932406888 /nfs/dbraw/zinc/40/68/88/932406888.db2.gz VISQTZQSPUVQCM-QGZVFWFLSA-N -1 3 370.449 3.821 20 0 FHADHM Cc1ncc(S(=O)(=O)[N-]Cc2cccc(OCc3ccccc3)c2)s1 ZINC000559142208 932730378 /nfs/dbraw/zinc/73/03/78/932730378.db2.gz CEAYWNVBNYXTHT-UHFFFAOYSA-N -1 3 374.487 3.509 20 0 FHADHM Cc1sc2[n-]c([C@H](C)OC(=O)c3ccc(N)cc3C)nc(=O)c2c1C ZINC000728367184 932734924 /nfs/dbraw/zinc/73/49/24/932734924.db2.gz ZAVJZGFOJSARQN-JTQLQIEISA-N -1 3 357.435 3.822 20 0 FHADHM COC(=O)c1ccc(Cl)c(S(=O)(=O)[N-]c2c(C)cccc2Cl)c1 ZINC000161048565 932761717 /nfs/dbraw/zinc/76/17/17/932761717.db2.gz IKAKNPQELVRLDL-UHFFFAOYSA-N -1 3 374.245 3.889 20 0 FHADHM Cc1c2cc(F)ccc2oc1S(=O)(=O)[N-]Cc1nccc2ccccc21 ZINC000471783920 932903627 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CCS[C@@H]1CC[C@@H](N(C)C(=O)c2c[n-]c3cc(F)c(F)cc3c2=O)C1 ZINC000933801327 933549293 /nfs/dbraw/zinc/54/92/93/933549293.db2.gz LYOGUDBRBLJGDU-GHMZBOCLSA-N -1 3 366.433 3.553 20 0 FHADHM C[C@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)c1cc(=O)[n-]c(C2CC2)n1 ZINC000518560121 933569227 /nfs/dbraw/zinc/56/92/27/933569227.db2.gz RIZNTRAIFWVLEW-SNVBAGLBSA-N -1 3 365.355 3.912 20 0 FHADHM Cc1ncc(S(=O)(=O)[N-][C@@H](C)c2ccc(C(F)(F)F)cc2)s1 ZINC000431063835 933756256 /nfs/dbraw/zinc/75/62/56/933756256.db2.gz ATPLDQQMLIMXMH-QMMMGPOBSA-N -1 3 350.387 3.510 20 0 FHADHM Cc1cc(Br)ccc1S(=O)(=O)[N-]C1(C(F)(F)F)CCC1 ZINC000471922076 933772037 /nfs/dbraw/zinc/77/20/37/933772037.db2.gz FQVHRLPWDREONY-UHFFFAOYSA-N -1 3 372.206 3.521 20 0 FHADHM C[C@H](NC(=O)c1c([O-])cccc1O)c1ccc(OCC(F)(F)F)cc1 ZINC000092120002 933882189 /nfs/dbraw/zinc/88/21/89/933882189.db2.gz BJQOEPUCWMWBKH-JTQLQIEISA-N -1 3 355.312 3.530 20 0 FHADHM COC(=O)c1cccc([N-]S(=O)(=O)c2cc(C)sc2C)c1Cl ZINC000431182215 934042246 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VUWCKAIKUONWDO-LSDHHAIUSA-N -1 3 373.338 3.628 20 0 FHADHM COc1cnc([C@H]2CCCN2CCOc2cccc3ccccc32)[n-]c1=O ZINC000934278639 935241269 /nfs/dbraw/zinc/24/12/69/935241269.db2.gz VAORLTYYEIETPM-QGZVFWFLSA-N -1 3 365.433 3.560 20 0 FHADHM CCc1ccc([O-])c(C(=O)N2CCC[C@@H](Cn3cnc4ccccc43)C2)c1 ZINC000684750955 935257712 /nfs/dbraw/zinc/25/77/12/935257712.db2.gz HEROEZICTHBPGZ-QGZVFWFLSA-N -1 3 363.461 3.857 20 0 FHADHM Cc1nnc([C@H](C)Nc2ccc(Oc3cccc(-c4nnn[n-]4)c3)cc2)o1 ZINC000737520151 945089988 /nfs/dbraw/zinc/08/99/88/945089988.db2.gz DRKWQHHVWWXHHS-NSHDSACASA-N -1 3 363.381 3.524 20 0 FHADHM Cc1nnc([C@H](C)Nc2ccc(Oc3cccc(-c4nn[n-]n4)c3)cc2)o1 ZINC000737520151 945089998 /nfs/dbraw/zinc/08/99/98/945089998.db2.gz DRKWQHHVWWXHHS-NSHDSACASA-N -1 3 363.381 3.524 20 0 FHADHM Cc1noc(C)c1[C@H](C)[N-]S(=O)(=O)c1c(Cl)cc(F)cc1Cl ZINC000684760121 935295383 /nfs/dbraw/zinc/29/53/83/935295383.db2.gz DWAWXFVPAGHUSC-ZETCQYMHSA-N -1 3 367.229 3.777 20 0 FHADHM CCCCOc1ccc(CNC(=O)NCc2ncccc2[O-])cc1Cl ZINC000472182329 935335639 /nfs/dbraw/zinc/33/56/39/935335639.db2.gz VHAIVMNGWXSAIR-UHFFFAOYSA-N -1 3 363.845 3.619 20 0 FHADHM O=C([O-])CCN(Cc1ccc(F)c(F)c1)C[C@@H]1CCC2(CCCC2)O1 ZINC000563284970 935418530 /nfs/dbraw/zinc/41/85/30/935418530.db2.gz WKWDBXQJJXHFME-HNNXBMFYSA-N -1 3 353.409 3.733 20 0 FHADHM CO[C@@H](CS(=O)(=O)[N-]c1ccc(C(F)(F)F)cc1Cl)C1CC1 ZINC000582301680 935500448 /nfs/dbraw/zinc/50/04/48/935500448.db2.gz QBVJBEULKUBFRS-LBPRGKRZSA-N -1 3 357.781 3.526 20 0 FHADHM CC(=O)c1cccc(NC(=O)c2cccc(OCc3cscn3)c2)c1[O-] ZINC000582317022 935519921 /nfs/dbraw/zinc/51/99/21/935519921.db2.gz WYLLDVKZSNNORB-UHFFFAOYSA-N -1 3 368.414 3.883 20 0 FHADHM COc1ccc(C(=O)N2C[C@@H](c3ccccc3Cl)OC[C@H]2C)c([O-])c1 ZINC000110515930 935605407 /nfs/dbraw/zinc/60/54/07/935605407.db2.gz XSOBGTZHBRMNQU-XIKOKIGWSA-N -1 3 361.825 3.656 20 0 FHADHM Cc1cc([C@@H]2CCCN(Cc3cc(=O)oc4cc([O-])c(Cl)cc34)C2)n[nH]1 ZINC000375700800 935651703 /nfs/dbraw/zinc/65/17/03/935651703.db2.gz JIUFBOZUYSCILP-GFCCVEGCSA-N -1 3 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O=C(Nc1cccc(C[S@@](=O)c2ccccc2)c1)c1c([O-])cccc1O ZINC000180854930 941358409 /nfs/dbraw/zinc/35/84/09/941358409.db2.gz QQVJOZJOSKVCLC-AREMUKBSSA-N -1 3 367.426 3.658 20 0 FHADHM CCn1c2ccc(C(=O)[O-])cc2nc1CN(C)C[C@@H]1CCc2ccccc21 ZINC000659804481 941406247 /nfs/dbraw/zinc/40/62/47/941406247.db2.gz XWIDTHHGSLIKLS-KRWDZBQOSA-N -1 3 363.461 3.916 20 0 FHADHM Cc1cc(S(=O)(=O)[N-][C@H]2CCO[C@H](c3ccccc3)C2)sc1Cl ZINC000188182983 941412063 /nfs/dbraw/zinc/41/20/63/941412063.db2.gz RJQNYNYKJZJMCN-KBPBESRZSA-N -1 3 371.911 3.909 20 0 FHADHM CCC(C)(CC)NC(=O)C[C@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000182439781 941424056 /nfs/dbraw/zinc/42/40/56/941424056.db2.gz OGLWUJCKOBZPPR-IBGZPJMESA-N -1 3 368.477 3.948 20 0 FHADHM O=C(Nc1ccc(Br)c(Cl)c1)c1cccc2n[n-]nc21 ZINC000188593656 941475908 /nfs/dbraw/zinc/47/59/08/941475908.db2.gz IHNHPKVHEUDUNI-UHFFFAOYSA-N -1 3 351.591 3.626 20 0 FHADHM CCCC1(CNC(=O)c2cc(NC(=O)c3cnoc3C)ccc2[O-])CCC1 ZINC000183171966 941491511 /nfs/dbraw/zinc/49/15/11/941491511.db2.gz 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368.820 3.969 20 0 FHADHM CCOC(=O)c1ccc(NC(=O)c2cccc([C@@H]3CCCOC3)c2)c([O-])c1 ZINC000501865503 942096378 /nfs/dbraw/zinc/09/63/78/942096378.db2.gz CSJTVDDFHAYSRW-QGZVFWFLSA-N -1 3 369.417 3.715 20 0 FHADHM CO[C@H](CC(C)C)CS(=O)(=O)[N-]C(c1cccs1)c1cccs1 ZINC000420676769 942153054 /nfs/dbraw/zinc/15/30/54/942153054.db2.gz LTGOSEQXRCNVBY-CYBMUJFWSA-N -1 3 373.565 3.880 20 0 FHADHM O=S(=O)([N-]C[C@H]1CC12CCSCC2)c1c(Cl)cccc1Cl ZINC000420701175 942162860 /nfs/dbraw/zinc/16/28/60/942162860.db2.gz DNJYORTVBCBBHM-SNVBAGLBSA-N -1 3 366.335 3.805 20 0 FHADHM COC(=O)c1[n-]c(=N[C@H]2C[C@H]2c2ccccc2C(F)(F)F)sc1C ZINC000434095915 942174207 /nfs/dbraw/zinc/17/42/07/942174207.db2.gz NEORDLRCBSVKSB-JQWIXIFHSA-N -1 3 356.369 3.647 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2ccc(OC)c(SC)c2)c(C)c1F ZINC000414389214 942180131 /nfs/dbraw/zinc/18/01/31/942180131.db2.gz PHHJTNQECVQTFV-UHFFFAOYSA-N -1 3 371.455 3.674 20 0 FHADHM Cc1cc(S(=O)(=O)Nc2cc([O-])c(F)cc2F)ccc1OC(C)C ZINC000414390830 942185149 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O=C([C@H]1C[C@H]1c1ccc(Cl)cc1Cl)N1CCCc2c(=O)[n-]cnc21 ZINC000893216515 942670785 /nfs/dbraw/zinc/67/07/85/942670785.db2.gz UIBNIGGBXCBVEK-STQMWFEESA-N -1 3 364.232 3.572 20 0 FHADHM O=C(N1CCCc2c(=O)[n-]cnc21)C1(Sc2ccccc2)CCCC1 ZINC000893216465 942670794 /nfs/dbraw/zinc/67/07/94/942670794.db2.gz RURWJVLWUZIKMV-UHFFFAOYSA-N -1 3 355.463 3.567 20 0 FHADHM Cc1cc(Cl)ccc1OCCCNC(=O)c1c[n-]c2ccccc2c1=O ZINC000502740967 942694279 /nfs/dbraw/zinc/69/42/79/942694279.db2.gz TYGXCFNPXMQXJI-UHFFFAOYSA-N -1 3 370.836 3.689 20 0 FHADHM Cc1cc(C)n([C@@H](C)CC(=O)Nc2ccc(Br)cc2[O-])n1 ZINC000613705454 942749307 /nfs/dbraw/zinc/74/93/07/942749307.db2.gz GGOWGXZAZRNQOX-NSHDSACASA-N -1 3 352.232 3.558 20 0 FHADHM CCCC1(C(=O)N=c2[n-]n(CC(F)(F)F)cc2Br)CCC1 ZINC000421682084 942756904 /nfs/dbraw/zinc/75/69/04/942756904.db2.gz KSZHCNAEXNFHSI-UHFFFAOYSA-N -1 3 368.197 3.539 20 0 FHADHM CCC[C@H](C(=O)N=c1[n-]n(CC(F)(F)F)cc1Br)C(C)C ZINC000421683167 942757512 /nfs/dbraw/zinc/75/75/12/942757512.db2.gz RPLCUKRCKQWBJP-VIFPVBQESA-N -1 3 370.213 3.641 20 0 FHADHM CC[C@@H]1CN(C(=O)c2cc(F)cc3n[n-]nc32)c2cccc(Cl)c2O1 ZINC000502841897 942790625 /nfs/dbraw/zinc/79/06/25/942790625.db2.gz GHBIJZSNVKNDOL-SNVBAGLBSA-N -1 3 360.776 3.568 20 0 FHADHM Cc1noc(C)c1[C@@H](C)CC(=O)N=c1cc(-c2cc(F)cc(F)c2)[n-][nH]1 ZINC000514218569 942826774 /nfs/dbraw/zinc/82/67/74/942826774.db2.gz KRAPLOMFXPOCAP-VIFPVBQESA-N -1 3 360.364 3.514 20 0 FHADHM COc1ccc([C@@H](CC(=O)[O-])NCc2cccc(C3CC3)c2)cc1OC ZINC000421812866 942841724 /nfs/dbraw/zinc/84/17/24/942841724.db2.gz DLDUHVVXKQABPM-GOSISDBHSA-N -1 3 355.434 3.887 20 0 FHADHM CCOC[C@H]([N-]S(=O)(=O)c1cc(Cl)ccc1C(F)(F)F)C(C)C ZINC000509977517 942886832 /nfs/dbraw/zinc/88/68/32/942886832.db2.gz TZVDWKSVBZRNEZ-LBPRGKRZSA-N -1 3 373.824 3.698 20 0 FHADHM CCCN(C(=O)c1cc(=O)[n-]c(C2CC2)n1)[C@@H]1C[C@@H](OCC)C12CCCC2 ZINC000580326901 942917341 /nfs/dbraw/zinc/91/73/41/942917341.db2.gz QMBJFQPCQIDWKJ-IAGOWNOFSA-N -1 3 373.497 3.650 20 0 FHADHM Cc1cc(OCCCC(=O)N=c2cc(-c3ccncc3)[n-][nH]2)ccc1Cl ZINC000503026595 942917918 /nfs/dbraw/zinc/91/79/18/942917918.db2.gz NNCFCYQFXXYWJM-UHFFFAOYSA-N -1 3 370.840 3.653 20 0 FHADHM C[C@@H](Sc1nccnc1N)c1nc(=O)c2c(-c3ccco3)csc2[n-]1 ZINC000430113906 942927074 /nfs/dbraw/zinc/92/70/74/942927074.db2.gz OQDRWTRNIVAYRI-MRVPVSSYSA-N -1 3 371.447 3.882 20 0 FHADHM COc1cccc(-c2nc(-c3cccnc3N3CCCCC3)no2)c1[O-] ZINC000273381612 942945000 /nfs/dbraw/zinc/94/50/00/942945000.db2.gz FZVSFOXXIQLGLC-UHFFFAOYSA-N -1 3 352.394 3.503 20 0 FHADHM CCC(C)(C)N(C)C(=O)c1c[n-]c2c(OC(F)(F)F)cccc2c1=O ZINC000473565022 942958224 /nfs/dbraw/zinc/95/82/24/942958224.db2.gz ZEEOJDWRJUHFSL-UHFFFAOYSA-N -1 3 356.344 3.687 20 0 FHADHM COCC1CCC([N-]S(=O)(=O)c2c(Cl)ccc(C)c2Cl)CC1 ZINC000416591527 942994309 /nfs/dbraw/zinc/99/43/09/942994309.db2.gz LYYAOCWTOYWPCE-UHFFFAOYSA-N -1 3 366.310 3.785 20 0 FHADHM C[C@H](OC(=O)c1cc(Cl)c(Cl)[n-]1)C(=O)N[C@@H](C)c1ccc(F)cc1 ZINC000028485978 943118477 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COC(=O)c1cccc2[n-]c(NC(=O)[C@H](C)CSc3ccccc3)nc21 ZINC000503589577 943277764 /nfs/dbraw/zinc/27/77/64/943277764.db2.gz CDHQFCSERQYKOW-GFCCVEGCSA-N -1 3 369.446 3.716 20 0 FHADHM CCOC(=O)c1c(C2CC2)csc1[N-]C(=O)c1cnc(C(C)=O)s1 ZINC000414694099 943290261 /nfs/dbraw/zinc/29/02/61/943290261.db2.gz NOHBWWQRHIXQPC-UHFFFAOYSA-N -1 3 364.448 3.714 20 0 FHADHM O=c1cc(CNc2c(F)cc(Br)cc2F)nc(C2CC2)[n-]1 ZINC000417030758 943297464 /nfs/dbraw/zinc/29/74/64/943297464.db2.gz WRXBESGGGHINRM-UHFFFAOYSA-N -1 3 356.170 3.712 20 0 FHADHM O=C(Nc1nc(C=Cc2ccccc2)cs1)c1cc(F)cc2n[n-]nc21 ZINC000503620093 943304302 /nfs/dbraw/zinc/30/43/02/943304302.db2.gz UIYWQOCCTUERSJ-VOTSOKGWSA-N -1 3 365.393 3.976 20 0 FHADHM C[C@H]([N-]S(=O)(=O)c1cccnc1C(F)(F)F)C(C)(C)c1ccccc1 ZINC000514806481 943304890 /nfs/dbraw/zinc/30/48/90/943304890.db2.gz IJFSQIDHZPRBPN-LBPRGKRZSA-N -1 3 372.412 3.745 20 0 FHADHM Cc1c(NCc2cc(=O)[n-]c(C3CC3)n2)cnn1-c1ccc(Cl)cc1 ZINC000417051259 943312173 /nfs/dbraw/zinc/31/21/73/943312173.db2.gz 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CCc1cc(=O)[n-]c(-c2ccc(N3CCC[C@@H]([C@@H]4CCCCO4)C3)nc2)n1 ZINC000664482160 943337439 /nfs/dbraw/zinc/33/74/39/943337439.db2.gz HLBABZRSKCIBNK-AEFFLSMTSA-N -1 3 368.481 3.592 20 0 FHADHM CCOc1cc(CN[C@@H](C)c2ncc(C(=O)OC)s2)cc(Cl)c1[O-] ZINC000425343326 943340433 /nfs/dbraw/zinc/34/04/33/943340433.db2.gz AFZOJOVOPHPIMU-VIFPVBQESA-N -1 3 370.858 3.538 20 0 FHADHM CC(=O)c1c(C)cc(C)c(C[S@](=O)Cc2cc(=O)[n-]c(C3CC3)n2)c1C ZINC000417134686 943373206 /nfs/dbraw/zinc/37/32/06/943373206.db2.gz AQKDAGSXPUDECB-AREMUKBSSA-N -1 3 372.490 3.636 20 0 FHADHM Cc1cccc(Cl)c1C[S@@](=O)Cc1nc(C(F)(F)F)cc(=O)[n-]1 ZINC000417174512 943394969 /nfs/dbraw/zinc/39/49/69/943394969.db2.gz MNMJFYKUQBHUBA-HSZRJFAPSA-N -1 3 364.776 3.612 20 0 FHADHM COCC[C@H]([N-]S(=O)(=O)c1cc(Cl)ccc1Cl)c1ccco1 ZINC000503889168 943404441 /nfs/dbraw/zinc/40/44/41/943404441.db2.gz ZWHYLBDYGOHBSC-LBPRGKRZSA-N -1 3 364.250 3.643 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)c1ccc2[nH]c3c(c2c1)CCCCC3 ZINC000515001753 943443522 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CCS(=O)(=O)Cc1nc(=O)c2c(-c3ccc(C)cc3C)csc2[n-]1 ZINC000545497348 943606267 /nfs/dbraw/zinc/60/62/67/943606267.db2.gz IAUUEPSWEPBLNW-UHFFFAOYSA-N -1 3 362.476 3.615 20 0 FHADHM C[C@H]1CC[C@@](CNCc2c(F)cccc2Br)(CC(=O)[O-])C1 ZINC000417571953 943710377 /nfs/dbraw/zinc/71/03/77/943710377.db2.gz UJLLBWNMXXBLAP-ZBEGNZNMSA-N -1 3 358.251 3.959 20 0 FHADHM COc1c(Cl)cc(Cl)cc1CN[C@H](C(=O)[O-])[C@@H](C)OC(C)(C)C ZINC000417581277 943729435 /nfs/dbraw/zinc/72/94/35/943729435.db2.gz FWYBDUZJRPLUAW-RNCFNFMXSA-N -1 3 364.269 3.748 20 0 FHADHM O=C([O-])CC[C@@H](NCc1cc(Cl)c2c(c1)OCCO2)c1ccccc1 ZINC000417605408 943746341 /nfs/dbraw/zinc/74/63/41/943746341.db2.gz XZLXUZKXQKVZGH-MRXNPFEDSA-N -1 3 361.825 3.807 20 0 FHADHM CCCOc1ccc(CN[C@@H]2C[C@@H](C(=O)[O-])c3ccccc32)cc1OC ZINC000417620372 943755894 /nfs/dbraw/zinc/75/58/94/943755894.db2.gz LOUSYBCQUGFBNW-QZTJIDSGSA-N -1 3 355.434 3.887 20 0 FHADHM C[C@@H](CNCc1csc(-c2cccc(Br)c2)n1)CC(=O)[O-] ZINC000417615693 943765222 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O=S(=O)([N-]C[C@@H]1C[C@H]1c1ccccc1)c1ccc(Br)s1 ZINC000515314499 943796821 /nfs/dbraw/zinc/79/68/21/943796821.db2.gz AXCAEAGYAFGYGF-RYUDHWBXSA-N -1 3 372.309 3.593 20 0 FHADHM O=C([O-])C[C@@H](CCNCc1cccc(F)c1Br)C(F)(F)F ZINC000417653296 943800677 /nfs/dbraw/zinc/80/06/77/943800677.db2.gz HAARTMJTCHLXNA-SECBINFHSA-N -1 3 372.156 3.721 20 0 FHADHM C[C@@H]1CCCN(Cc2cc(Cl)ccc2OCc2cccnc2)[C@@H]1C(=O)[O-] ZINC000424270872 943828524 /nfs/dbraw/zinc/82/85/24/943828524.db2.gz OHQYIMJEKNBDLG-KUHUBIRLSA-N -1 3 374.868 3.999 20 0 FHADHM O=C(N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1)c1cc([O-])ccc1Cl ZINC000516941722 943849399 /nfs/dbraw/zinc/84/93/99/943849399.db2.gz TUIMGRPWXDHUEY-JTQLQIEISA-N -1 3 369.223 3.847 20 0 FHADHM C[C@@H]1C[C@]1(NC(=O)c1cc(=O)c2ccccc2[n-]1)c1ccc(Cl)cc1 ZINC000505743363 943933417 /nfs/dbraw/zinc/93/34/17/943933417.db2.gz GNANGWUDUGZLMG-MPBGBICISA-N -1 3 352.821 3.847 20 0 FHADHM O=S(=O)([N-]c1ccc(-n2cccn2)c(F)c1)c1ccc2c(c1)CCCC2 ZINC000515591533 944043144 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FHADHM O=C(Nc1n[n-]c(-c2ccccn2)n1)[C@@H](OC1CCCC1)c1ccccc1 ZINC000439009383 944248216 /nfs/dbraw/zinc/24/82/16/944248216.db2.gz LKEGCOUGEGWFKJ-KRWDZBQOSA-N -1 3 363.421 3.506 20 0 FHADHM COC(=O)c1c(CC(C)C)csc1[N-]C(=O)c1cnc(C(C)=O)s1 ZINC000414883762 944281850 /nfs/dbraw/zinc/28/18/50/944281850.db2.gz NKSCWLKSDAKXSG-UHFFFAOYSA-N -1 3 366.464 3.645 20 0 FHADHM C[C@@H](CSc1nc2c(cnn2-c2ccccc2)c(=O)[n-]1)C(F)(F)F ZINC000439055423 944300754 /nfs/dbraw/zinc/30/07/54/944300754.db2.gz LHJBLFALZIUTCC-VIFPVBQESA-N -1 3 354.357 3.812 20 0 FHADHM CN(CCCCCc1cc(-c2ccccc2)n[nH]1)C(=O)c1cncc([O-])c1 ZINC000111571111 944303534 /nfs/dbraw/zinc/30/35/34/944303534.db2.gz CZOKIMNNOGBHPA-UHFFFAOYSA-N -1 3 364.449 3.662 20 0 FHADHM C[C@@]1(c2ccccc2)C[C@H]1[N-]S(=O)(=O)c1ccc(Br)s1 ZINC000608031447 944313388 /nfs/dbraw/zinc/31/33/88/944313388.db2.gz OQHDBAUHCCRRNO-RISCZKNCSA-N -1 3 372.309 3.519 20 0 FHADHM CC1(C)Cc2cc([N-]S(=O)(=O)c3ccc4ncccc4c3)ccc2O1 ZINC000468757047 944343132 /nfs/dbraw/zinc/34/31/32/944343132.db2.gz ALDHOMPTISFQFN-UHFFFAOYSA-N -1 3 354.431 3.749 20 0 FHADHM CCOc1cc2c(cc1[C@@H]1C[C@H]1NC(=O)c1ccc(C)cc1[O-])O[C@@H](C)C2 ZINC000436489956 944359235 /nfs/dbraw/zinc/35/92/35/944359235.db2.gz NYHFWSYSWUUBOV-QANKJYHBSA-N -1 3 367.445 3.709 20 0 FHADHM C[C@@H](CCOCc1ccccc1)NC(=O)CCCc1ccc([O-])c(F)c1 ZINC000518425378 944370828 /nfs/dbraw/zinc/37/08/28/944370828.db2.gz JAWHMOHVVGDKIQ-INIZCTEOSA-N -1 3 359.441 3.966 20 0 FHADHM O=C(N=c1cc(-c2ccncc2)[n-][nH]1)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1 ZINC000439145805 944378286 /nfs/dbraw/zinc/37/82/86/944378286.db2.gz XZMKZFWDVLHEFI-GJZGRUSLSA-N -1 3 373.243 3.943 20 0 FHADHM COc1cc(CNC(=O)c2ccc(C)cc2[O-])ccc1OCC(F)(F)F ZINC000436510539 944380772 /nfs/dbraw/zinc/38/07/72/944380772.db2.gz GISQZFVPBIJKFH-UHFFFAOYSA-N -1 3 369.339 3.580 20 0 FHADHM CC(=O)c1ccc(C(=O)N(C)Cc2ccccc2C(F)(F)F)cc1[O-] ZINC000436523685 944391625 /nfs/dbraw/zinc/39/16/25/944391625.db2.gz CDQRMAWJOSGTMM-UHFFFAOYSA-N -1 3 351.324 3.886 20 0 FHADHM Cc1oncc1C(=O)Nc1ccc(NC(=O)c2ccc(C)c(C)c2[O-])cc1 ZINC000436535670 944402231 /nfs/dbraw/zinc/40/22/31/944402231.db2.gz BCFIKXBUXVMHPG-UHFFFAOYSA-N -1 3 365.389 3.810 20 0 FHADHM Cc1ccc(C(=O)Nc2ccccc2CN2C[C@@H](C)O[C@@H](C)C2)c([O-])c1C ZINC000436555935 944412677 /nfs/dbraw/zinc/41/26/77/944412677.db2.gz JVYIALQXMRYAFP-IYBDPMFKSA-N -1 3 368.477 3.871 20 0 FHADHM O=C(c1ccccc1[O-])N1CCO[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000436577881 944425670 /nfs/dbraw/zinc/42/56/70/944425670.db2.gz TVYJXUGYJCVERK-INIZCTEOSA-N -1 3 351.324 3.625 20 0 FHADHM O=C(c1ccc([O-])cc1)N1CCN(c2ccnc3c(Cl)cccc23)CC1 ZINC000436563511 944429461 /nfs/dbraw/zinc/42/94/61/944429461.db2.gz HMYAGFPPYLVOCD-UHFFFAOYSA-N -1 3 367.836 3.556 20 0 FHADHM CCCNC(=O)CN(CCC)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436567213 944431976 /nfs/dbraw/zinc/43/19/76/944431976.db2.gz ZKNPLRLIMSUCIE-UHFFFAOYSA-N -1 3 370.449 3.563 20 0 FHADHM CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)c2ccc(C(C)=O)c([O-])c2)c1 ZINC000436593610 944439150 /nfs/dbraw/zinc/43/91/50/944439150.db2.gz CYOILXWUKPTICS-CYBMUJFWSA-N -1 3 368.433 3.509 20 0 FHADHM C[C@@H]1CN(C)c2ccccc2N(C(=O)c2ccc3c(c2[O-])OC(C)(C)C3)C1 ZINC000436592495 944439301 /nfs/dbraw/zinc/43/93/01/944439301.db2.gz VZJWFVQLYMNBFZ-CQSZACIVSA-N -1 3 366.461 3.838 20 0 FHADHM O=C(NCc1nc2ccccc2[nH]1)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436596162 944441917 /nfs/dbraw/zinc/44/19/17/944441917.db2.gz ORPOJIFEXZVBDI-UHFFFAOYSA-N -1 3 357.413 3.789 20 0 FHADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CCC[C@H]2COCC[C@@H]21 ZINC000436587672 944449867 /nfs/dbraw/zinc/44/98/67/944449867.db2.gz QACPWNCKCUZAME-FPOVZHCZSA-N -1 3 365.473 3.819 20 0 FHADHM O=C(Nc1ccc(CCO)cc1)c1cc(OCc2ccccc2)ccc1[O-] ZINC000436588054 944450759 /nfs/dbraw/zinc/45/07/59/944450759.db2.gz ROIYFWCZEHKBMJ-UHFFFAOYSA-N -1 3 363.413 3.758 20 0 FHADHM Cc1nccn1CCCCNC(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436590093 944451160 /nfs/dbraw/zinc/45/11/60/944451160.db2.gz LZCHNIKHNQDNPH-UHFFFAOYSA-N -1 3 363.461 3.698 20 0 FHADHM Cn1c(=O)oc2c1cccc2NC(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436602475 944454246 /nfs/dbraw/zinc/45/42/46/944454246.db2.gz KEXIZXHVDQOPDP-UHFFFAOYSA-N -1 3 374.396 3.680 20 0 FHADHM Cc1ccc(C(=O)NCc2cccc(COCC(F)(F)F)c2)c([O-])c1 ZINC000436603642 944454790 /nfs/dbraw/zinc/45/47/90/944454790.db2.gz MJBJTBGCSYGMCN-UHFFFAOYSA-N -1 3 353.340 3.710 20 0 FHADHM CCOCCCn1c2ccccc2nc1NC(=O)c1cc(C)ccc1[O-] ZINC001143565659 944455637 /nfs/dbraw/zinc/45/56/37/944455637.db2.gz PKRIQMSDHJQZGG-UHFFFAOYSA-N -1 3 353.422 3.729 20 0 FHADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CC[C@@H]([C@@H]2CCOC2)C1 ZINC000436605618 944456383 /nfs/dbraw/zinc/45/63/83/944456383.db2.gz PJURFBFEUJQMBV-WOJBJXKFSA-N -1 3 365.473 3.676 20 0 FHADHM Cc1nc(C(=O)Nc2ccc([O-])c(-c3nc4ccccc4s3)c2)c[nH]1 ZINC000436606445 944457622 /nfs/dbraw/zinc/45/76/22/944457622.db2.gz MRGXTHFAROOCGM-UHFFFAOYSA-N -1 3 350.403 3.953 20 0 FHADHM CCNC(=O)Nc1cccc([N-]S(=O)(=O)c2ccc(C)cc2C)c1C ZINC000278833893 944461270 /nfs/dbraw/zinc/46/12/70/944461270.db2.gz ZDJVRJCZGWIKJM-UHFFFAOYSA-N -1 3 361.467 3.554 20 0 FHADHM COC(C)(C)CS(=O)(=O)[N-]c1cccc(OCc2ccc(F)cc2)c1 ZINC000439250496 944463046 /nfs/dbraw/zinc/46/30/46/944463046.db2.gz MKZSYTSKWHWYGE-UHFFFAOYSA-N -1 3 367.442 3.571 20 0 FHADHM COc1cc([C@@H](C)NC(=O)c2ccc(O)cc2[O-])ccc1OC1CCCC1 ZINC000436625734 944466824 /nfs/dbraw/zinc/46/68/24/944466824.db2.gz PDLGWTDBZZORSY-CYBMUJFWSA-N -1 3 371.433 3.919 20 0 FHADHM O=C(c1ccc(O)cc1[O-])N1CCC[C@@H]1c1nc2cc(Cl)ccc2[nH]1 ZINC000436626660 944467733 /nfs/dbraw/zinc/46/77/33/944467733.db2.gz PVXPSQSNKMPXOL-OAHLLOKOSA-N -1 3 357.797 3.605 20 0 FHADHM CCC(C)(C)N(C)C(=O)C[C@@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436623871 944479542 /nfs/dbraw/zinc/47/95/42/944479542.db2.gz HRURMPTVIBABHO-LJQANCHMSA-N -1 3 368.477 3.900 20 0 FHADHM O=C(N[C@H]1C[C@H](c2ccc(Br)cc2)C1)c1c([O-])cccc1O ZINC000436640211 944490331 /nfs/dbraw/zinc/49/03/31/944490331.db2.gz HJYUOJQNVBTJSC-AULYBMBSSA-N -1 3 362.223 3.536 20 0 FHADHM CC[C@H](c1nnc(NC(=O)c2c([O-])cccc2O)s1)c1ccccc1 ZINC000436646170 944495409 /nfs/dbraw/zinc/49/54/09/944495409.db2.gz FKDAIKJHLXVDEF-LBPRGKRZSA-N -1 3 355.419 3.744 20 0 FHADHM CCC(=O)c1ccc([O-])c(NC(=O)C2CCN(Cc3ccccc3)CC2)c1 ZINC000436646249 944495464 /nfs/dbraw/zinc/49/54/64/944495464.db2.gz GNPXFQFFXDOOOW-UHFFFAOYSA-N -1 3 366.461 3.836 20 0 FHADHM Fc1ccc(Oc2ccc(CNC3(c4nn[n-]n4)CCCC3)cc2)cc1 ZINC000517680151 944507811 /nfs/dbraw/zinc/50/78/11/944507811.db2.gz SMXZGDOZKLPSBB-UHFFFAOYSA-N -1 3 353.401 3.690 20 0 FHADHM Fc1ccc(Oc2ccc(CNC3(c4nnn[n-]4)CCCC3)cc2)cc1 ZINC000517680151 944507814 /nfs/dbraw/zinc/50/78/14/944507814.db2.gz SMXZGDOZKLPSBB-UHFFFAOYSA-N -1 3 353.401 3.690 20 0 FHADHM CCc1ccc(C(=O)N2CCC(N3CCc4cc(F)ccc43)CC2)c([O-])c1 ZINC000436657157 944509254 /nfs/dbraw/zinc/50/92/54/944509254.db2.gz IEJGCGUCGHBMRN-UHFFFAOYSA-N -1 3 368.452 3.761 20 0 FHADHM COC(=O)CCc1ccc(NC(=O)c2cc3c(cc2[O-])CCCC3)cc1 ZINC000436680020 944517686 /nfs/dbraw/zinc/51/76/86/944517686.db2.gz MTPHAUMTANXDPP-UHFFFAOYSA-N -1 3 353.418 3.629 20 0 FHADHM COc1cc(-c2nc(Cc3csc(C(C)C)n3)no2)cc(OC)c1[O-] ZINC000436690871 944529671 /nfs/dbraw/zinc/52/96/71/944529671.db2.gz RTVZOKYYOXPGLY-UHFFFAOYSA-N -1 3 361.423 3.630 20 0 FHADHM CCC[C@@H](C(=O)Nc1nc2c(cccc2C(=O)OC)[n-]1)c1ccccc1 ZINC000438358789 944530230 /nfs/dbraw/zinc/53/02/30/944530230.db2.gz QOBSDIUOSSSVIR-CQSZACIVSA-N -1 3 351.406 3.872 20 0 FHADHM CCOc1ccc(NC(=O)c2ccc3c(c2[O-])OC(C)(C)C3)cc1OC ZINC000436675906 944531181 /nfs/dbraw/zinc/53/11/81/944531181.db2.gz MWGHYVLJGOZHER-UHFFFAOYSA-N -1 3 357.406 3.765 20 0 FHADHM CCOCc1ccccc1-c1noc(-c2cc(OC)c([O-])c(OC)c2)n1 ZINC000436692839 944531245 /nfs/dbraw/zinc/53/12/45/944531245.db2.gz YLZPXGUUWCOIMD-UHFFFAOYSA-N -1 3 356.378 3.663 20 0 FHADHM Cc1cc2cc(CN3CCN(C(=O)c4ccc([O-])cc4)CC3)oc2cc1C ZINC000436694126 944532685 /nfs/dbraw/zinc/53/26/85/944532685.db2.gz FYTDXOVPTRATMJ-UHFFFAOYSA-N -1 3 364.445 3.713 20 0 FHADHM CCN(CC)[C@H](CNC(=O)c1ccc2ccccc2c1[O-])c1ccco1 ZINC000436695734 944535667 /nfs/dbraw/zinc/53/56/67/944535667.db2.gz FRWFYGJVSDZJAL-GOSISDBHSA-N -1 3 352.434 3.951 20 0 FHADHM Cc1ccc([C@@H](NCc2ccc(OCC(F)(F)F)c(F)c2)C(=O)[O-])cc1 ZINC000426670351 944540895 /nfs/dbraw/zinc/54/08/95/944540895.db2.gz FBLUQGFWOWUUHK-MRXNPFEDSA-N -1 3 371.330 3.991 20 0 FHADHM CSc1nc(NC(=O)c2cc(C3CC3)nc3c(C)cc(C)cc23)n[n-]1 ZINC000438370495 944541296 /nfs/dbraw/zinc/54/12/96/944541296.db2.gz CNASGJQNAORVRL-UHFFFAOYSA-N -1 3 353.451 3.821 20 0 FHADHM CCOCCOc1ccc(Cl)cc1NC(=O)c1cc(OC)ccc1[O-] ZINC000436701498 944541840 /nfs/dbraw/zinc/54/18/40/944541840.db2.gz ARMDBJZRDJRVPB-UHFFFAOYSA-N -1 3 365.813 3.722 20 0 FHADHM COC(=O)c1cccc2[n-]c(NC(=O)c3ccc(Cl)c(Cl)c3)nc21 ZINC000438354914 944543814 /nfs/dbraw/zinc/54/38/14/944543814.db2.gz QKXSDSRQQOMECW-UHFFFAOYSA-N -1 3 364.188 3.909 20 0 FHADHM O=C(N[C@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1)c1ccccc1[O-] ZINC000436704485 944544291 /nfs/dbraw/zinc/54/42/91/944544291.db2.gz JSTAOFQWSGNDEC-SFHVURJKSA-N -1 3 365.351 3.543 20 0 FHADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1CCC[C@H]1[C@@H]1CCCO1 ZINC000436711424 944551837 /nfs/dbraw/zinc/55/18/37/944551837.db2.gz HSNIUEXGVOURJA-ICSRJNTNSA-N -1 3 353.418 3.968 20 0 FHADHM Cc1ccc(C(=O)N2CCN(c3cccc4cnccc43)C[C@@H]2C)c([O-])c1 ZINC000436714036 944552707 /nfs/dbraw/zinc/55/27/07/944552707.db2.gz DWJCOJKLUQTHMK-INIZCTEOSA-N -1 3 361.445 3.600 20 0 FHADHM COc1cccc(N2CC[C@@H](NC(=O)c3ccc(C(C)C)cc3[O-])C2)c1 ZINC000436720979 944559269 /nfs/dbraw/zinc/55/92/69/944559269.db2.gz KQFNILYYUSHRJZ-MRXNPFEDSA-N -1 3 354.450 3.533 20 0 FHADHM CCOC(=O)C(C)(C)c1csc(NC(=O)c2cc(CC)ccc2[O-])n1 ZINC000436734479 944564666 /nfs/dbraw/zinc/56/46/66/944564666.db2.gz ATKNUQBTXYVGDY-UHFFFAOYSA-N -1 3 362.451 3.504 20 0 FHADHM CCN(C[C@H]1CCCO1)C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436738490 944568113 /nfs/dbraw/zinc/56/81/13/944568113.db2.gz LTQPMYMXUVTRIZ-LJQANCHMSA-N -1 3 353.462 3.819 20 0 FHADHM Cc1cccc(C(=O)Nc2ccc(C)c(C(=O)N3CCCCC3)c2)c1[O-] ZINC000436729960 944576095 /nfs/dbraw/zinc/57/60/95/944576095.db2.gz USCKEAGVEYTUIX-UHFFFAOYSA-N -1 3 352.434 3.887 20 0 FHADHM COc1cccc(C(=O)Nc2nc(-c3ccc(SC)cc3)ns2)c1[O-] ZINC000440473863 944597441 /nfs/dbraw/zinc/59/74/41/944597441.db2.gz ZLHUABQKLURXLA-UHFFFAOYSA-N -1 3 373.459 3.894 20 0 FHADHM CC(C)C(=O)Nc1ccc(NC(=O)c2ccc3c(c2[O-])OC(C)(C)C3)cc1 ZINC000436777829 944608579 /nfs/dbraw/zinc/60/85/79/944608579.db2.gz ZZWWXSCZBXLLQP-UHFFFAOYSA-N -1 3 368.433 3.953 20 0 FHADHM CCCOc1cn(-c2ccccc2)nc1C(=O)Nc1cc(F)ccc1[O-] ZINC000436798406 944622358 /nfs/dbraw/zinc/62/23/58/944622358.db2.gz TUQCGIDLZOPENU-UHFFFAOYSA-N -1 3 355.369 3.758 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N(CCc2ccccc2)CC(C)C)c1 ZINC000436782308 944626920 /nfs/dbraw/zinc/62/69/20/944626920.db2.gz NISCWGHXHABNNK-UHFFFAOYSA-N -1 3 354.450 3.692 20 0 FHADHM Cc1nn(C)c2nc(C3CC3)cc(C(=O)Nc3cc(Cl)ccc3[O-])c12 ZINC000436786114 944630602 /nfs/dbraw/zinc/63/06/02/944630602.db2.gz RQIDPVMCHOUODI-UHFFFAOYSA-N -1 3 356.813 3.765 20 0 FHADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1C[C@@]2(CCCO2)[C@H]1C1CC1 ZINC000436785672 944631585 /nfs/dbraw/zinc/63/15/85/944631585.db2.gz PZXFYBNCWOACGV-GGAORHGYSA-N -1 3 363.457 3.767 20 0 FHADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1C[C@@]2(CCCO2)[C@@H]1C1CC1 ZINC000436785674 944631817 /nfs/dbraw/zinc/63/18/17/944631817.db2.gz PZXFYBNCWOACGV-GMAHTHKFSA-N -1 3 363.457 3.767 20 0 FHADHM CC(C)[C@H](Oc1ccc(Cl)cc1)C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000485641962 944634906 /nfs/dbraw/zinc/63/49/06/944634906.db2.gz GVBSFEMYGGFJFW-INIZCTEOSA-N -1 3 371.828 3.562 20 0 FHADHM CC(C)[C@H](Oc1ccc(Cl)cc1)C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000485641962 944634908 /nfs/dbraw/zinc/63/49/08/944634908.db2.gz GVBSFEMYGGFJFW-INIZCTEOSA-N -1 3 371.828 3.562 20 0 FHADHM Cc1ccc(C(=O)NCc2cccc(NC(=O)c3ccccc3)c2)c([O-])c1 ZINC000436787459 944636122 /nfs/dbraw/zinc/63/61/22/944636122.db2.gz OTOGATQYXBVPGT-UHFFFAOYSA-N -1 3 360.413 3.883 20 0 FHADHM C[C@H]1C[C@H](CC(=O)N2CCN(C(=O)c3ccc([O-])cc3)CC2)CC(C)(C)C1 ZINC000436790637 944641027 /nfs/dbraw/zinc/64/10/27/944641027.db2.gz HDIOLRUGDIVSRS-DLBZAZTESA-N -1 3 372.509 3.529 20 0 FHADHM CCOc1cc(-c2nc3ccc(C(=O)OC)cc3n2C)cc(Cl)c1[O-] ZINC000436815565 944651391 /nfs/dbraw/zinc/65/13/91/944651391.db2.gz LMSCEURTQBQJAV-UHFFFAOYSA-N -1 3 360.797 3.785 20 0 FHADHM CC(C)(C)[C@H]1OCCC[C@H]1CNC(=O)CCCc1ccc([O-])c(F)c1 ZINC000469396016 944656376 /nfs/dbraw/zinc/65/63/76/944656376.db2.gz RREURFWTLVOTCP-KXBFYZLASA-N -1 3 351.462 3.812 20 0 FHADHM C[C@H](O)C[C@@H]1CCCCN1C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436807325 944663890 /nfs/dbraw/zinc/66/38/90/944663890.db2.gz XNQADXWIJHJKDP-LPHOPBHVSA-N -1 3 353.462 3.749 20 0 FHADHM CCc1ccc(C(=O)N2CCC[C@H]2c2ccc3c(c2)OCCO3)c([O-])c1 ZINC000436811847 944667298 /nfs/dbraw/zinc/66/72/98/944667298.db2.gz KWXTTWXLPKBGNL-KRWDZBQOSA-N -1 3 353.418 3.703 20 0 FHADHM O=C(N=c1cc([C@H]2CCCO2)[n-][nH]1)c1cc(-c2ccccn2)ccc1Cl ZINC000473848101 944672274 /nfs/dbraw/zinc/67/22/74/944672274.db2.gz GLDYLZJEFPZTJS-QGZVFWFLSA-N -1 3 368.824 3.651 20 0 FHADHM CN(C(=O)C[C@H](NC(=O)c1ccc([O-])cc1)c1ccccc1)[C@H]1CC1(C)C ZINC000436815930 944673497 /nfs/dbraw/zinc/67/34/97/944673497.db2.gz QJFHWNNVYVIYFQ-OALUTQOASA-N -1 3 366.461 3.510 20 0 FHADHM CCc1ccc(C(=O)NC2(c3ccc(F)cc3F)CCOCC2)c([O-])c1 ZINC000436829814 944675740 /nfs/dbraw/zinc/67/57/40/944675740.db2.gz MUZOSQJPTDTKIF-UHFFFAOYSA-N -1 3 361.388 3.669 20 0 FHADHM CCc1ccc(C(=O)N2CC[C@@H](OCCCc3ccccc3)C2)c([O-])c1 ZINC000436833216 944678588 /nfs/dbraw/zinc/67/85/88/944678588.db2.gz UTQZXKQYTFGEMD-LJQANCHMSA-N -1 3 353.462 3.819 20 0 FHADHM Cc1nc(CCCNCc2csc(-c3ccccc3)n2)sc1C(=O)[O-] ZINC000426683541 944680721 /nfs/dbraw/zinc/68/07/21/944680721.db2.gz SSVBCNBFKYSOSM-UHFFFAOYSA-N -1 3 373.503 3.996 20 0 FHADHM CCc1ccc(C(=O)Nc2cccn(Cc3ccc(F)cc3)c2=O)c([O-])c1 ZINC000436834553 944682794 /nfs/dbraw/zinc/68/27/94/944682794.db2.gz ZWWNTOUJQCBTDL-UHFFFAOYSA-N -1 3 366.392 3.556 20 0 FHADHM CCc1ccc(C(=O)N[C@@H](C)c2nc(-c3cccc(F)c3)no2)c([O-])c1 ZINC000436835189 944682915 /nfs/dbraw/zinc/68/29/15/944682915.db2.gz UOUSWMSUWLHPEH-NSHDSACASA-N -1 3 355.369 3.635 20 0 FHADHM CCc1ccc(C(=O)N2CCC[C@@H]2c2cccc3c2OCCO3)c([O-])c1 ZINC000436822795 944692077 /nfs/dbraw/zinc/69/20/77/944692077.db2.gz XDHNUKVVZMIUTO-QGZVFWFLSA-N -1 3 353.418 3.703 20 0 FHADHM COc1ccc(CN[C@@H](C(=O)[O-])c2ccc(C)cc2)cc1Br ZINC000426678362 944692267 /nfs/dbraw/zinc/69/22/67/944692267.db2.gz PXEOLTCXTOIYEU-MRXNPFEDSA-N -1 3 364.239 3.682 20 0 FHADHM COc1ccc(CN[C@H](C(=O)[O-])c2ccc(C)cc2)cc1Br ZINC000426678361 944692464 /nfs/dbraw/zinc/69/24/64/944692464.db2.gz PXEOLTCXTOIYEU-INIZCTEOSA-N -1 3 364.239 3.682 20 0 FHADHM CC[C@H]1CN(C(=O)c2cc(CCc3ccccc3)ccc2[O-])C[C@@H](C)O1 ZINC000436847799 944714991 /nfs/dbraw/zinc/71/49/91/944714991.db2.gz LSCKUWJLHQJBHL-APWZRJJASA-N -1 3 353.462 3.817 20 0 FHADHM CC[C@@H](c1ccc(Cl)cc1)N1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436848911 944717141 /nfs/dbraw/zinc/71/71/41/944717141.db2.gz XJDDGEAFNZUPBQ-SFHVURJKSA-N -1 3 358.869 3.955 20 0 FHADHM Cc1cc(C(=O)Nc2cc(Br)ccc2[O-])nn1[C@@H](C)C1CC1 ZINC000436871724 944738949 /nfs/dbraw/zinc/73/89/49/944738949.db2.gz KQFICCJZDNOPDU-JTQLQIEISA-N -1 3 364.243 3.883 20 0 FHADHM COc1ccc(CN[C@H](C(=O)[O-])c2cccc(C)c2C)cc1OC(F)F ZINC000426732461 944742777 /nfs/dbraw/zinc/74/27/77/944742777.db2.gz INXMYPNGBUCAGC-KRWDZBQOSA-N -1 3 365.376 3.829 20 0 FHADHM CSc1nc(=O)[n-]c(C)c1C(=O)Nc1ccc(-c2ccccc2)c(C)n1 ZINC000426738089 944748895 /nfs/dbraw/zinc/74/88/95/944748895.db2.gz SSHPZCQZYCTGMF-UHFFFAOYSA-N -1 3 366.446 3.835 20 0 FHADHM Cc1cccc([C@@H](NCc2cnn(Cc3ccc(F)cc3)c2)C(=O)[O-])c1C ZINC000426737680 944749787 /nfs/dbraw/zinc/74/97/87/944749787.db2.gz PCTZTSWFCRRDOI-HXUWFJFHSA-N -1 3 367.424 3.603 20 0 FHADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1C[C@@H](CO)c2ccccc21 ZINC000436884808 944758964 /nfs/dbraw/zinc/75/89/64/944758964.db2.gz DJAYTSHXUHGSPD-HNNXBMFYSA-N -1 3 361.397 3.921 20 0 FHADHM CSc1cc2c(cc1CN[C@H](C(=O)[O-])c1cc(C)cc(C)c1)OCCO2 ZINC000426764250 944763499 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CS[C@@H]1CCC[C@H]([N-]S(=O)(=O)c2cc(Cl)ccc2Cl)C1 ZINC000609768991 946915285 /nfs/dbraw/zinc/91/52/85/946915285.db2.gz NHERBPXQGARRAO-WDEREUQCSA-N -1 3 354.324 3.946 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NC3CC4(C3)COC(C)(C)C4)nc2)n1 ZINC000897216834 946932215 /nfs/dbraw/zinc/93/22/15/946932215.db2.gz VVDHITMNIGBIOH-UHFFFAOYSA-N -1 3 354.454 3.566 20 0 FHADHM CC[C@@H](C)[C@@H]([N-]S(=O)(=O)c1cccc2cc(C)cnc21)C(F)(F)F ZINC001211677617 946933040 /nfs/dbraw/zinc/93/30/40/946933040.db2.gz MMSNGDWHMGAVIF-IAQYHMDHSA-N -1 3 360.401 3.799 20 0 FHADHM CC[C@H](C)[C@@H]([N-]S(=O)(=O)c1cc(Cl)c(OC)cc1C)C(F)(F)F ZINC001211677538 946933141 /nfs/dbraw/zinc/93/31/41/946933141.db2.gz JNARTPSFDVBGJX-ISVAXAHUSA-N -1 3 373.824 3.912 20 0 FHADHM CC(C)[C@@H](CNC(=O)c1ccc([O-])c(Cl)c1)N1CCc2ccccc2C1 ZINC000025534894 947033072 /nfs/dbraw/zinc/03/30/72/947033072.db2.gz OWLJUYJAYXYTOC-LJQANCHMSA-N -1 3 372.896 3.858 20 0 FHADHM CN(Cc1c(Br)cccc1C(=O)[O-])C1Cc2ccccc2C1 ZINC000652400406 947034206 /nfs/dbraw/zinc/03/42/06/947034206.db2.gz UJTPGKXPHNCUOO-UHFFFAOYSA-N -1 3 360.251 3.747 20 0 FHADHM O=C([O-])c1cccc(Br)c1CN1CCC([C@H]2CCCO2)CC1 ZINC000652416206 947073210 /nfs/dbraw/zinc/07/32/10/947073210.db2.gz QEMYWKWWBINDFV-MRXNPFEDSA-N -1 3 368.271 3.538 20 0 FHADHM CCC(CC)n1nc(C)cc1C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825113555 947080566 /nfs/dbraw/zinc/08/05/66/947080566.db2.gz AYRVGAVNWATABT-ZDUSSCGKSA-N -1 3 368.441 3.651 20 0 FHADHM CCC(CC)n1nc(C)cc1C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825113555 947080575 /nfs/dbraw/zinc/08/05/75/947080575.db2.gz AYRVGAVNWATABT-ZDUSSCGKSA-N -1 3 368.441 3.651 20 0 FHADHM CN(CCc1cccs1)Cc1c(Br)cccc1C(=O)[O-] ZINC000652428124 947089276 /nfs/dbraw/zinc/08/92/76/947089276.db2.gz MJCXWBPLVLNKAV-UHFFFAOYSA-N -1 3 354.269 3.883 20 0 FHADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)c3ccc(-c4cnco4)cc3)cc2)n1 ZINC000523033441 947098771 /nfs/dbraw/zinc/09/87/71/947098771.db2.gz BPEKYRLRMOXIDQ-UHFFFAOYSA-N -1 3 372.384 3.653 20 0 FHADHM Cc1cc(C)cc(-c2cc(=NC(=O)[C@@H]3CCC(=O)[C@H](C)C3(C)C)[nH][n-]2)c1 ZINC000444703962 947130391 /nfs/dbraw/zinc/13/03/91/947130391.db2.gz KQJZVOURLUKIQC-HOCLYGCPSA-N -1 3 353.466 3.695 20 0 FHADHM O=C([O-])[C@@H]1CN(CCOc2ccccc2C(F)(F)F)Cc2ccccc21 ZINC000652471162 947197874 /nfs/dbraw/zinc/19/78/74/947197874.db2.gz VRXNQVHLBPUYHN-OAHLLOKOSA-N -1 3 365.351 3.768 20 0 FHADHM O=C([O-])C1(O)CCN(Cc2cccc(Oc3ccc(Cl)cc3)c2)CC1 ZINC000652483616 947215929 /nfs/dbraw/zinc/21/59/29/947215929.db2.gz QLYXUBLIJDDWME-UHFFFAOYSA-N -1 3 361.825 3.544 20 0 FHADHM O=C([O-])CCCN(Cc1ccccc1)Cc1ncccc1C(F)(F)F ZINC000652494612 947227756 /nfs/dbraw/zinc/22/77/56/947227756.db2.gz SJIFXSBZKDHQEH-UHFFFAOYSA-N -1 3 352.356 3.967 20 0 FHADHM O=S(=O)([N-][C@@H]1C[C@H]1c1ccc(F)cc1)c1cc(Cl)ccc1Cl ZINC001211683409 947227918 /nfs/dbraw/zinc/22/79/18/947227918.db2.gz CEFCHYOWRBVDHL-GXTWGEPZSA-N -1 3 360.237 3.967 20 0 FHADHM Cc1ccc(-c2nc([C@H]3CN(Cc4ccccc4)C[C@@H](C)O3)no2)c([O-])c1 ZINC000665003699 947228880 /nfs/dbraw/zinc/22/88/80/947228880.db2.gz JLPQJTDHOFMPIO-DNVCBOLYSA-N -1 3 365.433 3.713 20 0 FHADHM CC[C@H]1[C@@H](C)CCN1C(=O)c1c[n-]c2ccc(Br)cc2c1=O ZINC000444363263 947229458 /nfs/dbraw/zinc/22/94/58/947229458.db2.gz IVKVWRDGIUBMKS-BONVTDFDSA-N -1 3 363.255 3.551 20 0 FHADHM Cc1c(C)c(C)c(S(=O)(=O)[N-]c2cccc([S@](C)=O)c2)c(C)c1C ZINC000330685445 947233519 /nfs/dbraw/zinc/23/35/19/947233519.db2.gz ULIISYWVSPEFRX-QHCPKHFHSA-N -1 3 365.520 3.767 20 0 FHADHM Cc1c(C)c(C)c(S(=O)(=O)[N-]c2cccc([S@@](C)=O)c2)c(C)c1C ZINC000330685444 947234034 /nfs/dbraw/zinc/23/40/34/947234034.db2.gz ULIISYWVSPEFRX-HSZRJFAPSA-N -1 3 365.520 3.767 20 0 FHADHM O=C(NCc1ccc([O-])c(F)c1)[C@H]1C[C@H]1c1ccccc1C(F)(F)F ZINC000523424954 947235976 /nfs/dbraw/zinc/23/59/76/947235976.db2.gz XPVWYAGIBWQWIQ-STQMWFEESA-N -1 3 353.315 3.970 20 0 FHADHM COc1ccc(-c2noc([C@@H](C)N3CCC[C@H](C(C)(C)C(=O)[O-])C3)n2)cc1 ZINC000652498644 947247756 /nfs/dbraw/zinc/24/77/56/947247756.db2.gz OSTNLYKZZBGRNJ-HIFRSBDPSA-N -1 3 373.453 3.629 20 0 FHADHM Cc1nc(C(C)C)sc1C(=O)Nc1ccc(-c2nc(C)cc(=O)[n-]2)cc1 ZINC000523419950 947250564 /nfs/dbraw/zinc/25/05/64/947250564.db2.gz KRDGTDJHULDPQD-UHFFFAOYSA-N -1 3 368.462 3.886 20 0 FHADHM C[C@@H](Oc1cc(Cl)cc(Cl)c1)C(=O)NCc1ccc([O-])c(F)c1 ZINC000523423916 947255476 /nfs/dbraw/zinc/25/54/76/947255476.db2.gz QWURFPKZKHFHEO-SECBINFHSA-N -1 3 358.196 3.922 20 0 FHADHM CCS[C@H]1CCCCN(c2ccc(-c3nc(CC)cc(=O)[n-]3)cn2)C1 ZINC000301268771 947260846 /nfs/dbraw/zinc/26/08/46/947260846.db2.gz XBLXEPWAXPLDEM-INIZCTEOSA-N -1 3 358.511 3.919 20 0 FHADHM COc1cccc(Sc2nc3c(cnn3-c3ccccc3)c(=O)[n-]2)c1 ZINC000301352019 947302557 /nfs/dbraw/zinc/30/25/57/947302557.db2.gz NAQXTGCJAJSGEX-UHFFFAOYSA-N -1 3 350.403 3.681 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@H](OC)c3ccccc3)nc2)n1 ZINC000301381021 947318446 /nfs/dbraw/zinc/31/84/46/947318446.db2.gz UIPPIVALQWEZOW-KRWDZBQOSA-N -1 3 350.422 3.606 20 0 FHADHM CN(C(=O)CCCc1ccsc1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000825817115 947340199 /nfs/dbraw/zinc/34/01/99/947340199.db2.gz BGANAIIRKPSAIF-UHFFFAOYSA-N -1 3 361.858 3.567 20 0 FHADHM CN(C(=O)CCCc1ccsc1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000825817115 947340214 /nfs/dbraw/zinc/34/02/14/947340214.db2.gz BGANAIIRKPSAIF-UHFFFAOYSA-N -1 3 361.858 3.567 20 0 FHADHM CN(C)c1ccc(C(F)(F)F)cc1NCc1ccc(-c2nnn[n-]2)cc1 ZINC000825875315 947352916 /nfs/dbraw/zinc/35/29/16/947352916.db2.gz JXIMYMBSABBERV-UHFFFAOYSA-N -1 3 362.359 3.564 20 0 FHADHM CN(C)c1ccc(C(F)(F)F)cc1NCc1ccc(-c2nn[n-]n2)cc1 ZINC000825875315 947352928 /nfs/dbraw/zinc/35/29/28/947352928.db2.gz JXIMYMBSABBERV-UHFFFAOYSA-N -1 3 362.359 3.564 20 0 FHADHM CC[C@H](CC1CCCCC1)C(=O)Nc1ccccc1[N-]S(C)(=O)=O ZINC000331349570 947402225 /nfs/dbraw/zinc/40/22/25/947402225.db2.gz NLTSRIUQPVKPHA-OAHLLOKOSA-N -1 3 352.500 3.993 20 0 FHADHM CC(C)CO[C@@H](C)c1noc(CN(C)Cc2cc(Cl)ccc2[O-])n1 ZINC000093885733 947498684 /nfs/dbraw/zinc/49/86/84/947498684.db2.gz VNQKNPKZEMGSRR-LBPRGKRZSA-N -1 3 353.850 3.794 20 0 FHADHM [O-]c1cccc(CN2CCC(n3cc(Br)cn3)CC2)c1Cl ZINC000508518932 947499728 /nfs/dbraw/zinc/49/97/28/947499728.db2.gz RIFGYMHKAJTITJ-UHFFFAOYSA-N -1 3 370.678 3.842 20 0 FHADHM O=S(=O)([N-]CCOc1c(Cl)cc(Cl)cc1Cl)c1ccco1 ZINC000188751441 947523504 /nfs/dbraw/zinc/52/35/04/947523504.db2.gz UZURABHSGWROOE-UHFFFAOYSA-N -1 3 370.641 3.597 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CNc1ccccc1OC1CCCC1 ZINC000826170948 947535279 /nfs/dbraw/zinc/53/52/79/947535279.db2.gz WMLMRXDKQKXDDQ-UHFFFAOYSA-N -1 3 365.437 3.809 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CNc1ccccc1OC1CCCC1 ZINC000826170948 947535284 /nfs/dbraw/zinc/53/52/84/947535284.db2.gz WMLMRXDKQKXDDQ-UHFFFAOYSA-N -1 3 365.437 3.809 20 0 FHADHM CCc1ccc(C(=O)N2CCC[C@H]2c2ccc(OC)c(OC)c2)c([O-])c1 ZINC000188912864 947551147 /nfs/dbraw/zinc/55/11/47/947551147.db2.gz HBVOYYCXNVKWIM-KRWDZBQOSA-N -1 3 355.434 3.949 20 0 FHADHM O=S(=O)([N-]CCC[C@@H]1CCCC[C@@H]1O)c1c(Cl)cccc1Cl ZINC000127727992 947564813 /nfs/dbraw/zinc/56/48/13/947564813.db2.gz DZFPKGDQBPZAOH-FZMZJTMJSA-N -1 3 366.310 3.603 20 0 FHADHM COc1cc(CN[C@@H](C(=O)[O-])c2cccc(C(F)(F)F)c2)ccc1C ZINC000663263005 947592512 /nfs/dbraw/zinc/59/25/12/947592512.db2.gz XGUDRMCDBIAIHP-MRXNPFEDSA-N -1 3 353.340 3.938 20 0 FHADHM COc1ccc(Oc2ccc(NCc3cccc(-c4nnn[n-]4)c3)cn2)cc1 ZINC000826211416 947618040 /nfs/dbraw/zinc/61/80/40/947618040.db2.gz BULZYMNMUXRYDW-UHFFFAOYSA-N -1 3 374.404 3.675 20 0 FHADHM COc1ccc(Oc2ccc(NCc3cccc(-c4nn[n-]n4)c3)cn2)cc1 ZINC000826211416 947618045 /nfs/dbraw/zinc/61/80/45/947618045.db2.gz BULZYMNMUXRYDW-UHFFFAOYSA-N -1 3 374.404 3.675 20 0 FHADHM CC(C)(C)OCc1cccc(C[N-]S(=O)(=O)c2c(F)cccc2F)c1 ZINC000523825558 947643914 /nfs/dbraw/zinc/64/39/14/947643914.db2.gz HIXZKSMWQPIQNS-UHFFFAOYSA-N -1 3 369.433 3.758 20 0 FHADHM CC(=CC(=O)N(c1ccccc1-c1nnn[n-]1)C1CCC1)c1cccs1 ZINC001573361510 947690167 /nfs/dbraw/zinc/69/01/67/947690167.db2.gz AKPQELITHJMJSW-OUKQBFOZSA-N -1 3 365.462 3.917 20 0 FHADHM CC(=CC(=O)N(c1ccccc1-c1nn[n-]n1)C1CCC1)c1cccs1 ZINC001573361510 947690171 /nfs/dbraw/zinc/69/01/71/947690171.db2.gz AKPQELITHJMJSW-OUKQBFOZSA-N -1 3 365.462 3.917 20 0 FHADHM CC(=CC(=O)Nc1nc(C)cc(C)c1-c1nnn[n-]1)c1cccc(Cl)c1 ZINC001573361801 947696130 /nfs/dbraw/zinc/69/61/30/947696130.db2.gz DZFXHKVFMDMIRY-NTMALXAHSA-N -1 3 368.828 3.574 20 0 FHADHM CC(=CC(=O)Nc1nc(C)cc(C)c1-c1nn[n-]n1)c1cccc(Cl)c1 ZINC001573361801 947696134 /nfs/dbraw/zinc/69/61/34/947696134.db2.gz DZFXHKVFMDMIRY-NTMALXAHSA-N -1 3 368.828 3.574 20 0 FHADHM CC(=CC(=O)N(c1ccc(-c2nnn[n-]2)cc1)C1CCC1)c1cccs1 ZINC001573362025 947698958 /nfs/dbraw/zinc/69/89/58/947698958.db2.gz HGGGVNDUVAGXLS-SEYXRHQNSA-N -1 3 365.462 3.917 20 0 FHADHM CC(=CC(=O)N(c1ccc(-c2nn[n-]n2)cc1)C1CCC1)c1cccs1 ZINC001573362025 947698966 /nfs/dbraw/zinc/69/89/66/947698966.db2.gz HGGGVNDUVAGXLS-SEYXRHQNSA-N -1 3 365.462 3.917 20 0 FHADHM Cc1c(N[C@H]2CCCc3cc(-c4nnn[n-]4)ccc32)cnn1-c1ccccc1 ZINC000826242294 947719361 /nfs/dbraw/zinc/71/93/61/947719361.db2.gz IYXPVJSCRQHSJU-IBGZPJMESA-N -1 3 371.448 3.850 20 0 FHADHM Cc1c(N[C@H]2CCCc3cc(-c4nn[n-]n4)ccc32)cnn1-c1ccccc1 ZINC000826242294 947719369 /nfs/dbraw/zinc/71/93/69/947719369.db2.gz IYXPVJSCRQHSJU-IBGZPJMESA-N -1 3 371.448 3.850 20 0 FHADHM Cc1nc(C(C)C)sc1[C@@H](C)OC(=O)c1ccc(-c2nnn[n-]2)cc1C ZINC000826251042 947729472 /nfs/dbraw/zinc/72/94/72/947729472.db2.gz CPKMZQQGIANPGX-GFCCVEGCSA-N -1 3 371.466 3.981 20 0 FHADHM Cc1nc(C(C)C)sc1[C@@H](C)OC(=O)c1ccc(-c2nn[n-]n2)cc1C ZINC000826251042 947729478 /nfs/dbraw/zinc/72/94/78/947729478.db2.gz CPKMZQQGIANPGX-GFCCVEGCSA-N -1 3 371.466 3.981 20 0 FHADHM C/C(=C/C1CCC(C)CC1)C(=O)N(C)c1ccc(-c2nnn[n-]2)cc1F ZINC001573366860 947747952 /nfs/dbraw/zinc/74/79/52/947747952.db2.gz ULWMYLPIHKOIAI-RAXLEYEMSA-N -1 3 357.433 3.741 20 0 FHADHM C/C(=C/C1CCC(C)CC1)C(=O)N(C)c1ccc(-c2nn[n-]n2)cc1F ZINC001573366860 947747958 /nfs/dbraw/zinc/74/79/58/947747958.db2.gz ULWMYLPIHKOIAI-RAXLEYEMSA-N -1 3 357.433 3.741 20 0 FHADHM C/C(=C\C1CCC(C)CC1)C(=O)N(C)c1ccc(-c2nnn[n-]2)cc1F ZINC001573366857 947748620 /nfs/dbraw/zinc/74/86/20/947748620.db2.gz ULWMYLPIHKOIAI-JLHYYAGUSA-N -1 3 357.433 3.741 20 0 FHADHM C/C(=C\C1CCC(C)CC1)C(=O)N(C)c1ccc(-c2nn[n-]n2)cc1F ZINC001573366857 947748627 /nfs/dbraw/zinc/74/86/27/947748627.db2.gz ULWMYLPIHKOIAI-JLHYYAGUSA-N -1 3 357.433 3.741 20 0 FHADHM C/C(=C/C1CCC(C)CC1)C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC001573367188 947756062 /nfs/dbraw/zinc/75/60/62/947756062.db2.gz YOXKOCUDEXKGSP-HHCFLCGASA-N -1 3 353.470 3.817 20 0 FHADHM C/C(=C/C1CCC(C)CC1)C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC001573367188 947756072 /nfs/dbraw/zinc/75/60/72/947756072.db2.gz YOXKOCUDEXKGSP-HHCFLCGASA-N -1 3 353.470 3.817 20 0 FHADHM CCN(Cc1c[nH]c2ccccc12)C(=O)c1cc(OC)c([O-])c(OC)c1 ZINC000189566008 947767281 /nfs/dbraw/zinc/76/72/81/947767281.db2.gz BYALCJIHBRLRBH-UHFFFAOYSA-N -1 3 354.406 3.553 20 0 FHADHM Cc1ccc(C(=O)NC2(c3cccc(-c4nnn[n-]4)c3)CC2)c(Cl)c1C ZINC000826281610 947807859 /nfs/dbraw/zinc/80/78/59/947807859.db2.gz BMIBYALKKLUUAD-UHFFFAOYSA-N -1 3 367.840 3.556 20 0 FHADHM Cc1ccc(C(=O)NC2(c3cccc(-c4nn[n-]n4)c3)CC2)c(Cl)c1C ZINC000826281610 947807870 /nfs/dbraw/zinc/80/78/70/947807870.db2.gz BMIBYALKKLUUAD-UHFFFAOYSA-N -1 3 367.840 3.556 20 0 FHADHM Cc1ccc(C2CCN(c3ccc(Cl)cc3-c3nnn[n-]3)CC2)cn1 ZINC000826285846 947824401 /nfs/dbraw/zinc/82/44/01/947824401.db2.gz LKRYUEVLTUUMPC-UHFFFAOYSA-N -1 3 354.845 3.608 20 0 FHADHM Cc1ccc(C2CCN(c3ccc(Cl)cc3-c3nn[n-]n3)CC2)cn1 ZINC000826285846 947824417 /nfs/dbraw/zinc/82/44/17/947824417.db2.gz LKRYUEVLTUUMPC-UHFFFAOYSA-N -1 3 354.845 3.608 20 0 FHADHM Cc1ccc([C@H]2CCN(c3ccc4cc(-c5nnn[n-]5)ccc4n3)C2)cc1 ZINC000826286011 947824524 /nfs/dbraw/zinc/82/45/24/947824524.db2.gz PWJJJEWCRBGIJB-SFHVURJKSA-N -1 3 356.433 3.717 20 0 FHADHM Cc1ccc([C@H]2CCN(c3ccc4cc(-c5nn[n-]n5)ccc4n3)C2)cc1 ZINC000826286011 947824533 /nfs/dbraw/zinc/82/45/33/947824533.db2.gz PWJJJEWCRBGIJB-SFHVURJKSA-N -1 3 356.433 3.717 20 0 FHADHM Cc1ccc(CNc2ccn(-c3ccc(-c4nn[n-]n4)cc3Cl)n2)cc1 ZINC000826288394 947839441 /nfs/dbraw/zinc/83/94/41/947839441.db2.gz FLQFCZJTDQKLOM-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM CC[C@H](c1nnc([N-]C(=O)c2cn(C(C)C)nn2)s1)c1ccccc1 ZINC000550412884 947869226 /nfs/dbraw/zinc/86/92/26/947869226.db2.gz VEZCQIPFEICKJT-ZDUSSCGKSA-N -1 3 356.455 3.505 20 0 FHADHM Cc1ccccc1[C@@H]1CCN(c2ncc(Cl)c(C)c2-c2nnn[n-]2)C1 ZINC000826307112 947882245 /nfs/dbraw/zinc/88/22/45/947882245.db2.gz WWBZMRRVEVHFBX-CYBMUJFWSA-N -1 3 354.845 3.526 20 0 FHADHM Cc1ccccc1[C@@H]1CCN(c2ncc(Cl)c(C)c2-c2nn[n-]n2)C1 ZINC000826307112 947882253 /nfs/dbraw/zinc/88/22/53/947882253.db2.gz WWBZMRRVEVHFBX-CYBMUJFWSA-N -1 3 354.845 3.526 20 0 FHADHM Cc1nc(C(=O)Oc2ccc(-c3nnn[n-]3)cc2)c(-c2ccccc2)s1 ZINC000826323392 947945632 /nfs/dbraw/zinc/94/56/32/947945632.db2.gz CHMJXRJBQLCUJZ-UHFFFAOYSA-N -1 3 363.402 3.518 20 0 FHADHM Cc1nc(C(=O)Oc2ccc(-c3nn[n-]n3)cc2)c(-c2ccccc2)s1 ZINC000826323392 947945634 /nfs/dbraw/zinc/94/56/34/947945634.db2.gz CHMJXRJBQLCUJZ-UHFFFAOYSA-N -1 3 363.402 3.518 20 0 FHADHM Cc1nc(C)c(F)c(Sc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)n1 ZINC000826324300 947948456 /nfs/dbraw/zinc/94/84/56/947948456.db2.gz LPVQNZFLTOAUBE-UHFFFAOYSA-N -1 3 370.335 3.583 20 0 FHADHM Cc1nc(C)c(F)c(Sc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)n1 ZINC000826324300 947948460 /nfs/dbraw/zinc/94/84/60/947948460.db2.gz LPVQNZFLTOAUBE-UHFFFAOYSA-N -1 3 370.335 3.583 20 0 FHADHM Cc1nscc1C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCCCC2 ZINC000826340136 947977483 /nfs/dbraw/zinc/97/74/83/947977483.db2.gz JECWFHYAQCSJTG-UHFFFAOYSA-N -1 3 374.495 3.604 20 0 FHADHM Cc1nscc1C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCCCC2 ZINC000826340136 947977491 /nfs/dbraw/zinc/97/74/91/947977491.db2.gz JECWFHYAQCSJTG-UHFFFAOYSA-N -1 3 374.495 3.604 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)NC2(c3ccc(F)cc3F)CCCC2)c1 ZINC000536429973 948099077 /nfs/dbraw/zinc/09/90/77/948099077.db2.gz NHBUOJRVOHDEJW-UHFFFAOYSA-N -1 3 374.387 3.828 20 0 FHADHM CC(C)c1ccoc1C(=O)Nc1cc(I)ccc1[O-] ZINC000585701372 948188797 /nfs/dbraw/zinc/18/87/97/948188797.db2.gz 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c1sc(COc2ccccc2)nc1CNc1cccc(-c2nnn[n-]2)c1 ZINC000826522783 948456648 /nfs/dbraw/zinc/45/66/48/948456648.db2.gz OEOQAFYMWKRBLL-UHFFFAOYSA-N -1 3 364.434 3.514 20 0 FHADHM c1sc(COc2ccccc2)nc1CNc1cccc(-c2nn[n-]n2)c1 ZINC000826522783 948456654 /nfs/dbraw/zinc/45/66/54/948456654.db2.gz OEOQAFYMWKRBLL-UHFFFAOYSA-N -1 3 364.434 3.514 20 0 FHADHM CCO[C@@H](CC[N-]S(=O)(=O)c1c(Cl)cccc1Cl)C(C)C ZINC000467800157 948459295 /nfs/dbraw/zinc/45/92/95/948459295.db2.gz SKEALKMGCLCMSN-ZDUSSCGKSA-N -1 3 354.299 3.723 20 0 FHADHM Cc1ccc([C@H]2OCCC[C@@H]2[N-]S(=O)(=O)c2ccc(Cl)s2)cc1 ZINC000467800795 948472794 /nfs/dbraw/zinc/47/27/94/948472794.db2.gz OPRZYKJULNURNT-XJKSGUPXSA-N -1 3 371.911 3.909 20 0 FHADHM CC(C)(CCC(=O)Nc1cc(-c2nnn[n-]2)ccc1F)c1ccccc1 ZINC001275483673 948497941 /nfs/dbraw/zinc/49/79/41/948497941.db2.gz PXIIYFQSVNJYPD-UHFFFAOYSA-N -1 3 353.401 3.702 20 0 FHADHM CC(C)(CCC(=O)Nc1cc(-c2nn[n-]n2)ccc1F)c1ccccc1 ZINC001275483673 948497947 /nfs/dbraw/zinc/49/79/47/948497947.db2.gz 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C[C@H](C(=O)Nc1ccc(Oc2ccccc2)c(-c2nn[n-]n2)c1)C(C)(F)F ZINC001573755046 948753288 /nfs/dbraw/zinc/75/32/88/948753288.db2.gz ABTAJJCXIKAFTA-LLVKDONJSA-N -1 3 373.363 3.889 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(Oc2ccccc2)c(-c2nnn[n-]2)c1)C(C)(F)F ZINC001573755060 948754722 /nfs/dbraw/zinc/75/47/22/948754722.db2.gz ABTAJJCXIKAFTA-NSHDSACASA-N -1 3 373.363 3.889 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(Oc2ccccc2)c(-c2nn[n-]n2)c1)C(C)(F)F ZINC001573755060 948754730 /nfs/dbraw/zinc/75/47/30/948754730.db2.gz ABTAJJCXIKAFTA-NSHDSACASA-N -1 3 373.363 3.889 20 0 FHADHM O=C([N-]c1nncs1)c1cc(-c2ccco2)n(-c2cccc(Cl)c2)n1 ZINC000021216148 948809275 /nfs/dbraw/zinc/80/92/75/948809275.db2.gz HNHBGVZIKXNWSE-UHFFFAOYSA-N -1 3 371.809 3.890 20 0 FHADHM [O-]c1ccc(-c2noc(-c3ccc(I)cc3)n2)cc1 ZINC000020480533 220329231 /nfs/dbraw/zinc/32/92/31/220329231.db2.gz PTRWGHMXTOCLHW-UHFFFAOYSA-N -1 3 364.142 3.714 20 0 FHADHM Cc1ccc(S(=O)(=O)[N-]c2cccc(F)c2F)c(Br)c1 ZINC000040231536 220897289 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O=C(N=c1cc2ccc(Br)cn2[n-]1)NCCCC(F)(F)F ZINC000482044886 515557040 /nfs/dbraw/zinc/55/70/40/515557040.db2.gz GINYPOHTCPIVJM-UHFFFAOYSA-N -1 3 365.153 3.561 20 0 FHADHM CCN=c1[n-]c(C(=O)N2CCc3ccc(Br)cc32)cs1 ZINC000478284834 515766301 /nfs/dbraw/zinc/76/63/01/515766301.db2.gz VNTMAMIUZIXSPX-UHFFFAOYSA-N -1 3 352.257 3.540 20 0 FHADHM CCN=c1[n-]c(C(=O)N2CC[C@H](Oc3ccccc3Cl)C2)cs1 ZINC000506198296 515811879 /nfs/dbraw/zinc/81/18/79/515811879.db2.gz BHZVJKBUXYLGJM-NSHDSACASA-N -1 3 351.859 3.522 20 0 FHADHM CCc1[n-][nH]c(=NC(=O)[C@@H]2CCO[C@@H](CC)C2)c1-c1ccc2c(c1)OCO2 ZINC000506758243 515974846 /nfs/dbraw/zinc/97/48/46/515974846.db2.gz GZXATBIUNQMOBB-KGLIPLIRSA-N -1 3 371.437 3.512 20 0 FHADHM Cc1cc(C)cc(-c2cc(=NC(=O)CCNC(=O)c3cccs3)[nH][n-]2)c1 ZINC000512539363 516301927 /nfs/dbraw/zinc/30/19/27/516301927.db2.gz CUDVJCHEECFSEG-UHFFFAOYSA-N -1 3 368.462 3.514 20 0 FHADHM O=C(Nc1cccc(CN2CCSCC2)c1)c1csc(=NC2CC2)[n-]1 ZINC000525368704 517018766 /nfs/dbraw/zinc/01/87/66/517018766.db2.gz 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CN(Cc1ccccc1)[C@@H]1CCN(C(=O)N=c2[n-]nc(C(C)(C)C)s2)C1 ZINC000608288969 521645937 /nfs/dbraw/zinc/64/59/37/521645937.db2.gz LZOWEHSVKXPSIY-OAHLLOKOSA-N -1 3 373.526 3.574 20 0 FHADHM O=C(c1ccc2c(c1[O-])CCCC2)N1CCO[C@H](c2ccccc2F)C1 ZINC000185780365 567863388 /nfs/dbraw/zinc/86/33/88/567863388.db2.gz JHRSEDSSKLIAIW-IBGZPJMESA-N -1 3 355.409 3.624 20 0 FHADHM COCCC1(CNC(=O)c2c[n-]nc2-c2ccc(Cl)s2)CCC1 ZINC000186446776 567922866 /nfs/dbraw/zinc/92/28/66/567922866.db2.gz JDYOGCBCRUZAJA-UHFFFAOYSA-N -1 3 353.875 3.728 20 0 FHADHM COc1ccc(Cl)c(S(=O)(=O)[N-]C2(c3ccc(F)cc3)CCC2)c1 ZINC000602255924 567960380 /nfs/dbraw/zinc/96/03/80/567960380.db2.gz WTCBWDYANMJDLB-UHFFFAOYSA-N -1 3 369.845 3.845 20 0 FHADHM O=C([N-]c1nnc(C(F)F)s1)c1c[nH]nc1-c1ccc(Cl)s1 ZINC000188606628 567987252 /nfs/dbraw/zinc/98/72/52/567987252.db2.gz SVAZZRRGMKUDNZ-UHFFFAOYSA-N -1 3 361.786 3.833 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)CO[C@H]3CCC[C@@H](C)C3)c2)n1 ZINC000602660878 568012317 /nfs/dbraw/zinc/01/23/17/568012317.db2.gz KTKNHJMSXRDGFR-KDOFPFPSSA-N -1 3 369.465 3.945 20 0 FHADHM CC[C@@H]1CCCN(C(=O)c2cc(=O)c3cc(Br)ccc3[n-]2)C1 ZINC000602744520 568021669 /nfs/dbraw/zinc/02/16/69/568021669.db2.gz UKBAZQGMDOTDKY-LLVKDONJSA-N -1 3 363.255 3.553 20 0 FHADHM O=C(NCCCCCc1ccc(F)cc1)c1c[n-]c2ccccc2c1=O ZINC000186965484 568028473 /nfs/dbraw/zinc/02/84/73/568028473.db2.gz ULRSTQDVBMLTOF-UHFFFAOYSA-N -1 3 352.409 3.810 20 0 FHADHM CCc1ccc([O-])c(C(=O)N[C@H](C)c2ccc(NC(=O)C3CC3)cc2)c1 ZINC000522759380 568059441 /nfs/dbraw/zinc/05/94/41/568059441.db2.gz DBRXYEQUAOBBFC-CYBMUJFWSA-N -1 3 352.434 3.794 20 0 FHADHM COC(=O)c1c(C)nc(=O)[n-]c1SCc1cccc(OCC(C)C)c1 ZINC000603310544 568084676 /nfs/dbraw/zinc/08/46/76/568084676.db2.gz QVKXUXVVYJZVPC-UHFFFAOYSA-N -1 3 362.451 3.604 20 0 FHADHM O=C(CNc1cccc(Cl)c1)Nc1ccc(Br)cc1[O-] ZINC000603858608 568169248 /nfs/dbraw/zinc/16/92/48/568169248.db2.gz PTXFJNXCZGLTES-UHFFFAOYSA-N -1 3 355.619 3.859 20 0 FHADHM CC1(C)CN(Cc2ccccc2)CC[C@H]1N=c1[n-]nc(C(F)F)s1 ZINC000390841952 568315652 /nfs/dbraw/zinc/31/56/52/568315652.db2.gz BLXPEISCORDVAE-CYBMUJFWSA-N -1 3 352.454 3.610 20 0 FHADHM CCn1cc(C(=O)[N-]c2c(F)cc(C(C)=O)c(F)c2F)c(C2CC2)n1 ZINC000637070112 568339920 /nfs/dbraw/zinc/33/99/20/568339920.db2.gz JQIAXOHMXZBACF-UHFFFAOYSA-N -1 3 351.328 3.653 20 0 FHADHM O=C(c1cc(=O)c2ccccc2[n-]1)N1CCC[C@@H]1c1ccc(F)c(F)c1 ZINC000365233713 568344498 /nfs/dbraw/zinc/34/44/98/568344498.db2.gz OKQZAXMZWPBMLU-GOSISDBHSA-N -1 3 354.356 3.784 20 0 FHADHM O=C(CCSc1ccccc1F)Nc1n[n-]c(-c2ccccc2F)n1 ZINC000604789804 568367336 /nfs/dbraw/zinc/36/73/36/568367336.db2.gz NPEOMGINJRKHRQ-UHFFFAOYSA-N -1 3 360.389 3.871 20 0 FHADHM Cc1cc(Cl)cc(NC(=O)c2cccn(Cc3ccccc3)c2=O)c1[O-] ZINC000604902116 568385069 /nfs/dbraw/zinc/38/50/69/568385069.db2.gz ITGXWWXPPVZDGH-UHFFFAOYSA-N -1 3 368.820 3.816 20 0 FHADHM Cc1ccc(CN2C[C@H](C(=O)Nc3cc(Cl)cc(C)c3[O-])CC2=O)cc1 ZINC000604902146 568385101 /nfs/dbraw/zinc/38/51/01/568385101.db2.gz NZDCYJPYYZXRRL-OAHLLOKOSA-N -1 3 372.852 3.650 20 0 FHADHM C[C@@]([N-]C(=O)c1ocnc1C(F)F)(c1ccc(F)cc1)C(F)(F)F ZINC000637099870 568386313 /nfs/dbraw/zinc/38/63/13/568386313.db2.gz UEKOIYYEZVCQHD-CYBMUJFWSA-N -1 3 352.234 3.959 20 0 FHADHM O=C([N-]c1c(F)cccc1Cl)c1nc(N2CCCC2)ncc1Cl ZINC000637103991 568390594 /nfs/dbraw/zinc/39/05/94/568390594.db2.gz NJRMIDJBZDPOSZ-UHFFFAOYSA-N -1 3 355.200 3.775 20 0 FHADHM O=c1nc(CSc2ncccn2)[n-]c2scc(-c3ccccc3)c21 ZINC000006909443 568410368 /nfs/dbraw/zinc/41/03/68/568410368.db2.gz ZVRKMIIXJHWFOC-UHFFFAOYSA-N -1 3 352.444 3.734 20 0 FHADHM Cc1ccc(NC(=O)CSc2nccn2-c2ccccc2C)c([O-])c1 ZINC000007284568 568489778 /nfs/dbraw/zinc/48/97/78/568489778.db2.gz QSLGVOGLEMTPGJ-UHFFFAOYSA-N -1 3 353.447 3.926 20 0 FHADHM COc1cccc(C(=O)N2CCC(c3cccc4cnccc43)CC2)c1[O-] ZINC000365333431 568515829 /nfs/dbraw/zinc/51/58/29/568515829.db2.gz LCZJFCJJUVRRIT-UHFFFAOYSA-N -1 3 362.429 3.969 20 0 FHADHM Cn1ccnc1-c1nnc([N-]C(=O)c2c(Cl)cc(F)cc2Cl)s1 ZINC000365331920 568519180 /nfs/dbraw/zinc/51/91/80/568519180.db2.gz GBISPQKLQIOOGX-UHFFFAOYSA-N -1 3 372.212 3.637 20 0 FHADHM O=C(c1c[n-]c2ccc(Oc3ccccc3)cc2c1=O)N1CC(C2CC2)C1 ZINC000643286800 568538407 /nfs/dbraw/zinc/53/84/07/568538407.db2.gz IVOZLYPDUNWYOI-UHFFFAOYSA-N -1 3 360.413 3.802 20 0 FHADHM O=C(N[C@H]1CCc2c1ccc(Cl)c2Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000738034540 598823976 /nfs/dbraw/zinc/82/39/76/598823976.db2.gz HGHPYOCHNUVEGO-AWEZNQCLSA-N -1 3 374.231 3.591 20 0 FHADHM O=C(N[C@H]1CCc2c1ccc(Cl)c2Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000738034540 598823977 /nfs/dbraw/zinc/82/39/77/598823977.db2.gz HGHPYOCHNUVEGO-AWEZNQCLSA-N -1 3 374.231 3.591 20 0 FHADHM CC(C)c1cnc(SCC(=O)c2ccc(-c3nnn[n-]3)cc2)n1C(C)C ZINC000735932474 598824098 /nfs/dbraw/zinc/82/40/98/598824098.db2.gz MDKCJZRCGKKXPL-UHFFFAOYSA-N -1 3 370.482 3.743 20 0 FHADHM CC(C)c1cnc(SCC(=O)c2ccc(-c3nn[n-]n3)cc2)n1C(C)C ZINC000735932474 598824099 /nfs/dbraw/zinc/82/40/99/598824099.db2.gz MDKCJZRCGKKXPL-UHFFFAOYSA-N -1 3 370.482 3.743 20 0 FHADHM CC(C)[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736103511 598829471 /nfs/dbraw/zinc/82/94/71/598829471.db2.gz YTUCMQBODNGGOA-KXBFYZLASA-N -1 3 363.465 3.559 20 0 FHADHM CC(C)[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736103511 598829473 /nfs/dbraw/zinc/82/94/73/598829473.db2.gz YTUCMQBODNGGOA-KXBFYZLASA-N -1 3 363.465 3.559 20 0 FHADHM CS[C@@H](C(=O)Nc1sc(C)c(C)c1-c1nnn[n-]1)c1ccccc1 ZINC000737173141 598829777 /nfs/dbraw/zinc/82/97/77/598829777.db2.gz WYSXEXFGSLXPPD-CYBMUJFWSA-N -1 3 359.480 3.588 20 0 FHADHM CS[C@@H](C(=O)Nc1sc(C)c(C)c1-c1nn[n-]n1)c1ccccc1 ZINC000737173141 598829778 /nfs/dbraw/zinc/82/97/78/598829778.db2.gz WYSXEXFGSLXPPD-CYBMUJFWSA-N -1 3 359.480 3.588 20 0 FHADHM O=C(NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1)[C@H]1CC=CCC1 ZINC000738113262 598836766 /nfs/dbraw/zinc/83/67/66/598836766.db2.gz YFXXAWTUIPULHE-AWEZNQCLSA-N -1 3 365.462 3.568 20 0 FHADHM CC[C@H]1CCCCCN1C(=O)CCCCOc1cccc(-c2nnn[n-]2)c1 ZINC000736399616 598837235 /nfs/dbraw/zinc/83/72/35/598837235.db2.gz JADVREWQHTUNNT-KRWDZBQOSA-N -1 3 371.485 3.597 20 0 FHADHM CC[C@H]1CCCCCN1C(=O)CCCCOc1cccc(-c2nn[n-]n2)c1 ZINC000736399616 598837237 /nfs/dbraw/zinc/83/72/37/598837237.db2.gz JADVREWQHTUNNT-KRWDZBQOSA-N -1 3 371.485 3.597 20 0 FHADHM CCC/C=C/C(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000736439775 598846299 /nfs/dbraw/zinc/84/62/99/598846299.db2.gz VNKXLNOXSNTOPU-XBXARRHUSA-N -1 3 353.451 3.568 20 0 FHADHM c1ccc2c(c1)cccc2-c1noc(CNc2ccc(-c3nn[n-]n3)cc2)n1 ZINC000738433303 598860564 /nfs/dbraw/zinc/86/05/64/598860564.db2.gz PTKAHWAUEXDFKO-UHFFFAOYSA-N -1 3 369.388 3.682 20 0 FHADHM CCSc1cccc(NC(=O)C=Cc2ccccc2-c2nnn[n-]2)c1 ZINC000736666588 598865590 /nfs/dbraw/zinc/86/55/90/598865590.db2.gz MDCVRWICVLZXAA-ZHACJKMWSA-N -1 3 351.435 3.631 20 0 FHADHM CCSc1cccc(NC(=O)C=Cc2ccccc2-c2nn[n-]n2)c1 ZINC000736666588 598865592 /nfs/dbraw/zinc/86/55/92/598865592.db2.gz MDCVRWICVLZXAA-ZHACJKMWSA-N -1 3 351.435 3.631 20 0 FHADHM CC(C)(CCCc1ccccc1)CNC(=O)c1sccc1-c1nnn[n-]1 ZINC000735664597 598866570 /nfs/dbraw/zinc/86/65/70/598866570.db2.gz LGYNYUPTASBHNC-UHFFFAOYSA-N -1 3 369.494 3.707 20 0 FHADHM CC(C)(CCCc1ccccc1)CNC(=O)c1sccc1-c1nn[n-]n1 ZINC000735664597 598866572 /nfs/dbraw/zinc/86/65/72/598866572.db2.gz LGYNYUPTASBHNC-UHFFFAOYSA-N -1 3 369.494 3.707 20 0 FHADHM C[C@H](CNc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)Oc1ccccc1 ZINC000736027096 598869458 /nfs/dbraw/zinc/86/94/58/598869458.db2.gz XGBVOVBJWBWLLU-LLVKDONJSA-N -1 3 363.343 3.765 20 0 FHADHM C[C@H](CNc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)Oc1ccccc1 ZINC000736027096 598869459 /nfs/dbraw/zinc/86/94/59/598869459.db2.gz XGBVOVBJWBWLLU-LLVKDONJSA-N -1 3 363.343 3.765 20 0 FHADHM CC[C@H](CC1CCCCC1)C(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1 ZINC000736351539 598903334 /nfs/dbraw/zinc/90/33/34/598903334.db2.gz RSFBVXNMYPCAIT-QGZVFWFLSA-N -1 3 355.486 3.822 20 0 FHADHM CC[C@H](CC1CCCCC1)C(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1 ZINC000736351539 598903336 /nfs/dbraw/zinc/90/33/36/598903336.db2.gz RSFBVXNMYPCAIT-QGZVFWFLSA-N -1 3 355.486 3.822 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@H]2C(=O)Nc2sccc2-c2nnn[n-]2)cc1 ZINC000735922038 598910823 /nfs/dbraw/zinc/91/08/23/598910823.db2.gz AHMULZLEZMHDFL-LSDHHAIUSA-N -1 3 353.451 3.794 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@H]2C(=O)Nc2sccc2-c2nn[n-]n2)cc1 ZINC000735922038 598910825 /nfs/dbraw/zinc/91/08/25/598910825.db2.gz AHMULZLEZMHDFL-LSDHHAIUSA-N -1 3 353.451 3.794 20 0 FHADHM O=C(Nc1cccc(Nc2ccccc2)c1)c1sccc1-c1nnn[n-]1 ZINC000738185914 598911027 /nfs/dbraw/zinc/91/10/27/598911027.db2.gz LELDEZUQQJXYGD-UHFFFAOYSA-N -1 3 362.418 3.924 20 0 FHADHM O=C(Nc1cccc(Nc2ccccc2)c1)c1sccc1-c1nn[n-]n1 ZINC000738185914 598911029 /nfs/dbraw/zinc/91/10/29/598911029.db2.gz LELDEZUQQJXYGD-UHFFFAOYSA-N -1 3 362.418 3.924 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@H]2C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)cc1 ZINC000735924116 598912315 /nfs/dbraw/zinc/91/23/15/598912315.db2.gz QJOIXURNZJRYKK-JKSUJKDBSA-N -1 3 365.412 3.871 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@H]2C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)cc1 ZINC000735924116 598912316 /nfs/dbraw/zinc/91/23/16/598912316.db2.gz QJOIXURNZJRYKK-JKSUJKDBSA-N -1 3 365.412 3.871 20 0 FHADHM O=C(NCc1coc2ccccc12)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000738123310 598924190 /nfs/dbraw/zinc/92/41/90/598924190.db2.gz AVAMUICZZBWGSY-UHFFFAOYSA-N -1 3 368.784 3.588 20 0 FHADHM O=C(NCc1coc2ccccc12)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000738123310 598924192 /nfs/dbraw/zinc/92/41/92/598924192.db2.gz AVAMUICZZBWGSY-UHFFFAOYSA-N -1 3 368.784 3.588 20 0 FHADHM CC1CCN(c2ccc(Nc3ncc(-c4nnn[n-]4)cc3Cl)cc2)CC1 ZINC000736280924 598935445 /nfs/dbraw/zinc/93/54/45/598935445.db2.gz RJYWRKFUTMOZAV-UHFFFAOYSA-N -1 3 369.860 3.895 20 0 FHADHM CC1CCN(c2ccc(Nc3ncc(-c4nn[n-]n4)cc3Cl)cc2)CC1 ZINC000736280924 598935446 /nfs/dbraw/zinc/93/54/46/598935446.db2.gz RJYWRKFUTMOZAV-UHFFFAOYSA-N -1 3 369.860 3.895 20 0 FHADHM CC(C)C[C@@H]1CCCCCN1C(=O)C=Cc1ccccc1-c1nnn[n-]1 ZINC000735796169 598943285 /nfs/dbraw/zinc/94/32/85/598943285.db2.gz VVQVNZANZMHXHF-CPFIRTDXSA-N -1 3 353.470 3.697 20 0 FHADHM CC(C)C[C@@H]1CCCCCN1C(=O)C=Cc1ccccc1-c1nn[n-]n1 ZINC000735796169 598943286 /nfs/dbraw/zinc/94/32/86/598943286.db2.gz VVQVNZANZMHXHF-CPFIRTDXSA-N -1 3 353.470 3.697 20 0 FHADHM CCOc1ccccc1[C@@H](CC)Nc1ncc(-c2nnn[n-]2)cc1Cl ZINC000736652835 598940134 /nfs/dbraw/zinc/94/01/34/598940134.db2.gz CFGJRDIGSXSBDW-CQSZACIVSA-N -1 3 358.833 3.877 20 0 FHADHM CCOc1ccccc1[C@@H](CC)Nc1ncc(-c2nn[n-]n2)cc1Cl ZINC000736652835 598940136 /nfs/dbraw/zinc/94/01/36/598940136.db2.gz CFGJRDIGSXSBDW-CQSZACIVSA-N -1 3 358.833 3.877 20 0 FHADHM CC[C@H]1CCC[C@H](NC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)C1 ZINC000736395068 598942187 /nfs/dbraw/zinc/94/21/87/598942187.db2.gz GTXKJYHEJYYADE-RDJZCZTQSA-N -1 3 371.485 3.501 20 0 FHADHM CC[C@H]1CCC[C@H](NC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)C1 ZINC000736395068 598942188 /nfs/dbraw/zinc/94/21/88/598942188.db2.gz GTXKJYHEJYYADE-RDJZCZTQSA-N -1 3 371.485 3.501 20 0 FHADHM Fc1cccc(Cl)c1[C@H]1C[C@@H]1Nc1ncc(-c2nnn[n-]2)cc1Cl ZINC000737659972 598972352 /nfs/dbraw/zinc/97/23/52/598972352.db2.gz GWECQIHHLVGQEL-UFBFGSQYSA-N -1 3 365.199 3.676 20 0 FHADHM Fc1cccc(Cl)c1[C@H]1C[C@@H]1Nc1ncc(-c2nn[n-]n2)cc1Cl ZINC000737659972 598972353 /nfs/dbraw/zinc/97/23/53/598972353.db2.gz GWECQIHHLVGQEL-UFBFGSQYSA-N -1 3 365.199 3.676 20 0 FHADHM C[C@@H](CCC1CCCCC1)NC(=O)CCc1ccc(-c2nnn[n-]2)cc1 ZINC000735984871 599007746 /nfs/dbraw/zinc/00/77/46/599007746.db2.gz HLCLYXOSAXZFIK-HNNXBMFYSA-N -1 3 355.486 3.665 20 0 FHADHM C[C@@H](CCC1CCCCC1)NC(=O)CCc1ccc(-c2nn[n-]n2)cc1 ZINC000735984871 599007748 /nfs/dbraw/zinc/00/77/48/599007748.db2.gz HLCLYXOSAXZFIK-HNNXBMFYSA-N -1 3 355.486 3.665 20 0 FHADHM Cc1cccc([C@H](C)NC(=S)Nc2ccccc2-c2nnn[n-]2)c1C ZINC000737391237 599014771 /nfs/dbraw/zinc/01/47/71/599014771.db2.gz YLFDMBDTBOMYGX-ZDUSSCGKSA-N -1 3 352.467 3.531 20 0 FHADHM Cc1cccc([C@H](C)NC(=S)Nc2ccccc2-c2nn[n-]n2)c1C ZINC000737391237 599014773 /nfs/dbraw/zinc/01/47/73/599014773.db2.gz YLFDMBDTBOMYGX-ZDUSSCGKSA-N -1 3 352.467 3.531 20 0 FHADHM CC[C@@H]1CCC[C@@H](NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)C1 ZINC000736395034 599023683 /nfs/dbraw/zinc/02/36/83/599023683.db2.gz GKSXXSFGNKIRFL-CRAIPNDOSA-N -1 3 370.501 3.756 20 0 FHADHM CC[C@@H]1CCC[C@@H](NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)C1 ZINC000736395034 599023684 /nfs/dbraw/zinc/02/36/84/599023684.db2.gz GKSXXSFGNKIRFL-CRAIPNDOSA-N -1 3 370.501 3.756 20 0 FHADHM O=C(OCCCc1c(F)cccc1Cl)c1sccc1-c1nnn[n-]1 ZINC000738221614 599029153 /nfs/dbraw/zinc/02/91/53/599029153.db2.gz LFDYFMHVLCFSGI-UHFFFAOYSA-N -1 3 366.805 3.510 20 0 FHADHM Cc1sc(NC(=O)c2cccc3ccc(C)nc32)c(-c2nnn[n-]2)c1C ZINC000737374021 599035389 /nfs/dbraw/zinc/03/53/89/599035389.db2.gz IZTUHKQSNUPSGC-UHFFFAOYSA-N -1 3 364.434 3.654 20 0 FHADHM Cc1sc(NC(=O)c2cccc3ccc(C)nc32)c(-c2nn[n-]n2)c1C ZINC000737374021 599035392 /nfs/dbraw/zinc/03/53/92/599035392.db2.gz IZTUHKQSNUPSGC-UHFFFAOYSA-N -1 3 364.434 3.654 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(NC[C@@H]2CCCc3ccccc32)n1 ZINC000737637097 599043249 /nfs/dbraw/zinc/04/32/49/599043249.db2.gz ZGJACNJGNSMHKB-LBPRGKRZSA-N -1 3 374.370 3.813 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(NC[C@@H]2CCCc3ccccc32)n1 ZINC000737637097 599043251 /nfs/dbraw/zinc/04/32/51/599043251.db2.gz ZGJACNJGNSMHKB-LBPRGKRZSA-N -1 3 374.370 3.813 20 0 FHADHM Cc1ccc(CCNc2nc(C(F)(F)F)ccc2-c2nnn[n-]2)c(C)c1 ZINC000737337474 599049380 /nfs/dbraw/zinc/04/93/80/599049380.db2.gz NKRZNBVQDCNSIQ-UHFFFAOYSA-N -1 3 362.359 3.552 20 0 FHADHM Cc1ccc(CCNc2nc(C(F)(F)F)ccc2-c2nn[n-]n2)c(C)c1 ZINC000737337474 599049385 /nfs/dbraw/zinc/04/93/85/599049385.db2.gz NKRZNBVQDCNSIQ-UHFFFAOYSA-N -1 3 362.359 3.552 20 0 FHADHM C[C@@H]1C[C@@H](c2ccccc2)CN1c1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000736234790 599060414 /nfs/dbraw/zinc/06/04/14/599060414.db2.gz KPKFMTYKAZDZRB-DGCLKSJQSA-N -1 3 374.370 3.663 20 0 FHADHM C[C@@H]1C[C@@H](c2ccccc2)CN1c1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000736234790 599060416 /nfs/dbraw/zinc/06/04/16/599060416.db2.gz KPKFMTYKAZDZRB-DGCLKSJQSA-N -1 3 374.370 3.663 20 0 FHADHM COc1cc(CNc2c(Cl)cccc2-c2nnn[n-]2)c2ccccc2n1 ZINC000821717214 599062453 /nfs/dbraw/zinc/06/24/53/599062453.db2.gz LLBQVXRXMKVNAT-UHFFFAOYSA-N -1 3 366.812 3.689 20 0 FHADHM COc1cc(CNc2c(Cl)cccc2-c2nn[n-]n2)c2ccccc2n1 ZINC000821717214 599062456 /nfs/dbraw/zinc/06/24/56/599062456.db2.gz LLBQVXRXMKVNAT-UHFFFAOYSA-N -1 3 366.812 3.689 20 0 FHADHM COc1cc(CNc2cc(Cl)ccc2-c2nnn[n-]2)c2ccccc2n1 ZINC000821717753 599062659 /nfs/dbraw/zinc/06/26/59/599062659.db2.gz XLLGCEFUOZYKAP-UHFFFAOYSA-N -1 3 366.812 3.689 20 0 FHADHM COc1cc(CNc2cc(Cl)ccc2-c2nn[n-]n2)c2ccccc2n1 ZINC000821717753 599062662 /nfs/dbraw/zinc/06/26/62/599062662.db2.gz XLLGCEFUOZYKAP-UHFFFAOYSA-N -1 3 366.812 3.689 20 0 FHADHM Cc1ccc(CC[C@H](C)Nc2nc(C(F)(F)F)ccc2-c2nnn[n-]2)o1 ZINC000822236159 599065163 /nfs/dbraw/zinc/06/51/63/599065163.db2.gz MFNBLWVSMLHHIE-VIFPVBQESA-N -1 3 366.347 3.615 20 0 FHADHM Cc1ccc(CC[C@H](C)Nc2nc(C(F)(F)F)ccc2-c2nn[n-]n2)o1 ZINC000822236159 599065166 /nfs/dbraw/zinc/06/51/66/599065166.db2.gz MFNBLWVSMLHHIE-VIFPVBQESA-N -1 3 366.347 3.615 20 0 FHADHM Cc1ccccc1O[C@@H](C)CNc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000822366517 599065608 /nfs/dbraw/zinc/06/56/08/599065608.db2.gz LIDFJMRBFTXUCS-AWEZNQCLSA-N -1 3 360.421 3.603 20 0 FHADHM Cc1ccccc1O[C@@H](C)CNc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000822366517 599065610 /nfs/dbraw/zinc/06/56/10/599065610.db2.gz LIDFJMRBFTXUCS-AWEZNQCLSA-N -1 3 360.421 3.603 20 0 FHADHM Cc1ccc(-c2nnc(CSc3ccc(-c4nnn[n-]4)cc3F)o2)cc1 ZINC000737289561 599066267 /nfs/dbraw/zinc/06/62/67/599066267.db2.gz VHQSFROKKUAQFM-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM Cc1ccc(-c2nnc(CSc3ccc(-c4nn[n-]n4)cc3F)o2)cc1 ZINC000737289561 599066270 /nfs/dbraw/zinc/06/62/70/599066270.db2.gz VHQSFROKKUAQFM-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM C[C@H]1CCC[C@H](C(=O)N(Cc2ccco2)c2ccccc2-c2nnn[n-]2)C1 ZINC000736244664 599070843 /nfs/dbraw/zinc/07/08/43/599070843.db2.gz LSRNBSMFJFBNBQ-GJZGRUSLSA-N -1 3 365.437 3.819 20 0 FHADHM C[C@H]1CCC[C@H](C(=O)N(Cc2ccco2)c2ccccc2-c2nn[n-]n2)C1 ZINC000736244664 599070846 /nfs/dbraw/zinc/07/08/46/599070846.db2.gz LSRNBSMFJFBNBQ-GJZGRUSLSA-N -1 3 365.437 3.819 20 0 FHADHM CCC(=CC(=O)Nc1cc(-c2nnn[n-]2)ccc1OC)c1ccc(C)cc1 ZINC000736304936 599072177 /nfs/dbraw/zinc/07/21/77/599072177.db2.gz SFGMYYXSLVTPEP-OWBHPGMISA-N -1 3 363.421 3.616 20 0 FHADHM CCC(=CC(=O)Nc1cc(-c2nn[n-]n2)ccc1OC)c1ccc(C)cc1 ZINC000736304936 599072180 /nfs/dbraw/zinc/07/21/80/599072180.db2.gz SFGMYYXSLVTPEP-OWBHPGMISA-N -1 3 363.421 3.616 20 0 FHADHM Cc1ccc([C@@H]2CCCCN2C(=O)c2sccc2-c2nnn[n-]2)cc1 ZINC000737332873 599083663 /nfs/dbraw/zinc/08/36/63/599083663.db2.gz WYZVLZQJEVTEHO-HNNXBMFYSA-N -1 3 353.451 3.604 20 0 FHADHM Cc1ccc([C@@H]2CCCCN2C(=O)c2sccc2-c2nn[n-]n2)cc1 ZINC000737332873 599083665 /nfs/dbraw/zinc/08/36/65/599083665.db2.gz WYZVLZQJEVTEHO-HNNXBMFYSA-N -1 3 353.451 3.604 20 0 FHADHM CCC(CC)(CC)NC(=O)CCCCOc1cccc(-c2nnn[n-]2)c1 ZINC000736336067 599088778 /nfs/dbraw/zinc/08/87/78/599088778.db2.gz YYTKMYDKOSXAAO-UHFFFAOYSA-N -1 3 359.474 3.501 20 0 FHADHM CCC(CC)(CC)NC(=O)CCCCOc1cccc(-c2nn[n-]n2)c1 ZINC000736336067 599088780 /nfs/dbraw/zinc/08/87/80/599088780.db2.gz YYTKMYDKOSXAAO-UHFFFAOYSA-N -1 3 359.474 3.501 20 0 FHADHM Cc1cc(F)cc2c1ncc(-c1nnn[n-]1)c2N1CCC2(CCCC2)C1 ZINC000822204665 599092998 /nfs/dbraw/zinc/09/29/98/599092998.db2.gz WNLQGQQFWHVCFG-UHFFFAOYSA-N -1 3 352.417 3.633 20 0 FHADHM Cc1cc(F)cc2c1ncc(-c1nn[n-]n1)c2N1CCC2(CCCC2)C1 ZINC000822204665 599093001 /nfs/dbraw/zinc/09/30/01/599093001.db2.gz WNLQGQQFWHVCFG-UHFFFAOYSA-N -1 3 352.417 3.633 20 0 FHADHM FC(F)(F)c1csc(CCNc2ccc(Cl)cc2-c2nnn[n-]2)n1 ZINC000822727904 599105612 /nfs/dbraw/zinc/10/56/12/599105612.db2.gz BFHZZHNRTDLSJH-UHFFFAOYSA-N -1 3 374.779 3.650 20 0 FHADHM FC(F)(F)c1csc(CCNc2ccc(Cl)cc2-c2nn[n-]n2)n1 ZINC000822727904 599105613 /nfs/dbraw/zinc/10/56/13/599105613.db2.gz BFHZZHNRTDLSJH-UHFFFAOYSA-N -1 3 374.779 3.650 20 0 FHADHM O[C@@H](C[C@H]1CCCN1c1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccccc1 ZINC000823675360 599109510 /nfs/dbraw/zinc/10/95/10/599109510.db2.gz WHALAMGNANYVHP-KDOFPFPSSA-N -1 3 369.856 3.613 20 0 FHADHM O[C@@H](C[C@H]1CCCN1c1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccccc1 ZINC000823675360 599109512 /nfs/dbraw/zinc/10/95/12/599109512.db2.gz WHALAMGNANYVHP-KDOFPFPSSA-N -1 3 369.856 3.613 20 0 FHADHM Clc1cc(Br)ccc1C=Cc1ccc(-c2nnn[n-]2)cn1 ZINC000822567752 599111365 /nfs/dbraw/zinc/11/13/65/599111365.db2.gz GNQRWQWRNXOYJS-DJWKRKHSSA-N -1 3 362.618 3.848 20 0 FHADHM Clc1cc(Br)ccc1C=Cc1ccc(-c2nn[n-]n2)cn1 ZINC000822567752 599111366 /nfs/dbraw/zinc/11/13/66/599111366.db2.gz GNQRWQWRNXOYJS-DJWKRKHSSA-N -1 3 362.618 3.848 20 0 FHADHM CCN(C(=O)c1cccc(F)c1Cl)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821159892 599143631 /nfs/dbraw/zinc/14/36/31/599143631.db2.gz CVDIPESEGLJKRP-NSHDSACASA-N -1 3 373.819 3.883 20 0 FHADHM CCN(C(=O)c1cccc(F)c1Cl)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821159892 599143633 /nfs/dbraw/zinc/14/36/33/599143633.db2.gz CVDIPESEGLJKRP-NSHDSACASA-N -1 3 373.819 3.883 20 0 FHADHM CCN(C(=O)c1cccc2cc[nH]c21)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821160376 599144254 /nfs/dbraw/zinc/14/42/54/599144254.db2.gz JUFNACLMFKKEPI-ZDUSSCGKSA-N -1 3 360.421 3.571 20 0 FHADHM CCN(C(=O)c1cccc2cc[nH]c21)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821160376 599144257 /nfs/dbraw/zinc/14/42/57/599144257.db2.gz JUFNACLMFKKEPI-ZDUSSCGKSA-N -1 3 360.421 3.571 20 0 FHADHM Cc1cccc([C@H](C)NC(=O)Nc2cc(-c3nnn[n-]3)ccc2C)c1C ZINC000737292220 599145882 /nfs/dbraw/zinc/14/58/82/599145882.db2.gz UFNROCPIMOHONH-AWEZNQCLSA-N -1 3 350.426 3.675 20 0 FHADHM Cc1cccc([C@H](C)NC(=O)Nc2cc(-c3nn[n-]n3)ccc2C)c1C ZINC000737292220 599145884 /nfs/dbraw/zinc/14/58/84/599145884.db2.gz UFNROCPIMOHONH-AWEZNQCLSA-N -1 3 350.426 3.675 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N1C[C@@H](c2ccccc2)C[C@H]1C ZINC000737293066 599145943 /nfs/dbraw/zinc/14/59/43/599145943.db2.gz ZUBZWOVXVQXVCW-PBHICJAKSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N1C[C@@H](c2ccccc2)C[C@H]1C ZINC000737293066 599145945 /nfs/dbraw/zinc/14/59/45/599145945.db2.gz ZUBZWOVXVQXVCW-PBHICJAKSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1ccc([C@@H](C)C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)CC(C)C)o1 ZINC000822227278 599147492 /nfs/dbraw/zinc/14/74/92/599147492.db2.gz BRFMDIOCYUOXME-OAHLLOKOSA-N -1 3 367.453 3.556 20 0 FHADHM Cc1ccc([C@@H](C)C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)CC(C)C)o1 ZINC000822227278 599147493 /nfs/dbraw/zinc/14/74/93/599147493.db2.gz BRFMDIOCYUOXME-OAHLLOKOSA-N -1 3 367.453 3.556 20 0 FHADHM CCCOc1ccc(CCC(=O)Nc2cc(-c3nnn[n-]3)ccc2C)cc1 ZINC000821134494 599148497 /nfs/dbraw/zinc/14/84/97/599148497.db2.gz XRCQCPJSQMLWHF-UHFFFAOYSA-N -1 3 365.437 3.535 20 0 FHADHM CCCOc1ccc(CCC(=O)Nc2cc(-c3nn[n-]n3)ccc2C)cc1 ZINC000821134494 599148500 /nfs/dbraw/zinc/14/85/00/599148500.db2.gz XRCQCPJSQMLWHF-UHFFFAOYSA-N -1 3 365.437 3.535 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@@H](C)CCc1cccc(F)c1 ZINC000822216787 599149393 /nfs/dbraw/zinc/14/93/93/599149393.db2.gz ZISCIDXXZWOSRZ-ZDUSSCGKSA-N -1 3 353.401 3.522 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@@H](C)CCc1cccc(F)c1 ZINC000822216787 599149395 /nfs/dbraw/zinc/14/93/95/599149395.db2.gz ZISCIDXXZWOSRZ-ZDUSSCGKSA-N -1 3 353.401 3.522 20 0 FHADHM COc1ccc2nc(C=Cc3ccc(OC)c(-c4nnn[n-]4)c3)sc2c1 ZINC000737120099 599154562 /nfs/dbraw/zinc/15/45/62/599154562.db2.gz IHKBOVAABPRUEK-XBXARRHUSA-N -1 3 365.418 3.664 20 0 FHADHM COc1ccc2nc(C=Cc3ccc(OC)c(-c4nn[n-]n4)c3)sc2c1 ZINC000737120099 599154563 /nfs/dbraw/zinc/15/45/63/599154563.db2.gz IHKBOVAABPRUEK-XBXARRHUSA-N -1 3 365.418 3.664 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1OCc1cc(Cl)ccc1Cl ZINC000737031436 599157172 /nfs/dbraw/zinc/15/71/72/599157172.db2.gz CWXXZPKUDRGWHC-UHFFFAOYSA-N -1 3 351.193 3.761 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1OCc1cc(Cl)ccc1Cl ZINC000737031436 599157174 /nfs/dbraw/zinc/15/71/74/599157174.db2.gz CWXXZPKUDRGWHC-UHFFFAOYSA-N -1 3 351.193 3.761 20 0 FHADHM Cc1ccc(SCc2nnc(-c3cccc(-c4nnn[n-]4)c3)o2)cc1C ZINC000737368250 599159096 /nfs/dbraw/zinc/15/90/96/599159096.db2.gz GQZKSCFOUQUWQR-UHFFFAOYSA-N -1 3 364.434 3.826 20 0 FHADHM Cc1ccc(SCc2nnc(-c3cccc(-c4nn[n-]n4)c3)o2)cc1C ZINC000737368250 599159097 /nfs/dbraw/zinc/15/90/97/599159097.db2.gz GQZKSCFOUQUWQR-UHFFFAOYSA-N -1 3 364.434 3.826 20 0 FHADHM C[C@@H](CC(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1cccc(F)c1 ZINC000735974827 599159448 /nfs/dbraw/zinc/15/94/48/599159448.db2.gz JTENFNHTZCGOQB-JTQLQIEISA-N -1 3 359.792 3.792 20 0 FHADHM C[C@@H](CC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1cccc(F)c1 ZINC000735974827 599159450 /nfs/dbraw/zinc/15/94/50/599159450.db2.gz JTENFNHTZCGOQB-JTQLQIEISA-N -1 3 359.792 3.792 20 0 FHADHM Cc1ccc([C@@H]2CCC[C@@H]2N(C)C(=O)c2sccc2-c2nnn[n-]2)cc1 ZINC000822232850 599161914 /nfs/dbraw/zinc/16/19/14/599161914.db2.gz CGDRWHLMKCVTED-HOCLYGCPSA-N -1 3 367.478 3.645 20 0 FHADHM Cc1ccc([C@@H]2CCC[C@@H]2N(C)C(=O)c2sccc2-c2nn[n-]n2)cc1 ZINC000822232850 599161917 /nfs/dbraw/zinc/16/19/17/599161917.db2.gz CGDRWHLMKCVTED-HOCLYGCPSA-N -1 3 367.478 3.645 20 0 FHADHM Cc1cc(C)cc(NC(=O)[C@H](C)Sc2ccc(-c3nnn[n-]3)cc2F)c1 ZINC000737251687 599169430 /nfs/dbraw/zinc/16/94/30/599169430.db2.gz VDXLKBKTLVVGFV-LBPRGKRZSA-N -1 3 371.441 3.742 20 0 FHADHM Cc1cc(C)cc(NC(=O)[C@H](C)Sc2ccc(-c3nn[n-]n3)cc2F)c1 ZINC000737251687 599169434 /nfs/dbraw/zinc/16/94/34/599169434.db2.gz VDXLKBKTLVVGFV-LBPRGKRZSA-N -1 3 371.441 3.742 20 0 FHADHM CC(C)(C)c1ccc([C@@H](O)CNc2c(F)cc(-c3nnn[n-]3)cc2F)cc1 ZINC000735650506 599171133 /nfs/dbraw/zinc/17/11/33/599171133.db2.gz PFNXCMXUSZUIIJ-INIZCTEOSA-N -1 3 373.407 3.588 20 0 FHADHM CC(C)(C)c1ccc([C@@H](O)CNc2c(F)cc(-c3nn[n-]n3)cc2F)cc1 ZINC000735650506 599171136 /nfs/dbraw/zinc/17/11/36/599171136.db2.gz PFNXCMXUSZUIIJ-INIZCTEOSA-N -1 3 373.407 3.588 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCC2)c1cccc(F)c1 ZINC000735570298 599176899 /nfs/dbraw/zinc/17/68/99/599176899.db2.gz NDSRULCLDXEDNT-JTQLQIEISA-N -1 3 371.441 3.688 20 0 FHADHM C[C@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCC2)c1cccc(F)c1 ZINC000735570298 599176901 /nfs/dbraw/zinc/17/69/01/599176901.db2.gz NDSRULCLDXEDNT-JTQLQIEISA-N -1 3 371.441 3.688 20 0 FHADHM CC(C)CN(C(=O)[C@@H](C)c1cccc(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000735818641 599183928 /nfs/dbraw/zinc/18/39/28/599183928.db2.gz PNTVIUAXYWGKDG-AWEZNQCLSA-N -1 3 367.428 3.799 20 0 FHADHM CC(C)CN(C(=O)[C@@H](C)c1cccc(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000735818641 599183929 /nfs/dbraw/zinc/18/39/29/599183929.db2.gz PNTVIUAXYWGKDG-AWEZNQCLSA-N -1 3 367.428 3.799 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@H](C)c1cccc(F)c1 ZINC000735904606 599185032 /nfs/dbraw/zinc/18/50/32/599185032.db2.gz SAOLAHZRAYGBDY-GFCCVEGCSA-N -1 3 369.400 3.535 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@H](C)c1cccc(F)c1 ZINC000735904606 599185034 /nfs/dbraw/zinc/18/50/34/599185034.db2.gz SAOLAHZRAYGBDY-GFCCVEGCSA-N -1 3 369.400 3.535 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@H](C)c1cccc(F)c1 ZINC000735511141 599182374 /nfs/dbraw/zinc/18/23/74/599182374.db2.gz DTMJDFYDXHYYHO-CQSZACIVSA-N -1 3 367.428 3.547 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@H](C)c1cccc(F)c1 ZINC000735511141 599182375 /nfs/dbraw/zinc/18/23/75/599182375.db2.gz DTMJDFYDXHYYHO-CQSZACIVSA-N -1 3 367.428 3.547 20 0 FHADHM O=C(Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1)[C@H]1Cc2ccccc21 ZINC000738209657 599186878 /nfs/dbraw/zinc/18/68/78/599186878.db2.gz QDXJHOWNRLHKGT-HNNXBMFYSA-N -1 3 373.441 3.874 20 0 FHADHM O=C(Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1)[C@H]1Cc2ccccc21 ZINC000738209657 599186881 /nfs/dbraw/zinc/18/68/81/599186881.db2.gz QDXJHOWNRLHKGT-HNNXBMFYSA-N -1 3 373.441 3.874 20 0 FHADHM CCCCNC(=O)c1cccc(Oc2cccc(Cl)c2-c2nnn[n-]2)c1 ZINC000736460694 599192798 /nfs/dbraw/zinc/19/27/98/599192798.db2.gz KCFJTFXAGFUIKF-UHFFFAOYSA-N -1 3 371.828 3.842 20 0 FHADHM CC[C@@H](OC(=O)Cc1ccc(-c2nnn[n-]2)cc1)C(C)(C)c1ccccc1 ZINC000736384671 599201188 /nfs/dbraw/zinc/20/11/88/599201188.db2.gz YDNIROFTAOOUOH-GOSISDBHSA-N -1 3 364.449 3.709 20 0 FHADHM CC[C@@H](OC(=O)Cc1ccc(-c2nn[n-]n2)cc1)C(C)(C)c1ccccc1 ZINC000736384671 599201189 /nfs/dbraw/zinc/20/11/89/599201189.db2.gz YDNIROFTAOOUOH-GOSISDBHSA-N -1 3 364.449 3.709 20 0 FHADHM Cc1cccc([C@@H]2CCCCN2C(=O)c2sccc2-c2nnn[n-]2)c1C ZINC000822299932 599202821 /nfs/dbraw/zinc/20/28/21/599202821.db2.gz ZNXMSQDBADQREF-INIZCTEOSA-N -1 3 367.478 3.912 20 0 FHADHM Cc1cccc([C@@H]2CCCCN2C(=O)c2sccc2-c2nn[n-]n2)c1C ZINC000822299932 599202824 /nfs/dbraw/zinc/20/28/24/599202824.db2.gz ZNXMSQDBADQREF-INIZCTEOSA-N -1 3 367.478 3.912 20 0 FHADHM CC(C)(C)C(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1 ZINC000819898098 599220216 /nfs/dbraw/zinc/22/02/16/599220216.db2.gz CROCFLYDJFYPSI-UHFFFAOYSA-N -1 3 355.373 3.783 20 0 FHADHM CC(C)(C)C(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1 ZINC000819898098 599220219 /nfs/dbraw/zinc/22/02/19/599220219.db2.gz CROCFLYDJFYPSI-UHFFFAOYSA-N -1 3 355.373 3.783 20 0 FHADHM CC[C@@H](C)C(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1 ZINC000820859030 599220397 /nfs/dbraw/zinc/22/03/97/599220397.db2.gz APAMWQAJHPITQI-LLVKDONJSA-N -1 3 355.373 3.783 20 0 FHADHM CC[C@@H](C)C(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1 ZINC000820859030 599220400 /nfs/dbraw/zinc/22/04/00/599220400.db2.gz APAMWQAJHPITQI-LLVKDONJSA-N -1 3 355.373 3.783 20 0 FHADHM C[C@@H]1C[C@@H]1[C@H](NC(=O)c1sccc1-c1nnn[n-]1)c1ccc(Cl)cc1 ZINC000736233675 599226468 /nfs/dbraw/zinc/22/64/68/599226468.db2.gz GJIRQBGKTVUXJE-BIGNPOOSSA-N -1 3 373.869 3.709 20 0 FHADHM C[C@@H]1C[C@@H]1[C@H](NC(=O)c1sccc1-c1nn[n-]n1)c1ccc(Cl)cc1 ZINC000736233675 599226471 /nfs/dbraw/zinc/22/64/71/599226471.db2.gz GJIRQBGKTVUXJE-BIGNPOOSSA-N -1 3 373.869 3.709 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)N[C@@H](CC1CC1)c1ccccc1 ZINC000737795578 599225125 /nfs/dbraw/zinc/22/51/25/599225125.db2.gz ASURKNCXVSFSBG-HSNDNRACSA-N -1 3 359.433 3.538 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)N[C@@H](CC1CC1)c1ccccc1 ZINC000737795578 599225127 /nfs/dbraw/zinc/22/51/27/599225127.db2.gz ASURKNCXVSFSBG-HSNDNRACSA-N -1 3 359.433 3.538 20 0 FHADHM COc1cccc(CCCSCc2ccc(-c3nnn[n-]3)cc2F)c1 ZINC000821867362 599227082 /nfs/dbraw/zinc/22/70/82/599227082.db2.gz CXBMCYTYDWKPBZ-UHFFFAOYSA-N -1 3 358.442 3.880 20 0 FHADHM COc1cccc(CCCSCc2ccc(-c3nn[n-]n3)cc2F)c1 ZINC000821867362 599227084 /nfs/dbraw/zinc/22/70/84/599227084.db2.gz CXBMCYTYDWKPBZ-UHFFFAOYSA-N -1 3 358.442 3.880 20 0 FHADHM C[C@@H]1C[C@H]1[C@H](NC(=O)c1ccc(-c2nnn[n-]2)cc1)c1ccc(Cl)cc1 ZINC000736237204 599228167 /nfs/dbraw/zinc/22/81/67/599228167.db2.gz VCGVRRNTTKJAPJ-SSKCKEOISA-N -1 3 367.840 3.647 20 0 FHADHM C[C@@H]1C[C@H]1[C@H](NC(=O)c1ccc(-c2nn[n-]n2)cc1)c1ccc(Cl)cc1 ZINC000736237204 599228169 /nfs/dbraw/zinc/22/81/69/599228169.db2.gz VCGVRRNTTKJAPJ-SSKCKEOISA-N -1 3 367.840 3.647 20 0 FHADHM C[C@@H]1C[C@@H]1[C@H](NC(=O)c1ccc(-c2nnn[n-]2)cc1)c1ccc(Cl)cc1 ZINC000736237205 599228610 /nfs/dbraw/zinc/22/86/10/599228610.db2.gz VCGVRRNTTKJAPJ-ZTFRIQLXSA-N -1 3 367.840 3.647 20 0 FHADHM C[C@@H]1C[C@@H]1[C@H](NC(=O)c1ccc(-c2nn[n-]n2)cc1)c1ccc(Cl)cc1 ZINC000736237205 599228612 /nfs/dbraw/zinc/22/86/12/599228612.db2.gz VCGVRRNTTKJAPJ-ZTFRIQLXSA-N -1 3 367.840 3.647 20 0 FHADHM Cc1ccc2[nH]cc(CCC(=O)Nc3cccc(-c4nnn[n-]4)c3C)c2c1 ZINC000822274949 607268413 /nfs/dbraw/zinc/26/84/13/607268413.db2.gz MCOLBCMFXHZFPY-UHFFFAOYSA-N -1 3 360.421 3.536 20 0 FHADHM Cc1ccc2[nH]cc(CCC(=O)Nc3cccc(-c4nn[n-]n4)c3C)c2c1 ZINC000822274949 607268414 /nfs/dbraw/zinc/26/84/14/607268414.db2.gz MCOLBCMFXHZFPY-UHFFFAOYSA-N -1 3 360.421 3.536 20 0 FHADHM Cc1cc(Cl)ccc1NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000822202402 599236184 /nfs/dbraw/zinc/23/61/84/599236184.db2.gz YNELCWPHUBAWQC-NSHDSACASA-N -1 3 356.817 3.711 20 0 FHADHM Cc1cc(Cl)ccc1NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000822202402 599236186 /nfs/dbraw/zinc/23/61/86/599236186.db2.gz YNELCWPHUBAWQC-NSHDSACASA-N -1 3 356.817 3.711 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N[C@@H]1CC(C)(C)c2ccccc21 ZINC000822217868 607266677 /nfs/dbraw/zinc/26/66/77/607266677.db2.gz QBAUEZHVXONMKF-QGZVFWFLSA-N -1 3 362.437 3.719 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N[C@@H]1CC(C)(C)c2ccccc21 ZINC000822217868 607266678 /nfs/dbraw/zinc/26/66/78/607266678.db2.gz QBAUEZHVXONMKF-QGZVFWFLSA-N -1 3 362.437 3.719 20 0 FHADHM CC[C@@H](C)c1ccccc1OCC(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000820882539 607267648 /nfs/dbraw/zinc/26/76/48/607267648.db2.gz SQZYSOMQQFSVLA-CYBMUJFWSA-N -1 3 365.437 3.706 20 0 FHADHM CC[C@@H](C)c1ccccc1OCC(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000820882539 607267649 /nfs/dbraw/zinc/26/76/49/607267649.db2.gz SQZYSOMQQFSVLA-CYBMUJFWSA-N -1 3 365.437 3.706 20 0 FHADHM Cc1cccc(NC(=S)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1C ZINC000822323361 599239730 /nfs/dbraw/zinc/23/97/30/599239730.db2.gz FSGZBFSJYHZAQM-ZDUSSCGKSA-N -1 3 352.467 3.531 20 0 FHADHM Cc1cccc(NC(=S)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1C ZINC000822323361 599239732 /nfs/dbraw/zinc/23/97/32/599239732.db2.gz FSGZBFSJYHZAQM-ZDUSSCGKSA-N -1 3 352.467 3.531 20 0 FHADHM Cc1c(Cl)cccc1NC(=S)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000822034460 599239761 /nfs/dbraw/zinc/23/97/61/599239761.db2.gz DSLFOSHGZOBCMU-LLVKDONJSA-N -1 3 372.885 3.876 20 0 FHADHM Cc1c(Cl)cccc1NC(=S)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000822034460 599239763 /nfs/dbraw/zinc/23/97/63/599239763.db2.gz DSLFOSHGZOBCMU-LLVKDONJSA-N -1 3 372.885 3.876 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)NCC(C)(C)Cc1ccccc1 ZINC000737295456 599242590 /nfs/dbraw/zinc/24/25/90/599242590.db2.gz XQNDIQJQTAWNSK-UHFFFAOYSA-N -1 3 364.453 3.566 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)NCC(C)(C)Cc1ccccc1 ZINC000737295456 599242591 /nfs/dbraw/zinc/24/25/91/599242591.db2.gz XQNDIQJQTAWNSK-UHFFFAOYSA-N -1 3 364.453 3.566 20 0 FHADHM Cc1c(NC(=O)c2cccc(OC3CCCC3)c2)cccc1-c1nnn[n-]1 ZINC000822107866 607270994 /nfs/dbraw/zinc/27/09/94/607270994.db2.gz FSFLWOUSDGOWKU-UHFFFAOYSA-N -1 3 363.421 3.749 20 0 FHADHM Cc1c(NC(=O)c2cccc(OC3CCCC3)c2)cccc1-c1nn[n-]n1 ZINC000822107866 607270995 /nfs/dbraw/zinc/27/09/95/607270995.db2.gz FSFLWOUSDGOWKU-UHFFFAOYSA-N -1 3 363.421 3.749 20 0 FHADHM Cc1cccc(OCCCCC(=O)Nc2cccc(-c3nnn[n-]3)c2C)c1 ZINC000822328458 607271755 /nfs/dbraw/zinc/27/17/55/607271755.db2.gz QGLHYBNSKQPUPM-UHFFFAOYSA-N -1 3 365.437 3.671 20 0 FHADHM Cc1cccc(OCCCCC(=O)Nc2cccc(-c3nn[n-]n3)c2C)c1 ZINC000822328458 607271756 /nfs/dbraw/zinc/27/17/56/607271756.db2.gz QGLHYBNSKQPUPM-UHFFFAOYSA-N -1 3 365.437 3.671 20 0 FHADHM Cc1c(NC(=O)Cc2coc3cc4c(cc23)CCC4)cccc1-c1nnn[n-]1 ZINC000822075391 607269053 /nfs/dbraw/zinc/26/90/53/607269053.db2.gz DHLBDQNLEDCUMF-UHFFFAOYSA-N -1 3 373.416 3.591 20 0 FHADHM Cc1c(NC(=O)Cc2coc3cc4c(cc23)CCC4)cccc1-c1nn[n-]n1 ZINC000822075391 607269054 /nfs/dbraw/zinc/26/90/54/607269054.db2.gz DHLBDQNLEDCUMF-UHFFFAOYSA-N -1 3 373.416 3.591 20 0 FHADHM COc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)/C=C/C1CCCCC1 ZINC000737027038 599246234 /nfs/dbraw/zinc/24/62/34/599246234.db2.gz XWVZRBDEQQIFIN-BQYQJAHWSA-N -1 3 362.817 3.571 20 0 FHADHM COc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)/C=C/C1CCCCC1 ZINC000737027038 599246237 /nfs/dbraw/zinc/24/62/37/599246237.db2.gz XWVZRBDEQQIFIN-BQYQJAHWSA-N -1 3 362.817 3.571 20 0 FHADHM CC[C@@H](NC(=O)Nc1cccc(-c2nnn[n-]2)c1)C(C)(C)c1ccccc1 ZINC000820920001 599247468 /nfs/dbraw/zinc/24/74/68/599247468.db2.gz ITKDYIKMYKSHCD-QGZVFWFLSA-N -1 3 364.453 3.745 20 0 FHADHM CC[C@@H](NC(=O)Nc1cccc(-c2nn[n-]n2)c1)C(C)(C)c1ccccc1 ZINC000820920001 599247470 /nfs/dbraw/zinc/24/74/70/599247470.db2.gz ITKDYIKMYKSHCD-QGZVFWFLSA-N -1 3 364.453 3.745 20 0 FHADHM CCCc1ccc(NC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000821138820 599250045 /nfs/dbraw/zinc/25/00/45/599250045.db2.gz ICRIASMNYYCFHU-CYBMUJFWSA-N -1 3 350.426 3.702 20 0 FHADHM CCCc1ccc(NC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000821138820 599250048 /nfs/dbraw/zinc/25/00/48/599250048.db2.gz ICRIASMNYYCFHU-CYBMUJFWSA-N -1 3 350.426 3.702 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)N[C@@H]1CC[C@@H]2CCC[C@@H]2C1 ZINC000823308466 599251361 /nfs/dbraw/zinc/25/13/61/599251361.db2.gz BDYKAQNHOWRFAW-QJPTWQEYSA-N -1 3 360.849 3.610 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)N[C@@H]1CC[C@@H]2CCC[C@@H]2C1 ZINC000823308466 599251363 /nfs/dbraw/zinc/25/13/63/599251363.db2.gz BDYKAQNHOWRFAW-QJPTWQEYSA-N -1 3 360.849 3.610 20 0 FHADHM CC[C@](C)(NC(=O)Nc1cccc(-c2nnn[n-]2)c1C)c1ccccc1 ZINC000820852703 607280530 /nfs/dbraw/zinc/28/05/30/607280530.db2.gz FNIHSKZNEOEEBG-IBGZPJMESA-N -1 3 350.426 3.622 20 0 FHADHM CC[C@](C)(NC(=O)Nc1cccc(-c2nn[n-]n2)c1C)c1ccccc1 ZINC000820852703 607280531 /nfs/dbraw/zinc/28/05/31/607280531.db2.gz FNIHSKZNEOEEBG-IBGZPJMESA-N -1 3 350.426 3.622 20 0 FHADHM Cc1c(NC(=O)N[C@H]2CCSc3ccccc32)cccc1-c1nnn[n-]1 ZINC000822092724 607281557 /nfs/dbraw/zinc/28/15/57/607281557.db2.gz YTIDMLSLRTTYMO-HNNXBMFYSA-N -1 3 366.450 3.534 20 0 FHADHM Cc1c(NC(=O)N[C@H]2CCSc3ccccc32)cccc1-c1nn[n-]n1 ZINC000822092724 607281558 /nfs/dbraw/zinc/28/15/58/607281558.db2.gz YTIDMLSLRTTYMO-HNNXBMFYSA-N -1 3 366.450 3.534 20 0 FHADHM CC(C)Oc1ccccc1NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820178595 599254029 /nfs/dbraw/zinc/25/40/29/599254029.db2.gz VKSBACNMXWFZKN-CYBMUJFWSA-N -1 3 366.425 3.537 20 0 FHADHM CC(C)Oc1ccccc1NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820178595 599254031 /nfs/dbraw/zinc/25/40/31/599254031.db2.gz VKSBACNMXWFZKN-CYBMUJFWSA-N -1 3 366.425 3.537 20 0 FHADHM Cc1c(NC(=O)N2C[C@@H](c3ccccc3)C[C@H]2C)cccc1-c1nnn[n-]1 ZINC000822085168 607286370 /nfs/dbraw/zinc/28/63/70/607286370.db2.gz WPTICRQEOLBCJA-CJNGLKHVSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1c(NC(=O)N2C[C@@H](c3ccccc3)C[C@H]2C)cccc1-c1nn[n-]n1 ZINC000822085168 607286371 /nfs/dbraw/zinc/28/63/71/607286371.db2.gz WPTICRQEOLBCJA-CJNGLKHVSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1c(NC(=O)N(C)[C@@H](C)c2cc(F)ccc2F)cccc1-c1nnn[n-]1 ZINC000822077815 607286488 /nfs/dbraw/zinc/28/64/88/607286488.db2.gz YMCPHZKCWMTHPG-NSHDSACASA-N -1 3 372.379 3.678 20 0 FHADHM Cc1c(NC(=O)N(C)[C@@H](C)c2cc(F)ccc2F)cccc1-c1nn[n-]n1 ZINC000822077815 607286489 /nfs/dbraw/zinc/28/64/89/607286489.db2.gz YMCPHZKCWMTHPG-NSHDSACASA-N -1 3 372.379 3.678 20 0 FHADHM Cc1c(NC(=O)N2CCCCC[C@H]2c2ccco2)cccc1-c1nnn[n-]1 ZINC000822084487 607290133 /nfs/dbraw/zinc/29/01/33/607290133.db2.gz LBHOSHNZELYQSD-INIZCTEOSA-N -1 3 366.425 3.917 20 0 FHADHM Cc1c(NC(=O)N2CCCCC[C@H]2c2ccco2)cccc1-c1nn[n-]n1 ZINC000822084487 607290134 /nfs/dbraw/zinc/29/01/34/607290134.db2.gz LBHOSHNZELYQSD-INIZCTEOSA-N -1 3 366.425 3.917 20 0 FHADHM CCN(Cc1c(F)cccc1F)C(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000821222473 607292016 /nfs/dbraw/zinc/29/20/16/607292016.db2.gz UODKKMZZWJOCAW-UHFFFAOYSA-N -1 3 372.379 3.507 20 0 FHADHM CCN(Cc1c(F)cccc1F)C(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000821222473 607292017 /nfs/dbraw/zinc/29/20/17/607292017.db2.gz UODKKMZZWJOCAW-UHFFFAOYSA-N -1 3 372.379 3.507 20 0 FHADHM Cc1c(NC(=O)N[C@H](c2ccccc2)C2CCC2)cccc1-c1nnn[n-]1 ZINC000822091945 607292535 /nfs/dbraw/zinc/29/25/35/607292535.db2.gz VDSXIWNARAHNKD-GOSISDBHSA-N -1 3 362.437 3.838 20 0 FHADHM Cc1c(NC(=O)N[C@H](c2ccccc2)C2CCC2)cccc1-c1nn[n-]n1 ZINC000822091945 607292536 /nfs/dbraw/zinc/29/25/36/607292536.db2.gz VDSXIWNARAHNKD-GOSISDBHSA-N -1 3 362.437 3.838 20 0 FHADHM Cc1cccc([C@H](C)NC(=O)Nc2cccc(-c3nnn[n-]3)c2C)c1C ZINC000822289289 607292599 /nfs/dbraw/zinc/29/25/99/607292599.db2.gz VOYAGTBOPVBCLK-AWEZNQCLSA-N -1 3 350.426 3.675 20 0 FHADHM Cc1cccc([C@H](C)NC(=O)Nc2cccc(-c3nn[n-]n3)c2C)c1C ZINC000822289289 607292600 /nfs/dbraw/zinc/29/26/00/607292600.db2.gz VOYAGTBOPVBCLK-AWEZNQCLSA-N -1 3 350.426 3.675 20 0 FHADHM Cc1cccc([C@@H]2CCCCCN2C(=O)c2sccc2-c2nnn[n-]2)c1 ZINC000737388609 599262635 /nfs/dbraw/zinc/26/26/35/599262635.db2.gz GIBNBOCYAVLYPL-INIZCTEOSA-N -1 3 367.478 3.994 20 0 FHADHM Cc1cccc([C@@H]2CCCCCN2C(=O)c2sccc2-c2nn[n-]n2)c1 ZINC000737388609 599262638 /nfs/dbraw/zinc/26/26/38/599262638.db2.gz GIBNBOCYAVLYPL-INIZCTEOSA-N -1 3 367.478 3.994 20 0 FHADHM CCN(C(=O)CCCC[C@H](C)C(C)=O)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821154787 607299659 /nfs/dbraw/zinc/29/96/59/607299659.db2.gz RNRHRFSUUPGLAY-GJZGRUSLSA-N -1 3 371.485 3.562 20 0 FHADHM CCN(C(=O)CCCC[C@H](C)C(C)=O)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821154787 607299660 /nfs/dbraw/zinc/29/96/60/607299660.db2.gz RNRHRFSUUPGLAY-GJZGRUSLSA-N -1 3 371.485 3.562 20 0 FHADHM CCC[C@@H]1[C@@H](C)CCCN1C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821033774 599263070 /nfs/dbraw/zinc/26/30/70/599263070.db2.gz FDYJKXWUTMTKMS-JJRVBVJISA-N -1 3 356.474 3.538 20 0 FHADHM CCC[C@@H]1[C@@H](C)CCCN1C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821033774 599263072 /nfs/dbraw/zinc/26/30/72/599263072.db2.gz FDYJKXWUTMTKMS-JJRVBVJISA-N -1 3 356.474 3.538 20 0 FHADHM FC(F)Oc1ccc(NCc2ccc(-c3nnn[n-]3)s2)cc1Cl ZINC000822736875 607308272 /nfs/dbraw/zinc/30/82/72/607308272.db2.gz LNNQTAYTEPOREG-UHFFFAOYSA-N -1 3 357.773 3.795 20 0 FHADHM CCOc1ccc(NCc2ccc(OC)c(-c3nnn[n-]3)c2)cc1Cl ZINC000821422334 607308894 /nfs/dbraw/zinc/30/88/94/607308894.db2.gz URYHWOZMBJRCNX-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM CCOc1ccc(NCc2ccc(OC)c(-c3nn[n-]n3)c2)cc1Cl ZINC000821422334 607308895 /nfs/dbraw/zinc/30/88/95/607308895.db2.gz URYHWOZMBJRCNX-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM Cc1nc(-c2cccc(NCc3cc(-c4nnn[n-]4)cs3)c2)cs1 ZINC000822420052 607309451 /nfs/dbraw/zinc/30/94/51/607309451.db2.gz ZIDLAJSGZXVUAU-UHFFFAOYSA-N -1 3 354.464 3.972 20 0 FHADHM Cc1nc(-c2cccc(NCc3cc(-c4nn[n-]n4)cs3)c2)cs1 ZINC000822420052 607309452 /nfs/dbraw/zinc/30/94/52/607309452.db2.gz ZIDLAJSGZXVUAU-UHFFFAOYSA-N -1 3 354.464 3.972 20 0 FHADHM COc1ccc(CNc2ccc3oc(C(C)C)nc3c2)cc1-c1nnn[n-]1 ZINC000821821842 607309837 /nfs/dbraw/zinc/30/98/37/607309837.db2.gz ZODPMYPKZCCBQH-UHFFFAOYSA-N -1 3 364.409 3.752 20 0 FHADHM COc1ccc(CNc2ccc3oc(C(C)C)nc3c2)cc1-c1nn[n-]n1 ZINC000821821842 607309838 /nfs/dbraw/zinc/30/98/38/607309838.db2.gz ZODPMYPKZCCBQH-UHFFFAOYSA-N -1 3 364.409 3.752 20 0 FHADHM Cc1ccc(NCc2ccc(-c3nnn[n-]3)s2)cc1Br ZINC000822255061 607311664 /nfs/dbraw/zinc/31/16/64/607311664.db2.gz UMMXWROGYDQPDX-UHFFFAOYSA-N -1 3 350.245 3.611 20 0 FHADHM Cc1ccc(NCc2ccc(-c3nnn[n-]3)s2)c(OCC(F)(F)F)c1 ZINC000822254152 607314184 /nfs/dbraw/zinc/31/41/84/607314184.db2.gz BGZXNCGQFUQVNS-UHFFFAOYSA-N -1 3 369.372 3.790 20 0 FHADHM c1c(-c2cccc(NCc3ccc(-c4nnn[n-]4)cc3)c2)nc2n1CCCC2 ZINC000823756514 607314697 /nfs/dbraw/zinc/31/46/97/607314697.db2.gz AVSBVJMEWAGPDB-UHFFFAOYSA-N -1 3 371.448 3.679 20 0 FHADHM c1c(-c2cccc(NCc3ccc(-c4nn[n-]n4)cc3)c2)nc2n1CCCC2 ZINC000823756514 607314698 /nfs/dbraw/zinc/31/46/98/607314698.db2.gz AVSBVJMEWAGPDB-UHFFFAOYSA-N -1 3 371.448 3.679 20 0 FHADHM FC(F)(F)c1cc(-c2nn[n-]n2)ccc1NCc1ccc2c(c1)COC2 ZINC000822718907 607305614 /nfs/dbraw/zinc/30/56/14/607305614.db2.gz USDHQYOTRJIFAO-UHFFFAOYSA-N -1 3 361.327 3.528 20 0 FHADHM Cc1ccc(NC(=O)C(C)(C)C)cc1NCc1ccc(-c2nnn[n-]2)s1 ZINC000822242695 607317274 /nfs/dbraw/zinc/31/72/74/607317274.db2.gz USTQZSWPUPXAPW-UHFFFAOYSA-N -1 3 370.482 3.833 20 0 FHADHM c1cc(-c2nnn[n-]2)sc1CNc1cccc(N2CCCCCC2)c1 ZINC000823756540 607318104 /nfs/dbraw/zinc/31/81/04/607318104.db2.gz BDQNGMYQLXNOID-UHFFFAOYSA-N -1 3 354.483 3.921 20 0 FHADHM Cc1ccccc1-n1cnnc1S[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000737416038 599286070 /nfs/dbraw/zinc/28/60/70/599286070.db2.gz VZRDLMBHIBRKSH-CYBMUJFWSA-N -1 3 363.450 3.609 20 0 FHADHM Cc1ccccc1-n1cnnc1S[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000737416038 599286071 /nfs/dbraw/zinc/28/60/71/599286071.db2.gz VZRDLMBHIBRKSH-CYBMUJFWSA-N -1 3 363.450 3.609 20 0 FHADHM COc1cc2ccccc2cc1C(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000821727692 607321180 /nfs/dbraw/zinc/32/11/80/607321180.db2.gz MLQBKNFBZMQEKW-UHFFFAOYSA-N -1 3 359.389 3.589 20 0 FHADHM COc1cc2ccccc2cc1C(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000821727692 607321181 /nfs/dbraw/zinc/32/11/81/607321181.db2.gz MLQBKNFBZMQEKW-UHFFFAOYSA-N -1 3 359.389 3.589 20 0 FHADHM CCC(CC)n1ccc(CSCCOc2cccc(-c3nnn[n-]3)c2)n1 ZINC000820897508 607325841 /nfs/dbraw/zinc/32/58/41/607325841.db2.gz HTURGKQHKLNZAF-UHFFFAOYSA-N -1 3 372.498 3.737 20 0 FHADHM CCC(CC)n1ccc(CSCCOc2cccc(-c3nn[n-]n3)c2)n1 ZINC000820897508 607325842 /nfs/dbraw/zinc/32/58/42/607325842.db2.gz HTURGKQHKLNZAF-UHFFFAOYSA-N -1 3 372.498 3.737 20 0 FHADHM CC(C)NC(=O)Nc1ccc([C@@H](C)NCc2cccc(C(=O)[O-])c2)cc1 ZINC000820029877 598191885 /nfs/dbraw/zinc/19/18/85/598191885.db2.gz UZCDLEAMZNRODD-CQSZACIVSA-N -1 3 355.438 3.766 20 0 FHADHM C[C@H](NCc1cccc(C(=O)[O-])c1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000263494221 598191979 /nfs/dbraw/zinc/19/19/79/598191979.db2.gz SESUVZSNTPGLFL-ZDUSSCGKSA-N -1 3 353.422 3.520 20 0 FHADHM COc1ccc2ccccc2c1-c1cc(CN2CCC(C(=O)[O-])CC2)on1 ZINC000567856763 598205640 /nfs/dbraw/zinc/20/56/40/598205640.db2.gz QTBAZDZGJLSEED-UHFFFAOYSA-N -1 3 366.417 3.800 20 0 FHADHM O=C(Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)[C@@H]1CC=CCC1 ZINC000738183517 598231276 /nfs/dbraw/zinc/23/12/76/598231276.db2.gz IUADQHJDWGHQFQ-OAHLLOKOSA-N -1 3 361.405 3.954 20 0 FHADHM O=C(Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)[C@@H]1CC=CCC1 ZINC000738183517 598231278 /nfs/dbraw/zinc/23/12/78/598231278.db2.gz IUADQHJDWGHQFQ-OAHLLOKOSA-N -1 3 361.405 3.954 20 0 FHADHM O=C(N[C@H](c1ccc(Cl)cc1)C1CCC1)c1cccc(-c2nnn[n-]2)c1 ZINC000737999376 598235758 /nfs/dbraw/zinc/23/57/58/598235758.db2.gz UHJTZZWHCGUINN-KRWDZBQOSA-N -1 3 367.840 3.791 20 0 FHADHM O=C(N[C@H](c1ccc(Cl)cc1)C1CCC1)c1cccc(-c2nn[n-]n2)c1 ZINC000737999376 598235759 /nfs/dbraw/zinc/23/57/59/598235759.db2.gz UHJTZZWHCGUINN-KRWDZBQOSA-N -1 3 367.840 3.791 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1N1CCc2[nH]c3ccc(Cl)cc3c2C1 ZINC000737641235 598239485 /nfs/dbraw/zinc/23/94/85/598239485.db2.gz VLSRSCIVNUNYND-UHFFFAOYSA-N -1 3 368.803 3.703 20 0 FHADHM Clc1ccc2[nH]c3c(c2c1)CN(Cc1cccc(-c2nnn[n-]2)c1)CC3 ZINC000737574752 598252968 /nfs/dbraw/zinc/25/29/68/598252968.db2.gz SERAMOFRGWCDHX-UHFFFAOYSA-N -1 3 364.840 3.560 20 0 FHADHM Clc1ccc2[nH]c3c(c2c1)CN(Cc1cccc(-c2nn[n-]n2)c1)CC3 ZINC000737574752 598252970 /nfs/dbraw/zinc/25/29/70/598252970.db2.gz SERAMOFRGWCDHX-UHFFFAOYSA-N -1 3 364.840 3.560 20 0 FHADHM CCCN(CC)C(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736470985 598266842 /nfs/dbraw/zinc/26/68/42/598266842.db2.gz QQTGDRSHISYZHJ-UHFFFAOYSA-N -1 3 366.425 3.923 20 0 FHADHM CCCN(CC)C(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736470985 598266844 /nfs/dbraw/zinc/26/68/44/598266844.db2.gz QQTGDRSHISYZHJ-UHFFFAOYSA-N -1 3 366.425 3.923 20 0 FHADHM CCCCCNC(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736451353 598267449 /nfs/dbraw/zinc/26/74/49/598267449.db2.gz LLFFYVSRSGRVHO-UHFFFAOYSA-N -1 3 366.425 3.971 20 0 FHADHM CCCCCNC(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736451353 598267450 /nfs/dbraw/zinc/26/74/50/598267450.db2.gz LLFFYVSRSGRVHO-UHFFFAOYSA-N -1 3 366.425 3.971 20 0 FHADHM COCc1ccccc1CNc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000737021784 598275272 /nfs/dbraw/zinc/27/52/72/598275272.db2.gz BPYQVVWOLGERBI-UHFFFAOYSA-N -1 3 363.343 3.644 20 0 FHADHM COCc1ccccc1CNc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000737021784 598275274 /nfs/dbraw/zinc/27/52/74/598275274.db2.gz BPYQVVWOLGERBI-UHFFFAOYSA-N -1 3 363.343 3.644 20 0 FHADHM Fc1ccc(OCCNc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)cc1 ZINC000737656608 598275702 /nfs/dbraw/zinc/27/57/02/598275702.db2.gz PBXOEIFODNQJFB-UHFFFAOYSA-N -1 3 367.306 3.516 20 0 FHADHM Clc1cc(NCc2ccnc(N3CCCCC3)c2)ccc1-c1nnn[n-]1 ZINC000737564996 598277255 /nfs/dbraw/zinc/27/72/55/598277255.db2.gz LWFXFCYLOCHPIQ-UHFFFAOYSA-N -1 3 369.860 3.518 20 0 FHADHM Clc1cc(NCc2ccnc(N3CCCCC3)c2)ccc1-c1nn[n-]n1 ZINC000737564996 598277256 /nfs/dbraw/zinc/27/72/56/598277256.db2.gz LWFXFCYLOCHPIQ-UHFFFAOYSA-N -1 3 369.860 3.518 20 0 FHADHM Cc1ccc(CCC(=O)N(C)c2ccc(-c3nnn[n-]3)cc2F)cc1Cl ZINC000737334562 598282414 /nfs/dbraw/zinc/28/24/14/598282414.db2.gz IWKABJHJPOPVAG-UHFFFAOYSA-N -1 3 373.819 3.563 20 0 FHADHM Cc1ccc(CCC(=O)N(C)c2ccc(-c3nn[n-]n3)cc2F)cc1Cl ZINC000737334562 598282416 /nfs/dbraw/zinc/28/24/16/598282416.db2.gz IWKABJHJPOPVAG-UHFFFAOYSA-N -1 3 373.819 3.563 20 0 FHADHM CC[C@H](C)Oc1ccccc1C=CC(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000729833918 598296666 /nfs/dbraw/zinc/29/66/66/598296666.db2.gz NZVIKAYDFKVYIH-GETOMWPZSA-N -1 3 363.421 3.696 20 0 FHADHM CC[C@H](C)Oc1ccccc1C=CC(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000729833918 598296667 /nfs/dbraw/zinc/29/66/67/598296667.db2.gz NZVIKAYDFKVYIH-GETOMWPZSA-N -1 3 363.421 3.696 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)cc1CSCc1nc(-c2cccs2)no1 ZINC000737650137 598314267 /nfs/dbraw/zinc/31/42/67/598314267.db2.gz NUIHANIUJRVQKQ-UHFFFAOYSA-N -1 3 374.426 3.551 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CSCc1nc(-c2cccs2)no1 ZINC000737650137 598314268 /nfs/dbraw/zinc/31/42/68/598314268.db2.gz NUIHANIUJRVQKQ-UHFFFAOYSA-N -1 3 374.426 3.551 20 0 FHADHM Cc1ccccc1[C@H](C)NC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000737421394 598317605 /nfs/dbraw/zinc/31/76/05/598317605.db2.gz LYFXPXNYPUCBJI-NSHDSACASA-N -1 3 372.885 3.876 20 0 FHADHM Cc1ccccc1[C@H](C)NC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000737421394 598317607 /nfs/dbraw/zinc/31/76/07/598317607.db2.gz LYFXPXNYPUCBJI-NSHDSACASA-N -1 3 372.885 3.876 20 0 FHADHM C[C@@H]1CCCC[C@H]1CNC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736269944 598321905 /nfs/dbraw/zinc/32/19/05/598321905.db2.gz HQGQMUICTWDBMH-MNOVXSKESA-N -1 3 364.906 3.633 20 0 FHADHM C[C@@H]1CCCC[C@H]1CNC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736269944 598321906 /nfs/dbraw/zinc/32/19/06/598321906.db2.gz HQGQMUICTWDBMH-MNOVXSKESA-N -1 3 364.906 3.633 20 0 FHADHM CCC1(C)CCN(C(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)CC1 ZINC000736397793 598323689 /nfs/dbraw/zinc/32/36/89/598323689.db2.gz VRQJWHLTKZRCKU-UHFFFAOYSA-N -1 3 364.906 3.729 20 0 FHADHM CCC1(C)CCN(C(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)CC1 ZINC000736397793 598323692 /nfs/dbraw/zinc/32/36/92/598323692.db2.gz VRQJWHLTKZRCKU-UHFFFAOYSA-N -1 3 364.906 3.729 20 0 FHADHM CC/C=C/CCOC(=O)c1occc1COc1cccc(-c2nnn[n-]2)c1 ZINC000736411889 598363010 /nfs/dbraw/zinc/36/30/10/598363010.db2.gz PYERPEBKENJMIM-ONEGZZNKSA-N -1 3 368.393 3.552 20 0 FHADHM CC/C=C/CCOC(=O)c1occc1COc1cccc(-c2nn[n-]n2)c1 ZINC000736411889 598363011 /nfs/dbraw/zinc/36/30/11/598363011.db2.gz PYERPEBKENJMIM-ONEGZZNKSA-N -1 3 368.393 3.552 20 0 FHADHM CN(Cc1ccccc1C(F)(F)F)c1ncc(-c2nnn[n-]2)cc1Cl ZINC000736827668 598387567 /nfs/dbraw/zinc/38/75/67/598387567.db2.gz GEWSHUXAZGCZPJ-UHFFFAOYSA-N -1 3 368.750 3.570 20 0 FHADHM CN(Cc1ccccc1C(F)(F)F)c1ncc(-c2nn[n-]n2)cc1Cl ZINC000736827668 598387568 /nfs/dbraw/zinc/38/75/68/598387568.db2.gz GEWSHUXAZGCZPJ-UHFFFAOYSA-N -1 3 368.750 3.570 20 0 FHADHM Fc1cc(-c2nnn[n-]2)cc(F)c1NCc1ccc(Br)cc1 ZINC000737638881 598388144 /nfs/dbraw/zinc/38/81/44/598388144.db2.gz IVZDFZDIPADBCO-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1cc(-c2nn[n-]n2)cc(F)c1NCc1ccc(Br)cc1 ZINC000737638881 598388145 /nfs/dbraw/zinc/38/81/45/598388145.db2.gz IVZDFZDIPADBCO-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM C[C@@H](Nc1ncc(-c2nnn[n-]2)cc1Cl)c1ccc(F)c(Cl)c1 ZINC000736137444 598391848 /nfs/dbraw/zinc/39/18/48/598391848.db2.gz MGDUGDIVVHHRDT-SSDOTTSWSA-N -1 3 353.188 3.881 20 0 FHADHM C[C@@H](Nc1ncc(-c2nn[n-]n2)cc1Cl)c1ccc(F)c(Cl)c1 ZINC000736137444 598391850 /nfs/dbraw/zinc/39/18/50/598391850.db2.gz MGDUGDIVVHHRDT-SSDOTTSWSA-N -1 3 353.188 3.881 20 0 FHADHM Cc1ccc(C)c(CS[C@H](C)C(=O)Nc2cccc(-c3nnn[n-]3)c2)c1 ZINC000737322733 598393071 /nfs/dbraw/zinc/39/30/71/598393071.db2.gz MPSMCAHUQHVCGP-CQSZACIVSA-N -1 3 367.478 3.744 20 0 FHADHM Cc1ccc(C)c(CS[C@H](C)C(=O)Nc2cccc(-c3nn[n-]n3)c2)c1 ZINC000737322733 598393072 /nfs/dbraw/zinc/39/30/72/598393072.db2.gz MPSMCAHUQHVCGP-CQSZACIVSA-N -1 3 367.478 3.744 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1OCc1cc(Cl)c2c(c1)OCCCO2 ZINC000737220797 598394790 /nfs/dbraw/zinc/39/47/90/598394790.db2.gz FIEGTSYHRZFSMK-UHFFFAOYSA-N -1 3 372.812 3.569 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1OCc1cc(-c2ccc(F)cc2)no1 ZINC000737221088 598395074 /nfs/dbraw/zinc/39/50/74/598395074.db2.gz FRMQNYCBNNDNSO-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM CSc1ccccc1NC(=O)[C@@H](C)Sc1ccc(-c2nnn[n-]2)cc1 ZINC000737189851 598414736 /nfs/dbraw/zinc/41/47/36/598414736.db2.gz CTAFCPRMKMKEMM-LLVKDONJSA-N -1 3 371.491 3.708 20 0 FHADHM CSc1ccccc1NC(=O)[C@@H](C)Sc1ccc(-c2nn[n-]n2)cc1 ZINC000737189851 598414738 /nfs/dbraw/zinc/41/47/38/598414738.db2.gz CTAFCPRMKMKEMM-LLVKDONJSA-N -1 3 371.491 3.708 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1ccc(F)cc1Cl ZINC000737196285 598416410 /nfs/dbraw/zinc/41/64/10/598416410.db2.gz DDJSHMZDJAJBHZ-WDDYJBPVSA-N -1 3 372.787 3.977 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1ccc(F)cc1Cl ZINC000737196285 598416411 /nfs/dbraw/zinc/41/64/11/598416411.db2.gz DDJSHMZDJAJBHZ-WDDYJBPVSA-N -1 3 372.787 3.977 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)c1sccc1SC(F)F ZINC000737295744 598422157 /nfs/dbraw/zinc/42/21/57/598422157.db2.gz ZIWNPAVKYCGTHX-UHFFFAOYSA-N -1 3 367.406 3.804 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)c1sccc1SC(F)F ZINC000737295744 598422159 /nfs/dbraw/zinc/42/21/59/598422159.db2.gz ZIWNPAVKYCGTHX-UHFFFAOYSA-N -1 3 367.406 3.804 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)NCCC1=CCCCC1 ZINC000735873570 598427288 /nfs/dbraw/zinc/42/72/88/598427288.db2.gz CIJDGMJVVSBVJV-UHFFFAOYSA-N -1 3 368.485 3.677 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)NCCC1=CCCCC1 ZINC000735873570 598427290 /nfs/dbraw/zinc/42/72/90/598427290.db2.gz CIJDGMJVVSBVJV-UHFFFAOYSA-N -1 3 368.485 3.677 20 0 FHADHM Cc1ccccc1-c1nc(C(=O)Nc2sccc2-c2nnn[n-]2)cs1 ZINC000737418905 598441929 /nfs/dbraw/zinc/44/19/29/598441929.db2.gz RWINQHFHSASNOV-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM Cc1ccccc1-c1nc(C(=O)Nc2sccc2-c2nn[n-]n2)cs1 ZINC000737418905 598441931 /nfs/dbraw/zinc/44/19/31/598441931.db2.gz RWINQHFHSASNOV-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM CC(C)n1cc(NC(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)cn1 ZINC000735961228 598443697 /nfs/dbraw/zinc/44/36/97/598443697.db2.gz OFWRJDPRTARNOG-UHFFFAOYSA-N -1 3 373.420 3.563 20 0 FHADHM CC(C)n1cc(NC(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)cn1 ZINC000735961228 598443699 /nfs/dbraw/zinc/44/36/99/598443699.db2.gz OFWRJDPRTARNOG-UHFFFAOYSA-N -1 3 373.420 3.563 20 0 FHADHM Fc1cccc(Sc2cc3c(cc2Cl)OCCO3)c1-c1nnn[n-]1 ZINC000737666562 598456572 /nfs/dbraw/zinc/45/65/72/598456572.db2.gz ZUPJYFHXCDKQKN-UHFFFAOYSA-N -1 3 364.789 3.582 20 0 FHADHM Clc1cccc(-c2cnc(COc3cccc(-c4nnn[n-]4)c3)o2)c1 ZINC000737574402 598465505 /nfs/dbraw/zinc/46/55/05/598465505.db2.gz JZIONSIIUPXROG-UHFFFAOYSA-N -1 3 353.769 3.754 20 0 FHADHM Clc1cccc(-c2cnc(COc3cccc(-c4nn[n-]n4)c3)o2)c1 ZINC000737574402 598465506 /nfs/dbraw/zinc/46/55/06/598465506.db2.gz JZIONSIIUPXROG-UHFFFAOYSA-N -1 3 353.769 3.754 20 0 FHADHM Cc1ccc(C)c(NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)c1 ZINC000737325188 598475433 /nfs/dbraw/zinc/47/54/33/598475433.db2.gz AUCDAVNVOJMECG-UHFFFAOYSA-N -1 3 362.437 3.680 20 0 FHADHM Cc1ccc(C)c(NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)c1 ZINC000737325188 598475438 /nfs/dbraw/zinc/47/54/38/598475438.db2.gz AUCDAVNVOJMECG-UHFFFAOYSA-N -1 3 362.437 3.680 20 0 FHADHM CC[C@@](C)(NC(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccccc1 ZINC000736314012 598483811 /nfs/dbraw/zinc/48/38/11/598483811.db2.gz HXJQMVZKUDJFFK-GOSISDBHSA-N -1 3 370.844 3.967 20 0 FHADHM CC[C@@](C)(NC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccccc1 ZINC000736314012 598483813 /nfs/dbraw/zinc/48/38/13/598483813.db2.gz HXJQMVZKUDJFFK-GOSISDBHSA-N -1 3 370.844 3.967 20 0 FHADHM Cc1ccc(C(=O)CCC(=O)O[C@H](C)c2cccc(-c3nnn[n-]3)c2)s1 ZINC000737308352 598486834 /nfs/dbraw/zinc/48/68/34/598486834.db2.gz LFTRTZARHLSMMY-GFCCVEGCSA-N -1 3 370.434 3.504 20 0 FHADHM Cc1ccc(C(=O)CCC(=O)O[C@H](C)c2cccc(-c3nn[n-]n3)c2)s1 ZINC000737308352 598486836 /nfs/dbraw/zinc/48/68/36/598486836.db2.gz LFTRTZARHLSMMY-GFCCVEGCSA-N -1 3 370.434 3.504 20 0 FHADHM C[C@@H](OC(=O)CCOc1ccc(Cl)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000736148285 598487298 /nfs/dbraw/zinc/48/72/98/598487298.db2.gz GRWVRKPLLRXOHX-GFCCVEGCSA-N -1 3 372.812 3.593 20 0 FHADHM C[C@@H](OC(=O)CCOc1ccc(Cl)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000736148285 598487299 /nfs/dbraw/zinc/48/72/99/598487299.db2.gz GRWVRKPLLRXOHX-GFCCVEGCSA-N -1 3 372.812 3.593 20 0 FHADHM COc1cccc2cc(C(=O)O[C@@H](C)c3cccc(-c4nnn[n-]4)c3)oc21 ZINC000737141390 598488216 /nfs/dbraw/zinc/48/82/16/598488216.db2.gz CQMYVWQASATUTO-NSHDSACASA-N -1 3 364.361 3.540 20 0 FHADHM COc1cccc2cc(C(=O)O[C@@H](C)c3cccc(-c4nn[n-]n4)c3)oc21 ZINC000737141390 598488218 /nfs/dbraw/zinc/48/82/18/598488218.db2.gz CQMYVWQASATUTO-NSHDSACASA-N -1 3 364.361 3.540 20 0 FHADHM C[C@H](OC(=O)CSCc1ccc(F)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000736155427 598489024 /nfs/dbraw/zinc/48/90/24/598489024.db2.gz NFYPXIMSQBIGFL-LBPRGKRZSA-N -1 3 372.425 3.543 20 0 FHADHM C[C@H](OC(=O)CSCc1ccc(F)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000736155427 598489026 /nfs/dbraw/zinc/48/90/26/598489026.db2.gz NFYPXIMSQBIGFL-LBPRGKRZSA-N -1 3 372.425 3.543 20 0 FHADHM CSc1ccc(C)c(C(=O)O[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000737193484 598489747 /nfs/dbraw/zinc/48/97/47/598489747.db2.gz SXBMWRCWXLQINS-GFCCVEGCSA-N -1 3 354.435 3.815 20 0 FHADHM CSc1ccc(C)c(C(=O)O[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000737193484 598489748 /nfs/dbraw/zinc/48/97/48/598489748.db2.gz SXBMWRCWXLQINS-GFCCVEGCSA-N -1 3 354.435 3.815 20 0 FHADHM CCCc1ccc(C(=O)Nc2cc(-c3nnn[n-]3)cn2C(C)(C)C)cc1 ZINC000736498221 598489961 /nfs/dbraw/zinc/48/99/61/598489961.db2.gz WMYXKWKPTQCSOQ-UHFFFAOYSA-N -1 3 352.442 3.628 20 0 FHADHM CCCc1ccc(C(=O)Nc2cc(-c3nn[n-]n3)cn2C(C)(C)C)cc1 ZINC000736498221 598489962 /nfs/dbraw/zinc/48/99/62/598489962.db2.gz WMYXKWKPTQCSOQ-UHFFFAOYSA-N -1 3 352.442 3.628 20 0 FHADHM C[C@H](Oc1cccc(Cl)c1)C(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000736180422 598491775 /nfs/dbraw/zinc/49/17/75/598491775.db2.gz ILEPSSISNIGYIT-RYUDHWBXSA-N -1 3 372.812 3.592 20 0 FHADHM C[C@H](Oc1cccc(Cl)c1)C(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000736180422 598491776 /nfs/dbraw/zinc/49/17/76/598491776.db2.gz ILEPSSISNIGYIT-RYUDHWBXSA-N -1 3 372.812 3.592 20 0 FHADHM Cc1ccc(N(C(=O)c2cccc(-c3nnn[n-]3)c2)C2CCCCC2)nc1 ZINC000737346582 598494977 /nfs/dbraw/zinc/49/49/77/598494977.db2.gz HXALSIHARHLFJS-UHFFFAOYSA-N -1 3 362.437 3.550 20 0 FHADHM Cc1ccc(N(C(=O)c2cccc(-c3nn[n-]n3)c2)C2CCCCC2)nc1 ZINC000737346582 598494978 /nfs/dbraw/zinc/49/49/78/598494978.db2.gz HXALSIHARHLFJS-UHFFFAOYSA-N -1 3 362.437 3.550 20 0 FHADHM CCc1ccc([C@@H](C)C(=O)Nc2sc(C)c(C)c2-c2nnn[n-]2)cc1 ZINC000736686210 598496706 /nfs/dbraw/zinc/49/67/06/598496706.db2.gz KCPUMNJLSJCSDQ-LLVKDONJSA-N -1 3 355.467 3.850 20 0 FHADHM CCc1ccc([C@@H](C)C(=O)Nc2sc(C)c(C)c2-c2nn[n-]n2)cc1 ZINC000736686210 598496709 /nfs/dbraw/zinc/49/67/09/598496709.db2.gz KCPUMNJLSJCSDQ-LLVKDONJSA-N -1 3 355.467 3.850 20 0 FHADHM COc1ccc([C@H]2CCCN2c2ccc(-c3nnn[n-]3)c(Cl)c2)cc1 ZINC000737078046 598506535 /nfs/dbraw/zinc/50/65/35/598506535.db2.gz YFPXJNBQXZPVLA-QGZVFWFLSA-N -1 3 355.829 3.870 20 0 FHADHM COc1ccc([C@H]2CCCN2c2ccc(-c3nn[n-]n3)c(Cl)c2)cc1 ZINC000737078046 598506536 /nfs/dbraw/zinc/50/65/36/598506536.db2.gz YFPXJNBQXZPVLA-QGZVFWFLSA-N -1 3 355.829 3.870 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H](C)Cc2cccc(F)c2)c1-c1nnn[n-]1 ZINC000736669314 598515264 /nfs/dbraw/zinc/51/52/64/598515264.db2.gz DFEFHTPIIQEGRY-JTQLQIEISA-N -1 3 373.457 3.755 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H](C)Cc2cccc(F)c2)c1-c1nn[n-]n1 ZINC000736669314 598515266 /nfs/dbraw/zinc/51/52/66/598515266.db2.gz DFEFHTPIIQEGRY-JTQLQIEISA-N -1 3 373.457 3.755 20 0 FHADHM CC(C)CC[C@H]1CCC[C@H]1NC(=O)CCc1ccc(-c2nnn[n-]2)cc1 ZINC000735796343 598519069 /nfs/dbraw/zinc/51/90/69/598519069.db2.gz AHCUOGJBEXKKFM-SJLPKXTDSA-N -1 3 355.486 3.520 20 0 FHADHM CC(C)CC[C@H]1CCC[C@H]1NC(=O)CCc1ccc(-c2nn[n-]n2)cc1 ZINC000735796343 598519070 /nfs/dbraw/zinc/51/90/70/598519070.db2.gz AHCUOGJBEXKKFM-SJLPKXTDSA-N -1 3 355.486 3.520 20 0 FHADHM CCc1sc(C(=O)Nc2sc(C)c(CC)c2-c2nnn[n-]2)cc1C ZINC000736714580 598519267 /nfs/dbraw/zinc/51/92/67/598519267.db2.gz XUGRENOSTDSXAV-UHFFFAOYSA-N -1 3 361.496 3.984 20 0 FHADHM CCc1sc(C(=O)Nc2sc(C)c(CC)c2-c2nn[n-]n2)cc1C ZINC000736714580 598519268 /nfs/dbraw/zinc/51/92/68/598519268.db2.gz XUGRENOSTDSXAV-UHFFFAOYSA-N -1 3 361.496 3.984 20 0 FHADHM Brc1cccc2c1CC[C@@H]2Nc1ccc(-c2nn[n-]n2)cc1 ZINC000735369799 598522015 /nfs/dbraw/zinc/52/20/15/598522015.db2.gz WXILMBJGKIMQBZ-HNNXBMFYSA-N -1 3 356.227 3.729 20 0 FHADHM CC(C)CC[C@H]1CCC[C@H]1NC(=O)N(C)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000735796848 598527709 /nfs/dbraw/zinc/52/77/09/598527709.db2.gz IUVLXDNZKBUTTO-SJLPKXTDSA-N -1 3 370.501 3.613 20 0 FHADHM CC(C)CC[C@H]1CCC[C@H]1NC(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000735796848 598527710 /nfs/dbraw/zinc/52/77/10/598527710.db2.gz IUVLXDNZKBUTTO-SJLPKXTDSA-N -1 3 370.501 3.613 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000108769634 598532967 /nfs/dbraw/zinc/53/29/67/598532967.db2.gz PIKBQMYOZGOYDN-RTBURBONSA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000108769634 598532968 /nfs/dbraw/zinc/53/29/68/598532968.db2.gz PIKBQMYOZGOYDN-RTBURBONSA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1ccccc1-c1nnn[n-]1)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000738191041 598533734 /nfs/dbraw/zinc/53/37/34/598533734.db2.gz IAFYPAXPXFYZPY-QZTJIDSGSA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1ccccc1-c1nn[n-]n1)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000738191041 598533736 /nfs/dbraw/zinc/53/37/36/598533736.db2.gz IAFYPAXPXFYZPY-QZTJIDSGSA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000738161618 598533925 /nfs/dbraw/zinc/53/39/25/598533925.db2.gz HAHMFIROLGFFPE-IAGOWNOFSA-N -1 3 373.391 3.901 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000738161618 598533927 /nfs/dbraw/zinc/53/39/27/598533927.db2.gz HAHMFIROLGFFPE-IAGOWNOFSA-N -1 3 373.391 3.901 20 0 FHADHM CCCCCC(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736441309 598543615 /nfs/dbraw/zinc/54/36/15/598543615.db2.gz PGPKABOILBVBJO-UHFFFAOYSA-N -1 3 365.437 3.965 20 0 FHADHM CCCCCC(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736441309 598543616 /nfs/dbraw/zinc/54/36/16/598543616.db2.gz PGPKABOILBVBJO-UHFFFAOYSA-N -1 3 365.437 3.965 20 0 FHADHM C[C@@H]1CCCC[C@@H]1CC(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(F)F ZINC000736263446 598545317 /nfs/dbraw/zinc/54/53/17/598545317.db2.gz QUNYUJHKCBWSSE-GHMZBOCLSA-N -1 3 365.384 3.623 20 0 FHADHM C[C@@H]1CCCC[C@@H]1CC(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(F)F ZINC000736263446 598545318 /nfs/dbraw/zinc/54/53/18/598545318.db2.gz QUNYUJHKCBWSSE-GHMZBOCLSA-N -1 3 365.384 3.623 20 0 FHADHM Fc1ccccc1-c1nc(COc2ccc(-c3nnn[n-]3)c(F)c2)cs1 ZINC000737652776 598550271 /nfs/dbraw/zinc/55/02/71/598550271.db2.gz OVSHDAVSCQWFAR-UHFFFAOYSA-N -1 3 371.372 3.847 20 0 FHADHM Fc1ccccc1-c1nc(COc2ccc(-c3nn[n-]n3)c(F)c2)cs1 ZINC000737652776 598550273 /nfs/dbraw/zinc/55/02/73/598550273.db2.gz OVSHDAVSCQWFAR-UHFFFAOYSA-N -1 3 371.372 3.847 20 0 FHADHM Cc1sc2nc(C)nc(Oc3ccc(-c4nnn[n-]4)cc3C)c2c1C ZINC000737481642 598551385 /nfs/dbraw/zinc/55/13/85/598551385.db2.gz COSAAYACUCXRAB-UHFFFAOYSA-N -1 3 352.423 3.897 20 0 FHADHM Cc1sc2nc(C)nc(Oc3ccc(-c4nn[n-]n4)cc3C)c2c1C ZINC000737481642 598551387 /nfs/dbraw/zinc/55/13/87/598551387.db2.gz COSAAYACUCXRAB-UHFFFAOYSA-N -1 3 352.423 3.897 20 0 FHADHM CC(C)CNC(=S)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000735839331 598551519 /nfs/dbraw/zinc/55/15/19/598551519.db2.gz PJOJNEPMASWBLJ-UHFFFAOYSA-N -1 3 368.466 3.601 20 0 FHADHM CC(C)CNC(=S)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000735839331 598551520 /nfs/dbraw/zinc/55/15/20/598551520.db2.gz PJOJNEPMASWBLJ-UHFFFAOYSA-N -1 3 368.466 3.601 20 0 FHADHM CSC[C@@H](C)C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCCCC2 ZINC000737180861 598553724 /nfs/dbraw/zinc/55/37/24/598553724.db2.gz SEWNYHIXJJZARO-SNVBAGLBSA-N -1 3 365.528 3.525 20 0 FHADHM CSC[C@@H](C)C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCCCC2 ZINC000737180861 598553725 /nfs/dbraw/zinc/55/37/25/598553725.db2.gz SEWNYHIXJJZARO-SNVBAGLBSA-N -1 3 365.528 3.525 20 0 FHADHM CC[C@H](C)N(C)C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736322800 598565352 /nfs/dbraw/zinc/56/53/52/598565352.db2.gz OWZRKGUSTWQJRY-ZDUSSCGKSA-N -1 3 366.425 3.921 20 0 FHADHM CC[C@H](C)N(C)C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736322800 598565353 /nfs/dbraw/zinc/56/53/53/598565353.db2.gz OWZRKGUSTWQJRY-ZDUSSCGKSA-N -1 3 366.425 3.921 20 0 FHADHM Fc1ccc(CNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)c(F)c1 ZINC000737648197 598578050 /nfs/dbraw/zinc/57/80/50/598578050.db2.gz GZEGSZCODJKCDT-UHFFFAOYSA-N -1 3 355.270 3.776 20 0 FHADHM Fc1ccc(CNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)c(F)c1 ZINC000737648197 598578051 /nfs/dbraw/zinc/57/80/51/598578051.db2.gz GZEGSZCODJKCDT-UHFFFAOYSA-N -1 3 355.270 3.776 20 0 FHADHM Cc1cc(C)c(-c2nnn[n-]2)c(SCc2ncc(-c3cccs3)o2)n1 ZINC000737239690 598582310 /nfs/dbraw/zinc/58/23/10/598582310.db2.gz FPBXBASFEQDERR-UHFFFAOYSA-N -1 3 370.463 3.887 20 0 FHADHM Cc1cc(C)c(-c2nn[n-]n2)c(SCc2ncc(-c3cccs3)o2)n1 ZINC000737239690 598582311 /nfs/dbraw/zinc/58/23/11/598582311.db2.gz FPBXBASFEQDERR-UHFFFAOYSA-N -1 3 370.463 3.887 20 0 FHADHM CC[C@H](OC(=O)CCc1ccc(-c2nnn[n-]2)cc1)c1ccc(OC)cc1 ZINC000736383327 598584463 /nfs/dbraw/zinc/58/44/63/598584463.db2.gz QBTWOWWWLPWJPF-SFHVURJKSA-N -1 3 366.421 3.502 20 0 FHADHM CC[C@H](OC(=O)CCc1ccc(-c2nn[n-]n2)cc1)c1ccc(OC)cc1 ZINC000736383327 598584465 /nfs/dbraw/zinc/58/44/65/598584465.db2.gz QBTWOWWWLPWJPF-SFHVURJKSA-N -1 3 366.421 3.502 20 0 FHADHM O=C(CCCc1ccc(Cl)cc1)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000737838065 598585135 /nfs/dbraw/zinc/58/51/35/598585135.db2.gz YEQOSCXGNXZFQO-UHFFFAOYSA-N -1 3 359.792 3.621 20 0 FHADHM O=C(CCCc1ccc(Cl)cc1)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000737838065 598585138 /nfs/dbraw/zinc/58/51/38/598585138.db2.gz YEQOSCXGNXZFQO-UHFFFAOYSA-N -1 3 359.792 3.621 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccc(OC2CCCC2)cc1 ZINC000738166516 598586610 /nfs/dbraw/zinc/58/66/10/598586610.db2.gz JZLZBDXDYQJFQP-UHFFFAOYSA-N -1 3 367.384 3.580 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccc(OC2CCCC2)cc1 ZINC000738166516 598586612 /nfs/dbraw/zinc/58/66/12/598586612.db2.gz JZLZBDXDYQJFQP-UHFFFAOYSA-N -1 3 367.384 3.580 20 0 FHADHM CCC[C@@H]1CCCC[C@@H]1NC(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000736436582 598608892 /nfs/dbraw/zinc/60/88/92/598608892.db2.gz RWKMHTIXUJKLIL-WBVHZDCISA-N -1 3 373.526 3.575 20 0 FHADHM CCC[C@@H]1CCCC[C@@H]1NC(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000736436582 598608894 /nfs/dbraw/zinc/60/88/94/598608894.db2.gz RWKMHTIXUJKLIL-WBVHZDCISA-N -1 3 373.526 3.575 20 0 FHADHM c1ccc2c(c1)cccc2-c1noc(Cc2ccc(-c3nnn[n-]3)cc2)n1 ZINC000738433027 598613383 /nfs/dbraw/zinc/61/33/83/598613383.db2.gz MGEVZCHQDFHASV-UHFFFAOYSA-N -1 3 354.373 3.661 20 0 FHADHM c1ccc2c(c1)cccc2-c1noc(Cc2ccc(-c3nn[n-]n3)cc2)n1 ZINC000738433027 598613385 /nfs/dbraw/zinc/61/33/85/598613385.db2.gz MGEVZCHQDFHASV-UHFFFAOYSA-N -1 3 354.373 3.661 20 0 FHADHM C[C@H]1CCCN(c2ccccc2OCc2ccc(-c3nnn[n-]3)cc2F)C1 ZINC000736276479 598616528 /nfs/dbraw/zinc/61/65/28/598616528.db2.gz IIHVDVXSIFYVAH-AWEZNQCLSA-N -1 3 367.428 3.821 20 0 FHADHM C[C@H]1CCCN(c2ccccc2OCc2ccc(-c3nn[n-]n3)cc2F)C1 ZINC000736276479 598616529 /nfs/dbraw/zinc/61/65/29/598616529.db2.gz IIHVDVXSIFYVAH-AWEZNQCLSA-N -1 3 367.428 3.821 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1cccc(Cl)c1 ZINC000736114336 598623862 /nfs/dbraw/zinc/62/38/62/598623862.db2.gz BBDKKTARLCEHCL-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM C[C@@H](NC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1cccc(Cl)c1 ZINC000736114336 598623863 /nfs/dbraw/zinc/62/38/63/598623863.db2.gz BBDKKTARLCEHCL-SECBINFHSA-N -1 3 360.780 3.542 20 0 FHADHM CCC[C@@H](Cc1ccccc1)NC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000736426004 598626223 /nfs/dbraw/zinc/62/62/23/598626223.db2.gz MWNTZZHLCTXDJR-AWEZNQCLSA-N -1 3 368.416 3.539 20 0 FHADHM CCC[C@@H](Cc1ccccc1)NC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000736426004 598626224 /nfs/dbraw/zinc/62/62/24/598626224.db2.gz MWNTZZHLCTXDJR-AWEZNQCLSA-N -1 3 368.416 3.539 20 0 FHADHM CCCN(Cc1ccccc1F)C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000736481034 598627632 /nfs/dbraw/zinc/62/76/32/598627632.db2.gz QLJFHFMOFMUFJB-UHFFFAOYSA-N -1 3 372.379 3.589 20 0 FHADHM CCCN(Cc1ccccc1F)C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000736481034 598627633 /nfs/dbraw/zinc/62/76/33/598627633.db2.gz QLJFHFMOFMUFJB-UHFFFAOYSA-N -1 3 372.379 3.589 20 0 FHADHM C[C@H](c1ccccc1Cl)N(C)C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000736205302 598628593 /nfs/dbraw/zinc/62/85/93/598628593.db2.gz VFMFTLIACLYLAZ-SNVBAGLBSA-N -1 3 374.807 3.884 20 0 FHADHM C[C@H](c1ccccc1Cl)N(C)C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000736205302 598628595 /nfs/dbraw/zinc/62/85/95/598628595.db2.gz VFMFTLIACLYLAZ-SNVBAGLBSA-N -1 3 374.807 3.884 20 0 FHADHM Fc1ccc(N2CCC[C@H]2c2nc3ccccc3s2)c(-c2nnn[n-]2)c1 ZINC000737660158 598629608 /nfs/dbraw/zinc/62/96/08/598629608.db2.gz NWRPGAOCCDZYRF-HNNXBMFYSA-N -1 3 366.425 3.957 20 0 FHADHM Fc1ccc(N2CCC[C@H]2c2nc3ccccc3s2)c(-c2nn[n-]n2)c1 ZINC000737660158 598629610 /nfs/dbraw/zinc/62/96/10/598629610.db2.gz NWRPGAOCCDZYRF-HNNXBMFYSA-N -1 3 366.425 3.957 20 0 FHADHM CC(C)[C@@H](NC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccccc1 ZINC000735722626 598631948 /nfs/dbraw/zinc/63/19/48/598631948.db2.gz VLKIWAIZVCJXRG-MRXNPFEDSA-N -1 3 354.389 3.525 20 0 FHADHM CC(C)[C@@H](NC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccccc1 ZINC000735722626 598631950 /nfs/dbraw/zinc/63/19/50/598631950.db2.gz VLKIWAIZVCJXRG-MRXNPFEDSA-N -1 3 354.389 3.525 20 0 FHADHM Cc1cc(Cl)ccc1NC(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000737261983 598645896 /nfs/dbraw/zinc/64/58/96/598645896.db2.gz BFFHCSRHMOBWBQ-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1cc(Cl)ccc1NC(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000737261983 598645897 /nfs/dbraw/zinc/64/58/97/598645897.db2.gz BFFHCSRHMOBWBQ-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM CCC[C@@H](C)NC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736424702 598647046 /nfs/dbraw/zinc/64/70/46/598647046.db2.gz RNHPDBOJTAAMSP-CYBMUJFWSA-N -1 3 351.410 3.577 20 0 FHADHM CCC[C@@H](C)NC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736424702 598647047 /nfs/dbraw/zinc/64/70/47/598647047.db2.gz RNHPDBOJTAAMSP-CYBMUJFWSA-N -1 3 351.410 3.577 20 0 FHADHM CC[C@@H]1CCCC[C@H]1NC(=O)CCCCOc1cccc(-c2nnn[n-]2)c1 ZINC000736400203 598652742 /nfs/dbraw/zinc/65/27/42/598652742.db2.gz MZVUHOGOJRDNAE-CRAIPNDOSA-N -1 3 371.485 3.501 20 0 FHADHM CC[C@@H]1CCCC[C@H]1NC(=O)CCCCOc1cccc(-c2nn[n-]n2)c1 ZINC000736400203 598652744 /nfs/dbraw/zinc/65/27/44/598652744.db2.gz MZVUHOGOJRDNAE-CRAIPNDOSA-N -1 3 371.485 3.501 20 0 FHADHM CC(C)[C@H]1CC[C@@H](C)C[C@@H]1NC(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000736236752 598653122 /nfs/dbraw/zinc/65/31/22/598653122.db2.gz MQJLRLVFUUNNLF-XYPHTWIQSA-N -1 3 373.526 3.536 20 0 FHADHM CC(C)[C@H]1CC[C@@H](C)C[C@@H]1NC(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000736236752 598653124 /nfs/dbraw/zinc/65/31/24/598653124.db2.gz MQJLRLVFUUNNLF-XYPHTWIQSA-N -1 3 373.526 3.536 20 0 FHADHM Clc1cc(NCCCOCCc2ccccc2)ccc1-c1nnn[n-]1 ZINC000737565711 598654948 /nfs/dbraw/zinc/65/49/48/598654948.db2.gz PEATZDRCNZRADF-UHFFFAOYSA-N -1 3 357.845 3.581 20 0 FHADHM Clc1cc(NCCCOCCc2ccccc2)ccc1-c1nn[n-]n1 ZINC000737565711 598654950 /nfs/dbraw/zinc/65/49/50/598654950.db2.gz PEATZDRCNZRADF-UHFFFAOYSA-N -1 3 357.845 3.581 20 0 FHADHM CC[C@H](NC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)C(C)C ZINC000736362790 598656821 /nfs/dbraw/zinc/65/68/21/598656821.db2.gz JATWENZVKBWPLI-SFHVURJKSA-N -1 3 365.437 3.823 20 0 FHADHM CC[C@H](NC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)C(C)C ZINC000736362790 598656823 /nfs/dbraw/zinc/65/68/23/598656823.db2.gz JATWENZVKBWPLI-SFHVURJKSA-N -1 3 365.437 3.823 20 0 FHADHM CC1(C)CCCN1C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736210339 598668579 /nfs/dbraw/zinc/66/85/79/598668579.db2.gz DMBACGAGTWNMDH-UHFFFAOYSA-N -1 3 363.421 3.674 20 0 FHADHM CC1(C)CCCN1C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736210339 598668581 /nfs/dbraw/zinc/66/85/81/598668581.db2.gz DMBACGAGTWNMDH-UHFFFAOYSA-N -1 3 363.421 3.674 20 0 FHADHM Clc1cc(NCCCCOCc2ccccc2)ccc1-c1nnn[n-]1 ZINC000737567167 598668706 /nfs/dbraw/zinc/66/87/06/598668706.db2.gz YATYCAJCAZEDPK-UHFFFAOYSA-N -1 3 357.845 3.929 20 0 FHADHM Clc1cc(NCCCCOCc2ccccc2)ccc1-c1nn[n-]n1 ZINC000737567167 598668707 /nfs/dbraw/zinc/66/87/07/598668707.db2.gz YATYCAJCAZEDPK-UHFFFAOYSA-N -1 3 357.845 3.929 20 0 FHADHM O[C@@H](CNc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccc2ccccc2c1 ZINC000738381609 598674458 /nfs/dbraw/zinc/67/44/58/598674458.db2.gz ILDKSXLNLIJESS-SFHVURJKSA-N -1 3 365.824 3.819 20 0 FHADHM O[C@@H](CNc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccc2ccccc2c1 ZINC000738381609 598674460 /nfs/dbraw/zinc/67/44/60/598674460.db2.gz ILDKSXLNLIJESS-SFHVURJKSA-N -1 3 365.824 3.819 20 0 FHADHM CCC(=O)Nc1ccc(Cl)c(NCc2ccc(-c3nnn[n-]3)cc2F)c1 ZINC000736308674 598699839 /nfs/dbraw/zinc/69/98/39/598699839.db2.gz GDCLEFQEGGTBPU-UHFFFAOYSA-N -1 3 374.807 3.620 20 0 FHADHM CCC(=O)Nc1ccc(Cl)c(NCc2ccc(-c3nn[n-]n3)cc2F)c1 ZINC000736308674 598699841 /nfs/dbraw/zinc/69/98/41/598699841.db2.gz GDCLEFQEGGTBPU-UHFFFAOYSA-N -1 3 374.807 3.620 20 0 FHADHM Cc1cc(F)ccc1N(Cc1ccno1)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000737271121 598703978 /nfs/dbraw/zinc/70/39/78/598703978.db2.gz RTJVUABIRUQBRG-UHFFFAOYSA-N -1 3 364.384 3.509 20 0 FHADHM Cc1cc(F)ccc1N(Cc1ccno1)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000737271121 598703979 /nfs/dbraw/zinc/70/39/79/598703979.db2.gz RTJVUABIRUQBRG-UHFFFAOYSA-N -1 3 364.384 3.509 20 0 FHADHM CCSCCOC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736664702 598727363 /nfs/dbraw/zinc/72/73/63/598727363.db2.gz CLARKIKIJALWDU-UHFFFAOYSA-N -1 3 370.434 3.569 20 0 FHADHM CCSCCOC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736664702 598727365 /nfs/dbraw/zinc/72/73/65/598727365.db2.gz CLARKIKIJALWDU-UHFFFAOYSA-N -1 3 370.434 3.569 20 0 FHADHM C[C@H](NC(=O)N1CCCC2(CCCCC2)C1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736113498 598728935 /nfs/dbraw/zinc/72/89/35/598728935.db2.gz OSTFCWINSPFCDZ-HNNXBMFYSA-N -1 3 368.485 3.684 20 0 FHADHM C[C@H](NC(=O)N1CCCC2(CCCCC2)C1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736113498 598728936 /nfs/dbraw/zinc/72/89/36/598728936.db2.gz OSTFCWINSPFCDZ-HNNXBMFYSA-N -1 3 368.485 3.684 20 0 FHADHM C[C@@H](NC(=O)C(C)(C)c1ccccc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000736099207 598735746 /nfs/dbraw/zinc/73/57/46/598735746.db2.gz TXGINVNEOONHPX-GFCCVEGCSA-N -1 3 369.856 3.675 20 0 FHADHM C[C@@H](NC(=O)C(C)(C)c1ccccc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000736099207 598735748 /nfs/dbraw/zinc/73/57/48/598735748.db2.gz TXGINVNEOONHPX-GFCCVEGCSA-N -1 3 369.856 3.675 20 0 FHADHM C[C@@H](Cc1ccccc1)C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCC2 ZINC000736059209 598741184 /nfs/dbraw/zinc/74/11/84/598741184.db2.gz RBPWUCJJNMFMMN-LBPRGKRZSA-N -1 3 367.478 3.624 20 0 FHADHM C[C@@H](Cc1ccccc1)C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCC2 ZINC000736059209 598741185 /nfs/dbraw/zinc/74/11/85/598741185.db2.gz RBPWUCJJNMFMMN-LBPRGKRZSA-N -1 3 367.478 3.624 20 0 FHADHM Cc1ccc(NC(=O)C(C)(C)C)cc1NCc1ccc(-c2nnn[n-]2)cc1 ZINC000737356994 598748950 /nfs/dbraw/zinc/74/89/50/598748950.db2.gz UUCRBTTVSCTYNC-UHFFFAOYSA-N -1 3 364.453 3.772 20 0 FHADHM Cc1ccc(NC(=O)C(C)(C)C)cc1NCc1ccc(-c2nn[n-]n2)cc1 ZINC000737356994 598748952 /nfs/dbraw/zinc/74/89/52/598748952.db2.gz UUCRBTTVSCTYNC-UHFFFAOYSA-N -1 3 364.453 3.772 20 0 FHADHM COCCSc1ccc([C@H](C)Nc2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000737014570 598755718 /nfs/dbraw/zinc/75/57/18/598755718.db2.gz PGRPXNQJWUWXIN-LBPRGKRZSA-N -1 3 373.457 3.917 20 0 FHADHM Cc1ccccc1[C@H](NC(=O)Nc1ccc(-c2nnn[n-]2)cc1)C(C)C ZINC000737421221 598757910 /nfs/dbraw/zinc/75/79/10/598757910.db2.gz KMUMJBCAVONIIG-QGZVFWFLSA-N -1 3 350.426 3.694 20 0 FHADHM Cc1ccccc1[C@H](NC(=O)Nc1ccc(-c2nn[n-]n2)cc1)C(C)C ZINC000737421221 598757912 /nfs/dbraw/zinc/75/79/12/598757912.db2.gz KMUMJBCAVONIIG-QGZVFWFLSA-N -1 3 350.426 3.694 20 0 FHADHM Cc1ccccc1[C@@H](NC(=O)Nc1ccc(-c2nnn[n-]2)cc1)C(C)C ZINC000737421216 598758014 /nfs/dbraw/zinc/75/80/14/598758014.db2.gz KMUMJBCAVONIIG-KRWDZBQOSA-N -1 3 350.426 3.694 20 0 FHADHM Cc1ccccc1[C@@H](NC(=O)Nc1ccc(-c2nn[n-]n2)cc1)C(C)C ZINC000737421216 598758016 /nfs/dbraw/zinc/75/80/16/598758016.db2.gz KMUMJBCAVONIIG-KRWDZBQOSA-N -1 3 350.426 3.694 20 0 FHADHM Fc1cc(F)c2ncc(-c3nnn[n-]3)c(NCc3ccc(Cl)o3)c2c1 ZINC000737653851 598771066 /nfs/dbraw/zinc/77/10/66/598771066.db2.gz TTZPMNCCSNDTJG-UHFFFAOYSA-N -1 3 362.727 3.552 20 0 FHADHM Fc1cc(F)c2ncc(-c3nn[n-]n3)c(NCc3ccc(Cl)o3)c2c1 ZINC000737653851 598771067 /nfs/dbraw/zinc/77/10/67/598771067.db2.gz TTZPMNCCSNDTJG-UHFFFAOYSA-N -1 3 362.727 3.552 20 0 FHADHM Fc1cc(F)c2ncc(-c3nnn[n-]3)c(NCc3ccc(F)c(F)c3)c2c1 ZINC000737653998 598771945 /nfs/dbraw/zinc/77/19/45/598771945.db2.gz VIOJBSNMGHJKTB-UHFFFAOYSA-N -1 3 374.301 3.583 20 0 FHADHM Fc1cc(F)c2ncc(-c3nn[n-]n3)c(NCc3ccc(F)c(F)c3)c2c1 ZINC000737653998 598771946 /nfs/dbraw/zinc/77/19/46/598771946.db2.gz VIOJBSNMGHJKTB-UHFFFAOYSA-N -1 3 374.301 3.583 20 0 FHADHM CC(C)N(Cc1ccc(F)cc1)C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000735873952 598781479 /nfs/dbraw/zinc/78/14/79/598781479.db2.gz KDOOBHLPFUGQIM-UHFFFAOYSA-N -1 3 372.379 3.587 20 0 FHADHM CC(C)N(Cc1ccc(F)cc1)C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000735873952 598781480 /nfs/dbraw/zinc/78/14/80/598781480.db2.gz KDOOBHLPFUGQIM-UHFFFAOYSA-N -1 3 372.379 3.587 20 0 FHADHM CC(C)[C@H](C)C(=O)Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000735699919 598803724 /nfs/dbraw/zinc/80/37/24/598803724.db2.gz DKWIBAJPINPELV-ZDUSSCGKSA-N -1 3 351.410 3.890 20 0 FHADHM CC(C)[C@H](C)C(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000735699919 598803725 /nfs/dbraw/zinc/80/37/25/598803725.db2.gz DKWIBAJPINPELV-ZDUSSCGKSA-N -1 3 351.410 3.890 20 0 FHADHM O=C(C[C@H]1C=CCC1)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737814367 598821643 /nfs/dbraw/zinc/82/16/43/598821643.db2.gz NMMJPDDISMOAGB-AWEZNQCLSA-N -1 3 361.405 3.954 20 0 FHADHM O=C(C[C@H]1C=CCC1)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737814367 598821644 /nfs/dbraw/zinc/82/16/44/598821644.db2.gz NMMJPDDISMOAGB-AWEZNQCLSA-N -1 3 361.405 3.954 20 0 FHADHM CC(C)Oc1c(Cl)cccc1NC(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000735904874 599300604 /nfs/dbraw/zinc/30/06/04/599300604.db2.gz VBXHTRMMVRPYFM-UHFFFAOYSA-N -1 3 357.801 3.560 20 0 FHADHM CC(C)Oc1c(Cl)cccc1NC(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC000735904874 599300606 /nfs/dbraw/zinc/30/06/06/599300606.db2.gz VBXHTRMMVRPYFM-UHFFFAOYSA-N -1 3 357.801 3.560 20 0 FHADHM CN(C(=O)Cc1ccc(-c2ccccc2)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736739371 599307732 /nfs/dbraw/zinc/30/77/32/599307732.db2.gz MONQGIBCGLHYNG-UHFFFAOYSA-N -1 3 369.428 3.739 20 0 FHADHM CN(C(=O)Cc1ccc(-c2ccccc2)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736739371 599307734 /nfs/dbraw/zinc/30/77/34/599307734.db2.gz MONQGIBCGLHYNG-UHFFFAOYSA-N -1 3 369.428 3.739 20 0 FHADHM CN(C(=O)c1cc(Cl)sc1Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000736749289 599307860 /nfs/dbraw/zinc/30/78/60/599307860.db2.gz PQYFYDUWHFPBJR-UHFFFAOYSA-N -1 3 354.222 3.512 20 0 FHADHM CN(C(=O)c1cc(Cl)sc1Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000736749289 599307863 /nfs/dbraw/zinc/30/78/63/599307863.db2.gz PQYFYDUWHFPBJR-UHFFFAOYSA-N -1 3 354.222 3.512 20 0 FHADHM CN(C(=O)C(c1ccccc1)c1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736733199 599309892 /nfs/dbraw/zinc/30/98/92/599309892.db2.gz SSSGERXHKULUED-UHFFFAOYSA-N -1 3 369.428 3.662 20 0 FHADHM CN(C(=O)C(c1ccccc1)c1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736733199 599309895 /nfs/dbraw/zinc/30/98/95/599309895.db2.gz SSSGERXHKULUED-UHFFFAOYSA-N -1 3 369.428 3.662 20 0 FHADHM C[C@H](c1ccc(-c2nnn[n-]2)cc1)N1CCO[C@@H](c2ccccc2Cl)C1 ZINC000736201242 599313699 /nfs/dbraw/zinc/31/36/99/599313699.db2.gz WJIMRIVWZPHXSV-FZKQIMNGSA-N -1 3 369.856 3.655 20 0 FHADHM C[C@H](c1ccc(-c2nn[n-]n2)cc1)N1CCO[C@@H](c2ccccc2Cl)C1 ZINC000736201242 599313701 /nfs/dbraw/zinc/31/37/01/599313701.db2.gz WJIMRIVWZPHXSV-FZKQIMNGSA-N -1 3 369.856 3.655 20 0 FHADHM Cc1cccc(NC(=O)[C@@H](C)S[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737398646 599329315 /nfs/dbraw/zinc/32/93/15/599329315.db2.gz JANGOWSKAHZASS-ZIAGYGMSSA-N -1 3 367.478 3.997 20 0 FHADHM Cc1cccc(NC(=O)[C@@H](C)S[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737398646 599329318 /nfs/dbraw/zinc/32/93/18/599329318.db2.gz JANGOWSKAHZASS-ZIAGYGMSSA-N -1 3 367.478 3.997 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1CNc1ccc(CC(F)(F)F)cc1 ZINC000737641373 599331452 /nfs/dbraw/zinc/33/14/52/599331452.db2.gz WXMFLFJTZQAGSC-UHFFFAOYSA-N -1 3 351.307 3.723 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CNc1ccc(CC(F)(F)F)cc1 ZINC000737641373 599331454 /nfs/dbraw/zinc/33/14/54/599331454.db2.gz WXMFLFJTZQAGSC-UHFFFAOYSA-N -1 3 351.307 3.723 20 0 FHADHM C[C@@H](S[C@@H](C)C(=O)N(C)C1CCCCC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736188263 599333231 /nfs/dbraw/zinc/33/32/31/599333231.db2.gz JZQYDRSSVWUEJT-KGLIPLIRSA-N -1 3 373.526 3.841 20 0 FHADHM C[C@@H](S[C@@H](C)C(=O)N(C)C1CCCCC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736188263 599333234 /nfs/dbraw/zinc/33/32/34/599333234.db2.gz JZQYDRSSVWUEJT-KGLIPLIRSA-N -1 3 373.526 3.841 20 0 FHADHM Cc1cccc(NC(=O)CS[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1C ZINC000737401557 599333917 /nfs/dbraw/zinc/33/39/17/599333917.db2.gz ZKVWASWDMXFXQK-AWEZNQCLSA-N -1 3 367.478 3.916 20 0 FHADHM Cc1cccc(NC(=O)CS[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1C ZINC000737401557 599333920 /nfs/dbraw/zinc/33/39/20/599333920.db2.gz ZKVWASWDMXFXQK-AWEZNQCLSA-N -1 3 367.478 3.916 20 0 FHADHM Cc1cc(Cl)ccc1NC(=O)CSc1ccccc1-c1nnn[n-]1 ZINC000822202186 599350508 /nfs/dbraw/zinc/35/05/08/599350508.db2.gz OOUNYFFPPNPNQA-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1cc(Cl)ccc1NC(=O)CSc1ccccc1-c1nn[n-]n1 ZINC000822202186 599350514 /nfs/dbraw/zinc/35/05/14/599350514.db2.gz OOUNYFFPPNPNQA-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1sc2ncnc(N[C@@H](C)c3cccc(-c4nnn[n-]4)c3)c2c1C ZINC000822563041 599353132 /nfs/dbraw/zinc/35/31/32/599353132.db2.gz DRAJPADIWIJUTE-JTQLQIEISA-N -1 3 351.439 3.661 20 0 FHADHM Cc1sc2ncnc(N[C@@H](C)c3cccc(-c4nn[n-]n4)c3)c2c1C ZINC000822563041 599353134 /nfs/dbraw/zinc/35/31/34/599353134.db2.gz DRAJPADIWIJUTE-JTQLQIEISA-N -1 3 351.439 3.661 20 0 FHADHM C[C@H](Nc1ncnc2sc3c(c21)CCC3)c1cccc(-c2nnn[n-]2)c1 ZINC000820461527 599357068 /nfs/dbraw/zinc/35/70/68/599357068.db2.gz LJVSVOCYSMXNHI-JTQLQIEISA-N -1 3 363.450 3.533 20 0 FHADHM C[C@H](Nc1ncnc2sc3c(c21)CCC3)c1cccc(-c2nn[n-]n2)c1 ZINC000820461527 599357070 /nfs/dbraw/zinc/35/70/70/599357070.db2.gz LJVSVOCYSMXNHI-JTQLQIEISA-N -1 3 363.450 3.533 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1CNc1cccc(CC(F)(F)F)c1 ZINC000821736250 607371159 /nfs/dbraw/zinc/37/11/59/607371159.db2.gz IBNFWMWDQKBEFY-UHFFFAOYSA-N -1 3 363.343 3.592 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CNc1cccc(CC(F)(F)F)c1 ZINC000821736250 607371161 /nfs/dbraw/zinc/37/11/61/607371161.db2.gz IBNFWMWDQKBEFY-UHFFFAOYSA-N -1 3 363.343 3.592 20 0 FHADHM Clc1ccccc1CNc1ccc(Br)cc1-c1nnn[n-]1 ZINC000737583883 599362371 /nfs/dbraw/zinc/36/23/71/599362371.db2.gz NBTIOZCVPPVRSZ-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM Clc1ccccc1CNc1ccc(Br)cc1-c1nn[n-]n1 ZINC000737583883 599362373 /nfs/dbraw/zinc/36/23/73/599362373.db2.gz NBTIOZCVPPVRSZ-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM C[C@@H](Nc1cccc(OC[C@@H]2CCCO2)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820461723 599364920 /nfs/dbraw/zinc/36/49/20/599364920.db2.gz QOBLHERRXNJLMZ-KUHUBIRLSA-N -1 3 365.437 3.598 20 0 FHADHM C[C@@H](Nc1cccc(OC[C@@H]2CCCO2)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820461723 599364923 /nfs/dbraw/zinc/36/49/23/599364923.db2.gz QOBLHERRXNJLMZ-KUHUBIRLSA-N -1 3 365.437 3.598 20 0 FHADHM C[C@@H](N[C@@H](C)c1ncc(-c2ccccc2)o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820414561 599366835 /nfs/dbraw/zinc/36/68/35/599366835.db2.gz ZFDIDDSRTZNANI-KGLIPLIRSA-N -1 3 360.421 3.934 20 0 FHADHM C[C@H](Nc1cccc(N2CCCCC2=O)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820461495 599367010 /nfs/dbraw/zinc/36/70/10/599367010.db2.gz KZIKJSSUOUOVNU-AWEZNQCLSA-N -1 3 362.437 3.557 20 0 FHADHM C[C@H](Nc1cccc(N2CCCCC2=O)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820461495 599367012 /nfs/dbraw/zinc/36/70/12/599367012.db2.gz KZIKJSSUOUOVNU-AWEZNQCLSA-N -1 3 362.437 3.557 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1cc2occc2s1 ZINC000736480136 599371430 /nfs/dbraw/zinc/37/14/30/599371430.db2.gz KVCPMSXXAPZRDG-UHFFFAOYSA-N -1 3 367.434 3.727 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1cc2occc2s1 ZINC000736480136 599371433 /nfs/dbraw/zinc/37/14/33/599371433.db2.gz KVCPMSXXAPZRDG-UHFFFAOYSA-N -1 3 367.434 3.727 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1CNc1ccc(F)c(C(F)(F)F)c1 ZINC000821736849 607371560 /nfs/dbraw/zinc/37/15/60/607371560.db2.gz PEAMDRTXNYPZEB-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CNc1ccc(F)c(C(F)(F)F)c1 ZINC000821736849 607371562 /nfs/dbraw/zinc/37/15/62/607371562.db2.gz PEAMDRTXNYPZEB-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM COC[C@@H](C)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)c(Cl)c1 ZINC000821682519 599373868 /nfs/dbraw/zinc/37/38/68/599373868.db2.gz HQTTXOYILREDSV-GFCCVEGCSA-N -1 3 373.844 3.546 20 0 FHADHM COC[C@@H](C)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)c(Cl)c1 ZINC000821682519 599373870 /nfs/dbraw/zinc/37/38/70/599373870.db2.gz HQTTXOYILREDSV-GFCCVEGCSA-N -1 3 373.844 3.546 20 0 FHADHM C[C@@H](CNc1cc(-c2nnn[n-]2)c2ccccc2n1)COCc1ccccc1 ZINC000736024927 599415779 /nfs/dbraw/zinc/41/57/79/599415779.db2.gz CNEPUNIRVKLQQD-HNNXBMFYSA-N -1 3 374.448 3.680 20 0 FHADHM C[C@@H](CNc1cc(-c2nn[n-]n2)c2ccccc2n1)COCc1ccccc1 ZINC000736024927 599415781 /nfs/dbraw/zinc/41/57/81/599415781.db2.gz CNEPUNIRVKLQQD-HNNXBMFYSA-N -1 3 374.448 3.680 20 0 FHADHM Clc1cccc([C@@H](NCc2ccc(-c3nnn[n-]3)o2)c2ccccc2)c1 ZINC000822585651 599421165 /nfs/dbraw/zinc/42/11/65/599421165.db2.gz IUBQPWYXBLCAGI-SFHVURJKSA-N -1 3 365.824 3.992 20 0 FHADHM Clc1cccc([C@@H](NCc2ccc(-c3nn[n-]n3)o2)c2ccccc2)c1 ZINC000822585651 599421167 /nfs/dbraw/zinc/42/11/67/599421167.db2.gz IUBQPWYXBLCAGI-SFHVURJKSA-N -1 3 365.824 3.992 20 0 FHADHM O[C@H](CNc1cc(Cl)ccc1-c1nnn[n-]1)c1ccc2ccccc2c1 ZINC000738385853 599435286 /nfs/dbraw/zinc/43/52/86/599435286.db2.gz ZCNOGQDDNYEFPQ-GOSISDBHSA-N -1 3 365.824 3.819 20 0 FHADHM O[C@H](CNc1cc(Cl)ccc1-c1nn[n-]n1)c1ccc2ccccc2c1 ZINC000738385853 599435289 /nfs/dbraw/zinc/43/52/89/599435289.db2.gz ZCNOGQDDNYEFPQ-GOSISDBHSA-N -1 3 365.824 3.819 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(N[C@@H]2CCCN(c3ccccc3)C2)c1 ZINC000737570714 599439787 /nfs/dbraw/zinc/43/97/87/599439787.db2.gz LJFWRNDGPGWZOQ-CQSZACIVSA-N -1 3 354.845 3.601 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(N[C@@H]2CCCN(c3ccccc3)C2)c1 ZINC000737570714 599439789 /nfs/dbraw/zinc/43/97/89/599439789.db2.gz LJFWRNDGPGWZOQ-CQSZACIVSA-N -1 3 354.845 3.601 20 0 FHADHM C[C@H](NC(=O)Nc1ccc(-c2nnn[n-]2)cc1)c1ccc(F)cc1Cl ZINC000736115787 599451082 /nfs/dbraw/zinc/45/10/82/599451082.db2.gz JOIVOCHZQJCUOY-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM C[C@H](NC(=O)Nc1ccc(-c2nn[n-]n2)cc1)c1ccc(F)cc1Cl ZINC000736115787 599451083 /nfs/dbraw/zinc/45/10/83/599451083.db2.gz JOIVOCHZQJCUOY-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM Cc1ccc(-c2ccc(CNCc3cc(-c4nn[n-]n4)ccc3F)o2)cc1 ZINC000822214031 599459365 /nfs/dbraw/zinc/45/93/65/599459365.db2.gz MHMMSQRAVWXZDZ-UHFFFAOYSA-N -1 3 363.396 3.864 20 0 FHADHM Cc1cc2nc(C=Cc3cnc4ccc(-c5nnn[n-]5)cn34)sc2cc1C ZINC000737285485 599460956 /nfs/dbraw/zinc/46/09/56/599460956.db2.gz SSPFMPCLOWUJHS-GQCTYLIASA-N -1 3 373.445 3.911 20 0 FHADHM Cc1cc2nc(C=Cc3cnc4ccc(-c5nn[n-]n5)cn34)sc2cc1C ZINC000737285485 599460958 /nfs/dbraw/zinc/46/09/58/599460958.db2.gz SSPFMPCLOWUJHS-GQCTYLIASA-N -1 3 373.445 3.911 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)CCc2cc(Cl)cs2)s1 ZINC000736679448 599465657 /nfs/dbraw/zinc/46/56/57/599465657.db2.gz UHOOZJKHPJVJNW-UHFFFAOYSA-N -1 3 367.887 3.777 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)CCc2cc(Cl)cs2)s1 ZINC000736679448 599465659 /nfs/dbraw/zinc/46/56/59/599465659.db2.gz UHOOZJKHPJVJNW-UHFFFAOYSA-N -1 3 367.887 3.777 20 0 FHADHM Fc1ccc(NCc2cc(Br)ccc2F)c(-c2nnn[n-]2)c1 ZINC000822783104 599472808 /nfs/dbraw/zinc/47/28/08/599472808.db2.gz VLBQTZQHVKIOBO-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1ccc(NCc2cc(Br)ccc2F)c(-c2nn[n-]n2)c1 ZINC000822783104 599472809 /nfs/dbraw/zinc/47/28/09/599472809.db2.gz VLBQTZQHVKIOBO-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM CCC[C@H](NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)C1CCCCC1 ZINC000821020956 599483856 /nfs/dbraw/zinc/48/38/56/599483856.db2.gz KENNKKZRDWLKDF-KSSFIOAISA-N -1 3 370.501 3.976 20 0 FHADHM CCC[C@H](NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)C1CCCCC1 ZINC000821020956 599483858 /nfs/dbraw/zinc/48/38/58/599483858.db2.gz KENNKKZRDWLKDF-KSSFIOAISA-N -1 3 370.501 3.976 20 0 FHADHM C[C@H](NC(=O)c1occc1-c1ccccc1)c1cccc(-c2nnn[n-]2)c1 ZINC000820403959 599499874 /nfs/dbraw/zinc/49/98/74/599499874.db2.gz NTCFWKXTVOGRBC-ZDUSSCGKSA-N -1 3 359.389 3.618 20 0 FHADHM C[C@H](NC(=O)c1occc1-c1ccccc1)c1cccc(-c2nn[n-]n2)c1 ZINC000820403959 599499877 /nfs/dbraw/zinc/49/98/77/599499877.db2.gz NTCFWKXTVOGRBC-ZDUSSCGKSA-N -1 3 359.389 3.618 20 0 FHADHM CSc1ccc(Cl)c(C(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000821984032 599513364 /nfs/dbraw/zinc/51/33/64/599513364.db2.gz LLYXXWFEVGZQEK-SNVBAGLBSA-N -1 3 373.869 3.733 20 0 FHADHM CSc1ccc(Cl)c(C(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000821984032 599513365 /nfs/dbraw/zinc/51/33/65/599513365.db2.gz LLYXXWFEVGZQEK-SNVBAGLBSA-N -1 3 373.869 3.733 20 0 FHADHM C[C@H](NC(=O)c1cc(Cl)cc(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820391431 599516519 /nfs/dbraw/zinc/51/65/19/599516519.db2.gz PSZIPFOYWKSPPL-VIFPVBQESA-N -1 3 362.220 3.665 20 0 FHADHM C[C@H](NC(=O)c1cc(Cl)cc(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820391431 599516522 /nfs/dbraw/zinc/51/65/22/599516522.db2.gz PSZIPFOYWKSPPL-VIFPVBQESA-N -1 3 362.220 3.665 20 0 FHADHM C[C@@H](S[C@@H](C)c1cccs1)C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000736188478 599521661 /nfs/dbraw/zinc/52/16/61/599521661.db2.gz KENWTXNKDSUCST-WDEREUQCSA-N -1 3 359.480 3.750 20 0 FHADHM C[C@@H](S[C@@H](C)c1cccs1)C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000736188478 599521664 /nfs/dbraw/zinc/52/16/64/599521664.db2.gz KENWTXNKDSUCST-WDEREUQCSA-N -1 3 359.480 3.750 20 0 FHADHM C[C@@H](NC(=O)c1cc2c(s1)CC[C@@H](C)C2)c1cccc(-c2nnn[n-]2)c1 ZINC000820735598 599521985 /nfs/dbraw/zinc/52/19/85/599521985.db2.gz TXPYEGYXHBXJJD-VXGBXAGGSA-N -1 3 367.478 3.544 20 0 FHADHM C[C@@H](NC(=O)c1cc2c(s1)CC[C@@H](C)C2)c1cccc(-c2nn[n-]n2)c1 ZINC000820735598 599521987 /nfs/dbraw/zinc/52/19/87/599521987.db2.gz TXPYEGYXHBXJJD-VXGBXAGGSA-N -1 3 367.478 3.544 20 0 FHADHM CCc1ccc([C@H](C)CC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000821475849 599522485 /nfs/dbraw/zinc/52/24/85/599522485.db2.gz BAFJPDGCNBOZHH-HUUCEWRRSA-N -1 3 363.465 3.800 20 0 FHADHM CCc1ccc([C@H](C)CC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000821475849 599522488 /nfs/dbraw/zinc/52/24/88/599522488.db2.gz BAFJPDGCNBOZHH-HUUCEWRRSA-N -1 3 363.465 3.800 20 0 FHADHM FC(F)(F)c1cc(NC[C@@H]2CCc3ccccc3N2)ccc1-c1nnn[n-]1 ZINC000822723230 599524521 /nfs/dbraw/zinc/52/45/21/599524521.db2.gz ARQQFTTWEMLKNL-ZDUSSCGKSA-N -1 3 374.370 3.724 20 0 FHADHM FC(F)(F)c1cc(NC[C@@H]2CCc3ccccc3N2)ccc1-c1nn[n-]n1 ZINC000822723230 599524524 /nfs/dbraw/zinc/52/45/24/599524524.db2.gz ARQQFTTWEMLKNL-ZDUSSCGKSA-N -1 3 374.370 3.724 20 0 FHADHM C[C@@H](S[C@@H]1CCN(c2ccc(-c3nnn[n-]3)cc2)C1=O)c1cccs1 ZINC000736188865 599524647 /nfs/dbraw/zinc/52/46/47/599524647.db2.gz MATZTVWVLOQNQO-IAQYHMDHSA-N -1 3 371.491 3.528 20 0 FHADHM C[C@@H](S[C@@H]1CCN(c2ccc(-c3nn[n-]n3)cc2)C1=O)c1cccs1 ZINC000736188865 599524650 /nfs/dbraw/zinc/52/46/50/599524650.db2.gz MATZTVWVLOQNQO-IAQYHMDHSA-N -1 3 371.491 3.528 20 0 FHADHM CC(C)C[C@H](C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000820051799 599527643 /nfs/dbraw/zinc/52/76/43/599527643.db2.gz WNEVSLJLGWPKGB-KXBFYZLASA-N -1 3 363.465 3.874 20 0 FHADHM CC(C)C[C@H](C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000820051799 599527645 /nfs/dbraw/zinc/52/76/45/599527645.db2.gz WNEVSLJLGWPKGB-KXBFYZLASA-N -1 3 363.465 3.874 20 0 FHADHM Cc1ccc(SCCC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000822266783 599527756 /nfs/dbraw/zinc/52/77/56/599527756.db2.gz IOLVPJCMGOMFTO-AWEZNQCLSA-N -1 3 367.478 3.535 20 0 FHADHM Cc1ccc(SCCC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000822266783 599527758 /nfs/dbraw/zinc/52/77/58/599527758.db2.gz IOLVPJCMGOMFTO-AWEZNQCLSA-N -1 3 367.478 3.535 20 0 FHADHM Cc1noc(C)c1C[C@H](C)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000737538812 599531322 /nfs/dbraw/zinc/53/13/22/599531322.db2.gz PQDMQQWTQIIFJN-QMMMGPOBSA-N -1 3 366.347 3.533 20 0 FHADHM Cc1noc(C)c1C[C@H](C)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000737538812 599531323 /nfs/dbraw/zinc/53/13/23/599531323.db2.gz PQDMQQWTQIIFJN-QMMMGPOBSA-N -1 3 366.347 3.533 20 0 FHADHM C[C@H](NC(=O)C(C)(C)c1ccccc1Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000820316323 599533511 /nfs/dbraw/zinc/53/35/11/599533511.db2.gz SVDJJRYUUXYIEN-LBPRGKRZSA-N -1 3 369.856 3.675 20 0 FHADHM C[C@H](NC(=O)C(C)(C)c1ccccc1Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000820316323 599533513 /nfs/dbraw/zinc/53/35/13/599533513.db2.gz SVDJJRYUUXYIEN-LBPRGKRZSA-N -1 3 369.856 3.675 20 0 FHADHM CC(C)CN(C(=O)[C@H](C)c1ccsc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000735818607 599541461 /nfs/dbraw/zinc/54/14/61/599541461.db2.gz OKDVJWTYRFPOHU-CYBMUJFWSA-N -1 3 355.467 3.721 20 0 FHADHM CC(C)CN(C(=O)[C@H](C)c1ccsc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000735818607 599541463 /nfs/dbraw/zinc/54/14/63/599541463.db2.gz OKDVJWTYRFPOHU-CYBMUJFWSA-N -1 3 355.467 3.721 20 0 FHADHM CC[C@H](Sc1ccccc1)C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820939849 599542797 /nfs/dbraw/zinc/54/27/97/599542797.db2.gz ZFOFUCBIGZSURS-DYVFJYSZSA-N -1 3 367.478 3.615 20 0 FHADHM CC[C@H](Sc1ccccc1)C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820939849 599542799 /nfs/dbraw/zinc/54/27/99/599542799.db2.gz ZFOFUCBIGZSURS-DYVFJYSZSA-N -1 3 367.478 3.615 20 0 FHADHM CC[C@@H](CC(=O)N(C)c1ccc(-c2nnn[n-]2)cc1F)c1ccc(C)cc1 ZINC000736331815 599544054 /nfs/dbraw/zinc/54/40/54/599544054.db2.gz LKNSZWHDVOHZAA-AWEZNQCLSA-N -1 3 367.428 3.861 20 0 FHADHM CC[C@@H](CC(=O)N(C)c1ccc(-c2nn[n-]n2)cc1F)c1ccc(C)cc1 ZINC000736331815 599544056 /nfs/dbraw/zinc/54/40/56/599544056.db2.gz LKNSZWHDVOHZAA-AWEZNQCLSA-N -1 3 367.428 3.861 20 0 FHADHM CCc1ccc([C@@H]2CCCCN2C(=O)Nc2ccc(-c3nnn[n-]3)cc2)o1 ZINC000821480461 599550652 /nfs/dbraw/zinc/55/06/52/599550652.db2.gz CMJJXZZDKUUSNG-INIZCTEOSA-N -1 3 366.425 3.781 20 0 FHADHM CCc1ccc([C@@H]2CCCCN2C(=O)Nc2ccc(-c3nn[n-]n3)cc2)o1 ZINC000821480461 599550653 /nfs/dbraw/zinc/55/06/53/599550653.db2.gz CMJJXZZDKUUSNG-INIZCTEOSA-N -1 3 366.425 3.781 20 0 FHADHM CCc1ccc([C@H]2CCCCN2C(=O)Nc2ccc(-c3nnn[n-]3)cc2)o1 ZINC000821480463 599550735 /nfs/dbraw/zinc/55/07/35/599550735.db2.gz CMJJXZZDKUUSNG-MRXNPFEDSA-N -1 3 366.425 3.781 20 0 FHADHM CCc1ccc([C@H]2CCCCN2C(=O)Nc2ccc(-c3nn[n-]n3)cc2)o1 ZINC000821480463 599550737 /nfs/dbraw/zinc/55/07/37/599550737.db2.gz CMJJXZZDKUUSNG-MRXNPFEDSA-N -1 3 366.425 3.781 20 0 FHADHM Cc1ccc([C@@H]2[C@@H](C)CCCN2C(=O)c2sccc2-c2nnn[n-]2)cc1 ZINC000737332453 599558681 /nfs/dbraw/zinc/55/86/81/599558681.db2.gz WQZAFBBDIWOIGS-BBRMVZONSA-N -1 3 367.478 3.850 20 0 FHADHM Cc1ccc([C@@H]2[C@@H](C)CCCN2C(=O)c2sccc2-c2nn[n-]n2)cc1 ZINC000737332453 599558684 /nfs/dbraw/zinc/55/86/84/599558684.db2.gz WQZAFBBDIWOIGS-BBRMVZONSA-N -1 3 367.478 3.850 20 0 FHADHM CC[C@H]1CCCN(c2c(-c3nnn[n-]3)cnc3c(F)ccc(F)c32)CC1 ZINC000820979630 599561168 /nfs/dbraw/zinc/56/11/68/599561168.db2.gz IOGDQVZJHCITDV-NSHDSACASA-N -1 3 358.396 3.710 20 0 FHADHM CC[C@H]1CCCN(c2c(-c3nn[n-]n3)cnc3c(F)ccc(F)c32)CC1 ZINC000820979630 599561170 /nfs/dbraw/zinc/56/11/70/599561170.db2.gz IOGDQVZJHCITDV-NSHDSACASA-N -1 3 358.396 3.710 20 0 FHADHM C[C@@H]1C[C@H](c2ccc(F)cc2)CN1c1c(-c2nnn[n-]2)cnc2ccccc21 ZINC000820668821 599564182 /nfs/dbraw/zinc/56/41/82/599564182.db2.gz XBXYNAVXMQFAAT-HIFRSBDPSA-N -1 3 374.423 3.936 20 0 FHADHM C[C@@H]1C[C@H](c2ccc(F)cc2)CN1c1c(-c2nn[n-]n2)cnc2ccccc21 ZINC000820668821 599564184 /nfs/dbraw/zinc/56/41/84/599564184.db2.gz XBXYNAVXMQFAAT-HIFRSBDPSA-N -1 3 374.423 3.936 20 0 FHADHM COc1ccc([C@@H](C)CCNc2c(F)cc(-c3nnn[n-]3)cc2F)cc1 ZINC000821777856 599588433 /nfs/dbraw/zinc/58/84/33/599588433.db2.gz NBVYRDHTRFKSTN-NSHDSACASA-N -1 3 359.380 3.759 20 0 FHADHM COc1ccc([C@@H](C)CCNc2c(F)cc(-c3nn[n-]n3)cc2F)cc1 ZINC000821777856 599588435 /nfs/dbraw/zinc/58/84/35/599588435.db2.gz NBVYRDHTRFKSTN-NSHDSACASA-N -1 3 359.380 3.759 20 0 FHADHM COc1ccc([C@H](C)CCNc2ncc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000821778252 599588539 /nfs/dbraw/zinc/58/85/39/599588539.db2.gz XFUIXDJQHVGAQH-LLVKDONJSA-N -1 3 358.833 3.529 20 0 FHADHM COc1ccc([C@H](C)CCNc2ncc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000821778252 599588541 /nfs/dbraw/zinc/58/85/41/599588541.db2.gz XFUIXDJQHVGAQH-LLVKDONJSA-N -1 3 358.833 3.529 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)N1CCC2(CCCC2)CC1 ZINC000735660781 599600268 /nfs/dbraw/zinc/60/02/68/599600268.db2.gz PBQZQBBUNBHYKV-UHFFFAOYSA-N -1 3 371.489 3.611 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)N1CCC2(CCCC2)CC1 ZINC000735660781 599600270 /nfs/dbraw/zinc/60/02/70/599600270.db2.gz PBQZQBBUNBHYKV-UHFFFAOYSA-N -1 3 371.489 3.611 20 0 FHADHM CCc1ccc([C@@H](C)CC(=O)OCc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000736686623 599605720 /nfs/dbraw/zinc/60/57/20/599605720.db2.gz KIRKMTPUBGRUSB-AWEZNQCLSA-N -1 3 350.422 3.666 20 0 FHADHM CCc1ccc([C@@H](C)CC(=O)OCc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000736686623 599605721 /nfs/dbraw/zinc/60/57/21/599605721.db2.gz KIRKMTPUBGRUSB-AWEZNQCLSA-N -1 3 350.422 3.666 20 0 FHADHM CC[C@H](C)[C@@H]1CCCCN1C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736335669 599608439 /nfs/dbraw/zinc/60/84/39/599608439.db2.gz ZIMTYRDSRFRHGM-VBQJREDUSA-N -1 3 356.474 3.538 20 0 FHADHM CC[C@H](C)[C@@H]1CCCCN1C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736335669 599608437 /nfs/dbraw/zinc/60/84/37/599608437.db2.gz ZIMTYRDSRFRHGM-VBQJREDUSA-N -1 3 356.474 3.538 20 0 FHADHM CC[C@@H](NC(=O)Nc1cc(-c2nnn[n-]2)ccc1C)c1ccc(F)cc1F ZINC000736361643 599609555 /nfs/dbraw/zinc/60/95/55/599609555.db2.gz GYPHDBBKYOIERZ-OAHLLOKOSA-N -1 3 372.379 3.726 20 0 FHADHM CC[C@@H](NC(=O)Nc1cc(-c2nn[n-]n2)ccc1C)c1ccc(F)cc1F ZINC000736361643 599609557 /nfs/dbraw/zinc/60/95/57/599609557.db2.gz GYPHDBBKYOIERZ-OAHLLOKOSA-N -1 3 372.379 3.726 20 0 FHADHM C[C@@H](OC(=O)[C@H](C)c1cccc(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820481325 599621229 /nfs/dbraw/zinc/62/12/29/599621229.db2.gz URTMIFSWAZGGFM-VXGBXAGGSA-N -1 3 356.813 3.928 20 0 FHADHM C[C@@H](OC(=O)[C@H](C)c1cccc(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820481325 599621230 /nfs/dbraw/zinc/62/12/30/599621230.db2.gz URTMIFSWAZGGFM-VXGBXAGGSA-N -1 3 356.813 3.928 20 0 FHADHM O=C(OCc1ccccc1-c1nnn[n-]1)C1CCC(c2ccccc2)CC1 ZINC000823431758 599622016 /nfs/dbraw/zinc/62/20/16/599622016.db2.gz VPIWRBJSWDLQRX-UHFFFAOYSA-N -1 3 362.433 3.884 20 0 FHADHM O=C(OCc1ccccc1-c1nn[n-]n1)C1CCC(c2ccccc2)CC1 ZINC000823431758 599622017 /nfs/dbraw/zinc/62/20/17/599622017.db2.gz VPIWRBJSWDLQRX-UHFFFAOYSA-N -1 3 362.433 3.884 20 0 FHADHM Cc1sc(NC(=O)[C@H](C)CCc2ccccc2F)c(-c2nnn[n-]2)c1C ZINC000822557190 599628658 /nfs/dbraw/zinc/62/86/58/599628658.db2.gz HIKIDJBZUYOEBE-SNVBAGLBSA-N -1 3 373.457 3.892 20 0 FHADHM Cc1sc(NC(=O)[C@H](C)CCc2ccccc2F)c(-c2nn[n-]n2)c1C ZINC000822557190 599628659 /nfs/dbraw/zinc/62/86/59/599628659.db2.gz HIKIDJBZUYOEBE-SNVBAGLBSA-N -1 3 373.457 3.892 20 0 FHADHM Cc1ccc([C@H](C)C(=O)Nc2sc3c(c2-c2nnn[n-]2)CC[C@H](C)C3)o1 ZINC000822227638 599628676 /nfs/dbraw/zinc/62/86/76/599628676.db2.gz QDWHPRTVMDPHOJ-ONGXEEELSA-N -1 3 371.466 3.697 20 0 FHADHM Cc1ccc([C@H](C)C(=O)Nc2sc3c(c2-c2nn[n-]n2)CC[C@H](C)C3)o1 ZINC000822227638 599628677 /nfs/dbraw/zinc/62/86/77/599628677.db2.gz QDWHPRTVMDPHOJ-ONGXEEELSA-N -1 3 371.466 3.697 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)cc1C ZINC000822226262 599632286 /nfs/dbraw/zinc/63/22/86/599632286.db2.gz JYBMAARSBCYBHC-UHFFFAOYSA-N -1 3 361.327 3.755 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)cc1C ZINC000822226262 599632287 /nfs/dbraw/zinc/63/22/87/599632287.db2.gz JYBMAARSBCYBHC-UHFFFAOYSA-N -1 3 361.327 3.755 20 0 FHADHM Cc1cc(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)sc1C ZINC000822175994 599632682 /nfs/dbraw/zinc/63/26/82/599632682.db2.gz DCHUPJHCNLFIDW-UHFFFAOYSA-N -1 3 367.356 3.816 20 0 FHADHM Cc1cc(C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)sc1C ZINC000822175994 599632683 /nfs/dbraw/zinc/63/26/83/599632683.db2.gz DCHUPJHCNLFIDW-UHFFFAOYSA-N -1 3 367.356 3.816 20 0 FHADHM C[C@H]1CCC[C@@H](C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)C1 ZINC000820691862 599632898 /nfs/dbraw/zinc/63/28/98/599632898.db2.gz ZVBIVUNECWCRQP-VHSXEESVSA-N -1 3 353.348 3.650 20 0 FHADHM C[C@H]1CCC[C@@H](C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)C1 ZINC000820691862 599632899 /nfs/dbraw/zinc/63/28/99/599632899.db2.gz ZVBIVUNECWCRQP-VHSXEESVSA-N -1 3 353.348 3.650 20 0 FHADHM CC(C)CCN(C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)C1CCCC1 ZINC000820073158 599681619 /nfs/dbraw/zinc/68/16/19/599681619.db2.gz RMHQZAOUROJHMQ-HNNXBMFYSA-N -1 3 370.501 3.928 20 0 FHADHM CC(C)CCN(C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)C1CCCC1 ZINC000820073158 599681620 /nfs/dbraw/zinc/68/16/20/599681620.db2.gz RMHQZAOUROJHMQ-HNNXBMFYSA-N -1 3 370.501 3.928 20 0 FHADHM COc1ccc2cc([C@H](C)OC(=O)c3ccc(-c4nnn[n-]4)cc3)ccc2c1 ZINC000821854814 599684832 /nfs/dbraw/zinc/68/48/32/599684832.db2.gz WMJJWUBJMAYIEH-ZDUSSCGKSA-N -1 3 374.400 3.947 20 0 FHADHM COc1ccc2cc([C@H](C)OC(=O)c3ccc(-c4nn[n-]n4)cc3)ccc2c1 ZINC000821854814 599684833 /nfs/dbraw/zinc/68/48/33/599684833.db2.gz WMJJWUBJMAYIEH-ZDUSSCGKSA-N -1 3 374.400 3.947 20 0 FHADHM Fc1ccc(NCc2cc(Cl)ccc2OC(F)F)c(-c2nnn[n-]2)c1 ZINC000822782839 599689494 /nfs/dbraw/zinc/68/94/94/599689494.db2.gz IZGHOGIQQMGGGE-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM Fc1ccc(NCc2cc(Cl)ccc2OC(F)F)c(-c2nn[n-]n2)c1 ZINC000822782839 599689495 /nfs/dbraw/zinc/68/94/95/599689495.db2.gz IZGHOGIQQMGGGE-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM Cc1cccc(NC(=O)N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1Cl ZINC000822323789 599693837 /nfs/dbraw/zinc/69/38/37/599693837.db2.gz OCQPTSNTXLTZPL-NSHDSACASA-N -1 3 356.817 3.711 20 0 FHADHM Cc1cccc(NC(=O)N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1Cl ZINC000822323789 599693838 /nfs/dbraw/zinc/69/38/38/599693838.db2.gz OCQPTSNTXLTZPL-NSHDSACASA-N -1 3 356.817 3.711 20 0 FHADHM Cc1cccc(NC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1Cl ZINC000822324108 599693884 /nfs/dbraw/zinc/69/38/84/599693884.db2.gz VRJOWVIMVSUKPL-NSHDSACASA-N -1 3 356.817 3.711 20 0 FHADHM Cc1cccc(NC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1Cl ZINC000822324108 599693885 /nfs/dbraw/zinc/69/38/85/599693885.db2.gz VRJOWVIMVSUKPL-NSHDSACASA-N -1 3 356.817 3.711 20 0 FHADHM COc1ccc(C(=O)C2CCN([C@H](C(=O)[O-])c3ccc(F)cc3)CC2)cc1 ZINC000579603228 599708931 /nfs/dbraw/zinc/70/89/31/599708931.db2.gz MDJZUCBTHVRYGR-IBGZPJMESA-N -1 3 371.408 3.555 20 0 FHADHM O=C([O-])[C@@H](NCc1ccc(C(=O)Nc2ccccc2)cc1)c1ccccc1 ZINC000739487712 599760276 /nfs/dbraw/zinc/76/02/76/599760276.db2.gz DHCRBMMBOUDSTK-FQEVSTJZSA-N -1 3 360.413 3.854 20 0 FHADHM O=C([O-])c1sccc1NC(=O)CN[C@H](c1ccc(F)cc1)C1CCC1 ZINC000739308714 599793161 /nfs/dbraw/zinc/79/31/61/599793161.db2.gz VQYFTTIRFNJQCN-INIZCTEOSA-N -1 3 362.426 3.655 20 0 FHADHM CCCN(Cc1cc(C)c(C(=O)[O-])o1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000737019782 599794036 /nfs/dbraw/zinc/79/40/36/599794036.db2.gz NGXUSPDUJGKNSP-CQSZACIVSA-N -1 3 366.458 3.508 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Oc1ccc(Oc2ccccn2)cc1 ZINC000826252604 607399843 /nfs/dbraw/zinc/39/98/43/607399843.db2.gz KGRBFSNYZQYJRF-UHFFFAOYSA-N -1 3 373.372 3.582 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Oc1ccc(Oc2ccccn2)cc1 ZINC000826252604 607399845 /nfs/dbraw/zinc/39/98/45/607399845.db2.gz KGRBFSNYZQYJRF-UHFFFAOYSA-N -1 3 373.372 3.582 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@H]1C(=O)O[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000826316100 607400624 /nfs/dbraw/zinc/40/06/24/607400624.db2.gz CTTBYTFYTQKSGY-KCPJHIHWSA-N -1 3 354.435 3.645 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@H]1C(=O)O[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000826316100 607400626 /nfs/dbraw/zinc/40/06/26/607400626.db2.gz CTTBYTFYTQKSGY-KCPJHIHWSA-N -1 3 354.435 3.645 20 0 FHADHM COc1ccc([C@H](NCc2ccc(OCC(F)(F)F)cc2)C(=O)[O-])cc1 ZINC000737969295 599859956 /nfs/dbraw/zinc/85/99/56/599859956.db2.gz JWYWYIVXFINFHF-INIZCTEOSA-N -1 3 369.339 3.552 20 0 FHADHM CC(C)(C)C(=O)N[C@H]1CCCN(Cc2c3ccccc3sc2C(=O)[O-])C1 ZINC000736242683 599991371 /nfs/dbraw/zinc/99/13/71/599991371.db2.gz XYGBUMAMIWEIJZ-ZDUSSCGKSA-N -1 3 374.506 3.726 20 0 FHADHM O=C([O-])c1cccc(NC(=O)CN[C@@H](c2ccc(Cl)cc2)C2CC2)c1 ZINC000739309333 600050308 /nfs/dbraw/zinc/05/03/08/600050308.db2.gz WTVMVSAZWCUFDJ-GOSISDBHSA-N -1 3 358.825 3.718 20 0 FHADHM CN(Cc1cccc(Br)c1)Cc1ccc(F)cc1C(=O)[O-] ZINC000071264988 600088045 /nfs/dbraw/zinc/08/80/45/600088045.db2.gz UUFVCMIECDWFTI-UHFFFAOYSA-N -1 3 352.203 3.918 20 0 FHADHM O=C([O-])c1cccc(CN2CCC(c3nc(-c4ccccc4)no3)CC2)c1 ZINC000666573469 600104627 /nfs/dbraw/zinc/10/46/27/600104627.db2.gz QDAJQSIKQOUPQS-UHFFFAOYSA-N -1 3 363.417 3.814 20 0 FHADHM Cc1sc(NC(=O)CN[C@H](c2ccccc2)C(C)C)c(C(=O)[O-])c1C ZINC000738998091 600117271 /nfs/dbraw/zinc/11/72/71/600117271.db2.gz XGYLIMYVOYQRLO-KRWDZBQOSA-N -1 3 360.479 3.989 20 0 FHADHM O=C(NC1(c2cccc(-c3nnn[n-]3)c2)CC1)c1cc2sccc2s1 ZINC000826428216 607424837 /nfs/dbraw/zinc/42/48/37/607424837.db2.gz SXLIJIWZAUESQQ-UHFFFAOYSA-N -1 3 367.459 3.562 20 0 FHADHM O=C(NC1(c2cccc(-c3nn[n-]n3)c2)CC1)c1cc2sccc2s1 ZINC000826428216 607424838 /nfs/dbraw/zinc/42/48/38/607424838.db2.gz SXLIJIWZAUESQQ-UHFFFAOYSA-N -1 3 367.459 3.562 20 0 FHADHM CCC[C@](C)(NCc1coc(-c2ccc(Br)cc2)n1)C(=O)[O-] ZINC000736962293 600154060 /nfs/dbraw/zinc/15/40/60/600154060.db2.gz HGERQLJVQWSMPY-INIZCTEOSA-N -1 3 367.243 3.837 20 0 FHADHM CCc1ccc2nc(NC(=O)c3ccc(-c4nnn[n-]4)cc3C)sc2c1 ZINC000825718057 607428212 /nfs/dbraw/zinc/42/82/12/607428212.db2.gz UTHGIDVKXYHRLR-UHFFFAOYSA-N -1 3 364.434 3.600 20 0 FHADHM CCc1ccc2nc(NC(=O)c3ccc(-c4nn[n-]n4)cc3C)sc2c1 ZINC000825718057 607428213 /nfs/dbraw/zinc/42/82/13/607428213.db2.gz UTHGIDVKXYHRLR-UHFFFAOYSA-N -1 3 364.434 3.600 20 0 FHADHM Cc1nc(C2CCCC2)sc1C(=O)N(C)c1ccc(-c2nnn[n-]2)cc1 ZINC000826324153 607434702 /nfs/dbraw/zinc/43/47/02/607434702.db2.gz GHMWMNGITSIUSJ-UHFFFAOYSA-N -1 3 368.466 3.566 20 0 FHADHM Cc1nc(C2CCCC2)sc1C(=O)N(C)c1ccc(-c2nn[n-]n2)cc1 ZINC000826324153 607434704 /nfs/dbraw/zinc/43/47/04/607434704.db2.gz GHMWMNGITSIUSJ-UHFFFAOYSA-N -1 3 368.466 3.566 20 0 FHADHM CCOc1ccc(C(C)=O)cc1CN[C@@](CC)(C(=O)[O-])c1ccccc1 ZINC000737195909 600305086 /nfs/dbraw/zinc/30/50/86/600305086.db2.gz ZLGMMRSOMLFTEE-OAQYLSRUSA-N -1 3 355.434 3.768 20 0 FHADHM C[C@@H]1CCCC[C@]1(CNC(=O)OC(C)(C)C)NCc1ccc(C(=O)[O-])o1 ZINC000387861907 600315680 /nfs/dbraw/zinc/31/56/80/600315680.db2.gz NIKCDFKUWWACBM-BFUOFWGJSA-N -1 3 366.458 3.541 20 0 FHADHM CCc1ccc(CN2CCc3cc(OC)c(OC)cc3[C@@H]2CC(=O)[O-])cc1 ZINC000737265852 600316811 /nfs/dbraw/zinc/31/68/11/600316811.db2.gz URLUTKAWBZCFLE-IBGZPJMESA-N -1 3 369.461 3.840 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@@H]2C(=O)N(C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000824347792 607437887 /nfs/dbraw/zinc/43/78/87/607437887.db2.gz NXQRPRBYWXPFRL-MOPGFXCFSA-N -1 3 361.449 3.757 20 0 FHADHM CC(C)c1ccc([C@H]2C[C@@H]2C(=O)N(C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000824347792 607437888 /nfs/dbraw/zinc/43/78/88/607437888.db2.gz NXQRPRBYWXPFRL-MOPGFXCFSA-N -1 3 361.449 3.757 20 0 FHADHM Cc1cc(NC(=O)c2oc3ccccc3c2CN(C)C)sc1C(=O)[O-] ZINC000738239330 600369907 /nfs/dbraw/zinc/36/99/07/600369907.db2.gz HODBZQVSTQFOAV-UHFFFAOYSA-N -1 3 358.419 3.815 20 0 FHADHM CC(C)C(=O)Nc1ccc(CN[C@@H](C(=O)[O-])c2cccc(Cl)c2)cc1 ZINC000736346495 600420404 /nfs/dbraw/zinc/42/04/04/600420404.db2.gz AQZUWJSQCPWFEL-QGZVFWFLSA-N -1 3 360.841 3.850 20 0 FHADHM O=C([O-])[C@H](NCc1ccc(Cn2cccn2)cc1)c1cccc(Cl)c1 ZINC000739500546 600421112 /nfs/dbraw/zinc/42/11/12/600421112.db2.gz ORUTUSPMLQKXEF-GOSISDBHSA-N -1 3 355.825 3.500 20 0 FHADHM O=C([O-])[C@H](NCc1cccc(NC(=O)C2CCC2)c1)c1cccc(Cl)c1 ZINC000739483625 600421381 /nfs/dbraw/zinc/42/13/81/600421381.db2.gz FZGFHGWCEQRQAY-GOSISDBHSA-N -1 3 372.852 3.994 20 0 FHADHM C[C@@H](N[C@H](C(=O)[O-])c1ccc(F)cc1)c1ccc(NC(=O)C2CC2)cc1 ZINC000736661277 600421597 /nfs/dbraw/zinc/42/15/97/600421597.db2.gz DPKJLQIQDCZVJQ-XIKOKIGWSA-N -1 3 356.397 3.651 20 0 FHADHM CN(C(=O)c1sccc1SC(F)F)c1ccc(-c2nnn[n-]2)cc1 ZINC000825833225 607443169 /nfs/dbraw/zinc/44/31/69/607443169.db2.gz CIXWZOVNWCABJO-UHFFFAOYSA-N -1 3 367.406 3.520 20 0 FHADHM CN(C(=O)c1sccc1SC(F)F)c1ccc(-c2nn[n-]n2)cc1 ZINC000825833225 607443171 /nfs/dbraw/zinc/44/31/71/607443171.db2.gz CIXWZOVNWCABJO-UHFFFAOYSA-N -1 3 367.406 3.520 20 0 FHADHM CCCC(=O)Nc1cccc(CN[C@H](C(=O)[O-])c2cccc(Cl)c2)c1 ZINC000736951403 600424589 /nfs/dbraw/zinc/42/45/89/600424589.db2.gz DBVBMKWUMVMINJ-SFHVURJKSA-N -1 3 360.841 3.994 20 0 FHADHM COc1cc(CN[C@@H](C(=O)[O-])c2ccc(Br)cc2)ccc1C 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/nfs/dbraw/zinc/53/68/75/607536875.db2.gz FEWDSRBIJZCEQX-CYBMUJFWSA-N -1 3 353.401 3.553 20 0 FHADHM O=C([O-])[C@H](c1cc(Cl)cc(Cl)c1)N1CCC(c2c[nH]cn2)CC1 ZINC000833172380 602050560 /nfs/dbraw/zinc/05/05/60/602050560.db2.gz UIBVSEDLAMMJGP-HNNXBMFYSA-N -1 3 354.237 3.722 20 0 FHADHM COc1ccc(CNc2ccc(Br)c(C)c2)cc1-c1nnn[n-]1 ZINC000826203682 607545249 /nfs/dbraw/zinc/54/52/49/607545249.db2.gz BEKAGTRBWUOXJX-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM COc1ccc(CNc2ccc(Br)c(C)c2)cc1-c1nn[n-]n1 ZINC000826203682 607545250 /nfs/dbraw/zinc/54/52/50/607545250.db2.gz BEKAGTRBWUOXJX-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM COc1ccc(CNc2ccc(C)cc2Br)cc1-c1nnn[n-]1 ZINC000826203815 607547330 /nfs/dbraw/zinc/54/73/30/607547330.db2.gz HJJAFUCTHMTTKT-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM COc1ccc(CNc2ccc(C)cc2Br)cc1-c1nn[n-]n1 ZINC000826203815 607547332 /nfs/dbraw/zinc/54/73/32/607547332.db2.gz HJJAFUCTHMTTKT-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM COc1cc(OC)cc([C@H](N[C@H]2CCSc3ccccc32)C(=O)[O-])c1 ZINC000832050950 602164136 /nfs/dbraw/zinc/16/41/36/602164136.db2.gz TYSAPXJETXGXSH-WMZOPIPTSA-N -1 3 359.447 3.656 20 0 FHADHM CCOc1cccc([C@@H](C)N[C@H](C(=O)[O-])c2cc(OC)cc(OC)c2)c1 ZINC000830100090 602169688 /nfs/dbraw/zinc/16/96/88/602169688.db2.gz VKMUSCSCQUPGHD-YJYMSZOUSA-N -1 3 359.422 3.579 20 0 FHADHM c1csc(CSc2nc(-c3ccccc3)ccc2-c2nnn[n-]2)n1 ZINC000826519425 607548551 /nfs/dbraw/zinc/54/85/51/607548551.db2.gz YBFYLJVJPVSVIH-UHFFFAOYSA-N -1 3 352.448 3.678 20 0 FHADHM c1csc(CSc2nc(-c3ccccc3)ccc2-c2nn[n-]n2)n1 ZINC000826519425 607548552 /nfs/dbraw/zinc/54/85/52/607548552.db2.gz YBFYLJVJPVSVIH-UHFFFAOYSA-N -1 3 352.448 3.678 20 0 FHADHM CN(C)CCN(Cc1ccccc1)C(=O)Nc1cc(NC(=O)[O-])ccc1F ZINC000739613116 603032561 /nfs/dbraw/zinc/03/25/61/603032561.db2.gz NOXVVFFSMJPRSQ-UHFFFAOYSA-N -1 3 374.416 3.511 20 0 FHADHM CC(C)[C@@](C)(CNC(=O)[O-])NCC(=O)Nc1ccccc1-c1ccccc1 ZINC000738769848 603078553 /nfs/dbraw/zinc/07/85/53/603078553.db2.gz 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ZINC000826316323 607655887 /nfs/dbraw/zinc/65/58/87/607655887.db2.gz KJOYMDGMGQYQJD-QWRGUYRKSA-N -1 3 359.842 3.632 20 0 FHADHM Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000826316323 607655888 /nfs/dbraw/zinc/65/58/88/607655888.db2.gz KJOYMDGMGQYQJD-QWRGUYRKSA-N -1 3 359.842 3.632 20 0 FHADHM CCSc1ccc([C@@H](C)NC(=O)c2ccc(-c3nnn[n-]3)cc2C)cc1 ZINC000825674339 607684479 /nfs/dbraw/zinc/68/44/79/607684479.db2.gz JHCOJPFLNZECNX-CYBMUJFWSA-N -1 3 367.478 3.778 20 0 FHADHM CCSc1ccc([C@@H](C)NC(=O)c2ccc(-c3nn[n-]n3)cc2C)cc1 ZINC000825674339 607684481 /nfs/dbraw/zinc/68/44/81/607684481.db2.gz JHCOJPFLNZECNX-CYBMUJFWSA-N -1 3 367.478 3.778 20 0 FHADHM CN(Cc1nc2cc(C(F)(F)F)ccc2o1)C1CCC(NC(=O)[O-])CC1 ZINC000828419728 604346196 /nfs/dbraw/zinc/34/61/96/604346196.db2.gz AJXCTTYRFRTVHM-UHFFFAOYSA-N -1 3 371.359 3.857 20 0 FHADHM Cc1cc([C@@H](C)N2CCC(C(=O)NC3CCCCC3)CC2)oc1C(=O)[O-] ZINC000832871453 604384390 /nfs/dbraw/zinc/38/43/90/604384390.db2.gz ROTZDVCPTAGTBF-CQSZACIVSA-N -1 3 362.470 3.508 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N(C)c1cc(Cl)cc(Cl)c1 ZINC000826243581 607689814 /nfs/dbraw/zinc/68/98/14/607689814.db2.gz NMFMPDFTPGXIBS-UHFFFAOYSA-N -1 3 362.220 3.759 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N(C)c1cc(Cl)cc(Cl)c1 ZINC000826243581 607689816 /nfs/dbraw/zinc/68/98/16/607689816.db2.gz NMFMPDFTPGXIBS-UHFFFAOYSA-N -1 3 362.220 3.759 20 0 FHADHM O=C([O-])[C@@H](NCc1ccc2c(c1)COC2)c1cc(Cl)cc(Cl)c1 ZINC000833170636 604401343 /nfs/dbraw/zinc/40/13/43/604401343.db2.gz ZVZKZVGBYGYFRQ-INIZCTEOSA-N -1 3 352.217 3.939 20 0 FHADHM Cc1ccc(-c2n[nH]cc2CNCc2ccc([C@H](C)NC(=O)[O-])cc2)o1 ZINC000830155430 604413590 /nfs/dbraw/zinc/41/35/90/604413590.db2.gz OHGFOCGWPBIYBP-ZDUSSCGKSA-N -1 3 354.410 3.597 20 0 FHADHM C[C@H](C(=O)[O-])[C@H](NCc1ccc(OCC(F)(F)F)nc1)c1ccccc1 ZINC000826055012 604484187 /nfs/dbraw/zinc/48/41/87/604484187.db2.gz UPJOMULFOXIIKE-LRDDRELGSA-N -1 3 368.355 3.574 20 0 FHADHM C[C@H](C(=O)[O-])[C@@H](NCc1ccc(OCC(F)(F)F)nc1)c1ccccc1 ZINC000826055011 604484540 /nfs/dbraw/zinc/48/45/40/604484540.db2.gz UPJOMULFOXIIKE-BLLLJJGKSA-N -1 3 368.355 3.574 20 0 FHADHM C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1cc(C(=O)[O-])cs1 ZINC000828461664 604509337 /nfs/dbraw/zinc/50/93/37/604509337.db2.gz BFGQRMWLNIUDMF-AWEZNQCLSA-N -1 3 373.478 3.575 20 0 FHADHM O=C([O-])N1CCC[C@H](CN[C@@H](c2cccc(Cl)c2)c2ccccn2)C1 ZINC000831980103 604527117 /nfs/dbraw/zinc/52/71/17/604527117.db2.gz CSVZCJQMELLLHC-KDOFPFPSSA-N -1 3 359.857 3.804 20 0 FHADHM CC(C)(C)n1cc(CN2CC[C@@H](C(=O)[O-])C2)c(-c2ccccc2Cl)n1 ZINC000263426559 604545451 /nfs/dbraw/zinc/54/54/51/604545451.db2.gz QTOZUFBLVOQDNW-CYBMUJFWSA-N -1 3 361.873 3.865 20 0 FHADHM C[C@@H](Oc1ccc(CN(Cc2ccccc2)C[C@@H]2CCCO2)cc1)C(=O)[O-] ZINC000833538204 604607887 /nfs/dbraw/zinc/60/78/87/604607887.db2.gz RRJJRXCSOVFHII-UTKZUKDTSA-N -1 3 369.461 3.720 20 0 FHADHM C[C@H](Oc1ccc(CN2CCC(OC3CCCCC3)CC2)cc1)C(=O)[O-] ZINC000833538973 604623133 /nfs/dbraw/zinc/62/31/33/604623133.db2.gz FCXYWBBVDGROLX-INIZCTEOSA-N -1 3 361.482 3.852 20 0 FHADHM CCCN(C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@H](C)c1cc2ccccc2o1 ZINC000825302052 607705328 /nfs/dbraw/zinc/70/53/28/607705328.db2.gz UTHMWVVMBWNABS-GFCCVEGCSA-N -1 3 364.409 3.554 20 0 FHADHM CCCN(C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@H](C)c1cc2ccccc2o1 ZINC000825302052 607705331 /nfs/dbraw/zinc/70/53/31/607705331.db2.gz UTHMWVVMBWNABS-GFCCVEGCSA-N -1 3 364.409 3.554 20 0 FHADHM O=C([O-])[C@H]1CC12CCN(CC1=Cc3cc(Cl)cc(Cl)c3OC1)CC2 ZINC000833771581 604648107 /nfs/dbraw/zinc/64/81/07/604648107.db2.gz JQFGUDSYLPHOBV-CQSZACIVSA-N -1 3 368.260 3.956 20 0 FHADHM C[C@@H](Oc1ccc(CN2CCS[C@H](c3ccccc3)C2)cc1)C(=O)[O-] ZINC000833539719 604653252 /nfs/dbraw/zinc/65/32/52/604653252.db2.gz IAJKORYQJVHXNL-BEFAXECRSA-N -1 3 357.475 3.829 20 0 FHADHM CC(C)(C(=O)[O-])[C@@H]1CCCN(Cc2nnc(-c3ccc(Cl)cc3)o2)C1 ZINC000392706561 604939829 /nfs/dbraw/zinc/93/98/29/604939829.db2.gz XMMXNLGRRWRAMI-CYBMUJFWSA-N -1 3 363.845 3.713 20 0 FHADHM C[C@@H](C(=O)Nc1ccc2ccccc2c1)N1CCC[C@@H](C(C)(C)C(=O)[O-])C1 ZINC000833409539 604949417 /nfs/dbraw/zinc/94/94/17/604949417.db2.gz OILOQLJEQLMOTP-MAUKXSAKSA-N -1 3 368.477 3.990 20 0 FHADHM C[C@H](N[C@H](C(=O)[O-])c1cccnc1)c1ccc(OCc2cccnc2)cc1 ZINC000827716880 604991180 /nfs/dbraw/zinc/99/11/80/604991180.db2.gz BRVFMMABLFAICU-YWZLYKJASA-N -1 3 363.417 3.532 20 0 FHADHM c1ccc([C@H]2CN(c3cc(-c4nnn[n-]4)c4ccccc4n3)CCS2)cc1 ZINC000826520120 607728741 /nfs/dbraw/zinc/72/87/41/607728741.db2.gz AXNPKLUHBZYXFC-GOSISDBHSA-N -1 3 374.473 3.709 20 0 FHADHM c1ccc([C@H]2CN(c3cc(-c4nn[n-]n4)c4ccccc4n3)CCS2)cc1 ZINC000826520120 607728742 /nfs/dbraw/zinc/72/87/42/607728742.db2.gz AXNPKLUHBZYXFC-GOSISDBHSA-N -1 3 374.473 3.709 20 0 FHADHM COCCCOc1cccc(CNc2c(Cl)cccc2-c2nnn[n-]2)c1 ZINC000826157309 607730051 /nfs/dbraw/zinc/73/00/51/607730051.db2.gz QLHDVPCMVIVAON-UHFFFAOYSA-N -1 3 373.844 3.548 20 0 FHADHM COCCCOc1cccc(CNc2c(Cl)cccc2-c2nn[n-]n2)c1 ZINC000826157309 607730053 /nfs/dbraw/zinc/73/00/53/607730053.db2.gz QLHDVPCMVIVAON-UHFFFAOYSA-N -1 3 373.844 3.548 20 0 FHADHM COCCCOc1cccc(CNc2cc(Cl)ccc2-c2nnn[n-]2)c1 ZINC000826157268 607730073 /nfs/dbraw/zinc/73/00/73/607730073.db2.gz NTBRFVGIYGFMFJ-UHFFFAOYSA-N -1 3 373.844 3.548 20 0 FHADHM COCCCOc1cccc(CNc2cc(Cl)ccc2-c2nn[n-]n2)c1 ZINC000826157268 607730075 /nfs/dbraw/zinc/73/00/75/607730075.db2.gz NTBRFVGIYGFMFJ-UHFFFAOYSA-N -1 3 373.844 3.548 20 0 FHADHM C[C@H](Oc1ccc(CN[C@H]2CCCc3c2cnn3C(C)(C)C)cc1)C(=O)[O-] ZINC000833540892 605091342 /nfs/dbraw/zinc/09/13/42/605091342.db2.gz NUKLZUPRBPJDLZ-KSSFIOAISA-N -1 3 371.481 3.657 20 0 FHADHM CC1CCC(OC2CCN(CCOc3ccccc3C(=O)[O-])CC2)CC1 ZINC000364254376 605210072 /nfs/dbraw/zinc/21/00/72/605210072.db2.gz PFFVUBBTCIDRFO-UHFFFAOYSA-N -1 3 361.482 3.823 20 0 FHADHM O=C(Nc1cccc(CSC2CCCC2)c1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC000826456807 607742290 /nfs/dbraw/zinc/74/22/90/607742290.db2.gz YDCGEIIJTULZKR-UHFFFAOYSA-N -1 3 368.466 3.623 20 0 FHADHM O=C(Nc1cccc(CSC2CCCC2)c1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC000826456807 607742291 /nfs/dbraw/zinc/74/22/91/607742291.db2.gz YDCGEIIJTULZKR-UHFFFAOYSA-N -1 3 368.466 3.623 20 0 FHADHM CC1=C(C(=O)[O-])C[C@@H](CN2CC=C(c3c[nH]c4cc(F)ccc43)CC2)O1 ZINC000833585108 605360820 /nfs/dbraw/zinc/36/08/20/605360820.db2.gz UJAIYXDPIVLMMJ-HNNXBMFYSA-N -1 3 356.397 3.544 20 0 FHADHM CC1(C)CCCC[C@H]1CC(=O)NC1(c2cccc(-c3nnn[n-]3)c2)CC1 ZINC000824803095 607756854 /nfs/dbraw/zinc/75/68/54/607756854.db2.gz SOXJSFCGOZOELP-HNNXBMFYSA-N -1 3 353.470 3.579 20 0 FHADHM CC1(C)CCCC[C@H]1CC(=O)NC1(c2cccc(-c3nn[n-]n3)c2)CC1 ZINC000824803095 607756855 /nfs/dbraw/zinc/75/68/55/607756855.db2.gz SOXJSFCGOZOELP-HNNXBMFYSA-N -1 3 353.470 3.579 20 0 FHADHM C[C@@H](c1ccc(C(=O)[O-])o1)N1CCC(n2ccc(C(F)(F)F)n2)CC1 ZINC000574578923 605474408 /nfs/dbraw/zinc/47/44/08/605474408.db2.gz WKCXDNHTWJLYGH-JTQLQIEISA-N -1 3 357.332 3.591 20 0 FHADHM O=C([O-])N1CCC[C@@H]1C1CCN(Cc2cnc(-c3ccncc3)s2)CC1 ZINC000834104622 605495415 /nfs/dbraw/zinc/49/54/15/605495415.db2.gz DMPUEUADHRQUAM-QGZVFWFLSA-N -1 3 372.494 3.560 20 0 FHADHM O=C([O-])N1CCc2cccc(CN3CCCO[C@@H](c4ccccc4)C3)c21 ZINC000834124035 605588515 /nfs/dbraw/zinc/58/85/15/605588515.db2.gz ZLJAYYCASLIBRP-LJQANCHMSA-N -1 3 352.434 3.691 20 0 FHADHM O=C(Nc1cccc2ccsc21)Nc1ccc(F)cc1-c1nnn[n-]1 ZINC000826454033 607764561 /nfs/dbraw/zinc/76/45/61/607764561.db2.gz HSNHVFODZSYULJ-UHFFFAOYSA-N -1 3 354.370 3.865 20 0 FHADHM O=C(Nc1cccc2ccsc21)Nc1ccc(F)cc1-c1nn[n-]n1 ZINC000826454033 607764562 /nfs/dbraw/zinc/76/45/62/607764562.db2.gz HSNHVFODZSYULJ-UHFFFAOYSA-N -1 3 354.370 3.865 20 0 FHADHM O=C([O-])N1CCC(CCN2CCC(C(F)(F)F)(C(F)(F)F)C2)CC1 ZINC000834079271 605605509 /nfs/dbraw/zinc/60/55/09/605605509.db2.gz VRNVRPZWLQEXGB-UHFFFAOYSA-N -1 3 362.314 3.583 20 0 FHADHM O=C(NCc1ccc(-c2nnn[n-]2)cc1F)Nc1cccc2ccsc21 ZINC000826441707 607768474 /nfs/dbraw/zinc/76/84/74/607768474.db2.gz PZHIEEHCNKKRPD-UHFFFAOYSA-N -1 3 368.397 3.542 20 0 FHADHM O=C(NCc1ccc(-c2nn[n-]n2)cc1F)Nc1cccc2ccsc21 ZINC000826441707 607768475 /nfs/dbraw/zinc/76/84/75/607768475.db2.gz PZHIEEHCNKKRPD-UHFFFAOYSA-N -1 3 368.397 3.542 20 0 FHADHM Cc1ccsc1C(=O)Nc1nc(-c2cccc(-c3nnn[n-]3)c2)cs1 ZINC000826315510 607769718 /nfs/dbraw/zinc/76/97/18/607769718.db2.gz LQHOXZDVKHIBIO-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM Cc1ccsc1C(=O)Nc1nc(-c2cccc(-c3nn[n-]n3)c2)cs1 ZINC000826315510 607769719 /nfs/dbraw/zinc/76/97/19/607769719.db2.gz LQHOXZDVKHIBIO-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM C[C@@H]1CCC[C@H](C(=O)Nc2nc(-c3cccc(-c4nnn[n-]4)c3)cs2)C1 ZINC000824928434 607770308 /nfs/dbraw/zinc/77/03/08/607770308.db2.gz SLHVKVCIRBNMFH-RISCZKNCSA-N -1 3 368.466 3.755 20 0 FHADHM C[C@@H]1CCC[C@H](C(=O)Nc2nc(-c3cccc(-c4nn[n-]n4)c3)cs2)C1 ZINC000824928434 607770309 /nfs/dbraw/zinc/77/03/09/607770309.db2.gz SLHVKVCIRBNMFH-RISCZKNCSA-N -1 3 368.466 3.755 20 0 FHADHM O=C(Nc1nc(-c2cccc(-c3nnn[n-]3)c2)cs1)C(F)=C1CCCC1 ZINC000826459674 607771631 /nfs/dbraw/zinc/77/16/31/607771631.db2.gz UIMVHOPLBZBGMM-UHFFFAOYSA-N -1 3 370.413 3.726 20 0 FHADHM O=C(Nc1nc(-c2cccc(-c3nn[n-]n3)c2)cs1)C(F)=C1CCCC1 ZINC000826459674 607771632 /nfs/dbraw/zinc/77/16/32/607771632.db2.gz UIMVHOPLBZBGMM-UHFFFAOYSA-N -1 3 370.413 3.726 20 0 FHADHM CCOc1cc(CN[C@H]2C[C@@H](NC(=O)[O-])c3ccccc32)ccc1OC ZINC000833861017 605799153 /nfs/dbraw/zinc/79/91/53/605799153.db2.gz DZLQKDWYOJFOTE-DLBZAZTESA-N -1 3 356.422 3.637 20 0 FHADHM CCOc1cc(CN[C@@H]2C[C@@H](NC(=O)[O-])c3ccccc32)ccc1OC ZINC000833861026 605799239 /nfs/dbraw/zinc/79/92/39/605799239.db2.gz DZLQKDWYOJFOTE-IAGOWNOFSA-N -1 3 356.422 3.637 20 0 FHADHM O=C([O-])N1CCC[C@@H]1[C@@H]1CCC[C@H]1NCc1coc(-c2ccccc2)n1 ZINC000834108863 605990155 /nfs/dbraw/zinc/99/01/55/605990155.db2.gz RUKLJRVUTQOTAJ-KZNAEPCWSA-N -1 3 355.438 3.742 20 0 FHADHM C[C@@H](Nc1nc2ccccc2cc1-c1nnn[n-]1)c1ccc(F)c(F)c1 ZINC000820462592 606026593 /nfs/dbraw/zinc/02/65/93/606026593.db2.gz YWVDDBRAWDSGHG-SNVBAGLBSA-N -1 3 352.348 3.866 20 0 FHADHM C[C@@H](Nc1nc2ccccc2cc1-c1nn[n-]n1)c1ccc(F)c(F)c1 ZINC000820462592 606026599 /nfs/dbraw/zinc/02/65/99/606026599.db2.gz YWVDDBRAWDSGHG-SNVBAGLBSA-N -1 3 352.348 3.866 20 0 FHADHM CC[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)cc2)CC[C@H]1c1ccccc1 ZINC000820989299 606029748 /nfs/dbraw/zinc/02/97/48/606029748.db2.gz QCMZNAHMQBALSL-DNVCBOLYSA-N -1 3 361.449 3.523 20 0 FHADHM CC[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)cc2)CC[C@H]1c1ccccc1 ZINC000820989299 606029752 /nfs/dbraw/zinc/02/97/52/606029752.db2.gz QCMZNAHMQBALSL-DNVCBOLYSA-N -1 3 361.449 3.523 20 0 FHADHM FC(F)(F)[C@H]1CCC[C@@H](Nc2nc3ccccc3cc2-c2nnn[n-]2)C1 ZINC000822713914 606034723 /nfs/dbraw/zinc/03/47/23/606034723.db2.gz BMMBSPXICBGAMH-NWDGAFQWSA-N -1 3 362.359 3.948 20 0 FHADHM FC(F)(F)[C@H]1CCC[C@@H](Nc2nc3ccccc3cc2-c2nn[n-]n2)C1 ZINC000822713914 606034727 /nfs/dbraw/zinc/03/47/27/606034727.db2.gz BMMBSPXICBGAMH-NWDGAFQWSA-N -1 3 362.359 3.948 20 0 FHADHM c1ccc2c(c1)cccc2C1CCN(c2ccc(-c3nnn[n-]3)nc2)CC1 ZINC000823791885 606065510 /nfs/dbraw/zinc/06/55/10/606065510.db2.gz LSDZVBNFHNMZTG-UHFFFAOYSA-N -1 3 356.433 3.799 20 0 FHADHM c1ccc2c(c1)cccc2C1CCN(c2ccc(-c3nn[n-]n3)nc2)CC1 ZINC000823791885 606065516 /nfs/dbraw/zinc/06/55/16/606065516.db2.gz LSDZVBNFHNMZTG-UHFFFAOYSA-N -1 3 356.433 3.799 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(-c2nnn[n-]2)cc1)c1ccc(Cl)c(Cl)c1 ZINC000471905871 606098968 /nfs/dbraw/zinc/09/89/68/606098968.db2.gz NTYKQZSHJJJIIR-SECBINFHSA-N -1 3 362.220 3.916 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(-c2nn[n-]n2)cc1)c1ccc(Cl)c(Cl)c1 ZINC000471905871 606098970 /nfs/dbraw/zinc/09/89/70/606098970.db2.gz NTYKQZSHJJJIIR-SECBINFHSA-N -1 3 362.220 3.916 20 0 FHADHM COC1CCC(CNc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)CC1 ZINC000821679889 606103242 /nfs/dbraw/zinc/10/32/42/606103242.db2.gz QEEZQCUXCFKIHU-UHFFFAOYSA-N -1 3 355.364 3.503 20 0 FHADHM O=C(C/C=C\c1cccc(F)c1)Nc1sc2c(c1-c1nnn[n-]1)CCC2 ZINC000822945827 606122180 /nfs/dbraw/zinc/12/21/80/606122180.db2.gz RRZXEPJSLJFWLB-DJWKRKHSSA-N -1 3 369.425 3.598 20 0 FHADHM O=C(C/C=C\c1cccc(F)c1)Nc1sc2c(c1-c1nn[n-]n1)CCC2 ZINC000822945827 606122182 /nfs/dbraw/zinc/12/21/82/606122182.db2.gz RRZXEPJSLJFWLB-DJWKRKHSSA-N -1 3 369.425 3.598 20 0 FHADHM Cc1sc(NC(=O)C/C=C/c2cccc(F)c2)c(-c2nnn[n-]2)c1C ZINC000822558083 606122236 /nfs/dbraw/zinc/12/22/36/606122236.db2.gz MJQJVWOISWZWJG-GQCTYLIASA-N -1 3 357.414 3.726 20 0 FHADHM Cc1sc(NC(=O)C/C=C/c2cccc(F)c2)c(-c2nn[n-]n2)c1C ZINC000822558083 606122237 /nfs/dbraw/zinc/12/22/37/606122237.db2.gz MJQJVWOISWZWJG-GQCTYLIASA-N -1 3 357.414 3.726 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H]1CCCC1(C)C ZINC000820086810 606130289 /nfs/dbraw/zinc/13/02/89/606130289.db2.gz FXVJQNBKNVPMAJ-QGZVFWFLSA-N -1 3 370.501 3.613 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H]1CCCC1(C)C ZINC000820086810 606130290 /nfs/dbraw/zinc/13/02/90/606130290.db2.gz FXVJQNBKNVPMAJ-QGZVFWFLSA-N -1 3 370.501 3.613 20 0 FHADHM CO[C@@H](C)c1nc(CSCc2ccc(F)cc2-c2nnn[n-]2)cs1 ZINC000821675332 606179544 /nfs/dbraw/zinc/17/95/44/606179544.db2.gz IYSDNCLAVLXPNS-VIFPVBQESA-N -1 3 365.459 3.603 20 0 FHADHM CO[C@@H](C)c1nc(CSCc2ccc(F)cc2-c2nn[n-]n2)cs1 ZINC000821675332 606179546 /nfs/dbraw/zinc/17/95/46/606179546.db2.gz IYSDNCLAVLXPNS-VIFPVBQESA-N -1 3 365.459 3.603 20 0 FHADHM Cc1ncsc1CCOc1ccc(-c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000822481661 606182290 /nfs/dbraw/zinc/18/22/90/606182290.db2.gz ATDQVTOFHQLKCO-UHFFFAOYSA-N -1 3 363.446 3.920 20 0 FHADHM Cc1ncsc1CCOc1ccc(-c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000822481661 606182293 /nfs/dbraw/zinc/18/22/93/606182293.db2.gz ATDQVTOFHQLKCO-UHFFFAOYSA-N -1 3 363.446 3.920 20 0 FHADHM CC(C)=C(C)C(=O)Nc1cccc(OCc2cccc(-c3nnn[n-]3)c2)c1 ZINC000820005034 606201861 /nfs/dbraw/zinc/20/18/61/606201861.db2.gz JOGWYLZXOHUPJV-UHFFFAOYSA-N -1 3 363.421 3.741 20 0 FHADHM CC(C)=C(C)C(=O)Nc1cccc(OCc2cccc(-c3nn[n-]n3)c2)c1 ZINC000820005034 606201864 /nfs/dbraw/zinc/20/18/64/606201864.db2.gz JOGWYLZXOHUPJV-UHFFFAOYSA-N -1 3 363.421 3.741 20 0 FHADHM COc1ccc(CN[C@@H](C)c2c(F)cccc2Cl)cc1-c1nnn[n-]1 ZINC000821805347 606224876 /nfs/dbraw/zinc/22/48/76/606224876.db2.gz UEUXOTWQOAZYMX-JTQLQIEISA-N -1 3 361.808 3.519 20 0 FHADHM COc1ccc(CN[C@@H](C)c2c(F)cccc2Cl)cc1-c1nn[n-]n1 ZINC000821805347 606224877 /nfs/dbraw/zinc/22/48/77/606224877.db2.gz UEUXOTWQOAZYMX-JTQLQIEISA-N -1 3 361.808 3.519 20 0 FHADHM O=C(Nc1ccc(Oc2ccccc2-c2nnn[n-]2)cc1)[C@H]1C[C@H]1C1CC1 ZINC000823357657 606236801 /nfs/dbraw/zinc/23/68/01/606236801.db2.gz XDWHQLHNVUIIMA-IRXDYDNUSA-N -1 3 361.405 3.644 20 0 FHADHM O=C(Nc1ccc(Oc2ccccc2-c2nn[n-]n2)cc1)[C@H]1C[C@H]1C1CC1 ZINC000823357657 606236803 /nfs/dbraw/zinc/23/68/03/606236803.db2.gz XDWHQLHNVUIIMA-IRXDYDNUSA-N -1 3 361.405 3.644 20 0 FHADHM c1cc(Oc2ncnc3c2CCC3)ccc1Oc1ccc(-c2nnn[n-]2)cc1 ZINC000823820391 606242545 /nfs/dbraw/zinc/24/25/45/606242545.db2.gz FFTZEBYSGWRQQV-UHFFFAOYSA-N -1 3 372.388 3.730 20 0 FHADHM c1cc(Oc2ncnc3c2CCC3)ccc1Oc1ccc(-c2nn[n-]n2)cc1 ZINC000823820391 606242547 /nfs/dbraw/zinc/24/25/47/606242547.db2.gz FFTZEBYSGWRQQV-UHFFFAOYSA-N -1 3 372.388 3.730 20 0 FHADHM O=C(Oc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1)[C@H]1C[C@@H]1C1CC1 ZINC000823453821 606261028 /nfs/dbraw/zinc/26/10/28/606261028.db2.gz ATQANMIKQNMSPT-MSOLQXFVSA-N -1 3 362.389 3.611 20 0 FHADHM O=C(Oc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1)[C@H]1C[C@@H]1C1CC1 ZINC000823453821 606261029 /nfs/dbraw/zinc/26/10/29/606261029.db2.gz ATQANMIKQNMSPT-MSOLQXFVSA-N -1 3 362.389 3.611 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@@H]2C(=O)Nc2ccc(F)cc2-c2nnn[n-]2)cc1 ZINC000820192784 606266172 /nfs/dbraw/zinc/26/61/72/606266172.db2.gz ZIJVRGKEKBHWFR-HOTGVXAUSA-N -1 3 365.412 3.871 20 0 FHADHM CC(C)c1ccc([C@@H]2C[C@@H]2C(=O)Nc2ccc(F)cc2-c2nn[n-]n2)cc1 ZINC000820192784 606266175 /nfs/dbraw/zinc/26/61/75/606266175.db2.gz ZIJVRGKEKBHWFR-HOTGVXAUSA-N -1 3 365.412 3.871 20 0 FHADHM Cc1cc2occ(CC(=O)Nc3ccc(F)cc3-c3nnn[n-]3)c2cc1C ZINC000822213170 606273043 /nfs/dbraw/zinc/27/30/43/606273043.db2.gz XIHFEBALIMNIOM-UHFFFAOYSA-N -1 3 365.368 3.550 20 0 FHADHM Cc1cc2occ(CC(=O)Nc3ccc(F)cc3-c3nn[n-]n3)c2cc1C ZINC000822213170 606273045 /nfs/dbraw/zinc/27/30/45/606273045.db2.gz XIHFEBALIMNIOM-UHFFFAOYSA-N -1 3 365.368 3.550 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@H](C)c1ccccc1F ZINC000821118277 606281065 /nfs/dbraw/zinc/28/10/65/606281065.db2.gz KMGLORCGIHLQBH-GFCCVEGCSA-N -1 3 368.416 3.570 20 0 FHADHM Fc1ccc(-c2cnc(CSc3cccc(-c4nnn[n-]4)c3)o2)cc1 ZINC000822753135 606328994 /nfs/dbraw/zinc/32/89/94/606328994.db2.gz GDBKZHOVLNPYOC-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM Fc1ccc(-c2cnc(CSc3cccc(-c4nn[n-]n4)c3)o2)cc1 ZINC000822753135 606328995 /nfs/dbraw/zinc/32/89/95/606328995.db2.gz GDBKZHOVLNPYOC-UHFFFAOYSA-N -1 3 353.382 3.953 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)N(CC1CC1)C1CCCCC1 ZINC000823343603 606346759 /nfs/dbraw/zinc/34/67/59/606346759.db2.gz AUMFRUPBMULUJP-UHFFFAOYSA-N -1 3 358.421 3.582 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)N(CC1CC1)C1CCCCC1 ZINC000823343603 606346760 /nfs/dbraw/zinc/34/67/60/606346760.db2.gz AUMFRUPBMULUJP-UHFFFAOYSA-N -1 3 358.421 3.582 20 0 FHADHM CC1(C)CN(C(=O)Nc2ccc(F)cc2-c2nnn[n-]2)[C@H]1c1ccccc1 ZINC000820601712 606347346 /nfs/dbraw/zinc/34/73/46/606347346.db2.gz SKAPWJFWMRYWFF-INIZCTEOSA-N -1 3 366.400 3.621 20 0 FHADHM CC1(C)CN(C(=O)Nc2ccc(F)cc2-c2nn[n-]n2)[C@H]1c1ccccc1 ZINC000820601712 606347347 /nfs/dbraw/zinc/34/73/47/606347347.db2.gz SKAPWJFWMRYWFF-INIZCTEOSA-N -1 3 366.400 3.621 20 0 FHADHM Cc1cccc2[nH]cc(CC(=O)O[C@H](C)c3ccc(-c4nnn[n-]4)cc3)c21 ZINC000822331989 606348440 /nfs/dbraw/zinc/34/84/40/606348440.db2.gz KEGKHZADKKZGNJ-CYBMUJFWSA-N -1 3 361.405 3.503 20 0 FHADHM Cc1cccc2[nH]cc(CC(=O)O[C@H](C)c3ccc(-c4nn[n-]n4)cc3)c21 ZINC000822331989 606348442 /nfs/dbraw/zinc/34/84/42/606348442.db2.gz KEGKHZADKKZGNJ-CYBMUJFWSA-N -1 3 361.405 3.503 20 0 FHADHM C[C@@H](OC(=O)CCSc1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820496615 606350434 /nfs/dbraw/zinc/35/04/34/606350434.db2.gz NFRNNLYRHUGLOM-CYBMUJFWSA-N -1 3 354.435 3.653 20 0 FHADHM C[C@@H](OC(=O)CCSc1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820496615 606350435 /nfs/dbraw/zinc/35/04/35/606350435.db2.gz NFRNNLYRHUGLOM-CYBMUJFWSA-N -1 3 354.435 3.653 20 0 FHADHM C[C@@H](OC(=O)[C@@H]1SCCc2ccccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488143 606350488 /nfs/dbraw/zinc/35/04/88/606350488.db2.gz LOPQJKCFJRCUEZ-SJKOYZFVSA-N -1 3 366.446 3.502 20 0 FHADHM C[C@@H](OC(=O)[C@@H]1SCCc2ccccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488143 606350489 /nfs/dbraw/zinc/35/04/89/606350489.db2.gz LOPQJKCFJRCUEZ-SJKOYZFVSA-N -1 3 366.446 3.502 20 0 FHADHM Cc1ccc(OCCC(=O)O[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1C ZINC000822262890 606353387 /nfs/dbraw/zinc/35/33/87/606353387.db2.gz GAZNHSIMNMNZQR-OAHLLOKOSA-N -1 3 366.421 3.557 20 0 FHADHM Cc1ccc(OCCC(=O)O[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1C ZINC000822262890 606353389 /nfs/dbraw/zinc/35/33/89/606353389.db2.gz GAZNHSIMNMNZQR-OAHLLOKOSA-N -1 3 366.421 3.557 20 0 FHADHM CS[C@H](C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000821943961 606357149 /nfs/dbraw/zinc/35/71/49/606357149.db2.gz YPWLQYMNXYQOED-LRDDRELGSA-N -1 3 354.435 3.575 20 0 FHADHM CS[C@H](C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000821943961 606357150 /nfs/dbraw/zinc/35/71/50/606357150.db2.gz YPWLQYMNXYQOED-LRDDRELGSA-N -1 3 354.435 3.575 20 0 FHADHM Cc1nc2ccccc2cc1C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000822462992 606358696 /nfs/dbraw/zinc/35/86/96/606358696.db2.gz MBYKFQRKHLRPED-ZDUSSCGKSA-N -1 3 359.389 3.641 20 0 FHADHM Cc1nc2ccccc2cc1C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000822462992 606358697 /nfs/dbraw/zinc/35/86/97/606358697.db2.gz MBYKFQRKHLRPED-ZDUSSCGKSA-N -1 3 359.389 3.641 20 0 FHADHM Cc1c(C(=O)O[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cnc2ccccc12 ZINC000822020889 606372688 /nfs/dbraw/zinc/37/26/88/606372688.db2.gz MVVSLBZUBGPJMQ-CYBMUJFWSA-N -1 3 359.389 3.641 20 0 FHADHM Cc1c(C(=O)O[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cnc2ccccc12 ZINC000822020889 606372691 /nfs/dbraw/zinc/37/26/91/606372691.db2.gz MVVSLBZUBGPJMQ-CYBMUJFWSA-N -1 3 359.389 3.641 20 0 FHADHM CC[C@@H](C)CN(CC)C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000820870343 606382071 /nfs/dbraw/zinc/38/20/71/606382071.db2.gz QWQKZIBKOJXCAD-SNVBAGLBSA-N -1 3 370.379 3.785 20 0 FHADHM CC[C@@H](C)CN(CC)C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000820870343 606382073 /nfs/dbraw/zinc/38/20/73/606382073.db2.gz QWQKZIBKOJXCAD-SNVBAGLBSA-N -1 3 370.379 3.785 20 0 FHADHM CCS[C@H]1CCC[C@@H](Nc2nc(C(F)(F)F)ccc2-c2nnn[n-]2)C1 ZINC000821455366 606401050 /nfs/dbraw/zinc/40/10/50/606401050.db2.gz JUFQMKLIUGLXQI-ZJUUUORDSA-N -1 3 372.420 3.757 20 0 FHADHM CCS[C@H]1CCC[C@@H](Nc2nc(C(F)(F)F)ccc2-c2nn[n-]n2)C1 ZINC000821455366 606401051 /nfs/dbraw/zinc/40/10/51/606401051.db2.gz JUFQMKLIUGLXQI-ZJUUUORDSA-N -1 3 372.420 3.757 20 0 FHADHM CC[C@@H](Nc1cc(-c2nnn[n-]2)c2ccccc2n1)c1ccc(OC)cc1 ZINC000820925587 606441753 /nfs/dbraw/zinc/44/17/53/606441753.db2.gz JWXNWLJYFSOUQV-QGZVFWFLSA-N -1 3 360.421 3.987 20 0 FHADHM CC[C@@H](Nc1cc(-c2nn[n-]n2)c2ccccc2n1)c1ccc(OC)cc1 ZINC000820925587 606441756 /nfs/dbraw/zinc/44/17/56/606441756.db2.gz JWXNWLJYFSOUQV-QGZVFWFLSA-N -1 3 360.421 3.987 20 0 FHADHM c1coc(CN(Cc2ccco2)c2cc(-c3nnn[n-]3)c3ccccc3n2)c1 ZINC000823816055 606447894 /nfs/dbraw/zinc/44/78/94/606447894.db2.gz OULFRDANFYNGID-UHFFFAOYSA-N -1 3 372.388 3.808 20 0 FHADHM c1coc(CN(Cc2ccco2)c2cc(-c3nn[n-]n3)c3ccccc3n2)c1 ZINC000823816055 606447896 /nfs/dbraw/zinc/44/78/96/606447896.db2.gz OULFRDANFYNGID-UHFFFAOYSA-N -1 3 372.388 3.808 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)cc1CNc1ccc(OC2CCC2)c(F)c1 ZINC000822761246 606465588 /nfs/dbraw/zinc/46/55/88/606465588.db2.gz DVFKXDDNDLMFFK-UHFFFAOYSA-N -1 3 357.364 3.688 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CNc1ccc(OC2CCC2)c(F)c1 ZINC000822761246 606465590 /nfs/dbraw/zinc/46/55/90/606465590.db2.gz DVFKXDDNDLMFFK-UHFFFAOYSA-N -1 3 357.364 3.688 20 0 FHADHM CCOc1cccc([C@H](CC)OC(=O)c2cc(-c3nnn[n-]3)cs2)c1 ZINC000821427256 606470204 /nfs/dbraw/zinc/47/02/04/606470204.db2.gz PWAYHVKZGREDBO-AWEZNQCLSA-N -1 3 358.423 3.635 20 0 FHADHM CCOc1cccc([C@H](CC)OC(=O)c2cc(-c3nn[n-]n3)cs2)c1 ZINC000821427256 606470205 /nfs/dbraw/zinc/47/02/05/606470205.db2.gz PWAYHVKZGREDBO-AWEZNQCLSA-N -1 3 358.423 3.635 20 0 FHADHM O=C(Nc1ccc(-c2ccccc2)cc1F)c1cc(-c2nnn[n-]2)cs1 ZINC000823299160 606493754 /nfs/dbraw/zinc/49/37/54/606493754.db2.gz KNNUCKGTMORFEF-UHFFFAOYSA-N -1 3 365.393 3.987 20 0 FHADHM O=C(Nc1ccc(-c2ccccc2)cc1F)c1cc(-c2nn[n-]n2)cs1 ZINC000823299160 606493755 /nfs/dbraw/zinc/49/37/55/606493755.db2.gz KNNUCKGTMORFEF-UHFFFAOYSA-N -1 3 365.393 3.987 20 0 FHADHM O=C(c1cc(-c2nnn[n-]2)cs1)N1Cc2ccccc2-c2ccccc21 ZINC000823472167 606496899 /nfs/dbraw/zinc/49/68/99/606496899.db2.gz BYZVRFZPIWPKRX-UHFFFAOYSA-N -1 3 359.414 3.756 20 0 FHADHM O=C(c1cc(-c2nn[n-]n2)cs1)N1Cc2ccccc2-c2ccccc21 ZINC000823472167 606496900 /nfs/dbraw/zinc/49/69/00/606496900.db2.gz BYZVRFZPIWPKRX-UHFFFAOYSA-N -1 3 359.414 3.756 20 0 FHADHM CC(C)CCOc1cccc(NC(=O)c2cc(-c3nnn[n-]3)cs2)c1 ZINC000820076496 606498278 /nfs/dbraw/zinc/49/82/78/606498278.db2.gz JXHUDEIBMLXUNR-UHFFFAOYSA-N -1 3 357.439 3.605 20 0 FHADHM CC(C)CCOc1cccc(NC(=O)c2cc(-c3nn[n-]n3)cs2)c1 ZINC000820076496 606498280 /nfs/dbraw/zinc/49/82/80/606498280.db2.gz JXHUDEIBMLXUNR-UHFFFAOYSA-N -1 3 357.439 3.605 20 0 FHADHM O=C(Nc1ccc2nc(C3CC3)sc2c1)c1cc(-c2nnn[n-]2)cs1 ZINC000823356081 606501330 /nfs/dbraw/zinc/50/13/30/606501330.db2.gz JXEZJLXILXKGRS-UHFFFAOYSA-N -1 3 368.447 3.668 20 0 FHADHM O=C(Nc1ccc2nc(C3CC3)sc2c1)c1cc(-c2nn[n-]n2)cs1 ZINC000823356081 606501331 /nfs/dbraw/zinc/50/13/31/606501331.db2.gz JXEZJLXILXKGRS-UHFFFAOYSA-N -1 3 368.447 3.668 20 0 FHADHM CC(C)Cn1ccc2cc(NC(=O)Cc3cccc(-c4nnn[n-]4)c3)ccc21 ZINC000820107879 606535740 /nfs/dbraw/zinc/53/57/40/606535740.db2.gz CZTMLVRBWCNOJZ-UHFFFAOYSA-N -1 3 374.448 3.659 20 0 FHADHM CC(C)Cn1ccc2cc(NC(=O)Cc3cccc(-c4nn[n-]n4)c3)ccc21 ZINC000820107879 606535742 /nfs/dbraw/zinc/53/57/42/606535742.db2.gz CZTMLVRBWCNOJZ-UHFFFAOYSA-N -1 3 374.448 3.659 20 0 FHADHM O=C(Nc1cccc(NC2CCCC2)c1)c1cc(-c2nnn[n-]2)cs1 ZINC000823367579 606584715 /nfs/dbraw/zinc/58/47/15/606584715.db2.gz LJTISYGMALYVBX-UHFFFAOYSA-N -1 3 354.439 3.535 20 0 FHADHM O=C(Nc1cccc(NC2CCCC2)c1)c1cc(-c2nn[n-]n2)cs1 ZINC000823367579 606584718 /nfs/dbraw/zinc/58/47/18/606584718.db2.gz LJTISYGMALYVBX-UHFFFAOYSA-N -1 3 354.439 3.535 20 0 FHADHM CN(C)C(=O)Sc1cccc(CSc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000821578168 606590894 /nfs/dbraw/zinc/59/08/94/606590894.db2.gz QTGGAYCTHAFCNY-UHFFFAOYSA-N -1 3 371.491 3.933 20 0 FHADHM CN(C)C(=O)Sc1cccc(CSc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000821578168 606590896 /nfs/dbraw/zinc/59/08/96/606590896.db2.gz QTGGAYCTHAFCNY-UHFFFAOYSA-N -1 3 371.491 3.933 20 0 FHADHM Fc1cc(NCc2ccc(-c3nnn[n-]3)cc2OC(F)F)ccc1Cl ZINC000822753157 606597719 /nfs/dbraw/zinc/59/77/19/606597719.db2.gz GVMKWGZKOYRVMR-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM Fc1cc(NCc2ccc(-c3nn[n-]n3)cc2OC(F)F)ccc1Cl ZINC000822753157 606597721 /nfs/dbraw/zinc/59/77/21/606597721.db2.gz GVMKWGZKOYRVMR-UHFFFAOYSA-N -1 3 369.734 3.873 20 0 FHADHM O=C(Nc1sc2c(c1-c1nnn[n-]1)CCCCCC2)C1CC(F)(F)C1 ZINC000823387662 606623311 /nfs/dbraw/zinc/62/33/11/606623311.db2.gz SWKISZQMDGGAAT-UHFFFAOYSA-N -1 3 367.425 3.571 20 0 FHADHM O=C(Nc1sc2c(c1-c1nn[n-]n1)CCCCCC2)C1CC(F)(F)C1 ZINC000823387662 606623313 /nfs/dbraw/zinc/62/33/13/606623313.db2.gz SWKISZQMDGGAAT-UHFFFAOYSA-N -1 3 367.425 3.571 20 0 FHADHM C[C@H](C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1)c1ccc(Cl)s1 ZINC000819866640 606624394 /nfs/dbraw/zinc/62/43/94/606624394.db2.gz ONDTXMLQXYYWOH-ZETCQYMHSA-N -1 3 368.249 3.977 20 0 FHADHM C[C@H](C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1)c1ccc(Cl)s1 ZINC000819866640 606624395 /nfs/dbraw/zinc/62/43/95/606624395.db2.gz ONDTXMLQXYYWOH-ZETCQYMHSA-N -1 3 368.249 3.977 20 0 FHADHM O=C(c1ccc(-c2nnn[n-]2)cc1)N1CCCCC[C@H]1/C=C/c1ccccc1 ZINC000823478791 606626666 /nfs/dbraw/zinc/62/66/66/606626666.db2.gz SPEHDSZVOIKFQQ-XIJQHFHMSA-N -1 3 373.460 3.965 20 0 FHADHM O=C(c1ccc(-c2nn[n-]n2)cc1)N1CCCCC[C@H]1/C=C/c1ccccc1 ZINC000823478791 606626667 /nfs/dbraw/zinc/62/66/67/606626667.db2.gz SPEHDSZVOIKFQQ-XIJQHFHMSA-N -1 3 373.460 3.965 20 0 FHADHM Cc1[nH]ccc1C(=O)Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000822009947 606628283 /nfs/dbraw/zinc/62/82/83/606628283.db2.gz HZOGOYRZPCTNLX-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM Cc1[nH]ccc1C(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000822009947 606628286 /nfs/dbraw/zinc/62/82/86/606628286.db2.gz HZOGOYRZPCTNLX-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM CC(C)N(C(=O)[C@H](C)Sc1ccc(Cl)cc1-c1nnn[n-]1)C(C)C ZINC000820550623 606630104 /nfs/dbraw/zinc/63/01/04/606630104.db2.gz XXUOLPOHTLRIKL-NSHDSACASA-N -1 3 367.906 3.646 20 0 FHADHM CC(C)N(C(=O)[C@H](C)Sc1ccc(Cl)cc1-c1nn[n-]n1)C(C)C ZINC000820550623 606630105 /nfs/dbraw/zinc/63/01/05/606630105.db2.gz XXUOLPOHTLRIKL-NSHDSACASA-N -1 3 367.906 3.646 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)C=C(C)c1cccc(Cl)c1 ZINC000821755911 606630588 /nfs/dbraw/zinc/63/05/88/606630588.db2.gz JYCQBXVBWMHQKB-FLIBITNWSA-N -1 3 369.812 3.571 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)C=C(C)c1cccc(Cl)c1 ZINC000821755911 606630589 /nfs/dbraw/zinc/63/05/89/606630589.db2.gz JYCQBXVBWMHQKB-FLIBITNWSA-N -1 3 369.812 3.571 20 0 FHADHM Cc1cccc(Cl)c1NC(=O)[C@@H](C)Sc1ccc(-c2nnn[n-]2)cc1 ZINC000822304351 606639474 /nfs/dbraw/zinc/63/94/74/606639474.db2.gz UMHKALKDTGJFMH-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM Cc1cccc(Cl)c1NC(=O)[C@@H](C)Sc1ccc(-c2nn[n-]n2)cc1 ZINC000822304351 606639475 /nfs/dbraw/zinc/63/94/75/606639475.db2.gz UMHKALKDTGJFMH-LLVKDONJSA-N -1 3 373.869 3.948 20 0 FHADHM CCCc1nc(CNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)cs1 ZINC000821143093 606656392 /nfs/dbraw/zinc/65/63/92/606656392.db2.gz QVGRTPHDWPBIDQ-UHFFFAOYSA-N -1 3 368.388 3.907 20 0 FHADHM CCCc1nc(CNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)cs1 ZINC000821143093 606656393 /nfs/dbraw/zinc/65/63/93/606656393.db2.gz QVGRTPHDWPBIDQ-UHFFFAOYSA-N -1 3 368.388 3.907 20 0 FHADHM Fc1cc(Br)cc(F)c1NCc1ccccc1-c1nnn[n-]1 ZINC000822748453 606656713 /nfs/dbraw/zinc/65/67/13/606656713.db2.gz ZIAAHMMIJLPPKE-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1cc(Br)cc(F)c1NCc1ccccc1-c1nn[n-]n1 ZINC000822748453 606656714 /nfs/dbraw/zinc/65/67/14/606656714.db2.gz ZIAAHMMIJLPPKE-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Cc1ccc(C)c([C@@H](C)N(C)C(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)c1 ZINC000822230437 606669694 /nfs/dbraw/zinc/66/96/94/606669694.db2.gz GQDCEPAGNPNHTA-GFCCVEGCSA-N -1 3 371.391 3.595 20 0 FHADHM Cc1ccc(C)c([C@@H](C)N(C)C(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)c1 ZINC000822230437 606669695 /nfs/dbraw/zinc/66/96/95/606669695.db2.gz GQDCEPAGNPNHTA-GFCCVEGCSA-N -1 3 371.391 3.595 20 0 FHADHM CCN(C(=O)CCO[C@H](C)CC(C)C)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821153859 606670330 /nfs/dbraw/zinc/67/03/30/606670330.db2.gz FTEZEZBHNDNINK-HZPDHXFCSA-N -1 3 373.501 3.618 20 0 FHADHM CCN(C(=O)CCO[C@H](C)CC(C)C)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821153859 606670331 /nfs/dbraw/zinc/67/03/31/606670331.db2.gz FTEZEZBHNDNINK-HZPDHXFCSA-N -1 3 373.501 3.618 20 0 FHADHM Cc1ccc(N(C(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)C(C)C)cc1 ZINC000822240943 606676237 /nfs/dbraw/zinc/67/62/37/606676237.db2.gz FYPUEHAAQWWBDZ-UHFFFAOYSA-N -1 3 357.364 3.509 20 0 FHADHM Cc1ccc(N(C(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)C(C)C)cc1 ZINC000822240943 606676238 /nfs/dbraw/zinc/67/62/38/606676238.db2.gz FYPUEHAAQWWBDZ-UHFFFAOYSA-N -1 3 357.364 3.509 20 0 FHADHM CC(C)CC[C@H](NC(=O)c1c(F)cc(-c2nnn[n-]2)cc1F)C(C)(C)C ZINC000820072493 606679637 /nfs/dbraw/zinc/67/96/37/606679637.db2.gz HSAGFZFKNFTSMJ-AWEZNQCLSA-N -1 3 365.428 3.726 20 0 FHADHM CC(C)CC[C@H](NC(=O)c1c(F)cc(-c2nn[n-]n2)cc1F)C(C)(C)C ZINC000820072493 606679638 /nfs/dbraw/zinc/67/96/38/606679638.db2.gz HSAGFZFKNFTSMJ-AWEZNQCLSA-N -1 3 365.428 3.726 20 0 FHADHM CCSc1cccc(NC(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)c1 ZINC000821461108 606679997 /nfs/dbraw/zinc/67/99/97/606679997.db2.gz JQHUGAFZLAUWRE-UHFFFAOYSA-N -1 3 361.377 3.509 20 0 FHADHM CCSc1cccc(NC(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)c1 ZINC000821461108 606679998 /nfs/dbraw/zinc/67/99/98/606679998.db2.gz JQHUGAFZLAUWRE-UHFFFAOYSA-N -1 3 361.377 3.509 20 0 FHADHM O=C(N[C@H](c1ccccc1)c1cccc(F)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000823139742 606693945 /nfs/dbraw/zinc/69/39/45/606693945.db2.gz LBRQCXOKDQKSJV-LJQANCHMSA-N -1 3 373.391 3.525 20 0 FHADHM O=C(N[C@H](c1ccccc1)c1cccc(F)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000823139742 606693946 /nfs/dbraw/zinc/69/39/46/606693946.db2.gz LBRQCXOKDQKSJV-LJQANCHMSA-N -1 3 373.391 3.525 20 0 FHADHM Fc1ccc([C@H]2CCN(c3c(-c4nnn[n-]4)cnc4ccccc43)C2)cc1 ZINC000822767046 606728919 /nfs/dbraw/zinc/72/89/19/606728919.db2.gz UOFTXPAJOYWIRG-AWEZNQCLSA-N -1 3 360.396 3.548 20 0 FHADHM Fc1ccc([C@H]2CCN(c3c(-c4nn[n-]n4)cnc4ccccc43)C2)cc1 ZINC000822767046 606728920 /nfs/dbraw/zinc/72/89/20/606728920.db2.gz UOFTXPAJOYWIRG-AWEZNQCLSA-N -1 3 360.396 3.548 20 0 FHADHM C[C@@H](OC(=O)c1c(F)cc(-c2nnn[n-]2)cc1F)c1ccccc1Cl ZINC000820501377 606755088 /nfs/dbraw/zinc/75/50/88/606755088.db2.gz JAZLUFORJMUUHZ-MRVPVSSYSA-N -1 3 364.739 3.716 20 0 FHADHM C[C@@H](OC(=O)c1c(F)cc(-c2nn[n-]n2)cc1F)c1ccccc1Cl ZINC000820501377 606755092 /nfs/dbraw/zinc/75/50/92/606755092.db2.gz JAZLUFORJMUUHZ-MRVPVSSYSA-N -1 3 364.739 3.716 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(OCc2ncc(-c3ccccc3)o2)c1 ZINC000822573557 606781802 /nfs/dbraw/zinc/78/18/02/606781802.db2.gz AOVVRIHTVYMKNS-UHFFFAOYSA-N -1 3 353.769 3.754 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(OCc2ncc(-c3ccccc3)o2)c1 ZINC000822573557 606781803 /nfs/dbraw/zinc/78/18/03/606781803.db2.gz AOVVRIHTVYMKNS-UHFFFAOYSA-N -1 3 353.769 3.754 20 0 FHADHM Cc1ccc(C)c([C@@H]2CCCN2C(=O)Nc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000822230320 606783308 /nfs/dbraw/zinc/78/33/08/606783308.db2.gz CMSFMEBQMUYIOW-SFHVURJKSA-N -1 3 362.437 3.853 20 0 FHADHM Cc1ccc(C)c([C@@H]2CCCN2C(=O)Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000822230320 606783310 /nfs/dbraw/zinc/78/33/10/606783310.db2.gz CMSFMEBQMUYIOW-SFHVURJKSA-N -1 3 362.437 3.853 20 0 FHADHM CCCC[C@H](NC(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)C1CCC1 ZINC000821043143 606789208 /nfs/dbraw/zinc/78/92/08/606789208.db2.gz LXCSDHLVYWORST-GUYCJALGSA-N -1 3 356.474 3.586 20 0 FHADHM CCCC[C@H](NC(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)C1CCC1 ZINC000821043143 606789210 /nfs/dbraw/zinc/78/92/10/606789210.db2.gz LXCSDHLVYWORST-GUYCJALGSA-N -1 3 356.474 3.586 20 0 FHADHM Cc1ccc(CC(=O)Nc2cc(-c3nnn[n-]3)cn2C(C)(C)C)c(Cl)c1 ZINC000822235216 606811690 /nfs/dbraw/zinc/81/16/90/606811690.db2.gz XPCIXAVGFZHWQK-UHFFFAOYSA-N -1 3 372.860 3.566 20 0 FHADHM Cc1ccc(CC(=O)Nc2cc(-c3nn[n-]n3)cn2C(C)(C)C)c(Cl)c1 ZINC000822235216 606811691 /nfs/dbraw/zinc/81/16/91/606811691.db2.gz XPCIXAVGFZHWQK-UHFFFAOYSA-N -1 3 372.860 3.566 20 0 FHADHM Clc1cc(Br)ccc1NCc1ccc(-c2nnn[n-]2)cc1 ZINC000822568713 606840809 /nfs/dbraw/zinc/84/08/09/606840809.db2.gz WYAFVCKYNSTUCD-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM Clc1cc(Br)ccc1NCc1ccc(-c2nn[n-]n2)cc1 ZINC000822568713 606840810 /nfs/dbraw/zinc/84/08/10/606840810.db2.gz WYAFVCKYNSTUCD-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM Cc1nc(C)c(CSCCCOc2cccc(-c3nnn[n-]3)c2)s1 ZINC000822431696 606841169 /nfs/dbraw/zinc/84/11/69/606841169.db2.gz GPHLYBSOWQFJRI-UHFFFAOYSA-N -1 3 361.496 3.642 20 0 FHADHM Cc1nc(C)c(CSCCCOc2cccc(-c3nn[n-]n3)c2)s1 ZINC000822431696 606841170 /nfs/dbraw/zinc/84/11/70/606841170.db2.gz GPHLYBSOWQFJRI-UHFFFAOYSA-N -1 3 361.496 3.642 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)c(CSCc2ccn(C3CCCC3)n2)c1 ZINC000822758499 606841892 /nfs/dbraw/zinc/84/18/92/606841892.db2.gz QAROYMKOBXSIFV-UHFFFAOYSA-N -1 3 358.446 3.751 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)c(CSCc2ccn(C3CCCC3)n2)c1 ZINC000822758499 606841894 /nfs/dbraw/zinc/84/18/94/606841894.db2.gz QAROYMKOBXSIFV-UHFFFAOYSA-N -1 3 358.446 3.751 20 0 FHADHM O=C(CSc1ccc(-c2nnn[n-]2)cc1Cl)c1c[nH]c2ccccc21 ZINC000823066215 606852050 /nfs/dbraw/zinc/85/20/50/606852050.db2.gz QKDITAMWQKXXCA-UHFFFAOYSA-N -1 3 369.837 3.976 20 0 FHADHM O=C(CSc1ccc(-c2nn[n-]n2)cc1Cl)c1c[nH]c2ccccc21 ZINC000823066215 606852052 /nfs/dbraw/zinc/85/20/52/606852052.db2.gz QKDITAMWQKXXCA-UHFFFAOYSA-N -1 3 369.837 3.976 20 0 FHADHM CCOc1cc(Br)ccc1NCc1ccc(-c2nnn[n-]2)cc1 ZINC000821393808 606866732 /nfs/dbraw/zinc/86/67/32/606866732.db2.gz BNJCJTJJZHBNLG-UHFFFAOYSA-N -1 3 374.242 3.640 20 0 FHADHM CCOc1cc(Br)ccc1NCc1ccc(-c2nn[n-]n2)cc1 ZINC000821393808 606866733 /nfs/dbraw/zinc/86/67/33/606866733.db2.gz BNJCJTJJZHBNLG-UHFFFAOYSA-N -1 3 374.242 3.640 20 0 FHADHM C[C@H]1CC[C@H](C)N1C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000820684750 606879177 /nfs/dbraw/zinc/87/91/77/606879177.db2.gz SABCDIZYEFWFCP-KBPBESRZSA-N -1 3 363.421 3.672 20 0 FHADHM C[C@H]1CC[C@H](C)N1C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000820684750 606879179 /nfs/dbraw/zinc/87/91/79/606879179.db2.gz SABCDIZYEFWFCP-KBPBESRZSA-N -1 3 363.421 3.672 20 0 FHADHM Fc1ccc(CNc2ccccc2N2CCCCCC2)cc1-c1nnn[n-]1 ZINC000822771763 606928087 /nfs/dbraw/zinc/92/80/87/606928087.db2.gz MASAVJJFSQWJBY-UHFFFAOYSA-N -1 3 366.444 3.998 20 0 FHADHM Fc1ccc(CNc2ccccc2N2CCCCCC2)cc1-c1nn[n-]n1 ZINC000822771763 606928088 /nfs/dbraw/zinc/92/80/88/606928088.db2.gz MASAVJJFSQWJBY-UHFFFAOYSA-N -1 3 366.444 3.998 20 0 FHADHM Fc1ccc(CNc2cccc(Oc3ccccn3)c2)cc1-c1nnn[n-]1 ZINC000822772440 606931674 /nfs/dbraw/zinc/93/16/74/606931674.db2.gz YYSAMGOSXYSIFR-UHFFFAOYSA-N -1 3 362.368 3.805 20 0 FHADHM Fc1ccc(CNc2cccc(Oc3ccccn3)c2)cc1-c1nn[n-]n1 ZINC000822772440 606931676 /nfs/dbraw/zinc/93/16/76/606931676.db2.gz YYSAMGOSXYSIFR-UHFFFAOYSA-N -1 3 362.368 3.805 20 0 FHADHM Fc1ccc(CNc2ccc(OC3CCC3)c(F)c2)cc1-c1nnn[n-]1 ZINC000822753291 606931756 /nfs/dbraw/zinc/93/17/56/606931756.db2.gz LVJUQAKKNVOEQI-UHFFFAOYSA-N -1 3 357.364 3.688 20 0 FHADHM Fc1ccc(CNc2ccc(OC3CCC3)c(F)c2)cc1-c1nn[n-]n1 ZINC000822753291 606931757 /nfs/dbraw/zinc/93/17/57/606931757.db2.gz LVJUQAKKNVOEQI-UHFFFAOYSA-N -1 3 357.364 3.688 20 0 FHADHM Cc1cc(C(=O)N(C)c2cc(Cl)ccc2-c2nnn[n-]2)ccc1Cl ZINC000822168747 606961448 /nfs/dbraw/zinc/96/14/48/606961448.db2.gz QKUMSGBUOFQPTH-UHFFFAOYSA-N -1 3 362.220 3.759 20 0 FHADHM Cc1cc(C(=O)N(C)c2cc(Cl)ccc2-c2nn[n-]n2)ccc1Cl ZINC000822168747 606961450 /nfs/dbraw/zinc/96/14/50/606961450.db2.gz QKUMSGBUOFQPTH-UHFFFAOYSA-N -1 3 362.220 3.759 20 0 FHADHM C[C@@H](SCc1cccc2nsnc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000820548698 606986905 /nfs/dbraw/zinc/98/69/05/606986905.db2.gz FMJBINWISPCULH-SNVBAGLBSA-N -1 3 354.464 3.866 20 0 FHADHM C[C@@H](SCc1cccc2nsnc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000820548698 606986908 /nfs/dbraw/zinc/98/69/08/606986908.db2.gz FMJBINWISPCULH-SNVBAGLBSA-N -1 3 354.464 3.866 20 0 FHADHM O=C(OCc1ccc(F)c(-c2nnn[n-]2)c1)c1cc(Cl)sc1Cl ZINC000823421829 606992711 /nfs/dbraw/zinc/99/27/11/606992711.db2.gz IDMQMOOSFRIPQK-UHFFFAOYSA-N -1 3 373.196 3.731 20 0 FHADHM O=C(OCc1ccc(F)c(-c2nn[n-]n2)c1)c1cc(Cl)sc1Cl ZINC000823421829 606992713 /nfs/dbraw/zinc/99/27/13/606992713.db2.gz IDMQMOOSFRIPQK-UHFFFAOYSA-N -1 3 373.196 3.731 20 0 FHADHM C[C@@H](Sc1ncccc1-c1nnn[n-]1)c1cccc(Br)c1 ZINC000820554923 607012556 /nfs/dbraw/zinc/01/25/56/607012556.db2.gz BPWFPMVYCZLQQV-SECBINFHSA-N -1 3 362.256 3.878 20 0 FHADHM C[C@@H](Sc1ncccc1-c1nn[n-]n1)c1cccc(Br)c1 ZINC000820554923 607012557 /nfs/dbraw/zinc/01/25/57/607012557.db2.gz BPWFPMVYCZLQQV-SECBINFHSA-N -1 3 362.256 3.878 20 0 FHADHM CSc1cccc(NC(=O)[C@@H](C)Sc2cccc(-c3nnn[n-]3)c2)c1 ZINC000821984882 607016916 /nfs/dbraw/zinc/01/69/16/607016916.db2.gz VXTACPQKPXUABS-LLVKDONJSA-N -1 3 371.491 3.708 20 0 FHADHM CSc1cccc(NC(=O)[C@@H](C)Sc2cccc(-c3nn[n-]n3)c2)c1 ZINC000821984882 607016918 /nfs/dbraw/zinc/01/69/18/607016918.db2.gz VXTACPQKPXUABS-LLVKDONJSA-N -1 3 371.491 3.708 20 0 FHADHM CC[C@@H](Cc1ccccc1)N(CC)C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000820913706 607036274 /nfs/dbraw/zinc/03/62/74/607036274.db2.gz JQJDDUFNOHLIIK-SFHVURJKSA-N -1 3 364.453 3.742 20 0 FHADHM CC[C@@H](Cc1ccccc1)N(CC)C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000820913706 607036276 /nfs/dbraw/zinc/03/62/76/607036276.db2.gz JQJDDUFNOHLIIK-SFHVURJKSA-N -1 3 364.453 3.742 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)c(CN2CCC[C@@H]2c2ccc(F)c(F)c2)c1 ZINC000822758756 607066804 /nfs/dbraw/zinc/06/68/04/607066804.db2.gz XQFNFSZHTSPKJR-QGZVFWFLSA-N -1 3 359.355 3.621 20 0 FHADHM O=C(OCc1cc(F)ccc1-c1nnn[n-]1)c1c(Cl)cccc1Cl ZINC000823413103 607074525 /nfs/dbraw/zinc/07/45/25/607074525.db2.gz AGKBPUGYDDFVQU-UHFFFAOYSA-N -1 3 367.167 3.670 20 0 FHADHM O=C(OCc1cc(F)ccc1-c1nn[n-]n1)c1c(Cl)cccc1Cl ZINC000823413103 607074528 /nfs/dbraw/zinc/07/45/28/607074528.db2.gz AGKBPUGYDDFVQU-UHFFFAOYSA-N -1 3 367.167 3.670 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NC(=O)CCCc1ccc(C)cc1 ZINC000821304887 607099811 /nfs/dbraw/zinc/09/98/11/607099811.db2.gz SYUWWZHNNGQBIA-UHFFFAOYSA-N -1 3 364.453 3.568 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NC(=O)C[C@H](C)c1cccc(F)c1 ZINC000821293599 607100380 /nfs/dbraw/zinc/10/03/80/607100380.db2.gz LQJSOHNQNOEUPA-LBPRGKRZSA-N -1 3 368.416 3.570 20 0 FHADHM C[C@H](c1ccccc1)n1ccc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)n1 ZINC000820461798 607112326 /nfs/dbraw/zinc/11/23/26/607112326.db2.gz QXWVRPIRYVVTPF-LSDHHAIUSA-N -1 3 359.437 3.846 20 0 FHADHM C[C@H](c1ccccc1)n1ccc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)n1 ZINC000820461798 607112327 /nfs/dbraw/zinc/11/23/27/607112327.db2.gz QXWVRPIRYVVTPF-LSDHHAIUSA-N -1 3 359.437 3.846 20 0 FHADHM C[C@H]1CN(c2c(Cl)cccc2-c2nnn[n-]2)C[C@H](c2ccsc2)O1 ZINC000820768743 607115931 /nfs/dbraw/zinc/11/59/31/607115931.db2.gz PBYVUYMOBVOBTI-IINYFYTJSA-N -1 3 361.858 3.548 20 0 FHADHM C[C@H]1CN(c2c(Cl)cccc2-c2nn[n-]n2)C[C@H](c2ccsc2)O1 ZINC000820768743 607115933 /nfs/dbraw/zinc/11/59/33/607115933.db2.gz PBYVUYMOBVOBTI-IINYFYTJSA-N -1 3 361.858 3.548 20 0 FHADHM Cc1ccc2c(CNc3ccc(-c4nn[n-]n4)cc3Cl)cc(=O)oc2c1 ZINC000822275576 607124142 /nfs/dbraw/zinc/12/41/42/607124142.db2.gz VVADARMOXTZIQR-UHFFFAOYSA-N -1 3 367.796 3.547 20 0 FHADHM Fc1cc(NC/C=C\Cl)ccc1OCc1cccc(-c2nnn[n-]2)c1 ZINC000822753068 607124199 /nfs/dbraw/zinc/12/41/99/607124199.db2.gz BLSRYKIURIRSME-UQCOIBPSSA-N -1 3 359.792 3.749 20 0 FHADHM Fc1cc(NC/C=C\Cl)ccc1OCc1cccc(-c2nn[n-]n2)c1 ZINC000822753068 607124200 /nfs/dbraw/zinc/12/42/00/607124200.db2.gz BLSRYKIURIRSME-UQCOIBPSSA-N -1 3 359.792 3.749 20 0 FHADHM Clc1cc(-c2nn[n-]n2)ccc1NCc1cc(-c2ccccc2)no1 ZINC000822563908 607124273 /nfs/dbraw/zinc/12/42/73/607124273.db2.gz PQVRVBQQCJSQLA-UHFFFAOYSA-N -1 3 352.785 3.787 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1OCc1cc(-c2ccc(Cl)cc2)no1 ZINC000822747997 607136654 /nfs/dbraw/zinc/13/66/54/607136654.db2.gz BRDGQHDNDCJNHG-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1OCc1cc(-c2ccc(Cl)cc2)no1 ZINC000822747997 607136655 /nfs/dbraw/zinc/13/66/55/607136655.db2.gz BRDGQHDNDCJNHG-UHFFFAOYSA-N -1 3 371.759 3.893 20 0 FHADHM Cc1oc(-c2cccs2)nc1COc1ccc(-c2nnn[n-]2)cc1F ZINC000822535295 607138221 /nfs/dbraw/zinc/13/82/21/607138221.db2.gz MSCMCOHGRPVXCB-UHFFFAOYSA-N -1 3 357.370 3.610 20 0 FHADHM Cc1oc(-c2cccs2)nc1COc1ccc(-c2nn[n-]n2)cc1F ZINC000822535295 607138222 /nfs/dbraw/zinc/13/82/22/607138222.db2.gz MSCMCOHGRPVXCB-UHFFFAOYSA-N -1 3 357.370 3.610 20 0 FHADHM Cc1ccccc1-c1noc([C@@H](C)Oc2ccc(-c3nnn[n-]3)cc2F)n1 ZINC000822345106 607139950 /nfs/dbraw/zinc/13/99/50/607139950.db2.gz DQGQCXQFNDKESX-LLVKDONJSA-N -1 3 366.356 3.504 20 0 FHADHM Cc1ccccc1-c1noc([C@@H](C)Oc2ccc(-c3nn[n-]n3)cc2F)n1 ZINC000822345106 607139952 /nfs/dbraw/zinc/13/99/52/607139952.db2.gz DQGQCXQFNDKESX-LLVKDONJSA-N -1 3 366.356 3.504 20 0 FHADHM CCCCC[C@H]1CCCN1C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821048605 607153342 /nfs/dbraw/zinc/15/33/42/607153342.db2.gz CZTIIMKYLBVAFL-YOEHRIQHSA-N -1 3 356.474 3.682 20 0 FHADHM CCCCC[C@H]1CCCN1C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821048605 607153344 /nfs/dbraw/zinc/15/33/44/607153344.db2.gz CZTIIMKYLBVAFL-YOEHRIQHSA-N -1 3 356.474 3.682 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@@H](CC)OC2CCCCC2)s1 ZINC000821466345 607157179 /nfs/dbraw/zinc/15/71/79/607157179.db2.gz VYVJMWXIOSTCNV-CQSZACIVSA-N -1 3 363.487 3.557 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@@H](CC)OC2CCCCC2)s1 ZINC000821466345 607157180 /nfs/dbraw/zinc/15/71/80/607157180.db2.gz VYVJMWXIOSTCNV-CQSZACIVSA-N -1 3 363.487 3.557 20 0 FHADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)c1ccc2sccc2c1 ZINC000821412540 607157311 /nfs/dbraw/zinc/15/73/11/607157311.db2.gz NZKRUOINIOJNLU-UHFFFAOYSA-N -1 3 365.418 3.732 20 0 FHADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)c1ccc2sccc2c1 ZINC000821412540 607157313 /nfs/dbraw/zinc/15/73/13/607157313.db2.gz NZKRUOINIOJNLU-UHFFFAOYSA-N -1 3 365.418 3.732 20 0 FHADHM O=C(c1cc(-c2nnn[n-]2)cs1)N1CCC[C@H]1CCCc1ccccc1 ZINC000823472338 607165700 /nfs/dbraw/zinc/16/57/00/607165700.db2.gz IRGSALHQSDLVHN-MRXNPFEDSA-N -1 3 367.478 3.556 20 0 FHADHM O=C(c1cc(-c2nn[n-]n2)cs1)N1CCC[C@H]1CCCc1ccccc1 ZINC000823472338 607165701 /nfs/dbraw/zinc/16/57/01/607165701.db2.gz IRGSALHQSDLVHN-MRXNPFEDSA-N -1 3 367.478 3.556 20 0 FHADHM Cc1cccc([C@H]2CCCN2c2ccc(C(F)(F)F)cc2-c2nnn[n-]2)n1 ZINC000822299451 607174864 /nfs/dbraw/zinc/17/48/64/607174864.db2.gz JGGSYSBELLQUCR-MRXNPFEDSA-N -1 3 374.370 3.930 20 0 FHADHM Cc1cccc([C@H]2CCCN2c2ccc(C(F)(F)F)cc2-c2nn[n-]n2)n1 ZINC000822299451 607174865 /nfs/dbraw/zinc/17/48/65/607174865.db2.gz JGGSYSBELLQUCR-MRXNPFEDSA-N -1 3 374.370 3.930 20 0 FHADHM O=C(Cc1cccc2ccccc21)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000823111851 607190473 /nfs/dbraw/zinc/19/04/73/607190473.db2.gz PLQXRQWSEMKHHS-UHFFFAOYSA-N -1 3 363.808 3.855 20 0 FHADHM O=C(Cc1cccc2ccccc21)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000823111851 607190474 /nfs/dbraw/zinc/19/04/74/607190474.db2.gz PLQXRQWSEMKHHS-UHFFFAOYSA-N -1 3 363.808 3.855 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000823315627 607190494 /nfs/dbraw/zinc/19/04/94/607190494.db2.gz ZUEXTIDWIUKPDP-VHSXEESVSA-N -1 3 373.766 3.827 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000823315627 607190495 /nfs/dbraw/zinc/19/04/95/607190495.db2.gz ZUEXTIDWIUKPDP-VHSXEESVSA-N -1 3 373.766 3.827 20 0 FHADHM Cc1ccccc1SCC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822366369 607191080 /nfs/dbraw/zinc/19/10/80/607191080.db2.gz IWWYEJNQQWNILE-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1ccccc1SCC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822366369 607191081 /nfs/dbraw/zinc/19/10/81/607191081.db2.gz IWWYEJNQQWNILE-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM C[C@H](c1ccccc1)N(C)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820563873 607195570 /nfs/dbraw/zinc/19/55/70/607195570.db2.gz WEANAFWUAMZEQD-LLVKDONJSA-N -1 3 356.817 3.745 20 0 FHADHM C[C@H](c1ccccc1)N(C)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820563873 607195571 /nfs/dbraw/zinc/19/55/71/607195571.db2.gz WEANAFWUAMZEQD-LLVKDONJSA-N -1 3 356.817 3.745 20 0 FHADHM C[C@H]1Cc2ccccc2[C@H]1NC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820813641 607195618 /nfs/dbraw/zinc/19/56/18/607195618.db2.gz LIGRLLDLZOLYMV-QFYYESIMSA-N -1 3 368.828 3.575 20 0 FHADHM C[C@H]1Cc2ccccc2[C@H]1NC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820813641 607195619 /nfs/dbraw/zinc/19/56/19/607195619.db2.gz LIGRLLDLZOLYMV-QFYYESIMSA-N -1 3 368.828 3.575 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N[C@@H]1CC[C@@H]2CCC[C@H]2C1 ZINC000823319391 607197018 /nfs/dbraw/zinc/19/70/18/607197018.db2.gz TXORGEXYJPLEMP-GMXVVIOVSA-N -1 3 360.849 3.610 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N[C@@H]1CC[C@@H]2CCC[C@H]2C1 ZINC000823319391 607197019 /nfs/dbraw/zinc/19/70/19/607197019.db2.gz TXORGEXYJPLEMP-GMXVVIOVSA-N -1 3 360.849 3.610 20 0 FHADHM O=C(NCc1coc2ccccc12)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000823266188 607198622 /nfs/dbraw/zinc/19/86/22/607198622.db2.gz OMDSVVCTSUSSEQ-UHFFFAOYSA-N -1 3 368.784 3.588 20 0 FHADHM O=C(NCc1coc2ccccc12)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000823266188 607198623 /nfs/dbraw/zinc/19/86/23/607198623.db2.gz OMDSVVCTSUSSEQ-UHFFFAOYSA-N -1 3 368.784 3.588 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N1CCC[C@@H]1c1ccccc1 ZINC000823313783 607200246 /nfs/dbraw/zinc/20/02/46/607200246.db2.gz IRYWSQNIIMUZPM-MRXNPFEDSA-N -1 3 368.828 3.889 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N1CCC[C@@H]1c1ccccc1 ZINC000823313783 607200247 /nfs/dbraw/zinc/20/02/47/607200247.db2.gz IRYWSQNIIMUZPM-MRXNPFEDSA-N -1 3 368.828 3.889 20 0 FHADHM C[C@H](CCNC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccccc1 ZINC000820241545 607202919 /nfs/dbraw/zinc/20/29/19/607202919.db2.gz GRQGXFZGAXAFCK-GFCCVEGCSA-N -1 3 370.844 3.835 20 0 FHADHM C[C@H](CCNC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccccc1 ZINC000820241545 607202920 /nfs/dbraw/zinc/20/29/20/607202920.db2.gz GRQGXFZGAXAFCK-GFCCVEGCSA-N -1 3 370.844 3.835 20 0 FHADHM O=C(c1sccc1-c1nnn[n-]1)N1CCC[C@H]1CCCc1ccccc1 ZINC000823498006 607225654 /nfs/dbraw/zinc/22/56/54/607225654.db2.gz DNHSSACOOFTPIE-OAHLLOKOSA-N -1 3 367.478 3.556 20 0 FHADHM O=C(c1sccc1-c1nn[n-]n1)N1CCC[C@H]1CCCc1ccccc1 ZINC000823498006 607225655 /nfs/dbraw/zinc/22/56/55/607225655.db2.gz DNHSSACOOFTPIE-OAHLLOKOSA-N -1 3 367.478 3.556 20 0 FHADHM CCc1cc(C)c(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CC[C@@H](C)C3)o1 ZINC000821470700 607235436 /nfs/dbraw/zinc/23/54/36/607235436.db2.gz SGJXJNAJFLPVII-SECBINFHSA-N -1 3 371.466 3.769 20 0 FHADHM CCc1cc(C)c(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CC[C@@H](C)C3)o1 ZINC000821470700 607235437 /nfs/dbraw/zinc/23/54/37/607235437.db2.gz SGJXJNAJFLPVII-SECBINFHSA-N -1 3 371.466 3.769 20 0 FHADHM Cc1sc(NC(=O)Cc2ccc(F)cc2Cl)c(-c2nnn[n-]2)c1C ZINC000822564103 607235963 /nfs/dbraw/zinc/23/59/63/607235963.db2.gz UETMVCUCZYFBDG-UHFFFAOYSA-N -1 3 365.821 3.519 20 0 FHADHM Cc1sc(NC(=O)Cc2ccc(F)cc2Cl)c(-c2nn[n-]n2)c1C ZINC000822564103 607235964 /nfs/dbraw/zinc/23/59/64/607235964.db2.gz UETMVCUCZYFBDG-UHFFFAOYSA-N -1 3 365.821 3.519 20 0 FHADHM O=C(C/C=C\c1cccc(F)c1)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822946419 607240834 /nfs/dbraw/zinc/24/08/34/607240834.db2.gz XJRJKDHCFYREJV-RQOWECAXSA-N -1 3 357.776 3.701 20 0 FHADHM O=C(C/C=C\c1cccc(F)c1)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822946419 607240835 /nfs/dbraw/zinc/24/08/35/607240835.db2.gz XJRJKDHCFYREJV-RQOWECAXSA-N -1 3 357.776 3.701 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)c1cccc(Cl)c1F ZINC000823319380 607241729 /nfs/dbraw/zinc/24/17/29/607241729.db2.gz TURBZJIDYBPBHA-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)c1cccc(Cl)c1F ZINC000823319380 607241730 /nfs/dbraw/zinc/24/17/30/607241730.db2.gz TURBZJIDYBPBHA-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM CC(C)(C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccccc1F ZINC000819892219 607242130 /nfs/dbraw/zinc/24/21/30/607242130.db2.gz ZKVNKIAHRXVLEA-UHFFFAOYSA-N -1 3 359.792 3.576 20 0 FHADHM CC(C)(C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccccc1F ZINC000819892219 607242131 /nfs/dbraw/zinc/24/21/31/607242131.db2.gz ZKVNKIAHRXVLEA-UHFFFAOYSA-N -1 3 359.792 3.576 20 0 FHADHM CC(C)(C)c1ncsc1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000819972043 607243154 /nfs/dbraw/zinc/24/31/54/607243154.db2.gz YNKMXJDBGDTUDV-UHFFFAOYSA-N -1 3 362.846 3.526 20 0 FHADHM CC(C)(C)c1ncsc1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000819972043 607243155 /nfs/dbraw/zinc/24/31/55/607243155.db2.gz YNKMXJDBGDTUDV-UHFFFAOYSA-N -1 3 362.846 3.526 20 0 FHADHM CCSc1ccccc1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000821461905 607243647 /nfs/dbraw/zinc/24/36/47/607243647.db2.gz VLSJXRCNQRBZHV-UHFFFAOYSA-N -1 3 359.842 3.884 20 0 FHADHM CCSc1ccccc1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000821461905 607243648 /nfs/dbraw/zinc/24/36/48/607243648.db2.gz VLSJXRCNQRBZHV-UHFFFAOYSA-N -1 3 359.842 3.884 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccc(F)c(Cl)c1 ZINC000823319003 607244086 /nfs/dbraw/zinc/24/40/86/607244086.db2.gz OIHCHXPGWJBKSA-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccc(F)c(Cl)c1 ZINC000823319003 607244087 /nfs/dbraw/zinc/24/40/87/607244087.db2.gz OIHCHXPGWJBKSA-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Oc1ccc(-c2nnn[n-]2)cc1F)c1cc(Cl)ccc1Cl ZINC000823450285 607248298 /nfs/dbraw/zinc/24/82/98/607248298.db2.gz NCDWWXLMQLBPGQ-UHFFFAOYSA-N -1 3 353.140 3.532 20 0 FHADHM O=C(Oc1ccc(-c2nn[n-]n2)cc1F)c1cc(Cl)ccc1Cl ZINC000823450285 607248299 /nfs/dbraw/zinc/24/82/99/607248299.db2.gz NCDWWXLMQLBPGQ-UHFFFAOYSA-N -1 3 353.140 3.532 20 0 FHADHM C[C@H]1CC[C@H](NC(=S)Nc2ccccc2-c2nnn[n-]2)c2ccccc21 ZINC000824917795 607783880 /nfs/dbraw/zinc/78/38/80/607783880.db2.gz NQYCKVVNEWICRG-SJCJKPOMSA-N -1 3 364.478 3.792 20 0 FHADHM C[C@H]1CC[C@H](NC(=S)Nc2ccccc2-c2nn[n-]n2)c2ccccc21 ZINC000824917795 607783881 /nfs/dbraw/zinc/78/38/81/607783881.db2.gz NQYCKVVNEWICRG-SJCJKPOMSA-N -1 3 364.478 3.792 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@H](C)c2ccccc2F)cc1-c1nnn[n-]1 ZINC000825553018 607784037 /nfs/dbraw/zinc/78/40/37/607784037.db2.gz IALOTWNPJBCURP-LLVKDONJSA-N -1 3 370.388 3.747 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@H](C)c2ccccc2F)cc1-c1nn[n-]n1 ZINC000825553018 607784038 /nfs/dbraw/zinc/78/40/38/607784038.db2.gz IALOTWNPJBCURP-LLVKDONJSA-N -1 3 370.388 3.747 20 0 FHADHM CCSc1ccc(CC(=O)Nc2sc(CC)cc2-c2nnn[n-]2)cc1 ZINC000825674054 607785364 /nfs/dbraw/zinc/78/53/64/607785364.db2.gz HCYCEYIWFXOTDD-UHFFFAOYSA-N -1 3 373.507 3.784 20 0 FHADHM CCSc1ccc(CC(=O)Nc2sc(CC)cc2-c2nn[n-]n2)cc1 ZINC000825674054 607785365 /nfs/dbraw/zinc/78/53/65/607785365.db2.gz HCYCEYIWFXOTDD-UHFFFAOYSA-N -1 3 373.507 3.784 20 0 FHADHM CN(C(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1)c1ccccc1-c1nnn[n-]1 ZINC000825812846 607789171 /nfs/dbraw/zinc/78/91/71/607789171.db2.gz VXFUEHUYCZVRIQ-MOPGFXCFSA-N -1 3 369.428 3.786 20 0 FHADHM CN(C(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1)c1ccccc1-c1nn[n-]n1 ZINC000825812846 607789172 /nfs/dbraw/zinc/78/91/72/607789172.db2.gz VXFUEHUYCZVRIQ-MOPGFXCFSA-N -1 3 369.428 3.786 20 0 FHADHM O=C(c1cccc(-c2nnn[n-]2)c1)N1CCCc2cc(Cl)cc(Cl)c21 ZINC000826473617 607792011 /nfs/dbraw/zinc/79/20/11/607792011.db2.gz GQXLJQIERPDTSG-UHFFFAOYSA-N -1 3 374.231 3.767 20 0 FHADHM O=C(c1cccc(-c2nn[n-]n2)c1)N1CCCc2cc(Cl)cc(Cl)c21 ZINC000826473617 607792012 /nfs/dbraw/zinc/79/20/12/607792012.db2.gz GQXLJQIERPDTSG-UHFFFAOYSA-N -1 3 374.231 3.767 20 0 FHADHM Cc1ccc(Cl)cc1C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2 ZINC000826289321 607793171 /nfs/dbraw/zinc/79/31/71/607793171.db2.gz VKVCNIRNENSLRX-UHFFFAOYSA-N -1 3 359.842 3.631 20 0 FHADHM Cc1ccc(Cl)cc1C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2 ZINC000826289321 607793172 /nfs/dbraw/zinc/79/31/72/607793172.db2.gz VKVCNIRNENSLRX-UHFFFAOYSA-N -1 3 359.842 3.631 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)CC1(C)CCCCC1 ZINC000824292857 607793362 /nfs/dbraw/zinc/79/33/62/607793362.db2.gz BRPMQSOOTPSNMR-UHFFFAOYSA-N -1 3 355.486 3.964 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)CC1(C)CCCCC1 ZINC000824292857 607793363 /nfs/dbraw/zinc/79/33/63/607793363.db2.gz BRPMQSOOTPSNMR-UHFFFAOYSA-N -1 3 355.486 3.964 20 0 FHADHM Cc1ccc(Cl)cc1C(=O)N(C)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000826289140 607800869 /nfs/dbraw/zinc/80/08/69/607800869.db2.gz LVOGVVXWMDIGIW-UHFFFAOYSA-N -1 3 362.220 3.759 20 0 FHADHM Cc1ccc(Cl)cc1C(=O)N(C)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000826289140 607800870 /nfs/dbraw/zinc/80/08/70/607800870.db2.gz LVOGVVXWMDIGIW-UHFFFAOYSA-N -1 3 362.220 3.759 20 0 FHADHM Cc1nc(C)c(-c2nnn[n-]2)c(S[C@@H]2CCCc3ccc(F)cc32)n1 ZINC000826324403 607808798 /nfs/dbraw/zinc/80/87/98/607808798.db2.gz PJGNZGQUVOGTDF-CQSZACIVSA-N -1 3 356.430 3.582 20 0 FHADHM CC[C@H](Nc1ccc2cc(-c3nnn[n-]3)ccc2n1)c1ccc(OC)cc1 ZINC000825146536 607838709 /nfs/dbraw/zinc/83/87/09/607838709.db2.gz CRCKYBUUOHZQIH-KRWDZBQOSA-N -1 3 360.421 3.987 20 0 FHADHM CC[C@H](Nc1ccc2cc(-c3nn[n-]n3)ccc2n1)c1ccc(OC)cc1 ZINC000825146536 607838710 /nfs/dbraw/zinc/83/87/10/607838710.db2.gz CRCKYBUUOHZQIH-KRWDZBQOSA-N -1 3 360.421 3.987 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)Nc1cccnc1-c1ccccc1 ZINC000826402108 607855852 /nfs/dbraw/zinc/85/58/52/607855852.db2.gz NBMHFAOHKRZLSL-OUKQBFOZSA-N -1 3 368.400 3.581 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)Nc1cccnc1-c1ccccc1 ZINC000826402108 607855853 /nfs/dbraw/zinc/85/58/53/607855853.db2.gz NBMHFAOHKRZLSL-OUKQBFOZSA-N -1 3 368.400 3.581 20 0 FHADHM C[C@@H](Cc1cccc(Cl)c1)C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000824457519 607881111 /nfs/dbraw/zinc/88/11/11/607881111.db2.gz OOXDTHCLLSQCGJ-STQMWFEESA-N -1 3 369.856 3.576 20 0 FHADHM C[C@@H](Cc1cccc(Cl)c1)C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000824457519 607881112 /nfs/dbraw/zinc/88/11/12/607881112.db2.gz OOXDTHCLLSQCGJ-STQMWFEESA-N -1 3 369.856 3.576 20 0 FHADHM CC(C)[C@H](C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(F)cc1 ZINC000824470331 607905948 /nfs/dbraw/zinc/90/59/48/607905948.db2.gz HPXNIUKLBQJUAE-ACJLOTCBSA-N -1 3 367.428 3.623 20 0 FHADHM CC(C)[C@H](C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(F)cc1 ZINC000824470331 607905949 /nfs/dbraw/zinc/90/59/49/607905949.db2.gz HPXNIUKLBQJUAE-ACJLOTCBSA-N -1 3 367.428 3.623 20 0 FHADHM CCNc1nc(SCc2ccc(-c3nnn[n-]3)cc2)nc2ccccc21 ZINC000825480984 607928269 /nfs/dbraw/zinc/92/82/69/607928269.db2.gz PKOGEIWQFVPYOG-UHFFFAOYSA-N -1 3 363.450 3.534 20 0 FHADHM CCNc1nc(SCc2ccc(-c3nn[n-]n3)cc2)nc2ccccc21 ZINC000825480984 607928270 /nfs/dbraw/zinc/92/82/70/607928270.db2.gz PKOGEIWQFVPYOG-UHFFFAOYSA-N -1 3 363.450 3.534 20 0 FHADHM CC[C@@H](C)[C@@H](C(=O)N1CCc2ccc(-c3nnn[n-]3)cc21)c1ccccc1 ZINC000825052490 607948633 /nfs/dbraw/zinc/94/86/33/607948633.db2.gz XOBNEZSNXUIAJQ-AUUYWEPGSA-N -1 3 361.449 3.586 20 0 FHADHM CC[C@@H](C)[C@@H](C(=O)N1CCc2ccc(-c3nn[n-]n3)cc21)c1ccccc1 ZINC000825052490 607948634 /nfs/dbraw/zinc/94/86/34/607948634.db2.gz XOBNEZSNXUIAJQ-AUUYWEPGSA-N -1 3 361.449 3.586 20 0 FHADHM CC[C@H](C)[C@H](C(=O)N1CCc2ccc(-c3nnn[n-]3)cc21)c1ccccc1 ZINC000825052493 607948863 /nfs/dbraw/zinc/94/88/63/607948863.db2.gz XOBNEZSNXUIAJQ-LIRRHRJNSA-N -1 3 361.449 3.586 20 0 FHADHM CC[C@H](C)[C@H](C(=O)N1CCc2ccc(-c3nn[n-]n3)cc21)c1ccccc1 ZINC000825052493 607948864 /nfs/dbraw/zinc/94/88/64/607948864.db2.gz XOBNEZSNXUIAJQ-LIRRHRJNSA-N -1 3 361.449 3.586 20 0 FHADHM CCN(Cc1csc(C2CC2)n1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825444259 607983292 /nfs/dbraw/zinc/98/32/92/607983292.db2.gz KQWVERXMAXNZQG-LBPRGKRZSA-N -1 3 354.483 3.784 20 0 FHADHM CCN(Cc1csc(C2CC2)n1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825444259 607983293 /nfs/dbraw/zinc/98/32/93/607983293.db2.gz KQWVERXMAXNZQG-LBPRGKRZSA-N -1 3 354.483 3.784 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)c1ccccc1CCC(F)(F)F ZINC000366992819 607999843 /nfs/dbraw/zinc/99/98/43/607999843.db2.gz DXMNCWSEUFXAFN-UHFFFAOYSA-N -1 3 361.327 3.614 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)c1ccccc1CCC(F)(F)F ZINC000366992819 607999844 /nfs/dbraw/zinc/99/98/44/607999844.db2.gz DXMNCWSEUFXAFN-UHFFFAOYSA-N -1 3 361.327 3.614 20 0 FHADHM CC(C)c1ccc([C@H]2CCCN2C(=O)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000824347560 608008224 /nfs/dbraw/zinc/00/82/24/608008224.db2.gz DGFAPHRYGZGITO-LJQANCHMSA-N -1 3 361.449 3.967 20 0 FHADHM CC(C)c1ccc([C@H]2CCCN2C(=O)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000824347560 608008225 /nfs/dbraw/zinc/00/82/25/608008225.db2.gz DGFAPHRYGZGITO-LJQANCHMSA-N -1 3 361.449 3.967 20 0 FHADHM c1ccc2c(c1)nc(NCc1cccc(-c3nn[n-]n3)c1)n2C1CCCC1 ZINC000826516341 608047162 /nfs/dbraw/zinc/04/71/62/608047162.db2.gz HOTBBHODGHGXDA-UHFFFAOYSA-N -1 3 359.437 3.944 20 0 FHADHM COc1ccc([C@H](C)Nc2ccc(-c3nn[n-]n3)cc2Br)cc1 ZINC000826188771 608048765 /nfs/dbraw/zinc/04/87/65/608048765.db2.gz GFEBUYCILQKXBV-JTQLQIEISA-N -1 3 374.242 3.811 20 0 FHADHM Fc1ccc(CNc2ccc(-c3nn[n-]n3)cc2Br)cc1F ZINC000826374643 608048990 /nfs/dbraw/zinc/04/89/90/608048990.db2.gz HFIVTZLVZXMREK-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM CC(C)c1cc(NCc2ccc(-c3nnn[n-]3)cc2F)nc(C(C)C)n1 ZINC000824347989 608049043 /nfs/dbraw/zinc/04/90/43/608049043.db2.gz VPLMJSURGCAEJN-UHFFFAOYSA-N -1 3 355.421 3.655 20 0 FHADHM CC(C)c1cc(NCc2ccc(-c3nn[n-]n3)cc2F)nc(C(C)C)n1 ZINC000824347989 608049044 /nfs/dbraw/zinc/04/90/44/608049044.db2.gz VPLMJSURGCAEJN-UHFFFAOYSA-N -1 3 355.421 3.655 20 0 FHADHM C[C@@H]1c2ccccc2CN1c1ccc(-c2nn[n-]n2)cc1Br ZINC000825027968 608050870 /nfs/dbraw/zinc/05/08/70/608050870.db2.gz ASQANHBRJLLYOR-SNVBAGLBSA-N -1 3 356.227 3.710 20 0 FHADHM FC1(F)CCC[C@@H](Nc2ccc(-c3nn[n-]n3)cc2Br)C1 ZINC000826370304 608051801 /nfs/dbraw/zinc/05/18/01/608051801.db2.gz MTHHEPBXAPHWNB-SECBINFHSA-N -1 3 358.190 3.619 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1c(F)cc(Cl)c(C)c1F ZINC000826249416 608074235 /nfs/dbraw/zinc/07/42/35/608074235.db2.gz BSKKCCADUBUNKD-UHFFFAOYSA-N -1 3 363.755 3.667 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1c(F)cc(Cl)c(C)c1F ZINC000826249416 608074236 /nfs/dbraw/zinc/07/42/36/608074236.db2.gz BSKKCCADUBUNKD-UHFFFAOYSA-N -1 3 363.755 3.667 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1)c1c(F)cccc1F ZINC000824044886 608113541 /nfs/dbraw/zinc/11/35/41/608113541.db2.gz AHVKGMVFMNCQKN-MRVPVSSYSA-N -1 3 363.755 3.541 20 0 FHADHM C[C@@H](C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1)c1c(F)cccc1F ZINC000824044886 608113542 /nfs/dbraw/zinc/11/35/42/608113542.db2.gz AHVKGMVFMNCQKN-MRVPVSSYSA-N -1 3 363.755 3.541 20 0 FHADHM Cc1cc(C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)cc(C)c1F ZINC000826257913 608119769 /nfs/dbraw/zinc/11/97/69/608119769.db2.gz SIKKTLLOCQNMND-UHFFFAOYSA-N -1 3 367.428 3.673 20 0 FHADHM Cc1cc(C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)cc(C)c1F ZINC000826257913 608119770 /nfs/dbraw/zinc/11/97/70/608119770.db2.gz SIKKTLLOCQNMND-UHFFFAOYSA-N -1 3 367.428 3.673 20 0 FHADHM Cc1sc(NC(=O)c2cc(F)c(Cl)cc2F)c(-c2nnn[n-]2)c1C ZINC000826349500 608122967 /nfs/dbraw/zinc/12/29/67/608122967.db2.gz JTBIURJSRFXJFN-UHFFFAOYSA-N -1 3 369.784 3.729 20 0 FHADHM Cc1sc(NC(=O)c2cc(F)c(Cl)cc2F)c(-c2nn[n-]n2)c1C ZINC000826349500 608122968 /nfs/dbraw/zinc/12/29/68/608122968.db2.gz JTBIURJSRFXJFN-UHFFFAOYSA-N -1 3 369.784 3.729 20 0 FHADHM Cc1cc(C)cc([C@H]2CCN(C(=O)C=Cc3ccccc3-c3nnn[n-]3)C2)c1 ZINC000826264425 608131830 /nfs/dbraw/zinc/13/18/30/608131830.db2.gz NZEXDIPUGDZQSM-DVBCCOPCSA-N -1 3 373.460 3.513 20 0 FHADHM Cc1cc(C)cc([C@H]2CCN(C(=O)C=Cc3ccccc3-c3nn[n-]n3)C2)c1 ZINC000826264425 608131831 /nfs/dbraw/zinc/13/18/31/608131831.db2.gz NZEXDIPUGDZQSM-DVBCCOPCSA-N -1 3 373.460 3.513 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)C1(Cc2ccc(Cl)cc2)CC1 ZINC000826277163 608156996 /nfs/dbraw/zinc/15/69/96/608156996.db2.gz LPWIBJCYCICKOZ-UHFFFAOYSA-N -1 3 367.840 3.790 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)C1(Cc2ccc(Cl)cc2)CC1 ZINC000826277163 608156998 /nfs/dbraw/zinc/15/69/98/608156998.db2.gz LPWIBJCYCICKOZ-UHFFFAOYSA-N -1 3 367.840 3.790 20 0 FHADHM CCSc1cccc(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)c1 ZINC000825674674 608159657 /nfs/dbraw/zinc/15/96/57/608159657.db2.gz PUJDIKRULGVWSJ-UHFFFAOYSA-N -1 3 359.842 3.884 20 0 FHADHM CCSc1cccc(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)c1 ZINC000825674674 608159659 /nfs/dbraw/zinc/15/96/59/608159659.db2.gz PUJDIKRULGVWSJ-UHFFFAOYSA-N -1 3 359.842 3.884 20 0 FHADHM Cc1nsc(Nc2ccc(Oc3ccc(-c4nn[n-]n4)cc3)cc2)n1 ZINC000826340124 608179188 /nfs/dbraw/zinc/17/91/88/608179188.db2.gz ILLSNBBLKXEROQ-UHFFFAOYSA-N -1 3 351.395 3.563 20 0 FHADHM CC[C@@H](Oc1cccc(C)c1)C(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000825159153 608182584 /nfs/dbraw/zinc/18/25/84/608182584.db2.gz KDWKXEFCXLHLMV-KBXCAEBGSA-N -1 3 366.421 3.637 20 0 FHADHM CC[C@@H](Oc1cccc(C)c1)C(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000825159153 608182586 /nfs/dbraw/zinc/18/25/86/608182586.db2.gz KDWKXEFCXLHLMV-KBXCAEBGSA-N -1 3 366.421 3.637 20 0 FHADHM CC[C@@H](Oc1ccccc1C)C(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000825159129 608184321 /nfs/dbraw/zinc/18/43/21/608184321.db2.gz JLNWHLLMCABLGU-WMLDXEAASA-N -1 3 366.421 3.637 20 0 FHADHM CC[C@@H](Oc1ccccc1C)C(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000825159129 608184322 /nfs/dbraw/zinc/18/43/22/608184322.db2.gz JLNWHLLMCABLGU-WMLDXEAASA-N -1 3 366.421 3.637 20 0 FHADHM C[C@H](OC(=O)C1(c2cccc(F)c2)CCC1)c1cccc(-c2nnn[n-]2)c1 ZINC000824713356 608184803 /nfs/dbraw/zinc/18/48/03/608184803.db2.gz HRCDHVDTFSVSHQ-ZDUSSCGKSA-N -1 3 366.396 3.732 20 0 FHADHM C[C@H](OC(=O)C1(c2cccc(F)c2)CCC1)c1cccc(-c2nn[n-]n2)c1 ZINC000824713356 608184805 /nfs/dbraw/zinc/18/48/05/608184805.db2.gz HRCDHVDTFSVSHQ-ZDUSSCGKSA-N -1 3 366.396 3.732 20 0 FHADHM CC(C)CCc1noc(CSc2cccc(Cl)c2-c2nnn[n-]2)n1 ZINC000824248819 608205173 /nfs/dbraw/zinc/20/51/73/608205173.db2.gz CYENHBMAFGRHCC-UHFFFAOYSA-N -1 3 364.862 3.784 20 0 FHADHM CC(C)CCc1noc(CSc2cccc(Cl)c2-c2nn[n-]n2)n1 ZINC000824248819 608205174 /nfs/dbraw/zinc/20/51/74/608205174.db2.gz CYENHBMAFGRHCC-UHFFFAOYSA-N -1 3 364.862 3.784 20 0 FHADHM COc1ccccc1C(=O)CSc1cccc(Cl)c1-c1nnn[n-]1 ZINC000826218233 608206493 /nfs/dbraw/zinc/20/64/93/608206493.db2.gz UUZMSCSGWAXYSD-UHFFFAOYSA-N -1 3 360.826 3.504 20 0 FHADHM COc1ccccc1C(=O)CSc1cccc(Cl)c1-c1nn[n-]n1 ZINC000826218233 608206494 /nfs/dbraw/zinc/20/64/94/608206494.db2.gz UUZMSCSGWAXYSD-UHFFFAOYSA-N -1 3 360.826 3.504 20 0 FHADHM Cc1cnc(CSc2nc(-c3ccccc3)ccc2-c2nnn[n-]2)s1 ZINC000826318805 608218838 /nfs/dbraw/zinc/21/88/38/608218838.db2.gz ZUBFNADMYGLCQW-UHFFFAOYSA-N -1 3 366.475 3.986 20 0 FHADHM Cc1cnc(CSc2nc(-c3ccccc3)ccc2-c2nn[n-]n2)s1 ZINC000826318805 608218839 /nfs/dbraw/zinc/21/88/39/608218839.db2.gz ZUBFNADMYGLCQW-UHFFFAOYSA-N -1 3 366.475 3.986 20 0 FHADHM FC(F)(F)[C@H]1CCC[C@H](Nc2ccc3cc(-c4nnn[n-]4)ccc3n2)C1 ZINC000826367040 608222019 /nfs/dbraw/zinc/22/20/19/608222019.db2.gz JETVVBCQQQPTLI-STQMWFEESA-N -1 3 362.359 3.948 20 0 FHADHM FC(F)(F)[C@H]1CCC[C@H](Nc2ccc3cc(-c4nn[n-]n4)ccc3n2)C1 ZINC000826367040 608222020 /nfs/dbraw/zinc/22/20/20/608222020.db2.gz JETVVBCQQQPTLI-STQMWFEESA-N -1 3 362.359 3.948 20 0 FHADHM CCOc1ccc(CNc2ccc3cc(-c4nnn[n-]4)ccc3n2)cc1F ZINC000825638124 608226615 /nfs/dbraw/zinc/22/66/15/608226615.db2.gz GDPPVGKFIIOUFP-UHFFFAOYSA-N -1 3 364.384 3.565 20 0 FHADHM CCOc1ccc(CNc2ccc3cc(-c4nn[n-]n4)ccc3n2)cc1F ZINC000825638124 608226617 /nfs/dbraw/zinc/22/66/17/608226617.db2.gz GDPPVGKFIIOUFP-UHFFFAOYSA-N -1 3 364.384 3.565 20 0 FHADHM CC(C)(C)Oc1cc(F)ccc1NCc1cc(-c2nnn[n-]2)ccc1F ZINC000824120081 608227017 /nfs/dbraw/zinc/22/70/17/608227017.db2.gz XNZVMDDJMCPSHT-UHFFFAOYSA-N -1 3 359.380 3.934 20 0 FHADHM CC(C)(C)Oc1cc(F)ccc1NCc1cc(-c2nn[n-]n2)ccc1F ZINC000824120081 608227019 /nfs/dbraw/zinc/22/70/19/608227019.db2.gz XNZVMDDJMCPSHT-UHFFFAOYSA-N -1 3 359.380 3.934 20 0 FHADHM CC(C)(C)c1nc(CCNc2c(F)cc(-c3nnn[n-]3)cc2F)cs1 ZINC000824142861 608230465 /nfs/dbraw/zinc/23/04/65/608230465.db2.gz YJMBEUXIISWIHD-UHFFFAOYSA-N -1 3 364.425 3.554 20 0 FHADHM CC(C)(C)c1nc(CCNc2c(F)cc(-c3nn[n-]n3)cc2F)cs1 ZINC000824142861 608230466 /nfs/dbraw/zinc/23/04/66/608230466.db2.gz YJMBEUXIISWIHD-UHFFFAOYSA-N -1 3 364.425 3.554 20 0 FHADHM c1ccc([C@@H]2CN(c3ccc4cc(-c5nnn[n-]5)ccc4n3)CCS2)cc1 ZINC000826520262 608235473 /nfs/dbraw/zinc/23/54/73/608235473.db2.gz DPONEJSPNAMKII-SFHVURJKSA-N -1 3 374.473 3.709 20 0 FHADHM c1ccc([C@@H]2CN(c3ccc4cc(-c5nn[n-]n5)ccc4n3)CCS2)cc1 ZINC000826520262 608235475 /nfs/dbraw/zinc/23/54/75/608235475.db2.gz DPONEJSPNAMKII-SFHVURJKSA-N -1 3 374.473 3.709 20 0 FHADHM COc1ccc([C@@H](OC)[C@H](C)Nc2ccc(Cl)cc2-c2nnn[n-]2)cc1 ZINC000826190085 608239689 /nfs/dbraw/zinc/23/96/89/608239689.db2.gz PIJHJWBPXCQINY-GTNSWQLSSA-N -1 3 373.844 3.717 20 0 FHADHM COc1ccc([C@@H](OC)[C@H](C)Nc2ccc(Cl)cc2-c2nn[n-]n2)cc1 ZINC000826190085 608239690 /nfs/dbraw/zinc/23/96/90/608239690.db2.gz PIJHJWBPXCQINY-GTNSWQLSSA-N -1 3 373.844 3.717 20 0 FHADHM CC(C)[C@H]1C[C@@H](Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)CCO1 ZINC000824216637 608242880 /nfs/dbraw/zinc/24/28/80/608242880.db2.gz UFWISTDLDBXFLL-SMDDNHRTSA-N -1 3 355.364 3.501 20 0 FHADHM CC(C)[C@H]1C[C@@H](Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)CCO1 ZINC000824216637 608242882 /nfs/dbraw/zinc/24/28/82/608242882.db2.gz UFWISTDLDBXFLL-SMDDNHRTSA-N -1 3 355.364 3.501 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N[C@H]1CCCc2cc(F)ccc21 ZINC000826278103 608273055 /nfs/dbraw/zinc/27/30/55/608273055.db2.gz RFSDUZDMNQHREE-INIZCTEOSA-N -1 3 366.400 3.513 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N[C@H]1CCCc2cc(F)ccc21 ZINC000826278103 608273057 /nfs/dbraw/zinc/27/30/57/608273057.db2.gz RFSDUZDMNQHREE-INIZCTEOSA-N -1 3 366.400 3.513 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccc(Cl)c(F)c1 ZINC000826453141 608311773 /nfs/dbraw/zinc/31/17/73/608311773.db2.gz XWMAUHAVQCRQLV-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccc(Cl)c(F)c1 ZINC000826453141 608311774 /nfs/dbraw/zinc/31/17/74/608311774.db2.gz XWMAUHAVQCRQLV-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CNc1cccc(OC2CCCC2)c1 ZINC000826170539 608319251 /nfs/dbraw/zinc/31/92/51/608319251.db2.gz DRXDSBHUVCXXDR-UHFFFAOYSA-N -1 3 365.437 3.809 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CNc1cccc(OC2CCCC2)c1 ZINC000826170539 608319253 /nfs/dbraw/zinc/31/92/53/608319253.db2.gz DRXDSBHUVCXXDR-UHFFFAOYSA-N -1 3 365.437 3.809 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CNc1ccc(C(=O)C(C)(C)C)cc1 ZINC000826170891 608320784 /nfs/dbraw/zinc/32/07/84/608320784.db2.gz SWAVQXXDMDYUEY-UHFFFAOYSA-N -1 3 365.437 3.716 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CNc1ccc(C(=O)C(C)(C)C)cc1 ZINC000826170891 608320787 /nfs/dbraw/zinc/32/07/87/608320787.db2.gz SWAVQXXDMDYUEY-UHFFFAOYSA-N -1 3 365.437 3.716 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CNc1cccc(Cl)c1OC(C)C ZINC000826170981 608321126 /nfs/dbraw/zinc/32/11/26/608321126.db2.gz XPDIPMAWGHKBHX-UHFFFAOYSA-N -1 3 373.844 3.928 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CNc1cccc(Cl)c1OC(C)C ZINC000826170981 608321128 /nfs/dbraw/zinc/32/11/28/608321128.db2.gz XPDIPMAWGHKBHX-UHFFFAOYSA-N -1 3 373.844 3.928 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CSCc1nc2ccccc2s1 ZINC000826173375 608322351 /nfs/dbraw/zinc/32/23/51/608322351.db2.gz AUEPGMQNSXOOAA-UHFFFAOYSA-N -1 3 369.475 3.918 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CSCc1nc2ccccc2s1 ZINC000826173375 608322353 /nfs/dbraw/zinc/32/23/53/608322353.db2.gz AUEPGMQNSXOOAA-UHFFFAOYSA-N -1 3 369.475 3.918 20 0 FHADHM CS[C@H](C)CCC(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCCC2 ZINC000826225874 608339198 /nfs/dbraw/zinc/33/91/98/608339198.db2.gz MTMIVPXFDYTEPR-SNVBAGLBSA-N -1 3 365.528 3.667 20 0 FHADHM CS[C@H](C)CCC(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCCC2 ZINC000826225874 608339199 /nfs/dbraw/zinc/33/91/99/608339199.db2.gz MTMIVPXFDYTEPR-SNVBAGLBSA-N -1 3 365.528 3.667 20 0 FHADHM CCN(C(=O)[C@@H]1CCc2ccccc21)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825367198 608343578 /nfs/dbraw/zinc/34/35/78/608343578.db2.gz KVINCNUVASFPMG-OAHLLOKOSA-N -1 3 367.840 3.603 20 0 FHADHM CCN(C(=O)[C@@H]1CCc2ccccc21)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825367198 608343580 /nfs/dbraw/zinc/34/35/80/608343580.db2.gz KVINCNUVASFPMG-OAHLLOKOSA-N -1 3 367.840 3.603 20 0 FHADHM CCN(C(=O)c1cc(C)c(F)c(C)c1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825380561 608345425 /nfs/dbraw/zinc/34/54/25/608345425.db2.gz QVHWNWQWCKWZOR-UHFFFAOYSA-N -1 3 373.819 3.943 20 0 FHADHM CCN(C(=O)c1cc(C)c(F)c(C)c1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825380561 608345426 /nfs/dbraw/zinc/34/54/26/608345426.db2.gz QVHWNWQWCKWZOR-UHFFFAOYSA-N -1 3 373.819 3.943 20 0 FHADHM CCc1oc(C(=O)N(CC)c2ccc(-c3nnn[n-]3)c(Cl)c2)cc1C ZINC000825776390 608346336 /nfs/dbraw/zinc/34/63/36/608346336.db2.gz HQJBVMATFNTXJO-UHFFFAOYSA-N -1 3 359.817 3.651 20 0 FHADHM CCc1oc(C(=O)N(CC)c2ccc(-c3nn[n-]n3)c(Cl)c2)cc1C ZINC000825776390 608346338 /nfs/dbraw/zinc/34/63/38/608346338.db2.gz HQJBVMATFNTXJO-UHFFFAOYSA-N -1 3 359.817 3.651 20 0 FHADHM CCN(C(=O)c1ccc(SC)o1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825385489 608347210 /nfs/dbraw/zinc/34/72/10/608347210.db2.gz HUPLAFHSJMAGKQ-UHFFFAOYSA-N -1 3 363.830 3.502 20 0 FHADHM CCN(C(=O)c1ccc(SC)o1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825385489 608347212 /nfs/dbraw/zinc/34/72/12/608347212.db2.gz HUPLAFHSJMAGKQ-UHFFFAOYSA-N -1 3 363.830 3.502 20 0 FHADHM CN(Cc1cccc(C(F)(F)F)c1)Cc1cccc(-c2nnn[n-]2)c1F ZINC000825976610 608386343 /nfs/dbraw/zinc/38/63/43/608386343.db2.gz NNAXLVHMWOQVPL-UHFFFAOYSA-N -1 3 365.334 3.657 20 0 FHADHM CN(Cc1cccc(C(F)(F)F)c1)Cc1cccc(-c2nn[n-]n2)c1F ZINC000825976610 608386345 /nfs/dbraw/zinc/38/63/45/608386345.db2.gz NNAXLVHMWOQVPL-UHFFFAOYSA-N -1 3 365.334 3.657 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)c1ccc(C(F)(F)F)cc1Cl ZINC000537147710 608425644 /nfs/dbraw/zinc/42/56/44/608425644.db2.gz DIRHTSKUUMDZGO-UHFFFAOYSA-N -1 3 367.718 3.791 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)c1ccc(C(F)(F)F)cc1Cl ZINC000537147710 608425645 /nfs/dbraw/zinc/42/56/45/608425645.db2.gz DIRHTSKUUMDZGO-UHFFFAOYSA-N -1 3 367.718 3.791 20 0 FHADHM C[C@H](NCc1ccnc(-c2nnn[n-]2)c1)c1cc(F)c(Cl)cc1Cl ZINC000824627289 608425786 /nfs/dbraw/zinc/42/57/86/608425786.db2.gz WBDWKDYWNWYDDU-QMMMGPOBSA-N -1 3 367.215 3.558 20 0 FHADHM C[C@H](NCc1ccnc(-c2nn[n-]n2)c1)c1cc(F)c(Cl)cc1Cl ZINC000824627289 608425787 /nfs/dbraw/zinc/42/57/87/608425787.db2.gz WBDWKDYWNWYDDU-QMMMGPOBSA-N -1 3 367.215 3.558 20 0 FHADHM O=C(CC/C=C\c1ccccc1)OCc1cccc(-c2nnn[n-]2)c1F ZINC000826405641 608448305 /nfs/dbraw/zinc/44/83/05/608448305.db2.gz NITSNCUGQQEMCZ-WTKPLQERSA-N -1 3 352.369 3.543 20 0 FHADHM O=C(CC/C=C\c1ccccc1)OCc1cccc(-c2nn[n-]n2)c1F ZINC000826405641 608448306 /nfs/dbraw/zinc/44/83/06/608448306.db2.gz NITSNCUGQQEMCZ-WTKPLQERSA-N -1 3 352.369 3.543 20 0 FHADHM C[C@H](NCc1ncc(-c2ccccc2F)o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824633193 608462580 /nfs/dbraw/zinc/46/25/80/608462580.db2.gz HOKNBIVTPHFQEY-LBPRGKRZSA-N -1 3 364.384 3.512 20 0 FHADHM C[C@H](NCc1ncc(-c2ccccc2F)o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824633193 608462582 /nfs/dbraw/zinc/46/25/82/608462582.db2.gz HOKNBIVTPHFQEY-LBPRGKRZSA-N -1 3 364.384 3.512 20 0 FHADHM Fc1c(CNc2ccc(SC(F)F)cc2)cccc1-c1nnn[n-]1 ZINC000826370823 608479722 /nfs/dbraw/zinc/47/97/22/608479722.db2.gz IXJJEBGVSSOAJK-UHFFFAOYSA-N -1 3 351.357 3.933 20 0 FHADHM Fc1c(CNc2ccc(SC(F)F)cc2)cccc1-c1nn[n-]n1 ZINC000826370823 608479723 /nfs/dbraw/zinc/47/97/23/608479723.db2.gz IXJJEBGVSSOAJK-UHFFFAOYSA-N -1 3 351.357 3.933 20 0 FHADHM Fc1c(CNc2cccc(OC3CCCC3)c2)cccc1-c1nnn[n-]1 ZINC000826370914 608481667 /nfs/dbraw/zinc/48/16/67/608481667.db2.gz LMHNTBPYTMRDSU-UHFFFAOYSA-N -1 3 353.401 3.939 20 0 FHADHM Fc1c(CNc2cccc(OC3CCCC3)c2)cccc1-c1nn[n-]n1 ZINC000826370914 608481668 /nfs/dbraw/zinc/48/16/68/608481668.db2.gz LMHNTBPYTMRDSU-UHFFFAOYSA-N -1 3 353.401 3.939 20 0 FHADHM CC1(CC(=O)N2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)CCCCC1 ZINC000824817002 608484401 /nfs/dbraw/zinc/48/44/01/608484401.db2.gz JXOZIKZHOKVBRM-UHFFFAOYSA-N -1 3 365.481 3.843 20 0 FHADHM CC1(CC(=O)N2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)CCCCC1 ZINC000824817002 608484402 /nfs/dbraw/zinc/48/44/02/608484402.db2.gz JXOZIKZHOKVBRM-UHFFFAOYSA-N -1 3 365.481 3.843 20 0 FHADHM O=C(/C=C\C1CCCCC1)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000826400147 608487230 /nfs/dbraw/zinc/48/72/30/608487230.db2.gz QIRITLZJUJQLKP-WDZFZDKYSA-N -1 3 363.465 3.619 20 0 FHADHM O=C(/C=C\C1CCCCC1)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000826400147 608487231 /nfs/dbraw/zinc/48/72/31/608487231.db2.gz QIRITLZJUJQLKP-WDZFZDKYSA-N -1 3 363.465 3.619 20 0 FHADHM CN(Cc1ccc(-c2nnn[n-]2)s1)Cc1ccc(Cl)cc1Cl ZINC000825961891 608500392 /nfs/dbraw/zinc/50/03/92/608500392.db2.gz OSOSXNMUUDLQCJ-UHFFFAOYSA-N -1 3 354.266 3.867 20 0 FHADHM CN(Cc1ccc(-c2nn[n-]n2)s1)Cc1ccc(Cl)cc1Cl ZINC000825961891 608500394 /nfs/dbraw/zinc/50/03/94/608500394.db2.gz OSOSXNMUUDLQCJ-UHFFFAOYSA-N -1 3 354.266 3.867 20 0 FHADHM C[C@H]1C[C@H]1c1ccc(CN(Cc2cc(-c3nn[n-]n3)cs2)C2CC2)o1 ZINC000824897813 608518253 /nfs/dbraw/zinc/51/82/53/608518253.db2.gz BHMRZSHWBRMUPN-MEDUHNTESA-N -1 3 355.467 3.809 20 0 FHADHM C[C@H]1C[C@H]1c1ccc(CN(Cc2cc(-c3nnn[n-]3)cs2)C2CC2)o1 ZINC000824897813 608518252 /nfs/dbraw/zinc/51/82/52/608518252.db2.gz BHMRZSHWBRMUPN-MEDUHNTESA-N -1 3 355.467 3.809 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H]1CCC(C)(C)C1 ZINC000824255674 608585886 /nfs/dbraw/zinc/58/58/86/608585886.db2.gz SNVMRIYMICKFGD-QGZVFWFLSA-N -1 3 370.501 3.613 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H]1CCC(C)(C)C1 ZINC000824255674 608585888 /nfs/dbraw/zinc/58/58/88/608585888.db2.gz SNVMRIYMICKFGD-QGZVFWFLSA-N -1 3 370.501 3.613 20 0 FHADHM c1cc(-c2nnn[n-]2)sc1CN1CCCC[C@H]1c1nc2ccccc2o1 ZINC000826524001 608741610 /nfs/dbraw/zinc/74/16/10/608741610.db2.gz FJCPKYSCWOZHKT-AWEZNQCLSA-N -1 3 366.450 3.797 20 0 FHADHM c1cc(-c2nn[n-]n2)sc1CN1CCCC[C@H]1c1nc2ccccc2o1 ZINC000826524001 608741613 /nfs/dbraw/zinc/74/16/13/608741613.db2.gz FJCPKYSCWOZHKT-AWEZNQCLSA-N -1 3 366.450 3.797 20 0 FHADHM COC[C@H](Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)c1ccccc1 ZINC000826151396 608798359 /nfs/dbraw/zinc/79/83/59/608798359.db2.gz ACRQOXVUXLKPMX-HNNXBMFYSA-N -1 3 363.343 3.685 20 0 FHADHM COC[C@H](Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)c1ccccc1 ZINC000826151396 608798360 /nfs/dbraw/zinc/79/83/60/608798360.db2.gz ACRQOXVUXLKPMX-HNNXBMFYSA-N -1 3 363.343 3.685 20 0 FHADHM C[C@H](NCc1nc(C(C)(C)C)cs1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824625787 609141245 /nfs/dbraw/zinc/14/12/45/609141245.db2.gz KAIZGKPVOSZISZ-JTQLQIEISA-N -1 3 360.462 3.611 20 0 FHADHM C[C@H](NCc1nc(C(C)(C)C)cs1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824625787 609141247 /nfs/dbraw/zinc/14/12/47/609141247.db2.gz KAIZGKPVOSZISZ-JTQLQIEISA-N -1 3 360.462 3.611 20 0 FHADHM Cc1ccc2c(c1)[C@H](NC(=O)Nc1cc(-c3nnn[n-]3)ccc1C)[C@@H](C)C2 ZINC000826294632 609157580 /nfs/dbraw/zinc/15/75/80/609157580.db2.gz XSWVJCLLDJDCET-SCLBCKFNSA-N -1 3 362.437 3.539 20 0 FHADHM Cc1ccc2c(c1)[C@H](NC(=O)Nc1cc(-c3nn[n-]n3)ccc1C)[C@@H](C)C2 ZINC000826294632 609157581 /nfs/dbraw/zinc/15/75/81/609157581.db2.gz XSWVJCLLDJDCET-SCLBCKFNSA-N -1 3 362.437 3.539 20 0 FHADHM CC(=O)Nc1ccc(N[C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1Cl ZINC000824000165 609164002 /nfs/dbraw/zinc/16/40/02/609164002.db2.gz XNWJCJOOYWWIOY-SNVBAGLBSA-N -1 3 356.817 3.652 20 0 FHADHM CC(=O)Nc1ccc(N[C@H](C)c2cccc(-c3nn[n-]n3)c2)cc1Cl ZINC000824000165 609164003 /nfs/dbraw/zinc/16/40/03/609164003.db2.gz XNWJCJOOYWWIOY-SNVBAGLBSA-N -1 3 356.817 3.652 20 0 FHADHM CCOc1cc(N[C@@H]2CCCc3cc(-c4nnn[n-]4)ccc32)ccc1OC ZINC000825615701 609173959 /nfs/dbraw/zinc/17/39/59/609173959.db2.gz HGYULESPTLLEBM-QGZVFWFLSA-N -1 3 365.437 3.764 20 0 FHADHM CCOc1cc(N[C@@H]2CCCc3cc(-c4nn[n-]n4)ccc32)ccc1OC ZINC000825615701 609173960 /nfs/dbraw/zinc/17/39/60/609173960.db2.gz HGYULESPTLLEBM-QGZVFWFLSA-N -1 3 365.437 3.764 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)ccc1OCc1ncc(Cl)cc1Cl ZINC000825609461 609174245 /nfs/dbraw/zinc/17/42/45/609174245.db2.gz MPGTUPFHGRLCDO-UHFFFAOYSA-N -1 3 366.208 3.546 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)ccc1OCc1ncc(Cl)cc1Cl ZINC000825609461 609174246 /nfs/dbraw/zinc/17/42/46/609174246.db2.gz MPGTUPFHGRLCDO-UHFFFAOYSA-N -1 3 366.208 3.546 20 0 FHADHM O=C(N[C@H](c1ccc(Cl)cc1)C1CCCC1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC000826427075 609210445 /nfs/dbraw/zinc/21/04/45/609210445.db2.gz FPTALGWQDOGANS-INIZCTEOSA-N -1 3 370.844 3.510 20 0 FHADHM O=C(N[C@H](c1ccc(Cl)cc1)C1CCCC1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC000826427075 609210446 /nfs/dbraw/zinc/21/04/46/609210446.db2.gz FPTALGWQDOGANS-INIZCTEOSA-N -1 3 370.844 3.510 20 0 FHADHM C[C@H](c1ccccc1)n1ccc(N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)n1 ZINC000824663492 609245227 /nfs/dbraw/zinc/24/52/27/609245227.db2.gz ZVVIKWXEOYQCHV-LSDHHAIUSA-N -1 3 359.437 3.846 20 0 FHADHM C[C@H](c1ccccc1)n1ccc(N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)n1 ZINC000824663492 609245229 /nfs/dbraw/zinc/24/52/29/609245229.db2.gz ZVVIKWXEOYQCHV-LSDHHAIUSA-N -1 3 359.437 3.846 20 0 FHADHM Cc1cnn(-c2ccc(C)cc2N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000826280465 609253605 /nfs/dbraw/zinc/25/36/05/609253605.db2.gz COLFHCJKNYQNCA-HNNXBMFYSA-N -1 3 359.437 3.842 20 0 FHADHM Cc1cnn(-c2ccc(C)cc2N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000826280465 609253608 /nfs/dbraw/zinc/25/36/08/609253608.db2.gz COLFHCJKNYQNCA-HNNXBMFYSA-N -1 3 359.437 3.842 20 0 FHADHM COc1cc(F)c(N[C@@H]2CCCc3cc(-c4nnn[n-]4)ccc32)cc1OC ZINC000826180087 609254817 /nfs/dbraw/zinc/25/48/17/609254817.db2.gz RNEGCRXONBAPAL-OAHLLOKOSA-N -1 3 369.400 3.513 20 0 FHADHM COc1cc(F)c(N[C@@H]2CCCc3cc(-c4nn[n-]n4)ccc32)cc1OC ZINC000826180087 609254818 /nfs/dbraw/zinc/25/48/18/609254818.db2.gz RNEGCRXONBAPAL-OAHLLOKOSA-N -1 3 369.400 3.513 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1CNc1nc2ccc(Cl)cc2s1 ZINC000826372215 609264764 /nfs/dbraw/zinc/26/47/64/609264764.db2.gz MYFLWJJFGVLJMZ-UHFFFAOYSA-N -1 3 360.805 3.881 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CNc1nc2ccc(Cl)cc2s1 ZINC000826372215 609264765 /nfs/dbraw/zinc/26/47/65/609264765.db2.gz MYFLWJJFGVLJMZ-UHFFFAOYSA-N -1 3 360.805 3.881 20 0 FHADHM CCC(=O)Nc1ccc(N[C@@H]2CCCc3cc(-c4nnn[n-]4)ccc32)cc1 ZINC000825035124 609268835 /nfs/dbraw/zinc/26/88/35/609268835.db2.gz VUFWTTVDJINIIC-GOSISDBHSA-N -1 3 362.437 3.705 20 0 FHADHM CCC(=O)Nc1ccc(N[C@@H]2CCCc3cc(-c4nn[n-]n4)ccc32)cc1 ZINC000825035124 609268837 /nfs/dbraw/zinc/26/88/37/609268837.db2.gz VUFWTTVDJINIIC-GOSISDBHSA-N -1 3 362.437 3.705 20 0 FHADHM COc1ccc(OC(F)F)c(N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000826210942 609275649 /nfs/dbraw/zinc/27/56/49/609275649.db2.gz KKDSEEZVKVUJDC-JTQLQIEISA-N -1 3 361.352 3.650 20 0 FHADHM COc1ccc(OC(F)F)c(N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000826210942 609275650 /nfs/dbraw/zinc/27/56/50/609275650.db2.gz KKDSEEZVKVUJDC-JTQLQIEISA-N -1 3 361.352 3.650 20 0 FHADHM C[C@@H](Nc1cccc(NC(=O)c2ccoc2)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824663368 609276381 /nfs/dbraw/zinc/27/63/81/609276381.db2.gz YNQYUPQXYUADRG-CYBMUJFWSA-N -1 3 374.404 3.885 20 0 FHADHM C[C@@H](Nc1cccc(NC(=O)c2ccoc2)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824663368 609276382 /nfs/dbraw/zinc/27/63/82/609276382.db2.gz YNQYUPQXYUADRG-CYBMUJFWSA-N -1 3 374.404 3.885 20 0 FHADHM CN1CCCc2cc(N[C@@H]3CCCc4cc(-c5nnn[n-]5)ccc43)ccc21 ZINC000826033934 609276876 /nfs/dbraw/zinc/27/68/76/609276876.db2.gz LIMXMWOPKWBRPG-LJQANCHMSA-N -1 3 360.465 3.739 20 0 FHADHM CN1CCCc2cc(N[C@@H]3CCCc4cc(-c5nn[n-]n5)ccc43)ccc21 ZINC000826033934 609276878 /nfs/dbraw/zinc/27/68/78/609276878.db2.gz LIMXMWOPKWBRPG-LJQANCHMSA-N -1 3 360.465 3.739 20 0 FHADHM C[C@H](Nc1ccc(-n2ccnc2)c(Cl)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824658566 609277374 /nfs/dbraw/zinc/27/73/74/609277374.db2.gz YLZJKDSHFICJRL-LBPRGKRZSA-N -1 3 365.828 3.879 20 0 FHADHM C[C@H](Nc1ccc(-n2ccnc2)c(Cl)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824658566 609277376 /nfs/dbraw/zinc/27/73/76/609277376.db2.gz YLZJKDSHFICJRL-LBPRGKRZSA-N -1 3 365.828 3.879 20 0 FHADHM C[C@H](Nc1ccc(-n2cccn2)c(Cl)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824657224 609277796 /nfs/dbraw/zinc/27/77/96/609277796.db2.gz PVMLXAVCMKXVNP-LBPRGKRZSA-N -1 3 365.828 3.879 20 0 FHADHM C[C@H](Nc1ccc(-n2cccn2)c(Cl)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824657224 609277798 /nfs/dbraw/zinc/27/77/98/609277798.db2.gz PVMLXAVCMKXVNP-LBPRGKRZSA-N -1 3 365.828 3.879 20 0 FHADHM Cc1cc(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)nn1-c1cccc(F)c1 ZINC000826270880 609281877 /nfs/dbraw/zinc/28/18/77/609281877.db2.gz SDRYSPIFADCUOA-CYBMUJFWSA-N -1 3 363.400 3.673 20 0 FHADHM Cc1cc(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)nn1-c1cccc(F)c1 ZINC000826270880 609281878 /nfs/dbraw/zinc/28/18/78/609281878.db2.gz SDRYSPIFADCUOA-CYBMUJFWSA-N -1 3 363.400 3.673 20 0 FHADHM COc1ccc(Br)c(N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000826186597 609281987 /nfs/dbraw/zinc/28/19/87/609281987.db2.gz BCEWXLHVTZGSGG-SNVBAGLBSA-N -1 3 374.242 3.811 20 0 FHADHM COc1ccc(Br)c(N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000826186597 609281988 /nfs/dbraw/zinc/28/19/88/609281988.db2.gz BCEWXLHVTZGSGG-SNVBAGLBSA-N -1 3 374.242 3.811 20 0 FHADHM Cc1ccc(C(C)C)cc1O[C@H](C)C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000641980291 609282140 /nfs/dbraw/zinc/28/21/40/609282140.db2.gz NVGCMUFKPMVHRI-CQSZACIVSA-N -1 3 365.437 3.705 20 0 FHADHM Cc1ccc(C(C)C)cc1O[C@H](C)C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000641980291 609282141 /nfs/dbraw/zinc/28/21/41/609282141.db2.gz NVGCMUFKPMVHRI-CQSZACIVSA-N -1 3 365.437 3.705 20 0 FHADHM CC[C@@H](c1ccncc1)N(CC)C(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000825159506 609299802 /nfs/dbraw/zinc/29/98/02/609299802.db2.gz PAQBNARMZNKVQE-INIZCTEOSA-N -1 3 370.844 3.529 20 0 FHADHM CC[C@@H](c1ccncc1)N(CC)C(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000825159506 609299804 /nfs/dbraw/zinc/29/98/04/609299804.db2.gz PAQBNARMZNKVQE-INIZCTEOSA-N -1 3 370.844 3.529 20 0 FHADHM Brc1cc(-c2nnn[n-]2)ccc1CSCc1ccco1 ZINC000823820986 609305712 /nfs/dbraw/zinc/30/57/12/609305712.db2.gz NNGRPGWYVIBVCM-UHFFFAOYSA-N -1 3 351.229 3.656 20 0 FHADHM Brc1cc(-c2nn[n-]n2)ccc1CSCc1ccco1 ZINC000823820986 609305714 /nfs/dbraw/zinc/30/57/14/609305714.db2.gz NNGRPGWYVIBVCM-UHFFFAOYSA-N -1 3 351.229 3.656 20 0 FHADHM Cn1cc(C=Cc2nc3ccccc3o2)c(-c2ccc(-c3nnn[n-]3)cc2)n1 ZINC000826359693 609307788 /nfs/dbraw/zinc/30/77/88/609307788.db2.gz NZPDCRVQPAUQKR-ZHACJKMWSA-N -1 3 369.388 3.579 20 0 FHADHM Cn1cc(C=Cc2nc3ccccc3o2)c(-c2ccc(-c3nn[n-]n3)cc2)n1 ZINC000826359693 609307789 /nfs/dbraw/zinc/30/77/89/609307789.db2.gz NZPDCRVQPAUQKR-ZHACJKMWSA-N -1 3 369.388 3.579 20 0 FHADHM CCC(CC)[C@H]1C[C@@H](Nc2nc3ccccc3cc2-c2nnn[n-]2)CCO1 ZINC000825108334 609321952 /nfs/dbraw/zinc/32/19/52/609321952.db2.gz VVWBCRVJWLJTBF-MAUKXSAKSA-N -1 3 366.469 3.811 20 0 FHADHM CCC(CC)[C@H]1C[C@@H](Nc2nc3ccccc3cc2-c2nn[n-]n2)CCO1 ZINC000825108334 609321954 /nfs/dbraw/zinc/32/19/54/609321954.db2.gz VVWBCRVJWLJTBF-MAUKXSAKSA-N -1 3 366.469 3.811 20 0 FHADHM C[C@@H](NCc1coc(-c2cccs2)n1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824625364 609329337 /nfs/dbraw/zinc/32/93/37/609329337.db2.gz GRGLWXXUEFWNCF-SNVBAGLBSA-N -1 3 370.413 3.573 20 0 FHADHM C[C@@H](NCc1coc(-c2cccs2)n1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824625364 609329339 /nfs/dbraw/zinc/32/93/39/609329339.db2.gz GRGLWXXUEFWNCF-SNVBAGLBSA-N -1 3 370.413 3.573 20 0 FHADHM C[C@H](N[C@@H](c1ccccc1)c1ccncc1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824540172 609330165 /nfs/dbraw/zinc/33/01/65/609330165.db2.gz SJDOXSVDEZDBQQ-XOBRGWDASA-N -1 3 374.423 3.841 20 0 FHADHM C[C@H](N[C@@H](c1ccccc1)c1ccncc1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824540172 609330167 /nfs/dbraw/zinc/33/01/67/609330167.db2.gz SJDOXSVDEZDBQQ-XOBRGWDASA-N -1 3 374.423 3.841 20 0 FHADHM C[C@@H](N[C@H]1CCCOc2ccc(F)cc21)c1ccc(-c2nn[n-]n2)cc1F ZINC000824545956 609330391 /nfs/dbraw/zinc/33/03/91/609330391.db2.gz FOVUITPBPMLCLF-DIFFPNOSSA-N -1 3 371.391 3.709 20 0 FHADHM CCC(CC)c1cc(CN[C@@H](C)c2ccc(-c3nnn[n-]3)cc2F)on1 ZINC000825114763 609337466 /nfs/dbraw/zinc/33/74/66/609337466.db2.gz PQDZISANTIKQGK-NSHDSACASA-N -1 3 358.421 3.748 20 0 FHADHM CCC(CC)c1cc(CN[C@@H](C)c2ccc(-c3nn[n-]n3)cc2F)on1 ZINC000825114763 609337468 /nfs/dbraw/zinc/33/74/68/609337468.db2.gz PQDZISANTIKQGK-NSHDSACASA-N -1 3 358.421 3.748 20 0 FHADHM C[C@@H](NCc1csc(-c2ccco2)n1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824626133 609340204 /nfs/dbraw/zinc/34/02/04/609340204.db2.gz MJEBBRZYBZORBK-SNVBAGLBSA-N -1 3 370.413 3.573 20 0 FHADHM C[C@@H](NCc1csc(-c2ccco2)n1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824626133 609340206 /nfs/dbraw/zinc/34/02/06/609340206.db2.gz MJEBBRZYBZORBK-SNVBAGLBSA-N -1 3 370.413 3.573 20 0 FHADHM CCOc1cc(C)ccc1CN[C@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000825616099 609340283 /nfs/dbraw/zinc/34/02/83/609340283.db2.gz WLOWEWVJUJLATJ-CYBMUJFWSA-N -1 3 355.417 3.564 20 0 FHADHM Cc1c(NCc2cc(-c3nnn[n-]3)cs2)cnn1-c1cc(C)ccc1C ZINC000826284480 609344769 /nfs/dbraw/zinc/34/47/69/609344769.db2.gz VCRODXPLWGUANI-UHFFFAOYSA-N -1 3 365.466 3.651 20 0 FHADHM Cc1c(NCc2cc(-c3nn[n-]n3)cs2)cnn1-c1cc(C)ccc1C ZINC000826284480 609344771 /nfs/dbraw/zinc/34/47/71/609344771.db2.gz VCRODXPLWGUANI-UHFFFAOYSA-N -1 3 365.466 3.651 20 0 FHADHM CC(=O)Nc1ccc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2F)cc1Cl ZINC000823999944 609345505 /nfs/dbraw/zinc/34/55/05/609345505.db2.gz OCGLNEQXLUXXFM-VIFPVBQESA-N -1 3 374.807 3.791 20 0 FHADHM CC(=O)Nc1ccc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2F)cc1Cl ZINC000823999944 609345506 /nfs/dbraw/zinc/34/55/06/609345506.db2.gz OCGLNEQXLUXXFM-VIFPVBQESA-N -1 3 374.807 3.791 20 0 FHADHM FC(F)(F)[C@@H](CCc1ccccc1)NCc1ccc(-c2nnn[n-]2)s1 ZINC000826367043 609346747 /nfs/dbraw/zinc/34/67/47/609346747.db2.gz JICAUWFADWYGFO-CQSZACIVSA-N -1 3 367.400 3.582 20 0 FHADHM C[C@@H](Nc1ccc(OCC2CC2)cc1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824656178 609347176 /nfs/dbraw/zinc/34/71/76/609347176.db2.gz IRSUHXDNSSKWDX-GFCCVEGCSA-N -1 3 353.401 3.968 20 0 FHADHM C[C@@H](Nc1ccc(OCC2CC2)cc1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824656178 609347179 /nfs/dbraw/zinc/34/71/79/609347179.db2.gz IRSUHXDNSSKWDX-GFCCVEGCSA-N -1 3 353.401 3.968 20 0 FHADHM O=C(N[C@@H](CC1CCC1)c1ccccc1)c1sccc1-c1nnn[n-]1 ZINC000826426883 609350670 /nfs/dbraw/zinc/35/06/70/609350670.db2.gz YOKHCSYMEACUPN-HNNXBMFYSA-N -1 3 353.451 3.590 20 0 FHADHM O=C(N[C@@H](CC1CCC1)c1ccccc1)c1sccc1-c1nn[n-]n1 ZINC000826426883 609350672 /nfs/dbraw/zinc/35/06/72/609350672.db2.gz YOKHCSYMEACUPN-HNNXBMFYSA-N -1 3 353.451 3.590 20 0 FHADHM Cc1ccc(-c2ccc(C(=O)Nc3ccc(-c4nnn[n-]4)cc3)s2)o1 ZINC000580614540 609370542 /nfs/dbraw/zinc/37/05/42/609370542.db2.gz MPYBGIOIHAKOHP-UHFFFAOYSA-N -1 3 351.391 3.749 20 0 FHADHM Cc1ccc(-c2ccc(C(=O)Nc3ccc(-c4nn[n-]n4)cc3)s2)o1 ZINC000580614540 609370545 /nfs/dbraw/zinc/37/05/45/609370545.db2.gz MPYBGIOIHAKOHP-UHFFFAOYSA-N -1 3 351.391 3.749 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N[C@H](CC(C)(C)C)C(F)(F)F ZINC000826278158 609382065 /nfs/dbraw/zinc/38/20/65/609382065.db2.gz SLPUWVHUDOYXFM-GFCCVEGCSA-N -1 3 370.379 3.664 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N[C@H](CC(C)(C)C)C(F)(F)F ZINC000826278158 609382067 /nfs/dbraw/zinc/38/20/67/609382067.db2.gz SLPUWVHUDOYXFM-GFCCVEGCSA-N -1 3 370.379 3.664 20 0 FHADHM Fc1cc(F)c(NCc2cccc(-c3nnn[n-]3)c2)c(Br)c1 ZINC000826373009 609424451 /nfs/dbraw/zinc/42/44/51/609424451.db2.gz VWAQRVJRMCLGOE-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1cc(F)c(NCc2cccc(-c3nn[n-]n3)c2)c(Br)c1 ZINC000826373009 609424452 /nfs/dbraw/zinc/42/44/52/609424452.db2.gz VWAQRVJRMCLGOE-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Cc1cccc(CNc2ccn(-c3ccc(-c4nn[n-]n4)cc3Cl)n2)c1 ZINC000826298325 609444275 /nfs/dbraw/zinc/44/42/75/609444275.db2.gz NWCLPVXGCLPMTQ-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM Cc1cccc(CNc2ccn(-c3ccc(Cl)cc3-c3nnn[n-]3)n2)c1 ZINC000826298109 609446095 /nfs/dbraw/zinc/44/60/95/609446095.db2.gz DQJJZQFGQMUVKC-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM Cc1cccc(CNc2ccn(-c3ccc(Cl)cc3-c3nn[n-]n3)n2)c1 ZINC000826298109 609446096 /nfs/dbraw/zinc/44/60/96/609446096.db2.gz DQJJZQFGQMUVKC-UHFFFAOYSA-N -1 3 365.828 3.626 20 0 FHADHM COc1ccc(CSc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)cn1 ZINC000826207835 609451147 /nfs/dbraw/zinc/45/11/47/609451147.db2.gz GXAJCQDAKPQUIS-UHFFFAOYSA-N -1 3 367.356 3.581 20 0 FHADHM COc1ccc(CSc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)cn1 ZINC000826207835 609451149 /nfs/dbraw/zinc/45/11/49/609451149.db2.gz GXAJCQDAKPQUIS-UHFFFAOYSA-N -1 3 367.356 3.581 20 0 FHADHM O=C1CCC[C@@H]1CCSc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000826480030 609453674 /nfs/dbraw/zinc/45/36/74/609453674.db2.gz PDPPEDXYXAIXAP-SECBINFHSA-N -1 3 356.373 3.737 20 0 FHADHM O=C1CCC[C@@H]1CCSc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000826480030 609453678 /nfs/dbraw/zinc/45/36/78/609453678.db2.gz PDPPEDXYXAIXAP-SECBINFHSA-N -1 3 356.373 3.737 20 0 FHADHM Cc1cc(NCc2cccc(-c3nnn[n-]3)c2F)ccc1Br ZINC000826271631 609473901 /nfs/dbraw/zinc/47/39/01/609473901.db2.gz ZOZCMGOJOQZKGL-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Cc1cc(NCc2cccc(-c3nn[n-]n3)c2F)ccc1Br ZINC000826271631 609473902 /nfs/dbraw/zinc/47/39/02/609473902.db2.gz ZOZCMGOJOQZKGL-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM CC(C)Oc1c(F)cc(NCc2ccc(-c3nnn[n-]3)cc2F)cc1F ZINC000824315125 609479748 /nfs/dbraw/zinc/47/97/48/609479748.db2.gz KRVZIKKDQVJTQY-UHFFFAOYSA-N -1 3 363.343 3.683 20 0 FHADHM CC(C)Oc1c(F)cc(NCc2ccc(-c3nn[n-]n3)cc2F)cc1F ZINC000824315125 609479749 /nfs/dbraw/zinc/47/97/49/609479749.db2.gz KRVZIKKDQVJTQY-UHFFFAOYSA-N -1 3 363.343 3.683 20 0 FHADHM C[C@H]1CCC[C@H]1C(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000824930049 609501588 /nfs/dbraw/zinc/50/15/88/609501588.db2.gz ZVNDRGNRNPPAKQ-SWLSCSKDSA-N -1 3 367.478 3.648 20 0 FHADHM COc1ccc(C)cc1[C@H](C)Nc1ncc(Cl)c(C)c1-c1nnn[n-]1 ZINC000826189798 609524051 /nfs/dbraw/zinc/52/40/51/609524051.db2.gz FKYHHJNMGBMGKF-NSHDSACASA-N -1 3 358.833 3.714 20 0 FHADHM COc1ccc(C)cc1[C@H](C)Nc1ncc(Cl)c(C)c1-c1nn[n-]n1 ZINC000826189798 609524054 /nfs/dbraw/zinc/52/40/54/609524054.db2.gz FKYHHJNMGBMGKF-NSHDSACASA-N -1 3 358.833 3.714 20 0 FHADHM Cc1ccnc(N2CCC[C@H](c3nc(C(C)C)cs3)C2)c1-c1nnn[n-]1 ZINC000826310067 609560550 /nfs/dbraw/zinc/56/05/50/609560550.db2.gz KLSVUGKPYODYPN-ZDUSSCGKSA-N -1 3 369.498 3.534 20 0 FHADHM Cc1ccnc(N2CCC[C@H](c3nc(C(C)C)cs3)C2)c1-c1nn[n-]n1 ZINC000826310067 609560552 /nfs/dbraw/zinc/56/05/52/609560552.db2.gz KLSVUGKPYODYPN-ZDUSSCGKSA-N -1 3 369.498 3.534 20 0 FHADHM Cc1c(Cl)cnc(N2CC[C@@H](C)C[C@@H]2c2ccco2)c1-c1nnn[n-]1 ZINC000826237298 609565690 /nfs/dbraw/zinc/56/56/90/609565690.db2.gz VCFLUNXFYSZURL-ZWNOBZJWSA-N -1 3 358.833 3.794 20 0 FHADHM Cc1c(Cl)cnc(N2CC[C@@H](C)C[C@@H]2c2ccco2)c1-c1nn[n-]n1 ZINC000826237298 609565691 /nfs/dbraw/zinc/56/56/91/609565691.db2.gz VCFLUNXFYSZURL-ZWNOBZJWSA-N -1 3 358.833 3.794 20 0 FHADHM Cc1nc2c(s1)[C@@H](Nc1nc3ccccc3cc1-c1nnn[n-]1)CCC2 ZINC000826328568 609565926 /nfs/dbraw/zinc/56/59/26/609565926.db2.gz WESPBNFPQPEAGU-HNNXBMFYSA-N -1 3 363.450 3.669 20 0 FHADHM Cc1nc2c(s1)[C@@H](Nc1nc3ccccc3cc1-c1nn[n-]n1)CCC2 ZINC000826328568 609565929 /nfs/dbraw/zinc/56/59/29/609565929.db2.gz WESPBNFPQPEAGU-HNNXBMFYSA-N -1 3 363.450 3.669 20 0 FHADHM Cc1ccnc(N[C@H](c2ccccc2)c2cccc(F)c2)c1-c1nnn[n-]1 ZINC000826311896 609574255 /nfs/dbraw/zinc/57/42/55/609574255.db2.gz QJINOAGQTMFZTJ-GOSISDBHSA-N -1 3 360.396 3.911 20 0 FHADHM Cc1ccnc(N[C@H](c2ccccc2)c2cccc(F)c2)c1-c1nn[n-]n1 ZINC000826311896 609574257 /nfs/dbraw/zinc/57/42/57/609574257.db2.gz QJINOAGQTMFZTJ-GOSISDBHSA-N -1 3 360.396 3.911 20 0 FHADHM C[C@@H]1CC[C@@H](C(F)(F)F)CN1c1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000824907236 609576251 /nfs/dbraw/zinc/57/62/51/609576251.db2.gz HEDVZPQFINGLQW-GHMZBOCLSA-N -1 3 362.359 3.582 20 0 FHADHM C[C@@H]1CC[C@@H](C(F)(F)F)CN1c1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000824907236 609576254 /nfs/dbraw/zinc/57/62/54/609576254.db2.gz HEDVZPQFINGLQW-GHMZBOCLSA-N -1 3 362.359 3.582 20 0 FHADHM C[C@H]1CC[C@@H](C(F)(F)F)CN1c1ccc2cc(-c3nnn[n-]3)ccc2n1 ZINC000824906693 609576384 /nfs/dbraw/zinc/57/63/84/609576384.db2.gz CWTRFAWZIFAQSN-GXFFZTMASA-N -1 3 362.359 3.582 20 0 FHADHM C[C@H]1CC[C@@H](C(F)(F)F)CN1c1ccc2cc(-c3nn[n-]n3)ccc2n1 ZINC000824906693 609576385 /nfs/dbraw/zinc/57/63/85/609576385.db2.gz CWTRFAWZIFAQSN-GXFFZTMASA-N -1 3 362.359 3.582 20 0 FHADHM COc1cccc([C@H]2C[C@H](C)CN2c2ccc(F)cc2-c2nnn[n-]2)c1 ZINC000826214974 609592720 /nfs/dbraw/zinc/59/27/20/609592720.db2.gz CHPOZFMXKCHWAY-KPZWWZAWSA-N -1 3 353.401 3.602 20 0 FHADHM COc1cccc([C@H]2C[C@H](C)CN2c2ccc(F)cc2-c2nn[n-]n2)c1 ZINC000826214974 609592722 /nfs/dbraw/zinc/59/27/22/609592722.db2.gz CHPOZFMXKCHWAY-KPZWWZAWSA-N -1 3 353.401 3.602 20 0 FHADHM COc1cccc([C@@H]2C[C@H](C)CN2c2ccc(F)cc2-c2nnn[n-]2)c1 ZINC000826214976 609593150 /nfs/dbraw/zinc/59/31/50/609593150.db2.gz CHPOZFMXKCHWAY-SGTLLEGYSA-N -1 3 353.401 3.602 20 0 FHADHM COc1cccc([C@@H]2C[C@H](C)CN2c2ccc(F)cc2-c2nn[n-]n2)c1 ZINC000826214976 609593151 /nfs/dbraw/zinc/59/31/51/609593151.db2.gz CHPOZFMXKCHWAY-SGTLLEGYSA-N -1 3 353.401 3.602 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)N1CCC[C@H]1/C=C/c1ccccc1 ZINC000826452438 609606879 /nfs/dbraw/zinc/60/68/79/609606879.db2.gz TZCJVFPTEWGWJD-RORWEDLISA-N -1 3 360.421 3.576 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)N1CCC[C@H]1/C=C/c1ccccc1 ZINC000826452438 609606881 /nfs/dbraw/zinc/60/68/81/609606881.db2.gz TZCJVFPTEWGWJD-RORWEDLISA-N -1 3 360.421 3.576 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@H]1C(=O)OCc1ccc(Cl)cc1-c1nnn[n-]1 ZINC000826316473 609616339 /nfs/dbraw/zinc/61/63/39/609616339.db2.gz PGHXEFKIMNEQCU-ZIAGYGMSSA-N -1 3 374.853 3.737 20 0 FHADHM Cc1ccsc1[C@@H]1C[C@H]1C(=O)OCc1ccc(Cl)cc1-c1nn[n-]n1 ZINC000826316473 609616340 /nfs/dbraw/zinc/61/63/40/609616340.db2.gz PGHXEFKIMNEQCU-ZIAGYGMSSA-N -1 3 374.853 3.737 20 0 FHADHM C[C@H](C(=O)OCc1ccc(Cl)cc1-c1nnn[n-]1)c1cccc(F)c1 ZINC000824052941 609619749 /nfs/dbraw/zinc/61/97/49/609619749.db2.gz SWFVDZYULCSOCM-JTQLQIEISA-N -1 3 360.776 3.506 20 0 FHADHM C[C@H](C(=O)OCc1ccc(Cl)cc1-c1nn[n-]n1)c1cccc(F)c1 ZINC000824052941 609619750 /nfs/dbraw/zinc/61/97/50/609619750.db2.gz SWFVDZYULCSOCM-JTQLQIEISA-N -1 3 360.776 3.506 20 0 FHADHM C[C@@H](C(=O)OCc1ccc(Cl)cc1-c1nnn[n-]1)c1cccc(F)c1 ZINC000824052942 609619765 /nfs/dbraw/zinc/61/97/65/609619765.db2.gz SWFVDZYULCSOCM-SNVBAGLBSA-N -1 3 360.776 3.506 20 0 FHADHM C[C@@H](C(=O)OCc1ccc(Cl)cc1-c1nn[n-]n1)c1cccc(F)c1 ZINC000824052942 609619766 /nfs/dbraw/zinc/61/97/66/609619766.db2.gz SWFVDZYULCSOCM-SNVBAGLBSA-N -1 3 360.776 3.506 20 0 FHADHM Cc1c(C(=O)[O-])cnn1C1CCN([C@@H]2CCc3c2cccc3Cl)CC1 ZINC000582128082 936318197 /nfs/dbraw/zinc/31/81/97/936318197.db2.gz WJNCJXMBVZJDCN-GOSISDBHSA-N -1 3 359.857 3.868 20 0 FHADHM O=C(Nc1ccc(Cl)cc1[O-])C1CCC(OC[C@@H]2CCCO2)CC1 ZINC000582980035 936340598 /nfs/dbraw/zinc/34/05/98/936340598.db2.gz SYKBGIVEOUQNSE-ZALBZXLWSA-N -1 3 353.846 3.739 20 0 FHADHM COc1ccc(Br)cc1-c1noc(-c2cc(Cl)n[n-]2)n1 ZINC001213500868 927286007 /nfs/dbraw/zinc/28/60/07/927286007.db2.gz SPGLOICNHPOEDS-UHFFFAOYSA-N -1 3 355.579 3.551 20 0 FHADHM C[C@H]([N-]S(=O)(=O)c1cc(Cl)ccc1C(F)(F)F)[C@H]1CCCCO1 ZINC000510045816 927381070 /nfs/dbraw/zinc/38/10/70/927381070.db2.gz VWBISSMVAVYEMV-JOYOIKCWSA-N -1 3 371.808 3.595 20 0 FHADHM Cc1nc(C)c(CCC(=O)NC2(c3ccc(Cl)cc3)CCCC2)c(=O)[n-]1 ZINC000155775291 927411081 /nfs/dbraw/zinc/41/10/81/927411081.db2.gz XHCISBGNLIQPBT-UHFFFAOYSA-N -1 3 373.884 3.558 20 0 FHADHM O=S(=O)([N-]Cc1cccc(-c2ccccn2)c1)c1ccc(F)cc1F ZINC000124149850 927586935 /nfs/dbraw/zinc/58/69/35/927586935.db2.gz SSEQAUKSJZJHSM-UHFFFAOYSA-N -1 3 360.385 3.505 20 0 FHADHM O=C(NCc1ncccc1[O-])Nc1cc(Cl)ccc1N1CCCCC1 ZINC000471128200 927622477 /nfs/dbraw/zinc/62/24/77/927622477.db2.gz AVCSKYUUUFSPOY-UHFFFAOYSA-N -1 3 360.845 3.753 20 0 FHADHM CCCc1nnc([N-]C(=O)c2cnc(-c3ccc(OC)cc3)s2)s1 ZINC000079691627 937186823 /nfs/dbraw/zinc/18/68/23/937186823.db2.gz WAULBAWQUKWPIO-UHFFFAOYSA-N -1 3 360.464 3.875 20 0 FHADHM Cc1c([N-]S(=O)(=O)c2ccc3c(c2)CCO3)cccc1C(F)(F)F ZINC000471135600 927733187 /nfs/dbraw/zinc/73/31/87/927733187.db2.gz COTDKPSWPMUFIC-UHFFFAOYSA-N -1 3 357.353 3.750 20 0 FHADHM COc1ccc([C@@H](CC(=O)[O-])NCc2ccc(OCC3CC3)cc2)cc1 ZINC000683171788 927739199 /nfs/dbraw/zinc/73/91/99/927739199.db2.gz OZGKTDOZGCBQFX-HXUWFJFHSA-N -1 3 355.434 3.790 20 0 FHADHM COc1ccc([C@H](CC(=O)[O-])NCc2cccc(OC(F)(F)F)c2)cc1 ZINC000683171823 927740927 /nfs/dbraw/zinc/74/09/27/927740927.db2.gz QEBUGZCUKDBPOA-INIZCTEOSA-N -1 3 369.339 3.899 20 0 FHADHM COc1ccc([C@@H](CC(=O)[O-])NCc2ccc(OC(C)C)c(OC)c2)cc1 ZINC000683171188 927746676 /nfs/dbraw/zinc/74/66/76/927746676.db2.gz GFWZDOVVUQDWGI-GOSISDBHSA-N -1 3 373.449 3.797 20 0 FHADHM COc1ccc([C@@H](CC(=O)[O-])NCc2cccc(OC(F)F)c2)cc1 ZINC000683172189 927750716 /nfs/dbraw/zinc/75/07/16/927750716.db2.gz VTAUYLOUBDMNIK-MRXNPFEDSA-N -1 3 351.349 3.602 20 0 FHADHM COc1ccc([C@@H](CC(=O)[O-])NCc2ccc(OC(F)(F)F)cc2)cc1 ZINC000683172405 927755861 /nfs/dbraw/zinc/75/58/61/927755861.db2.gz YUYSOPYZBRMJRJ-MRXNPFEDSA-N -1 3 369.339 3.899 20 0 FHADHM CC[C@@H](C)Oc1cc(CN[C@@H](C(=O)[O-])c2cccc(F)c2)ccc1OC ZINC000683172829 927756825 /nfs/dbraw/zinc/75/68/25/927756825.db2.gz DVJYJFZNSMZADG-BFUOFWGJSA-N -1 3 361.413 3.927 20 0 FHADHM O=C([N-]NC(=O)c1ccc(OCC2CCCCC2)cc1)c1ccccc1F ZINC000064679141 927966905 /nfs/dbraw/zinc/96/69/05/927966905.db2.gz POBWXXURUBBGTD-UHFFFAOYSA-N -1 3 370.424 3.860 20 0 FHADHM O=C(NCc1ncccc1[O-])Nc1cccc(COc2cccc(F)c2)c1 ZINC000471179877 928630853 /nfs/dbraw/zinc/63/08/53/928630853.db2.gz WOMZGHREUQQHDC-UHFFFAOYSA-N -1 3 367.380 3.827 20 0 FHADHM Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)N[C@H](C)C1CCC(F)(F)CC1 ZINC000655343900 928739997 /nfs/dbraw/zinc/73/99/97/928739997.db2.gz ZBGSQYAXQKYMGE-SNVBAGLBSA-N -1 3 355.429 3.732 20 0 FHADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)c3ccc(F)c(Cl)c3)cc2)n1 ZINC000154961093 937274059 /nfs/dbraw/zinc/27/40/59/937274059.db2.gz DCIXNVRKSSDNDC-UHFFFAOYSA-N -1 3 357.772 3.790 20 0 FHADHM COc1ccc(CN(C)C)cc1[N-]S(=O)(=O)c1ccc(C(C)C)cc1 ZINC000547713176 928811089 /nfs/dbraw/zinc/81/10/89/928811089.db2.gz ZYFIQIMBCLHYEH-UHFFFAOYSA-N -1 3 362.495 3.681 20 0 FHADHM CC[C@H]([N-]S(=O)(=O)c1cc(C)c(Cl)s1)c1nc(C)cs1 ZINC000187849628 928910772 /nfs/dbraw/zinc/91/07/72/928910772.db2.gz ZFGHRALMRXMYIK-VIFPVBQESA-N -1 3 350.918 3.904 20 0 FHADHM Cc1n[nH]c(C(C)C)c1C(=O)Nc1cc(C)cc(Br)c1[O-] ZINC000182906112 929291840 /nfs/dbraw/zinc/29/18/40/929291840.db2.gz BJWVODUXTXWJAT-UHFFFAOYSA-N -1 3 352.232 3.870 20 0 FHADHM COc1c(C)cc(S(=O)(=O)[N-]c2cncc(Cl)c2Cl)cc1C ZINC000180287365 929444742 /nfs/dbraw/zinc/44/47/42/929444742.db2.gz FFJWHWOVOLOSNL-UHFFFAOYSA-N -1 3 361.250 3.815 20 0 FHADHM Cc1c(C(=O)Nc2ccc(-c3nnn[n-]3)cc2)sc2cccc(F)c12 ZINC000123622626 929544411 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C/C=C/C=C/C(=O)Nc1ccc([N-]S(=O)(=O)c2ccc(C)cc2)cc1 ZINC000046462726 930305283 /nfs/dbraw/zinc/30/52/83/930305283.db2.gz XIJCYRLSIWMMNK-VNKDHWASSA-N -1 3 356.447 3.867 20 0 FHADHM CCOC(=O)c1cc2cc(OC)c(N)cc2n1-c1cccc([O-])c1Cl ZINC001210854876 930409625 /nfs/dbraw/zinc/40/96/25/930409625.db2.gz MNPOJUYNDRUEQV-UHFFFAOYSA-N -1 3 360.797 3.757 20 0 FHADHM CC(=O)N1CCC(Cn2ncc(C)c2Nc2cccc([O-])c2Cl)CC1 ZINC001210855458 930411463 /nfs/dbraw/zinc/41/14/63/930411463.db2.gz OJSROUITXSLICA-UHFFFAOYSA-N -1 3 362.861 3.553 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N2CCC[C@](C)(c3ccccc3)CC2)c1 ZINC000580322996 930500436 /nfs/dbraw/zinc/50/04/36/930500436.db2.gz YDMKIOLXAVXYCI-QFIPXVFZSA-N -1 3 366.461 3.935 20 0 FHADHM Cc1cc(=O)[n-]c(C(C)(C)NC(=O)c2cc3c(s2)CCCCCC3)n1 ZINC000622739095 930521393 /nfs/dbraw/zinc/52/13/93/930521393.db2.gz UFWYSTDGFLQBNE-UHFFFAOYSA-N -1 3 359.495 3.876 20 0 FHADHM CCOC(=O)c1cc(F)c(F)cc1[N-]C(=O)c1c(C)noc1C(F)F ZINC000610431643 930528730 /nfs/dbraw/zinc/52/87/30/930528730.db2.gz 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931893530 /nfs/dbraw/zinc/89/35/30/931893530.db2.gz VBMOYSARNOJSKP-UHFFFAOYSA-N -1 3 350.422 3.867 20 0 FHADHM O=C(NCc1ncccc1[O-])Nc1ccc(C(F)(F)C(F)(F)F)cc1 ZINC000684227579 931984232 /nfs/dbraw/zinc/98/42/32/931984232.db2.gz BTJVAPCAKUZWSU-UHFFFAOYSA-N -1 3 361.270 3.763 20 0 FHADHM CCc1cnc(CN[C@H](CCc2ccc(C(F)(F)F)cc2)C(=O)[O-])s1 ZINC000656569970 932107025 /nfs/dbraw/zinc/10/70/25/932107025.db2.gz UTNRZZBVNMZSSB-CQSZACIVSA-N -1 3 372.412 3.900 20 0 FHADHM Cc1cnn(C)c1CN[C@H](c1cc(Cl)cc(Cl)c1)C(C)(C)C(=O)[O-] ZINC000656570252 932107062 /nfs/dbraw/zinc/10/70/62/932107062.db2.gz VRSXIUVRHVSZHK-OAHLLOKOSA-N -1 3 370.280 3.977 20 0 FHADHM O=C([O-])[C@@H]1CN(Cc2ncc(-c3cccs3)o2)C[C@H]1c1ccccc1 ZINC000581488806 932160638 /nfs/dbraw/zinc/16/06/38/932160638.db2.gz ZLOKZMZMOUMTQE-LSDHHAIUSA-N -1 3 354.431 3.703 20 0 FHADHM CC(C)(C)[S@@](=O)Cc1cccc(NC(=O)c2[n-]cnc2C(F)(F)F)c1 ZINC000827981581 932267305 /nfs/dbraw/zinc/26/73/05/932267305.db2.gz XMHLXTXUCUPYBJ-VWLOTQADSA-N -1 3 373.400 3.728 20 0 FHADHM CC(C)(C)[S@@](=O)Cc1cccc(NC(=O)c2nc[n-]c2C(F)(F)F)c1 ZINC000827981581 932267307 /nfs/dbraw/zinc/26/73/07/932267307.db2.gz XMHLXTXUCUPYBJ-VWLOTQADSA-N -1 3 373.400 3.728 20 0 FHADHM CC[C@@H](OCCN1C[C@H](C(=O)[O-])C[C@H](C(F)(F)F)C1)c1ccccc1 ZINC000656758459 932392456 /nfs/dbraw/zinc/39/24/56/932392456.db2.gz ZIZJNRDSXKUTPA-OWCLPIDISA-N -1 3 359.388 3.739 20 0 FHADHM Cc1ccccc1-c1noc(CN2CC[C@H](C(=O)[O-])[C@@H]3CCCC[C@H]32)n1 ZINC000656762650 932398276 /nfs/dbraw/zinc/39/82/76/932398276.db2.gz BIGOTYJXFMEYDQ-YESZJQIVSA-N -1 3 355.438 3.510 20 0 FHADHM Cc1ccc(-c2noc(CN3CC[C@H](C(=O)[O-])[C@@H]4CCCC[C@H]43)n2)cc1 ZINC000656765219 932401500 /nfs/dbraw/zinc/40/15/00/932401500.db2.gz MMVAFKYJTVBDFY-YESZJQIVSA-N -1 3 355.438 3.510 20 0 FHADHM COc1ccc2ncc(C(=O)[O-])c(N3CCC([C@@H]4CCCCO4)CC3)c2c1 ZINC000656787249 932426075 /nfs/dbraw/zinc/42/60/75/932426075.db2.gz VIKXNQLHIFAYSM-IBGZPJMESA-N -1 3 370.449 3.727 20 0 FHADHM Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)NCc1ncccc1[O-] ZINC000471741385 932761730 /nfs/dbraw/zinc/76/17/30/932761730.db2.gz QMRWGOSMPDAMCI-CYBMUJFWSA-N -1 3 368.462 3.780 20 0 FHADHM CCC(CC)c1cc(C[N-]S(=O)(=O)Cc2cc(F)ccc2Cl)on1 ZINC000656918662 932790434 /nfs/dbraw/zinc/79/04/34/932790434.db2.gz PJYBBJMMBWKPCE-UHFFFAOYSA-N -1 3 374.865 3.990 20 0 FHADHM Cc1noc(C)c1CCC[N-]S(=O)(=O)c1c(Cl)cccc1Cl ZINC000084951485 933028703 /nfs/dbraw/zinc/02/87/03/933028703.db2.gz BEYAPXSBAILGAB-UHFFFAOYSA-N -1 3 363.266 3.509 20 0 FHADHM Cc1nc(CCCC(=O)Nc2cc(Br)ccc2[O-])cs1 ZINC000085586808 933062282 /nfs/dbraw/zinc/06/22/82/933062282.db2.gz RDKYFAXEYGCAGG-UHFFFAOYSA-N -1 3 355.257 3.881 20 0 FHADHM Cc1noc(C)c1C(=O)[N-]c1nnc(C23CC4CC(CC(C4)C2)C3)s1 ZINC000036801178 933130356 /nfs/dbraw/zinc/13/03/56/933130356.db2.gz DOTPPLPSKJBLJB-UHFFFAOYSA-N -1 3 358.467 3.863 20 0 FHADHM COc1cc2c(cc1F)CC[C@H]2[N-]S(=O)(=O)c1ccccc1SC ZINC000510567011 933234788 /nfs/dbraw/zinc/23/47/88/933234788.db2.gz XWCYYDORICLNJH-CQSZACIVSA-N -1 3 367.467 3.522 20 0 FHADHM COCC[C@@H]([N-]S(=O)(=O)c1ccc(F)cc1C(F)(F)F)C(C)(C)C ZINC000510586203 933249176 /nfs/dbraw/zinc/24/91/76/933249176.db2.gz AXIOZYREWXFAAF-CYBMUJFWSA-N -1 3 371.396 3.574 20 0 FHADHM COCC[C@H]([N-]S(=O)(=O)c1cccc(Cl)c1Cl)C(C)(C)C ZINC000510637030 933339264 /nfs/dbraw/zinc/33/92/64/933339264.db2.gz HWYPTOWHPADJNW-LBPRGKRZSA-N -1 3 354.299 3.723 20 0 FHADHM CCS[C@H]1CC[C@H](N(C)C(=O)c2c[n-]c3cc(F)c(F)cc3c2=O)C1 ZINC000933801330 933549128 /nfs/dbraw/zinc/54/91/28/933549128.db2.gz LYOGUDBRBLJGDU-QWRGUYRKSA-N -1 3 366.433 3.553 20 0 FHADHM Cc1ccsc1[C@H](Cc1ccccc1)NC(=O)NCc1ncccc1[O-] ZINC000471914236 933698753 /nfs/dbraw/zinc/69/87/53/933698753.db2.gz GFECZVRSAYWZBX-INIZCTEOSA-N -1 3 367.474 3.940 20 0 FHADHM Cc1nc(-c2ccc(S(=O)(=O)[N-]c3cc(F)cc(F)c3F)cc2)co1 ZINC000431144686 933923661 /nfs/dbraw/zinc/92/36/61/933923661.db2.gz TUNGYFUJWWOSSY-UHFFFAOYSA-N -1 3 368.336 3.868 20 0 FHADHM Cc1nc2ccc(S(=O)(=O)[N-]c3cc(F)cc(F)c3F)cc2s1 ZINC000431145801 933934636 /nfs/dbraw/zinc/93/46/36/933934636.db2.gz IJFQABRSGQBBOQ-UHFFFAOYSA-N -1 3 358.366 3.823 20 0 FHADHM Cc1nc(C)c(Cc2nc(Cc3cc(Cl)ccc3Cl)no2)c(=O)[n-]1 ZINC000544984646 934006658 /nfs/dbraw/zinc/00/66/58/934006658.db2.gz PIBLMDPVWMOWNX-UHFFFAOYSA-N -1 3 365.220 3.670 20 0 FHADHM CC[C@@H]1[C@H](C)CCN1C(=O)c1cc(=O)c2cc(Br)ccc2[n-]1 ZINC000548475523 934071060 /nfs/dbraw/zinc/07/10/60/934071060.db2.gz QLADPTCCEYQKFG-MEBBXXQBSA-N -1 3 363.255 3.551 20 0 FHADHM Cc1ccc([C@H](C)[C@H](O)C(=O)Nc2ccc(Br)cc2[O-])cc1 ZINC000535727490 934314269 /nfs/dbraw/zinc/31/42/69/934314269.db2.gz YTFPTFBRFSGEHK-ZBEGNZNMSA-N -1 3 364.239 3.566 20 0 FHADHM Cc1nc(-c2ccncc2)[n-]c(=O)c1CCC(=O)N[C@H]1CCC[C@H](C)CC1 ZINC000277010528 934453223 /nfs/dbraw/zinc/45/32/23/934453223.db2.gz AUCFATDDHKNEKE-YOEHRIQHSA-N -1 3 368.481 3.570 20 0 FHADHM Cc1nc(CCNCc2cc(C(F)(F)F)ccc2F)sc1C(=O)[O-] ZINC000277029002 934459431 /nfs/dbraw/zinc/45/94/31/934459431.db2.gz PLBLAKUNHLAZHM-UHFFFAOYSA-N -1 3 362.348 3.640 20 0 FHADHM Cc1nc(CCCNCc2nc(-c3ccccc3)cs2)sc1C(=O)[O-] ZINC000277040145 934463455 /nfs/dbraw/zinc/46/34/55/934463455.db2.gz QUMPUQLAZVSBLH-UHFFFAOYSA-N -1 3 373.503 3.996 20 0 FHADHM C[C@]1(CC[N-]S(=O)(=O)c2cc(C(F)(F)F)ccc2F)CC1(F)F ZINC000657161082 934559625 /nfs/dbraw/zinc/55/96/25/934559625.db2.gz XLLCHPVTKZHKEC-NSHDSACASA-N -1 3 361.307 3.558 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)CCCC[C@@H](C)C(C)=O)c2)n1 ZINC000151073856 934748800 /nfs/dbraw/zinc/74/88/00/934748800.db2.gz QHPDYXDTXQZVIK-CQSZACIVSA-N -1 3 369.465 3.723 20 0 FHADHM CCc1nnc([C@@H](C)Sc2nnc([N-]c3ccccc3F)s2)[nH]1 ZINC000657227662 934789168 /nfs/dbraw/zinc/78/91/68/934789168.db2.gz HSYXBLYBPMASIL-MRVPVSSYSA-N -1 3 350.448 3.955 20 0 FHADHM COc1cccc(S(=O)(=O)[N-]c2c3c(ccc2Cl)CC(C)(C)O3)c1 ZINC000684653515 934827432 /nfs/dbraw/zinc/82/74/32/934827432.db2.gz RTOCVQZTTPXEKG-UHFFFAOYSA-N -1 3 367.854 3.863 20 0 FHADHM CC(C)=CCC[C@@H](C)CC(=O)N1CCC[C@@H](C[N-]C(=O)C(F)(F)F)C1 ZINC000843598036 934855561 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CN(C)c1cccc(CCC(=O)Nc2cc(Br)ccc2[O-])c1 ZINC000472442008 940151965 /nfs/dbraw/zinc/15/19/65/940151965.db2.gz GCSUVKAMJBZDPN-UHFFFAOYSA-N -1 3 363.255 3.792 20 0 FHADHM CC(C)c1ccc(C(=O)N[C@@H](C)c2ccc(N3CCOC3=O)cc2)c([O-])c1 ZINC000065992519 940161853 /nfs/dbraw/zinc/16/18/53/940161853.db2.gz WDLAGWWHYZRHQS-AWEZNQCLSA-N -1 3 368.433 3.963 20 0 FHADHM O=C(OCc1coc(-c2ccc(F)c(F)c2)n1)c1cc(-c2ccco2)[n-]n1 ZINC000728619755 940174649 /nfs/dbraw/zinc/17/46/49/940174649.db2.gz RGVVJLNHXVLOGH-UHFFFAOYSA-N -1 3 371.299 3.960 20 0 FHADHM O=C(OCc1coc(-c2ccc(F)c(F)c2)n1)c1cc(-c2ccco2)n[n-]1 ZINC000728619755 940174650 /nfs/dbraw/zinc/17/46/50/940174650.db2.gz RGVVJLNHXVLOGH-UHFFFAOYSA-N -1 3 371.299 3.960 20 0 FHADHM COc1ccc(N[C@H]2CCCCc3ccccc32)cc1[N-]S(C)(=O)=O ZINC000177419592 940188012 /nfs/dbraw/zinc/18/80/12/940188012.db2.gz YALLADJZUGHYQZ-KRWDZBQOSA-N -1 3 360.479 3.946 20 0 FHADHM Cc1cc(=O)[n-]c(C(C)(C)NC(=O)[C@@H](C)Sc2ccccc2Cl)n1 ZINC000636112751 940258400 /nfs/dbraw/zinc/25/84/00/940258400.db2.gz ADIJXOSIEWAPTK-LLVKDONJSA-N -1 3 365.886 3.676 20 0 FHADHM O=C([N-]c1nc2ccccn2n1)c1sc2ccccc2c1Br ZINC000685807298 940282854 /nfs/dbraw/zinc/28/28/54/940282854.db2.gz RJJBGIJZYNKGGH-UHFFFAOYSA-N -1 3 373.235 3.959 20 0 FHADHM CCOc1ccc([N-]S(=O)(=O)c2cc(NC(=O)CC)ccc2C)cc1 ZINC000015898535 940298631 /nfs/dbraw/zinc/29/86/31/940298631.db2.gz XDSVKYUDPMUNLN-UHFFFAOYSA-N -1 3 362.451 3.543 20 0 FHADHM Cc1cc(=O)[n-]c([C@@H](C)N2CCN([C@@H](C)c3ccc(Cl)cc3)CC2)n1 ZINC000570474872 940326973 /nfs/dbraw/zinc/32/69/73/940326973.db2.gz KHZVVXDNEYTGKL-LSDHHAIUSA-N -1 3 360.889 3.584 20 0 FHADHM O=C(C=CCc1ccccc1F)N=c1cc2ccc(Br)cn2[n-]1 ZINC000511401506 940364777 /nfs/dbraw/zinc/36/47/77/940364777.db2.gz YVHCBLXUGOOTPO-HYXAFXHYSA-N -1 3 374.213 3.700 20 0 FHADHM CCc1noc(C)c1[N-]C(=O)c1nn(C(C)(C)C)cc1Br ZINC000612985920 940373417 /nfs/dbraw/zinc/37/34/17/940373417.db2.gz XUEGNRDSJBNGJU-UHFFFAOYSA-N -1 3 355.236 3.512 20 0 FHADHM O=C(Cc1csc2ccc(Br)cc12)Nc1ncccc1[O-] ZINC000472506386 940451901 /nfs/dbraw/zinc/45/19/01/940451901.db2.gz VOCOLPGALWQWHV-UHFFFAOYSA-N -1 3 363.236 3.946 20 0 FHADHM COC(=O)c1c(F)cccc1S(=O)(=O)[N-]c1c(C)cc(C)cc1Cl ZINC000613112111 940455748 /nfs/dbraw/zinc/45/57/48/940455748.db2.gz NSWAJJDKVLNVAP-UHFFFAOYSA-N -1 3 371.817 3.683 20 0 FHADHM O=S(=O)([N-][C@@H](c1ccccc1)C(F)(F)F)c1cnc2ccccc2c1 ZINC000548992808 940457285 /nfs/dbraw/zinc/45/72/85/940457285.db2.gz OWAKVXRAFONPFQ-INIZCTEOSA-N -1 3 366.364 3.817 20 0 FHADHM Cc1cccc([C@]2(F)CCN(C(=O)c3cc(=O)c4ccccc4[n-]3)C2)c1 ZINC000376222400 940485700 /nfs/dbraw/zinc/48/57/00/940485700.db2.gz YMFYXAVHHPODDA-NRFANRHFSA-N -1 3 350.393 3.547 20 0 FHADHM Cc1cc(Br)sc1S(=O)(=O)[N-]C[C@H]1CCC[C@@H]1C ZINC001211639213 940492674 /nfs/dbraw/zinc/49/26/74/940492674.db2.gz YMGVYQCAPQQTGQ-WCBMZHEXSA-N -1 3 352.319 3.534 20 0 FHADHM O=C(N[C@H]1C[C@H](c2ccc(F)c(Cl)c2)C1)c1cc(=O)c2ccccc2[n-]1 ZINC000376235090 940501191 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JOICMYFBPOEIIW-QMMMGPOBSA-N -1 3 351.280 3.532 20 0 FHADHM Cc1cc(C(F)(F)F)cc(C)c1NC(=O)c1cc(=O)[n-]c(C2CC2)n1 ZINC000636437005 941064578 /nfs/dbraw/zinc/06/45/78/941064578.db2.gz YYSRRMWBJDWPCO-UHFFFAOYSA-N -1 3 351.328 3.948 20 0 FHADHM O=C(CCSc1ccccc1Br)[N-]OCCC(F)(F)F ZINC000162953528 941064730 /nfs/dbraw/zinc/06/47/30/941064730.db2.gz HOYKNHAIOQBNDY-UHFFFAOYSA-N -1 3 372.206 3.932 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2ccc(OC)c(SC)c2)cc1C ZINC000414388243 941081105 /nfs/dbraw/zinc/08/11/05/941081105.db2.gz KYJXWTUKRAZVKO-UHFFFAOYSA-N -1 3 353.465 3.535 20 0 FHADHM CCc1nc([C@H]2CCCCN2C(=O)c2cc([O-])cc(C(F)(F)F)c2)no1 ZINC000623019054 941160604 /nfs/dbraw/zinc/16/06/04/941160604.db2.gz FNZUJFIYUJQSFN-CYBMUJFWSA-N -1 3 369.343 3.724 20 0 FHADHM O=C(Cc1ccccc1O)N=c1cc(-c2cc(Cl)cc(Cl)c2)[n-][nH]1 ZINC000589167371 941234062 /nfs/dbraw/zinc/23/40/62/941234062.db2.gz WDMKZPCBINQDRX-UHFFFAOYSA-N -1 3 362.216 3.692 20 0 FHADHM Cc1oncc1C(=O)Nc1ccc([O-])c(C(=O)N(C)[C@H]2CCCC[C@H]2C)c1 ZINC000179416702 941344496 /nfs/dbraw/zinc/34/44/96/941344496.db2.gz JRTBYPDXOUUBRU-PXAZEXFGSA-N -1 3 371.437 3.592 20 0 FHADHM Cc1noc(-c2ccccc2C(=O)Nc2cc(Br)ccc2[O-])n1 ZINC000179653645 941348902 /nfs/dbraw/zinc/34/89/02/941348902.db2.gz CZBZYZKKHJYPTF-UHFFFAOYSA-N -1 3 374.194 3.765 20 0 FHADHM COc1cc(OC)cc(-c2noc(C=C([O-])c3ccccc3Cl)n2)c1 ZINC001211647553 941357557 /nfs/dbraw/zinc/35/75/57/941357557.db2.gz VJIZACFJPBBQHE-UHFFFAOYSA-N -1 3 358.781 3.833 20 0 FHADHM Cc1c(Cl)cccc1NC(=O)[C@H]1CCCN1C(=O)c1ccccc1[O-] ZINC000181765748 941382637 /nfs/dbraw/zinc/38/26/37/941382637.db2.gz FGCVKWWDEKAOMG-MRXNPFEDSA-N -1 3 358.825 3.597 20 0 FHADHM O=C(c1cc([O-])c2ccccc2c1)N1CCSC[C@H]1c1nccs1 ZINC000376728474 941386819 /nfs/dbraw/zinc/38/68/19/941386819.db2.gz KRKSKWLHPJETAZ-HNNXBMFYSA-N -1 3 356.472 3.932 20 0 FHADHM O=C([O-])[C@@H]1CN(Cc2noc3c2CCCC3)C[C@H]1c1ccc(Cl)cc1 ZINC000659796971 941401380 /nfs/dbraw/zinc/40/13/80/941401380.db2.gz FQCANFMBSMQBMD-JKSUJKDBSA-N -1 3 360.841 3.507 20 0 FHADHM O=C([O-])[C@]12CN(Cc3csc(Nc4ccccc4)n3)C[C@H]1CCCC2 ZINC000659799469 941403729 /nfs/dbraw/zinc/40/37/29/941403729.db2.gz HROHELORMLWNNZ-AUUYWEPGSA-N -1 3 357.479 3.964 20 0 FHADHM O=C(C[C@@H](NC(=O)c1ccc([O-])cc1)c1ccccc1)NCc1ccccc1 ZINC000182874190 941465883 /nfs/dbraw/zinc/46/58/83/941465883.db2.gz SFOZVCNUNLRVLS-OAQYLSRUSA-N -1 3 374.440 3.570 20 0 FHADHM CCC(CC)NC(=O)C[C@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000182897091 941471754 /nfs/dbraw/zinc/47/17/54/941471754.db2.gz WHJDQBKZXBUFFC-IBGZPJMESA-N -1 3 354.450 3.558 20 0 FHADHM CN(C(=O)C[C@@H](NC(=O)c1ccc([O-])cc1)c1ccccc1)C1CCCC1 ZINC000182919813 941475295 /nfs/dbraw/zinc/47/52/95/941475295.db2.gz IKHUSVULOSSPOY-HXUWFJFHSA-N -1 3 366.461 3.654 20 0 FHADHM CS(=O)(=O)[N-]c1ccccc1NC(=O)c1cc(F)c2ccccc2c1 ZINC000549172388 941584875 /nfs/dbraw/zinc/58/48/75/941584875.db2.gz ZGDGHMXQYGHAEG-UHFFFAOYSA-N -1 3 358.394 3.603 20 0 FHADHM O=C(Cc1ccccc1F)N[N-]C(=O)c1sccc1-c1ccc(F)cc1 ZINC000066784676 941634399 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COc1ccc(-c2nc(CN3C[C@@H]4CCC[C@@]4(C(=O)[O-])C3)cs2)cc1 ZINC000262114891 941852248 /nfs/dbraw/zinc/85/22/48/941852248.db2.gz JBVPSZICGXOKKB-IFXJQAMLSA-N -1 3 358.463 3.505 20 0 FHADHM CC(C)[C@H](C[N-]S(=O)(=O)c1cccc(Cl)c1F)c1cccnc1 ZINC000433745021 941861734 /nfs/dbraw/zinc/86/17/34/941861734.db2.gz BNLQWHMDEYDAAJ-ZDUSSCGKSA-N -1 3 356.850 3.592 20 0 FHADHM O=C(NCc1ncccc1[O-])Nc1cccc(Br)c1Cl ZINC000549369592 942067714 /nfs/dbraw/zinc/06/77/14/942067714.db2.gz HXGAHVHRWAHRKZ-UHFFFAOYSA-N -1 3 356.607 3.525 20 0 FHADHM CC(C)(CNC(=O)c1c[n-]c2c(F)cc(F)cc2c1=O)CC(F)(F)F ZINC001167725179 942164800 /nfs/dbraw/zinc/16/48/00/942164800.db2.gz CSPRTWFWUGMDGH-UHFFFAOYSA-N -1 3 362.298 3.515 20 0 FHADHM Cc1cc(S(=O)(=O)[N-]C[C@@H]2CC23CCSCC3)sc1Cl ZINC000420711021 942170508 /nfs/dbraw/zinc/17/05/08/942170508.db2.gz WXJVNPROUSFYPO-JTQLQIEISA-N -1 3 351.946 3.522 20 0 FHADHM CCCc1nc([C@H](NC(=O)c2cc([O-])ccc2Cl)c2ccccc2)no1 ZINC000378023008 942175640 /nfs/dbraw/zinc/17/56/40/942175640.db2.gz DAVMRABKQFRNOB-QGZVFWFLSA-N -1 3 371.824 3.901 20 0 FHADHM Cc1cc(S(=O)(=O)[N-]C2CCC3(CC3)CC2)sc1Br ZINC000710170930 942213295 /nfs/dbraw/zinc/21/32/95/942213295.db2.gz CDOVQLVMQVBLCU-UHFFFAOYSA-N -1 3 364.330 3.820 20 0 FHADHM O=c1cc(CSCc2nccn2Cc2ccccc2)nc(C2CC2)[n-]1 ZINC000419412927 942259293 /nfs/dbraw/zinc/25/92/93/942259293.db2.gz DXQZZJBWDSDVJD-UHFFFAOYSA-N -1 3 352.463 3.738 20 0 FHADHM Cc1ccc([C@H](C)NC(=O)CSCc2cc(=O)[n-]c(C3CC3)n2)cc1C ZINC000419600657 942327907 /nfs/dbraw/zinc/32/79/07/942327907.db2.gz HRLCXJDONZURGW-AWEZNQCLSA-N -1 3 371.506 3.787 20 0 FHADHM COc1cccc(SC)c1[N-]C(=O)c1csc([C@@H]2CCCO2)n1 ZINC000416118109 942370198 /nfs/dbraw/zinc/37/01/98/942370198.db2.gz ABRLZMLHBHRXNM-LBPRGKRZSA-N -1 3 350.465 3.977 20 0 FHADHM CC[C@@H](CS(=O)(=O)[N-]c1ccc(Oc2nc(C)cs2)c(F)c1)OC ZINC000421162796 942379290 /nfs/dbraw/zinc/37/92/90/942379290.db2.gz GJJXCTKNWAVGNP-LBPRGKRZSA-N -1 3 374.459 3.550 20 0 FHADHM CC(C)C[C@@H](C(=O)N1CCCc2c(=O)[n-]cnc21)c1ccc(Cl)cc1 ZINC000893205597 942599422 /nfs/dbraw/zinc/59/94/22/942599422.db2.gz QOQJKWLMVZHZST-MRXNPFEDSA-N -1 3 359.857 3.945 20 0 FHADHM O=C(CCCc1cccc(C(F)(F)F)c1)N1CCCc2c(=O)[n-]cnc21 ZINC000893207306 942605283 /nfs/dbraw/zinc/60/52/83/942605283.db2.gz OCFMCADMSNDWFN-UHFFFAOYSA-N -1 3 365.355 3.503 20 0 FHADHM O=C(N1CCCc2c(=O)[n-]cnc21)C1(Cc2cccc(Cl)c2)CCCC1 ZINC000893216488 942670883 /nfs/dbraw/zinc/67/08/83/942670883.db2.gz SWPIZVSZKAMNRU-UHFFFAOYSA-N -1 3 371.868 3.918 20 0 FHADHM C[C@H](CC(=O)N1CCCc2c(=O)[n-]cnc21)c1ccccc1C(F)(F)F ZINC000893216272 942679615 /nfs/dbraw/zinc/67/96/15/942679615.db2.gz POKVNZVDLUGPES-LLVKDONJSA-N -1 3 365.355 3.674 20 0 FHADHM CCOc1ccc(S(=O)(=O)[N-]c2cccc(-c3cc[nH]n3)c2)c(C)c1 ZINC000501801015 942683247 /nfs/dbraw/zinc/68/32/47/942683247.db2.gz UTBYCQDDMJJEKB-UHFFFAOYSA-N -1 3 357.435 3.585 20 0 FHADHM CCC(CC)c1nnc([N-]C(=O)c2c(C)nn3c2nc(C)cc3C)s1 ZINC000514065790 942727621 /nfs/dbraw/zinc/72/76/21/942727621.db2.gz DJKFTTUJFHTJIQ-UHFFFAOYSA-N -1 3 358.471 3.662 20 0 FHADHM CCC[C@@H](C(=O)N=c1[n-]n(CC(F)(F)F)cc1Br)C(C)C ZINC000421683166 942757753 /nfs/dbraw/zinc/75/77/53/942757753.db2.gz RPLCUKRCKQWBJP-SECBINFHSA-N -1 3 370.213 3.641 20 0 FHADHM CC(C)[C@H]1N(Cc2cccc([O-])c2Br)CC12CCOCC2 ZINC000414546979 942760204 /nfs/dbraw/zinc/76/02/04/942760204.db2.gz YWSSRKFPQCJYHJ-MRXNPFEDSA-N -1 3 354.288 3.792 20 0 FHADHM CC(C)c1csc2[n-]c(-c3ccc(S(C)(=O)=O)s3)nc(=O)c12 ZINC000416410623 942801086 /nfs/dbraw/zinc/80/10/86/942801086.db2.gz GMUVLDYRBMUSIA-UHFFFAOYSA-N -1 3 354.478 3.652 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H]3CCO[C@H](CC(C)C)C3)nc2)n1 ZINC000378479274 942809222 /nfs/dbraw/zinc/80/92/22/942809222.db2.gz WXRNXVXHQXHEMK-DLBZAZTESA-N -1 3 356.470 3.812 20 0 FHADHM O=C(N=c1cc(-c2ccncc2)[n-][nH]1)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl ZINC000502938896 942869123 /nfs/dbraw/zinc/86/91/23/942869123.db2.gz KOIKVFGGSMIKBQ-ZIAGYGMSSA-N -1 3 373.243 3.943 20 0 FHADHM C[C@@H](NC(=O)c1cc(F)cc2n[n-]nc21)c1ccc(-c2ccncc2)cc1 ZINC000502990480 942887144 /nfs/dbraw/zinc/88/71/44/942887144.db2.gz JZFXQFZSSULPMA-GFCCVEGCSA-N -1 3 361.380 3.650 20 0 FHADHM O=C(c1ccc(O)cc1[O-])N1CCC[C@H]1c1nc(-c2ccccc2F)c[nH]1 ZINC000378568594 942902344 /nfs/dbraw/zinc/90/23/44/942902344.db2.gz DYPYRTJWXXNCPN-KRWDZBQOSA-N -1 3 367.380 3.604 20 0 FHADHM COc1ccc(C(=O)N(C)[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)c([O-])c1 ZINC000273351326 942938185 /nfs/dbraw/zinc/93/81/85/942938185.db2.gz YRPCSRPKRWMSQO-HNAYVOBHSA-N -1 3 359.397 3.532 20 0 FHADHM COc1ccccc1NC(=O)Cc1noc(-c2ccc(C(C)C)cc2[O-])n1 ZINC000273378105 942944092 /nfs/dbraw/zinc/94/40/92/942944092.db2.gz FGVGZEXLOKRTFI-UHFFFAOYSA-N -1 3 367.405 3.755 20 0 FHADHM Cc1cccc([C@@H]2CCCCN2C(=O)c2nnc3ccccc3c2[O-])c1C ZINC000173517380 942976727 /nfs/dbraw/zinc/97/67/27/942976727.db2.gz QHDCGCVBRDUMIL-IBGZPJMESA-N -1 3 361.445 3.907 20 0 FHADHM O=C([O-])CCCCN1CCC[C@@H]1c1ccccc1I ZINC000378642083 942991620 /nfs/dbraw/zinc/99/16/20/942991620.db2.gz ZPMDABPVDQZXDS-CQSZACIVSA-N -1 3 373.234 3.683 20 0 FHADHM CCCc1noc2nc(CC)cc(C(=O)[N-]c3nnc(C(F)F)s3)c12 ZINC000503141932 942998385 /nfs/dbraw/zinc/99/83/85/942998385.db2.gz OLXQUEZFCIQFLC-UHFFFAOYSA-N -1 3 367.381 3.779 20 0 FHADHM Cc1ccc(S(=O)(=O)[N-][C@H](c2ccccc2)C2(CO)CCCCC2)o1 ZINC000416625260 943012146 /nfs/dbraw/zinc/01/21/46/943012146.db2.gz OVOUEHNUVFAUNH-GOSISDBHSA-N -1 3 363.479 3.550 20 0 FHADHM Cc1cnc([N-]S(=O)(=O)c2c(C)cc(C)cc2C)c(Br)c1 ZINC000513784431 943065505 /nfs/dbraw/zinc/06/55/05/943065505.db2.gz RBISNOFYEMHGPR-UHFFFAOYSA-N -1 3 369.284 3.879 20 0 FHADHM O=S(=O)([N-]c1c(O)cccc1Cl)c1ccc(OC(F)(F)F)cc1 ZINC000647919089 943075590 /nfs/dbraw/zinc/07/55/90/943075590.db2.gz LTEOXYPYCJENSF-UHFFFAOYSA-N -1 3 367.732 3.745 20 0 FHADHM COc1ccc(N[C@H]2CCCc3sccc32)cc1[N-]S(C)(=O)=O ZINC000272103206 943095096 /nfs/dbraw/zinc/09/50/96/943095096.db2.gz PBODDTNENQJLFS-ZDUSSCGKSA-N -1 3 352.481 3.618 20 0 FHADHM O=C(Nc1cccnc1)c1ccc(NC(=O)c2cc([O-])ccc2Cl)cc1 ZINC000431902509 943136474 /nfs/dbraw/zinc/13/64/74/943136474.db2.gz LTCZLCHVAVWXKL-UHFFFAOYSA-N -1 3 367.792 3.945 20 0 FHADHM O=C(NCc1ccc([O-])c(Br)c1)N(CCC1CC1)CC1CC1 ZINC000664471061 943192800 /nfs/dbraw/zinc/19/28/00/943192800.db2.gz LSDNOAWMKBUXRP-UHFFFAOYSA-N -1 3 367.287 3.876 20 0 FHADHM CC(C)[C@H]1C[C@H](CC(=O)NCc2ccc([O-])c(Br)c2)CCO1 ZINC000272848815 943232813 /nfs/dbraw/zinc/23/28/13/943232813.db2.gz QOAWXSQZPZVZKI-MLGOLLRUSA-N -1 3 370.287 3.612 20 0 FHADHM CCN(CC)C(=O)c1ccc(NCc2cc(=O)[n-]c(C3CC3)n2)cc1Cl ZINC000417012188 943295582 /nfs/dbraw/zinc/29/55/82/943295582.db2.gz WDAANGXQWNXMJZ-UHFFFAOYSA-N -1 3 374.872 3.807 20 0 FHADHM CCN(CCc1ccc(C(F)(F)F)cc1)C(=O)c1c([O-])cccc1O ZINC000425319068 943296281 /nfs/dbraw/zinc/29/62/81/943296281.db2.gz CMKHULSZBGZDPX-UHFFFAOYSA-N -1 3 353.340 3.821 20 0 FHADHM Cc1cc(NC(=O)c2cc(F)cc3n[n-]nc32)ccc1OCC(F)(F)F ZINC000503654717 943322972 /nfs/dbraw/zinc/32/29/72/943322972.db2.gz MUKKGPDBZQCTRQ-UHFFFAOYSA-N -1 3 368.290 3.599 20 0 FHADHM O=C(Nc1ccc2c(c1)ncn2-c1ccccc1)c1cc(F)cc2n[n-]nc21 ZINC000503721425 943353887 /nfs/dbraw/zinc/35/38/87/943353887.db2.gz KDEARFLSCNJCJL-UHFFFAOYSA-N -1 3 372.363 3.688 20 0 FHADHM O=C(N[C@@H]1CCCC[C@H]1Cc1ccccc1)c1cc(=O)[n-]c(C2CC2)n1 ZINC000514947862 943398849 /nfs/dbraw/zinc/39/88/49/943398849.db2.gz MVSLEVZEPUNXOI-DLBZAZTESA-N -1 3 351.450 3.591 20 0 FHADHM Cc1c2cc(Cl)ccc2oc1S(=O)(=O)[N-]CC[C@H]1CCCCO1 ZINC000503995415 943458111 /nfs/dbraw/zinc/45/81/11/943458111.db2.gz ZCGSWHPQMINQNY-CYBMUJFWSA-N -1 3 357.859 3.632 20 0 FHADHM C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)NCc1ccc([O-])c(F)c1 ZINC000504335880 943598720 /nfs/dbraw/zinc/59/87/20/943598720.db2.gz HSVPPFWHLRXSQE-NSHDSACASA-N -1 3 370.346 3.981 20 0 FHADHM COc1cccc(Cl)c1CNCCCc1nc(C)c(C(=O)[O-])s1 ZINC000417542262 943681313 /nfs/dbraw/zinc/68/13/13/943681313.db2.gz DHZKAFPCYYFWEX-UHFFFAOYSA-N -1 3 354.859 3.534 20 0 FHADHM COc1ccc(CN[C@@H](CC(=O)[O-])c2cccc(Cl)c2)c(C)c1OC ZINC000417556132 943703577 /nfs/dbraw/zinc/70/35/77/943703577.db2.gz NPJFQRPFZAKMHO-INIZCTEOSA-N -1 3 363.841 3.971 20 0 FHADHM Cc1cnn(C)c1CN[C@H](CCC(=O)[O-])c1ccc(Cl)c(Cl)c1 ZINC000417565641 943717789 /nfs/dbraw/zinc/71/77/89/943717789.db2.gz HCBQDJOKISPBQR-CQSZACIVSA-N -1 3 356.253 3.731 20 0 FHADHM O=C([O-])C[C@@H](NCc1ncc(Cl)s1)C12CC3CC(CC(C3)C1)C2 ZINC000417577076 943721733 /nfs/dbraw/zinc/72/17/33/943721733.db2.gz LJISHGQAFZZWLV-CQCMJFKXSA-N -1 3 354.903 3.946 20 0 FHADHM Cc1nn(C)c2ncc(CN[C@@H](CC(=O)[O-])c3ccc(C(C)C)cc3)cc12 ZINC000417578840 943723112 /nfs/dbraw/zinc/72/31/12/943723112.db2.gz ZYKYADHOCGWXHP-IBGZPJMESA-N -1 3 366.465 3.706 20 0 FHADHM COc1cc(Cl)c(CN[C@H](C(=O)[O-])[C@@H](C)OC(C)(C)C)cc1Cl ZINC000417582590 943728675 /nfs/dbraw/zinc/72/86/75/943728675.db2.gz ISGGCZHRTFAVOM-OTYXRUKQSA-N -1 3 364.269 3.748 20 0 FHADHM O=C([O-])C[C@H](CNCc1ccc(-c2cccc(F)c2F)o1)C(F)(F)F ZINC000417621980 943756350 /nfs/dbraw/zinc/75/63/50/943756350.db2.gz HSUAAAXIOFMCOB-SECBINFHSA-N -1 3 363.282 3.968 20 0 FHADHM CCOc1c(Cl)cccc1CN[C@@H](CSCC=C(C)C)C(=O)[O-] ZINC000417622922 943757102 /nfs/dbraw/zinc/75/71/02/943757102.db2.gz IBDGIFRTCHAZOM-HNNXBMFYSA-N -1 3 357.903 3.981 20 0 FHADHM COc1cc(CN[C@H]2C[C@H](C(=O)[O-])c3ccccc32)cc(Cl)c1OC ZINC000417611118 943759771 /nfs/dbraw/zinc/75/97/71/943759771.db2.gz AKWLSYOHTJZQDD-HOCLYGCPSA-N -1 3 361.825 3.760 20 0 FHADHM CC(C)=CCSC[C@@H](NCc1ccc(C)cc1Br)C(=O)[O-] ZINC000417632795 943769749 /nfs/dbraw/zinc/76/97/49/943769749.db2.gz XEMAIPKDDSWJHJ-OAHLLOKOSA-N -1 3 372.328 4.000 20 0 FHADHM O=C([O-])C[C@@H](CNCc1cc(Cl)ccc1OC(F)F)C(F)(F)F ZINC000417631281 943769837 /nfs/dbraw/zinc/76/98/37/943769837.db2.gz RYYCFOIQVJENOF-QMMMGPOBSA-N -1 3 361.694 3.684 20 0 FHADHM O=C([O-])C[C@H](CNCc1ccc(-c2c(F)cccc2F)o1)C(F)(F)F ZINC000417633858 943771158 /nfs/dbraw/zinc/77/11/58/943771158.db2.gz UTWYUZDMLASFPC-SECBINFHSA-N -1 3 363.282 3.968 20 0 FHADHM COc1cc(Cl)c(CNC[C@@H](CC(=O)[O-])C(F)(F)F)cc1Cl ZINC000417625248 943775692 /nfs/dbraw/zinc/77/56/92/943775692.db2.gz LVDAEXGHGLIWJJ-MRVPVSSYSA-N -1 3 360.159 3.745 20 0 FHADHM CC(C)(C)c1nn(-c2ccccc2Cl)cc1CN[C@H]1C=C[C@H](C(=O)[O-])C1 ZINC000417626547 943776859 /nfs/dbraw/zinc/77/68/59/943776859.db2.gz TWOVUTPOXWLUNS-ZFWWWQNUSA-N -1 3 373.884 3.942 20 0 FHADHM CC(C)C[C@H](NC(=O)CN1CCCC[C@H]1CCC(=O)[O-])c1ccccc1 ZINC000424248936 943804807 /nfs/dbraw/zinc/80/48/07/943804807.db2.gz ACVDIKDJKIEHPJ-OALUTQOASA-N -1 3 360.498 3.609 20 0 FHADHM CC(C)Cc1ccc([C@@H](C)NC(=O)CN2CCCC[C@H]2CCC(=O)[O-])cc1 ZINC000424257526 943809181 /nfs/dbraw/zinc/80/91/81/943809181.db2.gz KNFOAQYMMNRCQM-XLIONFOSSA-N -1 3 374.525 3.782 20 0 FHADHM C[C@@H]1C[C@H]1[C@@H](NC(=O)c1cc(=O)[n-]c(C2CC2)n1)c1ccc(Cl)cc1 ZINC000516935854 943843861 /nfs/dbraw/zinc/84/38/61/943843861.db2.gz LKGGFPMHBZNNFF-VMDBXTETSA-N -1 3 357.841 3.840 20 0 FHADHM C[C@@H]1C[C@H]1[C@H](NC(=O)c1cc(=O)[n-]c(C2CC2)n1)c1ccc(Cl)cc1 ZINC000516935851 943844123 /nfs/dbraw/zinc/84/41/23/943844123.db2.gz LKGGFPMHBZNNFF-LGFNAOKASA-N -1 3 357.841 3.840 20 0 FHADHM C/C=C/c1ccc(OCC(=O)Nc2cccc(C(C)=O)c2[O-])c(OC)c1 ZINC000515399599 943848938 /nfs/dbraw/zinc/84/89/38/943848938.db2.gz OIWCUNPGHWEUSN-GQCTYLIASA-N -1 3 355.390 3.654 20 0 FHADHM O=C(Nc1ccc(-c2cn3ccccc3n2)cc1)c1cc(F)cc2n[n-]nc21 ZINC000515435252 943886962 /nfs/dbraw/zinc/88/69/62/943886962.db2.gz HLASHLIYOAQMJO-UHFFFAOYSA-N -1 3 372.363 3.664 20 0 FHADHM Cc1nc2cc(C(=O)Nc3ncccc3[O-])ccc2n1Cc1ccsc1 ZINC000473036403 943906375 /nfs/dbraw/zinc/90/63/75/943906375.db2.gz SMNJRYRJIFTSEN-UHFFFAOYSA-N -1 3 364.430 3.807 20 0 FHADHM COc1cc(C(=O)N[C@@]2(c3ccc(Cl)cc3)C[C@H]2C)cc(OC)c1[O-] ZINC000505738341 943918133 /nfs/dbraw/zinc/91/81/33/943918133.db2.gz QFVRRJHIIRMNFS-WYRIXSBYSA-N -1 3 361.825 3.728 20 0 FHADHM Cc1cc(F)c(CNC[C@H](Cc2ccc(Cl)cc2)C(=O)[O-])c(F)c1 ZINC000424630643 944020598 /nfs/dbraw/zinc/02/05/98/944020598.db2.gz ZKIFRBWXBFKXJS-ZDUSSCGKSA-N -1 3 353.796 3.960 20 0 FHADHM CCCCOc1ccc([N-]S(=O)(=O)c2ccc3c(c2)CCO3)c(C)c1 ZINC000517124892 944029152 /nfs/dbraw/zinc/02/91/52/944029152.db2.gz HSRDBZNWDGEVFB-UHFFFAOYSA-N -1 3 361.463 3.910 20 0 FHADHM Cc1c(Br)ccc(NC(=O)c2cc(F)cc3n[n-]nc32)c1F ZINC000505096000 944036133 /nfs/dbraw/zinc/03/61/33/944036133.db2.gz CVJUANLFTSKIAC-UHFFFAOYSA-N -1 3 367.153 3.559 20 0 FHADHM CCn1nc(C)c(S(=O)(=O)[N-]c2ccc(OC(C)C)cc2Cl)c1C ZINC000436154758 944059913 /nfs/dbraw/zinc/05/99/13/944059913.db2.gz OJOYWBLVOBGLBE-UHFFFAOYSA-N -1 3 371.890 3.761 20 0 FHADHM COc1cc([N-]S(=O)(=O)c2ccc(OCC(C)C)cc2)ccc1F ZINC000436159201 944063556 /nfs/dbraw/zinc/06/35/56/944063556.db2.gz HWFVUOOZEIBCRD-UHFFFAOYSA-N -1 3 353.415 3.670 20 0 FHADHM Cc1nc2cc(CSc3nc(=O)cc([O-])n3C3CCCC3)ccc2[nH]1 ZINC000436206850 944100917 /nfs/dbraw/zinc/10/09/17/944100917.db2.gz RJFXEKPWWOSJNU-UHFFFAOYSA-N -1 3 356.451 3.541 20 0 FHADHM Cc1nc2cc(CSc3nc([O-])cc(=O)n3C3CCCC3)ccc2[nH]1 ZINC000436206850 944100923 /nfs/dbraw/zinc/10/09/23/944100923.db2.gz RJFXEKPWWOSJNU-UHFFFAOYSA-N -1 3 356.451 3.541 20 0 FHADHM O=C1CCCc2cc(-c3nc4sc(C(F)(F)F)cc4c(=O)[n-]3)cnc21 ZINC000515807713 944223849 /nfs/dbraw/zinc/22/38/49/944223849.db2.gz 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365.260 3.874 20 0 FHADHM COc1cc(-c2nc(-c3ccc(Cl)cc3F)no2)cc(OC)c1[O-] ZINC000436536960 944402388 /nfs/dbraw/zinc/40/23/88/944402388.db2.gz WPCMWMUXPFPARZ-UHFFFAOYSA-N -1 3 350.733 3.919 20 0 FHADHM Cc1ccc(C(=O)Nc2cccc(CS(=O)(=O)C(C)(C)C)c2)c([O-])c1 ZINC000436546865 944405929 /nfs/dbraw/zinc/40/59/29/944405929.db2.gz LUMLLGOPDVPBPB-UHFFFAOYSA-N -1 3 361.463 3.666 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(Cc3nnc4ccccn43)cc2)c([O-])c1C ZINC000436544698 944422019 /nfs/dbraw/zinc/42/20/19/944422019.db2.gz KBJFHXCDVQNEKA-UHFFFAOYSA-N -1 3 372.428 3.895 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(Sc3nncn3C)c(Cl)c2)c([O-])c1 ZINC000436544176 944422924 /nfs/dbraw/zinc/42/29/24/944422924.db2.gz NYLGODKUCVUSDZ-UHFFFAOYSA-N -1 3 374.853 3.886 20 0 FHADHM CCN1CCN(C(=O)c2ccc3c(c2[O-])OC(C)(C)C3)c2ccccc21 ZINC000436557236 944425665 /nfs/dbraw/zinc/42/56/65/944425665.db2.gz NEXASPPSDWPONR-UHFFFAOYSA-N -1 3 352.434 3.592 20 0 FHADHM COc1cccc(Oc2ncccc2CNC(=O)c2ccc(C)cc2[O-])c1 ZINC000436565356 944430599 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CC(=O)c1ccc(C(=O)NC[C@@H]2CCCO[C@H]2c2ccc(C)cc2)cc1[O-] ZINC000436657890 944488505 /nfs/dbraw/zinc/48/85/05/944488505.db2.gz RXXIDEOZWTUXMA-RXVVDRJESA-N -1 3 367.445 3.801 20 0 FHADHM CC(=O)c1ccc(C(=O)Nc2nc(-c3cccc(O)c3)cs2)cc1[O-] ZINC000436647428 944496499 /nfs/dbraw/zinc/49/64/99/944496499.db2.gz KPFGPWOZIHSYLQ-UHFFFAOYSA-N -1 3 354.387 3.676 20 0 FHADHM CCC(=O)c1ccc([O-])c(NC(=O)[C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000436648262 944497126 /nfs/dbraw/zinc/49/71/26/944497126.db2.gz SPPYYMLLXYENME-SFHVURJKSA-N -1 3 366.461 3.836 20 0 FHADHM Cc1cc(C)n(-c2ccc(CNC(=O)c3ccc(C(C)C)cc3[O-])cn2)n1 ZINC000436676118 944507378 /nfs/dbraw/zinc/50/73/78/944507378.db2.gz YCLAKHJNQXFEKN-UHFFFAOYSA-N -1 3 364.449 3.643 20 0 FHADHM Cc1ccc(C(=O)N(CCCOc2ccccc2)C2CCOCC2)c([O-])c1 ZINC000436685029 944523114 /nfs/dbraw/zinc/52/31/14/944523114.db2.gz ACWKNLPAFVHXBE-UHFFFAOYSA-N -1 3 369.461 3.791 20 0 FHADHM Cc1ncsc1CNC(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436684539 944523996 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CN1CC[C@@H](CNC(=O)c2ccccc2[O-])[C@@H]1c1ccc(Cl)c(F)c1 ZINC000436718653 944557935 /nfs/dbraw/zinc/55/79/35/944557935.db2.gz XMDJHLGECDYHDF-UGSOOPFHSA-N -1 3 362.832 3.608 20 0 FHADHM C[C@@H](NC(=O)c1c[n-]c2ccccc2c1=O)c1cccc(OC(F)F)c1 ZINC000516175560 944560607 /nfs/dbraw/zinc/56/06/07/944560607.db2.gz BEOWGPKAQDXHQR-LLVKDONJSA-N -1 3 358.344 3.621 20 0 FHADHM COc1cc(N2CCN(C(=O)c3ccc(C(C)C)cc3[O-])CC2)ccc1F ZINC000436723552 944563040 /nfs/dbraw/zinc/56/30/40/944563040.db2.gz QKPZDSITRRAXQF-UHFFFAOYSA-N -1 3 372.440 3.626 20 0 FHADHM C[C@@H](NC(=O)c1c([O-])cccc1O)c1ccc(Oc2cccnc2)cc1 ZINC000436745551 944574492 /nfs/dbraw/zinc/57/44/92/944574492.db2.gz CQOUBLXSHUTOFW-CYBMUJFWSA-N -1 3 350.374 3.776 20 0 FHADHM CC(C)c1ccc(C(=O)N(C)[C@@H](C)c2ccc(-n3cncn3)cc2)c([O-])c1 ZINC000436758039 944580024 /nfs/dbraw/zinc/58/00/24/944580024.db2.gz XHDHPDUDLLUESA-HNNXBMFYSA-N -1 3 364.449 3.930 20 0 FHADHM CCn1cnnc1-c1cccc(NC(=O)c2cc3c(cc2[O-])CCCC3)c1 ZINC000436757969 944580137 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O=C(Nc1ccc(-c2cc(=O)[nH][nH]2)cc1)c1cc(Br)ccc1[O-] ZINC000436779327 944610637 /nfs/dbraw/zinc/61/06/37/944610637.db2.gz JOJFOIWEQZQAEL-UHFFFAOYSA-N -1 3 374.194 3.503 20 0 FHADHM COc1cc(-c2nc(-c3ccc(OC(C)(C)C)cn3)no2)cc(OC)c1[O-] ZINC000436788146 944635216 /nfs/dbraw/zinc/63/52/16/944635216.db2.gz UIMKNKGIODNNSG-UHFFFAOYSA-N -1 3 371.393 3.699 20 0 FHADHM O=C([O-])c1ccccc1C1CCN([C@H]2CCc3ccccc3NC2=O)CC1 ZINC000653377482 944635388 /nfs/dbraw/zinc/63/53/88/944635388.db2.gz AHZGADAZOMQWDW-FQEVSTJZSA-N -1 3 364.445 3.518 20 0 FHADHM CC(C)[C@@H](Oc1cccc(Cl)c1)C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000538746035 944635936 /nfs/dbraw/zinc/63/59/36/944635936.db2.gz RHHBLJUXTKANIK-MRXNPFEDSA-N -1 3 371.828 3.562 20 0 FHADHM CC(C)[C@@H](Oc1cccc(Cl)c1)C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000538746035 944635942 /nfs/dbraw/zinc/63/59/42/944635942.db2.gz RHHBLJUXTKANIK-MRXNPFEDSA-N -1 3 371.828 3.562 20 0 FHADHM O=C(CCCc1ccc2ccccc2c1)Nc1cccc(-c2nnn[n-]2)c1 ZINC000538265986 944635966 /nfs/dbraw/zinc/63/59/66/944635966.db2.gz NGRAAGNDVPMAGC-UHFFFAOYSA-N -1 3 357.417 3.981 20 0 FHADHM O=C(CCCc1ccc2ccccc2c1)Nc1cccc(-c2nn[n-]n2)c1 ZINC000538265986 944635971 /nfs/dbraw/zinc/63/59/71/944635971.db2.gz NGRAAGNDVPMAGC-UHFFFAOYSA-N -1 3 357.417 3.981 20 0 FHADHM C[C@@H]1C[C@H]1N1CCN(C(=O)c2ccc(Cl)c(Cl)c2[O-])C[C@@H](C)C1 ZINC000436789859 944638887 /nfs/dbraw/zinc/63/88/87/944638887.db2.gz FJDZWHRXSXOPLI-MISXGVKJSA-N -1 3 357.281 3.501 20 0 FHADHM C[C@H]1C[C@H]1N1CCN(C(=O)c2ccc(Cl)c(Cl)c2[O-])C[C@@H](C)C1 ZINC000436789858 944639055 /nfs/dbraw/zinc/63/90/55/944639055.db2.gz FJDZWHRXSXOPLI-COPLHBTASA-N -1 3 357.281 3.501 20 0 FHADHM O=C(CCCn1ccc2cc(Cl)ccc21)N=c1cc([C@H]2CCCO2)[n-][nH]1 ZINC000473842901 944649716 /nfs/dbraw/zinc/64/97/16/944649716.db2.gz MCKQYVBETYEMBU-QGZVFWFLSA-N -1 3 372.856 3.710 20 0 FHADHM O=C(N[C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1)c1c([O-])cccc1O ZINC000438469146 944654768 /nfs/dbraw/zinc/65/47/68/944654768.db2.gz ZOBDCDSKKVHCHF-AULYBMBSSA-N -1 3 351.324 3.793 20 0 FHADHM O=C(CCCc1ccc(Cl)c(Cl)c1)N=c1cc([C@H]2CCCO2)[n-][nH]1 ZINC000473844399 944661294 /nfs/dbraw/zinc/66/12/94/944661294.db2.gz RMBFHLQELLAMHA-OAHLLOKOSA-N -1 3 368.264 3.951 20 0 FHADHM CCc1ccc(C(=O)N[C@H](C)c2ccc(NC(=O)C3CC3)cc2)c([O-])c1 ZINC000436805471 944661574 /nfs/dbraw/zinc/66/15/74/944661574.db2.gz DDHWSYPWSYBGFO-CYBMUJFWSA-N -1 3 352.434 3.794 20 0 FHADHM O=C(CCCc1csc2ccccc12)N=c1cc([C@@H]2CCCO2)[n-][nH]1 ZINC000473846078 944666851 /nfs/dbraw/zinc/66/68/51/944666851.db2.gz ICTJTNDTVYLKAS-INIZCTEOSA-N -1 3 355.463 3.859 20 0 FHADHM COC[C@@H]1CCCCN(C(=O)c2cc(Cc3ccccc3)ccc2[O-])C1 ZINC000436812646 944669744 /nfs/dbraw/zinc/66/97/44/944669744.db2.gz BKZCHTHOCYFZGU-LJQANCHMSA-N -1 3 353.462 3.872 20 0 FHADHM CC(C)c1nc(C(=O)Nc2cc(F)ccc2[O-])nn1-c1ccccc1F ZINC000436812803 944669937 /nfs/dbraw/zinc/66/99/37/944669937.db2.gz NDRQESYCWQYYCD-UHFFFAOYSA-N -1 3 358.348 3.627 20 0 FHADHM CCOC(=O)C[C@H](C)N(C)C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436828651 944674825 /nfs/dbraw/zinc/67/48/25/944674825.db2.gz QXIKOHCABBINPP-INIZCTEOSA-N -1 3 369.461 3.591 20 0 FHADHM Cc1ccc(C(=O)N(C)Cc2ccc(OCC(F)(F)F)cc2)c([O-])c1 ZINC000436830140 944675658 /nfs/dbraw/zinc/67/56/58/944675658.db2.gz PYWWIIQTLZXSGH-UHFFFAOYSA-N -1 3 353.340 3.914 20 0 FHADHM Cc1ccc([C@@H]2CSCCN2CCOc2cccc(C(=O)[O-])c2)cc1 ZINC000516300923 944685330 /nfs/dbraw/zinc/68/53/30/944685330.db2.gz LAUXCKFKASMTMX-IBGZPJMESA-N -1 3 357.475 3.862 20 0 FHADHM CCCN(C(=O)c1ccc(CC)cc1[O-])[C@H](C)C(=O)Nc1ccccc1 ZINC000436820287 944688178 /nfs/dbraw/zinc/68/81/78/944688178.db2.gz GHQHNNPMKFZRME-OAHLLOKOSA-N -1 3 354.450 3.834 20 0 FHADHM CCc1ccc(C(=O)Nc2ccccc2CN2C[C@H](C)O[C@@H](C)C2)c([O-])c1 ZINC000436820857 944689498 /nfs/dbraw/zinc/68/94/98/944689498.db2.gz SZCLGRYCPBMINV-HOTGVXAUSA-N -1 3 368.477 3.816 20 0 FHADHM COC[C@H](C)Oc1ccc(Cl)cc1NC(=O)c1cccc(OC)c1[O-] ZINC000436821977 944690580 /nfs/dbraw/zinc/69/05/80/944690580.db2.gz RGCHLTWYZCGNAC-NSHDSACASA-N -1 3 365.813 3.720 20 0 FHADHM COc1cc(C[NH2+][C@@H](C)CCC[C@H](C)C(=O)[O-])cc(Br)c1[O-] ZINC000426694334 944695387 /nfs/dbraw/zinc/69/53/87/944695387.db2.gz IJTVELJUASFBJS-QWRGUYRKSA-N -1 3 374.275 3.532 20 0 FHADHM O=C([O-])COc1ccc(CCNCc2c(Cl)cccc2Cl)cc1 ZINC000426699456 944700737 /nfs/dbraw/zinc/70/07/37/944700737.db2.gz JEOHEHBGLRAQIY-UHFFFAOYSA-N -1 3 354.233 3.789 20 0 FHADHM COc1ccncc1CNC(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436840320 944707352 /nfs/dbraw/zinc/70/73/52/944707352.db2.gz RZNBVGXWTFMLQY-UHFFFAOYSA-N -1 3 350.374 3.518 20 0 FHADHM C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)N=c1cc([C@@H]2CCCO2)[n-][nH]1 ZINC000473849382 944709951 /nfs/dbraw/zinc/70/99/51/944709951.db2.gz VZQQIAKZTMRSTN-BMIGLBTASA-N -1 3 368.264 3.807 20 0 FHADHM CN(C)Cc1cccc(NC(=O)c2cc(F)cc(Br)c2[O-])c1 ZINC000436845652 944713342 /nfs/dbraw/zinc/71/33/42/944713342.db2.gz DXVRKLUELDSDSG-UHFFFAOYSA-N -1 3 367.218 3.608 20 0 FHADHM O=C([O-])Cc1ccccc1CNCc1ccc(OCC(F)(F)F)c(F)c1 ZINC000426693183 944713669 /nfs/dbraw/zinc/71/36/69/944713669.db2.gz YBJZADSLZZEYQZ-UHFFFAOYSA-N -1 3 371.330 3.684 20 0 FHADHM CCc1ccc([C@H]2COCCN2C(=O)CCCc2ccc([O-])c(F)c2)o1 ZINC000469398699 944715738 /nfs/dbraw/zinc/71/57/38/944715738.db2.gz ZCNKCYKRYIQJEK-QGZVFWFLSA-N -1 3 361.413 3.610 20 0 FHADHM COc1cccc2c1nc(-c1cc(Br)c([O-])c(OC)c1)n2C ZINC000436852915 944721848 /nfs/dbraw/zinc/72/18/48/944721848.db2.gz IVTUFSLFGBTDPR-UHFFFAOYSA-N -1 3 363.211 3.726 20 0 FHADHM COCCCOc1ccc(NC(=O)c2ccc(C)c(C)c2[O-])cc1OC ZINC000436861801 944727386 /nfs/dbraw/zinc/72/73/86/944727386.db2.gz VXFLNKFFZKQZRS-UHFFFAOYSA-N -1 3 359.422 3.685 20 0 FHADHM O=C([O-])[C@H](CSCCc1ccccc1)NCc1ccc(Cl)cc1F ZINC000426724442 944727554 /nfs/dbraw/zinc/72/75/54/944727554.db2.gz SIXKMRVAJPTRNP-KRWDZBQOSA-N -1 3 367.873 3.998 20 0 FHADHM COc1ccc([O-])c(-c2nc(-c3cc(OC(F)F)ccc3F)no2)c1 ZINC000436857814 944745708 /nfs/dbraw/zinc/74/57/08/944745708.db2.gz YGXPRMKBOMSQCC-UHFFFAOYSA-N -1 3 352.268 3.858 20 0 FHADHM [O-]c1cc2ccccc2cc1-c1nc(-c2ccc(Cn3cncn3)cc2)no1 ZINC000436895058 944747479 /nfs/dbraw/zinc/74/74/79/944747479.db2.gz HRBDZTPJHASFPR-UHFFFAOYSA-N -1 3 369.384 3.902 20 0 FHADHM CCC[C@H](CC1CCCC1)C(=O)N1CCN(C(=O)c2ccc([O-])cc2)CC1 ZINC000436883188 944755471 /nfs/dbraw/zinc/75/54/71/944755471.db2.gz BKPVRMXMOAQECL-LJQANCHMSA-N -1 3 372.509 3.673 20 0 FHADHM CCc1ccc(-c2nc([C@H](CC)NC(=O)c3ccccc3)no2)c([O-])c1 ZINC000436884100 944757798 /nfs/dbraw/zinc/75/77/98/944757798.db2.gz JLWDMLYFMLSFDE-INIZCTEOSA-N -1 3 351.406 3.886 20 0 FHADHM COC(=O)c1ccc(-c2nc(-c3ccc(F)cc3C(F)(F)F)no2)[n-]1 ZINC000426426386 944760744 /nfs/dbraw/zinc/76/07/44/944760744.db2.gz HOJHZXYIAPGTSC-UHFFFAOYSA-N -1 3 355.247 3.676 20 0 FHADHM COc1ccc([O-])c(-c2nc(Cc3coc(-c4ccc(F)cc4)n3)no2)c1 ZINC000436886662 944761559 /nfs/dbraw/zinc/76/15/59/944761559.db2.gz HVFHOAPNWXWZIO-UHFFFAOYSA-N -1 3 367.336 3.836 20 0 FHADHM O=C(Cc1noc(-c2cc3ccccc3cc2[O-])n1)Nc1ccc(F)cc1 ZINC000436890012 944764798 /nfs/dbraw/zinc/76/47/98/944764798.db2.gz DCVNZCWCMGPOMF-UHFFFAOYSA-N -1 3 363.348 3.916 20 0 FHADHM O=S(=O)([N-]c1ccccc1Br)c1cnc2ccsc2c1 ZINC000439573251 944775069 /nfs/dbraw/zinc/77/50/69/944775069.db2.gz SNSZPRQYMFNSOJ-UHFFFAOYSA-N -1 3 369.265 3.860 20 0 FHADHM CCOc1cc(CN[C@H](C(=O)[O-])c2ccc(Cl)c(F)c2)ccc1OC ZINC000426759633 944782000 /nfs/dbraw/zinc/78/20/00/944782000.db2.gz WZIKBPWZZGEYCN-KRWDZBQOSA-N -1 3 367.804 3.802 20 0 FHADHM COCC(=O)Nc1ccc(-c2noc(-c3ccc(C(C)C)cc3[O-])n2)cc1 ZINC000436897275 944784187 /nfs/dbraw/zinc/78/41/87/944784187.db2.gz ROLGEJDCDOYKSW-UHFFFAOYSA-N -1 3 367.405 3.818 20 0 FHADHM CN(C[C@H]1CCCC[C@H]1O)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436901205 944789876 /nfs/dbraw/zinc/78/98/76/944789876.db2.gz AFEYRCITFMGQSV-UYAOXDASSA-N -1 3 353.462 3.606 20 0 FHADHM COc1cccc(-c2nc(Cc3ccc(Br)s3)no2)c1[O-] ZINC000436900573 944790900 /nfs/dbraw/zinc/79/09/00/944790900.db2.gz CQLMDZRQUWTASM-UHFFFAOYSA-N -1 3 367.224 3.866 20 0 FHADHM [O-]c1c(-c2nc(Cc3n[nH]c(-c4ccccc4)n3)no2)ccc2ccccc21 ZINC000436931334 944793246 /nfs/dbraw/zinc/79/32/46/944793246.db2.gz ZZSTUJDHHKJGQT-UHFFFAOYSA-N -1 3 369.384 3.971 20 0 FHADHM CC[C@@H](CC(=O)N(C)c1ccc(-c2nnn[n-]2)cc1F)c1ccccc1 ZINC000736332461 944801983 /nfs/dbraw/zinc/80/19/83/944801983.db2.gz NHQTVOGQAJCYAF-ZDUSSCGKSA-N -1 3 353.401 3.553 20 0 FHADHM CC[C@@H](CC(=O)N(C)c1ccc(-c2nn[n-]n2)cc1F)c1ccccc1 ZINC000736332461 944801990 /nfs/dbraw/zinc/80/19/90/944801990.db2.gz NHQTVOGQAJCYAF-ZDUSSCGKSA-N -1 3 353.401 3.553 20 0 FHADHM C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2cc(F)c([O-])c(Cl)c2)C1 ZINC000436922922 944807122 /nfs/dbraw/zinc/80/71/22/944807122.db2.gz ROYFNYFOLUJSIE-DOMZBBRYSA-N -1 3 362.832 3.750 20 0 FHADHM Cc1ccc(NC(=O)c2cc3c(cc2[O-])CCCC3)cc1NC(=O)N(C)C ZINC000436925521 944812914 /nfs/dbraw/zinc/81/29/14/944812914.db2.gz GRDINFHDRLOFMV-UHFFFAOYSA-N -1 3 367.449 3.925 20 0 FHADHM COc1ccc2cc(CN[C@@H](C(=O)[O-])c3ccccc3OC)ccc2c1 ZINC000426795914 944817551 /nfs/dbraw/zinc/81/75/51/944817551.db2.gz ZNHYLYCOJZBTJZ-HXUWFJFHSA-N -1 3 351.402 3.773 20 0 FHADHM CCOc1cc(C=Cc2cc(=O)[n-]c(-c3ccncc3)n2)cc(Cl)c1O ZINC000436932987 944819221 /nfs/dbraw/zinc/81/92/21/944819221.db2.gz PEMDXSMBSXPTAN-ARJAWSKDSA-N -1 3 369.808 3.760 20 0 FHADHM COc1cccc([C@H](CC(=O)[O-])NCc2cccc(OC(F)(F)F)c2)c1 ZINC000426802949 944824518 /nfs/dbraw/zinc/82/45/18/944824518.db2.gz YYWNDWWAWMIUEK-INIZCTEOSA-N -1 3 369.339 3.899 20 0 FHADHM COc1ccc([C@@H](NCc2cc(C)c3ncccc3c2)C(=O)[O-])cc1F ZINC000426803319 944825860 /nfs/dbraw/zinc/82/58/60/944825860.db2.gz LTDFWCHJSNKZNV-LJQANCHMSA-N -1 3 354.381 3.606 20 0 FHADHM Cc1ccc(C(=O)Nc2cccc(CN3C[C@H](C)O[C@@H](C)C3)c2)c([O-])c1 ZINC000436940440 944828365 /nfs/dbraw/zinc/82/83/65/944828365.db2.gz ADTOUMRDGJQDAW-HOTGVXAUSA-N -1 3 354.450 3.562 20 0 FHADHM CCC[C@H](NC(=O)c1ccccc1)c1noc(-c2cc(OC)ccc2[O-])n1 ZINC000436944774 944832389 /nfs/dbraw/zinc/83/23/89/944832389.db2.gz NUQPTYPOOFHVIZ-INIZCTEOSA-N -1 3 367.405 3.722 20 0 FHADHM C[C@@H](c1ccc(F)c(Cl)c1)N1CCN(C(=O)c2ccc([O-])cc2)CC1 ZINC000436946048 944833194 /nfs/dbraw/zinc/83/31/94/944833194.db2.gz CBRYZRBEEQCBDR-ZDUSSCGKSA-N -1 3 362.832 3.704 20 0 FHADHM CCc1noc(C)c1CNC(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436945490 944834038 /nfs/dbraw/zinc/83/40/38/944834038.db2.gz GWWXDNMBMVTNJO-UHFFFAOYSA-N -1 3 352.390 3.973 20 0 FHADHM Cc1ccc(C(=O)N[C@@H](c2ccn(C)n2)c2ccc(Cl)cc2)c([O-])c1 ZINC000436960479 944837672 /nfs/dbraw/zinc/83/76/72/944837672.db2.gz QOTLKKFMHKYNQU-GOSISDBHSA-N -1 3 355.825 3.607 20 0 FHADHM CC(=O)Nc1cc(F)c(F)cc1NC(=O)c1ccc2c(c1[O-])CCCC2 ZINC000436967300 944843804 /nfs/dbraw/zinc/84/38/04/944843804.db2.gz XXDWHXIBMGFJGL-UHFFFAOYSA-N -1 3 360.360 3.760 20 0 FHADHM O=C(Nc1nnc([C@H]2CCCc3ccccc32)s1)c1c([O-])cccc1O ZINC000436955355 944850330 /nfs/dbraw/zinc/85/03/30/944850330.db2.gz KHJNUKIIAZLBIJ-ZDUSSCGKSA-N -1 3 367.430 3.670 20 0 FHADHM Cc1ccc(-c2nc(-c3cn4ccc(Br)cc4n3)no2)c([O-])c1 ZINC000436954602 944850865 /nfs/dbraw/zinc/85/08/65/944850865.db2.gz HSJFUYWABMYIPU-UHFFFAOYSA-N -1 3 371.194 3.828 20 0 FHADHM COCCc1nc2cc(NC(=O)c3ccc4c(c3[O-])CCCC4)ccc2o1 ZINC000436975558 944865912 /nfs/dbraw/zinc/86/59/12/944865912.db2.gz KVZXCXQXBYANPO-UHFFFAOYSA-N -1 3 366.417 3.853 20 0 FHADHM O=C(CCCCc1nc2ccccc2s1)N=c1cc([C@H]2CCCO2)[n-][nH]1 ZINC000473850489 944868998 /nfs/dbraw/zinc/86/89/98/944868998.db2.gz OETCEJWEGJDBRF-OAHLLOKOSA-N -1 3 370.478 3.644 20 0 FHADHM CCCCOc1ccc(C(=O)NC[C@@H](C[C@@H](C)O)c2ccccc2)c([O-])c1 ZINC000436988082 944880281 /nfs/dbraw/zinc/88/02/81/944880281.db2.gz OCQNYJIJZAUKSQ-SJLPKXTDSA-N -1 3 371.477 3.856 20 0 FHADHM CCCCOc1ccc(C(=O)NCc2nc(C(F)(F)F)cs2)c([O-])c1 ZINC000436988519 944882054 /nfs/dbraw/zinc/88/20/54/944882054.db2.gz LNMKLLMODZOMPQ-UHFFFAOYSA-N -1 3 374.384 3.976 20 0 FHADHM O=C([O-])CCCOc1ccc(NC(=O)[C@H]2CCCCN2C2CCCC2)cc1 ZINC000909334604 944904016 /nfs/dbraw/zinc/90/40/16/944904016.db2.gz DADQVFXPSNULIP-LJQANCHMSA-N -1 3 374.481 3.666 20 0 FHADHM CC(C)c1ccc(C(=O)N2CCC(CO)(c3ccccc3)CC2)c([O-])c1 ZINC000437006139 944904677 /nfs/dbraw/zinc/90/46/77/944904677.db2.gz QNOVHNFZRGTMII-UHFFFAOYSA-N -1 3 353.462 3.682 20 0 FHADHM CCCS(=O)(=O)Nc1cccc(NCc2c(F)ccc([O-])c2F)c1C ZINC000293820998 944917508 /nfs/dbraw/zinc/91/75/08/944917508.db2.gz DFHBGFXKWXRWQC-UHFFFAOYSA-N -1 3 370.421 3.743 20 0 FHADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CCc2ncsc2C1 ZINC000438683068 944924431 /nfs/dbraw/zinc/92/44/31/944924431.db2.gz SKAPIVNOLWBPAB-UHFFFAOYSA-N -1 3 364.470 3.832 20 0 FHADHM COC(=O)c1ccc(C(=O)Nc2ccc(Oc3cccc(OC)c3)cc2)[n-]1 ZINC000432027624 944933824 /nfs/dbraw/zinc/93/38/24/944933824.db2.gz RFUSCNBCIVVLEJ-UHFFFAOYSA-N -1 3 366.373 3.855 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2ccc3nn(C(C)C)cc3c2)cc1C ZINC000438759156 944995382 /nfs/dbraw/zinc/99/53/82/944995382.db2.gz XFJNSHHETBNEAK-UHFFFAOYSA-N -1 3 359.451 3.735 20 0 FHADHM O=C(N=c1cc([C@H]2CCCO2)[n-][nH]1)c1csc(-c2ccc(Cl)cc2)n1 ZINC000473852602 945003373 /nfs/dbraw/zinc/00/33/73/945003373.db2.gz UZODGOACYDCMLY-CQSZACIVSA-N -1 3 374.853 3.712 20 0 FHADHM Cc1ccc(C)c(NC(=O)[C@H](C)Sc2ccc(-c3nnn[n-]3)cc2F)c1 ZINC000737322785 945038769 /nfs/dbraw/zinc/03/87/69/945038769.db2.gz NQSNAGONFKLJKP-LBPRGKRZSA-N -1 3 371.441 3.742 20 0 FHADHM Cc1ccc(C)c(NC(=O)[C@H](C)Sc2ccc(-c3nn[n-]n3)cc2F)c1 ZINC000737322785 945038777 /nfs/dbraw/zinc/03/87/77/945038777.db2.gz NQSNAGONFKLJKP-LBPRGKRZSA-N -1 3 371.441 3.742 20 0 FHADHM Cc1ccc(Cl)cc1NC(=O)[C@H](C)Sc1ccccc1-c1nnn[n-]1 ZINC000737343366 945044969 /nfs/dbraw/zinc/04/49/69/945044969.db2.gz NYRIQLUYNKLXDT-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM Cc1ccc(Cl)cc1NC(=O)[C@H](C)Sc1ccccc1-c1nn[n-]n1 ZINC000737343366 945044978 /nfs/dbraw/zinc/04/49/78/945044978.db2.gz NYRIQLUYNKLXDT-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM CC(C)Oc1cccc(-c2noc(-c3ccc([N-]S(C)(=O)=O)cc3)n2)c1 ZINC000519611657 945375835 /nfs/dbraw/zinc/37/58/35/945375835.db2.gz MVRAXPRRCSXJGE-UHFFFAOYSA-N -1 3 373.434 3.562 20 0 FHADHM CC[C@@H]1CCC[C@H]1C[N-]S(=O)(=O)c1ccc(Br)cc1F ZINC001211889561 945395937 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CCC[C@@]1(C)CCCN(C(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)C1 ZINC000821027666 945616760 /nfs/dbraw/zinc/61/67/60/945616760.db2.gz PZJVWSQDNKVTQR-KUHUBIRLSA-N -1 3 356.474 3.540 20 0 FHADHM CCC[C@@]1(C)CCCN(C(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)C1 ZINC000821027666 945616761 /nfs/dbraw/zinc/61/67/61/945616761.db2.gz PZJVWSQDNKVTQR-KUHUBIRLSA-N -1 3 356.474 3.540 20 0 FHADHM CC(C)c1cccc(NC(=O)N2CCC(C[N-]C(=O)C(F)(F)F)CC2)c1 ZINC000281395899 945621950 /nfs/dbraw/zinc/62/19/50/945621950.db2.gz OLIDSCYYDCMFHN-UHFFFAOYSA-N -1 3 371.403 3.732 20 0 FHADHM Cc1nc(CSc2ccc(C(=O)NCc3ncccc3[O-])cc2)cs1 ZINC000473637637 945660787 /nfs/dbraw/zinc/66/07/87/945660787.db2.gz KFOUDJJOOLAOQJ-UHFFFAOYSA-N -1 3 371.487 3.774 20 0 FHADHM Cc1cc(C)c(C[C@@H](C(=O)NCc2ncccc2[O-])C(F)(F)F)c(C)c1 ZINC000473639969 945667362 /nfs/dbraw/zinc/66/73/62/945667362.db2.gz QZVDEGPTXRAJRD-HNNXBMFYSA-N -1 3 366.383 3.750 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NC(=O)Cc1ccc2ccccc2c1 ZINC000821304638 945668892 /nfs/dbraw/zinc/66/88/92/945668892.db2.gz OXWGDPSQMPJUJV-UHFFFAOYSA-N -1 3 372.432 3.633 20 0 FHADHM Cc1cc(Br)ccc1SCC(=O)Nc1ncccc1[O-] ZINC000048389974 945673494 /nfs/dbraw/zinc/67/34/94/945673494.db2.gz PNUKZRGDWLSDJE-UHFFFAOYSA-N -1 3 353.241 3.589 20 0 FHADHM O=C(CCCOc1ccc(Cl)cc1Cl)NCc1ncccc1[O-] ZINC000473641339 945684739 /nfs/dbraw/zinc/68/47/39/945684739.db2.gz VDPWDQUZQIFEQE-UHFFFAOYSA-N -1 3 355.221 3.569 20 0 FHADHM CCc1cc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCC3)oc1CC ZINC000821471313 945702861 /nfs/dbraw/zinc/70/28/61/945702861.db2.gz ZNZDVHVWBISGSC-UHFFFAOYSA-N -1 3 371.466 3.777 20 0 FHADHM CCc1cc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCC3)oc1CC ZINC000821471313 945702866 /nfs/dbraw/zinc/70/28/66/945702866.db2.gz ZNZDVHVWBISGSC-UHFFFAOYSA-N -1 3 371.466 3.777 20 0 FHADHM O=C(Nc1nnc(C(F)(F)F)[n-]1)[C@@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000110657379 945716958 /nfs/dbraw/zinc/71/69/58/945716958.db2.gz FMBHVSKQOKMPFB-RKDXNWHRSA-N -1 3 364.249 3.585 20 0 FHADHM O=C(Nc1nc(C(F)(F)F)n[n-]1)[C@@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000110657379 945716971 /nfs/dbraw/zinc/71/69/71/945716971.db2.gz FMBHVSKQOKMPFB-RKDXNWHRSA-N -1 3 364.249 3.585 20 0 FHADHM O=S(=O)([N-]c1cccc(CN2CCCCC2)c1)c1cncc(Cl)c1 ZINC000444038381 945743699 /nfs/dbraw/zinc/74/36/99/945743699.db2.gz IFMPYXOKUXARCO-UHFFFAOYSA-N -1 3 365.886 3.522 20 0 FHADHM FC(F)(F)c1n[n-]c(CNc2ncnc3sc4ccccc4c32)n1 ZINC000440654172 945748240 /nfs/dbraw/zinc/74/82/40/945748240.db2.gz XPNBFLBZURQQNE-UHFFFAOYSA-N -1 3 350.329 3.594 20 0 FHADHM COc1cc(C(=O)N[C@H]2CC[C@H](c3ccc(F)cc3)C2)cc(OC)c1[O-] ZINC000473654342 945752053 /nfs/dbraw/zinc/75/20/53/945752053.db2.gz NSWCUQIOGXZTKD-BBRMVZONSA-N -1 3 359.397 3.615 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)c3cc(C4CC4)no3)c2)n1 ZINC000281600666 945775647 /nfs/dbraw/zinc/77/56/47/945775647.db2.gz HXKMTEPBNITTBQ-UHFFFAOYSA-N -1 3 350.378 3.529 20 0 FHADHM COC(=O)c1ccc(CS[C@H](C)c2ccc(-c3nnn[n-]3)cc2)s1 ZINC000821669437 945790394 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CC(C)CCc1ccc([N-]S(=O)(=O)c2ccc3c(c2)CC(=O)N3)cc1 ZINC000519876624 945829905 /nfs/dbraw/zinc/82/99/05/945829905.db2.gz YTSOLDFQHYVEBS-UHFFFAOYSA-N -1 3 358.463 3.571 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H](CCO)C3CCCCC3)nc2)n1 ZINC000301529491 945832381 /nfs/dbraw/zinc/83/23/81/945832381.db2.gz JFUXHMFUOIVSAH-QGZVFWFLSA-N -1 3 356.470 3.550 20 0 FHADHM Cc1cccc(N2C[C@@H](C(=O)Nc3cc(Cl)ccc3[O-])CC2=O)c1C ZINC000111210529 945844999 /nfs/dbraw/zinc/84/49/99/945844999.db2.gz VMIFGNGCTQNQPI-ZDUSSCGKSA-N -1 3 358.825 3.654 20 0 FHADHM O=C(Cc1cc(Cl)c2c(c1)OCCO2)Nc1cc(Cl)ccc1[O-] ZINC000111211167 945848168 /nfs/dbraw/zinc/84/81/68/945848168.db2.gz IZEMCDGQCRGVML-UHFFFAOYSA-N -1 3 354.189 3.651 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N3CC[C@@H](c4ccc(F)cc4)C3)nc2)n1 ZINC000301589941 945863493 /nfs/dbraw/zinc/86/34/93/945863493.db2.gz YKUPVGAEEMCMRK-MRXNPFEDSA-N -1 3 364.424 3.940 20 0 FHADHM COc1cc(C(=O)N2C[C@H](c3ccc(C)cc3)C[C@@H]2C)cc(OC)c1[O-] ZINC000428327707 945885404 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20 0 FHADHM C[C@H](OC(=O)c1cc(Cl)c(Cl)[n-]1)C(=O)Nc1cccnc1Cl ZINC000011810568 946036351 /nfs/dbraw/zinc/03/63/51/946036351.db2.gz ANQPSAZIOMEBJD-LURJTMIESA-N -1 3 362.600 3.554 20 0 FHADHM O=S(=O)([N-][C@H]1CSc2ccccc21)c1cnc(Cl)c(Cl)c1 ZINC000738379353 946064047 /nfs/dbraw/zinc/06/40/47/946064047.db2.gz AJEBBVVSWVLIAY-NSHDSACASA-N -1 3 361.275 3.514 20 0 FHADHM Cc1nc(COc2ccc(Oc3ccc(-c4nnn[n-]4)cc3)cc2)oc1C ZINC000822444379 946091809 /nfs/dbraw/zinc/09/18/09/946091809.db2.gz OFXWGOAJAWEBBW-UHFFFAOYSA-N -1 3 363.377 3.843 20 0 FHADHM Cc1nc(COc2ccc(Oc3ccc(-c4nn[n-]n4)cc3)cc2)oc1C ZINC000822444379 946091818 /nfs/dbraw/zinc/09/18/18/946091818.db2.gz OFXWGOAJAWEBBW-UHFFFAOYSA-N -1 3 363.377 3.843 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N(C)C[C@H](C)c3nccs3)nc2)n1 ZINC000302119957 946130140 /nfs/dbraw/zinc/13/01/40/946130140.db2.gz DESPCXJKPLSIGF-LBPRGKRZSA-N -1 3 355.467 3.503 20 0 FHADHM CC[C@@H]1CCCC[C@H]1[N-]S(=O)(=O)c1ccc(Br)s1 ZINC000042254308 946226176 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COCCOCc1cc(-c2noc(-c3ccc(C)cc3[O-])n2)ccc1F ZINC000664965522 946366597 /nfs/dbraw/zinc/36/65/97/946366597.db2.gz OHUDHASVPVIMIG-UHFFFAOYSA-N -1 3 358.369 3.720 20 0 FHADHM CCCN1C(=O)C2(CCCCC2)N[C@H]1c1ccc([O-])c(Br)c1 ZINC000520310063 946381648 /nfs/dbraw/zinc/38/16/48/946381648.db2.gz CAINIUBTDYGEPK-OAHLLOKOSA-N -1 3 367.287 3.698 20 0 FHADHM O=S(=O)([N-]C[C@@H]1CCCC1(F)F)c1csnc1-c1ccccc1 ZINC001211893835 946390886 /nfs/dbraw/zinc/39/08/86/946390886.db2.gz GEGBBJBPMKYBAN-LBPRGKRZSA-N -1 3 358.435 3.524 20 0 FHADHM C[C@@H]1CC[C@H](N(C)C(=O)c2c[n-]c3ccc(Br)cc3c2=O)C1 ZINC000444402523 946459880 /nfs/dbraw/zinc/45/98/80/946459880.db2.gz JJQLQFULOBUHSH-PWSUYJOCSA-N -1 3 363.255 3.551 20 0 FHADHM Cc1cc([N-]S(=O)(=O)c2ccc(Cl)c(C(F)(F)F)c2)ccn1 ZINC000112496213 946628878 /nfs/dbraw/zinc/62/88/78/946628878.db2.gz KZUIQTRKBUIICF-UHFFFAOYSA-N -1 3 350.749 3.863 20 0 FHADHM CC(C)C[C@@H](C)N(C)C(=O)CSc1cccc(Cl)c1-c1nnn[n-]1 ZINC000824229101 946629178 /nfs/dbraw/zinc/62/91/78/946629178.db2.gz 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COc1cc(-c2nnn[n-]2)ccc1CNc1ccc(C)c(Br)c1 ZINC000826171010 947535195 /nfs/dbraw/zinc/53/51/95/947535195.db2.gz YUKIIMKYCHJNAT-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CNc1ccc(C)c(Br)c1 ZINC000826171010 947535202 /nfs/dbraw/zinc/53/52/02/947535202.db2.gz YUKIIMKYCHJNAT-UHFFFAOYSA-N -1 3 374.242 3.558 20 0 FHADHM NC(=O)CCCCC(=O)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000188949860 947566035 /nfs/dbraw/zinc/56/60/35/947566035.db2.gz LHALAIGXTYOQTK-UHFFFAOYSA-N -1 3 369.446 3.653 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)Nc1cc(SC)ccc1C ZINC000826186390 947570671 /nfs/dbraw/zinc/57/06/71/947570671.db2.gz QRHMZQXWVPHRSG-UHFFFAOYSA-N -1 3 370.438 3.550 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)Nc1cc(SC)ccc1C ZINC000826186390 947570679 /nfs/dbraw/zinc/57/06/79/947570679.db2.gz QRHMZQXWVPHRSG-UHFFFAOYSA-N -1 3 370.438 3.550 20 0 FHADHM COCc1ccc(CN[C@H](C(=O)[O-])c2cccc(C(F)(F)F)c2)cc1 ZINC000663262963 947593666 /nfs/dbraw/zinc/59/36/66/947593666.db2.gz WDLJIMPVFZMUQY-INIZCTEOSA-N -1 3 353.340 3.767 20 0 FHADHM O=C([O-])[C@H]1C=C[C@H](NCc2ccccc2OCc2ccc(F)cc2F)C1 ZINC000663264964 947598767 /nfs/dbraw/zinc/59/87/67/947598767.db2.gz ZSTAWWZGMNADPT-GUYCJALGSA-N -1 3 359.372 3.663 20 0 FHADHM CC(=O)Nc1cccc(C(=O)Nc2cc(Br)ccc2[O-])c1C ZINC000189033643 947609212 /nfs/dbraw/zinc/60/92/12/947609212.db2.gz XSESWOZLPOZUHE-UHFFFAOYSA-N -1 3 363.211 3.674 20 0 FHADHM COc1ccc2oc([C@@H](C)Nc3nccc(C)c3-c3nnn[n-]3)c(C)c2c1 ZINC000826213864 947622875 /nfs/dbraw/zinc/62/28/75/947622875.db2.gz PKRIZKKPRLLVNZ-GFCCVEGCSA-N -1 3 364.409 3.806 20 0 FHADHM COc1ccc2oc([C@@H](C)Nc3nccc(C)c3-c3nn[n-]n3)c(C)c2c1 ZINC000826213864 947622883 /nfs/dbraw/zinc/62/28/83/947622883.db2.gz PKRIZKKPRLLVNZ-GFCCVEGCSA-N -1 3 364.409 3.806 20 0 FHADHM CCc1ccc(C(=O)N[C@@H](C)c2c(C)nn(CC(F)(F)F)c2C)c([O-])c1 ZINC000189264113 947683343 /nfs/dbraw/zinc/68/33/43/947683343.db2.gz LDKGRLWZHXUDQV-JTQLQIEISA-N -1 3 369.387 3.821 20 0 FHADHM CCOc1cnc(-c2noc(-c3cc(Cc4ccccc4)ccc3[O-])n2)cn1 ZINC000445293148 947686244 /nfs/dbraw/zinc/68/62/44/947686244.db2.gz CZNGZHLRASKUBM-UHFFFAOYSA-N -1 3 374.400 3.889 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)Oc1ccc(-c2nnn[n-]2)cc1F ZINC001573364108 947718809 /nfs/dbraw/zinc/71/88/09/947718809.db2.gz FXYWAIRVWHTSQU-NTMALXAHSA-N -1 3 358.760 3.668 20 0 FHADHM CC(=Cc1ccc(Cl)cc1)C(=O)Oc1ccc(-c2nn[n-]n2)cc1F ZINC001573364108 947718812 /nfs/dbraw/zinc/71/88/12/947718812.db2.gz FXYWAIRVWHTSQU-NTMALXAHSA-N -1 3 358.760 3.668 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1C[C@@H](C)C[C@@H]1c1ccccc1F ZINC000826244095 947722741 /nfs/dbraw/zinc/72/27/41/947722741.db2.gz GXKDYLVQDROIIR-KPZWWZAWSA-N -1 3 365.412 3.538 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1C[C@@H](C)C[C@@H]1c1ccccc1F ZINC000826244095 947722750 /nfs/dbraw/zinc/72/27/50/947722750.db2.gz GXKDYLVQDROIIR-KPZWWZAWSA-N -1 3 365.412 3.538 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)N3CCC[C@H]3c3ccc[nH]3)cc2)cc(=O)[n-]1 ZINC000520467964 947724051 /nfs/dbraw/zinc/72/40/51/947724051.db2.gz YHEAQXIFSANZKJ-SFHVURJKSA-N -1 3 363.421 3.855 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC001573366822 947747391 /nfs/dbraw/zinc/74/73/91/947747391.db2.gz TWXBAGKORDEZNK-CSKARUKUSA-N -1 3 357.776 3.701 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC001573366822 947747403 /nfs/dbraw/zinc/74/74/03/947747403.db2.gz TWXBAGKORDEZNK-CSKARUKUSA-N -1 3 357.776 3.701 20 0 FHADHM C/C(=C/c1ccccc1)CN(C)C(=O)c1c(C)cc(-c2nnn[n-]2)cc1C ZINC001573367114 947756110 /nfs/dbraw/zinc/75/61/10/947756110.db2.gz XPLISXSTSQSMLR-UVTDQMKNSA-N -1 3 361.449 3.659 20 0 FHADHM C/C(=C/c1ccccc1)CN(C)C(=O)c1c(C)cc(-c2nn[n-]n2)cc1C ZINC001573367114 947756119 /nfs/dbraw/zinc/75/61/19/947756119.db2.gz XPLISXSTSQSMLR-UVTDQMKNSA-N -1 3 361.449 3.659 20 0 FHADHM O=S(=O)([N-]c1ccsc1Cl)c1cnn(-c2ccccc2F)c1 ZINC000189733226 947828793 /nfs/dbraw/zinc/82/87/93/947828793.db2.gz HDAHOVSQSWJIJY-UHFFFAOYSA-N -1 3 357.819 3.527 20 0 FHADHM O=C(c1ccc2c(c1[O-])CCCC2)N1CC2(CCOCC2)c2ccccc21 ZINC000189801450 947839621 /nfs/dbraw/zinc/83/96/21/947839621.db2.gz DOCZVCUVHGNSGM-UHFFFAOYSA-N -1 3 363.457 3.980 20 0 FHADHM Cc1ccc(CN[C@@H](c2cccc(-c3nnn[n-]3)c2)C(F)(F)F)c(C)c1 ZINC000826288568 947840019 /nfs/dbraw/zinc/84/00/19/947840019.db2.gz NHERCTNLSQUJSH-INIZCTEOSA-N -1 3 361.371 3.877 20 0 FHADHM Cc1ccc(CN[C@@H](c2cccc(-c3nn[n-]n3)c2)C(F)(F)F)c(C)c1 ZINC000826288568 947840023 /nfs/dbraw/zinc/84/00/23/947840023.db2.gz NHERCTNLSQUJSH-INIZCTEOSA-N -1 3 361.371 3.877 20 0 FHADHM Cc1ccc(Cl)c2ccc(NC(=O)c3cc(-c4nnn[n-]4)cs3)nc12 ZINC000826289434 947842466 /nfs/dbraw/zinc/84/24/66/947842466.db2.gz ZWLYLHYLDLJCRQ-UHFFFAOYSA-N -1 3 370.825 3.691 20 0 FHADHM Cc1ccc(Cl)c2ccc(NC(=O)c3cc(-c4nn[n-]n4)cs3)nc12 ZINC000826289434 947842471 /nfs/dbraw/zinc/84/24/71/947842471.db2.gz ZWLYLHYLDLJCRQ-UHFFFAOYSA-N -1 3 370.825 3.691 20 0 FHADHM Cc1ccc(SCCSc2nnc(C)c(C)c2-c2nnn[n-]2)cc1C ZINC000826293176 947852185 /nfs/dbraw/zinc/85/21/85/947852185.db2.gz DSBVWHVREIZNHJ-UHFFFAOYSA-N -1 3 372.523 3.775 20 0 FHADHM Cc1ccc(SCCSc2nnc(C)c(C)c2-c2nn[n-]n2)cc1C ZINC000826293176 947852192 /nfs/dbraw/zinc/85/21/92/947852192.db2.gz DSBVWHVREIZNHJ-UHFFFAOYSA-N -1 3 372.523 3.775 20 0 FHADHM CSc1ccc([O-])c(C(=O)N[C@H]2CC(C)(C)Oc3ccc(N)cc32)c1 ZINC000662563874 947904209 /nfs/dbraw/zinc/90/42/09/947904209.db2.gz JSILWPSHWPPRGP-HNNXBMFYSA-N -1 3 358.463 3.729 20 0 FHADHM Cc1nc(C)c(C)c(Sc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)n1 ZINC000826324082 947948171 /nfs/dbraw/zinc/94/81/71/947948171.db2.gz CXSKCFNYROBVHF-UHFFFAOYSA-N -1 3 366.372 3.752 20 0 FHADHM Cc1nc(C)c(C)c(Sc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)n1 ZINC000826324082 947948180 /nfs/dbraw/zinc/94/81/80/947948180.db2.gz CXSKCFNYROBVHF-UHFFFAOYSA-N -1 3 366.372 3.752 20 0 FHADHM CCC1([N-]S(=O)(=O)c2oc3ccc(Cl)cc3c2C)CCOCC1 ZINC000536416008 948044804 /nfs/dbraw/zinc/04/48/04/948044804.db2.gz LDNRTUFKHXOLNJ-UHFFFAOYSA-N -1 3 357.859 3.632 20 0 FHADHM Fc1ccc(CN[C@@H](c2cccc(-c3nnn[n-]3)c2)C(F)(F)F)cc1F ZINC000826374535 948160143 /nfs/dbraw/zinc/16/01/43/948160143.db2.gz CPLVCIFSXWPFTN-AWEZNQCLSA-N -1 3 369.297 3.538 20 0 FHADHM Fc1ccc(CN[C@@H](c2cccc(-c3nn[n-]n3)c2)C(F)(F)F)cc1F ZINC000826374535 948160152 /nfs/dbraw/zinc/16/01/52/948160152.db2.gz CPLVCIFSXWPFTN-AWEZNQCLSA-N -1 3 369.297 3.538 20 0 FHADHM O=C(Nc1nnc(C(F)(F)F)[n-]1)c1ccc(SC(F)(F)F)cc1 ZINC000036714261 948175782 /nfs/dbraw/zinc/17/57/82/948175782.db2.gz ZCQSLBXMXPLQNR-UHFFFAOYSA-N -1 3 356.251 3.688 20 0 FHADHM O=C(Nc1nc(C(F)(F)F)n[n-]1)c1ccc(SC(F)(F)F)cc1 ZINC000036714261 948175784 /nfs/dbraw/zinc/17/57/84/948175784.db2.gz ZCQSLBXMXPLQNR-UHFFFAOYSA-N -1 3 356.251 3.688 20 0 FHADHM CS(=O)(=O)[N-]c1ccc(C(=O)OCc2cccc3ccccc32)cc1 ZINC000029008192 948191373 /nfs/dbraw/zinc/19/13/73/948191373.db2.gz SWXMOUXIVHDIMS-UHFFFAOYSA-N -1 3 355.415 3.568 20 0 FHADHM CC[C@H](C)C(=O)N1CCC[C@@H](C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)C1 ZINC000134219119 948270264 /nfs/dbraw/zinc/27/02/64/948270264.db2.gz HIFCNRUGMJMWFM-NWDGAFQWSA-N -1 3 372.387 3.634 20 0 FHADHM CC(C)(C)OC(=O)N[C@@H](CCC(=O)Nc1ncccc1[O-])c1ccccc1 ZINC000729510506 948330541 /nfs/dbraw/zinc/33/05/41/948330541.db2.gz QGNGVEXNSYOXAO-HNNXBMFYSA-N -1 3 371.437 3.772 20 0 FHADHM O=C([O-])[C@H](CNCc1ccccc1OC1CCCC1)Oc1ccccc1 ZINC000417642723 948391716 /nfs/dbraw/zinc/39/17/16/948391716.db2.gz WVHZPOTYTNTSJM-FQEVSTJZSA-N -1 3 355.434 3.630 20 0 FHADHM Cc1c(C(=O)Nc2cc(-c3nnn[n-]3)ccc2F)sc2cccc(F)c12 ZINC001129729534 948470904 /nfs/dbraw/zinc/47/09/04/948470904.db2.gz YQZULDPAHSPIPC-UHFFFAOYSA-N -1 3 371.372 3.920 20 0 FHADHM Cc1c(C(=O)Nc2cc(-c3nn[n-]n3)ccc2F)sc2cccc(F)c12 ZINC001129729534 948470908 /nfs/dbraw/zinc/47/09/08/948470908.db2.gz YQZULDPAHSPIPC-UHFFFAOYSA-N -1 3 371.372 3.920 20 0 FHADHM Cc1ccc([C@@H]2OCCC[C@@H]2[N-]S(=O)(=O)c2ccc(Cl)s2)cc1 ZINC000467800792 948472714 /nfs/dbraw/zinc/47/27/14/948472714.db2.gz OPRZYKJULNURNT-BBRMVZONSA-N -1 3 371.911 3.909 20 0 FHADHM CC(C)=CCOc1cccc(C(=O)Nc2cc(-c3nnn[n-]3)ccc2F)c1 ZINC001436647448 948516539 /nfs/dbraw/zinc/51/65/39/948516539.db2.gz BRMTYAIGJGWCBY-UHFFFAOYSA-N -1 3 367.384 3.603 20 0 FHADHM CC(C)=CCOc1cccc(C(=O)Nc2cc(-c3nn[n-]n3)ccc2F)c1 ZINC001436647448 948516543 /nfs/dbraw/zinc/51/65/43/948516543.db2.gz BRMTYAIGJGWCBY-UHFFFAOYSA-N -1 3 367.384 3.603 20 0 FHADHM Cc1nc2cc(Br)cc([N-]C(=O)c3ncc(F)cc3F)c2o1 ZINC000190718061 948524210 /nfs/dbraw/zinc/52/42/10/948524210.db2.gz HCVNIWLHQTUMGO-UHFFFAOYSA-N -1 3 368.137 3.824 20 0 FHADHM CN(C)[C@H]1CCOc2c([N-]S(=O)(=O)c3ccc(Cl)cc3)cccc21 ZINC000432488342 948565897 /nfs/dbraw/zinc/56/58/97/948565897.db2.gz DPRKPNUYYRFFIA-INIZCTEOSA-N -1 3 366.870 3.526 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCCCC2)C(C)(F)F ZINC001573754090 948725129 /nfs/dbraw/zinc/72/51/29/948725129.db2.gz BDSZJVMUXADEBK-VIFPVBQESA-N -1 3 369.441 3.817 20 0 FHADHM C[C@@H](C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCCCC2)C(C)(F)F ZINC001573754090 948725138 /nfs/dbraw/zinc/72/51/38/948725138.db2.gz BDSZJVMUXADEBK-VIFPVBQESA-N -1 3 369.441 3.817 20 0 FHADHM Cc1ccc(-c2nc(CC(=O)Nc3ccc(F)c(Cl)c3)no2)c([O-])c1 ZINC000445378122 948744720 /nfs/dbraw/zinc/74/47/20/948744720.db2.gz BNTYCBQPXYHFFN-UHFFFAOYSA-N -1 3 361.760 3.724 20 0 FHADHM CS(=O)(=O)[N-]c1ccc(-c2nc(-c3cccc(Cl)c3F)no2)cc1 ZINC000445383984 948751582 /nfs/dbraw/zinc/75/15/82/948751582.db2.gz KJOWITOTYYKEEJ-UHFFFAOYSA-N -1 3 367.789 3.568 20 0 FHADHM CC(C)[C@@H](F)C(=O)Nc1ccc(Sc2ccccc2-c2nnn[n-]2)cc1 ZINC001574078599 948755738 /nfs/dbraw/zinc/75/57/38/948755738.db2.gz FEHONPPOPGFLBD-MRXNPFEDSA-N -1 3 371.441 3.951 20 0 FHADHM CC(C)[C@@H](F)C(=O)Nc1ccc(Sc2ccccc2-c2nn[n-]n2)cc1 ZINC001574078599 948755752 /nfs/dbraw/zinc/75/57/52/948755752.db2.gz FEHONPPOPGFLBD-MRXNPFEDSA-N -1 3 371.441 3.951 20 0 FHADHM O=S(=O)([N-]Cc1cccc(Cl)c1)c1ccc(Br)s1 ZINC000014225335 220116835 /nfs/dbraw/zinc/11/68/35/220116835.db2.gz KGJWAFRFEHKUQI-UHFFFAOYSA-N -1 3 366.689 3.643 20 0 FHADHM CC(=O)Nc1cccc(NC(=O)c2c[n-]nc2-c2ccc(Cl)cc2)c1 ZINC000014211119 220117186 /nfs/dbraw/zinc/11/71/86/220117186.db2.gz OZEIRRVDEWFWTQ-UHFFFAOYSA-N -1 3 354.797 3.941 20 0 FHADHM Cc1ccc(-n2cc(C(=O)[N-]c3nncs3)c(-c3ccccc3)n2)cc1 ZINC000021213603 220355173 /nfs/dbraw/zinc/35/51/73/220355173.db2.gz QAYOWEPBOKIZAJ-UHFFFAOYSA-N -1 3 361.430 3.952 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)c3ccccc3Cl)c2)n1 ZINC000049302898 221020690 /nfs/dbraw/zinc/02/06/90/221020690.db2.gz HRJGHXWZHZEAHW-UHFFFAOYSA-N -1 3 353.809 3.905 20 0 FHADHM COc1ccc(C(=O)N2CCC(Oc3cc(C)ccc3C)CC2)c([O-])c1 ZINC000055708955 221073788 /nfs/dbraw/zinc/07/37/88/221073788.db2.gz UOANOOBWVYZXPF-UHFFFAOYSA-N -1 3 355.434 3.701 20 0 FHADHM Cc1nc(-c2cccc([N-]S(=O)(=O)c3c(C)cc(C)cc3C)c2)no1 ZINC000063849776 221143752 /nfs/dbraw/zinc/14/37/52/221143752.db2.gz BLBRVVGNXHQNTR-UHFFFAOYSA-N -1 3 357.435 3.771 20 0 FHADHM Cc1ncc(C[N-]S(=O)(=O)c2ccc(Cl)c(C(F)(F)F)c2)s1 ZINC000098038987 222222022 /nfs/dbraw/zinc/22/20/22/222222022.db2.gz CJVMDYBJXBSWKB-UHFFFAOYSA-N -1 3 370.805 3.602 20 0 FHADHM CN(C)[C@@H](C[N-]S(=O)(=O)c1c(Cl)cccc1Cl)c1ccccc1 ZINC000098068617 222224566 /nfs/dbraw/zinc/22/45/66/222224566.db2.gz LFXPSTWDTZIOJQ-HNNXBMFYSA-N -1 3 373.305 3.575 20 0 FHADHM C[C@@H]1C[C@@H](NC(=O)c2csc(=NC3CC3)[n-]2)CCN1Cc1ccccc1 ZINC000476563181 515104385 /nfs/dbraw/zinc/10/43/85/515104385.db2.gz JECREBCMMOLRGF-PBHICJAKSA-N -1 3 370.522 3.500 20 0 FHADHM CCCCCc1n[n-]c(=NC(=O)N[C@H](C)CN2CCC[C@@H](C)C2)s1 ZINC000510384188 515524127 /nfs/dbraw/zinc/52/41/27/515524127.db2.gz ZTVASGGVJWNDJK-ZIAGYGMSSA-N -1 3 353.536 3.513 20 0 FHADHM COC(=O)c1ccc(C(=O)N=c2cc(-c3ccccc3C)[n-][nH]2)c(F)c1 ZINC000477613429 515526053 /nfs/dbraw/zinc/52/60/53/515526053.db2.gz BNDISBSEXRYAJH-UHFFFAOYSA-N -1 3 353.353 3.563 20 0 FHADHM O=C(N=c1cc2ccc(Br)cn2[n-]1)NCCc1ccsc1 ZINC000482158899 515592545 /nfs/dbraw/zinc/59/25/45/515592545.db2.gz MOUQGSYACHUHJJ-UHFFFAOYSA-N -1 3 365.256 3.523 20 0 FHADHM Cc1cc(C)cc(-c2cc(=NC(=O)[C@H]3CCN(CC(F)(F)F)C3)[nH][n-]2)c1 ZINC000473404469 515606786 /nfs/dbraw/zinc/60/67/86/515606786.db2.gz WPVATNOPCINWBH-ZDUSSCGKSA-N -1 3 366.387 3.516 20 0 FHADHM CC(=O)c1ccc(C(=O)N=c2cc3ccc(Br)cn3[n-]2)cc1 ZINC000511337294 515869289 /nfs/dbraw/zinc/86/92/89/515869289.db2.gz HOGDKIKRGJIVQV-UHFFFAOYSA-N -1 3 358.195 3.552 20 0 FHADHM Cc1cc(C)cc(-c2cc(=NC(=O)c3ccc4c(c3)[nH]c(=O)n4C)[nH][n-]2)c1 ZINC000523504028 516489362 /nfs/dbraw/zinc/48/93/62/516489362.db2.gz VOBUKJMHNCQZDQ-UHFFFAOYSA-N -1 3 361.405 3.538 20 0 FHADHM CCC(CC)c1n[n-]c(=NC(=O)N2CC[C@H](N3CCCCC3)C2)s1 ZINC000518626379 516726055 /nfs/dbraw/zinc/72/60/55/516726055.db2.gz VCJJQODEWBYBHI-AWEZNQCLSA-N -1 3 351.520 3.534 20 0 FHADHM CCCN1CCN(c2ccccc2CN=c2[n-]nc(C(C)(C)C)o2)CC1 ZINC000541824892 517233812 /nfs/dbraw/zinc/23/38/12/517233812.db2.gz UMLUSNZTBWYPCM-UHFFFAOYSA-N -1 3 357.502 3.511 20 0 FHADHM O=C(N=c1cc([C@H]2CCCO2)[n-][nH]1)c1cccc(OCc2cscn2)c1 ZINC000525968468 517262330 /nfs/dbraw/zinc/26/23/30/517262330.db2.gz LXPXDUJRAXTWHB-MRXNPFEDSA-N -1 3 370.434 3.549 20 0 FHADHM O=C(Cc1csc(-c2ccccc2)n1)N=c1cc([C@H]2CCCO2)[n-][nH]1 ZINC000526959883 517411584 /nfs/dbraw/zinc/41/15/84/517411584.db2.gz MRBXMSXUNKOGMU-OAHLLOKOSA-N -1 3 354.435 3.566 20 0 FHADHM O=C(N=c1cc(-c2ccccc2)[n-][nH]1)[C@@H]1CCCN(C(=O)c2ccccc2)C1 ZINC000520911782 517549509 /nfs/dbraw/zinc/54/95/09/517549509.db2.gz ITRRVTBFWQTAAW-GOSISDBHSA-N -1 3 374.444 3.568 20 0 FHADHM O=C(CCCc1ccc([O-])c(F)c1)Nc1cccc(OCC(F)F)n1 ZINC000530350275 517720914 /nfs/dbraw/zinc/72/09/14/517720914.db2.gz NIRWBXYLWUGUMK-UHFFFAOYSA-N -1 3 354.328 3.532 20 0 FHADHM Cc1[n-][nH]c(=NC(=O)[C@@H]2C[C@H](C)Cc3c[nH]nc32)c1-c1ccccc1F ZINC000527614034 517796943 /nfs/dbraw/zinc/79/69/43/517796943.db2.gz LXFYGITZEOTBDS-QMTHXVAHSA-N -1 3 353.401 3.552 20 0 FHADHM COCc1nc(C)c(C(=O)N=c2cc(-c3cc(F)cc(F)c3)[n-][nH]2)s1 ZINC000534723199 518013176 /nfs/dbraw/zinc/01/31/76/518013176.db2.gz XZGMZPODQMRFHS-UHFFFAOYSA-N -1 3 364.377 3.519 20 0 FHADHM CNc1ccc(C(F)(F)F)cc1C(=O)N=c1cc([C@H]2CCCO2)[n-][nH]1 ZINC000616823576 520162675 /nfs/dbraw/zinc/16/26/75/520162675.db2.gz RCWIBCQOUIWXLE-CYBMUJFWSA-N -1 3 354.332 3.574 20 0 FHADHM COc1cc(C(=O)N=c2cc([C@@H]3CCCO3)[n-][nH]2)ccc1C(F)(F)F ZINC000616825378 520164825 /nfs/dbraw/zinc/16/48/25/520164825.db2.gz XCZGHKUGWYTXDT-LBPRGKRZSA-N -1 3 355.316 3.541 20 0 FHADHM Cc1[n-][nH]c(=NC(=O)[C@H]2CC(=O)N(C3CCCCC3)C2)c1-c1ccccc1 ZINC000623490031 522063314 /nfs/dbraw/zinc/06/33/14/522063314.db2.gz CXEJDYVKLXHUDZ-INIZCTEOSA-N -1 3 366.465 3.505 20 0 FHADHM Cc1csc([C@H](C)NC(=O)c2ccc(C(=O)c3cccc([O-])c3)cc2)n1 ZINC000186511409 567929234 /nfs/dbraw/zinc/92/92/34/567929234.db2.gz OKNZMBJOMXZGIR-ZDUSSCGKSA-N -1 3 366.442 3.879 20 0 FHADHM COC(=O)c1cc(Cl)c(Cl)c([N-]C(=O)c2ncoc2C2CC2)c1 ZINC000602424438 567978995 /nfs/dbraw/zinc/97/89/95/567978995.db2.gz ZBGQGZPIJPKBPQ-UHFFFAOYSA-N -1 3 355.177 3.898 20 0 FHADHM COc1ccc([C@H]([N-]S(=O)(=O)c2ccccc2SC)C2CC2)cc1 ZINC000186898609 568005276 /nfs/dbraw/zinc/00/52/76/568005276.db2.gz ULRHAURCBMSPOL-GOSISDBHSA-N -1 3 363.504 3.847 20 0 FHADHM CCOC[C@H]1CCCN(C(=O)c2ccc(C(=O)c3cccc([O-])c3)cc2)C1 ZINC000186976750 568033196 /nfs/dbraw/zinc/03/31/96/568033196.db2.gz QZTCQOKNZSYQBI-INIZCTEOSA-N -1 3 367.445 3.512 20 0 FHADHM Cc1ccc(-c2nsc([N-]C(=O)c3cnc4ccccc4n3)n2)s1 ZINC000066413145 568067137 /nfs/dbraw/zinc/06/71/37/568067137.db2.gz AZHAYUVWMKCXHE-UHFFFAOYSA-N -1 3 353.432 3.771 20 0 FHADHM C[C@@H](NC(=O)NCc1ccc([O-])c(F)c1)c1nc(C(C)(C)C)cs1 ZINC000159315919 568134049 /nfs/dbraw/zinc/13/40/49/568134049.db2.gz MTRYXCNFRIOEEW-SNVBAGLBSA-N -1 3 351.447 3.846 20 0 FHADHM CCOC(=O)c1ncc(NC(=O)c2cc3c(s2)-c2ccccc2CC3)[n-]1 ZINC000617876437 568164265 /nfs/dbraw/zinc/16/42/65/568164265.db2.gz OSYGIUIWGBMWJL-UHFFFAOYSA-N -1 3 367.430 3.666 20 0 FHADHM CCOC(=O)c1nc(NC(=O)c2cc3c(s2)-c2ccccc2CC3)c[n-]1 ZINC000617876437 568164266 /nfs/dbraw/zinc/16/42/66/568164266.db2.gz OSYGIUIWGBMWJL-UHFFFAOYSA-N -1 3 367.430 3.666 20 0 FHADHM COC(=O)c1ccc(S(=O)(=O)[N-][C@H](CC(C)C)c2ccccc2)s1 ZINC000603957605 568189889 /nfs/dbraw/zinc/18/98/89/568189889.db2.gz WKIFKWSUHHEJFS-CQSZACIVSA-N -1 3 367.492 3.600 20 0 FHADHM CC(C)(C[N-]S(=O)(=O)c1cc(F)ccc1Cl)Oc1ccccc1 ZINC000604057559 568204242 /nfs/dbraw/zinc/20/42/42/568204242.db2.gz WYERXFJJAZZJLJ-UHFFFAOYSA-N -1 3 357.834 3.615 20 0 FHADHM O=S(=O)([N-]Cc1ccc2ccccc2n1)c1cc(F)ccc1Cl ZINC000604149070 568217139 /nfs/dbraw/zinc/21/71/39/568217139.db2.gz VBOSZJKIRWIHQE-UHFFFAOYSA-N -1 3 350.802 3.506 20 0 FHADHM Cc1ccc(S(=O)(=O)[N-]c2cccc(-c3nccc(C)n3)c2)c(C)c1 ZINC000604305171 568247332 /nfs/dbraw/zinc/24/73/32/568247332.db2.gz ILSVQFKZOPZWIH-UHFFFAOYSA-N -1 3 353.447 3.870 20 0 FHADHM O=S(=O)([N-]c1ccc(SCCN2CCCCC2)cc1)c1ccco1 ZINC000563136363 568275589 /nfs/dbraw/zinc/27/55/89/568275589.db2.gz ZNOJMTPHOMOBEM-UHFFFAOYSA-N -1 3 366.508 3.658 20 0 FHADHM COc1ccc2c(c1)[n-]cc(C(=O)N1C[C@H](c3ccccc3)C[C@H]1C)c2=O ZINC000604605393 568325427 /nfs/dbraw/zinc/32/54/27/568325427.db2.gz LYPAZTVTPONREH-GDBMZVCRSA-N -1 3 362.429 3.555 20 0 FHADHM COc1ccc(OC)c(S(=O)(=O)[N-]c2c(C)cc(C)cc2Cl)c1 ZINC000033897045 568328837 /nfs/dbraw/zinc/32/88/37/568328837.db2.gz WACYOSSUYMNDSE-UHFFFAOYSA-N -1 3 355.843 3.775 20 0 FHADHM CC[C@H](Cc1ccc(Cl)cc1)NC(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000604755518 568364763 /nfs/dbraw/zinc/36/47/63/568364763.db2.gz BJUZWNINIGCLDG-OAHLLOKOSA-N -1 3 354.837 3.933 20 0 FHADHM COc1ccccc1-c1cc(=NC(=O)C[C@@H](C)c2cccc(F)c2)[nH][n-]1 ZINC000604787995 568366984 /nfs/dbraw/zinc/36/69/84/568366984.db2.gz AGJDFOFXLKNZSY-CYBMUJFWSA-N -1 3 353.397 3.779 20 0 FHADHM Cc1cc(Cl)cc(NC(=O)[C@H]2CCCN(Cc3cccnc3)C2)c1[O-] ZINC000604901597 568384771 /nfs/dbraw/zinc/38/47/71/568384771.db2.gz JRLIYCIVTHANLF-HNNXBMFYSA-N -1 3 359.857 3.600 20 0 FHADHM CC(C)[C@H](Sc1n[n-]c(-c2ccccn2)n1)C(=O)NC1CCCCCC1 ZINC000604933121 568395441 /nfs/dbraw/zinc/39/54/41/568395441.db2.gz BFBZSWNZJBJCEN-INIZCTEOSA-N -1 3 373.526 3.822 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2ccc(OC(F)F)cc2)c(C)c1C 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MUESQZDWAVASKC-KBPBESRZSA-N -1 3 350.484 3.521 20 0 FHADHM CC(C)c1cc(C(=O)N2C[C@H](C)O[C@]3(CCOC3)C2)c([O-])c(C(C)C)c1 ZINC000408329769 568693712 /nfs/dbraw/zinc/69/37/12/568693712.db2.gz ZTHRVCYEXZBTMP-YCRPNKLZSA-N -1 3 361.482 3.659 20 0 FHADHM O=C([O-])[C@@H]1CN(Cc2ccc(Cl)c3cccnc23)C[C@H]1C(F)(F)F ZINC000299746520 571338388 /nfs/dbraw/zinc/33/83/88/571338388.db2.gz XYOOPJLTZOOQKO-VXGBXAGGSA-N -1 3 358.747 3.583 20 0 FHADHM COc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)[C@H](C)c1cccc(C)c1 ZINC000737027199 598829110 /nfs/dbraw/zinc/82/91/10/598829110.db2.gz ZTAZNNDAOLFXRZ-LLVKDONJSA-N -1 3 372.812 3.546 20 0 FHADHM COc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)[C@H](C)c1cccc(C)c1 ZINC000737027199 598829111 /nfs/dbraw/zinc/82/91/11/598829111.db2.gz ZTAZNNDAOLFXRZ-LLVKDONJSA-N -1 3 372.812 3.546 20 0 FHADHM Cc1cccc([C@H](C)C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCC3)c1 ZINC000737385023 598830093 /nfs/dbraw/zinc/83/00/93/598830093.db2.gz QOXRJAPZPAJATI-LBPRGKRZSA-N -1 3 367.478 3.858 20 0 FHADHM Cc1cccc([C@H](C)C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCC3)c1 ZINC000737385023 598830095 /nfs/dbraw/zinc/83/00/95/598830095.db2.gz QOXRJAPZPAJATI-LBPRGKRZSA-N -1 3 367.478 3.858 20 0 FHADHM CC(C)[C@@H](C)C(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000735699646 598833418 /nfs/dbraw/zinc/83/34/18/598833418.db2.gz CHZYQDNPQMRJHP-GFCCVEGCSA-N -1 3 355.467 3.504 20 0 FHADHM CCc1ccc([C@H]2CCCCCN2C(=O)c2sccc2-c2nnn[n-]2)o1 ZINC000736685033 598835456 /nfs/dbraw/zinc/83/54/56/598835456.db2.gz JSXGONWXANDZHO-CQSZACIVSA-N -1 3 371.466 3.841 20 0 FHADHM CCc1ccc([C@H]2CCCCCN2C(=O)c2sccc2-c2nn[n-]n2)o1 ZINC000736685033 598835457 /nfs/dbraw/zinc/83/54/57/598835457.db2.gz JSXGONWXANDZHO-CQSZACIVSA-N -1 3 371.466 3.841 20 0 FHADHM O=C(NCC1(c2cccs2)CCCCC1)c1sccc1-c1nnn[n-]1 ZINC000738044833 598836659 /nfs/dbraw/zinc/83/66/59/598836659.db2.gz LWIZGFPIIOOSDH-UHFFFAOYSA-N -1 3 373.507 3.622 20 0 FHADHM O=C(NCC1(c2cccs2)CCCCC1)c1sccc1-c1nn[n-]n1 ZINC000738044833 598836661 /nfs/dbraw/zinc/83/66/61/598836661.db2.gz LWIZGFPIIOOSDH-UHFFFAOYSA-N -1 3 373.507 3.622 20 0 FHADHM COc1cc(Cl)c(C)cc1NC(=O)Nc1cc(-c2nnn[n-]2)ccc1C ZINC000737048121 598850933 /nfs/dbraw/zinc/85/09/33/598850933.db2.gz WVMLNNMEUNXIOW-UHFFFAOYSA-N -1 3 372.816 3.790 20 0 FHADHM COc1cc(Cl)c(C)cc1NC(=O)Nc1cc(-c2nn[n-]n2)ccc1C ZINC000737048121 598850934 /nfs/dbraw/zinc/85/09/34/598850934.db2.gz WVMLNNMEUNXIOW-UHFFFAOYSA-N -1 3 372.816 3.790 20 0 FHADHM Cc1cc(C)nc(NCc2cccc(-c3ccc(-c4nnn[n-]4)s3)c2)n1 ZINC000737255518 598853897 /nfs/dbraw/zinc/85/38/97/598853897.db2.gz APPPLAFXIIPONE-UHFFFAOYSA-N -1 3 363.450 3.614 20 0 FHADHM Fc1cc(-c2nnn[n-]2)cc(F)c1NCc1ccccc1OCC1CC1 ZINC000737640213 598856155 /nfs/dbraw/zinc/85/61/55/598856155.db2.gz VGMYHQIJJNWXCR-UHFFFAOYSA-N -1 3 357.364 3.546 20 0 FHADHM Fc1cc(-c2nn[n-]n2)cc(F)c1NCc1ccccc1OCC1CC1 ZINC000737640213 598856157 /nfs/dbraw/zinc/85/61/57/598856157.db2.gz VGMYHQIJJNWXCR-UHFFFAOYSA-N -1 3 357.364 3.546 20 0 FHADHM Clc1cc(N[C@H](c2ccccc2)[C@H]2CCCO2)ccc1-c1nnn[n-]1 ZINC000737562907 598870614 /nfs/dbraw/zinc/87/06/14/598870614.db2.gz AFOAORFLGYPSHJ-IAGOWNOFSA-N -1 3 355.829 3.852 20 0 FHADHM Clc1cc(N[C@H](c2ccccc2)[C@H]2CCCO2)ccc1-c1nn[n-]n1 ZINC000737562907 598870615 /nfs/dbraw/zinc/87/06/15/598870615.db2.gz AFOAORFLGYPSHJ-IAGOWNOFSA-N -1 3 355.829 3.852 20 0 FHADHM CC(C)(C)OC(=O)NCc1cccc(-c2ccc(-c3nnn[n-]3)s2)c1 ZINC000735640097 598876612 /nfs/dbraw/zinc/87/66/12/598876612.db2.gz XEAIJJFHLNHQTG-UHFFFAOYSA-N -1 3 357.439 3.620 20 0 FHADHM CC[C@H]1CCCCCN1C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000736398515 598889309 /nfs/dbraw/zinc/88/93/09/598889309.db2.gz AZRLBCLPUQPHOB-AWEZNQCLSA-N -1 3 359.478 3.610 20 0 FHADHM CC[C@H]1CCCCCN1C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000736398515 598889311 /nfs/dbraw/zinc/88/93/11/598889311.db2.gz AZRLBCLPUQPHOB-AWEZNQCLSA-N -1 3 359.478 3.610 20 0 FHADHM C[C@@H](Oc1ccc(-c2nn[n-]n2)cc1)C(=O)OCc1ccc2ccccc2c1 ZINC000736170568 598894237 /nfs/dbraw/zinc/89/42/37/598894237.db2.gz VJDPOZGVCAHQCP-CQSZACIVSA-N -1 3 374.400 3.531 20 0 FHADHM Cc1ccc(CN(C(=O)Nc2cccc(-c3nnn[n-]3)c2)C2CC2)cc1C ZINC000737336479 598913706 /nfs/dbraw/zinc/91/37/06/598913706.db2.gz FJWPZOZXJVJEEE-UHFFFAOYSA-N -1 3 362.437 3.680 20 0 FHADHM Cc1ccc(CN(C(=O)Nc2cccc(-c3nn[n-]n3)c2)C2CC2)cc1C ZINC000737336479 598913708 /nfs/dbraw/zinc/91/37/08/598913708.db2.gz FJWPZOZXJVJEEE-UHFFFAOYSA-N -1 3 362.437 3.680 20 0 FHADHM CC[C@H](CC1CCCC1)C(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000736348460 598923853 /nfs/dbraw/zinc/92/38/53/598923853.db2.gz BPLDNAJKRQLQPG-QGZVFWFLSA-N -1 3 367.497 3.964 20 0 FHADHM CC[C@H](CC1CCCC1)C(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000736348460 598923854 /nfs/dbraw/zinc/92/38/54/598923854.db2.gz BPLDNAJKRQLQPG-QGZVFWFLSA-N -1 3 367.497 3.964 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)C=C1CCC(C)CC1 ZINC000736242025 598925994 /nfs/dbraw/zinc/92/59/94/598925994.db2.gz YUBKQKOYHZXVOU-UHFFFAOYSA-N -1 3 353.470 3.740 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)C=C1CCC(C)CC1 ZINC000736242025 598925995 /nfs/dbraw/zinc/92/59/95/598925995.db2.gz YUBKQKOYHZXVOU-UHFFFAOYSA-N -1 3 353.470 3.740 20 0 FHADHM C[C@H]1CC(=O)c2c1c(F)ccc2Oc1ncc(-c2nnn[n-]2)cc1Cl ZINC000736226078 598935427 /nfs/dbraw/zinc/93/54/27/598935427.db2.gz VASYUKRDMQGQGK-ZETCQYMHSA-N -1 3 359.748 3.536 20 0 FHADHM C[C@H]1CC(=O)c2c1c(F)ccc2Oc1ncc(-c2nn[n-]n2)cc1Cl ZINC000736226078 598935429 /nfs/dbraw/zinc/93/54/29/598935429.db2.gz VASYUKRDMQGQGK-ZETCQYMHSA-N -1 3 359.748 3.536 20 0 FHADHM Fc1ccc2c(c1)[C@H](Nc1ncc(-c3nnn[n-]3)cc1Cl)CCS2 ZINC000737668747 598936764 /nfs/dbraw/zinc/93/67/64/598936764.db2.gz XJYUDHWUMIOSGR-GFCCVEGCSA-N -1 3 362.821 3.703 20 0 FHADHM Fc1ccc2c(c1)[C@H](Nc1ncc(-c3nn[n-]n3)cc1Cl)CCS2 ZINC000737668747 598936766 /nfs/dbraw/zinc/93/67/66/598936766.db2.gz XJYUDHWUMIOSGR-GFCCVEGCSA-N -1 3 362.821 3.703 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1OCCSc1cccc(Cl)c1 ZINC000737033579 598939832 /nfs/dbraw/zinc/93/98/32/598939832.db2.gz XUXAMSKSZVMOTR-UHFFFAOYSA-N -1 3 362.842 3.700 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1OCCSc1cccc(Cl)c1 ZINC000737033579 598939833 /nfs/dbraw/zinc/93/98/33/598939833.db2.gz XUXAMSKSZVMOTR-UHFFFAOYSA-N -1 3 362.842 3.700 20 0 FHADHM CCCN(c1ncc(-c2nnn[n-]2)cc1Cl)[C@H](C)c1ccccc1OC ZINC000736478660 598939881 /nfs/dbraw/zinc/93/98/81/598939881.db2.gz CDZGSUCBPOVXNB-GFCCVEGCSA-N -1 3 372.860 3.901 20 0 FHADHM CCCN(c1ncc(-c2nn[n-]n2)cc1Cl)[C@H](C)c1ccccc1OC ZINC000736478660 598939883 /nfs/dbraw/zinc/93/98/83/598939883.db2.gz CDZGSUCBPOVXNB-GFCCVEGCSA-N -1 3 372.860 3.901 20 0 FHADHM Fc1cccc2c1C1(CCC1)CN2c1ncc(-c2nnn[n-]2)cc1Cl ZINC000737663584 598940287 /nfs/dbraw/zinc/94/02/87/598940287.db2.gz JEDBRTIXLBVQKP-UHFFFAOYSA-N -1 3 356.792 3.628 20 0 FHADHM Fc1cccc2c1C1(CCC1)CN2c1ncc(-c2nn[n-]n2)cc1Cl ZINC000737663584 598940288 /nfs/dbraw/zinc/94/02/88/598940288.db2.gz JEDBRTIXLBVQKP-UHFFFAOYSA-N -1 3 356.792 3.628 20 0 FHADHM Fc1cc(Oc2ncc(-c3nnn[n-]3)cc2Cl)ccc1Br ZINC000737654020 598942868 /nfs/dbraw/zinc/94/28/68/598942868.db2.gz VTYHFXBNQYBPNF-UHFFFAOYSA-N -1 3 370.569 3.609 20 0 FHADHM Fc1cc(Oc2ncc(-c3nn[n-]n3)cc2Cl)ccc1Br ZINC000737654020 598942869 /nfs/dbraw/zinc/94/28/69/598942869.db2.gz VTYHFXBNQYBPNF-UHFFFAOYSA-N -1 3 370.569 3.609 20 0 FHADHM CC[C@H](Nc1ncc(-c2nnn[n-]2)cc1Cl)c1cc(F)ccc1F ZINC000736370427 598975237 /nfs/dbraw/zinc/97/52/37/598975237.db2.gz RITMUZDUQDTYKF-ZDUSSCGKSA-N -1 3 350.760 3.757 20 0 FHADHM CC[C@H](Nc1ncc(-c2nn[n-]n2)cc1Cl)c1cc(F)ccc1F ZINC000736370427 598975238 /nfs/dbraw/zinc/97/52/38/598975238.db2.gz RITMUZDUQDTYKF-ZDUSSCGKSA-N -1 3 350.760 3.757 20 0 FHADHM Cc1ccc(C(=O)Nc2cccc(-c3nnn[n-]3)c2)cc1Oc1ccncc1 ZINC000578157623 598980155 /nfs/dbraw/zinc/98/01/55/598980155.db2.gz CWPBMYUMJOVHIT-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccc(C(=O)Nc2cccc(-c3nn[n-]n3)c2)cc1Oc1ccncc1 ZINC000578157623 598980156 /nfs/dbraw/zinc/98/01/56/598980156.db2.gz CWPBMYUMJOVHIT-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM CC[C@@H](OC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1cccc(OC)c1 ZINC000736379711 599028108 /nfs/dbraw/zinc/02/81/08/599028108.db2.gz CVYRBBKVRQUKOV-YUIUBULTSA-N -1 3 364.405 3.583 20 0 FHADHM CC[C@@H](OC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1cccc(OC)c1 ZINC000736379711 599028110 /nfs/dbraw/zinc/02/81/10/599028110.db2.gz CVYRBBKVRQUKOV-YUIUBULTSA-N -1 3 364.405 3.583 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(NCc2ccc(Cl)cc2)n1 ZINC000737635913 599037721 /nfs/dbraw/zinc/03/77/21/599037721.db2.gz PWZUEHPRPLJDPR-UHFFFAOYSA-N -1 3 354.723 3.546 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(NCc2ccc(Cl)cc2)n1 ZINC000737635913 599037724 /nfs/dbraw/zinc/03/77/24/599037724.db2.gz PWZUEHPRPLJDPR-UHFFFAOYSA-N -1 3 354.723 3.546 20 0 FHADHM CC1(C)CCCN(c2c(-c3nnn[n-]3)cnc3c(F)cc(F)cc32)CC1 ZINC000820594878 599037931 /nfs/dbraw/zinc/03/79/31/599037931.db2.gz DWXLAZFBAZNXGY-UHFFFAOYSA-N -1 3 358.396 3.710 20 0 FHADHM CC1(C)CCCN(c2c(-c3nn[n-]n3)cnc3c(F)cc(F)cc32)CC1 ZINC000820594878 599037933 /nfs/dbraw/zinc/03/79/33/599037933.db2.gz DWXLAZFBAZNXGY-UHFFFAOYSA-N -1 3 358.396 3.710 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N2CCC(c3ccccc3)CC2)n1 ZINC000737630977 599041711 /nfs/dbraw/zinc/04/17/11/599041711.db2.gz AFPQHOWVEOKQOH-UHFFFAOYSA-N -1 3 374.370 3.665 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N2CCC(c3ccccc3)CC2)n1 ZINC000737630977 599041714 /nfs/dbraw/zinc/04/17/14/599041714.db2.gz AFPQHOWVEOKQOH-UHFFFAOYSA-N -1 3 374.370 3.665 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N[C@H](c2ccccc2)C2CC2)n1 ZINC000737633245 599042152 /nfs/dbraw/zinc/04/21/52/599042152.db2.gz PLTWAQZUMLWHNI-CQSZACIVSA-N -1 3 360.343 3.844 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N[C@H](c2ccccc2)C2CC2)n1 ZINC000737633245 599042154 /nfs/dbraw/zinc/04/21/54/599042154.db2.gz PLTWAQZUMLWHNI-CQSZACIVSA-N -1 3 360.343 3.844 20 0 FHADHM CC1(C)[C@H](Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)[C@@H]2CCCO[C@@H]21 ZINC000820582915 599042816 /nfs/dbraw/zinc/04/28/16/599042816.db2.gz AOWCEPQABJTLTO-YUTCNCBUSA-N -1 3 367.375 3.501 20 0 FHADHM CC1(C)[C@H](Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)[C@@H]2CCCO[C@@H]21 ZINC000820582915 599042819 /nfs/dbraw/zinc/04/28/19/599042819.db2.gz AOWCEPQABJTLTO-YUTCNCBUSA-N -1 3 367.375 3.501 20 0 FHADHM C[C@H](CNc1nc(C(F)(F)F)ccc1-c1nnn[n-]1)c1ccc(F)cc1 ZINC000736025447 599049067 /nfs/dbraw/zinc/04/90/67/599049067.db2.gz GOWRSQUGJVLPAU-SECBINFHSA-N -1 3 366.322 3.635 20 0 FHADHM C[C@H](CNc1nc(C(F)(F)F)ccc1-c1nn[n-]n1)c1ccc(F)cc1 ZINC000736025447 599049070 /nfs/dbraw/zinc/04/90/70/599049070.db2.gz GOWRSQUGJVLPAU-SECBINFHSA-N -1 3 366.322 3.635 20 0 FHADHM CC[C@@H](Cc1ccccc1)Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1 ZINC000736353246 599053821 /nfs/dbraw/zinc/05/38/21/599053821.db2.gz VNVMCGTXOBNXRI-LBPRGKRZSA-N -1 3 362.359 3.714 20 0 FHADHM CC[C@@H](Cc1ccccc1)Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1 ZINC000736353246 599053824 /nfs/dbraw/zinc/05/38/24/599053824.db2.gz VNVMCGTXOBNXRI-LBPRGKRZSA-N -1 3 362.359 3.714 20 0 FHADHM CC(C)C1CCN(c2c(-c3nnn[n-]3)cnc3c(F)ccc(F)c32)CC1 ZINC000820045961 599054178 /nfs/dbraw/zinc/05/41/78/599054178.db2.gz PCXUHPMMJVRZRW-UHFFFAOYSA-N -1 3 358.396 3.566 20 0 FHADHM CC(C)C1CCN(c2c(-c3nn[n-]n3)cnc3c(F)ccc(F)c32)CC1 ZINC000820045961 599054180 /nfs/dbraw/zinc/05/41/80/599054180.db2.gz PCXUHPMMJVRZRW-UHFFFAOYSA-N -1 3 358.396 3.566 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N[C@@H]2CC[C@H]3CCC[C@@H]3C2)n1 ZINC000822723869 599055212 /nfs/dbraw/zinc/05/52/12/599055212.db2.gz RPWNDTREHNDGJE-GMTAPVOTSA-N -1 3 352.364 3.661 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N[C@@H]2CC[C@H]3CCC[C@@H]3C2)n1 ZINC000822723869 599055215 /nfs/dbraw/zinc/05/52/15/599055215.db2.gz RPWNDTREHNDGJE-GMTAPVOTSA-N -1 3 352.364 3.661 20 0 FHADHM Cc1cc(C(=O)CSc2ccc(-c3nnn[n-]3)cc2F)c(C)n1C1CC1 ZINC000737228400 599064307 /nfs/dbraw/zinc/06/43/07/599064307.db2.gz YLVKTAYJIWJPBG-UHFFFAOYSA-N -1 3 371.441 3.734 20 0 FHADHM Cc1cc(C(=O)CSc2ccc(-c3nn[n-]n3)cc2F)c(C)n1C1CC1 ZINC000737228400 599064310 /nfs/dbraw/zinc/06/43/10/599064310.db2.gz YLVKTAYJIWJPBG-UHFFFAOYSA-N -1 3 371.441 3.734 20 0 FHADHM Cc1nc2ccccc2nc1CSc1ccc(-c2nnn[n-]2)cc1F ZINC000737489542 599064516 /nfs/dbraw/zinc/06/45/16/599064516.db2.gz JNDVBHACYUAUJY-UHFFFAOYSA-N -1 3 352.398 3.550 20 0 FHADHM Cc1nc2ccccc2nc1CSc1ccc(-c2nn[n-]n2)cc1F ZINC000737489542 599064518 /nfs/dbraw/zinc/06/45/18/599064518.db2.gz JNDVBHACYUAUJY-UHFFFAOYSA-N -1 3 352.398 3.550 20 0 FHADHM Cn1c(CSc2ccc(-c3nnn[n-]3)cc2F)nc2cc(Cl)ccc21 ZINC000737594416 599066589 /nfs/dbraw/zinc/06/65/89/599066589.db2.gz ZIHOKBBECRMOMA-UHFFFAOYSA-N -1 3 374.832 3.838 20 0 FHADHM Cn1c(CSc2ccc(-c3nn[n-]n3)cc2F)nc2cc(Cl)ccc21 ZINC000737594416 599066592 /nfs/dbraw/zinc/06/65/92/599066592.db2.gz ZIHOKBBECRMOMA-UHFFFAOYSA-N -1 3 374.832 3.838 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@@H]1C[C@@H]1C1CCCCC1 ZINC000735903960 599070629 /nfs/dbraw/zinc/07/06/29/599070629.db2.gz JKFUQIHSVNFWPF-HZPDHXFCSA-N -1 3 369.469 3.809 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@@H]1C[C@@H]1C1CCCCC1 ZINC000735903960 599070631 /nfs/dbraw/zinc/07/06/31/599070631.db2.gz JKFUQIHSVNFWPF-HZPDHXFCSA-N -1 3 369.469 3.809 20 0 FHADHM CCN(C(=O)[C@@H]1C[C@H]1C1CCCCC1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736503456 599070679 /nfs/dbraw/zinc/07/06/79/599070679.db2.gz XCASBCPPFYAFEG-MDASCCDHSA-N -1 3 367.497 3.993 20 0 FHADHM CCN(C(=O)[C@@H]1C[C@H]1C1CCCCC1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736503456 599070681 /nfs/dbraw/zinc/07/06/81/599070681.db2.gz XCASBCPPFYAFEG-MDASCCDHSA-N -1 3 367.497 3.993 20 0 FHADHM CC(C)(C)n1cc(-c2nnn[n-]2)cc1NC(=O)[C@@H]1C[C@H]1C1CCCCC1 ZINC000735654819 599069843 /nfs/dbraw/zinc/06/98/43/599069843.db2.gz JCBKDMBVLDNCEZ-LSDHHAIUSA-N -1 3 356.474 3.578 20 0 FHADHM CC(C)(C)n1cc(-c2nn[n-]n2)cc1NC(=O)[C@@H]1C[C@H]1C1CCCCC1 ZINC000735654819 599069846 /nfs/dbraw/zinc/06/98/46/599069846.db2.gz JCBKDMBVLDNCEZ-LSDHHAIUSA-N -1 3 356.474 3.578 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H]2C[C@H]2C2CCCCC2)c1-c1nnn[n-]1 ZINC000736672073 599072345 /nfs/dbraw/zinc/07/23/45/599072345.db2.gz XOWXQOSOBWJQOC-UONOGXRCSA-N -1 3 359.499 3.954 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@@H]2C[C@H]2C2CCCCC2)c1-c1nn[n-]n1 ZINC000736672073 599072347 /nfs/dbraw/zinc/07/23/47/599072347.db2.gz XOWXQOSOBWJQOC-UONOGXRCSA-N -1 3 359.499 3.954 20 0 FHADHM Fc1ccc(N[C@@H]2COc3c2ccc(Cl)c3Cl)c(-c2nnn[n-]2)c1 ZINC000822778991 599076409 /nfs/dbraw/zinc/07/64/09/599076409.db2.gz QRYHITJSLYZADW-GFCCVEGCSA-N -1 3 366.183 3.858 20 0 FHADHM Fc1ccc(N[C@@H]2COc3c2ccc(Cl)c3Cl)c(-c2nn[n-]n2)c1 ZINC000822778991 599076412 /nfs/dbraw/zinc/07/64/12/599076412.db2.gz QRYHITJSLYZADW-GFCCVEGCSA-N -1 3 366.183 3.858 20 0 FHADHM CC(C)(NC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)C1CC1 ZINC000735677545 599086395 /nfs/dbraw/zinc/08/63/95/599086395.db2.gz DHAKUUHWEFUEJP-UHFFFAOYSA-N -1 3 363.421 3.577 20 0 FHADHM CC(C)(NC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)C1CC1 ZINC000735677545 599086398 /nfs/dbraw/zinc/08/63/98/599086398.db2.gz DHAKUUHWEFUEJP-UHFFFAOYSA-N -1 3 363.421 3.577 20 0 FHADHM CO[C@H](CNc1ccc(Cl)cc1-c1nnn[n-]1)c1cccc(Cl)c1 ZINC000821677148 599090519 /nfs/dbraw/zinc/09/05/19/599090519.db2.gz PRGXUFFSCFYVLA-OAHLLOKOSA-N -1 3 364.236 3.973 20 0 FHADHM CO[C@H](CNc1ccc(Cl)cc1-c1nn[n-]n1)c1cccc(Cl)c1 ZINC000821677148 599090522 /nfs/dbraw/zinc/09/05/22/599090522.db2.gz PRGXUFFSCFYVLA-OAHLLOKOSA-N -1 3 364.236 3.973 20 0 FHADHM CO[C@H](CNc1c(F)cc(-c2nnn[n-]2)cc1F)c1cccc(Cl)c1 ZINC000821677046 599090650 /nfs/dbraw/zinc/09/06/50/599090650.db2.gz NDAIKCDDARMJHK-CQSZACIVSA-N -1 3 365.771 3.598 20 0 FHADHM CO[C@H](CNc1c(F)cc(-c2nn[n-]n2)cc1F)c1cccc(Cl)c1 ZINC000821677046 599090652 /nfs/dbraw/zinc/09/06/52/599090652.db2.gz NDAIKCDDARMJHK-CQSZACIVSA-N -1 3 365.771 3.598 20 0 FHADHM CO[C@@H](CNc1c(F)cc(-c2nnn[n-]2)cc1F)c1cccc(Cl)c1 ZINC000821677045 599090802 /nfs/dbraw/zinc/09/08/02/599090802.db2.gz NDAIKCDDARMJHK-AWEZNQCLSA-N -1 3 365.771 3.598 20 0 FHADHM CO[C@@H](CNc1c(F)cc(-c2nn[n-]n2)cc1F)c1cccc(Cl)c1 ZINC000821677045 599090805 /nfs/dbraw/zinc/09/08/05/599090805.db2.gz NDAIKCDDARMJHK-AWEZNQCLSA-N -1 3 365.771 3.598 20 0 FHADHM C[C@@H](CCC1CCCCC1)NC(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1 ZINC000735984996 599105666 /nfs/dbraw/zinc/10/56/66/599105666.db2.gz IBFOOHQEOGENGS-HNNXBMFYSA-N -1 3 370.501 3.757 20 0 FHADHM C[C@@H](CCC1CCCCC1)NC(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1 ZINC000735984996 599105667 /nfs/dbraw/zinc/10/56/67/599105667.db2.gz IBFOOHQEOGENGS-HNNXBMFYSA-N -1 3 370.501 3.757 20 0 FHADHM C[C@@H](CCC1CCCCC1)NC(=O)NCc1ccc(-c2nnn[n-]2)cc1F ZINC000735987461 599105747 /nfs/dbraw/zinc/10/57/47/599105747.db2.gz ZDXXRKUMAYKHDY-ZDUSSCGKSA-N -1 3 374.464 3.554 20 0 FHADHM C[C@@H](CCC1CCCCC1)NC(=O)NCc1ccc(-c2nn[n-]n2)cc1F ZINC000735987461 599105749 /nfs/dbraw/zinc/10/57/49/599105749.db2.gz ZDXXRKUMAYKHDY-ZDUSSCGKSA-N -1 3 374.464 3.554 20 0 FHADHM CC(C)CC[C@H](NC(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1)C(C)(C)C ZINC000735798538 599106045 /nfs/dbraw/zinc/10/60/45/599106045.db2.gz XOIDHKNKJLWEGZ-KRWDZBQOSA-N -1 3 372.517 3.859 20 0 FHADHM CC(C)CC[C@H](NC(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1)C(C)(C)C ZINC000735798538 599106048 /nfs/dbraw/zinc/10/60/48/599106048.db2.gz XOIDHKNKJLWEGZ-KRWDZBQOSA-N -1 3 372.517 3.859 20 0 FHADHM COC(=O)[C@@H](SCc1cc(C)ccc1C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736902313 599113932 /nfs/dbraw/zinc/11/39/32/599113932.db2.gz SUXUENBGZJVWLI-KRWDZBQOSA-N -1 3 368.462 3.631 20 0 FHADHM COC(=O)[C@@H](SCc1cc(C)ccc1C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736902313 599113933 /nfs/dbraw/zinc/11/39/33/599113933.db2.gz SUXUENBGZJVWLI-KRWDZBQOSA-N -1 3 368.462 3.631 20 0 FHADHM Fc1cc(-c2nnn[n-]2)cc(F)c1NCc1ccc(-c2cccnc2)cc1 ZINC000822741421 599111730 /nfs/dbraw/zinc/11/17/30/599111730.db2.gz WXNFKLKORUWGSA-UHFFFAOYSA-N -1 3 364.359 3.819 20 0 FHADHM Fc1cc(-c2nn[n-]n2)cc(F)c1NCc1ccc(-c2cccnc2)cc1 ZINC000822741421 599111734 /nfs/dbraw/zinc/11/17/34/599111734.db2.gz WXNFKLKORUWGSA-UHFFFAOYSA-N -1 3 364.359 3.819 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)c1cc(C2CC2)nc2ccc(F)cc21 ZINC000463302280 599131757 /nfs/dbraw/zinc/13/17/57/599131757.db2.gz QZYQJDBDPDTKAB-UHFFFAOYSA-N -1 3 374.379 3.684 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)c1cc(C2CC2)nc2ccc(F)cc21 ZINC000463302280 599131759 /nfs/dbraw/zinc/13/17/59/599131759.db2.gz QZYQJDBDPDTKAB-UHFFFAOYSA-N -1 3 374.379 3.684 20 0 FHADHM O=C(CCCC1CCCC1)NCCSCc1ccccc1-c1nnn[n-]1 ZINC000822955358 599135782 /nfs/dbraw/zinc/13/57/82/599135782.db2.gz RGXOMKSDCXMIGM-UHFFFAOYSA-N -1 3 373.526 3.577 20 0 FHADHM O=C(CCCC1CCCC1)NCCSCc1ccccc1-c1nn[n-]n1 ZINC000822955358 599135784 /nfs/dbraw/zinc/13/57/84/599135784.db2.gz RGXOMKSDCXMIGM-UHFFFAOYSA-N -1 3 373.526 3.577 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1cccc(F)c1Cl ZINC000821104763 599141352 /nfs/dbraw/zinc/14/13/52/599141352.db2.gz POJSFLDWJBZPIH-UHFFFAOYSA-N -1 3 373.819 3.712 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1cccc(F)c1Cl ZINC000821104763 599141355 /nfs/dbraw/zinc/14/13/55/599141355.db2.gz POJSFLDWJBZPIH-UHFFFAOYSA-N -1 3 373.819 3.712 20 0 FHADHM Cc1nc(C2CCCC2)sc1C(=O)Nc1cc(-c2nnn[n-]2)ccc1C ZINC000822220337 599149153 /nfs/dbraw/zinc/14/91/53/599149153.db2.gz MRHUGHNFGWHLGU-UHFFFAOYSA-N -1 3 368.466 3.850 20 0 FHADHM Cc1nc(C2CCCC2)sc1C(=O)Nc1cc(-c2nn[n-]n2)ccc1C ZINC000822220337 599149155 /nfs/dbraw/zinc/14/91/55/599149155.db2.gz MRHUGHNFGWHLGU-UHFFFAOYSA-N -1 3 368.466 3.850 20 0 FHADHM Cc1ccccc1CSCc1nnc(-c2ccc(-c3nnn[n-]3)cc2)o1 ZINC000737428198 599158467 /nfs/dbraw/zinc/15/84/67/599158467.db2.gz MXSLJJPRDBXRQG-UHFFFAOYSA-N -1 3 364.434 3.659 20 0 FHADHM Cc1ccccc1CSCc1nnc(-c2ccc(-c3nn[n-]n3)cc2)o1 ZINC000737428198 599158469 /nfs/dbraw/zinc/15/84/69/599158469.db2.gz MXSLJJPRDBXRQG-UHFFFAOYSA-N -1 3 364.434 3.659 20 0 FHADHM Cc1cc(C)cc(NC(=O)[C@@H](C)Sc2ccc(-c3nnn[n-]3)cc2F)c1 ZINC000737251684 599169562 /nfs/dbraw/zinc/16/95/62/599169562.db2.gz VDXLKBKTLVVGFV-GFCCVEGCSA-N -1 3 371.441 3.742 20 0 FHADHM Cc1cc(C)cc(NC(=O)[C@@H](C)Sc2ccc(-c3nn[n-]n3)cc2F)c1 ZINC000737251684 599169563 /nfs/dbraw/zinc/16/95/63/599169563.db2.gz VDXLKBKTLVVGFV-GFCCVEGCSA-N -1 3 371.441 3.742 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1SCc1cn2cc(Cl)ccc2n1 ZINC000737643151 599169586 /nfs/dbraw/zinc/16/95/86/599169586.db2.gz BXJZIQOIOKIAAC-UHFFFAOYSA-N -1 3 360.805 3.599 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1SCc1cn2cc(Cl)ccc2n1 ZINC000737643151 599169587 /nfs/dbraw/zinc/16/95/87/599169587.db2.gz BXJZIQOIOKIAAC-UHFFFAOYSA-N -1 3 360.805 3.599 20 0 FHADHM Fc1ccc(-n2ccc(CSc3ccc(-c4nnn[n-]4)cc3F)n2)cc1 ZINC000737647133 599172188 /nfs/dbraw/zinc/17/21/88/599172188.db2.gz BVORFKBIBVPKDX-UHFFFAOYSA-N -1 3 370.388 3.623 20 0 FHADHM Fc1ccc(-n2ccc(CSc3ccc(-c4nn[n-]n4)cc3F)n2)cc1 ZINC000737647133 599172190 /nfs/dbraw/zinc/17/21/90/599172190.db2.gz BVORFKBIBVPKDX-UHFFFAOYSA-N -1 3 370.388 3.623 20 0 FHADHM CCCCCC[C@@H](C)C(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000736445686 599179016 /nfs/dbraw/zinc/17/90/16/599179016.db2.gz MAUBYVAIXKDKTD-OAHLLOKOSA-N -1 3 355.486 3.964 20 0 FHADHM CCCCCC[C@@H](C)C(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000736445686 599179018 /nfs/dbraw/zinc/17/90/18/599179018.db2.gz MAUBYVAIXKDKTD-OAHLLOKOSA-N -1 3 355.486 3.964 20 0 FHADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@@H](C)c1cccc(F)c1 ZINC000735904607 599184381 /nfs/dbraw/zinc/18/43/81/599184381.db2.gz SAOLAHZRAYGBDY-LBPRGKRZSA-N -1 3 369.400 3.535 20 0 FHADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@@H](C)c1cccc(F)c1 ZINC000735904607 599184384 /nfs/dbraw/zinc/18/43/84/599184384.db2.gz SAOLAHZRAYGBDY-LBPRGKRZSA-N -1 3 369.400 3.535 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)[C@@H](C)c2cccc(Cl)c2)s1 ZINC000736678720 599184740 /nfs/dbraw/zinc/18/47/40/599184740.db2.gz GCFLBLNPJAEVKE-VIFPVBQESA-N -1 3 361.858 3.886 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)[C@@H](C)c2cccc(Cl)c2)s1 ZINC000736678720 599184741 /nfs/dbraw/zinc/18/47/41/599184741.db2.gz GCFLBLNPJAEVKE-VIFPVBQESA-N -1 3 361.858 3.886 20 0 FHADHM CCCCCC[C@H](C)C(=O)Nc1ccnn1-c1ccc(-c2nn[n-]n2)cc1 ZINC000736447286 599189017 /nfs/dbraw/zinc/18/90/17/599189017.db2.gz SVNYLWIALILVJU-AWEZNQCLSA-N -1 3 367.457 3.597 20 0 FHADHM C[C@H](OC(=O)[C@H]1C[C@@H]1c1c(F)cccc1F)c1cccc(-c2nnn[n-]2)c1 ZINC000736147954 599189752 /nfs/dbraw/zinc/18/97/52/599189752.db2.gz BINYDZLKTZYJDT-BPNCWPANSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@H]1C[C@@H]1c1c(F)cccc1F)c1cccc(-c2nn[n-]n2)c1 ZINC000736147954 599189755 /nfs/dbraw/zinc/18/97/55/599189755.db2.gz BINYDZLKTZYJDT-BPNCWPANSA-N -1 3 370.359 3.553 20 0 FHADHM Cc1cc(NC(=O)C=Cc2ccccc2-c2nnn[n-]2)c2cccnc2c1C ZINC000822207000 599197769 /nfs/dbraw/zinc/19/77/69/599197769.db2.gz HPFXCOBWVYKLJB-MDZDMXLPSA-N -1 3 370.416 3.684 20 0 FHADHM Cc1cc(NC(=O)C=Cc2ccccc2-c2nn[n-]n2)c2cccnc2c1C ZINC000822207000 599197771 /nfs/dbraw/zinc/19/77/71/599197771.db2.gz HPFXCOBWVYKLJB-MDZDMXLPSA-N -1 3 370.416 3.684 20 0 FHADHM O=C(Nc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1)c1ccoc1 ZINC000823357731 599219819 /nfs/dbraw/zinc/21/98/19/599219819.db2.gz ZYXHEZBTAPQSLH-UHFFFAOYSA-N -1 3 365.324 3.643 20 0 FHADHM O=C(Nc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1)c1ccoc1 ZINC000823357731 599219822 /nfs/dbraw/zinc/21/98/22/599219822.db2.gz ZYXHEZBTAPQSLH-UHFFFAOYSA-N -1 3 365.324 3.643 20 0 FHADHM C[C@H](CCSc1ccccc1)OC(=O)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000820248542 607261744 /nfs/dbraw/zinc/26/17/44/607261744.db2.gz JOPWKQYUNBDKCX-CQSZACIVSA-N -1 3 368.462 3.523 20 0 FHADHM C[C@H](CCSc1ccccc1)OC(=O)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000820248542 607261745 /nfs/dbraw/zinc/26/17/45/607261745.db2.gz JOPWKQYUNBDKCX-CQSZACIVSA-N -1 3 368.462 3.523 20 0 FHADHM Cc1cccc(C)c1NC(=S)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000822293599 599239483 /nfs/dbraw/zinc/23/94/83/599239483.db2.gz DHWDDZRWXJDLIY-CYBMUJFWSA-N -1 3 352.467 3.531 20 0 FHADHM Cc1cccc(C)c1NC(=S)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000822293599 599239484 /nfs/dbraw/zinc/23/94/84/599239484.db2.gz DHWDDZRWXJDLIY-CYBMUJFWSA-N -1 3 352.467 3.531 20 0 FHADHM CC[C@H](Cc1ccc(C)cc1)N(C)C(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000820912965 599240425 /nfs/dbraw/zinc/24/04/25/599240425.db2.gz ARYWFLFKJAQDJT-GOSISDBHSA-N -1 3 364.453 3.660 20 0 FHADHM CC[C@H](Cc1ccc(C)cc1)N(C)C(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000820912965 599240427 /nfs/dbraw/zinc/24/04/27/599240427.db2.gz ARYWFLFKJAQDJT-GOSISDBHSA-N -1 3 364.453 3.660 20 0 FHADHM COC(=O)[C@H](Sc1ccc(-c2nnn[n-]2)cc1)c1cccc(Cl)c1 ZINC000736903297 599245386 /nfs/dbraw/zinc/24/53/86/599245386.db2.gz ZFVYHEZUFLKDJE-CQSZACIVSA-N -1 3 360.826 3.527 20 0 FHADHM COC(=O)[C@H](Sc1ccc(-c2nn[n-]n2)cc1)c1cccc(Cl)c1 ZINC000736903297 599245389 /nfs/dbraw/zinc/24/53/89/599245389.db2.gz ZFVYHEZUFLKDJE-CQSZACIVSA-N -1 3 360.826 3.527 20 0 FHADHM C[C@H](Nc1cc(-c2nnn[n-]2)c2ccccc2n1)c1cccc(F)c1F ZINC000824651440 608304353 /nfs/dbraw/zinc/30/43/53/608304353.db2.gz ZTBDNJGIAFPMQP-JTQLQIEISA-N -1 3 352.348 3.866 20 0 FHADHM C[C@H](Nc1cc(-c2nn[n-]n2)c2ccccc2n1)c1cccc(F)c1F ZINC000824651440 608304354 /nfs/dbraw/zinc/30/43/54/608304354.db2.gz ZTBDNJGIAFPMQP-JTQLQIEISA-N -1 3 352.348 3.866 20 0 FHADHM O=C(C=CC1CCCCC1)Nc1sc2c(c1-c1nn[n-]n1)CCCC2 ZINC000737795411 599246827 /nfs/dbraw/zinc/24/68/27/599246827.db2.gz KKPHRWJJFFKVSN-KHPPLWFESA-N -1 3 357.483 3.882 20 0 FHADHM O=C(/C=C\C1CCCCC1)Nc1sc2c(c1-c1nn[n-]n1)CCCC2 ZINC000737795411 599246829 /nfs/dbraw/zinc/24/68/29/599246829.db2.gz KKPHRWJJFFKVSN-KHPPLWFESA-N -1 3 357.483 3.882 20 0 FHADHM C[C@H](NC(=O)Nc1cc(Cl)ccc1F)c1cccc(-c2nnn[n-]2)c1 ZINC000820374919 599248969 /nfs/dbraw/zinc/24/89/69/599248969.db2.gz TXRFBLHIBUMYDC-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM C[C@H](NC(=O)Nc1cc(Cl)ccc1F)c1cccc(-c2nn[n-]n2)c1 ZINC000820374919 599248971 /nfs/dbraw/zinc/24/89/71/599248971.db2.gz TXRFBLHIBUMYDC-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM Cc1ccc(CC[C@H](C)NC(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)o1 ZINC000822235190 599250423 /nfs/dbraw/zinc/25/04/23/599250423.db2.gz WZZPIFUZGBCPMC-JTQLQIEISA-N -1 3 374.832 3.564 20 0 FHADHM Cc1ccc(CC[C@H](C)NC(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)o1 ZINC000822235190 599250425 /nfs/dbraw/zinc/25/04/25/599250425.db2.gz WZZPIFUZGBCPMC-JTQLQIEISA-N -1 3 374.832 3.564 20 0 FHADHM Cc1c(NC(=O)N[C@H](c2ccco2)c2ccccc2)cccc1-c1nnn[n-]1 ZINC000822091035 607280809 /nfs/dbraw/zinc/28/08/09/607280809.db2.gz NAWIFKJGNKOEFJ-SFHVURJKSA-N -1 3 374.404 3.679 20 0 FHADHM Cc1c(NC(=O)N[C@H](c2ccco2)c2ccccc2)cccc1-c1nn[n-]n1 ZINC000822091035 607280810 /nfs/dbraw/zinc/28/08/10/607280810.db2.gz NAWIFKJGNKOEFJ-SFHVURJKSA-N -1 3 374.404 3.679 20 0 FHADHM O=C(C=Cc1ccccc1-c1nnn[n-]1)N1CC[C@H]1c1ccc(Cl)cc1 ZINC000737795998 599252075 /nfs/dbraw/zinc/25/20/75/599252075.db2.gz DMTROVUQWFROND-JEZWAEDTSA-N -1 3 365.824 3.507 20 0 FHADHM O=C(C=Cc1ccccc1-c1nn[n-]n1)N1CC[C@H]1c1ccc(Cl)cc1 ZINC000737795998 599252076 /nfs/dbraw/zinc/25/20/76/599252076.db2.gz DMTROVUQWFROND-JEZWAEDTSA-N -1 3 365.824 3.507 20 0 FHADHM Cc1ccc([C@@H](C)N(C)C(=O)Nc2cccc(-c3nnn[n-]3)c2C)cc1 ZINC000822228992 607281838 /nfs/dbraw/zinc/28/18/38/607281838.db2.gz KDFHQEFUNODSRJ-CQSZACIVSA-N -1 3 350.426 3.708 20 0 FHADHM Cc1ccc([C@@H](C)N(C)C(=O)Nc2cccc(-c3nn[n-]n3)c2C)cc1 ZINC000822228992 607281839 /nfs/dbraw/zinc/28/18/39/607281839.db2.gz KDFHQEFUNODSRJ-CQSZACIVSA-N -1 3 350.426 3.708 20 0 FHADHM Cc1ccc([C@@H](C)NC(=O)Nc2cccc(-c3nnn[n-]3)c2C)cc1F ZINC000822228993 607284182 /nfs/dbraw/zinc/28/41/82/607284182.db2.gz KGFLVQRSRYVZJJ-GFCCVEGCSA-N -1 3 354.389 3.505 20 0 FHADHM Cc1ccc([C@@H](C)NC(=O)Nc2cccc(-c3nn[n-]n3)c2C)cc1F ZINC000822228993 607284183 /nfs/dbraw/zinc/28/41/83/607284183.db2.gz KGFLVQRSRYVZJJ-GFCCVEGCSA-N -1 3 354.389 3.505 20 0 FHADHM Cc1c(NC(=O)Nc2ccccc2OCC2CC2)cccc1-c1nnn[n-]1 ZINC000822102917 607286001 /nfs/dbraw/zinc/28/60/01/607286001.db2.gz FEEUKHAIWRCMSR-UHFFFAOYSA-N -1 3 364.409 3.608 20 0 FHADHM Cc1c(NC(=O)Nc2ccccc2OCC2CC2)cccc1-c1nn[n-]n1 ZINC000822102917 607286002 /nfs/dbraw/zinc/28/60/02/607286002.db2.gz FEEUKHAIWRCMSR-UHFFFAOYSA-N -1 3 364.409 3.608 20 0 FHADHM CCCOc1ccccc1NC(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000821138927 607290371 /nfs/dbraw/zinc/29/03/71/607290371.db2.gz KVUPFBKZMWAUMF-UHFFFAOYSA-N -1 3 352.398 3.608 20 0 FHADHM CCCOc1ccccc1NC(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000821138927 607290372 /nfs/dbraw/zinc/29/03/72/607290372.db2.gz KVUPFBKZMWAUMF-UHFFFAOYSA-N -1 3 352.398 3.608 20 0 FHADHM O=C(Nc1ccc(F)cc1OC1CCCC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000823346035 607294742 /nfs/dbraw/zinc/29/47/42/607294742.db2.gz GQEKFFBRUZMNHW-UHFFFAOYSA-N -1 3 367.384 3.580 20 0 FHADHM O=C(Nc1ccc(F)cc1OC1CCCC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000823346035 607294743 /nfs/dbraw/zinc/29/47/43/607294743.db2.gz GQEKFFBRUZMNHW-UHFFFAOYSA-N -1 3 367.384 3.580 20 0 FHADHM CC[C@]1(C)CCCN(C(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(C)C)C1 ZINC000820950703 599264519 /nfs/dbraw/zinc/26/45/19/599264519.db2.gz QZMRMUZEGQAZSB-LJQANCHMSA-N -1 3 372.473 3.698 20 0 FHADHM CC[C@]1(C)CCCN(C(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(C)C)C1 ZINC000820950703 599264521 /nfs/dbraw/zinc/26/45/21/599264521.db2.gz QZMRMUZEGQAZSB-LJQANCHMSA-N -1 3 372.473 3.698 20 0 FHADHM c1cc(CNc2ccc3c(c2)OC2(CCCCC2)O3)cc(-c2nnn[n-]2)c1 ZINC000823751132 607311069 /nfs/dbraw/zinc/31/10/69/607311069.db2.gz AADHUOFHTXCMOQ-UHFFFAOYSA-N -1 3 363.421 3.910 20 0 FHADHM c1cc(CNc2ccc3c(c2)OC2(CCCCC2)O3)cc(-c2nn[n-]n2)c1 ZINC000823751132 607311070 /nfs/dbraw/zinc/31/10/70/607311070.db2.gz AADHUOFHTXCMOQ-UHFFFAOYSA-N -1 3 363.421 3.910 20 0 FHADHM c1cc(-c2nnn[n-]2)sc1CNc1ccc2c(c1)OC1(CCCC1)O2 ZINC000823767131 607311272 /nfs/dbraw/zinc/31/12/72/607311272.db2.gz NFFGTEOMKVLHLN-UHFFFAOYSA-N -1 3 355.423 3.582 20 0 FHADHM COc1ccc(NCc2cc(-c3nnn[n-]3)cs2)cc1OC1CCCC1 ZINC000821835718 607313272 /nfs/dbraw/zinc/31/32/72/607313272.db2.gz QCRSTDQLZAIHPO-UHFFFAOYSA-N -1 3 371.466 3.870 20 0 FHADHM COc1ccc(NCc2cc(-c3nn[n-]n3)cs2)cc1OC1CCCC1 ZINC000821835718 607313273 /nfs/dbraw/zinc/31/32/73/607313273.db2.gz QCRSTDQLZAIHPO-UHFFFAOYSA-N -1 3 371.466 3.870 20 0 FHADHM COc1ccc(CNc2ccccc2OC2CCCC2)cc1-c1nnn[n-]1 ZINC000821824871 607313392 /nfs/dbraw/zinc/31/33/92/607313392.db2.gz PICDXESHTZTUGO-UHFFFAOYSA-N -1 3 365.437 3.809 20 0 FHADHM COc1ccc(CNc2ccccc2OC2CCCC2)cc1-c1nn[n-]n1 ZINC000821824871 607313393 /nfs/dbraw/zinc/31/33/93/607313393.db2.gz PICDXESHTZTUGO-UHFFFAOYSA-N -1 3 365.437 3.809 20 0 FHADHM Cc1ccccc1NC(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000822362417 599290160 /nfs/dbraw/zinc/29/01/60/599290160.db2.gz SFNYSEABXAWPFI-UHFFFAOYSA-N -1 3 362.315 3.838 20 0 FHADHM Cc1ccccc1NC(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000822362417 599290162 /nfs/dbraw/zinc/29/01/62/599290162.db2.gz SFNYSEABXAWPFI-UHFFFAOYSA-N -1 3 362.315 3.838 20 0 FHADHM Cc1c(NC(=O)c2ccccc2Oc2cccnc2)cccc1-c1nnn[n-]1 ZINC000822115510 607321932 /nfs/dbraw/zinc/32/19/32/607321932.db2.gz FBPLRFBOHBVCGA-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1c(NC(=O)c2ccccc2Oc2cccnc2)cccc1-c1nn[n-]n1 ZINC000822115510 607321933 /nfs/dbraw/zinc/32/19/33/607321933.db2.gz FBPLRFBOHBVCGA-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM COc1cc([C@H](C)NCc2cccc(C(=O)[O-])c2)ccc1OC(F)F ZINC000820759223 598192622 /nfs/dbraw/zinc/19/26/22/598192622.db2.gz IPFLYXJZEBRNEA-NSHDSACASA-N -1 3 351.349 3.846 20 0 FHADHM CC(C)CC(=O)Nc1ccc(Nc2cccc(F)c2-c2nnn[n-]2)cc1 ZINC000735755490 598236963 /nfs/dbraw/zinc/23/69/63/598236963.db2.gz FYAXJOUIXSFZOZ-UHFFFAOYSA-N -1 3 354.389 3.734 20 0 FHADHM CC(C)CC(=O)Nc1ccc(Nc2cccc(F)c2-c2nn[n-]n2)cc1 ZINC000735755490 598236965 /nfs/dbraw/zinc/23/69/65/598236965.db2.gz FYAXJOUIXSFZOZ-UHFFFAOYSA-N -1 3 354.389 3.734 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1NC[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000737641779 598242219 /nfs/dbraw/zinc/24/22/19/598242219.db2.gz YLEOOBXCIGGOHO-MAUKXSAKSA-N -1 3 353.401 3.586 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1NC[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000737641778 598242415 /nfs/dbraw/zinc/24/24/15/598242415.db2.gz YLEOOBXCIGGOHO-CRAIPNDOSA-N -1 3 353.401 3.586 20 0 FHADHM COc1ccc(CN(C)c2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)cc1 ZINC000737090066 598274416 /nfs/dbraw/zinc/27/44/16/598274416.db2.gz AFVNQFOOPJNDBE-UHFFFAOYSA-N -1 3 363.343 3.531 20 0 FHADHM COc1ccc(CN(C)c2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)cc1 ZINC000737090066 598274418 /nfs/dbraw/zinc/27/44/18/598274418.db2.gz AFVNQFOOPJNDBE-UHFFFAOYSA-N -1 3 363.343 3.531 20 0 FHADHM C[C@@H](c1ccccc1)N(C)C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000736203380 598276577 /nfs/dbraw/zinc/27/65/77/598276577.db2.gz MXEPYOSXVNGQFH-ZDUSSCGKSA-N -1 3 367.457 3.648 20 0 FHADHM C[C@@H](c1ccccc1)N(C)C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000736203380 598276580 /nfs/dbraw/zinc/27/65/80/598276580.db2.gz MXEPYOSXVNGQFH-ZDUSSCGKSA-N -1 3 367.457 3.648 20 0 FHADHM C[C@H](Sc1cccc(Cl)c1)C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC000736189419 598294167 /nfs/dbraw/zinc/29/41/67/598294167.db2.gz CEDLIUWQUKAVTD-JTQLQIEISA-N -1 3 359.842 3.639 20 0 FHADHM C[C@H](Sc1cccc(Cl)c1)C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC000736189419 598294169 /nfs/dbraw/zinc/29/41/69/598294169.db2.gz CEDLIUWQUKAVTD-JTQLQIEISA-N -1 3 359.842 3.639 20 0 FHADHM CC(C)c1ccc(NC(=S)NCc2ccc(-c3nnn[n-]3)cc2F)cc1 ZINC000735928076 598296588 /nfs/dbraw/zinc/29/65/88/598296588.db2.gz FBPDTLSIVWPTMK-UHFFFAOYSA-N -1 3 370.457 3.616 20 0 FHADHM CC(C)c1ccc(NC(=S)NCc2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000735928076 598296589 /nfs/dbraw/zinc/29/65/89/598296589.db2.gz FBPDTLSIVWPTMK-UHFFFAOYSA-N -1 3 370.457 3.616 20 0 FHADHM O=C(c1sccc1-c1nnn[n-]1)N1Cc2ccccc2-c2ccccc2C1 ZINC000738292177 598298497 /nfs/dbraw/zinc/29/84/97/598298497.db2.gz XUDYFIXOIVAVAC-UHFFFAOYSA-N -1 3 373.441 3.751 20 0 FHADHM O=C(c1sccc1-c1nn[n-]n1)N1Cc2ccccc2-c2ccccc2C1 ZINC000738292177 598298498 /nfs/dbraw/zinc/29/84/98/598298498.db2.gz XUDYFIXOIVAVAC-UHFFFAOYSA-N -1 3 373.441 3.751 20 0 FHADHM Cc1cc(C)c(-c2nnn[n-]2)c(NCc2cccc(COC(C)(C)C)c2)n1 ZINC000737240941 598299145 /nfs/dbraw/zinc/29/91/45/598299145.db2.gz NKLXZTPSRFVSOG-UHFFFAOYSA-N -1 3 366.469 3.806 20 0 FHADHM Cc1cc(C)c(-c2nn[n-]n2)c(NCc2cccc(COC(C)(C)C)c2)n1 ZINC000737240941 598299147 /nfs/dbraw/zinc/29/91/47/598299147.db2.gz NKLXZTPSRFVSOG-UHFFFAOYSA-N -1 3 366.469 3.806 20 0 FHADHM CN(C(=O)c1ccc(C(C)(C)C)cc1)c1ccc(-c2nnn[n-]2)cc1F ZINC000736743077 598311564 /nfs/dbraw/zinc/31/15/64/598311564.db2.gz YPEXNAZLYOMKEK-UHFFFAOYSA-N -1 3 353.401 3.580 20 0 FHADHM CN(C(=O)c1ccc(C(C)(C)C)cc1)c1ccc(-c2nn[n-]n2)cc1F ZINC000736743077 598311566 /nfs/dbraw/zinc/31/15/66/598311566.db2.gz YPEXNAZLYOMKEK-UHFFFAOYSA-N -1 3 353.401 3.580 20 0 FHADHM CCOc1ccc(NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1 ZINC000736646881 598315606 /nfs/dbraw/zinc/31/56/06/598315606.db2.gz MFPRIEDYNHEIEV-UHFFFAOYSA-N -1 3 374.857 3.728 20 0 FHADHM CCOc1ccc(NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1 ZINC000736646881 598315609 /nfs/dbraw/zinc/31/56/09/598315609.db2.gz MFPRIEDYNHEIEV-UHFFFAOYSA-N -1 3 374.857 3.728 20 0 FHADHM CCCCC[C@H](C)NC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736440238 598316872 /nfs/dbraw/zinc/31/68/72/598316872.db2.gz BJYUACVMNZABNJ-JTQLQIEISA-N -1 3 352.895 3.775 20 0 FHADHM CCCCC[C@H](C)NC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736440238 598316874 /nfs/dbraw/zinc/31/68/74/598316874.db2.gz BJYUACVMNZABNJ-JTQLQIEISA-N -1 3 352.895 3.775 20 0 FHADHM CCc1ccc(NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1 ZINC000736690942 598317035 /nfs/dbraw/zinc/31/70/35/598317035.db2.gz MCSHUNMWLNEIRS-UHFFFAOYSA-N -1 3 358.858 3.891 20 0 FHADHM CCc1ccc(NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1 ZINC000736690942 598317036 /nfs/dbraw/zinc/31/70/36/598317036.db2.gz MCSHUNMWLNEIRS-UHFFFAOYSA-N -1 3 358.858 3.891 20 0 FHADHM CCN(C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)C1CCCCC1 ZINC000736508821 598317259 /nfs/dbraw/zinc/31/72/59/598317259.db2.gz OARVLKKVDDTYHW-UHFFFAOYSA-N -1 3 364.906 3.872 20 0 FHADHM CCN(C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)C1CCCCC1 ZINC000736508821 598317261 /nfs/dbraw/zinc/31/72/61/598317261.db2.gz OARVLKKVDDTYHW-UHFFFAOYSA-N -1 3 364.906 3.872 20 0 FHADHM CCCCC[C@@H](C)NC(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736440240 598317378 /nfs/dbraw/zinc/31/73/78/598317378.db2.gz BJYUACVMNZABNJ-SNVBAGLBSA-N -1 3 352.895 3.775 20 0 FHADHM CCCCC[C@@H](C)NC(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736440240 598317380 /nfs/dbraw/zinc/31/73/80/598317380.db2.gz BJYUACVMNZABNJ-SNVBAGLBSA-N -1 3 352.895 3.775 20 0 FHADHM Fc1ccc(F)c(NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c1 ZINC000737660177 598317652 /nfs/dbraw/zinc/31/76/52/598317652.db2.gz OGYPHSXELJYRHQ-UHFFFAOYSA-N -1 3 366.784 3.607 20 0 FHADHM Fc1ccc(F)c(NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c1 ZINC000737660177 598317654 /nfs/dbraw/zinc/31/76/54/598317654.db2.gz OGYPHSXELJYRHQ-UHFFFAOYSA-N -1 3 366.784 3.607 20 0 FHADHM C[C@@H]1CCCC[C@H]1N(C)C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736270261 598318368 /nfs/dbraw/zinc/31/83/68/598318368.db2.gz IUAGKSCDPVHOGB-QMTHXVAHSA-N -1 3 364.906 3.727 20 0 FHADHM C[C@@H]1CCCC[C@H]1N(C)C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736270261 598318370 /nfs/dbraw/zinc/31/83/70/598318370.db2.gz IUAGKSCDPVHOGB-QMTHXVAHSA-N -1 3 364.906 3.727 20 0 FHADHM CCOc1cccc(NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c1 ZINC000736656471 598320422 /nfs/dbraw/zinc/32/04/22/598320422.db2.gz YUYRVODMRIAYPM-UHFFFAOYSA-N -1 3 374.857 3.728 20 0 FHADHM CCOc1cccc(NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c1 ZINC000736656471 598320424 /nfs/dbraw/zinc/32/04/24/598320424.db2.gz YUYRVODMRIAYPM-UHFFFAOYSA-N -1 3 374.857 3.728 20 0 FHADHM CC[C@H](COC(=O)CCc1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000736351914 598331349 /nfs/dbraw/zinc/33/13/49/598331349.db2.gz IXILDXRXAMNIEJ-MRXNPFEDSA-N -1 3 350.422 3.536 20 0 FHADHM CC[C@H](COC(=O)CCc1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000736351914 598331351 /nfs/dbraw/zinc/33/13/51/598331351.db2.gz IXILDXRXAMNIEJ-MRXNPFEDSA-N -1 3 350.422 3.536 20 0 FHADHM C[C@@H](OC(=O)CCc1ccc(-c2nnn[n-]2)cc1)c1ccc(F)cc1Cl ZINC000737194972 598331939 /nfs/dbraw/zinc/33/19/39/598331939.db2.gz YOXYNHBRXUFNNY-LLVKDONJSA-N -1 3 374.803 3.896 20 0 FHADHM C[C@@H](OC(=O)CCc1ccc(-c2nn[n-]n2)cc1)c1ccc(F)cc1Cl ZINC000737194972 598331940 /nfs/dbraw/zinc/33/19/40/598331940.db2.gz YOXYNHBRXUFNNY-LLVKDONJSA-N -1 3 374.803 3.896 20 0 FHADHM COc1ccc(CNc2cccc(F)c2-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000737096596 598353145 /nfs/dbraw/zinc/35/31/45/598353145.db2.gz XAYBLGAEUAXFGD-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM COc1ccc(CNc2cccc(F)c2-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000737096596 598353146 /nfs/dbraw/zinc/35/31/46/598353146.db2.gz XAYBLGAEUAXFGD-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM CCCCN(Cc1ccccc1Cl)C(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000736457330 598366178 /nfs/dbraw/zinc/36/61/78/598366178.db2.gz NIAGNDBBYIHXPH-UHFFFAOYSA-N -1 3 369.856 3.963 20 0 FHADHM CCCCN(Cc1ccccc1Cl)C(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC000736457330 598366179 /nfs/dbraw/zinc/36/61/79/598366179.db2.gz NIAGNDBBYIHXPH-UHFFFAOYSA-N -1 3 369.856 3.963 20 0 FHADHM Cc1ccc(CSCCNc2ncc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000737342600 598387029 /nfs/dbraw/zinc/38/70/29/598387029.db2.gz IGXYDWLPYTYPMF-UHFFFAOYSA-N -1 3 360.874 3.569 20 0 FHADHM Cc1ccc(CSCCNc2ncc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000737342600 598387030 /nfs/dbraw/zinc/38/70/30/598387030.db2.gz IGXYDWLPYTYPMF-UHFFFAOYSA-N -1 3 360.874 3.569 20 0 FHADHM C[C@@H](Nc1ncc(-c2nnn[n-]2)cc1Cl)c1cccc(OC(F)F)c1 ZINC000736135457 598389054 /nfs/dbraw/zinc/38/90/54/598389054.db2.gz ABCGTLIMFSQEAP-MRVPVSSYSA-N -1 3 366.759 3.690 20 0 FHADHM C[C@@H](Nc1ncc(-c2nn[n-]n2)cc1Cl)c1cccc(OC(F)F)c1 ZINC000736135457 598389056 /nfs/dbraw/zinc/38/90/56/598389056.db2.gz ABCGTLIMFSQEAP-MRVPVSSYSA-N -1 3 366.759 3.690 20 0 FHADHM Clc1cccc2c1OCC[C@H]2Nc1ncc(-c2nnn[n-]2)cc1Cl ZINC000737558581 598391263 /nfs/dbraw/zinc/39/12/63/598391263.db2.gz NZBUYDHDNIOFDC-GFCCVEGCSA-N -1 3 363.208 3.504 20 0 FHADHM Clc1cccc2c1OCC[C@H]2Nc1ncc(-c2nn[n-]n2)cc1Cl ZINC000737558581 598391264 /nfs/dbraw/zinc/39/12/64/598391264.db2.gz NZBUYDHDNIOFDC-GFCCVEGCSA-N -1 3 363.208 3.504 20 0 FHADHM Cc1c2cc(F)ccc2oc1CNc1ncc(-c2nnn[n-]2)cc1Cl ZINC000737212148 598392638 /nfs/dbraw/zinc/39/26/38/598392638.db2.gz PQGYJNOAJWEDRL-UHFFFAOYSA-N -1 3 358.764 3.721 20 0 FHADHM Cc1c2cc(F)ccc2oc1CNc1ncc(-c2nn[n-]n2)cc1Cl ZINC000737212148 598392639 /nfs/dbraw/zinc/39/26/39/598392639.db2.gz PQGYJNOAJWEDRL-UHFFFAOYSA-N -1 3 358.764 3.721 20 0 FHADHM Cc1ccccc1[C@@H](C)NC(=O)[C@H](C)Sc1ccc(-c2nnn[n-]2)cc1 ZINC000737419923 598417427 /nfs/dbraw/zinc/41/74/27/598417427.db2.gz GMHUZQDILRGQCE-KGLIPLIRSA-N -1 3 367.478 3.533 20 0 FHADHM Cc1ccccc1[C@@H](C)NC(=O)[C@H](C)Sc1ccc(-c2nn[n-]n2)cc1 ZINC000737419923 598417428 /nfs/dbraw/zinc/41/74/28/598417428.db2.gz GMHUZQDILRGQCE-KGLIPLIRSA-N -1 3 367.478 3.533 20 0 FHADHM Cc1ccc2c(CSc3ccc(-c4nnn[n-]4)cc3)cc(=O)oc2c1C ZINC000737371309 598420377 /nfs/dbraw/zinc/42/03/77/598420377.db2.gz BIUHSBVSRKBHIM-UHFFFAOYSA-N -1 3 364.430 3.882 20 0 FHADHM Cc1ccc2c(CSc3ccc(-c4nn[n-]n4)cc3)cc(=O)oc2c1C ZINC000737371309 598420380 /nfs/dbraw/zinc/42/03/80/598420380.db2.gz BIUHSBVSRKBHIM-UHFFFAOYSA-N -1 3 364.430 3.882 20 0 FHADHM CSc1ccsc1C(=O)N(CC(C)C)c1ccc(-c2nnn[n-]2)cc1 ZINC000737192199 598421051 /nfs/dbraw/zinc/42/10/51/598421051.db2.gz RHPRCITXOLZMGV-UHFFFAOYSA-N -1 3 373.507 3.953 20 0 FHADHM CSc1ccsc1C(=O)N(CC(C)C)c1ccc(-c2nn[n-]n2)cc1 ZINC000737192199 598421053 /nfs/dbraw/zinc/42/10/53/598421053.db2.gz RHPRCITXOLZMGV-UHFFFAOYSA-N -1 3 373.507 3.953 20 0 FHADHM CC(C)[C@H](Sc1ccccc1)C(=O)OCc1ccccc1-c1nnn[n-]1 ZINC000735736762 598425336 /nfs/dbraw/zinc/42/53/36/598425336.db2.gz WEOPVULTCMPKJQ-KRWDZBQOSA-N -1 3 368.462 3.727 20 0 FHADHM CC(C)[C@H](Sc1ccccc1)C(=O)OCc1ccccc1-c1nn[n-]n1 ZINC000735736762 598425338 /nfs/dbraw/zinc/42/53/38/598425338.db2.gz WEOPVULTCMPKJQ-KRWDZBQOSA-N -1 3 368.462 3.727 20 0 FHADHM CCc1cccc(NC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)c1 ZINC000736698612 598426258 /nfs/dbraw/zinc/42/62/58/598426258.db2.gz KEBJOAJZOGKTJL-UHFFFAOYSA-N -1 3 364.453 3.872 20 0 FHADHM CCc1cccc(NC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)c1 ZINC000736698612 598426260 /nfs/dbraw/zinc/42/62/60/598426260.db2.gz KEBJOAJZOGKTJL-UHFFFAOYSA-N -1 3 364.453 3.872 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)NC[C@H]1CCC[C@H](C)C1 ZINC000736247313 598429776 /nfs/dbraw/zinc/42/97/76/598429776.db2.gz BKMCGXBNTLHDIG-RDJZCZTQSA-N -1 3 370.501 3.613 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)NC[C@H]1CCC[C@H](C)C1 ZINC000736247313 598429778 /nfs/dbraw/zinc/42/97/78/598429778.db2.gz BKMCGXBNTLHDIG-RDJZCZTQSA-N -1 3 370.501 3.613 20 0 FHADHM C[C@@H](NC(=O)C[C@@H]1C[C@@H](C)CC(C)(C)C1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736229481 598442395 /nfs/dbraw/zinc/44/23/95/598442395.db2.gz QZDUASJHZMOFHW-KFWWJZLASA-N -1 3 355.486 3.896 20 0 FHADHM C[C@@H](NC(=O)C[C@@H]1C[C@@H](C)CC(C)(C)C1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736229481 598442397 /nfs/dbraw/zinc/44/23/97/598442397.db2.gz QZDUASJHZMOFHW-KFWWJZLASA-N -1 3 355.486 3.896 20 0 FHADHM CC(=CC(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccccc1Cl ZINC000735448853 598442563 /nfs/dbraw/zinc/44/25/63/598442563.db2.gz LOGPGALMLKHAJG-YLSINNKHSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=CC(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccccc1Cl ZINC000735448853 598442564 /nfs/dbraw/zinc/44/25/64/598442564.db2.gz LOGPGALMLKHAJG-YLSINNKHSA-N -1 3 367.840 3.801 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)C[C@H]1C[C@@H](C)CC(C)(C)C1 ZINC000737057797 598443893 /nfs/dbraw/zinc/44/38/93/598443893.db2.gz JQFJRVGOBACTNV-CHWSQXEVSA-N -1 3 357.458 3.666 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)C[C@H]1C[C@@H](C)CC(C)(C)C1 ZINC000737057797 598443894 /nfs/dbraw/zinc/44/38/94/598443894.db2.gz JQFJRVGOBACTNV-CHWSQXEVSA-N -1 3 357.458 3.666 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)[C@@H]1C[C@H]1c1cccc2ccccc21 ZINC000738164391 598452853 /nfs/dbraw/zinc/45/28/53/598452853.db2.gz YRYOFTXWWFAHMA-DLBZAZTESA-N -1 3 373.391 3.901 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)[C@@H]1C[C@H]1c1cccc2ccccc21 ZINC000738164391 598452855 /nfs/dbraw/zinc/45/28/55/598452855.db2.gz YRYOFTXWWFAHMA-DLBZAZTESA-N -1 3 373.391 3.901 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)[C@H]1C[C@@H]1c1cccc2ccccc21 ZINC000738164394 598453407 /nfs/dbraw/zinc/45/34/07/598453407.db2.gz YRYOFTXWWFAHMA-SJORKVTESA-N -1 3 373.391 3.901 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)[C@H]1C[C@@H]1c1cccc2ccccc21 ZINC000738164394 598453408 /nfs/dbraw/zinc/45/34/08/598453408.db2.gz YRYOFTXWWFAHMA-SJORKVTESA-N -1 3 373.391 3.901 20 0 FHADHM COc1cc(-c2nnn[n-]2)cc(Cl)c1OCc1ccc(Cl)s1 ZINC000737025143 598471222 /nfs/dbraw/zinc/47/12/22/598471222.db2.gz LZYRZIPVGVURQC-UHFFFAOYSA-N -1 3 357.222 3.823 20 0 FHADHM COc1cc(-c2nn[n-]n2)cc(Cl)c1OCc1ccc(Cl)s1 ZINC000737025143 598471224 /nfs/dbraw/zinc/47/12/24/598471224.db2.gz LZYRZIPVGVURQC-UHFFFAOYSA-N -1 3 357.222 3.823 20 0 FHADHM C[C@H](CN(C)C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccccc1 ZINC000735999053 598473888 /nfs/dbraw/zinc/47/38/88/598473888.db2.gz ZZGRINAZGPORDH-GFCCVEGCSA-N -1 3 370.844 3.788 20 0 FHADHM C[C@H](CN(C)C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccccc1 ZINC000735999053 598473889 /nfs/dbraw/zinc/47/38/89/598473889.db2.gz ZZGRINAZGPORDH-GFCCVEGCSA-N -1 3 370.844 3.788 20 0 FHADHM Cc1cc(F)ccc1NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000737271187 598475187 /nfs/dbraw/zinc/47/51/87/598475187.db2.gz STFQCBBSEDSXEY-UHFFFAOYSA-N -1 3 366.400 3.511 20 0 FHADHM Cc1cc(F)ccc1NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000737271187 598475188 /nfs/dbraw/zinc/47/51/88/598475188.db2.gz STFQCBBSEDSXEY-UHFFFAOYSA-N -1 3 366.400 3.511 20 0 FHADHM C[C@@H](OC(=O)C[C@H](C)c1ccccc1F)c1cccc(-c2nnn[n-]2)c1 ZINC000735975449 598482674 /nfs/dbraw/zinc/48/26/74/598482674.db2.gz GUBXPDAFBTUVJC-QWHCGFSZSA-N -1 3 354.385 3.804 20 0 FHADHM C[C@@H](OC(=O)C[C@H](C)c1ccccc1F)c1cccc(-c2nn[n-]n2)c1 ZINC000735975449 598482676 /nfs/dbraw/zinc/48/26/76/598482676.db2.gz GUBXPDAFBTUVJC-QWHCGFSZSA-N -1 3 354.385 3.804 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccc(Cl)s1)c1cccc(-c2nnn[n-]2)c1 ZINC000736150079 598487190 /nfs/dbraw/zinc/48/71/90/598487190.db2.gz ILDPDEOJWJVMBK-QEHWCHDUSA-N -1 3 360.826 3.899 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccc(Cl)s1)c1cccc(-c2nn[n-]n2)c1 ZINC000736150079 598487193 /nfs/dbraw/zinc/48/71/93/598487193.db2.gz ILDPDEOJWJVMBK-QEHWCHDUSA-N -1 3 360.826 3.899 20 0 FHADHM C[C@H](CC(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C)c1ccccc1 ZINC000735974259 598488064 /nfs/dbraw/zinc/48/80/64/598488064.db2.gz GDUOLHUKBZASAN-CYBMUJFWSA-N -1 3 352.442 3.556 20 0 FHADHM C[C@H](CC(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C)c1ccccc1 ZINC000735974259 598488065 /nfs/dbraw/zinc/48/80/65/598488065.db2.gz GDUOLHUKBZASAN-CYBMUJFWSA-N -1 3 352.442 3.556 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccc(Cl)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000736147983 598490375 /nfs/dbraw/zinc/49/03/75/598490375.db2.gz BKXJFWVWASSLHA-UMAGTOLTSA-N -1 3 354.797 3.838 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccc(Cl)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000736147983 598490376 /nfs/dbraw/zinc/49/03/76/598490376.db2.gz BKXJFWVWASSLHA-UMAGTOLTSA-N -1 3 354.797 3.838 20 0 FHADHM C[C@H]1CC[C@H](NC(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)CC1 ZINC000737196686 598495021 /nfs/dbraw/zinc/49/50/21/598495021.db2.gz YDUPVWSGNVRGTH-SHTZXODSSA-N -1 3 361.449 3.842 20 0 FHADHM C[C@H]1CC[C@H](NC(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)CC1 ZINC000737196686 598495022 /nfs/dbraw/zinc/49/50/22/598495022.db2.gz YDUPVWSGNVRGTH-SHTZXODSSA-N -1 3 361.449 3.842 20 0 FHADHM CC(C)CC[C@H]1CCC[C@H]1NC(=S)Nc1ccccc1-c1nnn[n-]1 ZINC000735796795 598513270 /nfs/dbraw/zinc/51/32/70/598513270.db2.gz IISRYOZEXBAYAA-UKRRQHHQSA-N -1 3 358.515 3.758 20 0 FHADHM CC(C)CC[C@H]1CCC[C@H]1NC(=S)Nc1ccccc1-c1nn[n-]n1 ZINC000735796795 598513271 /nfs/dbraw/zinc/51/32/71/598513271.db2.gz IISRYOZEXBAYAA-UKRRQHHQSA-N -1 3 358.515 3.758 20 0 FHADHM CCc1c(C)sc(NC(=O)CCc2ccc(F)cc2)c1-c1nnn[n-]1 ZINC000736671205 598516733 /nfs/dbraw/zinc/51/67/33/598516733.db2.gz UJKYXUUZJJCROP-UHFFFAOYSA-N -1 3 359.430 3.509 20 0 FHADHM CCc1c(C)sc(NC(=O)CCc2ccc(F)cc2)c1-c1nn[n-]n1 ZINC000736671205 598516734 /nfs/dbraw/zinc/51/67/34/598516734.db2.gz UJKYXUUZJJCROP-UHFFFAOYSA-N -1 3 359.430 3.509 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccccc2SC)c1-c1nnn[n-]1 ZINC000736676993 598519211 /nfs/dbraw/zinc/51/92/11/598519211.db2.gz XVPCLGSRBSCQFS-UHFFFAOYSA-N -1 3 359.480 3.773 20 0 FHADHM CCc1c(C)sc(NC(=O)c2ccccc2SC)c1-c1nn[n-]n1 ZINC000736676993 598519212 /nfs/dbraw/zinc/51/92/12/598519212.db2.gz XVPCLGSRBSCQFS-UHFFFAOYSA-N -1 3 359.480 3.773 20 0 FHADHM Cc1nc(-c2ccccc2)c(C(=O)Oc2ccc(-c3nn[n-]n3)cc2)s1 ZINC000737463467 598530017 /nfs/dbraw/zinc/53/00/17/598530017.db2.gz TVKKZEAZHOWEEK-UHFFFAOYSA-N -1 3 363.402 3.518 20 0 FHADHM CC[C@H](Cc1ccccc1)NC(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736349551 598532729 /nfs/dbraw/zinc/53/27/29/598532729.db2.gz GOWKGMUSTGXIRQ-CYBMUJFWSA-N -1 3 370.844 3.663 20 0 FHADHM CC[C@H](Cc1ccccc1)NC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736349551 598532731 /nfs/dbraw/zinc/53/27/31/598532731.db2.gz GOWKGMUSTGXIRQ-CYBMUJFWSA-N -1 3 370.844 3.663 20 0 FHADHM CCc1c(C)sc(NC(=O)Cc2cc(C)ccc2C)c1-c1nnn[n-]1 ZINC000736675827 598540763 /nfs/dbraw/zinc/54/07/63/598540763.db2.gz PHPBZLVFTUCIPN-UHFFFAOYSA-N -1 3 355.467 3.597 20 0 FHADHM CCc1c(C)sc(NC(=O)Cc2cc(C)ccc2C)c1-c1nn[n-]n1 ZINC000736675827 598540764 /nfs/dbraw/zinc/54/07/64/598540764.db2.gz PHPBZLVFTUCIPN-UHFFFAOYSA-N -1 3 355.467 3.597 20 0 FHADHM C[C@H]1CCC[C@H](CC(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(F)F)C1 ZINC000736247186 598543380 /nfs/dbraw/zinc/54/33/80/598543380.db2.gz AZHDAALLUXKNMO-QWRGUYRKSA-N -1 3 365.384 3.623 20 0 FHADHM C[C@H]1CCC[C@H](CC(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(F)F)C1 ZINC000736247186 598543382 /nfs/dbraw/zinc/54/33/82/598543382.db2.gz AZHDAALLUXKNMO-QWRGUYRKSA-N -1 3 365.384 3.623 20 0 FHADHM CCC[C@H](C)C(=O)Nc1ccc(OCc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736418124 598543427 /nfs/dbraw/zinc/54/34/27/598543427.db2.gz AIMLKFQDETXAGV-AWEZNQCLSA-N -1 3 365.437 3.820 20 0 FHADHM CCC[C@H](C)C(=O)Nc1ccc(OCc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736418124 598543428 /nfs/dbraw/zinc/54/34/28/598543428.db2.gz AIMLKFQDETXAGV-AWEZNQCLSA-N -1 3 365.437 3.820 20 0 FHADHM C[C@H]1CCCC[C@H]1CC(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(F)F ZINC000736263448 598545213 /nfs/dbraw/zinc/54/52/13/598545213.db2.gz QUNYUJHKCBWSSE-QWRGUYRKSA-N -1 3 365.384 3.623 20 0 FHADHM C[C@H]1CCCC[C@H]1CC(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(F)F ZINC000736263448 598545215 /nfs/dbraw/zinc/54/52/15/598545215.db2.gz QUNYUJHKCBWSSE-QWRGUYRKSA-N -1 3 365.384 3.623 20 0 FHADHM Fc1cc(OCc2ccc(OCC(F)(F)F)cc2)ccc1-c1nnn[n-]1 ZINC000737652749 598549398 /nfs/dbraw/zinc/54/93/98/598549398.db2.gz OTPWDRCKDHNGRV-UHFFFAOYSA-N -1 3 368.290 3.526 20 0 FHADHM Fc1cc(OCc2ccc(OCC(F)(F)F)cc2)ccc1-c1nn[n-]n1 ZINC000737652749 598549399 /nfs/dbraw/zinc/54/93/99/598549399.db2.gz OTPWDRCKDHNGRV-UHFFFAOYSA-N -1 3 368.290 3.526 20 0 FHADHM Fc1ccc(C(F)(F)F)cc1NCCOc1ccc(-c2nn[n-]n2)cc1 ZINC000737647163 598553535 /nfs/dbraw/zinc/55/35/35/598553535.db2.gz CAXJBUOTTYQSCT-UHFFFAOYSA-N -1 3 367.306 3.516 20 0 FHADHM Cc1cc(Oc2ccccc2)ccc1NC(=O)c1ccc(-c2nnn[n-]2)cn1 ZINC000737279767 598570017 /nfs/dbraw/zinc/57/00/17/598570017.db2.gz MIDAGPRMNRDZOR-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1cc(Oc2ccccc2)ccc1NC(=O)c1ccc(-c2nn[n-]n2)cn1 ZINC000737279767 598570018 /nfs/dbraw/zinc/57/00/18/598570018.db2.gz MIDAGPRMNRDZOR-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Fc1cccc(OCCNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)c1 ZINC000737663202 598575595 /nfs/dbraw/zinc/57/55/95/598575595.db2.gz HRDOKZNSCDWKNI-UHFFFAOYSA-N -1 3 367.306 3.516 20 0 FHADHM Fc1cccc(OCCNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)c1 ZINC000737663202 598575596 /nfs/dbraw/zinc/57/55/96/598575596.db2.gz HRDOKZNSCDWKNI-UHFFFAOYSA-N -1 3 367.306 3.516 20 0 FHADHM Cc1nc(C)c(CCNc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)s1 ZINC000737474828 598580211 /nfs/dbraw/zinc/58/02/11/598580211.db2.gz VQZJYMPFRKYUJW-UHFFFAOYSA-N -1 3 368.388 3.613 20 0 FHADHM Cc1nc(C)c(CCNc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)s1 ZINC000737474828 598580212 /nfs/dbraw/zinc/58/02/12/598580212.db2.gz VQZJYMPFRKYUJW-UHFFFAOYSA-N -1 3 368.388 3.613 20 0 FHADHM CC(C)Oc1ccc(NC(=S)Nc2ccc(F)c(-c3nnn[n-]3)c2)cc1 ZINC000735912922 598581508 /nfs/dbraw/zinc/58/15/08/598581508.db2.gz JMFLVEJLXXEVHY-UHFFFAOYSA-N -1 3 372.429 3.602 20 0 FHADHM CC(C)Oc1ccc(NC(=S)Nc2ccc(F)c(-c3nn[n-]n3)c2)cc1 ZINC000735912922 598581509 /nfs/dbraw/zinc/58/15/09/598581509.db2.gz JMFLVEJLXXEVHY-UHFFFAOYSA-N -1 3 372.429 3.602 20 0 FHADHM O=C(Nc1ccc(Cl)cc1-n1cccc1)c1sccc1-c1nnn[n-]1 ZINC000738164380 598587347 /nfs/dbraw/zinc/58/73/47/598587347.db2.gz YDTCWDXANUXZKP-UHFFFAOYSA-N -1 3 370.825 3.625 20 0 FHADHM O=C(Nc1ccc(Cl)cc1-n1cccc1)c1sccc1-c1nn[n-]n1 ZINC000738164380 598587349 /nfs/dbraw/zinc/58/73/49/598587349.db2.gz YDTCWDXANUXZKP-UHFFFAOYSA-N -1 3 370.825 3.625 20 0 FHADHM Fc1cc(-c2nnn[n-]2)cc(F)c1NCC1(Sc2ccccc2)CC1 ZINC000737640436 598594141 /nfs/dbraw/zinc/59/41/41/598594141.db2.gz WXYGIWROSVHKDB-UHFFFAOYSA-N -1 3 359.405 3.882 20 0 FHADHM Fc1cc(-c2nn[n-]n2)cc(F)c1NCC1(Sc2ccccc2)CC1 ZINC000737640436 598594144 /nfs/dbraw/zinc/59/41/44/598594144.db2.gz WXYGIWROSVHKDB-UHFFFAOYSA-N -1 3 359.405 3.882 20 0 FHADHM CC(C)c1ccc2cc(C(=O)Nc3ccc(F)c(-c4nnn[n-]4)c3)[nH]c2c1 ZINC000735927840 598600496 /nfs/dbraw/zinc/60/04/96/598600496.db2.gz CSOCVZCRTRLGIY-UHFFFAOYSA-N -1 3 364.384 3.863 20 0 FHADHM CC(C)c1ccc2cc(C(=O)Nc3ccc(F)c(-c4nn[n-]n4)c3)[nH]c2c1 ZINC000735927840 598600498 /nfs/dbraw/zinc/60/04/98/598600498.db2.gz CSOCVZCRTRLGIY-UHFFFAOYSA-N -1 3 364.384 3.863 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)N(Cc1ccco1)C1CCCC1 ZINC000738161622 598601834 /nfs/dbraw/zinc/60/18/34/598601834.db2.gz HANBHKBEYFYWJW-UHFFFAOYSA-N -1 3 370.388 3.576 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)N(Cc1ccco1)C1CCCC1 ZINC000738161622 598601836 /nfs/dbraw/zinc/60/18/36/598601836.db2.gz HANBHKBEYFYWJW-UHFFFAOYSA-N -1 3 370.388 3.576 20 0 FHADHM Cc1ccc(-c2noc([C@H](C)Oc3ccc(-c4nn[n-]n4)cc3)n2)cc1F ZINC000737303501 598608804 /nfs/dbraw/zinc/60/88/04/598608804.db2.gz MLRJHZCPXZRGKQ-NSHDSACASA-N -1 3 366.356 3.504 20 0 FHADHM CC[C@@H]1c2ccsc2CCN1C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000736413277 598632377 /nfs/dbraw/zinc/63/23/77/598632377.db2.gz XQMIMVBISHCSDT-CQSZACIVSA-N -1 3 372.429 3.609 20 0 FHADHM CC[C@@H]1c2ccsc2CCN1C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000736413277 598632378 /nfs/dbraw/zinc/63/23/78/598632378.db2.gz XQMIMVBISHCSDT-CQSZACIVSA-N -1 3 372.429 3.609 20 0 FHADHM Cc1cccc(-c2nnc(SCc3ccc(F)cc3-c3nnn[n-]3)o2)c1 ZINC000737379179 598643081 /nfs/dbraw/zinc/64/30/81/598643081.db2.gz DRWVLNXUFMLYPP-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM Cc1cccc(-c2nnc(SCc3ccc(F)cc3-c3nn[n-]n3)o2)c1 ZINC000737379179 598643083 /nfs/dbraw/zinc/64/30/83/598643083.db2.gz DRWVLNXUFMLYPP-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM Cc1ccccc1NC(=O)c1ccc(Oc2ccc(-c3nnn[n-]3)cn2)cc1 ZINC000737436968 598643821 /nfs/dbraw/zinc/64/38/21/598643821.db2.gz UXBUXLSNBFVWAQ-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccccc1NC(=O)c1ccc(Oc2ccc(-c3nn[n-]n3)cn2)cc1 ZINC000737436968 598643823 /nfs/dbraw/zinc/64/38/23/598643823.db2.gz UXBUXLSNBFVWAQ-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM O=C(OC1CCCCC1)c1ccc(Oc2ccc(-c3nnn[n-]3)cn2)cc1 ZINC000738216442 598645564 /nfs/dbraw/zinc/64/55/64/598645564.db2.gz ZXFSQPCBUMQVAA-UHFFFAOYSA-N -1 3 365.393 3.544 20 0 FHADHM O=C(OC1CCCCC1)c1ccc(Oc2ccc(-c3nn[n-]n3)cn2)cc1 ZINC000738216442 598645565 /nfs/dbraw/zinc/64/55/65/598645565.db2.gz ZXFSQPCBUMQVAA-UHFFFAOYSA-N -1 3 365.393 3.544 20 0 FHADHM O=C(CSc1ccc(-c2nnn[n-]2)cc1)Nc1ccc2ccccc2c1 ZINC000737946365 598645878 /nfs/dbraw/zinc/64/58/78/598645878.db2.gz CNDKDGOXCSWPQY-UHFFFAOYSA-N -1 3 361.430 3.751 20 0 FHADHM O=C(CSc1ccc(-c2nn[n-]n2)cc1)Nc1ccc2ccccc2c1 ZINC000737946365 598645879 /nfs/dbraw/zinc/64/58/79/598645879.db2.gz CNDKDGOXCSWPQY-UHFFFAOYSA-N -1 3 361.430 3.751 20 0 FHADHM CC(C)c1ocnc1C(=O)Nc1sc2c(c1-c1nnn[n-]1)CCCCC2 ZINC000735954400 598646065 /nfs/dbraw/zinc/64/60/65/598646065.db2.gz ZDPSDVGLFUXQNN-UHFFFAOYSA-N -1 3 372.454 3.561 20 0 FHADHM CC(C)c1ocnc1C(=O)Nc1sc2c(c1-c1nn[n-]n1)CCCCC2 ZINC000735954400 598646066 /nfs/dbraw/zinc/64/60/66/598646066.db2.gz ZDPSDVGLFUXQNN-UHFFFAOYSA-N -1 3 372.454 3.561 20 0 FHADHM O=C(C[C@@H](c1ccccc1)C(F)(F)F)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000104368046 598646835 /nfs/dbraw/zinc/64/68/35/598646835.db2.gz QHRHRETVQHUSSL-AWEZNQCLSA-N -1 3 361.327 3.541 20 0 FHADHM O=C(C[C@@H](c1ccccc1)C(F)(F)F)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000104368046 598646837 /nfs/dbraw/zinc/64/68/37/598646837.db2.gz QHRHRETVQHUSSL-AWEZNQCLSA-N -1 3 361.327 3.541 20 0 FHADHM Cc1sc(NC(=O)C(C)(C)c2ccc(C)cc2)c(-c2nnn[n-]2)c1C ZINC000737316474 598647166 /nfs/dbraw/zinc/64/71/66/598647166.db2.gz COFLURYBRIGCHA-UHFFFAOYSA-N -1 3 355.467 3.770 20 0 FHADHM Cc1sc(NC(=O)C(C)(C)c2ccc(C)cc2)c(-c2nn[n-]n2)c1C ZINC000737316474 598647167 /nfs/dbraw/zinc/64/71/67/598647167.db2.gz COFLURYBRIGCHA-UHFFFAOYSA-N -1 3 355.467 3.770 20 0 FHADHM Cc1sc(NC(=O)C(C)(C)c2ccc(F)cc2)c(-c2nnn[n-]2)c1C ZINC000737565532 598647844 /nfs/dbraw/zinc/64/78/44/598647844.db2.gz ZTEHUPSFLCMUMR-UHFFFAOYSA-N -1 3 359.430 3.600 20 0 FHADHM Cc1sc(NC(=O)C(C)(C)c2ccc(F)cc2)c(-c2nn[n-]n2)c1C ZINC000737565532 598647846 /nfs/dbraw/zinc/64/78/46/598647846.db2.gz ZTEHUPSFLCMUMR-UHFFFAOYSA-N -1 3 359.430 3.600 20 0 FHADHM CN(C(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)C1CCCC1 ZINC000736741432 598650153 /nfs/dbraw/zinc/65/01/53/598650153.db2.gz PAQOWZBFSQNMQV-UHFFFAOYSA-N -1 3 363.421 3.674 20 0 FHADHM CN(C(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)C1CCCC1 ZINC000736741432 598650155 /nfs/dbraw/zinc/65/01/55/598650155.db2.gz PAQOWZBFSQNMQV-UHFFFAOYSA-N -1 3 363.421 3.674 20 0 FHADHM CC(C)(C)[C@@H]1CCCC[C@@H]1NC(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000735597657 598651442 /nfs/dbraw/zinc/65/14/42/598651442.db2.gz RNOZMXQKPPUPTE-CVEARBPZSA-N -1 3 373.526 3.680 20 0 FHADHM CC(C)(C)[C@@H]1CCCC[C@@H]1NC(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000735597657 598651444 /nfs/dbraw/zinc/65/14/44/598651444.db2.gz RNOZMXQKPPUPTE-CVEARBPZSA-N -1 3 373.526 3.680 20 0 FHADHM CC(C)[C@@H](CC(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000736103691 598652171 /nfs/dbraw/zinc/65/21/71/598652171.db2.gz XSQNTEGMOAKYJR-DNVCBOLYSA-N -1 3 363.465 3.874 20 0 FHADHM CC(C)[C@@H](CC(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000736103691 598652172 /nfs/dbraw/zinc/65/21/72/598652172.db2.gz XSQNTEGMOAKYJR-DNVCBOLYSA-N -1 3 363.465 3.874 20 0 FHADHM Cc1cc([C@@H](C)NC(=O)CSc2ccc(-c3nnn[n-]3)cc2)c(C)s1 ZINC000737244695 598654093 /nfs/dbraw/zinc/65/40/93/598654093.db2.gz KEVRQPCRHPECGF-LLVKDONJSA-N -1 3 373.507 3.515 20 0 FHADHM Cc1cc([C@@H](C)NC(=O)CSc2ccc(-c3nn[n-]n3)cc2)c(C)s1 ZINC000737244695 598654094 /nfs/dbraw/zinc/65/40/94/598654094.db2.gz KEVRQPCRHPECGF-LLVKDONJSA-N -1 3 373.507 3.515 20 0 FHADHM Fc1ccc(CSc2ncc(Cl)cc2Cl)c(-c2nnn[n-]2)c1 ZINC000737651896 598697053 /nfs/dbraw/zinc/69/70/53/598697053.db2.gz ZEXPQMXOSMKKRD-UHFFFAOYSA-N -1 3 356.213 4.000 20 0 FHADHM Fc1ccc(CSc2ncc(Cl)cc2Cl)c(-c2nn[n-]n2)c1 ZINC000737651896 598697054 /nfs/dbraw/zinc/69/70/54/598697054.db2.gz ZEXPQMXOSMKKRD-UHFFFAOYSA-N -1 3 356.213 4.000 20 0 FHADHM Cc1ccc(NCc2ccc(-c3nnn[n-]3)cc2)cc1NC(=O)C(C)(C)C ZINC000737361509 598700760 /nfs/dbraw/zinc/70/07/60/598700760.db2.gz IICQTTVNUGEDGW-UHFFFAOYSA-N -1 3 364.453 3.772 20 0 FHADHM Cc1ccc(NCc2ccc(-c3nn[n-]n3)cc2)cc1NC(=O)C(C)(C)C ZINC000737361509 598700762 /nfs/dbraw/zinc/70/07/62/598700762.db2.gz IICQTTVNUGEDGW-UHFFFAOYSA-N -1 3 364.453 3.772 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nnn[n-]1)c1cc2ccc(F)cc2s1 ZINC000738236341 598707544 /nfs/dbraw/zinc/70/75/44/598707544.db2.gz VAXGSTJCDKYCEK-UHFFFAOYSA-N -1 3 372.356 3.717 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nn[n-]n1)c1cc2ccc(F)cc2s1 ZINC000738236341 598707546 /nfs/dbraw/zinc/70/75/46/598707546.db2.gz VAXGSTJCDKYCEK-UHFFFAOYSA-N -1 3 372.356 3.717 20 0 FHADHM CC(C)[C@H](CC(=O)OCc1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000735711164 598711948 /nfs/dbraw/zinc/71/19/48/598711948.db2.gz WHWSQMUBOYMFGU-SFHVURJKSA-N -1 3 350.422 3.740 20 0 FHADHM CC(C)[C@H](CC(=O)OCc1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000735711164 598711949 /nfs/dbraw/zinc/71/19/49/598711949.db2.gz WHWSQMUBOYMFGU-SFHVURJKSA-N -1 3 350.422 3.740 20 0 FHADHM C[C@@H](OC(=O)CSc1ccc(-c2nnn[n-]2)cc1)c1ccc(Cl)cc1 ZINC000736154682 598713270 /nfs/dbraw/zinc/71/32/70/598713270.db2.gz AADVIJBHVMWXAF-LLVKDONJSA-N -1 3 374.853 3.917 20 0 FHADHM C[C@@H](OC(=O)CSc1ccc(-c2nn[n-]n2)cc1)c1ccc(Cl)cc1 ZINC000736154682 598713272 /nfs/dbraw/zinc/71/32/72/598713272.db2.gz AADVIJBHVMWXAF-LLVKDONJSA-N -1 3 374.853 3.917 20 0 FHADHM O=C(CSc1nc2ccc(Cl)cc2o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000737952811 598718917 /nfs/dbraw/zinc/71/89/17/598718917.db2.gz BXNHSKGMIFTXRB-UHFFFAOYSA-N -1 3 371.809 3.636 20 0 FHADHM O=C(CSc1nc2ccc(Cl)cc2o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000737952811 598718919 /nfs/dbraw/zinc/71/89/19/598718919.db2.gz BXNHSKGMIFTXRB-UHFFFAOYSA-N -1 3 371.809 3.636 20 0 FHADHM CC(C)(C)[C@H]1CCc2c(sc(NC(=O)C(F)(F)F)c2-c2nnn[n-]2)C1 ZINC000735598011 598728458 /nfs/dbraw/zinc/72/84/58/598728458.db2.gz WKWHHIWMBLUAJA-ZETCQYMHSA-N -1 3 373.404 3.580 20 0 FHADHM CC(C)(C)[C@H]1CCc2c(sc(NC(=O)C(F)(F)F)c2-c2nn[n-]n2)C1 ZINC000735598011 598728460 /nfs/dbraw/zinc/72/84/60/598728460.db2.gz WKWHHIWMBLUAJA-ZETCQYMHSA-N -1 3 373.404 3.580 20 0 FHADHM CCc1ccccc1OC(=O)CCCCOc1cccc(-c2nnn[n-]2)c1 ZINC000736702490 598734207 /nfs/dbraw/zinc/73/42/07/598734207.db2.gz QDPOTGQVJNMBIO-UHFFFAOYSA-N -1 3 366.421 3.584 20 0 FHADHM CCc1ccccc1OC(=O)CCCCOc1cccc(-c2nn[n-]n2)c1 ZINC000736702490 598734208 /nfs/dbraw/zinc/73/42/08/598734208.db2.gz QDPOTGQVJNMBIO-UHFFFAOYSA-N -1 3 366.421 3.584 20 0 FHADHM CCC(=CC(=O)Nc1sc(C)c(C)c1-c1nnn[n-]1)c1ccccc1 ZINC000736305833 598734332 /nfs/dbraw/zinc/73/43/32/598734332.db2.gz XCLKOCXOXAYHJJ-RAXLEYEMSA-N -1 3 353.451 3.977 20 0 FHADHM CCC(=CC(=O)Nc1sc(C)c(C)c1-c1nn[n-]n1)c1ccccc1 ZINC000736305833 598734334 /nfs/dbraw/zinc/73/43/34/598734334.db2.gz XCLKOCXOXAYHJJ-RAXLEYEMSA-N -1 3 353.451 3.977 20 0 FHADHM C[C@@H](OC(=O)[C@H](C)CSc1ccccc1)c1cccc(-c2nnn[n-]2)c1 ZINC000736047904 598734794 /nfs/dbraw/zinc/73/47/94/598734794.db2.gz TTZYIEXOBMFODI-ZIAGYGMSSA-N -1 3 368.462 3.899 20 0 FHADHM C[C@@H](OC(=O)[C@H](C)CSc1ccccc1)c1cccc(-c2nn[n-]n2)c1 ZINC000736047904 598734795 /nfs/dbraw/zinc/73/47/95/598734795.db2.gz TTZYIEXOBMFODI-ZIAGYGMSSA-N -1 3 368.462 3.899 20 0 FHADHM Cc1cc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCCC3)ccc1F ZINC000737238768 598735128 /nfs/dbraw/zinc/73/51/28/598735128.db2.gz SHYQLJQGIQQMPC-UHFFFAOYSA-N -1 3 371.441 3.897 20 0 FHADHM Cc1cc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCCC3)ccc1F ZINC000737238768 598735129 /nfs/dbraw/zinc/73/51/29/598735129.db2.gz SHYQLJQGIQQMPC-UHFFFAOYSA-N -1 3 371.441 3.897 20 0 FHADHM Cc1ccccc1CCC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C(C)C ZINC000737426022 598736904 /nfs/dbraw/zinc/73/69/04/598736904.db2.gz HIFLVHSRKHRZPE-UHFFFAOYSA-N -1 3 363.465 3.545 20 0 FHADHM Cc1ccccc1CCC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C(C)C ZINC000737426022 598736905 /nfs/dbraw/zinc/73/69/05/598736905.db2.gz HIFLVHSRKHRZPE-UHFFFAOYSA-N -1 3 363.465 3.545 20 0 FHADHM C[C@@H](Sc1ccc(Cl)cc1)C(=O)Nc1sccc1-c1nnn[n-]1 ZINC000736193447 598752913 /nfs/dbraw/zinc/75/29/13/598752913.db2.gz RCYFYTIHAZGXOL-MRVPVSSYSA-N -1 3 365.871 3.701 20 0 FHADHM C[C@@H](Sc1ccc(Cl)cc1)C(=O)Nc1sccc1-c1nn[n-]n1 ZINC000736193447 598752914 /nfs/dbraw/zinc/75/29/14/598752914.db2.gz RCYFYTIHAZGXOL-MRVPVSSYSA-N -1 3 365.871 3.701 20 0 FHADHM Cc1ccccc1[C@H](NC(=O)CCc1ccc(-c2nnn[n-]2)cc1)C(C)C ZINC000737424047 598754742 /nfs/dbraw/zinc/75/47/42/598754742.db2.gz UJVCGTBYTJMBMF-HXUWFJFHSA-N -1 3 363.465 3.621 20 0 FHADHM Cc1ccccc1[C@H](NC(=O)CCc1ccc(-c2nn[n-]n2)cc1)C(C)C ZINC000737424047 598754743 /nfs/dbraw/zinc/75/47/43/598754743.db2.gz UJVCGTBYTJMBMF-HXUWFJFHSA-N -1 3 363.465 3.621 20 0 FHADHM O=C(Nc1cccc(Oc2ccncc2)c1)Nc1cccc(-c2nnn[n-]2)c1 ZINC000738182339 598758737 /nfs/dbraw/zinc/75/87/37/598758737.db2.gz DPFCGFNOKAIWKM-UHFFFAOYSA-N -1 3 373.376 3.698 20 0 FHADHM O=C(Nc1cccc(Oc2ccncc2)c1)Nc1cccc(-c2nn[n-]n2)c1 ZINC000738182339 598758738 /nfs/dbraw/zinc/75/87/38/598758738.db2.gz DPFCGFNOKAIWKM-UHFFFAOYSA-N -1 3 373.376 3.698 20 0 FHADHM CC(C)(C)CN(Cc1ccccc1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000735618165 598768848 /nfs/dbraw/zinc/76/88/48/598768848.db2.gz KDUTUSNIBJBSAO-UHFFFAOYSA-N -1 3 364.453 3.947 20 0 FHADHM CC(C)(C)CN(Cc1ccccc1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000735618165 598768850 /nfs/dbraw/zinc/76/88/50/598768850.db2.gz KDUTUSNIBJBSAO-UHFFFAOYSA-N -1 3 364.453 3.947 20 0 FHADHM Cc1cccc(CNc2c(-c3nnn[n-]3)cnc3c(F)cc(F)cc32)c1 ZINC000737393028 598770853 /nfs/dbraw/zinc/77/08/53/598770853.db2.gz FCMAQYXRQKTFPK-UHFFFAOYSA-N -1 3 352.348 3.614 20 0 FHADHM Cc1cccc(CNc2c(-c3nn[n-]n3)cnc3c(F)cc(F)cc32)c1 ZINC000737393028 598770854 /nfs/dbraw/zinc/77/08/54/598770854.db2.gz FCMAQYXRQKTFPK-UHFFFAOYSA-N -1 3 352.348 3.614 20 0 FHADHM C[C@H](OC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)C1CC1 ZINC000736163860 598786267 /nfs/dbraw/zinc/78/62/67/598786267.db2.gz RTEYAZLGUABQLW-LBPRGKRZSA-N -1 3 350.378 3.614 20 0 FHADHM C[C@H](OC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)C1CC1 ZINC000736163860 598786269 /nfs/dbraw/zinc/78/62/69/598786269.db2.gz RTEYAZLGUABQLW-LBPRGKRZSA-N -1 3 350.378 3.614 20 0 FHADHM CCCCNC(=S)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736461960 598789126 /nfs/dbraw/zinc/78/91/26/598789126.db2.gz XUTCCYGLUSCHAS-UHFFFAOYSA-N -1 3 368.466 3.746 20 0 FHADHM CCCCNC(=S)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736461960 598789128 /nfs/dbraw/zinc/78/91/28/598789128.db2.gz XUTCCYGLUSCHAS-UHFFFAOYSA-N -1 3 368.466 3.746 20 0 FHADHM CCN(C(=O)[C@@H]1CCc2ccccc21)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736503416 598789942 /nfs/dbraw/zinc/78/99/42/598789942.db2.gz WHZRGVMMKUCJQV-IFXJQAMLSA-N -1 3 361.449 3.506 20 0 FHADHM CCN(C(=O)[C@@H]1CCc2ccccc21)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736503416 598789943 /nfs/dbraw/zinc/78/99/43/598789943.db2.gz WHZRGVMMKUCJQV-IFXJQAMLSA-N -1 3 361.449 3.506 20 0 FHADHM CCC(C)(CC)NC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736312007 598805410 /nfs/dbraw/zinc/80/54/10/598805410.db2.gz COXUKFIBNIKCDM-UHFFFAOYSA-N -1 3 365.437 3.968 20 0 FHADHM CCC(C)(CC)NC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736312007 598805411 /nfs/dbraw/zinc/80/54/11/598805411.db2.gz COXUKFIBNIKCDM-UHFFFAOYSA-N -1 3 365.437 3.968 20 0 FHADHM CC(C)Oc1ccc(NC(=S)N[C@H]2CCCC[C@@H]2C)cc1-c1nnn[n-]1 ZINC000820173559 607367262 /nfs/dbraw/zinc/36/72/62/607367262.db2.gz HTLVHDMYSWNFCH-WFASDCNBSA-N -1 3 374.514 3.519 20 0 FHADHM CC(C)Oc1ccc(NC(=S)N[C@H]2CCCC[C@@H]2C)cc1-c1nn[n-]n1 ZINC000820173559 607367263 /nfs/dbraw/zinc/36/72/63/607367263.db2.gz HTLVHDMYSWNFCH-WFASDCNBSA-N -1 3 374.514 3.519 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1CSCc1cc(-c2ccco2)on1 ZINC000821752129 607367452 /nfs/dbraw/zinc/36/74/52/607367452.db2.gz GXTHVAJVJAHNOT-UHFFFAOYSA-N -1 3 369.406 3.557 20 0 FHADHM CC(C)CCc1noc(CS[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)n1 ZINC000735817483 599325186 /nfs/dbraw/zinc/32/51/86/599325186.db2.gz AFLPUKNIOZDTDG-LBPRGKRZSA-N -1 3 358.471 3.833 20 0 FHADHM CC(C)CCc1noc(CS[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)n1 ZINC000735817483 599325187 /nfs/dbraw/zinc/32/51/87/599325187.db2.gz AFLPUKNIOZDTDG-LBPRGKRZSA-N -1 3 358.471 3.833 20 0 FHADHM FC(F)Sc1ccc(NCCOc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000737639044 599327107 /nfs/dbraw/zinc/32/71/07/599327107.db2.gz LNPHTPDITZGJSW-UHFFFAOYSA-N -1 3 363.393 3.672 20 0 FHADHM FC(F)Sc1ccc(NCCOc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000737639044 599327110 /nfs/dbraw/zinc/32/71/10/599327110.db2.gz LNPHTPDITZGJSW-UHFFFAOYSA-N -1 3 363.393 3.672 20 0 FHADHM CCCCOc1cccc(NCCOc2cccc(-c3nnn[n-]3)c2)c1 ZINC000736464086 599327602 /nfs/dbraw/zinc/32/76/02/599327602.db2.gz VYSHBLXHSKORNP-UHFFFAOYSA-N -1 3 353.426 3.537 20 0 FHADHM CCCCOc1cccc(NCCOc2cccc(-c3nn[n-]n3)c2)c1 ZINC000736464086 599327604 /nfs/dbraw/zinc/32/76/04/599327604.db2.gz VYSHBLXHSKORNP-UHFFFAOYSA-N -1 3 353.426 3.537 20 0 FHADHM C[C@@H](SCCC(=O)Nc1cccc(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736187466 599327717 /nfs/dbraw/zinc/32/77/17/599327717.db2.gz BBSVUJJBHDFJSA-GFCCVEGCSA-N -1 3 371.441 3.829 20 0 FHADHM C[C@@H](SCCC(=O)Nc1cccc(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736187466 599327719 /nfs/dbraw/zinc/32/77/19/599327719.db2.gz BBSVUJJBHDFJSA-GFCCVEGCSA-N -1 3 371.441 3.829 20 0 FHADHM C[C@@H](SCCC(=O)Nc1ccccc1F)c1ccc(-c2nnn[n-]2)cc1 ZINC000736192311 599328803 /nfs/dbraw/zinc/32/88/03/599328803.db2.gz XYDLJYXFOFPNEX-GFCCVEGCSA-N -1 3 371.441 3.829 20 0 FHADHM C[C@@H](SCCC(=O)Nc1ccccc1F)c1ccc(-c2nn[n-]n2)cc1 ZINC000736192311 599328806 /nfs/dbraw/zinc/32/88/06/599328806.db2.gz XYDLJYXFOFPNEX-GFCCVEGCSA-N -1 3 371.441 3.829 20 0 FHADHM C[C@@H](S[C@H](C)c1ccc(-c2nnn[n-]2)cc1)C(=O)Nc1cccc(F)c1 ZINC000736191813 599328999 /nfs/dbraw/zinc/32/89/99/599328999.db2.gz XANXDXJINLIIJQ-VXGBXAGGSA-N -1 3 371.441 3.827 20 0 FHADHM C[C@@H](S[C@H](C)c1ccc(-c2nn[n-]n2)cc1)C(=O)Nc1cccc(F)c1 ZINC000736191813 599329001 /nfs/dbraw/zinc/32/90/01/599329001.db2.gz XANXDXJINLIIJQ-VXGBXAGGSA-N -1 3 371.441 3.827 20 0 FHADHM CC(C)Oc1c(Cl)cccc1NCCOc1cccc(-c2nnn[n-]2)c1 ZINC000735904935 599329613 /nfs/dbraw/zinc/32/96/13/599329613.db2.gz XCFCOHODCGDUGQ-UHFFFAOYSA-N -1 3 373.844 3.798 20 0 FHADHM CC(C)Oc1c(Cl)cccc1NCCOc1cccc(-c2nn[n-]n2)c1 ZINC000735904935 599329614 /nfs/dbraw/zinc/32/96/14/599329614.db2.gz XCFCOHODCGDUGQ-UHFFFAOYSA-N -1 3 373.844 3.798 20 0 FHADHM Fc1ccc(NCc2ccc(OC(F)(F)F)cc2)cc1-c1nnn[n-]1 ZINC000737655617 599331708 /nfs/dbraw/zinc/33/17/08/599331708.db2.gz AUKIGEJMBVEIEI-UHFFFAOYSA-N -1 3 353.279 3.517 20 0 FHADHM Fc1ccc(NCc2ccc(OC(F)(F)F)cc2)cc1-c1nn[n-]n1 ZINC000737655617 599331710 /nfs/dbraw/zinc/33/17/10/599331710.db2.gz AUKIGEJMBVEIEI-UHFFFAOYSA-N -1 3 353.279 3.517 20 0 FHADHM C[C@H](SCC(=O)N[C@@H]1CCC[C@@H](C)[C@H]1C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736190496 599332610 /nfs/dbraw/zinc/33/26/10/599332610.db2.gz SMZGDWZAUXINKV-VWPFQQQWSA-N -1 3 373.526 3.602 20 0 FHADHM C[C@H](SCC(=O)N[C@@H]1CCC[C@@H](C)[C@H]1C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736190496 599332611 /nfs/dbraw/zinc/33/26/11/599332611.db2.gz SMZGDWZAUXINKV-VWPFQQQWSA-N -1 3 373.526 3.602 20 0 FHADHM CC(C)[C@@H](Sc1ccccc1-c1nnn[n-]1)C(=O)N(C)C1CCCCC1 ZINC000820031665 599346158 /nfs/dbraw/zinc/34/61/58/599346158.db2.gz GZTCQTDBWVFDPC-QGZVFWFLSA-N -1 3 373.526 3.775 20 0 FHADHM CC(C)[C@@H](Sc1ccccc1-c1nn[n-]n1)C(=O)N(C)C1CCCCC1 ZINC000820031665 599346161 /nfs/dbraw/zinc/34/61/61/599346161.db2.gz GZTCQTDBWVFDPC-QGZVFWFLSA-N -1 3 373.526 3.775 20 0 FHADHM COCCOc1ccc(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1Cl ZINC000821693979 599369713 /nfs/dbraw/zinc/36/97/13/599369713.db2.gz XRYKXGNGYZDBHY-GFCCVEGCSA-N -1 3 373.844 3.718 20 0 FHADHM COCCOc1ccc(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1Cl ZINC000821693979 599369716 /nfs/dbraw/zinc/36/97/16/599369716.db2.gz XRYKXGNGYZDBHY-GFCCVEGCSA-N -1 3 373.844 3.718 20 0 FHADHM CSCCCC(=O)Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1 ZINC000737181164 599372735 /nfs/dbraw/zinc/37/27/35/599372735.db2.gz LBFZDYBUPDFDHT-UHFFFAOYSA-N -1 3 359.480 3.677 20 0 FHADHM CSCCCC(=O)Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1 ZINC000737181164 599372737 /nfs/dbraw/zinc/37/27/37/599372737.db2.gz LBFZDYBUPDFDHT-UHFFFAOYSA-N -1 3 359.480 3.677 20 0 FHADHM C[C@H](NC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1ccc(F)cc1Cl ZINC000736099085 599377801 /nfs/dbraw/zinc/37/78/01/599377801.db2.gz GKXJVADMCXYNAQ-LAHYYIKRSA-N -1 3 371.803 3.550 20 0 FHADHM C[C@H](NC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1ccc(F)cc1Cl ZINC000736099085 599377804 /nfs/dbraw/zinc/37/78/04/599377804.db2.gz GKXJVADMCXYNAQ-LAHYYIKRSA-N -1 3 371.803 3.550 20 0 FHADHM Cc1cc(-c2nn[n-]n2)cc(C)c1OCc1cc(-c2ccc(F)cc2)no1 ZINC000822128947 599389299 /nfs/dbraw/zinc/38/92/99/599389299.db2.gz GONFMYIDTKBHHU-UHFFFAOYSA-N -1 3 365.368 3.857 20 0 FHADHM COc1ccc([C@H]2CCCN2c2cc(Cl)ccc2-c2nnn[n-]2)cc1 ZINC000737077185 599397593 /nfs/dbraw/zinc/39/75/93/599397593.db2.gz SKAJAPSHLBKOCY-MRXNPFEDSA-N -1 3 355.829 3.870 20 0 FHADHM COc1ccc([C@H]2CCCN2c2cc(Cl)ccc2-c2nn[n-]n2)cc1 ZINC000737077185 599397600 /nfs/dbraw/zinc/39/76/00/599397600.db2.gz SKAJAPSHLBKOCY-MRXNPFEDSA-N -1 3 355.829 3.870 20 0 FHADHM C[C@@H](NC(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1)c1cccc(Cl)c1 ZINC000820352314 599397943 /nfs/dbraw/zinc/39/79/43/599397943.db2.gz UFGPSGDAUXYXGQ-VXGBXAGGSA-N -1 3 370.844 3.642 20 0 FHADHM C[C@@H](NC(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1)c1cccc(Cl)c1 ZINC000820352314 599397946 /nfs/dbraw/zinc/39/79/46/599397946.db2.gz UFGPSGDAUXYXGQ-VXGBXAGGSA-N -1 3 370.844 3.642 20 0 FHADHM C[C@H](NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(Cl)cc1 ZINC000820353388 599398654 /nfs/dbraw/zinc/39/86/54/599398654.db2.gz ZPVBKQDGQVPKAG-RYUDHWBXSA-N -1 3 370.844 3.642 20 0 FHADHM C[C@H](NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)c1ccc(Cl)cc1 ZINC000820353388 599398657 /nfs/dbraw/zinc/39/86/57/599398657.db2.gz ZPVBKQDGQVPKAG-RYUDHWBXSA-N -1 3 370.844 3.642 20 0 FHADHM Fc1ccc(C2=CCN(c3cc(-c4nnn[n-]4)c4ccccc4n3)CC2)cc1 ZINC000737647108 599400799 /nfs/dbraw/zinc/40/07/99/599400799.db2.gz BPECZNLSAUSNCF-UHFFFAOYSA-N -1 3 372.407 3.848 20 0 FHADHM Fc1ccc(C2=CCN(c3cc(-c4nn[n-]n4)c4ccccc4n3)CC2)cc1 ZINC000737647108 599400801 /nfs/dbraw/zinc/40/08/01/599400801.db2.gz BPECZNLSAUSNCF-UHFFFAOYSA-N -1 3 372.407 3.848 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(NCc2ccnc(N3CCCCC3)c2)c1 ZINC000737570979 599412989 /nfs/dbraw/zinc/41/29/89/599412989.db2.gz OMMFRVNXJULKDO-UHFFFAOYSA-N -1 3 369.860 3.518 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(NCc2ccnc(N3CCCCC3)c2)c1 ZINC000737570979 599412990 /nfs/dbraw/zinc/41/29/90/599412990.db2.gz OMMFRVNXJULKDO-UHFFFAOYSA-N -1 3 369.860 3.518 20 0 FHADHM Fc1ccc(C2(CNc3cc(-c4nnn[n-]4)c4ccccc4n3)CC2)cc1 ZINC000737652502 599413001 /nfs/dbraw/zinc/41/30/01/599413001.db2.gz UUGYNCRGLFTHTI-UHFFFAOYSA-N -1 3 360.396 3.698 20 0 FHADHM Fc1ccc(C2(CNc3cc(-c4nn[n-]n4)c4ccccc4n3)CC2)cc1 ZINC000737652502 599413002 /nfs/dbraw/zinc/41/30/02/599413002.db2.gz UUGYNCRGLFTHTI-UHFFFAOYSA-N -1 3 360.396 3.698 20 0 FHADHM Clc1ccc(CCNc2cc(-c3nnn[n-]3)c3ccccc3n2)s1 ZINC000737576337 599413013 /nfs/dbraw/zinc/41/30/13/599413013.db2.gz PSWZXWAKFQXPJW-UHFFFAOYSA-N -1 3 356.842 3.784 20 0 FHADHM Clc1ccc(CCNc2cc(-c3nn[n-]n3)c3ccccc3n2)s1 ZINC000737576337 599413014 /nfs/dbraw/zinc/41/30/14/599413014.db2.gz PSWZXWAKFQXPJW-UHFFFAOYSA-N -1 3 356.842 3.784 20 0 FHADHM CCc1cccc2c1OCC[C@@H]2Nc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000736694982 599424929 /nfs/dbraw/zinc/42/49/29/599424929.db2.gz FTJBSHBNKGHFHC-SFHVURJKSA-N -1 3 372.432 3.913 20 0 FHADHM CCc1cccc2c1OCC[C@@H]2Nc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000736694982 599424930 /nfs/dbraw/zinc/42/49/30/599424930.db2.gz FTJBSHBNKGHFHC-SFHVURJKSA-N -1 3 372.432 3.913 20 0 FHADHM CC[C@H](NC(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1)C1CCCCC1 ZINC000820919771 599431042 /nfs/dbraw/zinc/43/10/42/599431042.db2.gz GLPJEOWXBKFSQQ-GUYCJALGSA-N -1 3 356.474 3.586 20 0 FHADHM CC[C@H](NC(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1)C1CCCCC1 ZINC000820919771 599431045 /nfs/dbraw/zinc/43/10/45/599431045.db2.gz GLPJEOWXBKFSQQ-GUYCJALGSA-N -1 3 356.474 3.586 20 0 FHADHM CCOc1ccc(CNc2cc(-c3nnn[n-]3)c3ccccc3n2)cc1F ZINC000736644204 599431331 /nfs/dbraw/zinc/43/13/31/599431331.db2.gz HKQXZKXQRDTUIU-UHFFFAOYSA-N -1 3 364.384 3.565 20 0 FHADHM CCOc1ccc(CNc2cc(-c3nn[n-]n3)c3ccccc3n2)cc1F ZINC000736644204 599431333 /nfs/dbraw/zinc/43/13/33/599431333.db2.gz HKQXZKXQRDTUIU-UHFFFAOYSA-N -1 3 364.384 3.565 20 0 FHADHM CC(C)COc1ccc(C(C)(C)NCc2ccc(-c3nnn[n-]3)o2)cc1 ZINC000820102664 599432687 /nfs/dbraw/zinc/43/26/87/599432687.db2.gz FZJTXKAGLRUIGJ-UHFFFAOYSA-N -1 3 355.442 3.519 20 0 FHADHM CCc1nc([C@H](C)Nc2cc(-c3nnn[n-]3)c3ccccc3n2)cs1 ZINC000736698066 599437714 /nfs/dbraw/zinc/43/77/14/599437714.db2.gz HWKXZLMFYXJHRB-JTQLQIEISA-N -1 3 351.439 3.607 20 0 FHADHM CCc1nc([C@H](C)Nc2cc(-c3nn[n-]n3)c3ccccc3n2)cs1 ZINC000736698066 599437716 /nfs/dbraw/zinc/43/77/16/599437716.db2.gz HWKXZLMFYXJHRB-JTQLQIEISA-N -1 3 351.439 3.607 20 0 FHADHM Fc1ccc(CSCc2ccc3ccccc3n2)c(-c2nnn[n-]2)c1 ZINC000737651237 599452336 /nfs/dbraw/zinc/45/23/36/599452336.db2.gz UZPBFBKXTDTZAB-UHFFFAOYSA-N -1 3 351.410 3.987 20 0 FHADHM Fc1ccc(CSCc2ccc3ccccc3n2)c(-c2nn[n-]n2)c1 ZINC000737651237 599452339 /nfs/dbraw/zinc/45/23/39/599452339.db2.gz UZPBFBKXTDTZAB-UHFFFAOYSA-N -1 3 351.410 3.987 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@H](C)C[C@H](C)CC ZINC000821104428 599459074 /nfs/dbraw/zinc/45/90/74/599459074.db2.gz CQCZUTCLHFDVPZ-HUUCEWRRSA-N -1 3 358.490 3.613 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@H](C)C[C@H](C)CC ZINC000821104428 599459076 /nfs/dbraw/zinc/45/90/76/599459076.db2.gz CQCZUTCLHFDVPZ-HUUCEWRRSA-N -1 3 358.490 3.613 20 0 FHADHM Cc1ccc2nc(C=Cc3cnc4ccc(-c5nnn[n-]5)cn34)ccc2c1 ZINC000737373103 599460713 /nfs/dbraw/zinc/46/07/13/599460713.db2.gz CZKCYDVBTFWOQM-SREVYHEPSA-N -1 3 353.389 3.541 20 0 FHADHM Cc1ccc2nc(C=Cc3cnc4ccc(-c5nn[n-]n5)cn34)ccc2c1 ZINC000737373103 599460716 /nfs/dbraw/zinc/46/07/16/599460716.db2.gz CZKCYDVBTFWOQM-SREVYHEPSA-N -1 3 353.389 3.541 20 0 FHADHM Clc1ccc2ccc(C=Cc3cnc4ccc(-c5nnn[n-]5)cn34)nc2c1 ZINC000737575647 599464295 /nfs/dbraw/zinc/46/42/95/599464295.db2.gz ZVDYEZFLKMKDOQ-VOTSOKGWSA-N -1 3 373.807 3.886 20 0 FHADHM Clc1ccc2ccc(C=Cc3cnc4ccc(-c5nn[n-]n5)cn34)nc2c1 ZINC000737575647 599464298 /nfs/dbraw/zinc/46/42/98/599464298.db2.gz ZVDYEZFLKMKDOQ-VOTSOKGWSA-N -1 3 373.807 3.886 20 0 FHADHM C[C@H](NC(=O)N1CCC2(CCCCC2)CC1)c1cccc(-c2nnn[n-]2)c1 ZINC000820339496 599478066 /nfs/dbraw/zinc/47/80/66/599478066.db2.gz CZHKOGVRARAZPB-HNNXBMFYSA-N -1 3 368.485 3.684 20 0 FHADHM C[C@H](NC(=O)N1CCC2(CCCCC2)CC1)c1cccc(-c2nn[n-]n2)c1 ZINC000820339496 599478068 /nfs/dbraw/zinc/47/80/68/599478068.db2.gz CZHKOGVRARAZPB-HNNXBMFYSA-N -1 3 368.485 3.684 20 0 FHADHM Fc1ccc(NCc2cccc(OCC(F)(F)F)c2)c(-c2nnn[n-]2)c1 ZINC000822783148 599479164 /nfs/dbraw/zinc/47/91/64/599479164.db2.gz XIQADFKWUJRQOY-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM Fc1ccc(NCc2cccc(OCC(F)(F)F)c2)c(-c2nn[n-]n2)c1 ZINC000822783148 599479165 /nfs/dbraw/zinc/47/91/65/599479165.db2.gz XIQADFKWUJRQOY-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM C[C@H](C[C@H](O)c1ccc(F)cc1)Nc1ccc(Cl)cc1-c1nnn[n-]1 ZINC000820232147 607381169 /nfs/dbraw/zinc/38/11/69/607381169.db2.gz FCOBGOFULKQQFF-HWPZZCPQSA-N -1 3 361.808 3.583 20 0 FHADHM C[C@H](C[C@H](O)c1ccc(F)cc1)Nc1ccc(Cl)cc1-c1nn[n-]n1 ZINC000820232147 607381172 /nfs/dbraw/zinc/38/11/72/607381172.db2.gz FCOBGOFULKQQFF-HWPZZCPQSA-N -1 3 361.808 3.583 20 0 FHADHM Fc1ccc(NCc2cc(F)cc(Br)c2)c(-c2nnn[n-]2)c1 ZINC000822748174 599488710 /nfs/dbraw/zinc/48/87/10/599488710.db2.gz LFBNMPNIDCRDPJ-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1ccc(NCc2cc(F)cc(Br)c2)c(-c2nn[n-]n2)c1 ZINC000822748174 599488712 /nfs/dbraw/zinc/48/87/12/599488712.db2.gz LFBNMPNIDCRDPJ-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM C[C@H](Nc1ccc(F)cc1-c1nnn[n-]1)c1ccc(Br)cc1 ZINC000820455389 599500439 /nfs/dbraw/zinc/50/04/39/599500439.db2.gz IBSXWRNFLYADLF-VIFPVBQESA-N -1 3 362.206 3.941 20 0 FHADHM C[C@H](Nc1ccc(F)cc1-c1nn[n-]n1)c1ccc(Br)cc1 ZINC000820455389 599500441 /nfs/dbraw/zinc/50/04/41/599500441.db2.gz IBSXWRNFLYADLF-VIFPVBQESA-N -1 3 362.206 3.941 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1NCc1ccccc1Br ZINC000822585556 599503703 /nfs/dbraw/zinc/50/37/03/599503703.db2.gz DSXLWAHFAPOLLC-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1NCc1ccccc1Br ZINC000822585556 599503704 /nfs/dbraw/zinc/50/37/04/599503704.db2.gz DSXLWAHFAPOLLC-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM C[C@@H](NC(=O)C[C@@H]1C[C@@H](C)CC(C)(C)C1)c1cccc(-c2nnn[n-]2)c1 ZINC000820655258 599515044 /nfs/dbraw/zinc/51/50/44/599515044.db2.gz ALHHGIMDOQEYAO-KFWWJZLASA-N -1 3 355.486 3.896 20 0 FHADHM C[C@@H](NC(=O)C[C@@H]1C[C@@H](C)CC(C)(C)C1)c1cccc(-c2nn[n-]n2)c1 ZINC000820655258 599515046 /nfs/dbraw/zinc/51/50/46/599515046.db2.gz ALHHGIMDOQEYAO-KFWWJZLASA-N -1 3 355.486 3.896 20 0 FHADHM CCOc1ccccc1CNc1ccc(-c2nn[n-]n2)cc1C(F)(F)F ZINC000736654754 599519883 /nfs/dbraw/zinc/51/98/83/599519883.db2.gz XLCKSZNQACBRTK-UHFFFAOYSA-N -1 3 363.343 3.896 20 0 FHADHM FC(F)(F)c1cc(-c2nn[n-]n2)ccc1NCc1ccc(Cl)nc1 ZINC000737625683 599521085 /nfs/dbraw/zinc/52/10/85/599521085.db2.gz DDMJXUKXQHKPJC-UHFFFAOYSA-N -1 3 354.723 3.546 20 0 FHADHM C[C@H](S[C@@H](C)c1cccs1)C(=O)Nc1ccccc1-c1nnn[n-]1 ZINC000736188208 599524186 /nfs/dbraw/zinc/52/41/86/599524186.db2.gz JBQGLTZBYRMFRD-QWRGUYRKSA-N -1 3 359.480 3.750 20 0 FHADHM C[C@H](S[C@@H](C)c1cccs1)C(=O)Nc1ccccc1-c1nn[n-]n1 ZINC000736188208 599524189 /nfs/dbraw/zinc/52/41/89/599524189.db2.gz JBQGLTZBYRMFRD-QWRGUYRKSA-N -1 3 359.480 3.750 20 0 FHADHM FC(F)(F)c1cc(NC[C@H]2CCc3ccccc3N2)ccc1-c1nnn[n-]1 ZINC000822723229 599524483 /nfs/dbraw/zinc/52/44/83/599524483.db2.gz ARQQFTTWEMLKNL-CYBMUJFWSA-N -1 3 374.370 3.724 20 0 FHADHM FC(F)(F)c1cc(NC[C@H]2CCc3ccccc3N2)ccc1-c1nn[n-]n1 ZINC000822723229 599524486 /nfs/dbraw/zinc/52/44/86/599524486.db2.gz ARQQFTTWEMLKNL-CYBMUJFWSA-N -1 3 374.370 3.724 20 0 FHADHM C[C@H](NC(=O)c1cc2c(s1)CCCCC2)c1cccc(-c2nnn[n-]2)c1 ZINC000820390000 599525765 /nfs/dbraw/zinc/52/57/65/599525765.db2.gz CXEOPJTWLVWRON-LBPRGKRZSA-N -1 3 367.478 3.688 20 0 FHADHM C[C@H](NC(=O)c1cc2c(s1)CCCCC2)c1cccc(-c2nn[n-]n2)c1 ZINC000820390000 599525767 /nfs/dbraw/zinc/52/57/67/599525767.db2.gz CXEOPJTWLVWRON-LBPRGKRZSA-N -1 3 367.478 3.688 20 0 FHADHM C[C@@H](NC(=O)c1cc2cc(Cl)ccc2o1)c1cccc(-c2nnn[n-]2)c1 ZINC000820391096 599526488 /nfs/dbraw/zinc/52/64/88/599526488.db2.gz MZXIJXFOEFVTPN-SNVBAGLBSA-N -1 3 367.796 3.757 20 0 FHADHM C[C@@H](NC(=O)c1cc2cc(Cl)ccc2o1)c1cccc(-c2nn[n-]n2)c1 ZINC000820391096 599526490 /nfs/dbraw/zinc/52/64/90/599526490.db2.gz MZXIJXFOEFVTPN-SNVBAGLBSA-N -1 3 367.796 3.757 20 0 FHADHM CS[C@H]1CCC[C@H](Nc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)C1 ZINC000737180959 599526574 /nfs/dbraw/zinc/52/65/74/599526574.db2.gz URCPSSBPNUZVOO-QWRGUYRKSA-N -1 3 357.405 3.972 20 0 FHADHM CC(C)c1ccc2cc(C(=O)N[C@H](C)c3cccc(-c4nnn[n-]4)c3)[nH]c2c1 ZINC000820192435 599527626 /nfs/dbraw/zinc/52/76/26/599527626.db2.gz NRBRTCIGQWDNFE-CYBMUJFWSA-N -1 3 374.448 3.962 20 0 FHADHM CC(C)c1ccc2cc(C(=O)N[C@H](C)c3cccc(-c4nn[n-]n4)c3)[nH]c2c1 ZINC000820192435 599527629 /nfs/dbraw/zinc/52/76/29/599527629.db2.gz NRBRTCIGQWDNFE-CYBMUJFWSA-N -1 3 374.448 3.962 20 0 FHADHM CC(C)c1ccc2cc(C(=O)N[C@@H](C)c3cccc(-c4nnn[n-]4)c3)[nH]c2c1 ZINC000820192436 599528065 /nfs/dbraw/zinc/52/80/65/599528065.db2.gz NRBRTCIGQWDNFE-ZDUSSCGKSA-N -1 3 374.448 3.962 20 0 FHADHM CC(C)c1ccc2cc(C(=O)N[C@@H](C)c3cccc(-c4nn[n-]n4)c3)[nH]c2c1 ZINC000820192436 599528068 /nfs/dbraw/zinc/52/80/68/599528068.db2.gz NRBRTCIGQWDNFE-ZDUSSCGKSA-N -1 3 374.448 3.962 20 0 FHADHM C[C@H](NC(=O)c1cc2ccc(F)cc2s1)c1cccc(-c2nnn[n-]2)c1 ZINC000820391457 599529032 /nfs/dbraw/zinc/52/90/32/599529032.db2.gz QDJJTPBLNZXRIP-JTQLQIEISA-N -1 3 367.409 3.712 20 0 FHADHM C[C@H](NC(=O)c1cc2ccc(F)cc2s1)c1cccc(-c2nn[n-]n2)c1 ZINC000820391457 599529035 /nfs/dbraw/zinc/52/90/35/599529035.db2.gz QDJJTPBLNZXRIP-JTQLQIEISA-N -1 3 367.409 3.712 20 0 FHADHM Cc1sc(NC(=O)CC/C=C/c2ccccc2)c(-c2nnn[n-]2)c1C ZINC000737563730 599540027 /nfs/dbraw/zinc/54/00/27/599540027.db2.gz SPBXFYWGMWXDEQ-UXBLZVDNSA-N -1 3 353.451 3.977 20 0 FHADHM Cc1sc(NC(=O)CC/C=C/c2ccccc2)c(-c2nn[n-]n2)c1C ZINC000737563730 599540029 /nfs/dbraw/zinc/54/00/29/599540029.db2.gz SPBXFYWGMWXDEQ-UXBLZVDNSA-N -1 3 353.451 3.977 20 0 FHADHM CC[C@H](CC(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccc(C)cc1 ZINC000736331301 599542390 /nfs/dbraw/zinc/54/23/90/599542390.db2.gz IWAUMVCHTQJMCO-JKSUJKDBSA-N -1 3 363.465 3.936 20 0 FHADHM CC[C@H](CC(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccc(C)cc1 ZINC000736331301 599542391 /nfs/dbraw/zinc/54/23/91/599542391.db2.gz IWAUMVCHTQJMCO-JKSUJKDBSA-N -1 3 363.465 3.936 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H](C)Cc2ccccc2F)c1-c1nnn[n-]1 ZINC000736670816 599544432 /nfs/dbraw/zinc/54/44/32/599544432.db2.gz SLHFVJXKAXEJPV-SNVBAGLBSA-N -1 3 373.457 3.755 20 0 FHADHM CCc1c(C)sc(NC(=O)[C@H](C)Cc2ccccc2F)c1-c1nn[n-]n1 ZINC000736670816 599544435 /nfs/dbraw/zinc/54/44/35/599544435.db2.gz SLHFVJXKAXEJPV-SNVBAGLBSA-N -1 3 373.457 3.755 20 0 FHADHM Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)C=Cc2ccccc2-c2nnn[n-]2)C1 ZINC000737424411 599548956 /nfs/dbraw/zinc/54/89/56/599548956.db2.gz YDNKULVHMMUJDN-ASAMJXSQSA-N -1 3 373.460 3.593 20 0 FHADHM Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)C=Cc2ccccc2-c2nn[n-]n2)C1 ZINC000737424411 599548958 /nfs/dbraw/zinc/54/89/58/599548958.db2.gz YDNKULVHMMUJDN-ASAMJXSQSA-N -1 3 373.460 3.593 20 0 FHADHM Cc1ccc([C@H]2CCCCN2C(=O)Nc2cccc(-c3nnn[n-]3)c2)o1 ZINC000822233773 599551262 /nfs/dbraw/zinc/55/12/62/599551262.db2.gz UUJYVKCGBKYWBM-OAHLLOKOSA-N -1 3 352.398 3.527 20 0 FHADHM Cc1ccc([C@H]2CCCCN2C(=O)Nc2cccc(-c3nn[n-]n3)c2)o1 ZINC000822233773 599551263 /nfs/dbraw/zinc/55/12/63/599551263.db2.gz UUJYVKCGBKYWBM-OAHLLOKOSA-N -1 3 352.398 3.527 20 0 FHADHM CCc1ccc([C@H]2CCCCN2c2ncc(-c3nnn[n-]3)cc2Cl)o1 ZINC000821482080 599578796 /nfs/dbraw/zinc/57/87/96/599578796.db2.gz PXVBTNHQSDBXSY-CQSZACIVSA-N -1 3 358.833 3.802 20 0 FHADHM CCc1ccc([C@H]2CCCCN2c2ncc(-c3nn[n-]n3)cc2Cl)o1 ZINC000821482080 599578799 /nfs/dbraw/zinc/57/87/99/599578799.db2.gz PXVBTNHQSDBXSY-CQSZACIVSA-N -1 3 358.833 3.802 20 0 FHADHM Clc1ccccc1N1CCC[C@H](Nc2ccc(-c3nn[n-]n3)cc2)C1 ZINC000822585810 599579795 /nfs/dbraw/zinc/57/97/95/599579795.db2.gz NSQTXTSEYYXWKE-HNNXBMFYSA-N -1 3 354.845 3.601 20 0 FHADHM CS[C@H]1CCCCN(c2c(-c3nnn[n-]3)cnc3c(C)cc(F)cc32)C1 ZINC000821956290 607385700 /nfs/dbraw/zinc/38/57/00/607385700.db2.gz LPOLVDYEXZYHMV-ZDUSSCGKSA-N -1 3 372.473 3.584 20 0 FHADHM CS[C@H]1CCCCN(c2c(-c3nn[n-]n3)cnc3c(C)cc(F)cc32)C1 ZINC000821956290 607385702 /nfs/dbraw/zinc/38/57/02/607385702.db2.gz LPOLVDYEXZYHMV-ZDUSSCGKSA-N -1 3 372.473 3.584 20 0 FHADHM Cc1ccccc1[C@H]1C[C@H](C)N(C(=O)Nc2ccc(-c3nnn[n-]3)cc2)C1 ZINC000737424889 599599652 /nfs/dbraw/zinc/59/96/52/599599652.db2.gz YVNPRQITHXIGOP-HOCLYGCPSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1ccccc1[C@H]1C[C@H](C)N(C(=O)Nc2ccc(-c3nn[n-]n3)cc2)C1 ZINC000737424889 599599653 /nfs/dbraw/zinc/59/96/53/599599653.db2.gz YVNPRQITHXIGOP-HOCLYGCPSA-N -1 3 362.437 3.585 20 0 FHADHM CS[C@@H]1CCCCN(c2c(-c3nnn[n-]3)cnc3ccc(Cl)cc32)C1 ZINC000821956589 607385999 /nfs/dbraw/zinc/38/59/99/607385999.db2.gz SBNKDBCTFCXWAZ-GFCCVEGCSA-N -1 3 374.901 3.790 20 0 FHADHM CS[C@@H]1CCCCN(c2c(-c3nn[n-]n3)cnc3ccc(Cl)cc32)C1 ZINC000821956589 607386001 /nfs/dbraw/zinc/38/60/01/607386001.db2.gz SBNKDBCTFCXWAZ-GFCCVEGCSA-N -1 3 374.901 3.790 20 0 FHADHM CS[C@H]1CCCCN(c2c(-c3nnn[n-]3)cnc3ccc(Cl)cc32)C1 ZINC000821956590 607386316 /nfs/dbraw/zinc/38/63/16/607386316.db2.gz SBNKDBCTFCXWAZ-LBPRGKRZSA-N -1 3 374.901 3.790 20 0 FHADHM CS[C@H]1CCCCN(c2c(-c3nn[n-]n3)cnc3ccc(Cl)cc32)C1 ZINC000821956590 607386318 /nfs/dbraw/zinc/38/63/18/607386318.db2.gz SBNKDBCTFCXWAZ-LBPRGKRZSA-N -1 3 374.901 3.790 20 0 FHADHM Cc1nc(-c2cccc(C(=O)Nc3sccc3-c3nnn[n-]3)c2)cs1 ZINC000822419088 599629881 /nfs/dbraw/zinc/62/98/81/599629881.db2.gz LXEMYDIRDQIUMW-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM Cc1nc(-c2cccc(C(=O)Nc3sccc3-c3nn[n-]n3)c2)cs1 ZINC000822419088 599629882 /nfs/dbraw/zinc/62/98/82/599629882.db2.gz LXEMYDIRDQIUMW-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM O=C(C=Cc1ccsc1)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000822936694 599634000 /nfs/dbraw/zinc/63/40/00/599634000.db2.gz XAEFVKJCAODRNB-DAFODLJHSA-N -1 3 365.340 3.599 20 0 FHADHM O=C(C=Cc1ccsc1)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000822936694 599634001 /nfs/dbraw/zinc/63/40/01/599634001.db2.gz XAEFVKJCAODRNB-DAFODLJHSA-N -1 3 365.340 3.599 20 0 FHADHM COc1ccc(CNc2ccc(OCCC(C)C)cc2)cc1-c1nnn[n-]1 ZINC000821821503 599647305 /nfs/dbraw/zinc/64/73/05/599647305.db2.gz ILRBCCYZHBPGTE-UHFFFAOYSA-N -1 3 367.453 3.912 20 0 FHADHM COc1ccc(CNc2ccc(OCCC(C)C)cc2)cc1-c1nn[n-]n1 ZINC000821821503 599647306 /nfs/dbraw/zinc/64/73/06/599647306.db2.gz ILRBCCYZHBPGTE-UHFFFAOYSA-N -1 3 367.453 3.912 20 0 FHADHM CCCn1ccc2ccc(NC(=O)C=Cc3ccccc3-c3nnn[n-]3)cc21 ZINC000821148955 599651843 /nfs/dbraw/zinc/65/18/43/599651843.db2.gz QSZJMZLKQMHYEZ-CSKARUKUSA-N -1 3 372.432 3.883 20 0 FHADHM CCCn1ccc2ccc(NC(=O)C=Cc3ccccc3-c3nn[n-]n3)cc21 ZINC000821148955 599651844 /nfs/dbraw/zinc/65/18/44/599651844.db2.gz QSZJMZLKQMHYEZ-CSKARUKUSA-N -1 3 372.432 3.883 20 0 FHADHM CC(C)CCOc1ccc(NC(=O)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000136005858 599656434 /nfs/dbraw/zinc/65/64/34/599656434.db2.gz DLMJJLSSOHDNEV-UHFFFAOYSA-N -1 3 351.410 3.544 20 0 FHADHM CC(C)CCOc1ccc(NC(=O)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000136005858 599656435 /nfs/dbraw/zinc/65/64/35/599656435.db2.gz DLMJJLSSOHDNEV-UHFFFAOYSA-N -1 3 351.410 3.544 20 0 FHADHM CC[C@@H](C)C[C@H](C)NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C(C)C ZINC000820869573 599678503 /nfs/dbraw/zinc/67/85/03/599678503.db2.gz HYTYOIIFOFKWCR-CABCVRRESA-N -1 3 358.490 3.611 20 0 FHADHM CC[C@@H](C)C[C@H](C)NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C(C)C ZINC000820869573 599678504 /nfs/dbraw/zinc/67/85/04/599678504.db2.gz HYTYOIIFOFKWCR-CABCVRRESA-N -1 3 358.490 3.611 20 0 FHADHM CC(C)C[C@@H]1CCCCCN1C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820062524 599680406 /nfs/dbraw/zinc/68/04/06/599680406.db2.gz NMECKGATCYSMOQ-YJBOKZPZSA-N -1 3 370.501 3.928 20 0 FHADHM CC(C)C[C@@H]1CCCCCN1C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820062524 599680407 /nfs/dbraw/zinc/68/04/07/599680407.db2.gz NMECKGATCYSMOQ-YJBOKZPZSA-N -1 3 370.501 3.928 20 0 FHADHM CC(C)C[C@@H]1CCN(c2c(-c3nnn[n-]3)cnc3c(F)ccc(F)c32)C1 ZINC000820068165 599686505 /nfs/dbraw/zinc/68/65/05/599686505.db2.gz OLEXQJWTSJOHCS-NSHDSACASA-N -1 3 358.396 3.566 20 0 FHADHM CC(C)C[C@@H]1CCN(c2c(-c3nn[n-]n3)cnc3c(F)ccc(F)c32)C1 ZINC000820068165 599686506 /nfs/dbraw/zinc/68/65/06/599686506.db2.gz OLEXQJWTSJOHCS-NSHDSACASA-N -1 3 358.396 3.566 20 0 FHADHM CC(C)C[C@H]1CCN(C(=O)Nc2cc(-c3nnn[n-]3)ccc2OC(C)C)C1 ZINC000820068824 599692501 /nfs/dbraw/zinc/69/25/01/599692501.db2.gz UHJRFISCDCABBM-CQSZACIVSA-N -1 3 372.473 3.554 20 0 FHADHM CC(C)C[C@H]1CCN(C(=O)Nc2cc(-c3nn[n-]n3)ccc2OC(C)C)C1 ZINC000820068824 599692502 /nfs/dbraw/zinc/69/25/02/599692502.db2.gz UHJRFISCDCABBM-CQSZACIVSA-N -1 3 372.473 3.554 20 0 FHADHM CCN(CC)[C@@H](CNC(=O)c1ccccc1NC(=O)[O-])c1ccsc1 ZINC000737086546 599709150 /nfs/dbraw/zinc/70/91/50/599709150.db2.gz ZUNZCTBHAUHWDN-INIZCTEOSA-N -1 3 361.467 3.651 20 0 FHADHM Cc1ccc([C@@H](CNC(=O)Nc2ccc(F)c(NC(=O)[O-])c2)N(C)C)cc1 ZINC000738563260 599714863 /nfs/dbraw/zinc/71/48/63/599714863.db2.gz YWFUOCQSDZPLTP-QGZVFWFLSA-N -1 3 374.416 3.648 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)O[C@H](c1ccccc1)c1cccnc1 ZINC000826250987 607399405 /nfs/dbraw/zinc/39/94/05/607399405.db2.gz BNCYDGLZBGNEJU-LJQANCHMSA-N -1 3 371.400 3.517 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)O[C@H](c1ccccc1)c1cccnc1 ZINC000826250987 607399406 /nfs/dbraw/zinc/39/94/06/607399406.db2.gz BNCYDGLZBGNEJU-LJQANCHMSA-N -1 3 371.400 3.517 20 0 FHADHM CN(CCCc1cc(-c2ccc(F)cc2)no1)Cc1cc(C(=O)[O-])co1 ZINC000737441517 599852485 /nfs/dbraw/zinc/85/24/85/599852485.db2.gz WETKOBKYLCLPPQ-UHFFFAOYSA-N -1 3 358.369 3.837 20 0 FHADHM O=C([O-])CN(Cc1ccc(F)c(F)c1)Cc1cc(F)cc2cccnc21 ZINC000739795098 599865282 /nfs/dbraw/zinc/86/52/82/599865282.db2.gz AJJGXCVMCSSTDE-UHFFFAOYSA-N -1 3 360.335 3.739 20 0 FHADHM O=C([O-])CN(Cc1ccc(OC(F)F)cc1)Cc1ccc(F)c(F)c1 ZINC000739796503 599865374 /nfs/dbraw/zinc/86/53/74/599865374.db2.gz KEGVMWPCHLTSSR-UHFFFAOYSA-N -1 3 357.303 3.653 20 0 FHADHM O=C([O-])CC[C@H](NC(=O)c1cccc(CN2CCCC2)c1)c1ccccc1 ZINC000739662805 599952109 /nfs/dbraw/zinc/95/21/09/599952109.db2.gz ZYYRFPWDJKVDPA-FQEVSTJZSA-N -1 3 366.461 3.618 20 0 FHADHM O=C([O-])c1cc(Cl)ccc1OC(=O)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000740074866 599969373 /nfs/dbraw/zinc/96/93/73/599969373.db2.gz FFLDWXOQELVASF-OAHLLOKOSA-N -1 3 373.836 3.856 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1COC(=O)C[C@H](C)c1cccc(F)c1 ZINC000826253317 607411416 /nfs/dbraw/zinc/41/14/16/607411416.db2.gz LWZBYVCRABUBSE-ZDUSSCGKSA-N -1 3 354.385 3.551 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1COC(=O)C[C@H](C)c1cccc(F)c1 ZINC000826253317 607411417 /nfs/dbraw/zinc/41/14/17/607411417.db2.gz LWZBYVCRABUBSE-ZDUSSCGKSA-N -1 3 354.385 3.551 20 0 FHADHM C[C@@H](C(=O)Nc1cccc(CSCCC(=O)[O-])c1)N1[C@H](C)CC[C@H]1C ZINC000736762741 600109781 /nfs/dbraw/zinc/10/97/81/600109781.db2.gz LUQJMMNZNHOKHN-KFWWJZLASA-N -1 3 364.511 3.594 20 0 FHADHM Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1sc(C)c(C)c1-c1nnn[n-]1 ZINC000826316516 607428835 /nfs/dbraw/zinc/42/88/35/607428835.db2.gz QWQBOTYUZIEWPX-QWRGUYRKSA-N -1 3 359.480 3.657 20 0 FHADHM Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1sc(C)c(C)c1-c1nn[n-]n1 ZINC000826316516 607428836 /nfs/dbraw/zinc/42/88/36/607428836.db2.gz QWQBOTYUZIEWPX-QWRGUYRKSA-N -1 3 359.480 3.657 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1nc2cc(Cl)ccc2s1 ZINC000826251625 607431159 /nfs/dbraw/zinc/43/11/59/607431159.db2.gz WBUYLCMWXFRAKZ-UHFFFAOYSA-N -1 3 370.825 3.691 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1nc2cc(Cl)ccc2s1 ZINC000826251625 607431160 /nfs/dbraw/zinc/43/11/60/607431160.db2.gz WBUYLCMWXFRAKZ-UHFFFAOYSA-N -1 3 370.825 3.691 20 0 FHADHM CCC[C@H]1CCCN(C(=O)Nc2ccc(OC(C)C)c(-c3nnn[n-]3)c2)C1 ZINC000821040113 607431288 /nfs/dbraw/zinc/43/12/88/607431288.db2.gz IPTQJGRKEIOPHV-AWEZNQCLSA-N -1 3 372.473 3.698 20 0 FHADHM CCC[C@H]1CCCN(C(=O)Nc2ccc(OC(C)C)c(-c3nn[n-]n3)c2)C1 ZINC000821040113 607431289 /nfs/dbraw/zinc/43/12/89/607431289.db2.gz IPTQJGRKEIOPHV-AWEZNQCLSA-N -1 3 372.473 3.698 20 0 FHADHM C[C@@H](C(=O)N(C)c1ccc(-c2nnn[n-]2)cc1)c1ccc2ccccc2c1 ZINC000824041209 607432771 /nfs/dbraw/zinc/43/27/71/607432771.db2.gz ZIEHLKKIIIAQEG-CQSZACIVSA-N -1 3 357.417 3.786 20 0 FHADHM C[C@@H](C(=O)N(C)c1ccc(-c2nn[n-]n2)cc1)c1ccc2ccccc2c1 ZINC000824041209 607432773 /nfs/dbraw/zinc/43/27/73/607432773.db2.gz ZIEHLKKIIIAQEG-CQSZACIVSA-N -1 3 357.417 3.786 20 0 FHADHM CCC[C@@](C)(NCc1csc(-c2ccc(OC)cc2OC)n1)C(=O)[O-] ZINC000736963356 600322808 /nfs/dbraw/zinc/32/28/08/600322808.db2.gz XYAUBFQIKLNFQP-GOSISDBHSA-N -1 3 364.467 3.560 20 0 FHADHM CN(C)Cc1c2ccccc2oc1C(=O)Nc1cccc(NC(=O)[O-])c1 ZINC000737367694 600406480 /nfs/dbraw/zinc/40/64/80/600406480.db2.gz CTXNVILAHLYSJF-UHFFFAOYSA-N -1 3 353.378 3.837 20 0 FHADHM C[C@H](C(=O)Nc1cccc(CSCCC(=O)[O-])c1)N1CCCCCC1 ZINC000736218513 600409550 /nfs/dbraw/zinc/40/95/50/600409550.db2.gz OYAVSPYIDDLRAM-OAHLLOKOSA-N -1 3 364.511 3.598 20 0 FHADHM CCOc1cc(CN[C@@H](C(=O)[O-])c2ccccc2)ccc1OC(F)F ZINC000262703926 600425324 /nfs/dbraw/zinc/42/53/24/600425324.db2.gz LSPCAXWMEBRLJW-MRXNPFEDSA-N -1 3 351.349 3.602 20 0 FHADHM Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000826316787 607444867 /nfs/dbraw/zinc/44/48/67/607444867.db2.gz YPLOPNPLMZQIRF-QWRGUYRKSA-N -1 3 359.842 3.632 20 0 FHADHM Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000826316787 607444868 /nfs/dbraw/zinc/44/48/68/607444868.db2.gz YPLOPNPLMZQIRF-QWRGUYRKSA-N -1 3 359.842 3.632 20 0 FHADHM CN(C(=O)c1sccc1-c1nnn[n-]1)c1c(Cl)cccc1Cl ZINC000821574463 607452584 /nfs/dbraw/zinc/45/25/84/607452584.db2.gz HYAJNYUTKHDJIW-UHFFFAOYSA-N -1 3 354.222 3.512 20 0 FHADHM CN(C(=O)c1sccc1-c1nn[n-]n1)c1c(Cl)cccc1Cl ZINC000821574463 607452586 /nfs/dbraw/zinc/45/25/86/607452586.db2.gz HYAJNYUTKHDJIW-UHFFFAOYSA-N -1 3 354.222 3.512 20 0 FHADHM CC(C)[C@H](c1ccccc1)N(C)CC(=O)NCc1ccc(NC(=O)[O-])cc1 ZINC000736389783 600540877 /nfs/dbraw/zinc/54/08/77/600540877.db2.gz DCXQHJLNRTWCLK-HXUWFJFHSA-N -1 3 369.465 3.722 20 0 FHADHM Cc1[nH]c(C(=O)[C@H](C)N2C[C@@H](c3ccccc3)C[C@H]2C)c(C)c1C(=O)[O-] ZINC000738228852 600630550 /nfs/dbraw/zinc/63/05/50/600630550.db2.gz CTAODOCTELGCBW-PVUWLOKVSA-N -1 3 354.450 3.779 20 0 FHADHM CCN(CCOc1ccc(Br)cc1)Cc1ccc(C(=O)[O-])o1 ZINC000579967300 600975064 /nfs/dbraw/zinc/97/50/64/600975064.db2.gz BZFRVRKQEGMDCM-UHFFFAOYSA-N -1 3 368.227 3.641 20 0 FHADHM Cc1nccn1[C@H]1CCCN([C@H](C(=O)[O-])c2ccc(Cl)cc2Cl)C1 ZINC000833010436 601002232 /nfs/dbraw/zinc/00/22/32/601002232.db2.gz HPCKVNWBXLLTEB-BBRMVZONSA-N -1 3 368.264 3.961 20 0 FHADHM Cc1coc(-c2cccc(NCc3ccc(-c4nnn[n-]4)cc3F)c2)n1 ZINC000822403885 607491037 /nfs/dbraw/zinc/49/10/37/607491037.db2.gz YURRBFNDDHVATG-UHFFFAOYSA-N -1 3 350.357 3.581 20 0 FHADHM Cc1coc(-c2cccc(NCc3ccc(-c4nn[n-]n4)cc3F)c2)n1 ZINC000822403885 607491038 /nfs/dbraw/zinc/49/10/38/607491038.db2.gz YURRBFNDDHVATG-UHFFFAOYSA-N -1 3 350.357 3.581 20 0 FHADHM Cc1ccc(NCc2ccc(-c3nnn[n-]3)cc2F)cc1OCC(F)F ZINC000822254756 607489239 /nfs/dbraw/zinc/48/92/39/607489239.db2.gz QMJAYUCSICOXSF-UHFFFAOYSA-N -1 3 363.343 3.570 20 0 FHADHM Cc1ccc(NCc2ccc(-c3nn[n-]n3)cc2F)cc1OCC(F)F ZINC000822254756 607489240 /nfs/dbraw/zinc/48/92/40/607489240.db2.gz QMJAYUCSICOXSF-UHFFFAOYSA-N -1 3 363.343 3.570 20 0 FHADHM C/C(=C/CN(C)[C@@H]1CCSc2ccc(Br)cc21)C(=O)[O-] ZINC000825730623 601163375 /nfs/dbraw/zinc/16/33/75/601163375.db2.gz ZNYXWESCQURADM-OMPYUXFZSA-N -1 3 356.285 3.949 20 0 FHADHM C[C@@H](OC(=O)c1ccc(-c2nnc(C3CC3)[nH]2)cc1)c1ccc(C(=O)[O-])o1 ZINC000827854166 601188288 /nfs/dbraw/zinc/18/82/88/601188288.db2.gz RDDUJCVDQOGANE-SNVBAGLBSA-N -1 3 367.361 3.558 20 0 FHADHM CCc1ccc2c(CN[C@@H](c3ccccc3)[C@@H](C)C(=O)[O-])cc(=O)oc2c1 ZINC000830259686 601204255 /nfs/dbraw/zinc/20/42/55/601204255.db2.gz CQURMKZSJFOKQD-SPLOXXLWSA-N -1 3 365.429 3.907 20 0 FHADHM Cc1ccc(NC(=O)CN[C@@H](c2ccccc2)[C@@H](C)C(=O)[O-])cc1Cl ZINC000832943566 601205444 /nfs/dbraw/zinc/20/54/44/601205444.db2.gz GVFXOOSGJGFPJR-FZKQIMNGSA-N -1 3 360.841 3.639 20 0 FHADHM Cc1sc(NC(=O)CN[C@H](c2ccccc2)[C@@H](C)C(=O)[O-])c(C)c1C ZINC000833036016 601206636 /nfs/dbraw/zinc/20/66/36/601206636.db2.gz HRNFPXURTJMGQI-DYVFJYSZSA-N -1 3 360.479 3.663 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1c(F)cc(F)cc1F ZINC000820488461 607497780 /nfs/dbraw/zinc/49/77/80/607497780.db2.gz OIYMKXDJNZLLMT-FGEFZZPRSA-N -1 3 374.322 3.602 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1c(F)cc(F)cc1F ZINC000820488461 607497786 /nfs/dbraw/zinc/49/77/86/607497786.db2.gz OIYMKXDJNZLLMT-FGEFZZPRSA-N -1 3 374.322 3.602 20 0 FHADHM CCc1oc(C(=O)[O-])cc1CN1CCC(O)(c2cccc(C)c2C)CC1 ZINC000830369322 601422083 /nfs/dbraw/zinc/42/20/83/601422083.db2.gz MLMMPYLIMJPMFQ-UHFFFAOYSA-N -1 3 357.450 3.641 20 0 FHADHM CCc1ccc2c(CN3CCc4ccccc4[C@@H]3C(=O)[O-])cc(=O)oc2c1 ZINC000830260105 601544726 /nfs/dbraw/zinc/54/47/26/601544726.db2.gz QWEWSVJKOKTFAI-OAQYLSRUSA-N -1 3 363.413 3.539 20 0 FHADHM Cc1ccc2c(CN3CCc4ccccc4[C@H]3C(=O)[O-])cc(=O)oc2c1C ZINC000832962052 601547453 /nfs/dbraw/zinc/54/74/53/601547453.db2.gz PQZDOFPOEHHAIM-FQEVSTJZSA-N -1 3 363.413 3.594 20 0 FHADHM O=C([O-])c1cccc(CN(Cc2ccccc2)C[C@@H](O)c2ccco2)c1 ZINC000833328378 601611582 /nfs/dbraw/zinc/61/15/82/601611582.db2.gz HGXQCGZULYCICD-LJQANCHMSA-N -1 3 351.402 3.714 20 0 FHADHM O=C([O-])c1cccc(CN(Cc2ccccc2)C[C@H](O)c2ccco2)c1 ZINC000833328377 601611757 /nfs/dbraw/zinc/61/17/57/601611757.db2.gz HGXQCGZULYCICD-IBGZPJMESA-N -1 3 351.402 3.714 20 0 FHADHM O=C([O-])c1ccc(CN(Cc2ccccc2)C[C@H](O)c2ccco2)cc1 ZINC000833315535 601611850 /nfs/dbraw/zinc/61/18/50/601611850.db2.gz YSBNGQKUYJZKPP-IBGZPJMESA-N -1 3 351.402 3.714 20 0 FHADHM CCC(CC)(CC(=O)[O-])NCc1nc(-c2cccc(C(F)(F)F)c2)no1 ZINC000828804441 601633957 /nfs/dbraw/zinc/63/39/57/601633957.db2.gz MOYFLWHKEFWICB-UHFFFAOYSA-N -1 3 371.359 3.879 20 0 FHADHM CCc1cccc(C)c1NC(=O)CN[C@@H](c1ccccc1)[C@@H](C)C(=O)[O-] ZINC000830260125 601655009 /nfs/dbraw/zinc/65/50/09/601655009.db2.gz RREXETNROATUGO-FOIQADDNSA-N -1 3 354.450 3.548 20 0 FHADHM Cc1cc(Cl)ccc1NC(=O)CN[C@@H](c1ccccc1)[C@@H](C)C(=O)[O-] ZINC000832886449 601657139 /nfs/dbraw/zinc/65/71/39/601657139.db2.gz NXVBBKKKHSQVED-FZKQIMNGSA-N -1 3 360.841 3.639 20 0 FHADHM CCOC(=O)c1oc2ccccc2c1CN1CCC(CCC(=O)[O-])CC1 ZINC000595882573 601844089 /nfs/dbraw/zinc/84/40/89/601844089.db2.gz LGZARHOJSLTRGE-UHFFFAOYSA-N -1 3 359.422 3.686 20 0 FHADHM CN(C[C@@H](O)c1cccc(Cl)c1)[C@@H](C(=O)[O-])c1cc(F)c(F)c(F)c1 ZINC000830714803 601902560 /nfs/dbraw/zinc/90/25/60/601902560.db2.gz YXRGYSKBISPHNG-GDBMZVCRSA-N -1 3 373.758 3.548 20 0 FHADHM O=C([O-])N1CCC[C@@H]1[C@@H]1CCCCN1Cc1cnc(-c2ccccc2)nc1 ZINC000740514567 601924762 /nfs/dbraw/zinc/92/47/62/601924762.db2.gz CUPJIAWBMSPVNE-RBUKOAKNSA-N -1 3 366.465 3.641 20 0 FHADHM Cc1ccc(C)c(NC(=O)[C@@H](c2ccccc2)N2CC[C@@](C)(C(=O)[O-])C2)c1 ZINC000263044660 601941935 /nfs/dbraw/zinc/94/19/35/601941935.db2.gz FACNJOGCZGBODL-DENIHFKCSA-N -1 3 366.461 3.780 20 0 FHADHM C[C@@]1(C(=O)[O-])CCN(Cc2cc(Cl)ccc2OCc2cccnc2)C1 ZINC000263216529 601946996 /nfs/dbraw/zinc/94/69/96/601946996.db2.gz XOOIYZDUFFMXTM-LJQANCHMSA-N -1 3 360.841 3.611 20 0 FHADHM COc1cc(OC)cc([C@H](N[C@H](C)c2ccc(OC(C)C)cc2)C(=O)[O-])c1 ZINC000832049205 602166780 /nfs/dbraw/zinc/16/67/80/602166780.db2.gz FWPXNIZBAGUKOV-VLIAUNLRSA-N -1 3 373.449 3.968 20 0 FHADHM COc1cc(OC)cc([C@@H](N[C@@H]2CCc3cc(Cl)ccc32)C(=O)[O-])c1 ZINC000832051525 602168184 /nfs/dbraw/zinc/16/81/84/602168184.db2.gz WETZLYMYMQRGDG-QZTJIDSGSA-N -1 3 361.825 3.760 20 0 FHADHM C[C@@H](c1nnc(-c2ccc(Cl)c(Cl)c2)o1)N1C[C@H](C(=O)[O-])[C@H](C)C1 ZINC000828425363 602223009 /nfs/dbraw/zinc/22/30/09/602223009.db2.gz ZIXRIMZEOHBPIT-YWVKMMECSA-N -1 3 370.236 3.757 20 0 FHADHM C[C@@H](NC(=O)[O-])[C@H]1CCCCN1Cc1ccc(OCc2ccccn2)cc1 ZINC000738999822 602259976 /nfs/dbraw/zinc/25/99/76/602259976.db2.gz IHXQBAAPHWHXHW-OXQOHEQNSA-N -1 3 369.465 3.671 20 0 FHADHM CN(C(=O)Nc1cccc(NC(=O)[O-])c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000830507810 602363589 /nfs/dbraw/zinc/36/35/89/602363589.db2.gz PDSWJLMCGPYNLU-GOSISDBHSA-N -1 3 368.437 3.515 20 0 FHADHM CN(C(=O)[O-])C1CCN(CCOC(c2ccccc2)c2ccccc2)CC1 ZINC000737938422 602532833 /nfs/dbraw/zinc/53/28/33/602532833.db2.gz YFIYYIWBQXYHPD-UHFFFAOYSA-N -1 3 368.477 3.867 20 0 FHADHM O=C([O-])Nc1ccc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000740710069 602603037 /nfs/dbraw/zinc/60/30/37/602603037.db2.gz JTPDINPKFMHYCJ-HNNXBMFYSA-N -1 3 374.466 3.797 20 0 FHADHM CC(C)N(CCCNCc1cc2cnn(C(C)C)c2nc1Cl)C(=O)[O-] ZINC000738847853 602650280 /nfs/dbraw/zinc/65/02/80/602650280.db2.gz GHICPOOZFMOFPX-UHFFFAOYSA-N -1 3 367.881 3.534 20 0 FHADHM C[C@H]1CN(Cc2c(-c3ccccc3)nc3sccn23)CC[C@@H]1NC(=O)[O-] ZINC000739185911 603185895 /nfs/dbraw/zinc/18/58/95/603185895.db2.gz RCRPZOAUIZQIMA-ZFWWWQNUSA-N -1 3 370.478 3.541 20 0 FHADHM CCc1ccc([C@@H](CNC(=O)c2ccc(C)c(NC(=O)[O-])c2)N(C)C)cc1 ZINC000827576666 603250994 /nfs/dbraw/zinc/25/09/94/603250994.db2.gz GNCDBKUPMQJKPO-LJQANCHMSA-N -1 3 369.465 3.680 20 0 FHADHM Cc1ccc(C(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1NC(=O)[O-] ZINC000830210835 603251209 /nfs/dbraw/zinc/25/12/09/603251209.db2.gz FAMWGGJWRQWEDC-INIZCTEOSA-N -1 3 373.478 3.713 20 0 FHADHM O=C([O-])Nc1ccc(CNCc2ccc(-n3cnc4ccccc43)cc2)cn1 ZINC000832842300 603545851 /nfs/dbraw/zinc/54/58/51/603545851.db2.gz VAFZNVQYWZWBDK-UHFFFAOYSA-N -1 3 373.416 3.800 20 0 FHADHM CCN(Cc1cccc(NC(=O)c2cccc(CN(C)C)c2)c1)C(=O)[O-] ZINC000827170472 603656440 /nfs/dbraw/zinc/65/64/40/603656440.db2.gz INJDKRDJOCCGDV-UHFFFAOYSA-N -1 3 355.438 3.500 20 0 FHADHM c1nn(-c2ccccc2)cc1-c1nc(-c2cccc(-c3nnn[n-]3)c2)cs1 ZINC000826519551 607645498 /nfs/dbraw/zinc/64/54/98/607645498.db2.gz CRYMMSLNHAZAON-UHFFFAOYSA-N -1 3 371.429 3.843 20 0 FHADHM c1nn(-c2ccccc2)cc1-c1nc(-c2cccc(-c3nn[n-]n3)c2)cs1 ZINC000826519551 607645500 /nfs/dbraw/zinc/64/55/00/607645500.db2.gz CRYMMSLNHAZAON-UHFFFAOYSA-N -1 3 371.429 3.843 20 0 FHADHM C[C@@H]1C[C@H](NC(=O)Nc2ccc(NC(=O)[O-])cc2)CN1Cc1ccccc1 ZINC000825794700 603988415 /nfs/dbraw/zinc/98/84/15/603988415.db2.gz OPVDXBRIMNIRBU-KDOFPFPSSA-N -1 3 368.437 3.561 20 0 FHADHM C[C@H]1C[C@H](NC(=O)Nc2ccc(NC(=O)[O-])cc2)CN1Cc1ccccc1 ZINC000825794701 603988710 /nfs/dbraw/zinc/98/87/10/603988710.db2.gz OPVDXBRIMNIRBU-KSSFIOAISA-N -1 3 368.437 3.561 20 0 FHADHM CCCOc1ccc(NC(=O)c2ccc(-c3nnn[n-]3)cc2C)cc1Cl ZINC000825338705 607666262 /nfs/dbraw/zinc/66/62/62/607666262.db2.gz FNLYIKRGCQFBBO-UHFFFAOYSA-N -1 3 371.828 3.870 20 0 FHADHM CCCOc1ccc(NC(=O)c2ccc(-c3nn[n-]n3)cc2C)cc1Cl ZINC000825338705 607666264 /nfs/dbraw/zinc/66/62/64/607666264.db2.gz FNLYIKRGCQFBBO-UHFFFAOYSA-N -1 3 371.828 3.870 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)c3ccc(-c4nnn[n-]4)cc3C)cc2)oc1C ZINC000826250408 607668577 /nfs/dbraw/zinc/66/85/77/607668577.db2.gz ZPOYXHQSLWLQCN-UHFFFAOYSA-N -1 3 374.404 3.699 20 0 FHADHM Cc1nc(-c2ccc(NC(=O)c3ccc(-c4nn[n-]n4)cc3C)cc2)oc1C ZINC000826250408 607668578 /nfs/dbraw/zinc/66/85/78/607668578.db2.gz ZPOYXHQSLWLQCN-UHFFFAOYSA-N -1 3 374.404 3.699 20 0 FHADHM C[C@@H](NC(=O)[O-])[C@H]1CCCN(Cc2ccccc2Oc2cccnc2)C1 ZINC000825272459 604257684 /nfs/dbraw/zinc/25/76/84/604257684.db2.gz LDPKCKGCPBTHCW-CVEARBPZSA-N -1 3 355.438 3.742 20 0 FHADHM C[C@H](CC(=O)Nc1ccccc1C(F)(F)F)NCc1ccc(C(=O)[O-])o1 ZINC000827241182 604329644 /nfs/dbraw/zinc/32/96/44/604329644.db2.gz SHRCDYFJKATXTM-SNVBAGLBSA-N -1 3 370.327 3.504 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)NC1CC(c2cccc(Cl)c2)C1 ZINC000826246327 607695967 /nfs/dbraw/zinc/69/59/67/607695967.db2.gz AYMMOXRJHCRVNZ-UHFFFAOYSA-N -1 3 367.840 3.505 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)NC1CC(c2cccc(Cl)c2)C1 ZINC000826246327 607695968 /nfs/dbraw/zinc/69/59/68/607695968.db2.gz AYMMOXRJHCRVNZ-UHFFFAOYSA-N -1 3 367.840 3.505 20 0 FHADHM O=C([O-])[C@H](c1cc(Cl)cc(Cl)c1)N1CC[C@@]2(O)CCCC[C@@H]2C1 ZINC000833172412 604501496 /nfs/dbraw/zinc/50/14/96/604501496.db2.gz UZZFPMGZQWBLDK-PVUWLOKVSA-N -1 3 358.265 3.746 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1CC[C@H](C)[C@@H]1c1cccc(F)c1 ZINC000826244368 607700171 /nfs/dbraw/zinc/70/01/71/607700171.db2.gz PMBWONJHIXIAKR-KPZWWZAWSA-N -1 3 365.412 3.538 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1CC[C@H](C)[C@@H]1c1cccc(F)c1 ZINC000826244368 607700173 /nfs/dbraw/zinc/70/01/73/607700173.db2.gz PMBWONJHIXIAKR-KPZWWZAWSA-N -1 3 365.412 3.538 20 0 FHADHM O=C([O-])N1CCC[C@@H](CN[C@H](c2cccc(Cl)c2)c2ccccn2)C1 ZINC000831980102 604527069 /nfs/dbraw/zinc/52/70/69/604527069.db2.gz CSVZCJQMELLLHC-KBXCAEBGSA-N -1 3 359.857 3.804 20 0 FHADHM C[C@H]1CN(c2ccc(C(=O)[O-])cc2)CCN1Cc1nccc2ccccc21 ZINC000833635752 604620421 /nfs/dbraw/zinc/62/04/21/604620421.db2.gz XRTLIGPJKYVJAQ-INIZCTEOSA-N -1 3 361.445 3.644 20 0 FHADHM C[C@@H](Oc1ccc(CN2CCC(Oc3ccc(F)cc3)CC2)cc1)C(=O)[O-] ZINC000833541789 604620588 /nfs/dbraw/zinc/62/05/88/604620588.db2.gz NSWXFOUZTUKANX-OAHLLOKOSA-N -1 3 373.424 3.721 20 0 FHADHM C[C@H]1Cc2cc(-c3ccc(CN[C@@H](C(=O)[O-])c4cccnc4)cc3)ccc2O1 ZINC000833633042 604631770 /nfs/dbraw/zinc/63/17/70/604631770.db2.gz RQOYEXYJBHWPHH-OYHNWAKOSA-N -1 3 374.440 3.988 20 0 FHADHM CC(C)(C)OC(=O)Nc1ccc(CN2CCC(CCC(=O)[O-])CC2)cn1 ZINC000833444615 604641503 /nfs/dbraw/zinc/64/15/03/604641503.db2.gz GSCSLAKALUCWAR-UHFFFAOYSA-N -1 3 363.458 3.505 20 0 FHADHM Cc1ccc(-c2ncc(CN(CCC(=O)[O-])C[C@@H]3CCCO3)s2)cc1 ZINC000833746862 604656719 /nfs/dbraw/zinc/65/67/19/604656719.db2.gz SHTZADQEXQDQNK-INIZCTEOSA-N -1 3 360.479 3.574 20 0 FHADHM O=C([O-])c1cc(CN2CCC[C@H](c3nc(C(F)(F)F)cs3)C2)c[nH]1 ZINC000833779090 604675849 /nfs/dbraw/zinc/67/58/49/604675849.db2.gz IILPWHBKOFEQHM-JTQLQIEISA-N -1 3 359.373 3.568 20 0 FHADHM CC[C@@H](CC(=O)OCc1cccc(-c2nnn[n-]2)c1)c1ccc(OC)cc1 ZINC000825083188 607714613 /nfs/dbraw/zinc/71/46/13/607714613.db2.gz YGEMFRQFRWBFIU-HNNXBMFYSA-N -1 3 366.421 3.502 20 0 FHADHM CC[C@@H](CC(=O)OCc1cccc(-c2nn[n-]n2)c1)c1ccc(OC)cc1 ZINC000825083188 607714615 /nfs/dbraw/zinc/71/46/15/607714615.db2.gz YGEMFRQFRWBFIU-HNNXBMFYSA-N -1 3 366.421 3.502 20 0 FHADHM C[C@H](NCc1ccc(CCNC(=O)[O-])cc1)c1ccc(F)cc1N(C)C ZINC000825503691 604942415 /nfs/dbraw/zinc/94/24/15/604942415.db2.gz XDKYBWYVCDMRTP-AWEZNQCLSA-N -1 3 359.445 3.553 20 0 FHADHM CC(C)(C(=O)[O-])[C@H]1CCCN(Cc2coc(-c3ccc(F)c(F)c3)n2)C1 ZINC000833419600 604947500 /nfs/dbraw/zinc/94/75/00/604947500.db2.gz HENRSUQCKZOWQP-ZDUSSCGKSA-N -1 3 364.392 3.943 20 0 FHADHM CC(=O)Nc1cccc([C@@H](C)NCc2ccc([C@@H](C)NC(=O)[O-])cc2)c1 ZINC000823618627 605114674 /nfs/dbraw/zinc/11/46/74/605114674.db2.gz YNZFDLGDIPWXPM-ZIAGYGMSSA-N -1 3 355.438 3.824 20 0 FHADHM CC(C)(C(=O)[O-])[C@@H](NCC(=O)Nc1ccc2c(c1)CCC2)c1ccccc1 ZINC000833411469 605174812 /nfs/dbraw/zinc/17/48/12/605174812.db2.gz CAULQAZTRYPKTK-FQEVSTJZSA-N -1 3 366.461 3.556 20 0 FHADHM CCCCCN(Cc1ccc(Cl)cc1)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC000825275935 607741107 /nfs/dbraw/zinc/74/11/07/607741107.db2.gz IRDGMJJNZNZKGM-UHFFFAOYSA-N -1 3 372.860 3.681 20 0 FHADHM CCCCCN(Cc1ccc(Cl)cc1)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC000825275935 607741108 /nfs/dbraw/zinc/74/11/08/607741108.db2.gz IRDGMJJNZNZKGM-UHFFFAOYSA-N -1 3 372.860 3.681 20 0 FHADHM CC1=C(C(=O)[O-])C[C@@H](CN[C@@H](Cc2ccc(Cl)cc2)c2ccccn2)O1 ZINC000833579714 605270165 /nfs/dbraw/zinc/27/01/65/605270165.db2.gz OPMIIGYDJKPSPE-LPHOPBHVSA-N -1 3 372.852 3.756 20 0 FHADHM Cc1oc(-c2ccsc2)nc1CN1C[C@@H]2CCC[C@@H](NC(=O)[O-])[C@H]2C1 ZINC000833934600 605450646 /nfs/dbraw/zinc/45/06/46/605450646.db2.gz MLDPVTPIGSWWIC-AEGPPILISA-N -1 3 361.467 3.580 20 0 FHADHM O=C([O-])N1CCC[C@@H]1[C@@H]1CCCN(Cc2cnc(-c3ccccn3)s2)C1 ZINC000834104686 605473158 /nfs/dbraw/zinc/47/31/58/605473158.db2.gz FCJZDLQLLFSYML-RHSMWYFYSA-N -1 3 372.494 3.560 20 0 FHADHM O=C([O-])Nc1ccc2c(c1)CC[C@H]2NCc1cc(Cl)c2c(c1)OCCO2 ZINC000834263526 605592610 /nfs/dbraw/zinc/59/26/10/605592610.db2.gz TWMILPMLKHRZGT-MRXNPFEDSA-N -1 3 374.824 3.978 20 0 FHADHM C[C@H](NC(=O)[O-])[C@@H]1CCCN(Cc2ccccc2OCc2cccnc2)C1 ZINC000833813538 605601784 /nfs/dbraw/zinc/60/17/84/605601784.db2.gz PSUCHVWFKNSSPO-FUHWJXTLSA-N -1 3 369.465 3.529 20 0 FHADHM O=C([O-])N[C@@H]1C[C@H](NCc2ccc(-n3ccnc3)c(F)c2)c2ccccc21 ZINC000834159858 605795624 /nfs/dbraw/zinc/79/56/24/605795624.db2.gz YYOUVQWVCUUYRN-ZWKOTPCHSA-N -1 3 366.396 3.555 20 0 FHADHM COC(=O)c1ccc(F)c(CN[C@@H](c2ccccc2)C(C)(C)C(=O)[O-])c1 ZINC000833715828 605845135 /nfs/dbraw/zinc/84/51/35/605845135.db2.gz GBTBQQCEQGHPBO-KRWDZBQOSA-N -1 3 359.397 3.554 20 0 FHADHM Cn1cc(CN[C@H]2C[C@@H](NC(=O)[O-])c3ccccc32)c(-c2ccccc2)n1 ZINC000833946739 605984007 /nfs/dbraw/zinc/98/40/07/605984007.db2.gz LVDRNFDCECRCOM-RBUKOAKNSA-N -1 3 362.433 3.630 20 0 FHADHM CN(Cc1nc(C(F)(F)F)cs1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000821616812 606044941 /nfs/dbraw/zinc/04/49/41/606044941.db2.gz IMIRTFROASFIPR-UHFFFAOYSA-N -1 3 374.779 3.632 20 0 FHADHM CN(Cc1nc(C(F)(F)F)cs1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000821616812 606044946 /nfs/dbraw/zinc/04/49/46/606044946.db2.gz IMIRTFROASFIPR-UHFFFAOYSA-N -1 3 374.779 3.632 20 0 FHADHM COc1ccc([C@@H](C)CC(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1 ZINC000821777946 606123424 /nfs/dbraw/zinc/12/34/24/606123424.db2.gz PIBRQVIHSMLRAW-NSHDSACASA-N -1 3 371.828 3.661 20 0 FHADHM COc1ccc([C@@H](C)CC(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1 ZINC000821777946 606123425 /nfs/dbraw/zinc/12/34/25/606123425.db2.gz PIBRQVIHSMLRAW-NSHDSACASA-N -1 3 371.828 3.661 20 0 FHADHM CN(C)c1cccc([C@@H]2CCCN2c2c(F)cc(-c3nnn[n-]3)cc2F)c1 ZINC000821590853 606124969 /nfs/dbraw/zinc/12/49/69/606124969.db2.gz JJVFRHFTHCDRSK-KRWDZBQOSA-N -1 3 370.407 3.552 20 0 FHADHM CN(C)c1cccc([C@@H]2CCCN2c2c(F)cc(-c3nn[n-]n3)cc2F)c1 ZINC000821590853 606124971 /nfs/dbraw/zinc/12/49/71/606124971.db2.gz JJVFRHFTHCDRSK-KRWDZBQOSA-N -1 3 370.407 3.552 20 0 FHADHM CO[C@@H](C)c1nc(CSCc2cc(-c3nnn[n-]3)ccc2F)cs1 ZINC000821675574 606179814 /nfs/dbraw/zinc/17/98/14/606179814.db2.gz OPUQRFZKOOKUAM-VIFPVBQESA-N -1 3 365.459 3.603 20 0 FHADHM CO[C@@H](C)c1nc(CSCc2cc(-c3nn[n-]n3)ccc2F)cs1 ZINC000821675574 606179815 /nfs/dbraw/zinc/17/98/15/606179815.db2.gz OPUQRFZKOOKUAM-VIFPVBQESA-N -1 3 365.459 3.603 20 0 FHADHM CO[C@@H](C)c1nc(CSCc2ccc(-c3nnn[n-]3)cc2F)cs1 ZINC000821675144 606179822 /nfs/dbraw/zinc/17/98/22/606179822.db2.gz DUWHAWJFGGPFRC-VIFPVBQESA-N -1 3 365.459 3.603 20 0 FHADHM CO[C@@H](C)c1nc(CSCc2ccc(-c3nn[n-]n3)cc2F)cs1 ZINC000821675144 606179824 /nfs/dbraw/zinc/17/98/24/606179824.db2.gz DUWHAWJFGGPFRC-VIFPVBQESA-N -1 3 365.459 3.603 20 0 FHADHM Cc1ccccc1[C@H](NC(=O)Cc1ccc(-c2nnn[n-]2)cc1)C(C)(C)C ZINC000822350984 606190286 /nfs/dbraw/zinc/19/02/86/606190286.db2.gz IRNOXYCSXULCNN-IBGZPJMESA-N -1 3 363.465 3.621 20 0 FHADHM Cc1ccccc1[C@H](NC(=O)Cc1ccc(-c2nn[n-]n2)cc1)C(C)(C)C ZINC000822350984 606190288 /nfs/dbraw/zinc/19/02/88/606190288.db2.gz IRNOXYCSXULCNN-IBGZPJMESA-N -1 3 363.465 3.621 20 0 FHADHM CC(C)[C@@H](CNc1cc(-c2nnn[n-]2)c2ccccc2n1)c1cccnc1 ZINC000820020419 606228952 /nfs/dbraw/zinc/22/89/52/606228952.db2.gz GBDVSUOKKICBIJ-QGZVFWFLSA-N -1 3 359.437 3.662 20 0 FHADHM CC(C)[C@@H](CNc1cc(-c2nn[n-]n2)c2ccccc2n1)c1cccnc1 ZINC000820020419 606228954 /nfs/dbraw/zinc/22/89/54/606228954.db2.gz GBDVSUOKKICBIJ-QGZVFWFLSA-N -1 3 359.437 3.662 20 0 FHADHM O=C(Nc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1)[C@H]1C[C@@H]1C1CC1 ZINC000823350526 606238273 /nfs/dbraw/zinc/23/82/73/606238273.db2.gz QIVLLZYZMZAIKY-MSOLQXFVSA-N -1 3 361.405 3.644 20 0 FHADHM O=C(Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1)[C@H]1C[C@@H]1C1CC1 ZINC000823350526 606238275 /nfs/dbraw/zinc/23/82/75/606238275.db2.gz QIVLLZYZMZAIKY-MSOLQXFVSA-N -1 3 361.405 3.644 20 0 FHADHM Cc1ccc(Oc2ccc(NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)cc2)cc1 ZINC000822267417 606249589 /nfs/dbraw/zinc/24/95/89/606249589.db2.gz SELFVYGWSNKXSL-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM Cc1ccc(Oc2ccc(NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)cc2)cc1 ZINC000822267417 606249591 /nfs/dbraw/zinc/24/95/91/606249591.db2.gz SELFVYGWSNKXSL-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM O=C(Oc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1)[C@@H]1C[C@H]1C1CC1 ZINC000823453824 606260824 /nfs/dbraw/zinc/26/08/24/606260824.db2.gz ATQANMIKQNMSPT-ZWKOTPCHSA-N -1 3 362.389 3.611 20 0 FHADHM O=C(Oc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1)[C@@H]1C[C@H]1C1CC1 ZINC000823453824 606260826 /nfs/dbraw/zinc/26/08/26/606260826.db2.gz ATQANMIKQNMSPT-ZWKOTPCHSA-N -1 3 362.389 3.611 20 0 FHADHM CC(=CC(=O)Nc1ccc(F)cc1-c1nnn[n-]1)c1ccccc1Cl ZINC000819765309 606268074 /nfs/dbraw/zinc/26/80/74/606268074.db2.gz ODUJSNPXUJCIKM-CSKARUKUSA-N -1 3 357.776 3.701 20 0 FHADHM CC(=CC(=O)Nc1ccc(F)cc1-c1nn[n-]n1)c1ccccc1Cl ZINC000819765309 606268076 /nfs/dbraw/zinc/26/80/76/606268076.db2.gz ODUJSNPXUJCIKM-CSKARUKUSA-N -1 3 357.776 3.701 20 0 FHADHM O=C(c1cc(-c2nnn[n-]2)c[nH]1)N1CCCCC[C@@H]1c1ccc(Cl)cc1 ZINC000823466777 606277577 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O=C(CSc1cccc(-c2nn[n-]n2)c1)Nc1cccc2ccccc21 ZINC000823070524 606326170 /nfs/dbraw/zinc/32/61/70/606326170.db2.gz CFIZBOSULKNKTB-UHFFFAOYSA-N -1 3 361.430 3.751 20 0 FHADHM CC(C)Oc1ccccc1CC(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820178099 606345142 /nfs/dbraw/zinc/34/51/42/606345142.db2.gz HORAMASAYQUFPN-AWEZNQCLSA-N -1 3 366.421 3.501 20 0 FHADHM CC(C)Oc1ccccc1CC(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820178099 606345144 /nfs/dbraw/zinc/34/51/44/606345144.db2.gz HORAMASAYQUFPN-AWEZNQCLSA-N -1 3 366.421 3.501 20 0 FHADHM C[C@@H](OC(=O)COc1ccc2ccccc2c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820495291 606345623 /nfs/dbraw/zinc/34/56/23/606345623.db2.gz GTUJIQIWJNECFR-CQSZACIVSA-N -1 3 374.400 3.703 20 0 FHADHM C[C@@H](OC(=O)COc1ccc2ccccc2c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820495291 606345625 /nfs/dbraw/zinc/34/56/25/606345625.db2.gz GTUJIQIWJNECFR-CQSZACIVSA-N -1 3 374.400 3.703 20 0 FHADHM Cc1cccc([C@H]2CCCN2C(=O)Nc2ccc(F)cc2-c2nnn[n-]2)c1 ZINC000822299562 606346713 /nfs/dbraw/zinc/34/67/13/606346713.db2.gz MXZPALMADBEIOP-QGZVFWFLSA-N -1 3 366.400 3.683 20 0 FHADHM Cc1cccc([C@H]2CCCN2C(=O)Nc2ccc(F)cc2-c2nn[n-]n2)c1 ZINC000822299562 606346714 /nfs/dbraw/zinc/34/67/14/606346714.db2.gz MXZPALMADBEIOP-QGZVFWFLSA-N -1 3 366.400 3.683 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccc2ccccc2n1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488941 606348701 /nfs/dbraw/zinc/34/87/01/606348701.db2.gz XCDQPYRZCPIYPD-DINCDJDBSA-N -1 3 371.400 3.733 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccc2ccccc2n1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488941 606348703 /nfs/dbraw/zinc/34/87/03/606348703.db2.gz XCDQPYRZCPIYPD-DINCDJDBSA-N -1 3 371.400 3.733 20 0 FHADHM C[C@@H](SCc1ccccc1)C(=O)O[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820549907 606350190 /nfs/dbraw/zinc/35/01/90/606350190.db2.gz SYNPLMUZLQKFKZ-ZIAGYGMSSA-N -1 3 368.462 3.793 20 0 FHADHM C[C@@H](SCc1ccccc1)C(=O)O[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820549907 606350192 /nfs/dbraw/zinc/35/01/92/606350192.db2.gz SYNPLMUZLQKFKZ-ZIAGYGMSSA-N -1 3 368.462 3.793 20 0 FHADHM Cc1ccc(SCC(=O)O[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000822266559 606353488 /nfs/dbraw/zinc/35/34/88/606353488.db2.gz CJRSFHGSOKHQPZ-ZDUSSCGKSA-N -1 3 354.435 3.572 20 0 FHADHM Cc1ccc(SCC(=O)O[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000822266559 606353490 /nfs/dbraw/zinc/35/34/90/606353490.db2.gz CJRSFHGSOKHQPZ-ZDUSSCGKSA-N -1 3 354.435 3.572 20 0 FHADHM Cc1cc(OCC(=O)O[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)ccc1Cl ZINC000822210526 606358541 /nfs/dbraw/zinc/35/85/41/606358541.db2.gz FYTIEVLPMOASPG-LBPRGKRZSA-N -1 3 372.812 3.512 20 0 FHADHM Cc1cc(OCC(=O)O[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)ccc1Cl ZINC000822210526 606358542 /nfs/dbraw/zinc/35/85/42/606358542.db2.gz FYTIEVLPMOASPG-LBPRGKRZSA-N -1 3 372.812 3.512 20 0 FHADHM CSCCCC(=O)Oc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000821962642 606361434 /nfs/dbraw/zinc/36/14/34/606361434.db2.gz UNYRAWPWFMXWKH-UHFFFAOYSA-N -1 3 370.434 3.708 20 0 FHADHM CSCCCC(=O)Oc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000821962642 606361436 /nfs/dbraw/zinc/36/14/36/606361436.db2.gz UNYRAWPWFMXWKH-UHFFFAOYSA-N -1 3 370.434 3.708 20 0 FHADHM O=C(Nc1sccc1-c1nnn[n-]1)c1ccc(Oc2ccccc2)o1 ZINC000823387143 606373156 /nfs/dbraw/zinc/37/31/56/606373156.db2.gz DGIHFMADYHVNRI-UHFFFAOYSA-N -1 3 353.363 3.566 20 0 FHADHM O=C(Nc1sccc1-c1nn[n-]n1)c1ccc(Oc2ccccc2)o1 ZINC000823387143 606373157 /nfs/dbraw/zinc/37/31/57/606373157.db2.gz DGIHFMADYHVNRI-UHFFFAOYSA-N -1 3 353.363 3.566 20 0 FHADHM Cc1c(C(=O)O[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cnc2ccccc12 ZINC000822020890 606373972 /nfs/dbraw/zinc/37/39/72/606373972.db2.gz MVVSLBZUBGPJMQ-ZDUSSCGKSA-N -1 3 359.389 3.641 20 0 FHADHM Cc1c(C(=O)O[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cnc2ccccc12 ZINC000822020890 606373973 /nfs/dbraw/zinc/37/39/73/606373973.db2.gz MVVSLBZUBGPJMQ-ZDUSSCGKSA-N -1 3 359.389 3.641 20 0 FHADHM O[C@H](CCc1ccc(Nc2ncccc2-c2nnn[n-]2)cc1)c1ccccc1 ZINC000823674797 606432774 /nfs/dbraw/zinc/43/27/74/606432774.db2.gz RPUKXXDEBXNWQN-LJQANCHMSA-N -1 3 372.432 3.672 20 0 FHADHM O[C@H](CCc1ccc(Nc2ncccc2-c2nn[n-]n2)cc1)c1ccccc1 ZINC000823674797 606432776 /nfs/dbraw/zinc/43/27/76/606432776.db2.gz RPUKXXDEBXNWQN-LJQANCHMSA-N -1 3 372.432 3.672 20 0 FHADHM O[C@H](CCc1cccc(Nc2ncccc2-c2nnn[n-]2)c1)c1ccccc1 ZINC000823675835 606433191 /nfs/dbraw/zinc/43/31/91/606433191.db2.gz ZVTQPUNSWZMTQF-LJQANCHMSA-N -1 3 372.432 3.672 20 0 FHADHM O[C@H](CCc1cccc(Nc2ncccc2-c2nn[n-]n2)c1)c1ccccc1 ZINC000823675835 606433192 /nfs/dbraw/zinc/43/31/92/606433192.db2.gz ZVTQPUNSWZMTQF-LJQANCHMSA-N -1 3 372.432 3.672 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)N1CCCC[C@@H]1c1ccc(F)cc1 ZINC000823359914 606439165 /nfs/dbraw/zinc/43/91/65/606439165.db2.gz UORVGISNJQJMKV-QGZVFWFLSA-N -1 3 366.400 3.765 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)N1CCCC[C@@H]1c1ccc(F)cc1 ZINC000823359914 606439167 /nfs/dbraw/zinc/43/91/67/606439167.db2.gz UORVGISNJQJMKV-QGZVFWFLSA-N -1 3 366.400 3.765 20 0 FHADHM CC[C@H](Nc1cc(-c2nnn[n-]2)c2ccccc2n1)c1ccc(OC)cc1 ZINC000820925586 606441903 /nfs/dbraw/zinc/44/19/03/606441903.db2.gz JWXNWLJYFSOUQV-KRWDZBQOSA-N -1 3 360.421 3.987 20 0 FHADHM CC[C@H](Nc1cc(-c2nn[n-]n2)c2ccccc2n1)c1ccc(OC)cc1 ZINC000820925586 606441905 /nfs/dbraw/zinc/44/19/05/606441905.db2.gz JWXNWLJYFSOUQV-KRWDZBQOSA-N -1 3 360.421 3.987 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1N1CCC[C@@H](c2nc3ccccc3o2)C1 ZINC000822743953 606452724 /nfs/dbraw/zinc/45/27/24/606452724.db2.gz IWCZTRWGBSCUHM-CYBMUJFWSA-N -1 3 364.384 3.531 20 0 FHADHM Cc1cc(C)c2ncc(-c3nnn[n-]3)c(N3CCC[C@@H]3c3ccccn3)c2c1 ZINC000822195051 606458642 /nfs/dbraw/zinc/45/86/42/606458642.db2.gz FLIBRMZWICYRLU-GOSISDBHSA-N -1 3 371.448 3.768 20 0 FHADHM Cc1cc(C)c2ncc(-c3nn[n-]n3)c(N3CCC[C@@H]3c3ccccn3)c2c1 ZINC000822195051 606458645 /nfs/dbraw/zinc/45/86/45/606458645.db2.gz FLIBRMZWICYRLU-GOSISDBHSA-N -1 3 371.448 3.768 20 0 FHADHM Cc1c2ccccc2oc1[C@H](C)OC(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000822021355 606464338 /nfs/dbraw/zinc/46/43/38/606464338.db2.gz XXCLXWPZADMJTK-JTQLQIEISA-N -1 3 354.391 3.901 20 0 FHADHM Cc1c2ccccc2oc1[C@H](C)OC(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000822021355 606464340 /nfs/dbraw/zinc/46/43/40/606464340.db2.gz XXCLXWPZADMJTK-JTQLQIEISA-N -1 3 354.391 3.901 20 0 FHADHM Cc1csc(N(C(=O)c2cc(-c3nnn[n-]3)cs2)c2ccccc2)n1 ZINC000822414682 606478944 /nfs/dbraw/zinc/47/89/44/606478944.db2.gz PSYCIKWHEKGVRQ-UHFFFAOYSA-N -1 3 368.447 3.672 20 0 FHADHM Cc1csc(N(C(=O)c2cc(-c3nn[n-]n3)cs2)c2ccccc2)n1 ZINC000822414682 606478946 /nfs/dbraw/zinc/47/89/46/606478946.db2.gz PSYCIKWHEKGVRQ-UHFFFAOYSA-N -1 3 368.447 3.672 20 0 FHADHM Cc1cscc1C(=O)Nc1nc(-c2ccc(-c3nnn[n-]3)cc2)cs1 ZINC000822414627 606489381 /nfs/dbraw/zinc/48/93/81/606489381.db2.gz NTKYMMZEJOUBPW-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM Cc1cscc1C(=O)Nc1nc(-c2ccc(-c3nn[n-]n3)cc2)cs1 ZINC000822414627 606489383 /nfs/dbraw/zinc/48/93/83/606489383.db2.gz NTKYMMZEJOUBPW-UHFFFAOYSA-N -1 3 368.447 3.612 20 0 FHADHM CCCN(C(=O)c1cc(-c2nnn[n-]2)cs1)[C@H](C)c1ccccc1OC ZINC000821083342 606491816 /nfs/dbraw/zinc/49/18/16/606491816.db2.gz 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ZINC000820892652 606509769 /nfs/dbraw/zinc/50/97/69/606509769.db2.gz DTTSUVMABCDEIU-FQEVSTJZSA-N -1 3 363.465 3.703 20 0 FHADHM CCC(CC)[C@H](NC(=O)Cc1cccc(-c2nn[n-]n2)c1)c1ccccc1 ZINC000820892652 606509770 /nfs/dbraw/zinc/50/97/70/606509770.db2.gz DTTSUVMABCDEIU-FQEVSTJZSA-N -1 3 363.465 3.703 20 0 FHADHM Cc1ccc([C@@H]2[C@@H](C)CCCN2C(=O)c2cc(-c3nnn[n-]3)cs2)cc1 ZINC000822231787 606516521 /nfs/dbraw/zinc/51/65/21/606516521.db2.gz HNGXNMBQEJBYDP-GUYCJALGSA-N -1 3 367.478 3.850 20 0 FHADHM Cc1ccc([C@@H]2[C@@H](C)CCCN2C(=O)c2cc(-c3nn[n-]n3)cs2)cc1 ZINC000822231787 606516522 /nfs/dbraw/zinc/51/65/22/606516522.db2.gz HNGXNMBQEJBYDP-GUYCJALGSA-N -1 3 367.478 3.850 20 0 FHADHM O=C(Nc1ccc(OC2CCCC2)c(F)c1)c1cc(-c2nnn[n-]2)cs1 ZINC000823350582 606520003 /nfs/dbraw/zinc/52/00/03/606520003.db2.gz SHIIMQXDMHBRRC-UHFFFAOYSA-N -1 3 373.413 3.641 20 0 FHADHM O=C(Nc1ccc(OC2CCCC2)c(F)c1)c1cc(-c2nn[n-]n2)cs1 ZINC000823350582 606520005 /nfs/dbraw/zinc/52/00/05/606520005.db2.gz SHIIMQXDMHBRRC-UHFFFAOYSA-N -1 3 373.413 3.641 20 0 FHADHM CC[C@H]1CN(C(=O)c2cc(-c3nnn[n-]3)cs2)CC[C@H]1c1ccccc1 ZINC000820989261 606523954 /nfs/dbraw/zinc/52/39/54/606523954.db2.gz PJBJTZYRTDSCCY-XJKSGUPXSA-N -1 3 367.478 3.584 20 0 FHADHM CC[C@H]1CN(C(=O)c2cc(-c3nn[n-]n3)cs2)CC[C@H]1c1ccccc1 ZINC000820989261 606523956 /nfs/dbraw/zinc/52/39/56/606523956.db2.gz PJBJTZYRTDSCCY-XJKSGUPXSA-N -1 3 367.478 3.584 20 0 FHADHM CC1CC(NC(=O)c2ccccc2Sc2ccccc2-c2nnn[n-]2)C1 ZINC000820657429 606547207 /nfs/dbraw/zinc/54/72/07/606547207.db2.gz KWEAUTMHQAPOER-UHFFFAOYSA-N -1 3 365.462 3.546 20 0 FHADHM CC1CC(NC(=O)c2ccccc2Sc2ccccc2-c2nn[n-]n2)C1 ZINC000820657429 606547208 /nfs/dbraw/zinc/54/72/08/606547208.db2.gz KWEAUTMHQAPOER-UHFFFAOYSA-N -1 3 365.462 3.546 20 0 FHADHM CC1(CNC(=O)Nc2ccc(Oc3ccc(-c4nnn[n-]4)cc3)cc2)CC1 ZINC000820618525 606573896 /nfs/dbraw/zinc/57/38/96/606573896.db2.gz HHXIBJIYUWDYKQ-UHFFFAOYSA-N -1 3 364.409 3.581 20 0 FHADHM CC1(CNC(=O)Nc2ccc(Oc3ccc(-c4nn[n-]n4)cc3)cc2)CC1 ZINC000820618525 606573897 /nfs/dbraw/zinc/57/38/97/606573897.db2.gz HHXIBJIYUWDYKQ-UHFFFAOYSA-N -1 3 364.409 3.581 20 0 FHADHM Cc1cc([C@H](C)NC(=O)Nc2cc(-c3nnn[n-]3)ccc2C)ccc1F ZINC000822192043 606574498 /nfs/dbraw/zinc/57/44/98/606574498.db2.gz XJQGKKORJYJFJU-LBPRGKRZSA-N -1 3 354.389 3.505 20 0 FHADHM Cc1cc([C@H](C)NC(=O)Nc2cc(-c3nn[n-]n3)ccc2C)ccc1F ZINC000822192043 606574499 /nfs/dbraw/zinc/57/44/99/606574499.db2.gz XJQGKKORJYJFJU-LBPRGKRZSA-N -1 3 354.389 3.505 20 0 FHADHM CN(C)C(=O)Sc1ccc(CSc2ccccc2-c2nnn[n-]2)cc1 ZINC000821578156 606590738 /nfs/dbraw/zinc/59/07/38/606590738.db2.gz QEGYNLGHKWZNLN-UHFFFAOYSA-N -1 3 371.491 3.933 20 0 FHADHM CN(C)C(=O)Sc1ccc(CSc2ccccc2-c2nn[n-]n2)cc1 ZINC000821578156 606590740 /nfs/dbraw/zinc/59/07/40/606590740.db2.gz QEGYNLGHKWZNLN-UHFFFAOYSA-N -1 3 371.491 3.933 20 0 FHADHM Cc1nc(CNc2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)oc1C ZINC000822444370 606596978 /nfs/dbraw/zinc/59/69/78/606596978.db2.gz OAMHJYXQAIAGFI-UHFFFAOYSA-N -1 3 362.393 3.876 20 0 FHADHM Fc1cccc(Br)c1NCc1ccc(-c2nnn[n-]2)cc1F ZINC000822743793 606597249 /nfs/dbraw/zinc/59/72/49/606597249.db2.gz FYIYGJOVCNYEQF-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1cccc(Br)c1NCc1ccc(-c2nn[n-]n2)cc1F ZINC000822743793 606597250 /nfs/dbraw/zinc/59/72/50/606597250.db2.gz FYIYGJOVCNYEQF-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Cc1cc(CCCC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c(C)s1 ZINC000822199693 606604227 /nfs/dbraw/zinc/60/42/27/606604227.db2.gz DQWBGWVRDWLESO-ZDUSSCGKSA-N -1 3 369.494 3.745 20 0 FHADHM Cc1cc(CCCC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c(C)s1 ZINC000822199693 606604229 /nfs/dbraw/zinc/60/42/29/606604229.db2.gz DQWBGWVRDWLESO-ZDUSSCGKSA-N -1 3 369.494 3.745 20 0 FHADHM Cc1cc(CCCC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c(C)s1 ZINC000822199692 606604654 /nfs/dbraw/zinc/60/46/54/606604654.db2.gz DQWBGWVRDWLESO-CYBMUJFWSA-N -1 3 369.494 3.745 20 0 FHADHM Cc1cc(CCCC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c(C)s1 ZINC000822199692 606604655 /nfs/dbraw/zinc/60/46/55/606604655.db2.gz DQWBGWVRDWLESO-CYBMUJFWSA-N -1 3 369.494 3.745 20 0 FHADHM FC(F)(F)c1cccc(-c2noc(Cc3cccc(-c4nnn[n-]4)c3)n2)c1 ZINC000822729278 606620189 /nfs/dbraw/zinc/62/01/89/606620189.db2.gz ZQUNTPRSKTYBEP-UHFFFAOYSA-N -1 3 372.310 3.526 20 0 FHADHM FC(F)(F)c1cccc(-c2noc(Cc3cccc(-c4nn[n-]n4)c3)n2)c1 ZINC000822729278 606620191 /nfs/dbraw/zinc/62/01/91/606620191.db2.gz ZQUNTPRSKTYBEP-UHFFFAOYSA-N -1 3 372.310 3.526 20 0 FHADHM O=C(Oc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1)C1CC(F)(F)C1 ZINC000823454779 606623108 /nfs/dbraw/zinc/62/31/08/606623108.db2.gz UFSQRIDHAUMEBA-UHFFFAOYSA-N -1 3 372.331 3.610 20 0 FHADHM O=C(Oc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1)C1CC(F)(F)C1 ZINC000823454779 606623109 /nfs/dbraw/zinc/62/31/09/606623109.db2.gz UFSQRIDHAUMEBA-UHFFFAOYSA-N -1 3 372.331 3.610 20 0 FHADHM CC(C)N(C(=O)[C@@H](C)Sc1ccc(Cl)cc1-c1nnn[n-]1)C(C)C ZINC000820550622 606630178 /nfs/dbraw/zinc/63/01/78/606630178.db2.gz XXUOLPOHTLRIKL-LLVKDONJSA-N -1 3 367.906 3.646 20 0 FHADHM CC(C)N(C(=O)[C@@H](C)Sc1ccc(Cl)cc1-c1nn[n-]n1)C(C)C ZINC000820550622 606630180 /nfs/dbraw/zinc/63/01/80/606630180.db2.gz XXUOLPOHTLRIKL-LLVKDONJSA-N -1 3 367.906 3.646 20 0 FHADHM Cc1[nH]ccc1C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000822009885 606631942 /nfs/dbraw/zinc/63/19/42/606631942.db2.gz GNWPTAIKGMDQGQ-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM Cc1[nH]ccc1C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000822009885 606631943 /nfs/dbraw/zinc/63/19/43/606631943.db2.gz GNWPTAIKGMDQGQ-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM Cc1cccnc1C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000822369250 606632472 /nfs/dbraw/zinc/63/24/72/606632472.db2.gz DUOHUUNINCZFJQ-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1cccnc1C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000822369250 606632474 /nfs/dbraw/zinc/63/24/74/606632474.db2.gz DUOHUUNINCZFJQ-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM CC(C)C[C@@H](C)OCCC(=O)N(CC(C)C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820057121 606670135 /nfs/dbraw/zinc/67/01/35/606670135.db2.gz WWEPEXQNKURONQ-MRXNPFEDSA-N -1 3 373.501 3.697 20 0 FHADHM CC(C)C[C@@H](C)OCCC(=O)N(CC(C)C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820057121 606670136 /nfs/dbraw/zinc/67/01/36/606670136.db2.gz WWEPEXQNKURONQ-MRXNPFEDSA-N -1 3 373.501 3.697 20 0 FHADHM CCc1cnc(CNc2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)o1 ZINC000821499574 606702684 /nfs/dbraw/zinc/70/26/84/606702684.db2.gz NBYSVZNFWDANQZ-UHFFFAOYSA-N -1 3 362.393 3.822 20 0 FHADHM CCOCCC1(CNc2nc3ccccc3cc2-c2nnn[n-]2)CCCC1 ZINC000821373366 606721376 /nfs/dbraw/zinc/72/13/76/606721376.db2.gz HPOYZCNCAPWTCW-UHFFFAOYSA-N -1 3 366.469 3.814 20 0 FHADHM CCOCCC1(CNc2nc3ccccc3cc2-c2nn[n-]n2)CCCC1 ZINC000821373366 606721378 /nfs/dbraw/zinc/72/13/78/606721378.db2.gz HPOYZCNCAPWTCW-UHFFFAOYSA-N -1 3 366.469 3.814 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(OCc2csc(-c3ccoc3)n2)c1 ZINC000822574794 606787408 /nfs/dbraw/zinc/78/74/08/606787408.db2.gz ZKYNLTJUEMCTEC-UHFFFAOYSA-N -1 3 359.798 3.816 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(OCc2csc(-c3ccoc3)n2)c1 ZINC000822574794 606787410 /nfs/dbraw/zinc/78/74/10/606787410.db2.gz ZKYNLTJUEMCTEC-UHFFFAOYSA-N -1 3 359.798 3.816 20 0 FHADHM Fc1ccc(-c2csc(NCc3cc(-c4nnn[n-]4)ccc3F)n2)cc1 ZINC000822753696 606799823 /nfs/dbraw/zinc/79/98/23/606799823.db2.gz RNFHOZHRTJAPAX-UHFFFAOYSA-N -1 3 370.388 3.881 20 0 FHADHM Fc1ccc(-c2csc(NCc3cc(-c4nn[n-]n4)ccc3F)n2)cc1 ZINC000822753696 606799825 /nfs/dbraw/zinc/79/98/25/606799825.db2.gz RNFHOZHRTJAPAX-UHFFFAOYSA-N -1 3 370.388 3.881 20 0 FHADHM CC(C)CN(C(=O)c1sccc1-c1nnn[n-]1)c1ccc(Cl)cc1 ZINC000820081560 606811920 /nfs/dbraw/zinc/81/19/20/606811920.db2.gz LFZCZPOAQZKWMF-UHFFFAOYSA-N -1 3 361.858 3.884 20 0 FHADHM CC(C)CN(C(=O)c1sccc1-c1nn[n-]n1)c1ccc(Cl)cc1 ZINC000820081560 606811922 /nfs/dbraw/zinc/81/19/22/606811922.db2.gz LFZCZPOAQZKWMF-UHFFFAOYSA-N -1 3 361.858 3.884 20 0 FHADHM CC(C)N(C(=O)CS[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)C1CCCC1 ZINC000820548949 606827934 /nfs/dbraw/zinc/82/79/34/606827934.db2.gz JCFNVCLVPWWBTB-AWEZNQCLSA-N -1 3 373.526 3.841 20 0 FHADHM CC(C)N(C(=O)CS[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)C1CCCC1 ZINC000820548949 606827936 /nfs/dbraw/zinc/82/79/36/606827936.db2.gz JCFNVCLVPWWBTB-AWEZNQCLSA-N -1 3 373.526 3.841 20 0 FHADHM CCC1(C(=O)Nc2nc(-c3ccc(-c4nnn[n-]4)cc3)cs2)CCCC1 ZINC000820944025 606841990 /nfs/dbraw/zinc/84/19/90/606841990.db2.gz GQCOPBAEUVYYNF-UHFFFAOYSA-N -1 3 368.466 3.899 20 0 FHADHM CCC1(C(=O)Nc2nc(-c3ccc(-c4nn[n-]n4)cc3)cs2)CCCC1 ZINC000820944025 606841992 /nfs/dbraw/zinc/84/19/92/606841992.db2.gz GQCOPBAEUVYYNF-UHFFFAOYSA-N -1 3 368.466 3.899 20 0 FHADHM CC[C@@H](Sc1ccc(-c2nnn[n-]2)cn1)C(=O)c1ccc(Cl)cc1 ZINC000820939068 606866894 /nfs/dbraw/zinc/86/68/94/606866894.db2.gz PTQJBOPPNHIVRZ-CYBMUJFWSA-N -1 3 359.842 3.669 20 0 FHADHM CC[C@@H](Sc1ccc(-c2nn[n-]n2)cn1)C(=O)c1ccc(Cl)cc1 ZINC000820939068 606866896 /nfs/dbraw/zinc/86/68/96/606866896.db2.gz PTQJBOPPNHIVRZ-CYBMUJFWSA-N -1 3 359.842 3.669 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1cccc(Cl)c1F ZINC000820120292 606871671 /nfs/dbraw/zinc/87/16/71/606871671.db2.gz AOPINHPPNXURFK-UHFFFAOYSA-N -1 3 373.819 3.710 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1cccc(Cl)c1F ZINC000820120292 606871673 /nfs/dbraw/zinc/87/16/73/606871673.db2.gz AOPINHPPNXURFK-UHFFFAOYSA-N -1 3 373.819 3.710 20 0 FHADHM Clc1cc(N2CCC[C@@H](Nc3ccccc3)C2)ccc1-c1nnn[n-]1 ZINC000822567825 606875529 /nfs/dbraw/zinc/87/55/29/606875529.db2.gz HYBXAEUCTHGONR-CQSZACIVSA-N -1 3 354.845 3.601 20 0 FHADHM Clc1cc(N2CCC[C@@H](Nc3ccccc3)C2)ccc1-c1nn[n-]n1 ZINC000822567825 606875531 /nfs/dbraw/zinc/87/55/31/606875531.db2.gz HYBXAEUCTHGONR-CQSZACIVSA-N -1 3 354.845 3.601 20 0 FHADHM O[C@@H](CNc1cc(Cl)ccc1-c1nnn[n-]1)c1cc2ccccc2s1 ZINC000823690869 606878303 /nfs/dbraw/zinc/87/83/03/606878303.db2.gz WPGXSKMYDZVKOY-AWEZNQCLSA-N -1 3 371.853 3.880 20 0 FHADHM O[C@@H](CNc1cc(Cl)ccc1-c1nn[n-]n1)c1cc2ccccc2s1 ZINC000823690869 606878305 /nfs/dbraw/zinc/87/83/05/606878305.db2.gz WPGXSKMYDZVKOY-AWEZNQCLSA-N -1 3 371.853 3.880 20 0 FHADHM CCc1nnc(Sc2nc3ccccc3s2)c(-c2nnn[n-]2)c1CC ZINC000821548642 606910162 /nfs/dbraw/zinc/91/01/62/606910162.db2.gz RSFRGPAXCAZGKW-UHFFFAOYSA-N -1 3 369.479 3.542 20 0 FHADHM COCc1cccc(CNc2ccc(C(F)(F)F)cc2-c2nnn[n-]2)c1 ZINC000821695834 606921567 /nfs/dbraw/zinc/92/15/67/606921567.db2.gz KDNINZRSJYFPIQ-UHFFFAOYSA-N -1 3 363.343 3.644 20 0 FHADHM COCc1cccc(CNc2ccc(C(F)(F)F)cc2-c2nn[n-]n2)c1 ZINC000821695834 606921568 /nfs/dbraw/zinc/92/15/68/606921568.db2.gz KDNINZRSJYFPIQ-UHFFFAOYSA-N -1 3 363.343 3.644 20 0 FHADHM CN(C(=O)C/C=C\c1cccc(F)c1)c1cc(Cl)ccc1-c1nnn[n-]1 ZINC000821569631 606958891 /nfs/dbraw/zinc/95/88/91/606958891.db2.gz QEUQJUAFTWJNSM-HYXAFXHYSA-N -1 3 371.803 3.726 20 0 FHADHM CN(C(=O)C/C=C\c1cccc(F)c1)c1cc(Cl)ccc1-c1nn[n-]n1 ZINC000821569631 606958893 /nfs/dbraw/zinc/95/88/93/606958893.db2.gz QEUQJUAFTWJNSM-HYXAFXHYSA-N -1 3 371.803 3.726 20 0 FHADHM Fc1ccc(CN(Cc2ccco2)Cc2cccs2)cc1-c1nnn[n-]1 ZINC000822766629 606960367 /nfs/dbraw/zinc/96/03/67/606960367.db2.gz LQGGHRMHVYFABQ-UHFFFAOYSA-N -1 3 369.425 3.863 20 0 FHADHM Fc1ccc(CN(Cc2ccco2)Cc2cccs2)cc1-c1nn[n-]n1 ZINC000822766629 606960369 /nfs/dbraw/zinc/96/03/69/606960369.db2.gz LQGGHRMHVYFABQ-UHFFFAOYSA-N -1 3 369.425 3.863 20 0 FHADHM Cc1cc(Cl)cc(C(=O)N(C)c2cc(Cl)ccc2-c2nnn[n-]2)c1 ZINC000822201170 606961305 /nfs/dbraw/zinc/96/13/05/606961305.db2.gz UHHJNPMHCALQTM-UHFFFAOYSA-N -1 3 362.220 3.759 20 0 FHADHM Cc1cc(Cl)cc(C(=O)N(C)c2cc(Cl)ccc2-c2nn[n-]n2)c1 ZINC000822201170 606961307 /nfs/dbraw/zinc/96/13/07/606961307.db2.gz UHHJNPMHCALQTM-UHFFFAOYSA-N -1 3 362.220 3.759 20 0 FHADHM Cc1nc(-c2ccccc2)ccc1C(=O)N(C)c1ccccc1-c1nnn[n-]1 ZINC000822419750 606969630 /nfs/dbraw/zinc/96/96/30/606969630.db2.gz UCLZIOZFKUCJCO-UHFFFAOYSA-N -1 3 370.416 3.514 20 0 FHADHM Cc1nc(-c2ccccc2)ccc1C(=O)N(C)c1ccccc1-c1nn[n-]n1 ZINC000822419750 606969631 /nfs/dbraw/zinc/96/96/31/606969631.db2.gz UCLZIOZFKUCJCO-UHFFFAOYSA-N -1 3 370.416 3.514 20 0 FHADHM CCCCCOc1ccc(C(=O)N(C)c2ccccc2-c2nnn[n-]2)cc1 ZINC000821056355 606970936 /nfs/dbraw/zinc/97/09/36/606970936.db2.gz OSFOJFSTBISAES-UHFFFAOYSA-N -1 3 365.437 3.712 20 0 FHADHM CCCCCOc1ccc(C(=O)N(C)c2ccccc2-c2nn[n-]n2)cc1 ZINC000821056355 606970937 /nfs/dbraw/zinc/97/09/37/606970937.db2.gz OSFOJFSTBISAES-UHFFFAOYSA-N -1 3 365.437 3.712 20 0 FHADHM CN(C(=O)c1cc2c(s1)CCCCCC2)c1ccccc1-c1nnn[n-]1 ZINC000821573470 606973996 /nfs/dbraw/zinc/97/39/96/606973996.db2.gz RECCSJRDCDQRCN-UHFFFAOYSA-N -1 3 367.478 3.864 20 0 FHADHM CN(C(=O)c1cc2c(s1)CCCCCC2)c1ccccc1-c1nn[n-]n1 ZINC000821573470 606973997 /nfs/dbraw/zinc/97/39/97/606973997.db2.gz RECCSJRDCDQRCN-UHFFFAOYSA-N -1 3 367.478 3.864 20 0 FHADHM Cc1ccc2ccccc2c1C[S@](=O)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000822279583 606978970 /nfs/dbraw/zinc/97/89/70/606978970.db2.gz BNJPRVXIDXDRTM-AREMUKBSSA-N -1 3 362.458 3.777 20 0 FHADHM Cc1ccc2ccccc2c1C[S@](=O)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000822279583 606978971 /nfs/dbraw/zinc/97/89/71/606978971.db2.gz BNJPRVXIDXDRTM-AREMUKBSSA-N -1 3 362.458 3.777 20 0 FHADHM CCCC1(CNC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C2CC2)CCC1 ZINC000821034494 606988821 /nfs/dbraw/zinc/98/88/21/606988821.db2.gz NKEQQBAXVVZFON-UHFFFAOYSA-N -1 3 368.485 3.511 20 0 FHADHM CCCC1(CNC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C2CC2)CCC1 ZINC000821034494 606988823 /nfs/dbraw/zinc/98/88/23/606988823.db2.gz NKEQQBAXVVZFON-UHFFFAOYSA-N -1 3 368.485 3.511 20 0 FHADHM O=C(OCc1ccc(F)c(-c2nnn[n-]2)c1)c1cccc(Cl)c1Cl ZINC000823426159 606990815 /nfs/dbraw/zinc/99/08/15/606990815.db2.gz BABIETWJKABXFE-UHFFFAOYSA-N -1 3 367.167 3.670 20 0 FHADHM O=C(OCc1ccc(F)c(-c2nn[n-]n2)c1)c1cccc(Cl)c1Cl ZINC000823426159 606990816 /nfs/dbraw/zinc/99/08/16/606990816.db2.gz BABIETWJKABXFE-UHFFFAOYSA-N -1 3 367.167 3.670 20 0 FHADHM CC(C)[C@@H](Sc1cccc(-c2nnn[n-]2)c1)C(=O)N(C)c1ccccc1 ZINC000820033863 607011612 /nfs/dbraw/zinc/01/16/12/607011612.db2.gz ZATXGEWTXWBOBU-QGZVFWFLSA-N -1 3 367.478 3.646 20 0 FHADHM CC(C)[C@@H](Sc1cccc(-c2nn[n-]n2)c1)C(=O)N(C)c1ccccc1 ZINC000820033863 607011613 /nfs/dbraw/zinc/01/16/13/607011613.db2.gz ZATXGEWTXWBOBU-QGZVFWFLSA-N -1 3 367.478 3.646 20 0 FHADHM Cc1cc(C)c(NC(=O)[C@H](C)Sc2cccc(-c3nnn[n-]3)c2)c(C)c1 ZINC000822194067 607013758 /nfs/dbraw/zinc/01/37/58/607013758.db2.gz HIQKFNQKSAEEMI-AWEZNQCLSA-N -1 3 367.478 3.911 20 0 FHADHM Cc1cc(C)c(NC(=O)[C@H](C)Sc2cccc(-c3nn[n-]n3)c2)c(C)c1 ZINC000822194067 607013759 /nfs/dbraw/zinc/01/37/59/607013759.db2.gz HIQKFNQKSAEEMI-AWEZNQCLSA-N -1 3 367.478 3.911 20 0 FHADHM Cc1cc(C)c(NC(=O)[C@@H](C)Sc2cccc(-c3nnn[n-]3)c2)c(C)c1 ZINC000822194068 607013859 /nfs/dbraw/zinc/01/38/59/607013859.db2.gz HIQKFNQKSAEEMI-CQSZACIVSA-N -1 3 367.478 3.911 20 0 FHADHM Cc1cc(C)c(NC(=O)[C@@H](C)Sc2cccc(-c3nn[n-]n3)c2)c(C)c1 ZINC000822194068 607013861 /nfs/dbraw/zinc/01/38/61/607013861.db2.gz HIQKFNQKSAEEMI-CQSZACIVSA-N -1 3 367.478 3.911 20 0 FHADHM C[C@H](Sc1cccc(-c2nnn[n-]2)c1)c1nc(Cc2ccccc2)no1 ZINC000820556624 607015051 /nfs/dbraw/zinc/01/50/51/607015051.db2.gz UYJSHUVCHSSAGM-LBPRGKRZSA-N -1 3 364.434 3.694 20 0 FHADHM C[C@H](Sc1cccc(-c2nn[n-]n2)c1)c1nc(Cc2ccccc2)no1 ZINC000820556624 607015054 /nfs/dbraw/zinc/01/50/54/607015054.db2.gz UYJSHUVCHSSAGM-LBPRGKRZSA-N -1 3 364.434 3.694 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1OCc1coc(-c2cccc(F)c2)n1 ZINC000822221368 607029462 /nfs/dbraw/zinc/02/94/62/607029462.db2.gz LWRRNUROFWTKDT-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1OCc1coc(-c2cccc(F)c2)n1 ZINC000822221368 607029465 /nfs/dbraw/zinc/02/94/65/607029465.db2.gz LWRRNUROFWTKDT-UHFFFAOYSA-N -1 3 351.341 3.548 20 0 FHADHM Cc1oc(-c2cccs2)nc1COc1cc(-c2nnn[n-]2)ccc1C ZINC000822221300 607031502 /nfs/dbraw/zinc/03/15/02/607031502.db2.gz JKEHXWHJVJYQDV-UHFFFAOYSA-N -1 3 353.407 3.779 20 0 FHADHM Cc1oc(-c2cccs2)nc1COc1cc(-c2nn[n-]n2)ccc1C ZINC000822221300 607031503 /nfs/dbraw/zinc/03/15/03/607031503.db2.gz JKEHXWHJVJYQDV-UHFFFAOYSA-N -1 3 353.407 3.779 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)C[C@H]1CC[C@@H](C)C1 ZINC000820087758 607034008 /nfs/dbraw/zinc/03/40/08/607034008.db2.gz ZEPJXLBIXGRJQR-WBVHZDCISA-N -1 3 355.486 3.678 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)C[C@H]1CC[C@@H](C)C1 ZINC000820087758 607034011 /nfs/dbraw/zinc/03/40/11/607034011.db2.gz ZEPJXLBIXGRJQR-WBVHZDCISA-N -1 3 355.486 3.678 20 0 FHADHM C[C@@H]1CC[C@@H](CC(=O)N(Cc2ccco2)c2ccccc2-c2nnn[n-]2)C1 ZINC000820684170 607054867 /nfs/dbraw/zinc/05/48/67/607054867.db2.gz MSNVAQSFBRCQJX-HUUCEWRRSA-N -1 3 365.437 3.819 20 0 FHADHM C[C@@H]1CC[C@@H](CC(=O)N(Cc2ccco2)c2ccccc2-c2nn[n-]n2)C1 ZINC000820684170 607054869 /nfs/dbraw/zinc/05/48/69/607054869.db2.gz MSNVAQSFBRCQJX-HUUCEWRRSA-N -1 3 365.437 3.819 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CN[C@@H]1CCCOc2ccc(Cl)cc21 ZINC000822741516 607056849 /nfs/dbraw/zinc/05/68/49/607056849.db2.gz YCOKVRQJKSZUJF-MRXNPFEDSA-N -1 3 373.819 3.663 20 0 FHADHM CCC1CCC(N(C(=O)NCc2cccc(-c3nnn[n-]3)c2)C2CC2)CC1 ZINC000820972698 607101314 /nfs/dbraw/zinc/10/13/14/607101314.db2.gz QXGYRLYZAVKLJG-UHFFFAOYSA-N -1 3 368.485 3.510 20 0 FHADHM CCC1CCC(N(C(=O)NCc2cccc(-c3nn[n-]n3)c2)C2CC2)CC1 ZINC000820972698 607101315 /nfs/dbraw/zinc/10/13/15/607101315.db2.gz QXGYRLYZAVKLJG-UHFFFAOYSA-N -1 3 368.485 3.510 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cccc2ccccc21 ZINC000821305096 607102257 /nfs/dbraw/zinc/10/22/57/607102257.db2.gz WTFAUOIOTSGLEV-UHFFFAOYSA-N -1 3 358.405 3.704 20 0 FHADHM CCCC1(CNC(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)CC(C)C)CC1 ZINC000821035003 607124950 /nfs/dbraw/zinc/12/49/50/607124950.db2.gz YHOQYDXWBUUVPL-UHFFFAOYSA-N -1 3 370.501 3.615 20 0 FHADHM CCCC1(CNC(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)CC(C)C)CC1 ZINC000821035003 607124951 /nfs/dbraw/zinc/12/49/51/607124951.db2.gz YHOQYDXWBUUVPL-UHFFFAOYSA-N -1 3 370.501 3.615 20 0 FHADHM CC(C)c1ccccc1NC(=O)CNc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820197781 607125786 /nfs/dbraw/zinc/12/57/86/607125786.db2.gz NQBLRCYMNFUMNS-UHFFFAOYSA-N -1 3 370.844 3.694 20 0 FHADHM FC(F)(F)c1ccc2oc(COc3ccccc3-c3nnn[n-]3)nc2c1 ZINC000822728943 607150288 /nfs/dbraw/zinc/15/02/88/607150288.db2.gz NPGSYFATFNFDOQ-UHFFFAOYSA-N -1 3 361.283 3.606 20 0 FHADHM FC(F)(F)c1ccc2oc(COc3ccccc3-c3nn[n-]n3)nc2c1 ZINC000822728943 607150290 /nfs/dbraw/zinc/15/02/90/607150290.db2.gz NPGSYFATFNFDOQ-UHFFFAOYSA-N -1 3 361.283 3.606 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nnn[n-]2)c1)c1ccc2sccc2c1 ZINC000823333050 607153012 /nfs/dbraw/zinc/15/30/12/607153012.db2.gz XLLDZTNXTHCDEN-UHFFFAOYSA-N -1 3 355.810 3.987 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nn[n-]n2)c1)c1ccc2sccc2c1 ZINC000823333050 607153014 /nfs/dbraw/zinc/15/30/14/607153014.db2.gz XLLDZTNXTHCDEN-UHFFFAOYSA-N -1 3 355.810 3.987 20 0 FHADHM CC(C)[C@@H](Sc1ccc(-c2nnn[n-]2)cc1)C(=O)Nc1ccccc1F ZINC000820031205 607162043 /nfs/dbraw/zinc/16/20/43/607162043.db2.gz BNWLUBVTYCIAGP-MRXNPFEDSA-N -1 3 371.441 3.761 20 0 FHADHM CC(C)[C@@H](Sc1ccc(-c2nn[n-]n2)cc1)C(=O)Nc1ccccc1F ZINC000820031205 607162044 /nfs/dbraw/zinc/16/20/44/607162044.db2.gz BNWLUBVTYCIAGP-MRXNPFEDSA-N -1 3 371.441 3.761 20 0 FHADHM CCC[C@H](C)[C@@H]1CCCN1C(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000821015141 607164634 /nfs/dbraw/zinc/16/46/34/607164634.db2.gz OHLZURWCIIAFEG-YOEHRIQHSA-N -1 3 373.526 3.527 20 0 FHADHM CCC[C@H](C)[C@@H]1CCCN1C(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000821015141 607164635 /nfs/dbraw/zinc/16/46/35/607164635.db2.gz OHLZURWCIIAFEG-YOEHRIQHSA-N -1 3 373.526 3.527 20 0 FHADHM Cc1cc(-c2noc(CSc3cccc(-c4nnn[n-]4)c3)n2)ccc1F ZINC000822152178 607169889 /nfs/dbraw/zinc/16/98/89/607169889.db2.gz GOQTXDSHAHCHNL-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM Cc1cc(-c2noc(CSc3cccc(-c4nn[n-]n4)c3)n2)ccc1F ZINC000822152178 607169890 /nfs/dbraw/zinc/16/98/90/607169890.db2.gz GOQTXDSHAHCHNL-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)c1cc2cccc(F)c2o1 ZINC000823318906 607191208 /nfs/dbraw/zinc/19/12/08/607191208.db2.gz NPEYDEKGFGZUNA-UHFFFAOYSA-N -1 3 357.732 3.658 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)c1cc2cccc(F)c2o1 ZINC000823318906 607191209 /nfs/dbraw/zinc/19/12/09/607191209.db2.gz NPEYDEKGFGZUNA-UHFFFAOYSA-N -1 3 357.732 3.658 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)[C@@H]1C[C@@H]1c1cccc(Cl)c1 ZINC000823314983 607191223 /nfs/dbraw/zinc/19/12/23/607191223.db2.gz VYUMGQXXSGJEIW-CHWSQXEVSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)[C@@H]1C[C@@H]1c1cccc(Cl)c1 ZINC000823314983 607191224 /nfs/dbraw/zinc/19/12/24/607191224.db2.gz VYUMGQXXSGJEIW-CHWSQXEVSA-N -1 3 374.231 3.916 20 0 FHADHM C[C@@H](CCc1ccccc1)NC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820252560 607195374 /nfs/dbraw/zinc/19/53/74/607195374.db2.gz BSUATXGFVYYSOB-LBPRGKRZSA-N -1 3 370.844 3.663 20 0 FHADHM C[C@@H](CCc1ccccc1)NC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820252560 607195375 /nfs/dbraw/zinc/19/53/75/607195375.db2.gz BSUATXGFVYYSOB-LBPRGKRZSA-N -1 3 370.844 3.663 20 0 FHADHM C[C@H](c1ccc(F)cc1)N(C)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820563620 607195579 /nfs/dbraw/zinc/19/55/79/607195579.db2.gz SFNNMDRGBIGCPL-SNVBAGLBSA-N -1 3 374.807 3.884 20 0 FHADHM C[C@H](c1ccc(F)cc1)N(C)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820563620 607195580 /nfs/dbraw/zinc/19/55/80/607195580.db2.gz SFNNMDRGBIGCPL-SNVBAGLBSA-N -1 3 374.807 3.884 20 0 FHADHM CCN(Cc1cccs1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000821230382 607195857 /nfs/dbraw/zinc/19/58/57/607195857.db2.gz JFWODIAOYQMGQN-UHFFFAOYSA-N -1 3 362.846 3.636 20 0 FHADHM CCN(Cc1cccs1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000821230382 607195858 /nfs/dbraw/zinc/19/58/58/607195858.db2.gz JFWODIAOYQMGQN-UHFFFAOYSA-N -1 3 362.846 3.636 20 0 FHADHM CCC[C@H](C)[C@H]1CCCN1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000821015623 607197256 /nfs/dbraw/zinc/19/72/56/607197256.db2.gz RMUHDGVVZMZCJK-XHDPSFHLSA-N -1 3 362.865 3.953 20 0 FHADHM CCC[C@H](C)[C@H]1CCCN1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000821015623 607197257 /nfs/dbraw/zinc/19/72/57/607197257.db2.gz RMUHDGVVZMZCJK-XHDPSFHLSA-N -1 3 362.865 3.953 20 0 FHADHM CC(C)C[C@H]1CCCCN1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820063499 607197990 /nfs/dbraw/zinc/19/79/90/607197990.db2.gz VANHZFPUVAICIT-CYBMUJFWSA-N -1 3 362.865 3.953 20 0 FHADHM CC(C)C[C@H]1CCCCN1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820063499 607197991 /nfs/dbraw/zinc/19/79/91/607197991.db2.gz VANHZFPUVAICIT-CYBMUJFWSA-N -1 3 362.865 3.953 20 0 FHADHM C[C@@H]1c2ccsc2CCN1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820826089 607199921 /nfs/dbraw/zinc/19/99/21/607199921.db2.gz IZLBWBXWLBMCHM-SECBINFHSA-N -1 3 374.857 3.733 20 0 FHADHM C[C@@H]1c2ccsc2CCN1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820826089 607199922 /nfs/dbraw/zinc/19/99/22/607199922.db2.gz IZLBWBXWLBMCHM-SECBINFHSA-N -1 3 374.857 3.733 20 0 FHADHM C[C@H]1c2ccccc2CN1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000820826030 607201385 /nfs/dbraw/zinc/20/13/85/607201385.db2.gz INGAPLCTYIKFHR-JTQLQIEISA-N -1 3 354.801 3.629 20 0 FHADHM C[C@H]1c2ccccc2CN1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000820826030 607201386 /nfs/dbraw/zinc/20/13/86/607201386.db2.gz INGAPLCTYIKFHR-JTQLQIEISA-N -1 3 354.801 3.629 20 0 FHADHM CN(C(=O)Cc1ccc(C(C)(C)C)cc1)c1ccc(-c2nnn[n-]2)cc1F ZINC000821571065 607238394 /nfs/dbraw/zinc/23/83/94/607238394.db2.gz YJWUMQFSKYSNNR-UHFFFAOYSA-N -1 3 367.428 3.509 20 0 FHADHM CN(C(=O)Cc1ccc(C(C)(C)C)cc1)c1ccc(-c2nn[n-]n2)cc1F ZINC000821571065 607238395 /nfs/dbraw/zinc/23/83/95/607238395.db2.gz YJWUMQFSKYSNNR-UHFFFAOYSA-N -1 3 367.428 3.509 20 0 FHADHM CC(C)COc1ccc(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000820102744 607241290 /nfs/dbraw/zinc/24/12/90/607241290.db2.gz IXYWWJKSYAHJRI-UHFFFAOYSA-N -1 3 371.828 3.807 20 0 FHADHM CC(C)COc1ccc(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000820102744 607241291 /nfs/dbraw/zinc/24/12/91/607241291.db2.gz IXYWWJKSYAHJRI-UHFFFAOYSA-N -1 3 371.828 3.807 20 0 FHADHM O=C(C[C@H]1CCc2ccccc21)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822945513 607241675 /nfs/dbraw/zinc/24/16/75/607241675.db2.gz IJAATGQYWROXMT-GFCCVEGCSA-N -1 3 353.813 3.579 20 0 FHADHM O=C(C[C@H]1CCc2ccccc21)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822945513 607241676 /nfs/dbraw/zinc/24/16/76/607241676.db2.gz IJAATGQYWROXMT-GFCCVEGCSA-N -1 3 353.813 3.579 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)c1cccc(-n2cccc2)c1 ZINC000823319420 607243124 /nfs/dbraw/zinc/24/31/24/607243124.db2.gz VCNXUNHDNXHHKG-UHFFFAOYSA-N -1 3 364.796 3.563 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)c1cccc(-n2cccc2)c1 ZINC000823319420 607243125 /nfs/dbraw/zinc/24/31/25/607243125.db2.gz VCNXUNHDNXHHKG-UHFFFAOYSA-N -1 3 364.796 3.563 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)c1c(F)cccc1Cl ZINC000823319613 607243298 /nfs/dbraw/zinc/24/32/98/607243298.db2.gz VXWSIACPMTUZOS-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)c1c(F)cccc1Cl ZINC000823319613 607243299 /nfs/dbraw/zinc/24/32/99/607243299.db2.gz VXWSIACPMTUZOS-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM Cc1nc(C2CCCC2)sc1C(=O)Oc1ccc(-c2nnn[n-]2)cc1F ZINC000822431584 607250351 /nfs/dbraw/zinc/25/03/51/607250351.db2.gz AYYWNOORRWOYIR-UHFFFAOYSA-N -1 3 373.413 3.648 20 0 FHADHM Cc1nc(C2CCCC2)sc1C(=O)Oc1ccc(-c2nn[n-]n2)cc1F ZINC000822431584 607250352 /nfs/dbraw/zinc/25/03/52/607250352.db2.gz AYYWNOORRWOYIR-UHFFFAOYSA-N -1 3 373.413 3.648 20 0 FHADHM CCN(C(=O)CSc1ccc(Cl)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000825376903 607797307 /nfs/dbraw/zinc/79/73/07/607797307.db2.gz PSPZEPWGFPWEEP-UHFFFAOYSA-N -1 3 373.869 3.665 20 0 FHADHM CCN(C(=O)CSc1ccc(Cl)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000825376903 607797308 /nfs/dbraw/zinc/79/73/08/607797308.db2.gz PSPZEPWGFPWEEP-UHFFFAOYSA-N -1 3 373.869 3.665 20 0 FHADHM CCN(C(=O)[C@@H]1C[C@]12CCCc1ccccc12)c1ccc(-c2nnn[n-]2)cc1 ZINC000825367363 607799914 /nfs/dbraw/zinc/79/99/14/607799914.db2.gz OEHZDUMEAAGOMG-UGKGYDQZSA-N -1 3 373.460 3.514 20 0 FHADHM CCN(C(=O)[C@@H]1C[C@]12CCCc1ccccc12)c1ccc(-c2nn[n-]n2)cc1 ZINC000825367363 607799915 /nfs/dbraw/zinc/79/99/15/607799915.db2.gz OEHZDUMEAAGOMG-UGKGYDQZSA-N -1 3 373.460 3.514 20 0 FHADHM C[C@@H](NC(=O)CCC(C)(C)c1ccccc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824480474 607815824 /nfs/dbraw/zinc/81/58/24/607815824.db2.gz WNVCIDWKZJDCLF-OAHLLOKOSA-N -1 3 363.465 3.802 20 0 FHADHM C[C@@H](NC(=O)CCC(C)(C)c1ccccc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824480474 607815825 /nfs/dbraw/zinc/81/58/25/607815825.db2.gz WNVCIDWKZJDCLF-OAHLLOKOSA-N -1 3 363.465 3.802 20 0 FHADHM COc1ccc2cccc(CC(=O)Nc3cc(-c4nnn[n-]4)ccc3C)c2c1 ZINC000826213442 607818017 /nfs/dbraw/zinc/81/80/17/607818017.db2.gz WZHIQVIEFXIICO-UHFFFAOYSA-N -1 3 373.416 3.518 20 0 FHADHM COc1ccc2cccc(CC(=O)Nc3cc(-c4nn[n-]n4)ccc3C)c2c1 ZINC000826213442 607818018 /nfs/dbraw/zinc/81/80/18/607818018.db2.gz WZHIQVIEFXIICO-UHFFFAOYSA-N -1 3 373.416 3.518 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@@H](C)Cc1ccccc1Cl ZINC000826277432 607818088 /nfs/dbraw/zinc/81/80/88/607818088.db2.gz UPGHJXLJENKSQH-LBPRGKRZSA-N -1 3 355.829 3.646 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@@H](C)Cc1ccccc1Cl ZINC000826277432 607818089 /nfs/dbraw/zinc/81/80/89/607818089.db2.gz UPGHJXLJENKSQH-LBPRGKRZSA-N -1 3 355.829 3.646 20 0 FHADHM CC(C)(C)SCCCC(=O)Nc1sc2c(c1-c1nnn[n-]1)CCC2 ZINC000824124571 607826337 /nfs/dbraw/zinc/82/63/37/607826337.db2.gz VVJVVFWWUXLKEL-UHFFFAOYSA-N -1 3 365.528 3.667 20 0 FHADHM CC(C)(C)SCCCC(=O)Nc1sc2c(c1-c1nn[n-]n1)CCC2 ZINC000824124571 607826338 /nfs/dbraw/zinc/82/63/38/607826338.db2.gz VVJVVFWWUXLKEL-UHFFFAOYSA-N -1 3 365.528 3.667 20 0 FHADHM O=C(Nc1cccc(F)c1)c1c(Cl)cc(-c2nnn[n-]2)cc1Cl ZINC000826456554 607832766 /nfs/dbraw/zinc/83/27/66/607832766.db2.gz LDRLIHDEHNQSFL-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1cccc(F)c1)c1c(Cl)cc(-c2nn[n-]n2)cc1Cl ZINC000826456554 607832767 /nfs/dbraw/zinc/83/27/67/607832767.db2.gz LDRLIHDEHNQSFL-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM CCN(C(=O)CCCCCCC(C)=O)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825371382 607833999 /nfs/dbraw/zinc/83/39/99/607833999.db2.gz FYDQNQKXXUJVJT-INIZCTEOSA-N -1 3 371.485 3.706 20 0 FHADHM CCN(C(=O)CCCCCCC(C)=O)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825371382 607834000 /nfs/dbraw/zinc/83/40/00/607834000.db2.gz FYDQNQKXXUJVJT-INIZCTEOSA-N -1 3 371.485 3.706 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)cc1N1CCC[C@H](C(F)(F)F)C1 ZINC000826368353 607838930 /nfs/dbraw/zinc/83/89/30/607838930.db2.gz MGEDLAYWWSIMJL-VIFPVBQESA-N -1 3 365.281 3.664 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)cc1N1CCC[C@H](C(F)(F)F)C1 ZINC000826368353 607838931 /nfs/dbraw/zinc/83/89/31/607838931.db2.gz MGEDLAYWWSIMJL-VIFPVBQESA-N -1 3 365.281 3.664 20 0 FHADHM Cc1cc(F)ccc1[C@@H](O)CSc1ccc(-c2nnn[n-]2)cc1Cl ZINC000826269031 607843033 /nfs/dbraw/zinc/84/30/33/607843033.db2.gz YCIOCQULUBFXAI-AWEZNQCLSA-N -1 3 364.833 3.793 20 0 FHADHM Cc1cc(F)ccc1[C@@H](O)CSc1ccc(-c2nn[n-]n2)cc1Cl ZINC000826269031 607843034 /nfs/dbraw/zinc/84/30/34/607843034.db2.gz YCIOCQULUBFXAI-AWEZNQCLSA-N -1 3 364.833 3.793 20 0 FHADHM O=C(CCSc1ccc(-c2nnn[n-]2)cc1Cl)Nc1ccccc1 ZINC000826408291 607843107 /nfs/dbraw/zinc/84/31/07/607843107.db2.gz ZQUGMBKYUMLJRM-UHFFFAOYSA-N -1 3 359.842 3.641 20 0 FHADHM O=C(CCSc1ccc(-c2nn[n-]n2)cc1Cl)Nc1ccccc1 ZINC000826408291 607843108 /nfs/dbraw/zinc/84/31/08/607843108.db2.gz ZQUGMBKYUMLJRM-UHFFFAOYSA-N -1 3 359.842 3.641 20 0 FHADHM Cc1c(C(=O)Nc2ccc(F)cc2-c2nnn[n-]2)cccc1-c1ccccn1 ZINC000826234925 607861621 /nfs/dbraw/zinc/86/16/21/607861621.db2.gz UPNWMHDZZFCJGM-UHFFFAOYSA-N -1 3 374.379 3.629 20 0 FHADHM Cc1c(C(=O)Nc2ccc(F)cc2-c2nn[n-]n2)cccc1-c1ccccn1 ZINC000826234925 607861622 /nfs/dbraw/zinc/86/16/22/607861622.db2.gz UPNWMHDZZFCJGM-UHFFFAOYSA-N -1 3 374.379 3.629 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000823943920 607881000 /nfs/dbraw/zinc/88/10/00/607881000.db2.gz VFAOMYIMLWIBSF-HHQWOOOKSA-N -1 3 367.840 3.801 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000823943920 607881001 /nfs/dbraw/zinc/88/10/01/607881001.db2.gz VFAOMYIMLWIBSF-HHQWOOOKSA-N -1 3 367.840 3.801 20 0 FHADHM C[C@H](NC(=O)[C@@H]1CC[C@@H]2CCCC[C@H]2C1)c1cccc(-c2nnn[n-]2)c1 ZINC000824472816 607905825 /nfs/dbraw/zinc/90/58/25/607905825.db2.gz XCEDWERQKMVVFL-ILXVDBEPSA-N -1 3 353.470 3.650 20 0 FHADHM C[C@H](NC(=O)[C@@H]1CC[C@@H]2CCCC[C@H]2C1)c1cccc(-c2nn[n-]n2)c1 ZINC000824472816 607905826 /nfs/dbraw/zinc/90/58/26/607905826.db2.gz XCEDWERQKMVVFL-ILXVDBEPSA-N -1 3 353.470 3.650 20 0 FHADHM Cc1c(NC(=O)[C@@H](c2ccc(F)cc2)C(C)C)cccc1-c1nnn[n-]1 ZINC000826241173 607908701 /nfs/dbraw/zinc/90/87/01/607908701.db2.gz UBDQKSUTLIFDCR-QGZVFWFLSA-N -1 3 353.401 3.693 20 0 FHADHM Cc1c(NC(=O)[C@@H](c2ccc(F)cc2)C(C)C)cccc1-c1nn[n-]n1 ZINC000826241173 607908702 /nfs/dbraw/zinc/90/87/02/607908702.db2.gz UBDQKSUTLIFDCR-QGZVFWFLSA-N -1 3 353.401 3.693 20 0 FHADHM Cc1cccc(Cl)c1NC(=O)CSc1cccc(-c2nnn[n-]2)c1 ZINC000826298303 607932960 /nfs/dbraw/zinc/93/29/60/607932960.db2.gz MYKABDCWRQUQBN-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1cccc(Cl)c1NC(=O)CSc1cccc(-c2nn[n-]n2)c1 ZINC000826298303 607932961 /nfs/dbraw/zinc/93/29/61/607932961.db2.gz MYKABDCWRQUQBN-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM CC[C@@H](C)[C@H](C(=O)N1CCc2ccc(-c3nnn[n-]3)cc21)c1ccccc1 ZINC000825052492 607948639 /nfs/dbraw/zinc/94/86/39/607948639.db2.gz XOBNEZSNXUIAJQ-KUHUBIRLSA-N -1 3 361.449 3.586 20 0 FHADHM CC[C@@H](C)[C@H](C(=O)N1CCc2ccc(-c3nn[n-]n3)cc21)c1ccccc1 ZINC000825052492 607948640 /nfs/dbraw/zinc/94/86/40/607948640.db2.gz XOBNEZSNXUIAJQ-KUHUBIRLSA-N -1 3 361.449 3.586 20 0 FHADHM CCc1nc2sccc2c(N[C@H](C)c2cccc(-c3nnn[n-]3)c2)n1 ZINC000825750257 607965405 /nfs/dbraw/zinc/96/54/05/607965405.db2.gz OEGKLSLWUGPVSP-SNVBAGLBSA-N -1 3 351.439 3.607 20 0 FHADHM CCc1nc2sccc2c(N[C@H](C)c2cccc(-c3nn[n-]n3)c2)n1 ZINC000825750257 607965406 /nfs/dbraw/zinc/96/54/06/607965406.db2.gz OEGKLSLWUGPVSP-SNVBAGLBSA-N -1 3 351.439 3.607 20 0 FHADHM Cc1cnc(Nc2ccc(Oc3ccccc3-c3nnn[n-]3)c(F)c2)nc1 ZINC000826318973 607965789 /nfs/dbraw/zinc/96/57/89/607965789.db2.gz IXPYJBFBUDVWOU-UHFFFAOYSA-N -1 3 363.356 3.640 20 0 FHADHM Cc1cnc(Nc2ccc(Oc3ccccc3-c3nn[n-]n3)c(F)c2)nc1 ZINC000826318973 607965790 /nfs/dbraw/zinc/96/57/90/607965790.db2.gz IXPYJBFBUDVWOU-UHFFFAOYSA-N -1 3 363.356 3.640 20 0 FHADHM FC(F)(F)c1ccc(-c2nnn[n-]2)c(N2CCCC23CCCCC3)n1 ZINC000826368235 607969961 /nfs/dbraw/zinc/96/99/61/607969961.db2.gz IFFGNNOEDUPCBO-UHFFFAOYSA-N -1 3 352.364 3.584 20 0 FHADHM FC(F)(F)c1ccc(-c2nn[n-]n2)c(N2CCCC23CCCCC3)n1 ZINC000826368235 607969962 /nfs/dbraw/zinc/96/99/62/607969962.db2.gz IFFGNNOEDUPCBO-UHFFFAOYSA-N -1 3 352.364 3.584 20 0 FHADHM CCCn1c2ccc(-c3nnn[n-]3)cc2nc1-c1ccnc2ccccc21 ZINC000825352890 607975093 /nfs/dbraw/zinc/97/50/93/607975093.db2.gz RKRPKEKKSRUCKO-UHFFFAOYSA-N -1 3 355.405 3.842 20 0 FHADHM CCCn1c2ccc(-c3nn[n-]n3)cc2nc1-c1ccnc2ccccc21 ZINC000825352890 607975094 /nfs/dbraw/zinc/97/50/94/607975094.db2.gz RKRPKEKKSRUCKO-UHFFFAOYSA-N -1 3 355.405 3.842 20 0 FHADHM CCn1c2ccc(-c3nnn[n-]3)cc2nc1-c1cccc(OC(F)F)c1 ZINC000825782677 607975145 /nfs/dbraw/zinc/97/51/45/607975145.db2.gz LGTMGSJXEQCPQD-UHFFFAOYSA-N -1 3 356.336 3.505 20 0 FHADHM CCn1c2ccc(-c3nn[n-]n3)cc2nc1-c1cccc(OC(F)F)c1 ZINC000825782677 607975146 /nfs/dbraw/zinc/97/51/46/607975146.db2.gz LGTMGSJXEQCPQD-UHFFFAOYSA-N -1 3 356.336 3.505 20 0 FHADHM CC(C)c1ccc([C@@H]2CCCN2C(=O)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000824347559 608008305 /nfs/dbraw/zinc/00/83/05/608008305.db2.gz DGFAPHRYGZGITO-IBGZPJMESA-N -1 3 361.449 3.967 20 0 FHADHM CC(C)c1ccc([C@@H]2CCCN2C(=O)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000824347559 608008306 /nfs/dbraw/zinc/00/83/06/608008306.db2.gz DGFAPHRYGZGITO-IBGZPJMESA-N -1 3 361.449 3.967 20 0 FHADHM COCCCCNc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1 ZINC000826155819 608019168 /nfs/dbraw/zinc/01/91/68/608019168.db2.gz DAUSQJKWSREOHC-UHFFFAOYSA-N -1 3 357.389 3.637 20 0 FHADHM COCCCCNc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1 ZINC000826155819 608019169 /nfs/dbraw/zinc/01/91/69/608019169.db2.gz DAUSQJKWSREOHC-UHFFFAOYSA-N -1 3 357.389 3.637 20 0 FHADHM Cc1ccc([C@@H]2CCCN2c2ccc(-c3nn[n-]n3)cc2Br)o1 ZINC000826285793 608050139 /nfs/dbraw/zinc/05/01/39/608050139.db2.gz JWIINKVSHYRRCP-AWEZNQCLSA-N -1 3 374.242 3.872 20 0 FHADHM Cc1c(Br)cccc1CSc1ccc(-c2nnn[n-]2)cn1 ZINC000826234410 608054834 /nfs/dbraw/zinc/05/48/34/608054834.db2.gz VEHVDEFXKLMGDX-UHFFFAOYSA-N -1 3 362.256 3.625 20 0 FHADHM Cc1c(Br)cccc1CSc1ccc(-c2nn[n-]n2)cn1 ZINC000826234410 608054835 /nfs/dbraw/zinc/05/48/35/608054835.db2.gz VEHVDEFXKLMGDX-UHFFFAOYSA-N -1 3 362.256 3.625 20 0 FHADHM C[C@H](c1ccccc1Cl)N1CCO[C@@H](c2cccc(-c3nnn[n-]3)c2)C1 ZINC000824772607 608066211 /nfs/dbraw/zinc/06/62/11/608066211.db2.gz VRNKGADFIMEQGL-FZKQIMNGSA-N -1 3 369.856 3.655 20 0 FHADHM C[C@H](c1ccccc1Cl)N1CCO[C@@H](c2cccc(-c3nn[n-]n3)c2)C1 ZINC000824772607 608066212 /nfs/dbraw/zinc/06/62/12/608066212.db2.gz VRNKGADFIMEQGL-FZKQIMNGSA-N -1 3 369.856 3.655 20 0 FHADHM CC(C)Oc1c(F)cc(NCc2cc(-c3nnn[n-]3)cs2)cc1F ZINC000824315171 608134236 /nfs/dbraw/zinc/13/42/36/608134236.db2.gz MEVFAIYASRETES-UHFFFAOYSA-N -1 3 351.382 3.606 20 0 FHADHM CC(C)Oc1c(F)cc(NCc2cc(-c3nn[n-]n3)cs2)cc1F ZINC000824315171 608134237 /nfs/dbraw/zinc/13/42/37/608134237.db2.gz MEVFAIYASRETES-UHFFFAOYSA-N -1 3 351.382 3.606 20 0 FHADHM C[C@@H]1CCc2c(sc(NC(=O)CCCC(F)(F)F)c2-c2nnn[n-]2)C1 ZINC000824966298 608148407 /nfs/dbraw/zinc/14/84/07/608148407.db2.gz AGVPOIPARLVOBY-MRVPVSSYSA-N -1 3 373.404 3.724 20 0 FHADHM C[C@@H]1CCc2c(sc(NC(=O)CCCC(F)(F)F)c2-c2nn[n-]n2)C1 ZINC000824966298 608148408 /nfs/dbraw/zinc/14/84/08/608148408.db2.gz AGVPOIPARLVOBY-MRVPVSSYSA-N -1 3 373.404 3.724 20 0 FHADHM CC(C)(C)[C@H]1C[C@@H](Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)CCO1 ZINC000824079367 608149783 /nfs/dbraw/zinc/14/97/83/608149783.db2.gz PAAHGNSLYAXXIH-SMDDNHRTSA-N -1 3 369.391 3.891 20 0 FHADHM CC(C)(C)[C@H]1C[C@@H](Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)CCO1 ZINC000824079367 608149785 /nfs/dbraw/zinc/14/97/85/608149785.db2.gz PAAHGNSLYAXXIH-SMDDNHRTSA-N -1 3 369.391 3.891 20 0 FHADHM Cc1cccc(C2=CCN(C(=O)C=Cc3ccccc3-c3nnn[n-]3)CC2)c1 ZINC000826297221 608163406 /nfs/dbraw/zinc/16/34/06/608163406.db2.gz ZEEJFRKLECQDQI-KTKRTIGZSA-N -1 3 371.444 3.504 20 0 FHADHM Cc1cccc(C2=CCN(C(=O)C=Cc3ccccc3-c3nn[n-]n3)CC2)c1 ZINC000826297221 608163408 /nfs/dbraw/zinc/16/34/08/608163408.db2.gz ZEEJFRKLECQDQI-KTKRTIGZSA-N -1 3 371.444 3.504 20 0 FHADHM Clc1nsc(Sc2nc3cc(Cl)ccc3[nH]2)c1-c1nnn[n-]1 ZINC000826353023 608170765 /nfs/dbraw/zinc/17/07/65/608170765.db2.gz YBUQAZRBMKFVNU-UHFFFAOYSA-N -1 3 370.250 3.658 20 0 FHADHM C[C@H](OC(=O)[C@H]1CCSc2ccccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000824715937 608182075 /nfs/dbraw/zinc/18/20/75/608182075.db2.gz VKZBINLGAZPESJ-LRDDRELGSA-N -1 3 366.446 3.751 20 0 FHADHM C[C@H](OC(=O)[C@H]1CCSc2ccccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000824715937 608182076 /nfs/dbraw/zinc/18/20/76/608182076.db2.gz VKZBINLGAZPESJ-LRDDRELGSA-N -1 3 366.446 3.751 20 0 FHADHM Cc1ccccc1C(C)(C)C(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000826306222 608184108 /nfs/dbraw/zinc/18/41/08/608184108.db2.gz SUXVQZLRCKZDAM-AWEZNQCLSA-N -1 3 350.422 3.757 20 0 FHADHM Cc1ccccc1C(C)(C)C(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000826306222 608184110 /nfs/dbraw/zinc/18/41/10/608184110.db2.gz SUXVQZLRCKZDAM-AWEZNQCLSA-N -1 3 350.422 3.757 20 0 FHADHM CC[C@H](Oc1ccccc1C)C(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000825159130 608184348 /nfs/dbraw/zinc/18/43/48/608184348.db2.gz JLNWHLLMCABLGU-YOEHRIQHSA-N -1 3 366.421 3.637 20 0 FHADHM CC[C@H](Oc1ccccc1C)C(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000825159130 608184351 /nfs/dbraw/zinc/18/43/51/608184351.db2.gz JLNWHLLMCABLGU-YOEHRIQHSA-N -1 3 366.421 3.637 20 0 FHADHM Cc1cc(C)cc(NC(=O)CSc2cccc(Cl)c2-c2nnn[n-]2)c1 ZINC000826264698 608206437 /nfs/dbraw/zinc/20/64/37/608206437.db2.gz XFHOHKCRAMMIMS-UHFFFAOYSA-N -1 3 373.869 3.868 20 0 FHADHM Cc1cc(C)cc(NC(=O)CSc2cccc(Cl)c2-c2nn[n-]n2)c1 ZINC000826264698 608206438 /nfs/dbraw/zinc/20/64/38/608206438.db2.gz XFHOHKCRAMMIMS-UHFFFAOYSA-N -1 3 373.869 3.868 20 0 FHADHM Cc1ccc(C(=O)CSc2cccc(Cl)c2-c2nnn[n-]2)s1 ZINC000826281244 608207876 /nfs/dbraw/zinc/20/78/76/608207876.db2.gz KRZDZNSYDXGEDF-UHFFFAOYSA-N -1 3 350.856 3.865 20 0 FHADHM Cc1ccc(C(=O)CSc2cccc(Cl)c2-c2nn[n-]n2)s1 ZINC000826281244 608207881 /nfs/dbraw/zinc/20/78/81/608207881.db2.gz KRZDZNSYDXGEDF-UHFFFAOYSA-N -1 3 350.856 3.865 20 0 FHADHM O=C(C=Cc1ccc2[nH]ccc2c1)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000826400740 608229842 /nfs/dbraw/zinc/22/98/42/608229842.db2.gz GUHZOJZFNXOGAG-KXFIGUGUSA-N -1 3 364.796 3.653 20 0 FHADHM O=C(C=Cc1ccc2[nH]ccc2c1)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000826400740 608229843 /nfs/dbraw/zinc/22/98/43/608229843.db2.gz GUHZOJZFNXOGAG-KXFIGUGUSA-N -1 3 364.796 3.653 20 0 FHADHM CCN(C(=O)c1ccc(Cl)c(F)c1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825385506 608236193 /nfs/dbraw/zinc/23/61/93/608236193.db2.gz IIMFENFOFLKBGH-LLVKDONJSA-N -1 3 373.819 3.883 20 0 FHADHM CCN(C(=O)c1ccc(Cl)c(F)c1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825385506 608236195 /nfs/dbraw/zinc/23/61/95/608236195.db2.gz IIMFENFOFLKBGH-LLVKDONJSA-N -1 3 373.819 3.883 20 0 FHADHM COc1ccc([C@H](OC)[C@H](C)Nc2ccc(Cl)cc2-c2nnn[n-]2)cc1 ZINC000826190083 608239628 /nfs/dbraw/zinc/23/96/28/608239628.db2.gz PIJHJWBPXCQINY-APPDUMDISA-N -1 3 373.844 3.717 20 0 FHADHM COc1ccc([C@H](OC)[C@H](C)Nc2ccc(Cl)cc2-c2nn[n-]n2)cc1 ZINC000826190083 608239629 /nfs/dbraw/zinc/23/96/29/608239629.db2.gz PIJHJWBPXCQINY-APPDUMDISA-N -1 3 373.844 3.717 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccc2[nH]ccc2c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824712820 608246804 /nfs/dbraw/zinc/24/68/04/608246804.db2.gz DEFXHKAIKRJUAA-CFNZNRNTSA-N -1 3 359.389 3.666 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccc2[nH]ccc2c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824712820 608246805 /nfs/dbraw/zinc/24/68/05/608246805.db2.gz DEFXHKAIKRJUAA-CFNZNRNTSA-N -1 3 359.389 3.666 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccc2[nH]ccc2c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824716575 608247625 /nfs/dbraw/zinc/24/76/25/608247625.db2.gz YGMWBTUSMJAHCP-YMSVAJCUSA-N -1 3 359.389 3.666 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccc2[nH]ccc2c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824716575 608247627 /nfs/dbraw/zinc/24/76/27/608247627.db2.gz YGMWBTUSMJAHCP-YMSVAJCUSA-N -1 3 359.389 3.666 20 0 FHADHM C[C@@H]1CCC[C@H](OCCCCCC(=O)Nc2ccc(-c3nnn[n-]3)cc2)C1 ZINC000162236294 608262169 /nfs/dbraw/zinc/26/21/69/608262169.db2.gz OVXUIMXTLYDIRZ-QAPCUYQASA-N -1 3 371.485 3.961 20 0 FHADHM C[C@@H]1CCC[C@H](OCCCCCC(=O)Nc2ccc(-c3nn[n-]n3)cc2)C1 ZINC000162236294 608262171 /nfs/dbraw/zinc/26/21/71/608262171.db2.gz OVXUIMXTLYDIRZ-QAPCUYQASA-N -1 3 371.485 3.961 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CSc1nc(C)c(C)n1CC(C)C ZINC000826173880 608263196 /nfs/dbraw/zinc/26/31/96/608263196.db2.gz ZECXSNMEPZVZFY-UHFFFAOYSA-N -1 3 372.498 3.637 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CSc1nc(C)c(C)n1CC(C)C ZINC000826173880 608263198 /nfs/dbraw/zinc/26/31/98/608263198.db2.gz ZECXSNMEPZVZFY-UHFFFAOYSA-N -1 3 372.498 3.637 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccc(Cl)c(F)c1 ZINC000826452305 608266192 /nfs/dbraw/zinc/26/61/92/608266192.db2.gz OIKAMACDJRCWCZ-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccc(Cl)c(F)c1 ZINC000826452305 608266194 /nfs/dbraw/zinc/26/61/94/608266194.db2.gz OIKAMACDJRCWCZ-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1c(F)ccc(C)c1F ZINC000825318980 608269356 /nfs/dbraw/zinc/26/93/56/608269356.db2.gz VDHHFNFFLAJOOT-UHFFFAOYSA-N -1 3 371.391 3.506 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1c(F)ccc(C)c1F ZINC000825318980 608269357 /nfs/dbraw/zinc/26/93/57/608269357.db2.gz VDHHFNFFLAJOOT-UHFFFAOYSA-N -1 3 371.391 3.506 20 0 FHADHM Cc1ccc(F)c(C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)c1F ZINC000826289021 608269618 /nfs/dbraw/zinc/26/96/18/608269618.db2.gz HBMQYTVLUFXFMB-UHFFFAOYSA-N -1 3 371.391 3.504 20 0 FHADHM Cc1ccc(F)c(C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)c1F ZINC000826289021 608269619 /nfs/dbraw/zinc/26/96/19/608269619.db2.gz HBMQYTVLUFXFMB-UHFFFAOYSA-N -1 3 371.391 3.504 20 0 FHADHM O=C(Nc1ccc(C2CC2)cc1)N(Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000826453426 608273329 /nfs/dbraw/zinc/27/33/29/608273329.db2.gz KFNKNBPJMQWOQB-UHFFFAOYSA-N -1 3 374.448 3.941 20 0 FHADHM O=C(Nc1ccc(C2CC2)cc1)N(Cc1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000826453426 608273330 /nfs/dbraw/zinc/27/33/30/608273330.db2.gz KFNKNBPJMQWOQB-UHFFFAOYSA-N -1 3 374.448 3.941 20 0 FHADHM Cc1nc(-c2ccccc2)sc1CNc1nc(C)ccc1-c1nnn[n-]1 ZINC000826277456 608282232 /nfs/dbraw/zinc/28/22/32/608282232.db2.gz VKSDMIHEWBZUMC-UHFFFAOYSA-N -1 3 363.450 3.614 20 0 FHADHM Cc1nc(-c2ccccc2)sc1CNc1nc(C)ccc1-c1nn[n-]n1 ZINC000826277456 608282234 /nfs/dbraw/zinc/28/22/34/608282234.db2.gz VKSDMIHEWBZUMC-UHFFFAOYSA-N -1 3 363.450 3.614 20 0 FHADHM COc1ccc(Cl)cc1[C@@H](C)NCc1cc(-c2nn[n-]n2)ccc1F ZINC000826208489 608284662 /nfs/dbraw/zinc/28/46/62/608284662.db2.gz MYYXCIJGWQRREN-SNVBAGLBSA-N -1 3 361.808 3.519 20 0 FHADHM C[C@@H](Nc1cc(-c2nnn[n-]2)c2ccccc2n1)c1cccc(F)c1F ZINC000824651442 608304554 /nfs/dbraw/zinc/30/45/54/608304554.db2.gz ZTBDNJGIAFPMQP-SNVBAGLBSA-N -1 3 352.348 3.866 20 0 FHADHM C[C@@H](Nc1cc(-c2nn[n-]n2)c2ccccc2n1)c1cccc(F)c1F ZINC000824651442 608304556 /nfs/dbraw/zinc/30/45/56/608304556.db2.gz ZTBDNJGIAFPMQP-SNVBAGLBSA-N -1 3 352.348 3.866 20 0 FHADHM CCOc1cc(Cl)ccc1NCc1ccc(-c2nnn[n-]2)cc1OC ZINC000825615677 608320269 /nfs/dbraw/zinc/32/02/69/608320269.db2.gz GLULFPIYSOEFDO-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM CCOc1cc(Cl)ccc1NCc1ccc(-c2nn[n-]n2)cc1OC ZINC000825615677 608320271 /nfs/dbraw/zinc/32/02/71/608320271.db2.gz GLULFPIYSOEFDO-UHFFFAOYSA-N -1 3 359.817 3.540 20 0 FHADHM CCCCOc1ccccc1NCc1ccc(-c2nnn[n-]2)cc1OC ZINC000825296900 608320427 /nfs/dbraw/zinc/32/04/27/608320427.db2.gz ZOMDVCLSJHETLL-UHFFFAOYSA-N -1 3 353.426 3.666 20 0 FHADHM CCCCOc1ccccc1NCc1ccc(-c2nn[n-]n2)cc1OC ZINC000825296900 608320428 /nfs/dbraw/zinc/32/04/28/608320428.db2.gz ZOMDVCLSJHETLL-UHFFFAOYSA-N -1 3 353.426 3.666 20 0 FHADHM CCN(C(=O)[C@H](C)c1cccc(F)c1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825361545 608346857 /nfs/dbraw/zinc/34/68/57/608346857.db2.gz DXXXRLHXTDPGOA-LLVKDONJSA-N -1 3 373.819 3.816 20 0 FHADHM CCN(C(=O)[C@H](C)c1cccc(F)c1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825361545 608346859 /nfs/dbraw/zinc/34/68/59/608346859.db2.gz DXXXRLHXTDPGOA-LLVKDONJSA-N -1 3 373.819 3.816 20 0 FHADHM CCC(C)(C)NC(=O)NCc1ccc(-c2ccccc2-c2nnn[n-]2)cc1 ZINC000825044938 608358635 /nfs/dbraw/zinc/35/86/35/608358635.db2.gz WDYUDAGVTUCEEG-UHFFFAOYSA-N -1 3 364.453 3.522 20 0 FHADHM CCC(C)(C)NC(=O)NCc1ccc(-c2ccccc2-c2nn[n-]n2)cc1 ZINC000825044938 608358636 /nfs/dbraw/zinc/35/86/36/608358636.db2.gz WDYUDAGVTUCEEG-UHFFFAOYSA-N -1 3 364.453 3.522 20 0 FHADHM C[C@H](NCc1ncc(-c2cccc(F)c2)o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824634248 608459463 /nfs/dbraw/zinc/45/94/63/608459463.db2.gz UIIAYDCEFXCGQH-LBPRGKRZSA-N -1 3 364.384 3.512 20 0 FHADHM C[C@H](NCc1ncc(-c2cccc(F)c2)o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824634248 608459464 /nfs/dbraw/zinc/45/94/64/608459464.db2.gz UIIAYDCEFXCGQH-LBPRGKRZSA-N -1 3 364.384 3.512 20 0 FHADHM Cc1ccc(C)c(NC(=O)N2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)c1 ZINC000826284967 608469226 /nfs/dbraw/zinc/46/92/26/608469226.db2.gz MBLSCRCTAUWWAM-UHFFFAOYSA-N -1 3 374.448 3.805 20 0 FHADHM Cc1ccc(C)c(NC(=O)N2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)c1 ZINC000826284967 608469228 /nfs/dbraw/zinc/46/92/28/608469228.db2.gz MBLSCRCTAUWWAM-UHFFFAOYSA-N -1 3 374.448 3.805 20 0 FHADHM Fc1ccc(NCc2cccc(-c3nnn[n-]3)c2F)cc1C(F)(F)F ZINC000826375705 608481247 /nfs/dbraw/zinc/48/12/47/608481247.db2.gz YXXRJILZAJOZGI-UHFFFAOYSA-N -1 3 355.270 3.776 20 0 FHADHM Fc1ccc(NCc2cccc(-c3nn[n-]n3)c2F)cc1C(F)(F)F ZINC000826375705 608481249 /nfs/dbraw/zinc/48/12/49/608481249.db2.gz YXXRJILZAJOZGI-UHFFFAOYSA-N -1 3 355.270 3.776 20 0 FHADHM O=C(c1ccccc1)c1cccc(NCc2cccc(-c3nnn[n-]3)c2F)c1 ZINC000826474408 608481382 /nfs/dbraw/zinc/48/13/82/608481382.db2.gz OQVSKHYJULONMC-UHFFFAOYSA-N -1 3 373.391 3.849 20 0 FHADHM O=C(c1ccccc1)c1cccc(NCc2cccc(-c3nn[n-]n3)c2F)c1 ZINC000826474408 608481383 /nfs/dbraw/zinc/48/13/83/608481383.db2.gz OQVSKHYJULONMC-UHFFFAOYSA-N -1 3 373.391 3.849 20 0 FHADHM O=C(c1cc2ccccc2o1)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000826470119 608484431 /nfs/dbraw/zinc/48/44/31/608484431.db2.gz CUQAMXZQWHQLNJ-UHFFFAOYSA-N -1 3 371.400 3.542 20 0 FHADHM O=C(c1cc2ccccc2o1)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000826470119 608484432 /nfs/dbraw/zinc/48/44/32/608484432.db2.gz CUQAMXZQWHQLNJ-UHFFFAOYSA-N -1 3 371.400 3.542 20 0 FHADHM CSc1cccc(NC(=O)N(C)Cc2ccc(-c3nnn[n-]3)cc2)c1C ZINC000826230629 608518028 /nfs/dbraw/zinc/51/80/28/608518028.db2.gz BXILHPGMMFMERF-UHFFFAOYSA-N -1 3 368.466 3.561 20 0 FHADHM CSc1cccc(NC(=O)N(C)Cc2ccc(-c3nn[n-]n3)cc2)c1C ZINC000826230629 608518029 /nfs/dbraw/zinc/51/80/29/608518029.db2.gz BXILHPGMMFMERF-UHFFFAOYSA-N -1 3 368.466 3.561 20 0 FHADHM C[C@H]1C[C@@H]1c1ccc(CN(Cc2ccc(-c3nnn[n-]3)s2)C2CC2)o1 ZINC000824899618 608518564 /nfs/dbraw/zinc/51/85/64/608518564.db2.gz LSYWAFYOQMILFR-NHYWBVRUSA-N -1 3 355.467 3.809 20 0 FHADHM C[C@H]1C[C@@H]1c1ccc(CN(Cc2ccc(-c3nn[n-]n3)s2)C2CC2)o1 ZINC000824899618 608518565 /nfs/dbraw/zinc/51/85/65/608518565.db2.gz LSYWAFYOQMILFR-NHYWBVRUSA-N -1 3 355.467 3.809 20 0 FHADHM CN(Cc1cccc(-c2nn[n-]n2)c1)Cc1cc(C(F)(F)F)ccc1F ZINC000825976755 608525071 /nfs/dbraw/zinc/52/50/71/608525071.db2.gz PCDVCOLWVHOBMQ-UHFFFAOYSA-N -1 3 365.334 3.657 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)c2cccc3ccc(C)nc32)s1 ZINC000825694669 608539646 /nfs/dbraw/zinc/53/96/46/608539646.db2.gz YZNGFAMUSINDOJ-UHFFFAOYSA-N -1 3 364.434 3.600 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)c2cccc3ccc(C)nc32)s1 ZINC000825694669 608539648 /nfs/dbraw/zinc/53/96/48/608539648.db2.gz YZNGFAMUSINDOJ-UHFFFAOYSA-N -1 3 364.434 3.600 20 0 FHADHM CCC[C@@H](NCc1ccc(-c2nn[n-]n2)cc1OC)c1ccc(F)cc1F ZINC000825241981 608553425 /nfs/dbraw/zinc/55/34/25/608553425.db2.gz GAQTWSXZDAXOPC-QGZVFWFLSA-N -1 3 373.407 3.785 20 0 FHADHM FC(F)(F)c1cc(-c2nn[n-]n2)ccc1N1CCC(c2cccnc2)CC1 ZINC000826368513 608554406 /nfs/dbraw/zinc/55/44/06/608554406.db2.gz SANHSFPOMDYJGC-UHFFFAOYSA-N -1 3 374.370 3.665 20 0 FHADHM Fc1ccc([C@H](CC(F)(F)F)NCc2ccc(-c3nnn[n-]3)s2)cc1 ZINC000826373458 608569612 /nfs/dbraw/zinc/56/96/12/608569612.db2.gz MUSKHBZYEIYPJV-LBPRGKRZSA-N -1 3 371.363 3.851 20 0 FHADHM C[C@@H]1CCN(C(=O)c2ccc(Cl)c(-c3nnn[n-]3)c2)c2ccccc21 ZINC000824956995 608574423 /nfs/dbraw/zinc/57/44/23/608574423.db2.gz VLLDPRSOIXPICC-LLVKDONJSA-N -1 3 353.813 3.674 20 0 FHADHM C[C@@H]1CCN(C(=O)c2ccc(Cl)c(-c3nn[n-]n3)c2)c2ccccc21 ZINC000824956995 608574424 /nfs/dbraw/zinc/57/44/24/608574424.db2.gz VLLDPRSOIXPICC-LLVKDONJSA-N -1 3 353.813 3.674 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@H]1CCC(C)(C)C1 ZINC000824255673 608585956 /nfs/dbraw/zinc/58/59/56/608585956.db2.gz SNVMRIYMICKFGD-KRWDZBQOSA-N -1 3 370.501 3.613 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@H]1CCC(C)(C)C1 ZINC000824255673 608585957 /nfs/dbraw/zinc/58/59/57/608585957.db2.gz SNVMRIYMICKFGD-KRWDZBQOSA-N -1 3 370.501 3.613 20 0 FHADHM CCN(Cc1ccc(Cl)s1)Cc1cccc(-c2nnn[n-]2)c1F ZINC000825435372 608642058 /nfs/dbraw/zinc/64/20/58/608642058.db2.gz VUPUEPOXOOHJFE-UHFFFAOYSA-N -1 3 351.838 3.743 20 0 FHADHM CCN(Cc1ccc(Cl)s1)Cc1cccc(-c2nn[n-]n2)c1F ZINC000825435372 608642059 /nfs/dbraw/zinc/64/20/59/608642059.db2.gz VUPUEPOXOOHJFE-UHFFFAOYSA-N -1 3 351.838 3.743 20 0 FHADHM Fc1c(CSc2ccc(C(F)(F)F)cn2)cccc1-c1nnn[n-]1 ZINC000826370597 608669516 /nfs/dbraw/zinc/66/95/16/608669516.db2.gz ABCXUBCUKBNGKH-UHFFFAOYSA-N -1 3 355.320 3.712 20 0 FHADHM Fc1c(CSc2ccc(C(F)(F)F)cn2)cccc1-c1nn[n-]n1 ZINC000826370597 608669517 /nfs/dbraw/zinc/66/95/17/608669517.db2.gz ABCXUBCUKBNGKH-UHFFFAOYSA-N -1 3 355.320 3.712 20 0 FHADHM CCOc1cccc2cc([C@H](C)Nc3cnccc3-c3nnn[n-]3)oc21 ZINC000825653689 608768962 /nfs/dbraw/zinc/76/89/62/608768962.db2.gz IAWBUJMWXDFXEN-NSHDSACASA-N -1 3 350.382 3.580 20 0 FHADHM CCOc1cccc2cc([C@H](C)Nc3cnccc3-c3nn[n-]n3)oc21 ZINC000825653689 608768963 /nfs/dbraw/zinc/76/89/63/608768963.db2.gz IAWBUJMWXDFXEN-NSHDSACASA-N -1 3 350.382 3.580 20 0 FHADHM Cc1cccc(COc2ccc(CNc3cnccc3-c3nnn[n-]3)cc2)c1 ZINC000826298157 608772737 /nfs/dbraw/zinc/77/27/37/608772737.db2.gz GMUYUOABWMWAND-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM Cc1cccc(COc2ccc(CNc3cnccc3-c3nn[n-]n3)cc2)c1 ZINC000826298157 608772738 /nfs/dbraw/zinc/77/27/38/608772738.db2.gz GMUYUOABWMWAND-UHFFFAOYSA-N -1 3 372.432 3.761 20 0 FHADHM COc1cc(F)cc(CNc2ccc(-c3nn[n-]n3)cc2C(F)(F)F)c1 ZINC000826180760 608799649 /nfs/dbraw/zinc/79/96/49/608799649.db2.gz VWVRVRXAIFJFAU-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM Fc1ccccc1C=C1CCN(Cc2ccc(-c3nnn[n-]3)s2)CC1 ZINC000826378272 608836579 /nfs/dbraw/zinc/83/65/79/608836579.db2.gz BUHIYZIAZFKMDE-UHFFFAOYSA-N -1 3 355.442 3.747 20 0 FHADHM CCCOc1c(Cl)cc(CNc2cccc(-c3nnn[n-]3)c2)cc1OC ZINC000825338567 608870165 /nfs/dbraw/zinc/87/01/65/608870165.db2.gz DDUUQDHLNQATIX-UHFFFAOYSA-N -1 3 373.844 3.930 20 0 FHADHM CCCOc1c(Cl)cc(CNc2cccc(-c3nn[n-]n3)c2)cc1OC ZINC000825338567 608870167 /nfs/dbraw/zinc/87/01/67/608870167.db2.gz DDUUQDHLNQATIX-UHFFFAOYSA-N -1 3 373.844 3.930 20 0 FHADHM COCCOc1cc(C)ccc1N[C@@H](C)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000826160761 609157861 /nfs/dbraw/zinc/15/78/61/609157861.db2.gz FFUJIEZELRULMQ-ZDUSSCGKSA-N -1 3 371.416 3.513 20 0 FHADHM COCCOc1cc(C)ccc1N[C@@H](C)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000826160761 609157863 /nfs/dbraw/zinc/15/78/63/609157863.db2.gz FFUJIEZELRULMQ-ZDUSSCGKSA-N -1 3 371.416 3.513 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(OCc2ncc(Cl)cc2Cl)c1 ZINC000826353891 609174463 /nfs/dbraw/zinc/17/44/63/609174463.db2.gz HYEHQMGZWYEGQY-UHFFFAOYSA-N -1 3 356.600 3.801 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(OCc2ncc(Cl)cc2Cl)c1 ZINC000826353891 609174465 /nfs/dbraw/zinc/17/44/65/609174465.db2.gz HYEHQMGZWYEGQY-UHFFFAOYSA-N -1 3 356.600 3.801 20 0 FHADHM Cc1cc(NCc2ccccc2-c2nnn[n-]2)nn1-c1cc(C)cc(C)c1 ZINC000826264168 609180502 /nfs/dbraw/zinc/18/05/02/609180502.db2.gz DWRPQYOKGLPKQR-UHFFFAOYSA-N -1 3 359.437 3.590 20 0 FHADHM Cc1cc(NCc2ccccc2-c2nn[n-]n2)nn1-c1cc(C)cc(C)c1 ZINC000826264168 609180504 /nfs/dbraw/zinc/18/05/04/609180504.db2.gz DWRPQYOKGLPKQR-UHFFFAOYSA-N -1 3 359.437 3.590 20 0 FHADHM FC1=CCCN(Cc2cccc(OCc3ccccc3-c3nnn[n-]3)c2)C1 ZINC000826370126 609201401 /nfs/dbraw/zinc/20/14/01/609201401.db2.gz FFHRYFQVWYGZAM-UHFFFAOYSA-N -1 3 365.412 3.505 20 0 FHADHM FC1=CCCN(Cc2cccc(OCc3ccccc3-c3nn[n-]n3)c2)C1 ZINC000826370126 609201402 /nfs/dbraw/zinc/20/14/02/609201402.db2.gz FFHRYFQVWYGZAM-UHFFFAOYSA-N -1 3 365.412 3.505 20 0 FHADHM C[C@H](Nc1ccc(OCC2CC2)cc1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824657925 609235195 /nfs/dbraw/zinc/23/51/95/609235195.db2.gz SPEVCQZPCOBPPX-LBPRGKRZSA-N -1 3 353.401 3.968 20 0 FHADHM C[C@H](Nc1ccc(OCC2CC2)cc1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824657925 609235196 /nfs/dbraw/zinc/23/51/96/609235196.db2.gz SPEVCQZPCOBPPX-LBPRGKRZSA-N -1 3 353.401 3.968 20 0 FHADHM CCCCCC[C@H](C)Nc1ccc(N2CCC(O)CC2)c(-c2nnn[n-]2)c1 ZINC000825271707 609242573 /nfs/dbraw/zinc/24/25/73/609242573.db2.gz MLQUDXKYNVIGJM-HNNXBMFYSA-N -1 3 372.517 3.599 20 0 FHADHM CCCCCC[C@H](C)Nc1ccc(N2CCC(O)CC2)c(-c2nn[n-]n2)c1 ZINC000825271707 609242575 /nfs/dbraw/zinc/24/25/75/609242575.db2.gz MLQUDXKYNVIGJM-HNNXBMFYSA-N -1 3 372.517 3.599 20 0 FHADHM C[C@@H](Nc1ccc2c(c1)CCCN2C)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824654895 609276474 /nfs/dbraw/zinc/27/64/74/609276474.db2.gz AEVKDSFTCNEIAJ-GFCCVEGCSA-N -1 3 352.417 3.561 20 0 FHADHM C[C@@H](Nc1ccc2c(c1)CCCN2C)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824654895 609276476 /nfs/dbraw/zinc/27/64/76/609276476.db2.gz AEVKDSFTCNEIAJ-GFCCVEGCSA-N -1 3 352.417 3.561 20 0 FHADHM Cc1cc(C)n(-c2cccc(N[C@@H](C)c3ccc(-c4nnn[n-]4)cc3)c2)n1 ZINC000826264855 609276904 /nfs/dbraw/zinc/27/69/04/609276904.db2.gz CFTKTFANBCHUEA-HNNXBMFYSA-N -1 3 359.437 3.842 20 0 FHADHM Cc1cc(C)n(-c2cccc(N[C@@H](C)c3ccc(-c4nn[n-]n4)cc3)c2)n1 ZINC000826264855 609276906 /nfs/dbraw/zinc/27/69/06/609276906.db2.gz CFTKTFANBCHUEA-HNNXBMFYSA-N -1 3 359.437 3.842 20 0 FHADHM CSc1cc2c(cc1N[C@@H](C)c1cccc(-c3nnn[n-]3)c1)OCCO2 ZINC000826230045 609278682 /nfs/dbraw/zinc/27/86/82/609278682.db2.gz BLHAZUADXHFXFO-NSHDSACASA-N -1 3 369.450 3.533 20 0 FHADHM CSc1cc2c(cc1N[C@@H](C)c1cccc(-c3nn[n-]n3)c1)OCCO2 ZINC000826230045 609278684 /nfs/dbraw/zinc/27/86/84/609278684.db2.gz BLHAZUADXHFXFO-NSHDSACASA-N -1 3 369.450 3.533 20 0 FHADHM Cc1cc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)nn1-c1cccc(F)c1 ZINC000826270881 609282039 /nfs/dbraw/zinc/28/20/39/609282039.db2.gz SDRYSPIFADCUOA-ZDUSSCGKSA-N -1 3 363.400 3.673 20 0 FHADHM Cc1cc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)nn1-c1cccc(F)c1 ZINC000826270881 609282042 /nfs/dbraw/zinc/28/20/42/609282042.db2.gz SDRYSPIFADCUOA-ZDUSSCGKSA-N -1 3 363.400 3.673 20 0 FHADHM CC1CCC(N(C(=O)c2ccc(Cl)c(-c3nnn[n-]3)c2)C2CC2)CC1 ZINC000824917244 609297562 /nfs/dbraw/zinc/29/75/62/609297562.db2.gz NDDQPULUJUKVHH-UHFFFAOYSA-N -1 3 359.861 3.703 20 0 FHADHM CC1CCC(N(C(=O)c2ccc(Cl)c(-c3nn[n-]n3)c2)C2CC2)CC1 ZINC000824917244 609297563 /nfs/dbraw/zinc/29/75/63/609297563.db2.gz NDDQPULUJUKVHH-UHFFFAOYSA-N -1 3 359.861 3.703 20 0 FHADHM Cc1ccc(N(C)C(=O)c2ccc(Cl)c(-c3nnn[n-]3)c2)cc1Cl ZINC000826290004 609300001 /nfs/dbraw/zinc/30/00/01/609300001.db2.gz WCBHAUJUQFXMRX-UHFFFAOYSA-N -1 3 362.220 3.759 20 0 FHADHM Cc1ccc(N(C)C(=O)c2ccc(Cl)c(-c3nn[n-]n3)c2)cc1Cl ZINC000826290004 609300003 /nfs/dbraw/zinc/30/00/03/609300003.db2.gz WCBHAUJUQFXMRX-UHFFFAOYSA-N -1 3 362.220 3.759 20 0 FHADHM O=C(NC1(c2cccc(Cl)c2)CC1)c1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000826429249 609301009 /nfs/dbraw/zinc/30/10/09/609301009.db2.gz YAFXJVUALFQWQM-UHFFFAOYSA-N -1 3 374.231 3.593 20 0 FHADHM O=C(NC1(c2cccc(Cl)c2)CC1)c1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000826429249 609301011 /nfs/dbraw/zinc/30/10/11/609301011.db2.gz YAFXJVUALFQWQM-UHFFFAOYSA-N -1 3 374.231 3.593 20 0 FHADHM COCCC[C@H](C)C(=O)Oc1ccc(-c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000826156356 609302418 /nfs/dbraw/zinc/30/24/18/609302418.db2.gz ZPQDMGKWCSTFLT-AWEZNQCLSA-N -1 3 366.421 3.502 20 0 FHADHM COCCC[C@H](C)C(=O)Oc1ccc(-c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000826156356 609302419 /nfs/dbraw/zinc/30/24/19/609302419.db2.gz ZPQDMGKWCSTFLT-AWEZNQCLSA-N -1 3 366.421 3.502 20 0 FHADHM Cc1csc(SCc2ccc(-c3nnn[n-]3)cc2Br)n1 ZINC000826321110 609306251 /nfs/dbraw/zinc/30/62/51/609306251.db2.gz QNQBKPOJOQMDQB-UHFFFAOYSA-N -1 3 368.285 3.686 20 0 FHADHM Cc1csc(SCc2ccc(-c3nn[n-]n3)cc2Br)n1 ZINC000826321110 609306252 /nfs/dbraw/zinc/30/62/52/609306252.db2.gz QNQBKPOJOQMDQB-UHFFFAOYSA-N -1 3 368.285 3.686 20 0 FHADHM CN(C(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1)c1ccccc1 ZINC000825834503 609307112 /nfs/dbraw/zinc/30/71/12/609307112.db2.gz WKVMUQXXLOSPKA-UHFFFAOYSA-N -1 3 371.400 3.936 20 0 FHADHM CN(C(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1)c1ccccc1 ZINC000825834503 609307114 /nfs/dbraw/zinc/30/71/14/609307114.db2.gz WKVMUQXXLOSPKA-UHFFFAOYSA-N -1 3 371.400 3.936 20 0 FHADHM CCC(CC)[C@H]1C[C@H](Nc2cc(-c3nnn[n-]3)c3ccccc3n2)CCO1 ZINC000825107523 609322019 /nfs/dbraw/zinc/32/20/19/609322019.db2.gz PRXKCCXKIORCRY-RDTXWAMCSA-N -1 3 366.469 3.811 20 0 FHADHM CCC(CC)[C@H]1C[C@H](Nc2cc(-c3nn[n-]n3)c3ccccc3n2)CCO1 ZINC000825107523 609322021 /nfs/dbraw/zinc/32/20/21/609322021.db2.gz PRXKCCXKIORCRY-RDTXWAMCSA-N -1 3 366.469 3.811 20 0 FHADHM C[C@@H]1[C@@H](C)CCN1C(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000824956461 609327403 /nfs/dbraw/zinc/32/74/03/609327403.db2.gz RKIYUYMANZQZPU-UONOGXRCSA-N -1 3 363.421 3.530 20 0 FHADHM C[C@@H]1[C@@H](C)CCN1C(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000824956461 609327404 /nfs/dbraw/zinc/32/74/04/609327404.db2.gz RKIYUYMANZQZPU-UONOGXRCSA-N -1 3 363.421 3.530 20 0 FHADHM Cc1ccc(NC(=O)c2ccccc2Oc2ccccc2-c2nnn[n-]2)cn1 ZINC000826291762 609331074 /nfs/dbraw/zinc/33/10/74/609331074.db2.gz VFOKNIRDRQVQIA-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccc(NC(=O)c2ccccc2Oc2ccccc2-c2nn[n-]n2)cn1 ZINC000826291762 609331076 /nfs/dbraw/zinc/33/10/76/609331076.db2.gz VFOKNIRDRQVQIA-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM C[C@H](NCc1cc(-c2ccccc2)on1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824606130 609331926 /nfs/dbraw/zinc/33/19/26/609331926.db2.gz NNUFPVUQLGWYTA-LBPRGKRZSA-N -1 3 364.384 3.512 20 0 FHADHM C[C@H](NCc1cc(-c2ccccc2)on1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824606130 609331928 /nfs/dbraw/zinc/33/19/28/609331928.db2.gz NNUFPVUQLGWYTA-LBPRGKRZSA-N -1 3 364.384 3.512 20 0 FHADHM FC(F)(F)[C@H](CCc1ccccc1)NCc1cc(-c2nnn[n-]2)cs1 ZINC000826366913 609346998 /nfs/dbraw/zinc/34/69/98/609346998.db2.gz CWBQMZZZFZVWPU-AWEZNQCLSA-N -1 3 367.400 3.582 20 0 FHADHM FC(F)(F)[C@H](CCc1ccccc1)NCc1cc(-c2nn[n-]n2)cs1 ZINC000826366913 609347000 /nfs/dbraw/zinc/34/70/00/609347000.db2.gz CWBQMZZZFZVWPU-AWEZNQCLSA-N -1 3 367.400 3.582 20 0 FHADHM C[C@@H](Nc1ccc(OCC(F)F)cc1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824656561 609347359 /nfs/dbraw/zinc/34/73/59/609347359.db2.gz LUICXBVSZUSKRQ-SNVBAGLBSA-N -1 3 363.343 3.823 20 0 FHADHM C[C@@H](Nc1ccc(OCC(F)F)cc1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824656561 609347361 /nfs/dbraw/zinc/34/73/61/609347361.db2.gz LUICXBVSZUSKRQ-SNVBAGLBSA-N -1 3 363.343 3.823 20 0 FHADHM CCOc1ccc(OC)cc1N[C@H](C)c1ccc(-c2nnn[n-]2)cc1F ZINC000825643290 609349950 /nfs/dbraw/zinc/34/99/50/609349950.db2.gz KZTQLJUDKALFDR-LLVKDONJSA-N -1 3 357.389 3.586 20 0 FHADHM CCOc1ccc(OC)cc1N[C@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000825643290 609349952 /nfs/dbraw/zinc/34/99/52/609349952.db2.gz KZTQLJUDKALFDR-LLVKDONJSA-N -1 3 357.389 3.586 20 0 FHADHM CC1(C)CC[C@@H](C(=O)Nc2nc(-c3ccc(-c4nnn[n-]4)cc3)cs2)C1 ZINC000824796621 609370566 /nfs/dbraw/zinc/37/05/66/609370566.db2.gz RWQLSVYAFLEZHW-CYBMUJFWSA-N -1 3 368.466 3.755 20 0 FHADHM CC1(C)CC[C@@H](C(=O)Nc2nc(-c3ccc(-c4nn[n-]n4)cc3)cs2)C1 ZINC000824796621 609370569 /nfs/dbraw/zinc/37/05/69/609370569.db2.gz RWQLSVYAFLEZHW-CYBMUJFWSA-N -1 3 368.466 3.755 20 0 FHADHM Cc1c(NC(=O)N[C@@H](CC(C)(C)C)C(F)(F)F)cccc1-c1nnn[n-]1 ZINC000826241801 609383779 /nfs/dbraw/zinc/38/37/79/609383779.db2.gz PCMLLHOZLFARSW-LBPRGKRZSA-N -1 3 370.379 3.664 20 0 FHADHM Cc1c(NC(=O)N[C@@H](CC(C)(C)C)C(F)(F)F)cccc1-c1nn[n-]n1 ZINC000826241801 609383782 /nfs/dbraw/zinc/38/37/82/609383782.db2.gz PCMLLHOZLFARSW-LBPRGKRZSA-N -1 3 370.379 3.664 20 0 FHADHM CCC[C@@H]1C[C@H]1NC(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000825251576 609385893 /nfs/dbraw/zinc/38/58/93/609385893.db2.gz CNOZBZSUMSLCHJ-CZUORRHYSA-N -1 3 363.421 3.577 20 0 FHADHM CCC[C@@H]1C[C@H]1NC(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000825251576 609385896 /nfs/dbraw/zinc/38/58/96/609385896.db2.gz CNOZBZSUMSLCHJ-CZUORRHYSA-N -1 3 363.421 3.577 20 0 FHADHM CC(C)[C@H]1CCN1C(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000824222960 609395524 /nfs/dbraw/zinc/39/55/24/609395524.db2.gz DGVGQLSHRYCYHV-MRXNPFEDSA-N -1 3 363.421 3.530 20 0 FHADHM CC(C)[C@H]1CCN1C(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000824222960 609395526 /nfs/dbraw/zinc/39/55/26/609395526.db2.gz DGVGQLSHRYCYHV-MRXNPFEDSA-N -1 3 363.421 3.530 20 0 FHADHM O=C(Nc1ccccc1Sc1ccccc1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC000826457586 609424397 /nfs/dbraw/zinc/42/43/97/609424397.db2.gz HVFLRWCYPFAZIN-UHFFFAOYSA-N -1 3 362.418 3.598 20 0 FHADHM O=C(Nc1ccccc1Sc1ccccc1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC000826457586 609424398 /nfs/dbraw/zinc/42/43/98/609424398.db2.gz HVFLRWCYPFAZIN-UHFFFAOYSA-N -1 3 362.418 3.598 20 0 FHADHM CC(C)Nc1cccc(F)c1NCCCOc1ccc(-c2nn[n-]n2)cc1 ZINC000824305109 609439309 /nfs/dbraw/zinc/43/93/09/609439309.db2.gz LGCSWWDVZAANKN-UHFFFAOYSA-N -1 3 370.432 3.707 20 0 FHADHM CC(C)n1ccnc1CSc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000824377596 609449688 /nfs/dbraw/zinc/44/96/88/609449688.db2.gz IDCIQLIYZSYPDL-UHFFFAOYSA-N -1 3 368.388 3.955 20 0 FHADHM CC(C)n1ccnc1CSc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000824377596 609449691 /nfs/dbraw/zinc/44/96/91/609449691.db2.gz IDCIQLIYZSYPDL-UHFFFAOYSA-N -1 3 368.388 3.955 20 0 FHADHM COc1ccnc(CSc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)c1 ZINC000826220985 609451398 /nfs/dbraw/zinc/45/13/98/609451398.db2.gz JNWGEMUWZRLESB-UHFFFAOYSA-N -1 3 367.356 3.581 20 0 FHADHM COc1ccnc(CSc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)c1 ZINC000826220985 609451401 /nfs/dbraw/zinc/45/14/01/609451401.db2.gz JNWGEMUWZRLESB-UHFFFAOYSA-N -1 3 367.356 3.581 20 0 FHADHM Cc1ncsc1CCSc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000826331479 609452625 /nfs/dbraw/zinc/45/26/25/609452625.db2.gz KGFNGDPHWWZSQS-UHFFFAOYSA-N -1 3 371.413 3.985 20 0 FHADHM Cc1ncsc1CCSc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000826331479 609452626 /nfs/dbraw/zinc/45/26/26/609452626.db2.gz KGFNGDPHWWZSQS-UHFFFAOYSA-N -1 3 371.413 3.985 20 0 FHADHM O=C(Nc1cccc(CSC2CCCC2)c1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC000826456392 609465729 /nfs/dbraw/zinc/46/57/29/609465729.db2.gz BLRCQATVEGGIHJ-UHFFFAOYSA-N -1 3 368.466 3.623 20 0 FHADHM O=C(Nc1cccc(CSC2CCCC2)c1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC000826456392 609465732 /nfs/dbraw/zinc/46/57/32/609465732.db2.gz BLRCQATVEGGIHJ-UHFFFAOYSA-N -1 3 368.466 3.623 20 0 FHADHM COc1ccc(-c2nnn[n-]2)cc1NCc1ccc(F)c(C(F)(F)F)c1 ZINC000826186614 609480966 /nfs/dbraw/zinc/48/09/66/609480966.db2.gz BVLIOBBDNFNZIY-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NCc1ccc(F)c(C(F)(F)F)c1 ZINC000826186614 609480967 /nfs/dbraw/zinc/48/09/67/609480967.db2.gz BVLIOBBDNFNZIY-UHFFFAOYSA-N -1 3 367.306 3.645 20 0 FHADHM Cc1ccc(Br)c(NCc2cccc(-c3nnn[n-]3)c2F)c1 ZINC000826281256 609481827 /nfs/dbraw/zinc/48/18/27/609481827.db2.gz KXCMXNBIOHLXHW-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Cc1ccc(Br)c(NCc2cccc(-c3nn[n-]n3)c2F)c1 ZINC000826281256 609481830 /nfs/dbraw/zinc/48/18/30/609481830.db2.gz KXCMXNBIOHLXHW-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM COc1cc(CNc2cccc(-c3nnn[n-]3)c2C)ccc1OC(C)C ZINC000826179197 609484805 /nfs/dbraw/zinc/48/48/05/609484805.db2.gz DEVFIBPHCGMXJL-UHFFFAOYSA-N -1 3 353.426 3.583 20 0 FHADHM COc1cc(CNc2cccc(-c3nn[n-]n3)c2C)ccc1OC(C)C ZINC000826179197 609484806 /nfs/dbraw/zinc/48/48/06/609484806.db2.gz DEVFIBPHCGMXJL-UHFFFAOYSA-N -1 3 353.426 3.583 20 0 FHADHM c1nc(CNc2ccc(OCc3cccc(-c4nnn[n-]4)c3)cc2)cs1 ZINC000826516647 609485241 /nfs/dbraw/zinc/48/52/41/609485241.db2.gz USYHQLKRDMEHIQ-UHFFFAOYSA-N -1 3 364.434 3.514 20 0 FHADHM c1nc(CNc2ccc(OCc3cccc(-c4nn[n-]n4)c3)cc2)cs1 ZINC000826516647 609485244 /nfs/dbraw/zinc/48/52/44/609485244.db2.gz USYHQLKRDMEHIQ-UHFFFAOYSA-N -1 3 364.434 3.514 20 0 FHADHM CCOC(=O)Nc1ccc(NCc2ccc(C)c(C)c2)cc1-c1nnn[n-]1 ZINC000825553706 609488562 /nfs/dbraw/zinc/48/85/62/609488562.db2.gz VDLOUBIIZIOVSZ-UHFFFAOYSA-N -1 3 366.425 3.664 20 0 FHADHM CCOC(=O)Nc1ccc(NCc2ccc(C)c(C)c2)cc1-c1nn[n-]n1 ZINC000825553706 609488563 /nfs/dbraw/zinc/48/85/63/609488563.db2.gz VDLOUBIIZIOVSZ-UHFFFAOYSA-N -1 3 366.425 3.664 20 0 FHADHM CCOC(=O)Nc1ccc(NCc2c(C)cccc2C)cc1-c1nnn[n-]1 ZINC000825553184 609490871 /nfs/dbraw/zinc/49/08/71/609490871.db2.gz LREOCXYTATZLBK-UHFFFAOYSA-N -1 3 366.425 3.664 20 0 FHADHM CCOC(=O)Nc1ccc(NCc2c(C)cccc2C)cc1-c1nn[n-]n1 ZINC000825553184 609490874 /nfs/dbraw/zinc/49/08/74/609490874.db2.gz LREOCXYTATZLBK-UHFFFAOYSA-N -1 3 366.425 3.664 20 0 FHADHM CC[C@@H](C)[C@@H](C)C(=O)Nc1nc(-c2ccc(-c3nnn[n-]3)cc2)cs1 ZINC000825049362 609506139 /nfs/dbraw/zinc/50/61/39/609506139.db2.gz BFVQXNCXFFVZJG-GHMZBOCLSA-N -1 3 356.455 3.611 20 0 FHADHM CC[C@@H](C)[C@@H](C)C(=O)Nc1nc(-c2ccc(-c3nn[n-]n3)cc2)cs1 ZINC000825049362 609506141 /nfs/dbraw/zinc/50/61/41/609506141.db2.gz BFVQXNCXFFVZJG-GHMZBOCLSA-N -1 3 356.455 3.611 20 0 FHADHM O=C(NC1(c2cccc(-c3nnn[n-]3)c2)CC1)c1ccc(-c2ccccc2)o1 ZINC000826427844 609511345 /nfs/dbraw/zinc/51/13/45/609511345.db2.gz CQEPAAMXCHJPRP-UHFFFAOYSA-N -1 3 371.400 3.546 20 0 FHADHM O=C(NC1(c2cccc(-c3nn[n-]n3)c2)CC1)c1ccc(-c2ccccc2)o1 ZINC000826427844 609511348 /nfs/dbraw/zinc/51/13/48/609511348.db2.gz CQEPAAMXCHJPRP-UHFFFAOYSA-N -1 3 371.400 3.546 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)[C@@H](C)[C@H](C)CC ZINC000825605548 609512118 /nfs/dbraw/zinc/51/21/18/609512118.db2.gz XDOOCUWXVSQUDS-ZJUUUORDSA-N -1 3 352.822 3.506 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)[C@@H](C)[C@H](C)CC ZINC000825605548 609512119 /nfs/dbraw/zinc/51/21/19/609512119.db2.gz XDOOCUWXVSQUDS-ZJUUUORDSA-N -1 3 352.822 3.506 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)[C@@H](C)[C@@H](C)CC ZINC000825605546 609512332 /nfs/dbraw/zinc/51/23/32/609512332.db2.gz XDOOCUWXVSQUDS-UWVGGRQHSA-N -1 3 352.822 3.506 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)[C@@H](C)[C@@H](C)CC ZINC000825605546 609512334 /nfs/dbraw/zinc/51/23/34/609512334.db2.gz XDOOCUWXVSQUDS-UWVGGRQHSA-N -1 3 352.822 3.506 20 0 FHADHM Cc1ccnc(N[C@@H](C)c2ccc(Br)cc2)c1-c1nnn[n-]1 ZINC000826311963 609520780 /nfs/dbraw/zinc/52/07/80/609520780.db2.gz RQFFZAGQGSMQAP-JTQLQIEISA-N -1 3 359.231 3.506 20 0 FHADHM Cc1ccnc(N[C@@H](C)c2ccc(Br)cc2)c1-c1nn[n-]n1 ZINC000826311963 609520781 /nfs/dbraw/zinc/52/07/81/609520781.db2.gz RQFFZAGQGSMQAP-JTQLQIEISA-N -1 3 359.231 3.506 20 0 FHADHM Cc1ccnc(N2CCC[C@H]2c2nc3ccccc3s2)c1-c1nnn[n-]1 ZINC000826310680 609520988 /nfs/dbraw/zinc/52/09/88/609520988.db2.gz FAFOAKDZAFZSDQ-ZDUSSCGKSA-N -1 3 363.450 3.521 20 0 FHADHM Cc1ccnc(N2CCC[C@H]2c2nc3ccccc3s2)c1-c1nn[n-]n1 ZINC000826310680 609520989 /nfs/dbraw/zinc/52/09/89/609520989.db2.gz FAFOAKDZAFZSDQ-ZDUSSCGKSA-N -1 3 363.450 3.521 20 0 FHADHM CCN(C(=O)[C@H]1C[C@H](C)C[C@H](C)C1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825366510 609523786 /nfs/dbraw/zinc/52/37/86/609523786.db2.gz ATVMSVGNPMEJCR-JTOWHCCKSA-N -1 3 355.486 3.849 20 0 FHADHM CCN(C(=O)[C@H]1C[C@H](C)C[C@H](C)C1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825366510 609523787 /nfs/dbraw/zinc/52/37/87/609523787.db2.gz ATVMSVGNPMEJCR-JTOWHCCKSA-N -1 3 355.486 3.849 20 0 FHADHM CC[C@H](C)[C@H](C)C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)nc1 ZINC000825051824 609527660 /nfs/dbraw/zinc/52/76/60/609527660.db2.gz SMCHPYRDXVICRP-STQMWFEESA-N -1 3 366.425 3.675 20 0 FHADHM CC[C@H](C)[C@H](C)C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)nc1 ZINC000825051824 609527661 /nfs/dbraw/zinc/52/76/61/609527661.db2.gz SMCHPYRDXVICRP-STQMWFEESA-N -1 3 366.425 3.675 20 0 FHADHM Cc1ccnc(N[C@@H](c2ccccc2)c2cccc(F)c2)c1-c1nnn[n-]1 ZINC000826311897 609573589 /nfs/dbraw/zinc/57/35/89/609573589.db2.gz QJINOAGQTMFZTJ-SFHVURJKSA-N -1 3 360.396 3.911 20 0 FHADHM Cc1ccnc(N[C@@H](c2ccccc2)c2cccc(F)c2)c1-c1nn[n-]n1 ZINC000826311897 609573590 /nfs/dbraw/zinc/57/35/90/609573590.db2.gz QJINOAGQTMFZTJ-SFHVURJKSA-N -1 3 360.396 3.911 20 0 FHADHM Cc1cc(C)n(-c2ccc([C@H](C)Nc3nccc(C)c3-c3nnn[n-]3)cc2)n1 ZINC000826265267 609575469 /nfs/dbraw/zinc/57/54/69/609575469.db2.gz RYYOYTIOIOAQNP-HNNXBMFYSA-N -1 3 374.452 3.546 20 0 FHADHM Cc1cc(C)n(-c2ccc([C@H](C)Nc3nccc(C)c3-c3nn[n-]n3)cc2)n1 ZINC000826265267 609575472 /nfs/dbraw/zinc/57/54/72/609575472.db2.gz RYYOYTIOIOAQNP-HNNXBMFYSA-N -1 3 374.452 3.546 20 0 FHADHM Cc1ccnc(N2CCCC[C@@H]2c2cc3ccccc3[nH]2)c1-c1nnn[n-]1 ZINC000826310779 609577016 /nfs/dbraw/zinc/57/70/16/609577016.db2.gz IANZKOFNEDDACJ-QGZVFWFLSA-N -1 3 359.437 3.783 20 0 FHADHM Cc1ccnc(N2CCCC[C@@H]2c2cc3ccccc3[nH]2)c1-c1nn[n-]n1 ZINC000826310779 609577018 /nfs/dbraw/zinc/57/70/18/609577018.db2.gz IANZKOFNEDDACJ-QGZVFWFLSA-N -1 3 359.437 3.783 20 0 FHADHM Cc1ccnc(N[C@H]2CC3(CCCC3)Oc3ccccc32)c1-c1nnn[n-]1 ZINC000826312344 609578967 /nfs/dbraw/zinc/57/89/67/609578967.db2.gz BSYFBOQPWOWTGG-HNNXBMFYSA-N -1 3 362.437 3.819 20 0 FHADHM Cc1ccnc(N[C@H]2CC3(CCCC3)Oc3ccccc32)c1-c1nn[n-]n1 ZINC000826312344 609578968 /nfs/dbraw/zinc/57/89/68/609578968.db2.gz BSYFBOQPWOWTGG-HNNXBMFYSA-N -1 3 362.437 3.819 20 0 FHADHM COc1cccc([C@@H]2C[C@H](C)CN2c2ncc(-c3nnn[n-]3)cc2Cl)c1 ZINC000826215208 609592838 /nfs/dbraw/zinc/59/28/38/609592838.db2.gz JHKKQFZJZYGZHJ-ZBEGNZNMSA-N -1 3 370.844 3.511 20 0 FHADHM COc1cccc([C@@H]2C[C@H](C)CN2c2ncc(-c3nn[n-]n3)cc2Cl)c1 ZINC000826215208 609592841 /nfs/dbraw/zinc/59/28/41/609592841.db2.gz JHKKQFZJZYGZHJ-ZBEGNZNMSA-N -1 3 370.844 3.511 20 0 FHADHM O=C(OCc1ccc(Cl)cc1-c1nnn[n-]1)[C@@H]1CCCc2sccc21 ZINC000826465525 609616569 /nfs/dbraw/zinc/61/65/69/609616569.db2.gz QLWHGNQTJDXWJI-CYBMUJFWSA-N -1 3 374.853 3.745 20 0 FHADHM O=C(OCc1ccc(Cl)cc1-c1nn[n-]n1)[C@@H]1CCCc2sccc21 ZINC000826465525 609616570 /nfs/dbraw/zinc/61/65/70/609616570.db2.gz QLWHGNQTJDXWJI-CYBMUJFWSA-N -1 3 374.853 3.745 20 0 FHADHM O=C(c1cc([O-])ccc1Cl)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000431510845 936328062 /nfs/dbraw/zinc/32/80/62/936328062.db2.gz VFALWDBNGNRFLG-MRXNPFEDSA-N -1 3 359.809 3.794 20 0 FHADHM CCOCCC1(C(=O)Nc2cccc(-c3nc(CC)cc(=O)[n-]3)c2)CCC1 ZINC000162154129 936350679 /nfs/dbraw/zinc/35/06/79/936350679.db2.gz FLTBJYHEYLIPJB-UHFFFAOYSA-N -1 3 369.465 3.535 20 0 FHADHM C[C@@H]1C[C@H](C)CCN(C(=O)NCc2ccc([O-])c(Br)c2)C1 ZINC000506374589 945064969 /nfs/dbraw/zinc/06/49/69/945064969.db2.gz DRGXMUADBUFJAG-VXGBXAGGSA-N -1 3 355.276 3.732 20 0 FHADHM Cc1csc(Nc2ccc(C(=O)Nc3n[n-]c(-c4ccco4)n3)cc2)n1 ZINC000583053780 937080341 /nfs/dbraw/zinc/08/03/41/937080341.db2.gz VBVQJVCYMOKIQQ-UHFFFAOYSA-N -1 3 366.406 3.826 20 0 FHADHM CCCN(C)[C@H](CNC(=O)[C@@](C)(CC)CC(=O)[O-])c1ccc(Cl)cc1 ZINC000634835450 937113809 /nfs/dbraw/zinc/11/38/09/937113809.db2.gz FGZWQQCMLUBREL-APWZRJJASA-N -1 3 368.905 3.730 20 0 FHADHM O=c1cc(CN[C@@H]2CCO[C@H]2c2ccccc2)c2cc(Cl)c([O-])cc2o1 ZINC000285959009 927318357 /nfs/dbraw/zinc/31/83/57/927318357.db2.gz DFTUJAZZYWKCPP-UZLBHIALSA-N -1 3 371.820 3.772 20 0 FHADHM C[C@@H]([N-]S(=O)(=O)c1cc(Cl)ccc1C(F)(F)F)[C@H]1CCCCO1 ZINC000510045814 927380513 /nfs/dbraw/zinc/38/05/13/927380513.db2.gz VWBISSMVAVYEMV-BXKDBHETSA-N -1 3 371.808 3.595 20 0 FHADHM O=S(=O)([N-]CC1(C2CC2)CC1)c1cc(Cl)ccc1C(F)(F)F ZINC000510062936 927537049 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20 0 FHADHM Cc1cc(Br)ccc1S(=O)(=O)[N-]c1cccc(F)c1F ZINC000471941970 933974396 /nfs/dbraw/zinc/97/43/96/933974396.db2.gz HWXVKCXDVIKAJR-UHFFFAOYSA-N -1 3 362.195 3.837 20 0 FHADHM Cc1cc(CN[C@H](C(=O)[O-])c2cccc(F)c2)ccc1Br ZINC000426820208 934284383 /nfs/dbraw/zinc/28/43/83/934284383.db2.gz KGFFIBIKJKTKFD-HNNXBMFYSA-N -1 3 352.203 3.812 20 0 FHADHM Cc1cc(S(=O)(=O)[N-]C2C(C)(C)C2(C)C)sc1Br ZINC000094541868 934303048 /nfs/dbraw/zinc/30/30/48/934303048.db2.gz HISRNIDWHCRASH-UHFFFAOYSA-N -1 3 352.319 3.532 20 0 FHADHM Cc1ccc([C@@H](C)[C@H](O)C(=O)Nc2ccc(Br)cc2[O-])cc1 ZINC000535727488 934313984 /nfs/dbraw/zinc/31/39/84/934313984.db2.gz YTFPTFBRFSGEHK-BZNIZROVSA-N -1 3 364.239 3.566 20 0 FHADHM CC(C)([N-]S(=O)(=O)c1cc(Cl)cc(C(F)(F)F)c1)C(F)F ZINC000684597655 934381372 /nfs/dbraw/zinc/38/13/72/934381372.db2.gz MQUQMCPCDRLJBZ-UHFFFAOYSA-N -1 3 351.724 3.681 20 0 FHADHM O=C(Nc1n[n-]c(-c2ccccn2)n1)c1cc2ccc(C(F)(F)F)cc2[nH]1 ZINC000535839183 934576398 /nfs/dbraw/zinc/57/63/98/934576398.db2.gz YRQZQJASOREJQP-UHFFFAOYSA-N -1 3 372.310 3.619 20 0 FHADHM O=C(N=c1cc(-c2cccnc2)[n-][nH]1)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1 ZINC000535879422 934686917 /nfs/dbraw/zinc/68/69/17/934686917.db2.gz JHJRVNJMGPNEKJ-GJZGRUSLSA-N -1 3 373.243 3.943 20 0 FHADHM Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)Nc2ncccc2[O-])o1 ZINC000215656796 934702752 /nfs/dbraw/zinc/70/27/52/934702752.db2.gz RVVWSWZOLMOYEE-UHFFFAOYSA-N -1 3 360.373 3.794 20 0 FHADHM COc1ccccc1C[C@H](CNCc1c(F)cccc1Cl)C(=O)[O-] ZINC000277178247 934749483 /nfs/dbraw/zinc/74/94/83/934749483.db2.gz FDEACUQKOQWRPJ-CYBMUJFWSA-N -1 3 351.805 3.521 20 0 FHADHM COc1ccc([C@H](CC(=O)[O-])NCc2ccc(Cl)s2)cc1OC ZINC000277235242 934823501 /nfs/dbraw/zinc/82/35/01/934823501.db2.gz IVJYGUMZKWEPPY-LBPRGKRZSA-N -1 3 355.843 3.724 20 0 FHADHM COc1cccc(-c2nc(C(=O)[N-]c3ncc(C(C)(C)C)s3)no2)c1 ZINC000472028973 934854039 /nfs/dbraw/zinc/85/40/39/934854039.db2.gz JCEAVJJFZBDWPN-UHFFFAOYSA-N -1 3 358.423 3.752 20 0 FHADHM O=C(c1cccc(NCc2cc([O-])cc(F)c2)c1)N1CCCC[C@@H]1CCO ZINC000472044249 934884136 /nfs/dbraw/zinc/88/41/36/934884136.db2.gz YEQVZZDIDUUDJB-LJQANCHMSA-N -1 3 372.440 3.521 20 0 FHADHM CCCCCOc1cc(C)ccc1CNC(=O)NCc1ncccc1[O-] ZINC000472050246 934894991 /nfs/dbraw/zinc/89/49/91/934894991.db2.gz WJBXMBXHRIGOHD-UHFFFAOYSA-N -1 3 357.454 3.664 20 0 FHADHM Cc1ccc(CNC(=O)NCc2ncccc2[O-])c(O[C@@H](C)CC(C)C)c1 ZINC000472050502 934902270 /nfs/dbraw/zinc/90/22/70/934902270.db2.gz ZOWMCESDGYSCKL-INIZCTEOSA-N -1 3 371.481 3.908 20 0 FHADHM CC(C)(C)[C@@H](CC(=O)[O-])NCc1cn(-c2ccc(Cl)cc2Cl)nn1 ZINC000277306020 934919676 /nfs/dbraw/zinc/91/96/76/934919676.db2.gz NCYMOUWKSFRRFK-CQSZACIVSA-N -1 3 371.268 3.553 20 0 FHADHM [O-]c1cc(F)cc(CNCc2nnc3c(Cl)cc(C(F)(F)F)cn23)c1 ZINC000472062623 934921875 /nfs/dbraw/zinc/92/18/75/934921875.db2.gz AMSWYLKFVVHOOF-UHFFFAOYSA-N -1 3 374.725 3.536 20 0 FHADHM C[C@H](CSc1nc2c(cnn2Cc2ccccc2)c(=O)[n-]1)C(F)(F)F ZINC000657283977 934930011 /nfs/dbraw/zinc/93/00/11/934930011.db2.gz JXAPUZNLMGCRTD-SNVBAGLBSA-N -1 3 368.384 3.871 20 0 FHADHM C[C@H]([N-]S(=O)(=O)c1ccc(Cl)cc1Cl)c1c(F)cncc1F ZINC000511027773 934954067 /nfs/dbraw/zinc/95/40/67/934954067.db2.gz ILWYCMFWJNIQRH-ZETCQYMHSA-N -1 3 367.204 3.706 20 0 FHADHM Cc1nc(C)c(CCC(=O)Nc2ccc(NC3CCCCC3)cc2)c(=O)[n-]1 ZINC000119681467 934971791 /nfs/dbraw/zinc/97/17/91/934971791.db2.gz HAEBELVHTVXZKR-UHFFFAOYSA-N -1 3 368.481 3.703 20 0 FHADHM C[C@@H](NC(=O)NCc1ncccc1[O-])[C@H](C)c1ccccc1C(F)(F)F ZINC000472115906 935069148 /nfs/dbraw/zinc/06/91/48/935069148.db2.gz SDKWEGTVDNQRRG-NWDGAFQWSA-N -1 3 367.371 3.797 20 0 FHADHM O=C([O-])[C@@H](c1ccc(Cl)c(Cl)c1)N1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000582133816 935316283 /nfs/dbraw/zinc/31/62/83/935316283.db2.gz NTPMFQDLVUSKTO-IAOVAPTHSA-N -1 3 372.292 3.992 20 0 FHADHM CC[C@]1(c2ccc(NCc3c([O-])cccc3Cl)cc2)CCC(=O)NC1=O ZINC000159064632 935378852 /nfs/dbraw/zinc/37/88/52/935378852.db2.gz RJUYRZICLDRCOA-HXUWFJFHSA-N -1 3 372.852 3.742 20 0 FHADHM CCCO[C@@H]1CCCN(Cc2cc(Br)ccc2C(=O)[O-])CC1 ZINC000563278260 935389731 /nfs/dbraw/zinc/38/97/31/935389731.db2.gz UREZZYUDTQXLFG-OAHLLOKOSA-N -1 3 370.287 3.928 20 0 FHADHM Cc1noc(C)c1C(=O)[N-]c1nnc([C@@H]2CCCc3ccccc32)s1 ZINC000277513386 935396826 /nfs/dbraw/zinc/39/68/26/935396826.db2.gz KMKFSQJTZLWMKH-CQSZACIVSA-N -1 3 354.435 3.863 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@@H]3CCCO[C@@H]3C(C)(C)C)nc2)n1 ZINC000118384830 935397181 /nfs/dbraw/zinc/39/71/81/935397181.db2.gz ABYJOFHAMGORHZ-LIRRHRJNSA-N -1 3 370.497 3.648 20 0 FHADHM CC(C)[C@]1(C(=O)[O-])CCN([C@@H](C)c2nc3ccccc3n2C(F)F)C1 ZINC000582247093 935446608 /nfs/dbraw/zinc/44/66/08/935446608.db2.gz CDWYFNADJRXAIG-SGTLLEGYSA-N -1 3 351.397 3.925 20 0 FHADHM COc1ccc([C@H](CC(=O)[O-])NCc2cccc(OC(C)C)c2)cc1OC ZINC000277534709 935484795 /nfs/dbraw/zinc/48/47/95/935484795.db2.gz ZILCMSHXGYTTIX-SFHVURJKSA-N -1 3 373.449 3.797 20 0 FHADHM CSc1cccc(F)c1C[N-]S(=O)(=O)c1c(F)cccc1Cl ZINC000509570251 945104845 /nfs/dbraw/zinc/10/48/45/945104845.db2.gz IEIKQGQCBGPBKJ-UHFFFAOYSA-N -1 3 363.838 3.819 20 0 FHADHM CSc1ccc([O-])c(C(=O)N2CC3(CCOCC3)[C@H]2c2ccco2)c1 ZINC000618107164 935554406 /nfs/dbraw/zinc/55/44/06/935554406.db2.gz PGTSCDKRKCHFSH-QGZVFWFLSA-N -1 3 359.447 3.701 20 0 FHADHM CC(=O)Nc1ccc(F)c([N-]C(=O)c2cc(-c3ccc(C)cc3)no2)c1 ZINC000047905639 935567707 /nfs/dbraw/zinc/56/77/07/935567707.db2.gz SRZVBYGGHLZPOB-UHFFFAOYSA-N -1 3 353.353 4.000 20 0 FHADHM Cc1cc(Cl)ccc1S(=O)(=O)[N-]c1ccc(O[C@H]2CCOC2)cc1 ZINC000158255220 935663240 /nfs/dbraw/zinc/66/32/40/935663240.db2.gz YKKOTCHMZRELQX-INIZCTEOSA-N -1 3 367.854 3.617 20 0 FHADHM O=C(c1cc([O-])ccc1Cl)N1CCC[C@H]1C[C@@H](O)c1cccs1 ZINC000277624070 935741552 /nfs/dbraw/zinc/74/15/52/935741552.db2.gz ITUGVBFJKSXMSM-XHDPSFHLSA-N -1 3 351.855 3.835 20 0 FHADHM CC[C@@H]1CN(C(=O)c2cc(=O)[n-]c(C3CC3)n2)c2cccc(Cl)c2O1 ZINC000563390279 935824591 /nfs/dbraw/zinc/82/45/91/935824591.db2.gz QWYFQUDZXNTPAX-LLVKDONJSA-N -1 3 359.813 3.531 20 0 FHADHM Cn1ccc(C(=O)N=c2cc(-c3cc(F)cc(F)c3)[n-][nH]2)c1C1CCC1 ZINC000560274477 935851746 /nfs/dbraw/zinc/85/17/46/935851746.db2.gz ICJPSUFTYLKRGH-UHFFFAOYSA-N -1 3 356.376 3.635 20 0 FHADHM Cc1ccc(NC(=O)C(C)C)cc1S(=O)(=O)[N-]c1ccccc1F ZINC000023988212 935874514 /nfs/dbraw/zinc/87/45/14/935874514.db2.gz RKZXCMZYVKDHIQ-UHFFFAOYSA-N -1 3 350.415 3.529 20 0 FHADHM CCOC(=O)[C@H](OC(=O)c1cc2ccsc2[n-]1)c1ccc(F)c(F)c1 ZINC000780502100 935919348 /nfs/dbraw/zinc/91/93/48/935919348.db2.gz WECWNCMJDYJAJK-CQSZACIVSA-N -1 3 365.357 3.969 20 0 FHADHM CCCC[C@@H](NC=C1C(=O)[N-]C(=O)c2ccccc21)c1ccc(OC)cc1 ZINC000728501728 935966822 /nfs/dbraw/zinc/96/68/22/935966822.db2.gz RGHGTXLWUSFJNO-IAERKFLBSA-N -1 3 364.445 3.827 20 0 FHADHM CC(C)(C)c1ccc2cc(C(=O)Nc3cccc(-c4nnn[n-]4)c3)[nH]c2c1 ZINC000075697411 936015503 /nfs/dbraw/zinc/01/55/03/936015503.db2.gz UOZBRVSEAXYDOH-UHFFFAOYSA-N -1 3 360.421 3.898 20 0 FHADHM CC(C)(C)c1ccc2cc(C(=O)Nc3cccc(-c4nn[n-]n4)c3)[nH]c2c1 ZINC000075697411 936015505 /nfs/dbraw/zinc/01/55/05/936015505.db2.gz UOZBRVSEAXYDOH-UHFFFAOYSA-N -1 3 360.421 3.898 20 0 FHADHM COC[C@H](NCc1cccc([O-])c1Br)c1cccc(OC)c1 ZINC000657612863 936095054 /nfs/dbraw/zinc/09/50/54/936095054.db2.gz PDCUEISXNITANE-HNNXBMFYSA-N -1 3 366.255 3.641 20 0 FHADHM CC[C@@H](NC(=O)Cc1noc(-c2ccc(C)cc2[O-])n1)c1ccccc1 ZINC000277901882 936125992 /nfs/dbraw/zinc/12/59/92/936125992.db2.gz IACHBLNPESWLTK-MRXNPFEDSA-N -1 3 351.406 3.561 20 0 FHADHM CCc1cc(=O)[n-]c(CN(Cc2ccc(C(F)(F)F)cc2)C2CC2)n1 ZINC000468269146 936186624 /nfs/dbraw/zinc/18/66/24/936186624.db2.gz DBIDOKVNCWFCCP-UHFFFAOYSA-N -1 3 351.372 3.928 20 0 FHADHM O=C(N[C@H](C1CCCCC1)C(F)(F)F)c1cc(=O)c2ccccc2[n-]1 ZINC000439999329 945149179 /nfs/dbraw/zinc/14/91/79/945149179.db2.gz ABGRDNGMSUMUFC-MRXNPFEDSA-N -1 3 352.356 3.769 20 0 FHADHM Cc1nc(C)c(CC(=O)O[C@@H](C)c2ccccc2-c2ccccc2)c(=O)[n-]1 ZINC000051967280 936246757 /nfs/dbraw/zinc/24/67/57/936246757.db2.gz CNESMZHSDOAYHX-HNNXBMFYSA-N -1 3 362.429 3.901 20 0 FHADHM Cc1cc(=O)[n-]c(C=Cc2cn(-c3ccccc3)nc2-c2ccncc2)n1 ZINC000583429234 938250793 /nfs/dbraw/zinc/25/07/93/938250793.db2.gz RHUWVOXEMSIYET-BQYQJAHWSA-N -1 3 355.401 3.909 20 0 FHADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CC[C@H](O)C12CCCC2 ZINC000583459250 938262891 /nfs/dbraw/zinc/26/28/91/938262891.db2.gz OVVISPBNEWZTTJ-NRFANRHFSA-N -1 3 365.473 3.697 20 0 FHADHM COC[C@]1(C(=O)[O-])CCN(Cc2csc(-c3ccc(C(C)C)cc3)n2)C1 ZINC000583505142 938281100 /nfs/dbraw/zinc/28/11/00/938281100.db2.gz UFPHVRRLKXBWHW-FQEVSTJZSA-N -1 3 374.506 3.857 20 0 FHADHM O=S(=O)([N-]CCCCCc1ccc(F)cc1)c1cnc(Cl)c(F)c1 ZINC001211589037 938307386 /nfs/dbraw/zinc/30/73/86/938307386.db2.gz HVHSLVWDZOETOL-UHFFFAOYSA-N -1 3 374.840 3.705 20 0 FHADHM Cc1cccc(NC(=O)[C@@H]2CCCN(Cc3cccc([O-])c3Cl)C2)n1 ZINC000507353015 945165529 /nfs/dbraw/zinc/16/55/29/945165529.db2.gz NKMKTVVHZIBCBQ-OAHLLOKOSA-N -1 3 359.857 3.600 20 0 FHADHM Cc1ccc(-c2nc(NC(=O)[C@H](C)CSCc3ccccc3)n[n-]2)o1 ZINC000440006268 945171017 /nfs/dbraw/zinc/17/10/17/945171017.db2.gz WAWCSNXPXSKETC-GFCCVEGCSA-N -1 3 356.451 3.881 20 0 FHADHM CC(C)(C)c1cc(N2CCC(c3n[n-]c(=O)o3)CC2)nc(C(C)(C)C)n1 ZINC000583725845 938381366 /nfs/dbraw/zinc/38/13/66/938381366.db2.gz IPOUGZXCODXUHL-UHFFFAOYSA-N -1 3 359.474 3.544 20 0 FHADHM C[C@@H](c1nc2ccccc2s1)N(C)C(=O)c1cc(=O)[n-]c(C2CC2)n1 ZINC000583761700 938394895 /nfs/dbraw/zinc/39/48/95/938394895.db2.gz ZPVHAFQRXLXJIE-JTQLQIEISA-N -1 3 354.435 3.503 20 0 FHADHM Cn1c(CSCc2cc(=O)[n-]c(-c3ccccc3)n2)nnc1C1CCC1 ZINC000572620221 938458864 /nfs/dbraw/zinc/45/88/64/938458864.db2.gz RLLYXMGEYNLCJO-UHFFFAOYSA-N -1 3 367.478 3.679 20 0 FHADHM Cc1oc([C@H](C)N2CCC(n3ccc(C(F)(F)F)n3)CC2)cc1C(=O)[O-] ZINC000583999613 938528863 /nfs/dbraw/zinc/52/88/63/938528863.db2.gz QVDZBXQFZBEEKE-JTQLQIEISA-N -1 3 371.359 3.900 20 0 FHADHM O=C(NCc1ccc([O-])c(Br)c1)c1cc2cc(F)ccc2[nH]1 ZINC000151515051 938559257 /nfs/dbraw/zinc/55/92/57/938559257.db2.gz RNISZSYPEULLIP-UHFFFAOYSA-N -1 3 363.186 3.705 20 0 FHADHM CC[C@H](OC1CCCC1)C(=O)NCc1ccc([O-])c(Br)c1 ZINC000151524401 938562759 /nfs/dbraw/zinc/56/27/59/938562759.db2.gz DGBOFVQXTYAGDB-HNNXBMFYSA-N -1 3 356.260 3.509 20 0 FHADHM O=C([O-])c1ccc(CN2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)s1 ZINC000584058803 938575534 /nfs/dbraw/zinc/57/55/34/938575534.db2.gz NNYDHJLSWYDBQD-LLVKDONJSA-N -1 3 372.368 3.513 20 0 FHADHM CC1C[C@H]2CC[C@@H](C1)N2[C@@H](C(=O)[O-])c1ccc(Br)cc1F ZINC000584064471 938577722 /nfs/dbraw/zinc/57/77/22/938577722.db2.gz DAQCSWZTFQQYCD-JHXYUMNGSA-N -1 3 356.235 3.977 20 0 FHADHM Cc1nc2ccccc2cc1C(=O)NCc1ccc([O-])c(Br)c1 ZINC000151571704 938582361 /nfs/dbraw/zinc/58/23/61/938582361.db2.gz BJFVVKQHGKKAIV-UHFFFAOYSA-N -1 3 371.234 3.941 20 0 FHADHM O=C(NCc1ccc([O-])c(Br)c1)c1nccc2ccccc21 ZINC000151584918 938588413 /nfs/dbraw/zinc/58/84/13/938588413.db2.gz YIABDNNEXPGUKY-UHFFFAOYSA-N -1 3 357.207 3.633 20 0 FHADHM O=C(CCc1c[nH]c2ccccc12)NCc1ccc([O-])c(Br)c1 ZINC000151600116 938594155 /nfs/dbraw/zinc/59/41/55/938594155.db2.gz STLZYOJQRBJXKY-UHFFFAOYSA-N -1 3 373.250 3.885 20 0 FHADHM CCSCc1cc(C(=O)[N-]c2scc(C3CC3)c2C(=O)OC)no1 ZINC000472316948 938682345 /nfs/dbraw/zinc/68/23/45/938682345.db2.gz PKBDFCMVTDMQRC-UHFFFAOYSA-N -1 3 366.464 3.906 20 0 FHADHM COC(=O)C12CCC(C(=O)Nc3ccc([O-])c(C(F)(F)F)c3)(CC1)CC2 ZINC000584366201 938712478 /nfs/dbraw/zinc/71/24/78/938712478.db2.gz IVFLEWYWHOPYDK-UHFFFAOYSA-N -1 3 371.355 3.863 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N[C@@H](C)c2c(F)cccc2Cl)c1 ZINC000081468100 938790065 /nfs/dbraw/zinc/79/00/65/938790065.db2.gz DGHXTCUERPRRMX-VIFPVBQESA-N -1 3 350.777 3.634 20 0 FHADHM Cc1cnc([C@H](C)[N-]S(=O)(=O)c2csc(-c3ccccc3)n2)s1 ZINC000427239501 945215336 /nfs/dbraw/zinc/21/53/36/945215336.db2.gz QIYRSAYZLIIOLI-NSHDSACASA-N -1 3 365.505 3.615 20 0 FHADHM CCCN(CC(=O)Nc1ccccc1C)C(=O)c1cccc(CC)c1[O-] ZINC000093918507 938932146 /nfs/dbraw/zinc/93/21/46/938932146.db2.gz FWJCTIWXEPEQAQ-UHFFFAOYSA-N -1 3 354.450 3.754 20 0 FHADHM O=S(=O)([N-]Cc1ccc(F)c(F)c1)c1cc(Cl)ccc1Cl ZINC000107556272 938936838 /nfs/dbraw/zinc/93/68/38/938936838.db2.gz CGVBBEONLYHVSS-UHFFFAOYSA-N -1 3 352.189 3.750 20 0 FHADHM COCCC1(C[N-]S(=O)(=O)c2cccc(Cl)c2Cl)CCCC1 ZINC000472325370 938949355 /nfs/dbraw/zinc/94/93/55/938949355.db2.gz XVGZZOVYVIPWPA-UHFFFAOYSA-N -1 3 366.310 3.869 20 0 FHADHM O=C(Nc1ccc(Oc2cccnc2)cc1)c1c[n-]c2ccccc2c1=O ZINC000204736792 938963145 /nfs/dbraw/zinc/96/31/45/938963145.db2.gz SDNLVYKIJDWLJN-UHFFFAOYSA-N -1 3 357.369 3.968 20 0 FHADHM CCC(C)(C)[N-]S(=O)(=O)c1cc(Cl)cc(Br)c1OC ZINC000024244655 938978456 /nfs/dbraw/zinc/97/84/56/938978456.db2.gz WINGTGKSXZFHTK-UHFFFAOYSA-N -1 3 370.696 3.578 20 0 FHADHM O=S(=O)([N-]C[C@H](c1ccccc1)C1CC1)c1cccnc1C(F)(F)F ZINC000431575002 938979285 /nfs/dbraw/zinc/97/92/85/938979285.db2.gz PHTPSEVEUSUFIX-CQSZACIVSA-N -1 3 370.396 3.573 20 0 FHADHM CC(C)COCCC[N-]S(=O)(=O)c1ccc(Cl)cc1C(F)(F)F ZINC000302808173 938984658 /nfs/dbraw/zinc/98/46/58/938984658.db2.gz IKTZNAFSZATIIU-UHFFFAOYSA-N -1 3 373.824 3.700 20 0 FHADHM Cc1c(CN2CCSCC2)cccc1NCc1cccc(C(=O)[O-])c1 ZINC000263488015 938990528 /nfs/dbraw/zinc/99/05/28/938990528.db2.gz QBCFTPPSKDCOJG-UHFFFAOYSA-N -1 3 356.491 3.854 20 0 FHADHM O=S(=O)(Cc1csc(CCc2ccccc2)n1)c1cccc([O-])c1 ZINC000183975428 939010853 /nfs/dbraw/zinc/01/08/53/939010853.db2.gz UEBONLMUZGEENI-UHFFFAOYSA-N -1 3 359.472 3.608 20 0 FHADHM O=C(NCc1ccc([O-])c(F)c1)N1CCC[C@@H]2O[C@H](c3ccccc3)C[C@@H]21 ZINC000650900533 939019472 /nfs/dbraw/zinc/01/94/72/939019472.db2.gz IRWFCFRNBPDORC-IHPCNDPISA-N -1 3 370.424 3.736 20 0 FHADHM Cc1cc(Br)c(S(=O)(=O)[N-][C@@H]2CCCC2(C)C)s1 ZINC000427251039 945228275 /nfs/dbraw/zinc/22/82/75/945228275.db2.gz BCUKEKVUNWZVFD-SNVBAGLBSA-N -1 3 352.319 3.676 20 0 FHADHM COC(=O)c1cccc2[n-]c(NC(=O)c3cc(C)oc3C(F)(F)F)nc21 ZINC000472364118 939120431 /nfs/dbraw/zinc/12/04/31/939120431.db2.gz ANIJHZVCEUIMOK-UHFFFAOYSA-N -1 3 367.283 3.522 20 0 FHADHM C/C=C(/C)C(=O)Nc1ccc(C)c(S(=O)(=O)[N-]c2ccc(OC)cc2)c1 ZINC000255710276 939128394 /nfs/dbraw/zinc/12/83/94/939128394.db2.gz QBQTWMITTLEOEQ-ACAGNQJTSA-N -1 3 374.462 3.709 20 0 FHADHM Cc1csc(C(=O)N=c2cc3ccc(Br)cn3[n-]2)c1Cl ZINC000511337082 939952950 /nfs/dbraw/zinc/95/29/50/939952950.db2.gz DJGVBHRIRPXWGY-UHFFFAOYSA-N -1 3 370.659 3.794 20 0 FHADHM CCc1cccc(CC)c1S(=O)(=O)[N-]c1ccc(-n2ccnc2)cc1 ZINC000605578733 939989870 /nfs/dbraw/zinc/98/98/70/939989870.db2.gz ZUXQUYWOMFLFFN-UHFFFAOYSA-N -1 3 355.463 3.798 20 0 FHADHM Cc1[n-]c(=O)c(C#N)c(C)c1CCC(=O)N(C)c1ccc(C(C)(C)C)cc1 ZINC000065861062 939992867 /nfs/dbraw/zinc/99/28/67/939992867.db2.gz ZFDXTZIMPIQMFW-UHFFFAOYSA-N -1 3 365.477 3.757 20 0 FHADHM CCc1nc2c(s1)[C@H](N(C)C(=O)c1ccc(C(C)=O)c([O-])c1)CCC2 ZINC000612471259 940088885 /nfs/dbraw/zinc/08/88/85/940088885.db2.gz ANHJPDFBYKTWAE-OAHLLOKOSA-N -1 3 358.463 3.763 20 0 FHADHM CC(C)c1ccc(C(=O)N[C@H](C)c2cccc(N3CCOC3=O)c2)c([O-])c1 ZINC000065992451 940161845 /nfs/dbraw/zinc/16/18/45/940161845.db2.gz GBIGREJWODGJCI-CQSZACIVSA-N -1 3 368.433 3.963 20 0 FHADHM C[C@H]1CN(C(=O)C(C)(C)C)C[C@H](C)N1C(=O)c1cc([O-])c2ccccc2c1 ZINC000408116188 945300944 /nfs/dbraw/zinc/30/09/44/945300944.db2.gz PDOJEUYQTNMQCS-GJZGRUSLSA-N -1 3 368.477 3.653 20 0 FHADHM C[C@H](OC(=O)c1cc(Cl)c(Cl)[n-]1)c1ccc(S(C)(=O)=O)cc1 ZINC000782627103 940196030 /nfs/dbraw/zinc/19/60/30/940196030.db2.gz HXFYUSIBRKCLBX-QMMMGPOBSA-N -1 3 362.234 3.643 20 0 FHADHM COC(=O)c1ccc(Cl)c(S(=O)(=O)[N-]c2ccc(C)cc2Cl)c1 ZINC000026528114 945305923 /nfs/dbraw/zinc/30/59/23/945305923.db2.gz JEWRMVXCYIRJKI-UHFFFAOYSA-N -1 3 374.245 3.889 20 0 FHADHM Cc1ccc(Cl)c(S(=O)(=O)[N-]CCOCCC(C)C)c1Cl ZINC000519308548 945306997 /nfs/dbraw/zinc/30/69/97/945306997.db2.gz RRXHPCQNNUPJFA-UHFFFAOYSA-N -1 3 354.299 3.643 20 0 FHADHM O=C(N=c1cc2ccc(Br)cn2[n-]1)c1cccc(Cl)c1F ZINC000511385317 940301083 /nfs/dbraw/zinc/30/10/83/940301083.db2.gz UCCYHXCJVSPLRN-UHFFFAOYSA-N -1 3 368.593 3.564 20 0 FHADHM Cc1csc([C@@H]([N-]S(=O)(=O)c2ccc(Cl)c(F)c2)C2CC2)n1 ZINC000651579305 945311996 /nfs/dbraw/zinc/31/19/96/945311996.db2.gz WNUBSKDYYWVEHZ-ZDUSSCGKSA-N -1 3 360.863 3.674 20 0 FHADHM CCc1ccc([O-])c(C(=O)N2CC3(CCOCC3)[C@@H]2c2ccccc2)c1 ZINC000413958992 940331289 /nfs/dbraw/zinc/33/12/89/940331289.db2.gz SEFATKLQMZDUSR-FQEVSTJZSA-N -1 3 351.446 3.949 20 0 FHADHM CC[C@H]([N-]S(=O)(=O)c1cc(OC)ccc1Cl)c1nc(C)cs1 ZINC000112362353 945314401 /nfs/dbraw/zinc/31/44/01/945314401.db2.gz WUQVQLRVZIOSSJ-LBPRGKRZSA-N -1 3 360.888 3.543 20 0 FHADHM O=C(OCCCOCC(F)(F)F)c1cccc2[n-]c(C(F)F)nc21 ZINC000924079942 940473123 /nfs/dbraw/zinc/47/31/23/940473123.db2.gz AHBGIFNJVGHZHO-UHFFFAOYSA-N -1 3 352.259 3.626 20 0 FHADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)c3coc(C4CCCC4)n3)cc2)n1 ZINC000549003060 940479759 /nfs/dbraw/zinc/47/97/59/940479759.db2.gz QLLOVPIENREANE-UHFFFAOYSA-N -1 3 364.405 3.643 20 0 FHADHM CCCc1ccccc1[N-]S(=O)(=O)c1ccc(OCCOC)c(C)c1 ZINC000047585427 945338245 /nfs/dbraw/zinc/33/82/45/945338245.db2.gz SLPDEHHPJAALGJ-UHFFFAOYSA-N -1 3 363.479 3.774 20 0 FHADHM Cc1ccc(C(=O)N2CCO[C@H](c3cccc(C(F)(F)F)c3)C2)c([O-])c1 ZINC000174985595 940798254 /nfs/dbraw/zinc/79/82/54/940798254.db2.gz 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940954099 /nfs/dbraw/zinc/95/40/99/940954099.db2.gz AYGMYPXSBWPFHQ-LLVKDONJSA-N -1 3 352.283 3.621 20 0 FHADHM Cc1cc(=O)[n-]c([C@H](C)N[C@H](C)c2nnc(-c3cccc(F)c3)s2)n1 ZINC000376441390 941012599 /nfs/dbraw/zinc/01/25/99/941012599.db2.gz JNICZAPJXQZFEZ-WDEREUQCSA-N -1 3 359.430 3.560 20 0 FHADHM Cc1ccc([C@@](O)(CC(=O)Nc2cc(Cl)ccc2[O-])C(F)(F)F)o1 ZINC000180439720 941016234 /nfs/dbraw/zinc/01/62/34/941016234.db2.gz CVUSXNULSOTQSG-AWEZNQCLSA-N -1 3 363.719 3.726 20 0 FHADHM C=Cc1ccc(S(=O)(=O)[N-]c2ccc(O[C@H]3CCCC[C@@H]3O)cc2)cc1 ZINC000414371550 941062588 /nfs/dbraw/zinc/06/25/88/941062588.db2.gz IYRVJDRIFAYTPG-PMACEKPBSA-N -1 3 373.474 3.813 20 0 FHADHM CC(C)[C@@H]([N-]S(=O)(=O)c1cccc2ccccc21)c1nc(C2CC2)no1 ZINC000176691856 941069115 /nfs/dbraw/zinc/06/91/15/941069115.db2.gz VOYVYFINPNNDHO-QGZVFWFLSA-N -1 3 371.462 3.776 20 0 FHADHM Cc1cnc(C[N-]S(=O)(=O)c2cc(Cl)cc(C(F)(F)F)c2)s1 ZINC000187206037 941083256 /nfs/dbraw/zinc/08/32/56/941083256.db2.gz LCBMLITZYNTWNY-UHFFFAOYSA-N -1 3 370.805 3.602 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2ccc(OC)c(SC)c2)c(C)c1C ZINC000414391043 941085719 /nfs/dbraw/zinc/08/57/19/941085719.db2.gz ZIOXEWGXBPMKDR-UHFFFAOYSA-N -1 3 367.492 3.843 20 0 FHADHM Cc1n[nH]c(C)c1[C@@H](C)CC(=O)[N-]OCc1ccc(C(F)(F)F)cc1 ZINC000163625060 941228370 /nfs/dbraw/zinc/22/83/70/941228370.db2.gz QSYSOQITYPQHBH-JTQLQIEISA-N -1 3 355.360 3.787 20 0 FHADHM O=C1CCOc2cc(-c3noc(C=C([O-])c4ccccc4Cl)n3)ccc21 ZINC001211644950 941252934 /nfs/dbraw/zinc/25/29/34/941252934.db2.gz JYOCYDKMFVETRB-UHFFFAOYSA-N -1 3 368.776 3.781 20 0 FHADHM O=C(c1cc([O-])c2ccccc2c1)N1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000425131839 941276098 /nfs/dbraw/zinc/27/60/98/941276098.db2.gz NUIIPDCZBBHYEZ-HXUWFJFHSA-N -1 3 351.446 3.967 20 0 FHADHM O=C(CCOc1ccc(Cl)cc1)OCc1noc(-c2ccccc2[O-])n1 ZINC000782941039 941311165 /nfs/dbraw/zinc/31/11/65/941311165.db2.gz HJTJTEOMRFRWOC-UHFFFAOYSA-N -1 3 374.780 3.608 20 0 FHADHM Cc1cc(=O)[n-]c(-c2cccc(NC(=O)c3ccccc3OC3CC3)c2)n1 ZINC000376602646 941312527 /nfs/dbraw/zinc/31/25/27/941312527.db2.gz QSXXOZSWTXPVRV-UHFFFAOYSA-N -1 3 361.401 3.951 20 0 FHADHM C[C@@H](CCc1ccc(O)cc1)NC(=O)c1cc([O-])cc(C(F)(F)F)c1 ZINC000623021223 941322946 /nfs/dbraw/zinc/32/29/46/941322946.db2.gz JPBIPERAXYJXFZ-NSHDSACASA-N -1 3 353.340 3.868 20 0 FHADHM Cc1ccccc1CN1CCCN(C(=O)c2ccc([O-])c(Cl)c2)CC1 ZINC000031766796 941334842 /nfs/dbraw/zinc/33/48/42/941334842.db2.gz PQPBBKSQPKMHNX-UHFFFAOYSA-N -1 3 358.869 3.702 20 0 FHADHM COc1ccc(N(C)C(=O)c2cc(Oc3ccccc3)ccc2[O-])cn1 ZINC000179471941 941345355 /nfs/dbraw/zinc/34/53/55/941345355.db2.gz LDXYVUNYXQKCBH-UHFFFAOYSA-N -1 3 350.374 3.865 20 0 FHADHM CC(C)Oc1ccc(-c2noc(C=C([O-])c3ccccc3Cl)n2)cn1 ZINC001211647079 941346308 /nfs/dbraw/zinc/34/63/08/941346308.db2.gz GSADCJLUYAIOMU-UHFFFAOYSA-N -1 3 357.797 3.998 20 0 FHADHM COc1cccc(-c2noc(C=C([O-])c3ccccc3Cl)n2)c1OC ZINC001211647392 941351838 /nfs/dbraw/zinc/35/18/38/941351838.db2.gz NHBGJTGWNOEKKF-UHFFFAOYSA-N -1 3 358.781 3.833 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)[C@H](Oc1ccccc1)c1ccccc1 ZINC000589972536 941376377 /nfs/dbraw/zinc/37/63/77/941376377.db2.gz CFOFZEISKKPPIT-LJQANCHMSA-N -1 3 371.400 3.626 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)[C@H](Oc1ccccc1)c1ccccc1 ZINC000589972536 941376381 /nfs/dbraw/zinc/37/63/81/941376381.db2.gz CFOFZEISKKPPIT-LJQANCHMSA-N -1 3 371.400 3.626 20 0 FHADHM Cc1cc([C@H](C)N2CCC(Cc3nc([C@H]4C[C@@H]4C)no3)CC2)oc1C(=O)[O-] ZINC000659798458 941402110 /nfs/dbraw/zinc/40/21/10/941402110.db2.gz DMRIGEBUAABOAX-WHOFXGATSA-N -1 3 373.453 3.808 20 0 FHADHM O=C([O-])[C@H](c1ccccc1F)N1CCC2(CCc3ccccc3O2)CC1 ZINC000659802245 941404846 /nfs/dbraw/zinc/40/48/46/941404846.db2.gz POFXHTKKWREPFG-IBGZPJMESA-N -1 3 355.409 3.811 20 0 FHADHM CCC1(NC(=O)C[C@H](NC(=O)c2ccc([O-])cc2)c2ccccc2)CCC1 ZINC000182553428 941437374 /nfs/dbraw/zinc/43/73/74/941437374.db2.gz KBQQFLZSQZODAF-IBGZPJMESA-N -1 3 366.461 3.702 20 0 FHADHM CCC(CC)NC(=O)C[C@@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000182897110 941471582 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Cc1nc(C)c(S(=O)(=O)[N-][C@H](CC(F)(F)F)c2ccccc2)s1 ZINC000433842232 941938688 /nfs/dbraw/zinc/93/86/88/941938688.db2.gz GZTZWYZWCXJZEV-GFCCVEGCSA-N -1 3 364.414 3.732 20 0 FHADHM O=C([N-]CC1CCN(Cc2ccc(C(F)F)c(F)c2)CC1)C(F)(F)F ZINC000894228281 941970782 /nfs/dbraw/zinc/97/07/82/941970782.db2.gz FVLDIUAASHOQFO-UHFFFAOYSA-N -1 3 368.321 3.654 20 0 FHADHM COc1cc(C(=O)N2Cc3cc(C)ccc3CC2(C)C)cc(OC)c1[O-] ZINC000513651395 942055663 /nfs/dbraw/zinc/05/56/63/942055663.db2.gz ZJOIDANWNMJDGB-UHFFFAOYSA-N -1 3 355.434 3.695 20 0 FHADHM CC(C)(C)CCOC(=O)c1cc(S(=O)(=O)[N-]c2ccccc2F)c[nH]1 ZINC000728727600 942116751 /nfs/dbraw/zinc/11/67/51/942116751.db2.gz PSCHLKMTNADQPS-UHFFFAOYSA-N -1 3 368.430 3.548 20 0 FHADHM Cc1ccc(-c2nc(NC(=O)c3cccn3Cc3cccs3)n[n-]2)o1 ZINC000181883780 942122504 /nfs/dbraw/zinc/12/25/04/942122504.db2.gz KAVBDBPTINWAQV-UHFFFAOYSA-N -1 3 353.407 3.537 20 0 FHADHM CC[C@@H](C)NC(=O)[C@@H](C)Sc1nnc([N-]c2ccccc2F)s1 ZINC000023210255 942143058 /nfs/dbraw/zinc/14/30/58/942143058.db2.gz 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O=C([O-])C[C@H](CNCc1cc(Cl)ccc1Br)C(F)F ZINC000417633759 943771995 /nfs/dbraw/zinc/77/19/95/943771995.db2.gz ZUPLADYXIYEPIL-MRVPVSSYSA-N -1 3 356.594 3.548 20 0 FHADHM CN(c1ccccc1)c1ccc(CNC[C@H](CC(=O)[O-])C(F)(F)F)cn1 ZINC000417627845 943777760 /nfs/dbraw/zinc/77/77/60/943777760.db2.gz OOJVJXSRYAOHDR-AWEZNQCLSA-N -1 3 367.371 3.592 20 0 FHADHM CCc1ccc(-c2nc(C3(NC(=O)OC(C)(C)C)CCC3)no2)c([O-])c1 ZINC000189174646 943847765 /nfs/dbraw/zinc/84/77/65/943847765.db2.gz KJSGTPFWBGDOJO-UHFFFAOYSA-N -1 3 359.426 3.909 20 0 FHADHM Cc1ccc(NC(=O)CSCC(=O)Nc2cc(Cl)ccc2[O-])cc1 ZINC000019850783 943851663 /nfs/dbraw/zinc/85/16/63/943851663.db2.gz SOOJBJZQFDISTO-UHFFFAOYSA-N -1 3 364.854 3.664 20 0 FHADHM Cc1cn([C@H](C)c2ccccc2)[nH]c1=NC(=O)c1cc([O-])ccc1Cl ZINC000505739058 943935976 /nfs/dbraw/zinc/93/59/76/943935976.db2.gz CJUQRBNKLUYUAH-CYBMUJFWSA-N -1 3 355.825 3.834 20 0 FHADHM Cc1ncsc1C[N-]S(=O)(=O)c1c(Cl)ccc(C)c1Cl ZINC000517088177 944004685 /nfs/dbraw/zinc/00/46/85/944004685.db2.gz 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CC(C)c1ccccc1S(=O)(=O)[N-]c1cc(-c2nc[nH]n2)ccc1F ZINC000436479885 944344835 /nfs/dbraw/zinc/34/48/35/944344835.db2.gz VWSNDLNPROPIJX-UHFFFAOYSA-N -1 3 360.414 3.535 20 0 FHADHM COc1c(C)cc(S(=O)(=O)[N-]c2ccc3c(c2)C(=O)CCC3)cc1C ZINC000425949037 944350888 /nfs/dbraw/zinc/35/08/88/944350888.db2.gz FZOWRZQENSZKBW-UHFFFAOYSA-N -1 3 359.447 3.632 20 0 FHADHM O=c1[nH]cc(S(=O)(=O)[N-]c2ccccc2SC2CCCC2)s1 ZINC000436474972 944356395 /nfs/dbraw/zinc/35/63/95/944356395.db2.gz AUGSUQJBDOPJFG-UHFFFAOYSA-N -1 3 356.494 3.684 20 0 FHADHM O=S(=O)([N-]c1cc(-c2nc[nH]n2)ccc1F)c1cccc2ccccc21 ZINC000436476525 944357777 /nfs/dbraw/zinc/35/77/77/944357777.db2.gz JGVHXMOZPXFQIS-UHFFFAOYSA-N -1 3 368.393 3.565 20 0 FHADHM CCCCCc1ccc(NC(=O)NCCNC(=O)c2ccc([O-])cc2)cc1 ZINC000436487530 944370687 /nfs/dbraw/zinc/37/06/87/944370687.db2.gz SSFGNLSSNSGAKW-UHFFFAOYSA-N -1 3 369.465 3.676 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N[C@]2(c3ccc(Cl)cc3)C[C@H]2C)c1 ZINC000436509660 944380104 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FHADHM CC(C)c1ccc(C(=O)N(C)[C@@H]2CCN(c3ccccc3F)C2=O)c([O-])c1 ZINC000436544042 944422731 /nfs/dbraw/zinc/42/27/31/944422731.db2.gz IDTIPGAWNTXBSP-GOSISDBHSA-N -1 3 370.424 3.532 20 0 FHADHM COc1ccc(NC(=O)c2cc3c(cc2[O-])CCCC3)c(OC)c1OC ZINC000436560742 944427214 /nfs/dbraw/zinc/42/72/14/944427214.db2.gz FJRISPKSGKTFQP-UHFFFAOYSA-N -1 3 357.406 3.549 20 0 FHADHM Cc1ccc(C(=O)N(C)C)cc1NC(=O)c1cc2c(cc1[O-])CCCC2 ZINC000436564015 944429646 /nfs/dbraw/zinc/42/96/46/944429646.db2.gz NUASLDMQJFJCAB-UHFFFAOYSA-N -1 3 352.434 3.534 20 0 FHADHM COC(=O)CCSCc1cccc(NC(=O)c2cc(C)ccc2[O-])c1 ZINC000436571403 944435313 /nfs/dbraw/zinc/43/53/13/944435313.db2.gz VQXBTEGJPYNHEF-UHFFFAOYSA-N -1 3 359.447 3.749 20 0 FHADHM COc1ccc(C(=O)NC[C@H](C)CSc2ccccc2OC)c([O-])c1 ZINC000436598256 944442986 /nfs/dbraw/zinc/44/29/86/944442986.db2.gz ZGKGYICIDLJWQN-ZDUSSCGKSA-N -1 3 361.463 3.568 20 0 FHADHM O=C(CCCc1ccc([O-])c(F)c1)NCc1ccccc1OCC1CC1 ZINC000469382816 944444514 /nfs/dbraw/zinc/44/45/14/944444514.db2.gz BGUDKQWWDWRCQF-UHFFFAOYSA-N -1 3 357.425 3.959 20 0 FHADHM Cc1ncc(CNC(=O)Nc2cccc(CSC(C)C)c2C)c(=O)[n-]1 ZINC000544271288 944445127 /nfs/dbraw/zinc/44/51/27/944445127.db2.gz DULCCYVGRWASIS-UHFFFAOYSA-N -1 3 360.483 3.762 20 0 FHADHM CC[C@H](c1ccc(F)cc1F)N1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436587392 944449694 /nfs/dbraw/zinc/44/96/94/944449694.db2.gz DWXKYUIBJHZPDE-GOSISDBHSA-N -1 3 360.404 3.580 20 0 FHADHM CCc1ccc(-c2noc([C@@H](C)NC(=O)c3ccc(OC)cc3[O-])n2)cc1 ZINC000436588193 944450398 /nfs/dbraw/zinc/45/03/98/944450398.db2.gz YWPOFFOUFXBNQG-GFCCVEGCSA-N -1 3 367.405 3.504 20 0 FHADHM COC1(C)CCN(C(=O)c2cc(CCc3ccccc3)ccc2[O-])CC1 ZINC000436618559 944452417 /nfs/dbraw/zinc/45/24/17/944452417.db2.gz SGZBFMBNLBKIML-UHFFFAOYSA-N -1 3 353.462 3.819 20 0 FHADHM CC(C)C1(NC(=O)C[C@@H](NC(=O)c2ccc([O-])cc2)c2ccccc2)CC1 ZINC000436608016 944457375 /nfs/dbraw/zinc/45/73/75/944457375.db2.gz JFDXRMFUWRUHMQ-LJQANCHMSA-N -1 3 366.461 3.558 20 0 FHADHM Cc1cnn([C@@H]2CCN(C(=O)c3cc(Oc4ccccc4)ccc3[O-])C2)c1 ZINC000436607382 944458237 /nfs/dbraw/zinc/45/82/37/944458237.db2.gz IPUXGGULAPHJLX-MRXNPFEDSA-N -1 3 363.417 3.777 20 0 FHADHM CN(C[C@@H]1CCCCO1)C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436610203 944461144 /nfs/dbraw/zinc/46/11/44/944461144.db2.gz MVWSLUUSRQKCIC-IBGZPJMESA-N -1 3 353.462 3.819 20 0 FHADHM Cc1nccn1C[C@H](C)CNC(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436617492 944465192 /nfs/dbraw/zinc/46/51/92/944465192.db2.gz NMOIWRNBKXEHEB-MRXNPFEDSA-N -1 3 363.461 3.554 20 0 FHADHM O=C(NCc1ccc(COCc2ccccc2)cc1)c1ccc(O)cc1[O-] ZINC000436625770 944466958 /nfs/dbraw/zinc/46/69/58/944466958.db2.gz PMFQUQWFKZJVHA-UHFFFAOYSA-N -1 3 363.413 3.745 20 0 FHADHM COc1ccccc1CC1CCN(C(=O)c2ccc(C(C)=O)c([O-])c2)CC1 ZINC000436634738 944474000 /nfs/dbraw/zinc/47/40/00/944474000.db2.gz LCELRVLGMMECGJ-UHFFFAOYSA-N -1 3 367.445 3.698 20 0 FHADHM CC(=O)c1ccc(C(=O)NCCc2coc(-c3ccc(C)cc3)n2)cc1[O-] ZINC000436638108 944477252 /nfs/dbraw/zinc/47/72/52/944477252.db2.gz ZQLABSYIQDUTPN-UHFFFAOYSA-N -1 3 364.401 3.531 20 0 FHADHM Cc1ccc(C(=O)N2CCN(C)c3cc(Br)ccc32)c([O-])c1 ZINC000436621076 944478103 /nfs/dbraw/zinc/47/81/03/944478103.db2.gz ATBTYTLRPWGECB-UHFFFAOYSA-N -1 3 361.239 3.560 20 0 FHADHM O=C(c1ccc(O)cc1[O-])N1CC[C@@](F)(c2cccc(C(F)(F)F)c2)C1 ZINC000436621067 944478198 /nfs/dbraw/zinc/47/81/98/944478198.db2.gz ASXHEANWAHYMDL-KRWDZBQOSA-N -1 3 369.314 3.828 20 0 FHADHM CC(=O)c1ccc(C(=O)NC[C@H]2CCCO[C@@H]2c2ccc(C)cc2)cc1[O-] ZINC000436657891 944488259 /nfs/dbraw/zinc/48/82/59/944488259.db2.gz RXXIDEOZWTUXMA-WIYYLYMNSA-N -1 3 367.445 3.801 20 0 FHADHM CCCCC1CCC(C(=O)N2CCN(C(=O)c3ccccc3[O-])CC2)CC1 ZINC000436639683 944489392 /nfs/dbraw/zinc/48/93/92/944489392.db2.gz LSSRSPCFNXHJBG-UHFFFAOYSA-N -1 3 372.509 3.673 20 0 FHADHM O=c1[n-]c(CN2CC3(CCC3)[C@@H]2[C@H]2CCCO2)nc2c3ccccc3oc21 ZINC000519569450 944499625 /nfs/dbraw/zinc/49/96/25/944499625.db2.gz RAYZAKVAYLTJEV-BEFAXECRSA-N -1 3 365.433 3.615 20 0 FHADHM CCc1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2ccccc2[O-])cc1C ZINC000436659380 944510664 /nfs/dbraw/zinc/51/06/64/944510664.db2.gz OPKSAYJJNVOASC-SFHVURJKSA-N -1 3 352.434 3.506 20 0 FHADHM COc1cc(NC(=O)c2cccc(C)c2[O-])cc(OC)c1Br ZINC000436679295 944518723 /nfs/dbraw/zinc/51/87/23/944518723.db2.gz GCVCJMUHKRUVLN-UHFFFAOYSA-N -1 3 366.211 3.733 20 0 FHADHM Cc1ccnc([C@@H](NC(=O)c2cc(Cc3ccccc3)ccc2[O-])C2CC2)n1 ZINC000436681480 944519942 /nfs/dbraw/zinc/51/99/42/944519942.db2.gz RRQAEKGLMOVBGS-NRFANRHFSA-N -1 3 373.456 3.963 20 0 FHADHM Cc1ccnc([C@H](NC(=O)c2cc(Cc3ccccc3)ccc2[O-])C2CC2)n1 ZINC000436681481 944520392 /nfs/dbraw/zinc/52/03/92/944520392.db2.gz RRQAEKGLMOVBGS-OAQYLSRUSA-N -1 3 373.456 3.963 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)c3ccc(O)c(CC)c3)c2)n1 ZINC000436686640 944526129 /nfs/dbraw/zinc/52/61/29/944526129.db2.gz ONZZRBFXPCRMEK-UHFFFAOYSA-N -1 3 363.417 3.932 20 0 FHADHM COc1cc(-c2nc(Cc3c[nH]c4cc(F)ccc34)no2)cc(OC)c1[O-] ZINC000436689869 944528461 /nfs/dbraw/zinc/52/84/61/944528461.db2.gz OTXYPGWGMCWIBK-UHFFFAOYSA-N -1 3 369.352 3.671 20 0 FHADHM CC(C)c1ccc(C(=O)N(CC(=O)N2CCCCCC2)C(C)C)c([O-])c1 ZINC000436698993 944537854 /nfs/dbraw/zinc/53/78/54/944537854.db2.gz RTXNJUGCGNNUHU-UHFFFAOYSA-N -1 3 360.498 3.769 20 0 FHADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1CCC[C@H]1[C@H]1CCCO1 ZINC000436711423 944551801 /nfs/dbraw/zinc/55/18/01/944551801.db2.gz HSNIUEXGVOURJA-AZUAARDMSA-N -1 3 353.418 3.968 20 0 FHADHM Cn1c(=O)oc2ccc(NC(=O)c3cc(Cc4ccccc4)ccc3[O-])cc21 ZINC000436719913 944558512 /nfs/dbraw/zinc/55/85/12/944558512.db2.gz DJAUGFPZJNYNIV-UHFFFAOYSA-N -1 3 374.396 3.680 20 0 FHADHM Cc1cc(S(=O)(=O)[N-]c2cc([N+](=O)[O-])ccc2F)ccc1OC(C)C ZINC000193820956 944564772 /nfs/dbraw/zinc/56/47/72/944564772.db2.gz CGSXOEWRFOOMPN-UHFFFAOYSA-N -1 3 368.386 3.630 20 0 FHADHM COc1ccc([O-])c(C(=O)Nc2nc(-c3ccc(SC)cc3)ns2)c1 ZINC000440472241 944570474 /nfs/dbraw/zinc/57/04/74/944570474.db2.gz TURFRZXTPRBSHM-UHFFFAOYSA-N -1 3 373.459 3.894 20 0 FHADHM C[C@H](NC(=O)c1c([O-])cccc1O)c1ccc(Oc2cccnc2)cc1 ZINC000436745552 944574589 /nfs/dbraw/zinc/57/45/89/944574589.db2.gz CQOUBLXSHUTOFW-ZDUSSCGKSA-N -1 3 350.374 3.776 20 0 FHADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CC[C@]2(C1)CCCOC2 ZINC000436729004 944575351 /nfs/dbraw/zinc/57/53/51/944575351.db2.gz OYVVLBDFAWHSKR-QHCPKHFHSA-N -1 3 365.473 3.820 20 0 FHADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CC[C@@]2(C1)CCCOC2 ZINC000436729003 944575382 /nfs/dbraw/zinc/57/53/82/944575382.db2.gz OYVVLBDFAWHSKR-HSZRJFAPSA-N -1 3 365.473 3.820 20 0 FHADHM Cc1nc(CCNC(=O)c2cc(Cc3ccccc3)ccc2[O-])c(C)o1 ZINC000436730927 944575906 /nfs/dbraw/zinc/57/59/06/944575906.db2.gz IXNIYLDKXIHQLZ-UHFFFAOYSA-N -1 3 350.418 3.560 20 0 FHADHM COc1cc(C(=O)NCc2c(OC)ccc3ccccc32)cc(OC)c1[O-] ZINC000436735089 944579549 /nfs/dbraw/zinc/57/95/49/944579549.db2.gz CGGNRMSTRYEIRI-UHFFFAOYSA-N -1 3 367.401 3.501 20 0 FHADHM CN1CCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])C2(CCCCC2)C1 ZINC000436750889 944589817 /nfs/dbraw/zinc/58/98/17/944589817.db2.gz IFQHWBFRUXZSGD-UHFFFAOYSA-N -1 3 356.388 3.502 20 0 FHADHM CCCc1noc2nc(-c3ccco3)cc(C(=O)Nc3ncccc3[O-])c12 ZINC000518684196 944595143 /nfs/dbraw/zinc/59/51/43/944595143.db2.gz KIAWMVDTCREXRL-UHFFFAOYSA-N -1 3 364.361 3.788 20 0 FHADHM COc1ccc([C@H](CNC(=O)c2ccc(Cl)cc2[O-])N2CCCC2)cc1 ZINC000436767259 944619508 /nfs/dbraw/zinc/61/95/08/944619508.db2.gz UIWXVRIJCVARGK-SFHVURJKSA-N -1 3 374.868 3.621 20 0 FHADHM CC(C)[C@H](C)CNC(=O)C[C@@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000183923969 944619812 /nfs/dbraw/zinc/61/98/12/944619812.db2.gz WTQNLIFPZZLIRM-OXQOHEQNSA-N -1 3 368.477 3.662 20 0 FHADHM CCCN(C(=O)c1cc(OC)c([O-])c(OC)c1)[C@@H]1CCc2ccccc21 ZINC000436784139 944628433 /nfs/dbraw/zinc/62/84/33/944628433.db2.gz VXSFYJPTUSHHRY-QGZVFWFLSA-N -1 3 355.434 3.949 20 0 FHADHM CCC[C@@H](NC(=O)c1cc(NC(C)=O)ccc1[O-])c1ccc(F)cc1F ZINC000436788328 944637381 /nfs/dbraw/zinc/63/73/81/944637381.db2.gz XFXSRQNXJIMVBJ-QGZVFWFLSA-N -1 3 362.376 3.900 20 0 FHADHM CCOc1ccc(CN(C(=O)c2cc(NC(C)=O)ccc2[O-])C(C)C)cc1 ZINC000436788427 944637603 /nfs/dbraw/zinc/63/76/03/944637603.db2.gz YZCHDBJWMMHYGT-UHFFFAOYSA-N -1 3 370.449 3.800 20 0 FHADHM CC(C)[C@H](Oc1cccc(Cl)c1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000552125270 944638284 /nfs/dbraw/zinc/63/82/84/944638284.db2.gz RFOGVLRYEWCYBD-INIZCTEOSA-N -1 3 371.828 3.562 20 0 FHADHM CC(C)[C@H](Oc1cccc(Cl)c1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000552125270 944638293 /nfs/dbraw/zinc/63/82/93/944638293.db2.gz RFOGVLRYEWCYBD-INIZCTEOSA-N -1 3 371.828 3.562 20 0 FHADHM C[C@@H]1C[C@@H]1N1CCN(C(=O)c2ccc(Cl)c(Cl)c2[O-])C[C@@H](C)C1 ZINC000436789861 944638922 /nfs/dbraw/zinc/63/89/22/944638922.db2.gz FJDZWHRXSXOPLI-WDMOLILDSA-N -1 3 357.281 3.501 20 0 FHADHM COc1ccc(C(=O)N[C@H](C)c2ccc(Br)s2)c([O-])c1 ZINC000436790657 944641288 /nfs/dbraw/zinc/64/12/88/944641288.db2.gz HHZJSPQCNJVADF-MRVPVSSYSA-N -1 3 356.241 3.716 20 0 FHADHM CC(C)[C@@H]1CN(C(=O)c2cc(Cc3ccccc3)ccc2[O-])CCCO1 ZINC000436815638 944651207 /nfs/dbraw/zinc/65/12/07/944651207.db2.gz PCMJWPYCVRYIPY-NRFANRHFSA-N -1 3 353.462 3.870 20 0 FHADHM CCc1ccc(C(=O)N2CCC[C@H]2c2cc(OC)ccc2OC)c([O-])c1 ZINC000436803104 944656572 /nfs/dbraw/zinc/65/65/72/944656572.db2.gz MNZIUTSEOPJCFE-SFHVURJKSA-N -1 3 355.434 3.949 20 0 FHADHM CCOC(=O)c1cc([N-]S(=O)(=O)c2cc(C)sc2C)c(F)cc1C ZINC000516264562 944656784 /nfs/dbraw/zinc/65/67/84/944656784.db2.gz LYFVVTRSOOVRLS-UHFFFAOYSA-N -1 3 371.455 3.790 20 0 FHADHM C[C@H](O)C[C@H]1CCCCN1C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436804669 944658835 /nfs/dbraw/zinc/65/88/35/944658835.db2.gz PTOXVGCZZMXELC-FXAWDEMLSA-N -1 3 367.489 3.943 20 0 FHADHM CO[C@H]1CCOc2c(NC(=O)c3ccc4c(c3[O-])OC(C)(C)C4)cccc21 ZINC000436805949 944660561 /nfs/dbraw/zinc/66/05/61/944660561.db2.gz GOGUPNIIKUTLLV-INIZCTEOSA-N -1 3 369.417 3.828 20 0 FHADHM CCc1ccc(C(=O)N2CCN(C(=O)CCC3CCCCC3)CC2)c([O-])c1 ZINC000436807808 944662620 /nfs/dbraw/zinc/66/26/20/944662620.db2.gz MPXQJGNYXIAUEL-UHFFFAOYSA-N -1 3 372.509 3.600 20 0 FHADHM Cc1ccc([C@H](C)[N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])s1 ZINC000053689241 944665173 /nfs/dbraw/zinc/66/51/73/944665173.db2.gz VDICTTCMEVQIHB-VIFPVBQESA-N -1 3 360.844 3.658 20 0 FHADHM CCc1ccc(C(=O)N2CCC(C(=O)c3ccc(C)cc3)CC2)c([O-])c1 ZINC000436811380 944668420 /nfs/dbraw/zinc/66/84/20/944668420.db2.gz JPRQXUNHWTWUKD-UHFFFAOYSA-N -1 3 351.446 3.998 20 0 FHADHM Cc1oc(-c2ccccc2)c(C(=O)N=c2cc([C@@H]3CCCO3)[n-][nH]2)c1C ZINC000473847197 944669297 /nfs/dbraw/zinc/66/92/97/944669297.db2.gz CGSRSVVSANKFSP-INIZCTEOSA-N -1 3 351.406 3.812 20 0 FHADHM O=C(N=c1cc([C@H]2CCCO2)[n-][nH]1)c1ccccc1CCc1ccccc1 ZINC000473847981 944673092 /nfs/dbraw/zinc/67/30/92/944673092.db2.gz DZMLLNODKYHKMB-HXUWFJFHSA-N -1 3 361.445 3.721 20 0 FHADHM O=C(CCCOc1cccc2ccccc21)N=c1cc([C@H]2CCCO2)[n-][nH]1 ZINC000473848575 944677705 /nfs/dbraw/zinc/67/77/05/944677705.db2.gz SJRIDDYKTUBTGF-LJQANCHMSA-N -1 3 365.433 3.634 20 0 FHADHM O=C(N[C@@H](CCO)c1ccco1)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436821298 944691483 /nfs/dbraw/zinc/69/14/83/944691483.db2.gz KSEPNQHNTOXKML-KRWDZBQOSA-N -1 3 353.374 3.631 20 0 FHADHM CCc1ccc(C(=O)N[C@@H](c2nc(-c3ccncc3)no2)C(C)C)c([O-])c1 ZINC000436822943 944691537 /nfs/dbraw/zinc/69/15/37/944691537.db2.gz YHUXGZGCYLKCFM-QGZVFWFLSA-N -1 3 366.421 3.527 20 0 FHADHM CCc1ccc(C(=O)Nc2cccc([C@H](C)N3CCOCC3)c2)c([O-])c1 ZINC000436825764 944695725 /nfs/dbraw/zinc/69/57/25/944695725.db2.gz MFOHFESAHWPKRX-HNNXBMFYSA-N -1 3 354.450 3.600 20 0 FHADHM Cc1nc(CCNCc2ccc(Oc3ccccc3)o2)sc1C(=O)[O-] ZINC000426699531 944700503 /nfs/dbraw/zinc/70/05/03/944700503.db2.gz JSSYOKZSUSFFSZ-UHFFFAOYSA-N -1 3 358.419 3.867 20 0 FHADHM CCOc1c(Cl)cc(CN[C@@H](C(=O)[O-])c2ccc(C)cc2)cc1OC ZINC000426702158 944701738 /nfs/dbraw/zinc/70/17/38/944701738.db2.gz FDAYKBONXOPKKZ-QGZVFWFLSA-N -1 3 363.841 3.971 20 0 FHADHM COc1ccc(CN[C@@H](C)CCC[C@H](C)C(=O)[O-])c(Br)c1O ZINC000426703744 944705409 /nfs/dbraw/zinc/70/54/09/944705409.db2.gz NIEASUGWKSLIMZ-QWRGUYRKSA-N -1 3 374.275 3.532 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@H]1C[C@H]1C1CCCCC1 ZINC000735873553 944709491 /nfs/dbraw/zinc/70/94/91/944709491.db2.gz CBEYIWIILHXUMS-OALUTQOASA-N -1 3 367.497 3.820 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@H]1C[C@H]1C1CCCCC1 ZINC000735873553 944709497 /nfs/dbraw/zinc/70/94/97/944709497.db2.gz CBEYIWIILHXUMS-OALUTQOASA-N -1 3 367.497 3.820 20 0 FHADHM COCc1cnc(NC(=O)c2cc(OCc3ccccc3)ccc2[O-])s1 ZINC000436844640 944711277 /nfs/dbraw/zinc/71/12/77/944711277.db2.gz HAVKXMVEEYMEAQ-UHFFFAOYSA-N -1 3 370.430 3.826 20 0 FHADHM Cc1cccc(C(=O)Nc2cccc(F)c2Cn2cccc(C)c2=O)c1[O-] ZINC000436846796 944713821 /nfs/dbraw/zinc/71/38/21/944713821.db2.gz YJIZMHDHNYNKFB-UHFFFAOYSA-N -1 3 366.392 3.610 20 0 FHADHM COc1cccc(C(=O)Nc2ccccc2O[C@H](C)C(F)(F)F)c1[O-] ZINC000436846431 944714939 /nfs/dbraw/zinc/71/49/39/944714939.db2.gz WYIIIQUTNZTXSJ-SNVBAGLBSA-N -1 3 355.312 3.983 20 0 FHADHM COc1ccc([C@@H](CCC(=O)[O-])NCc2cccc3c2OCCCO3)cc1 ZINC000426716383 944717253 /nfs/dbraw/zinc/71/72/53/944717253.db2.gz LXECAMBKBJHRGG-GOSISDBHSA-N -1 3 371.433 3.552 20 0 FHADHM Cc1ccc([C@@H](NCc2cc(Cl)c3c(c2)OCCCO3)C(=O)[O-])cc1 ZINC000426716301 944718963 /nfs/dbraw/zinc/71/89/63/944718963.db2.gz VBGGVDWZLUJKAW-QGZVFWFLSA-N -1 3 361.825 3.725 20 0 FHADHM CSc1cc2c(cc1CN[C@@H](c1ccccc1)[C@H](C)C(=O)[O-])OCCO2 ZINC000426722910 944723482 /nfs/dbraw/zinc/72/34/82/944723482.db2.gz JJDDLVQPWLXEID-ORAYPTAESA-N -1 3 373.474 3.731 20 0 FHADHM CCc1cc(=O)c2cc(NC(=O)c3cc4c(cc3[O-])CCCC4)ccc2[nH]1 ZINC000436863800 944730417 /nfs/dbraw/zinc/73/04/17/944730417.db2.gz WDHYQMJKJIWSQJ-UHFFFAOYSA-N -1 3 362.429 3.927 20 0 FHADHM CCc1ccc(NC(=O)Cc2noc(-c3ccc(CC)cc3[O-])n2)cc1 ZINC000436873961 944741173 /nfs/dbraw/zinc/74/11/73/944741173.db2.gz ORIFARYEYJFPAP-UHFFFAOYSA-N -1 3 351.406 3.748 20 0 FHADHM CC(C)COc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)CCCO3)cc1 ZINC000509601770 944749426 /nfs/dbraw/zinc/74/94/26/944749426.db2.gz MHXKISGQTGWXLD-UHFFFAOYSA-N -1 3 361.463 3.847 20 0 FHADHM COc1ccc(F)c(N2CCN(C(=O)c3ccc(C(C)C)cc3[O-])CC2)c1 ZINC000436886891 944761324 /nfs/dbraw/zinc/76/13/24/944761324.db2.gz MNCWTGDIRKHJRT-UHFFFAOYSA-N -1 3 372.440 3.626 20 0 FHADHM Cc1cc(C)cc([C@H](NCc2cc(Cl)c3c(c2)OCCO3)C(=O)[O-])c1 ZINC000426748782 944767968 /nfs/dbraw/zinc/76/79/68/944767968.db2.gz AABGPYRQOVAHSQ-KRWDZBQOSA-N -1 3 361.825 3.644 20 0 FHADHM CC(C)c1ccc(C(=O)N2CCc3c(ncn3-c3ccccc3)C2)c([O-])c1 ZINC000436891362 944768542 /nfs/dbraw/zinc/76/85/42/944768542.db2.gz GEKJLXBFXDYXLY-UHFFFAOYSA-N -1 3 361.445 3.900 20 0 FHADHM C[C@]1(C(=O)[O-])CCCC[C@H]1NCc1csc(COc2ccccc2)n1 ZINC000426752929 944773072 /nfs/dbraw/zinc/77/30/72/944773072.db2.gz GHBSSYLMTPOPED-APWZRJJASA-N -1 3 360.479 3.845 20 0 FHADHM CCOc1ccc(CN[C@H](C(=O)[O-])c2ccc(Cl)c(F)c2)cc1OC ZINC000426753638 944774518 /nfs/dbraw/zinc/77/45/18/944774518.db2.gz JTTWLVDSSTXFKQ-KRWDZBQOSA-N -1 3 367.804 3.802 20 0 FHADHM C[C@H]1CCC[C@@H](C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCCC3)C1 ZINC000736243906 944775532 /nfs/dbraw/zinc/77/55/32/944775532.db2.gz AUUFNCNMMZLMOR-NWDGAFQWSA-N -1 3 359.499 3.962 20 0 FHADHM C[C@H]1CCC[C@@H](C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCCC3)C1 ZINC000736243906 944775540 /nfs/dbraw/zinc/77/55/40/944775540.db2.gz AUUFNCNMMZLMOR-NWDGAFQWSA-N -1 3 359.499 3.962 20 0 FHADHM O=C(C[C@@H](NC(=O)c1ccc([O-])cc1)c1ccccc1)NCC1CCCC1 ZINC000436909117 944776180 /nfs/dbraw/zinc/77/61/80/944776180.db2.gz LASFWBALDYFQBK-HXUWFJFHSA-N -1 3 366.461 3.560 20 0 FHADHM Cc1ccc(-c2ccc(CN[C@@H](CN3CCCCC3)C(=O)[O-])s2)cc1 ZINC000426757013 944776777 /nfs/dbraw/zinc/77/67/77/944776777.db2.gz BKKDRKABMNSXTP-SFHVURJKSA-N -1 3 358.507 3.752 20 0 FHADHM CC(C)[C@@H](C)N(C)C(=O)C[C@H](NC(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000436908782 944777465 /nfs/dbraw/zinc/77/74/65/944777465.db2.gz JZFXJPVJGTYIRE-UZLBHIALSA-N -1 3 368.477 3.756 20 0 FHADHM COc1cccc(CSC[C@@H](NCc2ccccc2Cl)C(=O)[O-])c1 ZINC000426758045 944779593 /nfs/dbraw/zinc/77/95/93/944779593.db2.gz GPSSEHYJVFLRFI-QGZVFWFLSA-N -1 3 365.882 3.825 20 0 FHADHM COc1cccc(-c2nc(-c3cccc(NC(=O)C(C)C)c3)no2)c1[O-] ZINC000436897209 944784394 /nfs/dbraw/zinc/78/43/94/944784394.db2.gz QVTUTRHSRCRCEF-UHFFFAOYSA-N -1 3 353.378 3.712 20 0 FHADHM Cc1ccn(-c2ccccc2CNC(=O)CCCc2ccc([O-])c(F)c2)n1 ZINC000468783291 944788526 /nfs/dbraw/zinc/78/85/26/944788526.db2.gz BUGZWRFSTDIWLV-UHFFFAOYSA-N -1 3 367.424 3.665 20 0 FHADHM CN(C[C@@H]1CCCC[C@@H]1O)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436901199 944790087 /nfs/dbraw/zinc/79/00/87/944790087.db2.gz AFEYRCITFMGQSV-ICSRJNTNSA-N -1 3 353.462 3.606 20 0 FHADHM CCC[C@]1(CO)CCN(C(=O)c2cc(Oc3ccccc3)ccc2[O-])C1 ZINC000436930955 944793425 /nfs/dbraw/zinc/79/34/25/944793425.db2.gz ZKQQPRRWDAFJKN-NRFANRHFSA-N -1 3 355.434 3.809 20 0 FHADHM COc1cccc(C[C@H](NCc2csc(-c3ccsc3)n2)C(=O)[O-])c1 ZINC000426778733 944796095 /nfs/dbraw/zinc/79/60/95/944796095.db2.gz AGQJKTDSUXCZFH-INIZCTEOSA-N -1 3 374.487 3.666 20 0 FHADHM COc1cccc(-c2nc(-c3cccc(NC(=O)NC(C)C)c3)no2)c1[O-] ZINC000436914854 944797055 /nfs/dbraw/zinc/79/70/55/944797055.db2.gz NGBKVIJOELJAHE-UHFFFAOYSA-N -1 3 368.393 3.648 20 0 FHADHM Cc1cc(CN[C@H](C(=O)[O-])c2ccc(F)cc2)ccc1Br ZINC000426766572 944804341 /nfs/dbraw/zinc/80/43/41/944804341.db2.gz FTVOYTJJZQCFDZ-HNNXBMFYSA-N -1 3 352.203 3.812 20 0 FHADHM C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cc(F)c([O-])c(Cl)c2)C1 ZINC000436922924 944806643 /nfs/dbraw/zinc/80/66/43/944806643.db2.gz ROYFNYFOLUJSIE-SWLSCSKDSA-N -1 3 362.832 3.750 20 0 FHADHM COc1cccc(C[C@@H](NCc2csc(-c3cccs3)n2)C(=O)[O-])c1 ZINC000426806049 944806741 /nfs/dbraw/zinc/80/67/41/944806741.db2.gz IAMKIKMMEOCLTM-OAHLLOKOSA-N -1 3 374.487 3.666 20 0 FHADHM Cc1ccc(C(=O)NCCC(=O)Nc2ccc(Cl)cc2Cl)c([O-])c1 ZINC000436947381 944834279 /nfs/dbraw/zinc/83/42/79/944834279.db2.gz MALFQHYJWUTQBQ-UHFFFAOYSA-N -1 3 367.232 3.766 20 0 FHADHM CC(C)c1ccc(C(=O)N[C@H](c2cnn(C)c2)c2ccc(F)cc2)c([O-])c1 ZINC000436964035 944840088 /nfs/dbraw/zinc/84/00/88/944840088.db2.gz LGWMRTRMTTWAOK-FQEVSTJZSA-N -1 3 367.424 3.908 20 0 FHADHM CC(=O)Nc1ccc([N-]S(=O)(=O)c2ccc(C)cc2F)c(Cl)c1 ZINC000517924684 944842302 /nfs/dbraw/zinc/84/23/02/944842302.db2.gz DAUFKUMCPRYMBU-UHFFFAOYSA-N -1 3 356.806 3.547 20 0 FHADHM O=C([O-])[C@H](NCc1cc(Cl)c2c(c1)OCCCO2)c1cccc(F)c1 ZINC000426821625 944845324 /nfs/dbraw/zinc/84/53/24/944845324.db2.gz VKLWEZZQRRNRAW-MRXNPFEDSA-N -1 3 365.788 3.556 20 0 FHADHM CCOc1cccc(-c2cccc(NC(=O)c3ccc(C(=O)OC)[n-]3)n2)c1 ZINC000506994330 944846505 /nfs/dbraw/zinc/84/65/05/944846505.db2.gz FSRYBXAIBHOQGM-UHFFFAOYSA-N -1 3 365.389 3.514 20 0 FHADHM O=C([O-])[C@H](Cc1ccccc1)NCc1csc(-c2ccc(F)cc2)n1 ZINC000426825521 944849870 /nfs/dbraw/zinc/84/98/70/944849870.db2.gz MJZOJXAYYFKGCS-KRWDZBQOSA-N -1 3 356.422 3.735 20 0 FHADHM COc1ccc([C@H](NCc2cc3c(ccc(C)c3C)[nH]2)C(=O)[O-])cc1F ZINC000426826991 944851614 /nfs/dbraw/zinc/85/16/14/944851614.db2.gz VCCHXCJRZYLYHX-IBGZPJMESA-N -1 3 356.397 3.848 20 0 FHADHM O=C([O-])C[C@H](NCc1ccc(-n2cccn2)cc1)c1cccc(Cl)c1 ZINC000426828483 944853483 /nfs/dbraw/zinc/85/34/83/944853483.db2.gz VZDGRABKQZYIMF-SFHVURJKSA-N -1 3 355.825 3.831 20 0 FHADHM CC(=O)N1CCCc2cc(NC(=O)c3ccc4c(c3[O-])CCCC4)ccc21 ZINC000436957773 944854059 /nfs/dbraw/zinc/85/40/59/944854059.db2.gz XRBHNUYQWLDVDN-UHFFFAOYSA-N -1 3 364.445 3.822 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)[C@@H]1CCC[C@H](C)C1 ZINC000736625489 944859420 /nfs/dbraw/zinc/85/94/20/944859420.db2.gz AFBXNABDSRQHJS-WDEREUQCSA-N -1 3 364.833 3.651 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)[C@@H]1CCC[C@H](C)C1 ZINC000736625489 944859427 /nfs/dbraw/zinc/85/94/27/944859427.db2.gz AFBXNABDSRQHJS-WDEREUQCSA-N -1 3 364.833 3.651 20 0 FHADHM CC(C)c1ccc(C(=O)N2CCC[C@@]2(CO)Cc2ccccc2)c([O-])c1 ZINC000436977472 944868017 /nfs/dbraw/zinc/86/80/17/944868017.db2.gz DVGHXXHSNOUOTH-QFIPXVFZSA-N -1 3 353.462 3.725 20 0 FHADHM COc1cc(-c2nc3c(ccc(F)c3F)[nH]2)cc(Br)c1[O-] ZINC000436981153 944871536 /nfs/dbraw/zinc/87/15/36/944871536.db2.gz PWLUHBILRYOKQT-UHFFFAOYSA-N -1 3 355.138 3.985 20 0 FHADHM O=C(NCc1ccc([O-])c(F)c1)c1cc(OCc2ccccc2)ccc1O ZINC000436982135 944872463 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COC(=O)c1cc(S(=O)(=O)[N-][C@H](C)c2cccc3ccccc32)oc1C ZINC000432026459 944931749 /nfs/dbraw/zinc/93/17/49/944931749.db2.gz NGQYVHHTIPMTIJ-GFCCVEGCSA-N -1 3 373.430 3.567 20 0 FHADHM COc1ccc([C@@H]2CCCN2c2c(-c3nnn[n-]3)cnc3ccccc32)cc1 ZINC000737073858 944943954 /nfs/dbraw/zinc/94/39/54/944943954.db2.gz COVHOAKUPOGBNV-IBGZPJMESA-N -1 3 372.432 3.765 20 0 FHADHM COc1ccc([C@@H]2CCCN2c2c(-c3nn[n-]n3)cnc3ccccc32)cc1 ZINC000737073858 944943961 /nfs/dbraw/zinc/94/39/61/944943961.db2.gz COVHOAKUPOGBNV-IBGZPJMESA-N -1 3 372.432 3.765 20 0 FHADHM CCN(Cc1ccc2ccccc2c1)C(=O)Nc1ccc2c(c1)C(=O)[N-]C2=O ZINC000518954288 944966891 /nfs/dbraw/zinc/96/68/91/944966891.db2.gz YXIYKAKMJXDYLV-UHFFFAOYSA-N -1 3 373.412 3.777 20 0 FHADHM Cc1csc([C@H](C)[N-]S(=O)(=O)c2csc(-c3ccccc3)n2)n1 ZINC000500430530 944975014 /nfs/dbraw/zinc/97/50/14/944975014.db2.gz VWWRFCJBVIPCNJ-NSHDSACASA-N -1 3 365.505 3.615 20 0 FHADHM Cc1ccc(C(=O)NCc2ccccc2CN(C)Cc2ccco2)c([O-])c1 ZINC000439803970 944989986 /nfs/dbraw/zinc/98/99/86/944989986.db2.gz HPXZSMKFWAWKCO-UHFFFAOYSA-N -1 3 364.445 3.856 20 0 FHADHM O=C([N-]c1nc(Cc2ccccc2)ns1)c1nccc2ccsc21 ZINC001125951525 945008430 /nfs/dbraw/zinc/00/84/30/945008430.db2.gz BCOLFYOLSBUXQD-UHFFFAOYSA-N -1 3 352.444 3.991 20 0 FHADHM CCCOc1ccc(C(=O)N=c2cc([C@@H]3CCCO3)[n-][nH]2)c(OCCC)c1 ZINC000473854195 945047888 /nfs/dbraw/zinc/04/78/88/945047888.db2.gz XXDLQOYQTIDDQQ-KRWDZBQOSA-N -1 3 373.453 3.513 20 0 FHADHM CC(C)(C)c1ccc(OCCCC(=O)N=c2cc([C@@H]3CCCO3)[n-][nH]2)cc1 ZINC000473853909 945055510 /nfs/dbraw/zinc/05/55/10/945055510.db2.gz FEFDOSYUHZSHFT-SFHVURJKSA-N -1 3 371.481 3.778 20 0 FHADHM Cc1cccc2c1CCN(c1ccc(-c3nnn[n-]3)c(C(F)(F)F)c1)C2 ZINC000737411247 945058503 /nfs/dbraw/zinc/05/85/03/945058503.db2.gz XQUCBBAWVAUHPH-UHFFFAOYSA-N -1 3 359.355 3.757 20 0 FHADHM Cc1cccc2c1CCN(c1ccc(-c3nn[n-]n3)c(C(F)(F)F)c1)C2 ZINC000737411247 945058512 /nfs/dbraw/zinc/05/85/12/945058512.db2.gz XQUCBBAWVAUHPH-UHFFFAOYSA-N -1 3 359.355 3.757 20 0 FHADHM CC1(C)Cc2cc(S(=O)(=O)[N-]c3ccc(OC(F)F)cc3)ccc2O1 ZINC000440280583 945372794 /nfs/dbraw/zinc/37/27/94/945372794.db2.gz VYKDNFQCFQZQES-UHFFFAOYSA-N -1 3 369.389 3.802 20 0 FHADHM CCC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(F)c(CC)c2)cc1 ZINC000507637995 945385834 /nfs/dbraw/zinc/38/58/34/945385834.db2.gz RIHSTMOQEQUICH-UHFFFAOYSA-N -1 3 350.415 3.537 20 0 FHADHM CC(C)(C)Oc1ccc([N-]S(=O)(=O)c2ccc3[nH]c(=O)ccc3c2)cc1 ZINC000432200321 945386650 /nfs/dbraw/zinc/38/66/50/945386650.db2.gz BBMLEFULJSEHGE-UHFFFAOYSA-N -1 3 372.446 3.506 20 0 FHADHM CCCCc1nnc([N-]C(=O)c2cnc(OCc3ccccc3)cn2)s1 ZINC000428320222 945389810 /nfs/dbraw/zinc/38/98/10/945389810.db2.gz LSZHLKBELFGPIL-UHFFFAOYSA-N -1 3 369.450 3.502 20 0 FHADHM O=C([O-])[C@@H](CCNCc1csc(-c2ccccn2)n1)Cc1ccccc1 ZINC000426635387 945438969 /nfs/dbraw/zinc/43/89/69/945438969.db2.gz ACJUPTZESGNHSD-INIZCTEOSA-N -1 3 367.474 3.628 20 0 FHADHM O=C([O-])[C@H](CCNCc1csc(-c2ccccn2)n1)Cc1ccccc1 ZINC000426635388 945439478 /nfs/dbraw/zinc/43/94/78/945439478.db2.gz ACJUPTZESGNHSD-MRXNPFEDSA-N -1 3 367.474 3.628 20 0 FHADHM Cc1ccc(-c2csc(CNC(C)(C)c3nc(C)cc(=O)[n-]3)n2)cc1 ZINC000660748756 945456745 /nfs/dbraw/zinc/45/67/45/945456745.db2.gz AHUBOMVIACSJLE-UHFFFAOYSA-N -1 3 354.479 3.947 20 0 FHADHM Cc1cc(S(=O)(=O)[N-][C@@H](c2ncccc2C)C(C)C)c(F)cc1F ZINC000440384606 945460730 /nfs/dbraw/zinc/46/07/30/945460730.db2.gz PNARXMKVJADUJV-MRXNPFEDSA-N -1 3 354.422 3.652 20 0 FHADHM CCOc1ccc(-c2nc(CNC(C)(C)c3nc(C)cc(=O)[n-]3)co2)cc1 ZINC000660752730 945467685 /nfs/dbraw/zinc/46/76/85/945467685.db2.gz ZDNQUWKVNQPQEH-UHFFFAOYSA-N -1 3 368.437 3.569 20 0 FHADHM CC(=O)Nc1ccc([N-]S(=O)(=O)C2=CCCCC2)c(C(F)(F)F)c1 ZINC000281205631 945555296 /nfs/dbraw/zinc/55/52/96/945555296.db2.gz QBFARALKERBSHY-UHFFFAOYSA-N -1 3 362.373 3.863 20 0 FHADHM CC[C@H](c1ccc(F)cc1F)[S@@](=O)Cc1ccc(-c2nnn[n-]2)cc1 ZINC000820937671 945592365 /nfs/dbraw/zinc/59/23/65/945592365.db2.gz BSIVZRXINGURHI-CPJLOUKISA-N -1 3 362.405 3.545 20 0 FHADHM CC[C@H](c1ccc(F)cc1F)[S@@](=O)Cc1ccc(-c2nn[n-]n2)cc1 ZINC000820937671 945592368 /nfs/dbraw/zinc/59/23/68/945592368.db2.gz BSIVZRXINGURHI-CPJLOUKISA-N -1 3 362.405 3.545 20 0 FHADHM CCC[C@@H]1[C@@H](C)CCCN1C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821034602 945619092 /nfs/dbraw/zinc/61/90/92/945619092.db2.gz PRFISTOPPIUZKI-GRDNDAEWSA-N -1 3 356.474 3.538 20 0 FHADHM CCC[C@@H]1[C@@H](C)CCCN1C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821034602 945619099 /nfs/dbraw/zinc/61/90/99/945619099.db2.gz PRFISTOPPIUZKI-GRDNDAEWSA-N -1 3 356.474 3.538 20 0 FHADHM CCN(Cc1ccccc1)c1ccc(C(=O)NCc2ncccc2[O-])cc1 ZINC000473633413 945633042 /nfs/dbraw/zinc/63/30/42/945633042.db2.gz IAXSBPWPSDZOAM-UHFFFAOYSA-N -1 3 361.445 3.744 20 0 FHADHM O=C(COc1ccc(-c2ccccc2)cc1Cl)NCc1ncccc1[O-] ZINC000473636452 945655177 /nfs/dbraw/zinc/65/51/77/945655177.db2.gz GEFLYUXOZLARJW-UHFFFAOYSA-N -1 3 368.820 3.803 20 0 FHADHM O=C(NCc1ncccc1[O-])[C@H](Oc1ccc(F)c(F)c1)c1ccccc1 ZINC000473637414 945659221 /nfs/dbraw/zinc/65/92/21/945659221.db2.gz JYQVKPLMSBIRDL-LJQANCHMSA-N -1 3 370.355 3.502 20 0 FHADHM CC[C@@H](CNC(=O)c1c[n-]c2ccccc2c1=O)Oc1cccc(Cl)c1 ZINC000440621381 945736115 /nfs/dbraw/zinc/73/61/15/945736115.db2.gz HNVQBNCALRUBMU-AWEZNQCLSA-N -1 3 370.836 3.769 20 0 FHADHM COc1cccc(C[C@H](C)[N-]S(=O)(=O)c2c(Cl)cccc2Cl)c1 ZINC000261483524 945748152 /nfs/dbraw/zinc/74/81/52/945748152.db2.gz XZPWLEADWZVCSU-NSHDSACASA-N -1 3 374.289 3.912 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@@H]3CCCO[C@@H]3C(C)C)nc2)n1 ZINC000301518547 945826699 /nfs/dbraw/zinc/82/66/99/945826699.db2.gz HBBOXJLQQWJBJZ-IFXJQAMLSA-N -1 3 356.470 3.670 20 0 FHADHM O=C([N-]c1nnc(C(F)F)s1)c1cc(F)c(F)cc1Br ZINC000440771836 945878118 /nfs/dbraw/zinc/87/81/18/945878118.db2.gz PPJQYRZSYYZGCJ-UHFFFAOYSA-N -1 3 370.125 3.769 20 0 FHADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)Cc3ccc(Cl)cc3)c2)n1 ZINC000049304348 945910479 /nfs/dbraw/zinc/91/04/79/945910479.db2.gz RQUSZLKJPKFZMM-UHFFFAOYSA-N -1 3 367.836 3.834 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3C[C@H](OC)C3(CC)CC)nc2)n1 ZINC000301710798 945927442 /nfs/dbraw/zinc/92/74/42/945927442.db2.gz KIECNNPJMQVLGL-CVEARBPZSA-N -1 3 356.470 3.812 20 0 FHADHM Cc1ccc(S(=O)(=O)[N-]CC2(c3ccc(C(F)(F)F)cc3)CC2)o1 ZINC000444215221 946081849 /nfs/dbraw/zinc/08/18/49/946081849.db2.gz AWSBUXJRJBPENC-UHFFFAOYSA-N -1 3 359.369 3.617 20 0 FHADHM Cc1cc2c(cc1C)O[C@@H](C(=O)Nc1ccc([O-])c(C(F)(F)F)c1)C2 ZINC000440998598 946098798 /nfs/dbraw/zinc/09/87/98/946098798.db2.gz BNJIISCYTQLFRI-MRXNPFEDSA-N -1 3 351.324 3.970 20 0 FHADHM Cc1nnc(Nc2cccc(CCC(F)(F)F)c2)c(-c2nnn[n-]2)c1C ZINC000822515456 946108186 /nfs/dbraw/zinc/10/81/86/946108186.db2.gz MSBZYJDOOPRPCR-UHFFFAOYSA-N -1 3 363.347 3.512 20 0 FHADHM Cc1nnc(Nc2cccc(CCC(F)(F)F)c2)c(-c2nn[n-]n2)c1C ZINC000822515456 946108190 /nfs/dbraw/zinc/10/81/90/946108190.db2.gz MSBZYJDOOPRPCR-UHFFFAOYSA-N -1 3 363.347 3.512 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(N(C)Cc3cc(F)c(F)c(F)c3)nc2)n1 ZINC000302076984 946110084 /nfs/dbraw/zinc/11/00/84/946110084.db2.gz YNVBNJHOYCYCRW-UHFFFAOYSA-N -1 3 374.366 3.860 20 0 FHADHM C[C@@H]1C(=O)CC[C@@H](C(=O)Nc2cc(Br)ccc2[O-])C1(C)C ZINC000444262571 946145812 /nfs/dbraw/zinc/14/58/12/946145812.db2.gz VNAQCBPNMAVGGV-KOLCDFICSA-N -1 3 354.244 3.735 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@]3(O)CCCC(C)(C)C3)nc2)n1 ZINC000302475919 946231144 /nfs/dbraw/zinc/23/11/44/946231144.db2.gz FDHGTRPKSRSNNR-FQEVSTJZSA-N -1 3 356.470 3.550 20 0 FHADHM Cc1ccc(C(=O)Nc2cccc(CS(=O)(=O)C(C)C)c2)c([O-])c1C ZINC000112402307 946244381 /nfs/dbraw/zinc/24/43/81/946244381.db2.gz ACTLXFUQWFNFOI-UHFFFAOYSA-N -1 3 361.463 3.585 20 0 FHADHM Cc1ccccc1[C@@H](CC(=O)[O-])NC(=O)c1cccc(CN2CCCC2)c1 ZINC000909370851 946405428 /nfs/dbraw/zinc/40/54/28/946405428.db2.gz FOAGOTAIZXXHRV-HXUWFJFHSA-N -1 3 366.461 3.537 20 0 FHADHM c1ccc2cc(NCc3nnc(-c4ccc(-c5nnn[n-]5)cc4)o3)ccc2c1 ZINC000823802610 946484724 /nfs/dbraw/zinc/48/47/24/946484724.db2.gz UNZRAVMFYDPVSJ-UHFFFAOYSA-N -1 3 369.388 3.682 20 0 FHADHM c1ccc2cc(NCc3nnc(-c4ccc(-c5nn[n-]n5)cc4)o3)ccc2c1 ZINC000823802610 946484730 /nfs/dbraw/zinc/48/47/30/946484730.db2.gz UNZRAVMFYDPVSJ-UHFFFAOYSA-N -1 3 369.388 3.682 20 0 FHADHM Cc1cc(S(=O)(=O)[N-]CCc2csc(C(C)C)n2)sc1Cl ZINC000473902472 946597592 /nfs/dbraw/zinc/59/75/92/946597592.db2.gz RHJVEQUDTFBGKV-UHFFFAOYSA-N -1 3 364.945 3.811 20 0 FHADHM CC(C)[C@@H](Sc1cccc(Cl)c1-c1nnn[n-]1)C(=O)NC(C)(C)C ZINC000824207066 946623144 /nfs/dbraw/zinc/62/31/44/946623144.db2.gz OSQIJVMCFZAEKM-CYBMUJFWSA-N -1 3 367.906 3.552 20 0 FHADHM CC(C)[C@@H](Sc1cccc(Cl)c1-c1nn[n-]n1)C(=O)NC(C)(C)C ZINC000824207066 946623148 /nfs/dbraw/zinc/62/31/48/946623148.db2.gz OSQIJVMCFZAEKM-CYBMUJFWSA-N -1 3 367.906 3.552 20 0 FHADHM Cc1cc(S(=O)(=O)[N-]CCc2ccc3ccccc3n2)sc1Cl ZINC000473910710 946624463 /nfs/dbraw/zinc/62/44/63/946624463.db2.gz HPTFOKWFSZPRKL-UHFFFAOYSA-N -1 3 366.895 3.779 20 0 FHADHM Brc1cccc(-c2nnn[n-]2)c1N1CCC[C@]2(CC=CCC2)C1 ZINC001573279163 946632969 /nfs/dbraw/zinc/63/29/69/946632969.db2.gz 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361.449 3.757 20 0 FHADHM C[C@H](NC(=O)[C@@H]1CC1(C)C)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824470742 946722842 /nfs/dbraw/zinc/72/28/42/946722842.db2.gz LPUAVADFLRANHR-UGSOOPFHSA-N -1 3 361.449 3.757 20 0 FHADHM C[C@@H](NC(=O)C=C1CCC1)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824478784 946728261 /nfs/dbraw/zinc/72/82/61/946728261.db2.gz ILNIZWNVUPBZEX-CQSZACIVSA-N -1 3 359.433 3.821 20 0 FHADHM C[C@@H](NC(=O)C=C1CCC1)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824478784 946728264 /nfs/dbraw/zinc/72/82/64/946728264.db2.gz ILNIZWNVUPBZEX-CQSZACIVSA-N -1 3 359.433 3.821 20 0 FHADHM C[C@H](NC(=O)/C=C/C1CC1)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824479843 946731343 /nfs/dbraw/zinc/73/13/43/946731343.db2.gz QEHCVMYJMGHQRD-GMMCIKNFSA-N -1 3 359.433 3.677 20 0 FHADHM C[C@H](NC(=O)/C=C/C1CC1)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000824479843 946731349 /nfs/dbraw/zinc/73/13/49/946731349.db2.gz QEHCVMYJMGHQRD-GMMCIKNFSA-N -1 3 359.433 3.677 20 0 FHADHM C[C@@H](N[C@@H](CCc1ccccc1)C(F)F)c1ccc(-c2nnn[n-]2)cc1 ZINC000824532498 946770168 /nfs/dbraw/zinc/77/01/68/946770168.db2.gz UWNFLVIOMAEBNJ-DYVFJYSZSA-N -1 3 357.408 3.784 20 0 FHADHM C[C@@H](N[C@@H](CCc1ccccc1)C(F)F)c1ccc(-c2nn[n-]n2)cc1 ZINC000824532498 946770175 /nfs/dbraw/zinc/77/01/75/946770175.db2.gz UWNFLVIOMAEBNJ-DYVFJYSZSA-N -1 3 357.408 3.784 20 0 FHADHM C[C@H](N[C@@H](c1nccs1)c1ccccc1)c1cccc(-c2nnn[n-]2)c1 ZINC000824537633 946776046 /nfs/dbraw/zinc/77/60/46/946776046.db2.gz FGRQKKHVVRAHKQ-SUMWQHHRSA-N -1 3 362.462 3.763 20 0 FHADHM C[C@H](N[C@@H](c1nccs1)c1ccccc1)c1cccc(-c2nn[n-]n2)c1 ZINC000824537633 946776057 /nfs/dbraw/zinc/77/60/57/946776057.db2.gz FGRQKKHVVRAHKQ-SUMWQHHRSA-N -1 3 362.462 3.763 20 0 FHADHM CCc1ccc(-c2ccc(C(=O)Nc3ccc(Cc4nnn[n-]4)cc3)o2)cc1 ZINC000473944958 946855014 /nfs/dbraw/zinc/85/50/14/946855014.db2.gz ZFHQONUMOGPUSH-UHFFFAOYSA-N -1 3 373.416 3.865 20 0 FHADHM CCc1ccc(-c2ccc(C(=O)Nc3ccc(Cc4nn[n-]n4)cc3)o2)cc1 ZINC000473944958 946855019 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C[C@H](Nc1ccc(N2CCCCC2)cn1)c1ccc(-c2nnn[n-]2)cc1F ZINC000824656926 946888198 /nfs/dbraw/zinc/88/81/98/946888198.db2.gz ODPMGEAYQHBQDF-ZDUSSCGKSA-N -1 3 367.432 3.564 20 0 FHADHM C[C@H](Nc1ccc(N2CCCCC2)cn1)c1ccc(-c2nn[n-]n2)cc1F ZINC000824656926 946888217 /nfs/dbraw/zinc/88/82/17/946888217.db2.gz ODPMGEAYQHBQDF-ZDUSSCGKSA-N -1 3 367.432 3.564 20 0 FHADHM C[C@@H](OC(=O)[C@H]1CCc2c1cccc2Cl)c1ccc(-c2nnn[n-]2)cc1 ZINC000824712957 946907591 /nfs/dbraw/zinc/90/75/91/946907591.db2.gz FRFSXLACGBLEAH-BZNIZROVSA-N -1 3 368.824 3.854 20 0 FHADHM C[C@@H](OC(=O)[C@H]1CCc2c1cccc2Cl)c1ccc(-c2nn[n-]n2)cc1 ZINC000824712957 946907602 /nfs/dbraw/zinc/90/76/02/946907602.db2.gz FRFSXLACGBLEAH-BZNIZROVSA-N -1 3 368.824 3.854 20 0 FHADHM CS(=O)(=O)[N-]c1ccccc1NC(=O)CCCc1c[nH]c2ccccc12 ZINC000028020672 946909641 /nfs/dbraw/zinc/90/96/41/946909641.db2.gz SAIWWEINMDBDKG-UHFFFAOYSA-N -1 3 371.462 3.501 20 0 FHADHM [O-]c1cccnc1CNCc1ccc(Br)c(Br)c1 ZINC000475350004 946923081 /nfs/dbraw/zinc/92/30/81/946923081.db2.gz 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CC=CC=CC(=O)N[C@@H](C)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000825029005 947047594 /nfs/dbraw/zinc/04/75/94/947047594.db2.gz LRUYHXWWKCGSPU-BNGYNILWSA-N -1 3 359.433 3.843 20 0 FHADHM CC=CC=CC(=O)N[C@@H](C)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000825029005 947047603 /nfs/dbraw/zinc/04/76/03/947047603.db2.gz LRUYHXWWKCGSPU-BNGYNILWSA-N -1 3 359.433 3.843 20 0 FHADHM CCCO[C@@H]1CCCN(Cc2ccc(C(=O)[O-])cc2Br)CC1 ZINC000652411243 947064094 /nfs/dbraw/zinc/06/40/94/947064094.db2.gz SXDXLGZCOBDLQT-OAHLLOKOSA-N -1 3 370.287 3.928 20 0 FHADHM [O-]c1cccc(CN2CCC3(CC2)C[C@H](O)c2ccccc2O3)c1Cl ZINC000897265915 947073937 /nfs/dbraw/zinc/07/39/37/947073937.db2.gz UZYNOATVGLJDRU-KRWDZBQOSA-N -1 3 359.853 3.896 20 0 FHADHM CCC(CC)n1nc(C)cc1C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000825113735 947078830 /nfs/dbraw/zinc/07/88/30/947078830.db2.gz DZPFPBWUMXVKTQ-UHFFFAOYSA-N -1 3 373.848 3.638 20 0 FHADHM CCC(CC)n1nc(C)cc1C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000825113735 947078841 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FHADHM CCCC(=O)Nc1ccc(Cl)c(NCc2cccc(-c3nn[n-]n3)c2)c1 ZINC000825224669 947126507 /nfs/dbraw/zinc/12/65/07/947126507.db2.gz AZUZDTXUASJJHH-UHFFFAOYSA-N -1 3 370.844 3.871 20 0 FHADHM Cc1cc(C)cc(-c2cc(=NC(=O)[C@@H]3CCC(=O)[C@@H](C)C3(C)C)[nH][n-]2)c1 ZINC000444703963 947129967 /nfs/dbraw/zinc/12/99/67/947129967.db2.gz KQJZVOURLUKIQC-ZBFHGGJFSA-N -1 3 353.466 3.695 20 0 FHADHM CCCCCn1cc(CNc2ncc(Cl)c(C)c2-c2nnn[n-]2)c(C)n1 ZINC000825281884 947140939 /nfs/dbraw/zinc/14/09/39/947140939.db2.gz LZPIOUZNYJOORU-UHFFFAOYSA-N -1 3 374.880 3.531 20 0 FHADHM CCCCCn1cc(CNc2ncc(Cl)c(C)c2-c2nn[n-]n2)c(C)n1 ZINC000825281884 947140954 /nfs/dbraw/zinc/14/09/54/947140954.db2.gz LZPIOUZNYJOORU-UHFFFAOYSA-N -1 3 374.880 3.531 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)Nc1cccc(C)c1F ZINC000825319096 947153984 /nfs/dbraw/zinc/15/39/84/947153984.db2.gz XYRBUSTUDDOVGE-UHFFFAOYSA-N -1 3 368.416 3.758 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)Nc1cccc(C)c1F ZINC000825319096 947153993 /nfs/dbraw/zinc/15/39/93/947153993.db2.gz XYRBUSTUDDOVGE-UHFFFAOYSA-N -1 3 368.416 3.758 20 0 FHADHM C[C@@H]([N-]S(=O)(=O)c1cncc(Cl)c1)c1nc(C(C)(C)C)cs1 ZINC000330453508 947174117 /nfs/dbraw/zinc/17/41/17/947174117.db2.gz LRSCQMMXXDGEPU-SECBINFHSA-N -1 3 359.904 3.529 20 0 FHADHM CCN(CCC1CC1)C(=O)c1c[n-]c2ccc(Br)cc2c1=O ZINC000444362102 947187874 /nfs/dbraw/zinc/18/78/74/947187874.db2.gz IUMCYKYXGYYENT-UHFFFAOYSA-N -1 3 363.255 3.553 20 0 FHADHM CCc1cc(=O)[n-]c(-c2ccc(NCCOc3cccc(C)c3)nc2)n1 ZINC000301179054 947219602 /nfs/dbraw/zinc/21/96/02/947219602.db2.gz NQQNTGSJGJMSHH-UHFFFAOYSA-N -1 3 350.422 3.606 20 0 FHADHM CCOC(=O)c1ccc(F)c(S(=O)(=O)[N-][C@H](C)CC2CCCCC2)c1 ZINC001211684115 947232960 /nfs/dbraw/zinc/23/29/60/947232960.db2.gz YEUGEFWVHGJELF-CYBMUJFWSA-N -1 3 371.474 3.640 20 0 FHADHM CCOc1cccc([C@H](C)Nc2ncc(Cl)c(C)c2-c2nnn[n-]2)c1 ZINC000825649075 947272389 /nfs/dbraw/zinc/27/23/89/947272389.db2.gz KQIIUWJJRPCDRS-NSHDSACASA-N -1 3 358.833 3.795 20 0 FHADHM CCOc1cccc([C@H](C)Nc2ncc(Cl)c(C)c2-c2nn[n-]n2)c1 ZINC000825649075 947272395 /nfs/dbraw/zinc/27/23/95/947272395.db2.gz KQIIUWJJRPCDRS-NSHDSACASA-N -1 3 358.833 3.795 20 0 FHADHM Cc1cc(=O)[n-]c([C@@H](C)N2CCO[C@@H](c3ccc(Cl)c(Cl)c3)C2)n1 ZINC000248723425 947309139 /nfs/dbraw/zinc/30/91/39/947309139.db2.gz HHXZXGRCDYPKDB-IAQYHMDHSA-N -1 3 368.264 3.932 20 0 FHADHM CN(C)C(=O)c1cccc(CSc2cccc(Cl)c2-c2nnn[n-]2)c1 ZINC000825848501 947344681 /nfs/dbraw/zinc/34/46/81/947344681.db2.gz FBOYBRQZFYHNDZ-UHFFFAOYSA-N -1 3 373.869 3.514 20 0 FHADHM CN(C)C(=O)c1cccc(CSc2cccc(Cl)c2-c2nn[n-]n2)c1 ZINC000825848501 947344695 /nfs/dbraw/zinc/34/46/95/947344695.db2.gz FBOYBRQZFYHNDZ-UHFFFAOYSA-N -1 3 373.869 3.514 20 0 FHADHM Cc1c(C(=O)Nc2cc(Br)ccc2[O-])cnn1C(C)(C)C ZINC000126673818 947456407 /nfs/dbraw/zinc/45/64/07/947456407.db2.gz JWBCRKCTCSKOMD-UHFFFAOYSA-N -1 3 352.232 3.667 20 0 FHADHM Cc1noc(C)c1[N-]C(=O)c1cnn(-c2ccc(F)cc2)c1C(F)(F)F ZINC000523661621 947487197 /nfs/dbraw/zinc/48/71/97/947487197.db2.gz ZDMFKVXFRLAIGX-UHFFFAOYSA-N -1 3 368.290 3.887 20 0 FHADHM O=S(=O)([N-][C@@H](COc1ccccc1F)c1ccccc1)c1ccco1 ZINC000188609872 947500893 /nfs/dbraw/zinc/50/08/93/947500893.db2.gz JSMPUKNTPXDRON-INIZCTEOSA-N -1 3 361.394 3.517 20 0 FHADHM CCc1ccc(C(=O)N2CCC[C@@H]2c2ccc(OC)c(OC)c2)c([O-])c1 ZINC000188912845 947551047 /nfs/dbraw/zinc/55/10/47/947551047.db2.gz HBVOYYCXNVKWIM-QGZVFWFLSA-N -1 3 355.434 3.949 20 0 FHADHM CC[C@H](C(=O)Nc1ccc(Br)cc1[O-])c1c(C)noc1C ZINC000523731136 947551786 /nfs/dbraw/zinc/55/17/86/947551786.db2.gz YWAJGGGIZLMAQE-NSHDSACASA-N -1 3 353.216 3.892 20 0 FHADHM CCCCOC(=O)Cc1nc(=O)c2c(-c3ccc(C)s3)csc2[n-]1 ZINC000053843157 947555083 /nfs/dbraw/zinc/55/50/83/947555083.db2.gz PONGCDULSPPFDF-UHFFFAOYSA-N -1 3 362.476 3.907 20 0 FHADHM COc1cc([N-]S(=O)(=O)c2ccc(C)cc2C)ccc1OC(F)F ZINC000663261747 947584461 /nfs/dbraw/zinc/58/44/61/947584461.db2.gz MYWSWLAPXNFLBK-UHFFFAOYSA-N -1 3 357.378 3.714 20 0 FHADHM O=C([O-])[C@@H]1C=C[C@H](NCc2ccccc2OCc2ccc(F)cc2F)C1 ZINC000663264962 947598377 /nfs/dbraw/zinc/59/83/77/947598377.db2.gz ZSTAWWZGMNADPT-DYVFJYSZSA-N -1 3 359.372 3.663 20 0 FHADHM C[C@@H]([N-]S(=O)(=O)c1ccc(F)c(F)c1F)c1cc2ccccc2o1 ZINC000008058385 947629286 /nfs/dbraw/zinc/62/92/86/947629286.db2.gz QFLHCWQNMVGNOS-SECBINFHSA-N -1 3 355.337 3.890 20 0 FHADHM C=Cc1ccc(C(=O)N[C@H](c2cccc(-c3nnn[n-]3)c2)C(F)(F)F)cc1 ZINC001573354768 947636427 /nfs/dbraw/zinc/63/64/27/947636427.db2.gz HKCVICPZYCBAKL-OAHLLOKOSA-N -1 3 373.338 3.543 20 0 FHADHM C=Cc1ccc(C(=O)N[C@H](c2cccc(-c3nn[n-]n3)c2)C(F)(F)F)cc1 ZINC001573354768 947636434 /nfs/dbraw/zinc/63/64/34/947636434.db2.gz HKCVICPZYCBAKL-OAHLLOKOSA-N -1 3 373.338 3.543 20 0 FHADHM O=C(Nc1cc2c(cc1Cl)NC(=O)CO2)c1ccc2c(c1[O-])CCCC2 ZINC000185044642 947646013 /nfs/dbraw/zinc/64/60/13/947646013.db2.gz QYDWQGJEMIMBDL-UHFFFAOYSA-N -1 3 372.808 3.508 20 0 FHADHM CCn1cnnc1-c1ccccc1NC(=O)c1ccc2c(c1[O-])CCCC2 ZINC000185105221 947652268 /nfs/dbraw/zinc/65/22/68/947652268.db2.gz BKMLYZQZRLCVFC-UHFFFAOYSA-N -1 3 362.433 3.802 20 0 FHADHM CCc1ccc(-c2nc(-c3ccc(-n4nc(C)cc4C)nc3)no2)c([O-])c1 ZINC000189168334 947653802 /nfs/dbraw/zinc/65/38/02/947653802.db2.gz KETJKJJTRTWKLE-UHFFFAOYSA-N -1 3 361.405 3.869 20 0 FHADHM CSc1ccc(C)c(NC(=O)N(C)Cc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000826230101 947675544 /nfs/dbraw/zinc/67/55/44/947675544.db2.gz DNHUMVWKTDUHIV-UHFFFAOYSA-N -1 3 368.466 3.561 20 0 FHADHM CSc1ccc(C)c(NC(=O)N(C)Cc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000826230101 947675552 /nfs/dbraw/zinc/67/55/52/947675552.db2.gz DNHUMVWKTDUHIV-UHFFFAOYSA-N -1 3 368.466 3.561 20 0 FHADHM Cc1[nH]ccc1C(=O)N[C@@H](C)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000826233599 947684775 /nfs/dbraw/zinc/68/47/75/947684775.db2.gz NQNSIGGTYLJVTO-ZDUSSCGKSA-N -1 3 372.432 3.661 20 0 FHADHM Cc1[nH]ccc1C(=O)N[C@@H](C)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000826233599 947684784 /nfs/dbraw/zinc/68/47/84/947684784.db2.gz NQNSIGGTYLJVTO-ZDUSSCGKSA-N -1 3 372.432 3.661 20 0 FHADHM COc1cc(C(=O)N[C@H]2CC[C@@H](Cc3ccccc3)C2)cc(OC)c1[O-] ZINC000189338887 947693119 /nfs/dbraw/zinc/69/31/19/947693119.db2.gz YGSGRIQJXHAFIH-RDJZCZTQSA-N -1 3 355.434 3.551 20 0 FHADHM CCOc1ccc([N-]S(=O)(=O)Cc2ccc(C(F)F)cc2)nc1C ZINC000663301826 947697072 /nfs/dbraw/zinc/69/70/72/947697072.db2.gz PMPMHDMKRJAHQF-UHFFFAOYSA-N -1 3 356.394 3.668 20 0 FHADHM Cc1c(Cl)cnc(N[C@@H]2CCCOc3c(F)cccc32)c1-c1nnn[n-]1 ZINC000826238526 947702381 /nfs/dbraw/zinc/70/23/81/947702381.db2.gz ITOWBCSVLMQNAJ-CYBMUJFWSA-N -1 3 374.807 3.688 20 0 FHADHM Cc1c(Cl)cnc(N[C@@H]2CCCOc3c(F)cccc32)c1-c1nn[n-]n1 ZINC000826238526 947702386 /nfs/dbraw/zinc/70/23/86/947702386.db2.gz ITOWBCSVLMQNAJ-CYBMUJFWSA-N -1 3 374.807 3.688 20 0 FHADHM Cc1c(Cl)cnc(N[C@H]2CCCOc3ccc(F)cc32)c1-c1nnn[n-]1 ZINC000826238782 947703259 /nfs/dbraw/zinc/70/32/59/947703259.db2.gz PHRFENJWKOIHSE-ZDUSSCGKSA-N -1 3 374.807 3.688 20 0 FHADHM Cc1c(Cl)cnc(N[C@H]2CCCOc3ccc(F)cc32)c1-c1nn[n-]n1 ZINC000826238782 947703264 /nfs/dbraw/zinc/70/32/64/947703264.db2.gz PHRFENJWKOIHSE-ZDUSSCGKSA-N -1 3 374.807 3.688 20 0 FHADHM Cc1c[nH]cc1C(=O)N[C@H](C)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000826242758 947720340 /nfs/dbraw/zinc/72/03/40/947720340.db2.gz FCLCOFVDXFNGMH-CQSZACIVSA-N -1 3 372.432 3.661 20 0 FHADHM Cc1c[nH]cc1C(=O)N[C@H](C)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000826242758 947720351 /nfs/dbraw/zinc/72/03/51/947720351.db2.gz FCLCOFVDXFNGMH-CQSZACIVSA-N -1 3 372.432 3.661 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)Nc1ccc(-c2nnn[n-]2)c(F)c1 ZINC001573365078 947728180 /nfs/dbraw/zinc/72/81/80/947728180.db2.gz KWINWGJERPZDSL-YFHOEESVSA-N -1 3 357.776 3.701 20 0 FHADHM CC(=Cc1cccc(Cl)c1)C(=O)Nc1ccc(-c2nn[n-]n2)c(F)c1 ZINC001573365078 947728190 /nfs/dbraw/zinc/72/81/90/947728190.db2.gz KWINWGJERPZDSL-YFHOEESVSA-N -1 3 357.776 3.701 20 0 FHADHM O=C(Cc1noc(-c2ccccc2[O-])n1)Nc1ccc(Cl)cc1Cl ZINC000445372628 947746533 /nfs/dbraw/zinc/74/65/33/947746533.db2.gz FKCPQLFWHTWEQZ-UHFFFAOYSA-N -1 3 364.188 3.930 20 0 FHADHM CCOC(=O)c1cc(F)cc(S(=O)(=O)[N-]c2ccsc2Cl)c1 ZINC000189735552 947828997 /nfs/dbraw/zinc/82/89/97/947828997.db2.gz SURQYVCHYWUYSJ-UHFFFAOYSA-N -1 3 363.819 3.518 20 0 FHADHM Cc1ccc(C[C@H](C)C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCC3)cc1 ZINC000826286899 947830121 /nfs/dbraw/zinc/83/01/21/947830121.db2.gz VEYSRTKYMQSAPO-LBPRGKRZSA-N -1 3 367.478 3.543 20 0 FHADHM Cc1ccc(C[C@H](C)C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCC3)cc1 ZINC000826286899 947830132 /nfs/dbraw/zinc/83/01/32/947830132.db2.gz VEYSRTKYMQSAPO-LBPRGKRZSA-N -1 3 367.478 3.543 20 0 FHADHM Cc1ccc(Cl)c2ccc(NC(=O)c3cccc(-c4nnn[n-]4)c3)nc12 ZINC000826289063 947839768 /nfs/dbraw/zinc/83/97/68/947839768.db2.gz IZAOXKSRSLIMAJ-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1ccc(Cl)c2ccc(NC(=O)c3cccc(-c4nn[n-]n4)c3)nc12 ZINC000826289063 947839772 /nfs/dbraw/zinc/83/97/72/947839772.db2.gz IZAOXKSRSLIMAJ-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1ccccc1[C@@H](OC(=O)c1c[nH]c(-c2nnn[n-]2)c1)c1cccs1 ZINC000826305800 947878120 /nfs/dbraw/zinc/87/81/20/947878120.db2.gz IWGJOEWHWVMHSX-MRXNPFEDSA-N -1 3 365.418 3.511 20 0 FHADHM Cc1ccccc1[C@@H](OC(=O)c1c[nH]c(-c2nn[n-]n2)c1)c1cccs1 ZINC000826305800 947878131 /nfs/dbraw/zinc/87/81/31/947878131.db2.gz IWGJOEWHWVMHSX-MRXNPFEDSA-N -1 3 365.418 3.511 20 0 FHADHM COCCN(Cc1sccc1Br)C(=O)c1ccccc1[O-] ZINC000190179701 947939156 /nfs/dbraw/zinc/93/91/56/947939156.db2.gz XEJBRZJXXPTSAE-UHFFFAOYSA-N -1 3 370.268 3.505 20 0 FHADHM Cc1nc(CN[C@@H](C)c2ccc(-c3cccc(-c4nnn[n-]4)c3)cc2)oc1C ZINC000826326459 947952776 /nfs/dbraw/zinc/95/27/76/947952776.db2.gz QCNDCGOEEANQRB-AWEZNQCLSA-N -1 3 374.448 3.989 20 0 FHADHM Cc1nc(CN[C@@H](C)c2ccc(-c3cccc(-c4nn[n-]n4)c3)cc2)oc1C ZINC000826326459 947952791 /nfs/dbraw/zinc/95/27/91/947952791.db2.gz QCNDCGOEEANQRB-AWEZNQCLSA-N -1 3 374.448 3.989 20 0 FHADHM COc1ccc(S(=O)(=O)[N-]c2cc(Br)c(F)cc2C)cc1 ZINC000190382940 947955287 /nfs/dbraw/zinc/95/52/87/947955287.db2.gz YXWNBEAGCJZFMZ-UHFFFAOYSA-N -1 3 374.231 3.706 20 0 FHADHM Cc1nccc(N[C@@H](C)c2ccc(-c3cccc(-c4nnn[n-]4)c3)cc2)n1 ZINC000826330087 947961191 /nfs/dbraw/zinc/96/11/91/947961191.db2.gz DSQYDJHEKKWANO-ZDUSSCGKSA-N -1 3 357.421 3.805 20 0 FHADHM Cc1nccc(N[C@@H](C)c2ccc(-c3cccc(-c4nn[n-]n4)c3)cc2)n1 ZINC000826330087 947961198 /nfs/dbraw/zinc/96/11/98/947961198.db2.gz DSQYDJHEKKWANO-ZDUSSCGKSA-N -1 3 357.421 3.805 20 0 FHADHM Cc1nsc(N[C@H](C)c2ccc(-c3cccc(-c4nnn[n-]4)c3)cc2)n1 ZINC000826340468 947977758 /nfs/dbraw/zinc/97/77/58/947977758.db2.gz ZSRSKDZMOOHQSC-LLVKDONJSA-N -1 3 363.450 3.867 20 0 FHADHM Cc1nsc(N[C@H](C)c2ccc(-c3cccc(-c4nn[n-]n4)c3)cc2)n1 ZINC000826340468 947977767 /nfs/dbraw/zinc/97/77/67/947977767.db2.gz ZSRSKDZMOOHQSC-LLVKDONJSA-N -1 3 363.450 3.867 20 0 FHADHM O=c1nc(CN2CCC[C@H]2C(F)F)[n-]c2scc(-c3ccco3)c21 ZINC000663464320 948045112 /nfs/dbraw/zinc/04/51/12/948045112.db2.gz DDPVDRDNYNWZPL-JTQLQIEISA-N -1 3 351.378 3.886 20 0 FHADHM CC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccc(N3CCOCC3)cc2)cc1 ZINC000007055414 948047670 /nfs/dbraw/zinc/04/76/70/948047670.db2.gz AOMVNXCIDRXEGG-UHFFFAOYSA-N -1 3 374.506 3.622 20 0 FHADHM O=C([O-])[C@@H](CCCNCc1nccn1-c1ccccc1)Cc1ccccc1 ZINC000417556441 948215563 /nfs/dbraw/zinc/21/55/63/948215563.db2.gz OOYYLWMUBCPBFP-IBGZPJMESA-N -1 3 363.461 3.686 20 0 FHADHM O=C(NCc1ccc(-c2nnn[n-]2)cc1F)Nc1csc2ccccc12 ZINC000826441563 948302177 /nfs/dbraw/zinc/30/21/77/948302177.db2.gz JPCDEFJIMNDGSO-UHFFFAOYSA-N -1 3 368.397 3.542 20 0 FHADHM O=C(NCc1ccc(-c2nn[n-]n2)cc1F)Nc1csc2ccccc12 ZINC000826441563 948302185 /nfs/dbraw/zinc/30/21/85/948302185.db2.gz JPCDEFJIMNDGSO-UHFFFAOYSA-N -1 3 368.397 3.542 20 0 FHADHM CC(C)CC[N-]S(=O)(=O)c1ccc(Br)cc1C(F)(F)F ZINC000614598716 948329744 /nfs/dbraw/zinc/32/97/44/948329744.db2.gz MRRQNCNEWZCQCF-UHFFFAOYSA-N -1 3 374.222 3.792 20 0 FHADHM Cc1ccc([C@H]2[C@@H](C)CCCN2C(=O)c2cnc3c(cnn3C)c2[O-])cc1 ZINC000512063828 948336778 /nfs/dbraw/zinc/33/67/78/948336778.db2.gz JZSMWNCINIDVTN-KBXCAEBGSA-N -1 3 364.449 3.596 20 0 FHADHM O=C(c1cc2c(cc1[O-])OCO2)N1Cc2ccccc2[C@H](c2ccccc2)C1 ZINC000729517767 948404580 /nfs/dbraw/zinc/40/45/80/948404580.db2.gz KUOHZUJPWJNZGW-IBGZPJMESA-N -1 3 373.408 3.909 20 0 FHADHM c1cc(COc2ccc(N[C@@H]3CCCSC3)cc2)cc(-c2nnn[n-]2)c1 ZINC000826516737 948443587 /nfs/dbraw/zinc/44/35/87/948443587.db2.gz YZVGSOQNPFMLRW-QGZVFWFLSA-N -1 3 367.478 3.753 20 0 FHADHM c1cc(COc2ccc(N[C@@H]3CCCSC3)cc2)cc(-c2nn[n-]n2)c1 ZINC000826516737 948443593 /nfs/dbraw/zinc/44/35/93/948443593.db2.gz YZVGSOQNPFMLRW-QGZVFWFLSA-N -1 3 367.478 3.753 20 0 FHADHM CC(=O)Nc1ccc([O-])c(C(=O)N2C[C@H](c3ccc(C)cc3)C[C@@H]2C)c1 ZINC000279087616 948485644 /nfs/dbraw/zinc/48/56/44/948485644.db2.gz UACAIMNECHIMPS-WMLDXEAASA-N -1 3 352.434 3.677 20 0 FHADHM CO[C@H](C[N-]S(=O)(=O)c1ccc(Cl)cc1C(F)(F)F)C(C)(C)C ZINC000466894003 948496221 /nfs/dbraw/zinc/49/62/21/948496221.db2.gz MRQCTBSVBABJGQ-GFCCVEGCSA-N -1 3 373.824 3.698 20 0 FHADHM CC(C)Oc1ccc2ccccc2c1CN1CCC[C@H](c2n[nH]c(=O)[n-]2)C1 ZINC000520650361 948498386 /nfs/dbraw/zinc/49/83/86/948498386.db2.gz TZUPJHDWOITJGB-INIZCTEOSA-N -1 3 366.465 3.830 20 0 FHADHM 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/nfs/dbraw/zinc/85/61/31/598856131.db2.gz KTLHCVDOTUDAIX-UHFFFAOYSA-N -1 3 360.396 3.698 20 0 FHADHM Fc1cccc(C2(CNc3cc(-c4nn[n-]n4)c4ccccc4n3)CC2)c1 ZINC000737666373 598856132 /nfs/dbraw/zinc/85/61/32/598856132.db2.gz KTLHCVDOTUDAIX-UHFFFAOYSA-N -1 3 360.396 3.698 20 0 FHADHM Cc1cc(COc2ccc(-c3nnn[n-]3)cc2Cl)c2ccccc2n1 ZINC000737264930 598892541 /nfs/dbraw/zinc/89/25/41/598892541.db2.gz RCCDQGAJLYRHAZ-UHFFFAOYSA-N -1 3 351.797 3.956 20 0 FHADHM Cc1cc(COc2ccc(-c3nn[n-]n3)cc2Cl)c2ccccc2n1 ZINC000737264930 598892545 /nfs/dbraw/zinc/89/25/45/598892545.db2.gz RCCDQGAJLYRHAZ-UHFFFAOYSA-N -1 3 351.797 3.956 20 0 FHADHM C[C@H](Oc1ccccc1-c1nnn[n-]1)C(=O)OCc1ccc2ccccc2c1 ZINC000736186410 598895386 /nfs/dbraw/zinc/89/53/86/598895386.db2.gz BFAFSIDTOWKGBM-AWEZNQCLSA-N -1 3 374.400 3.531 20 0 FHADHM C[C@H](Oc1ccccc1-c1nn[n-]n1)C(=O)OCc1ccc2ccccc2c1 ZINC000736186410 598895387 /nfs/dbraw/zinc/89/53/87/598895387.db2.gz BFAFSIDTOWKGBM-AWEZNQCLSA-N -1 3 374.400 3.531 20 0 FHADHM CC[C@H]1c2ccccc2CCN1C(=S)Nc1ccccc1-c1nnn[n-]1 ZINC000736406920 598901419 /nfs/dbraw/zinc/90/14/19/598901419.db2.gz NHBXEFLPRIQXOJ-KRWDZBQOSA-N -1 3 364.478 3.573 20 0 FHADHM CC[C@H]1c2ccccc2CCN1C(=S)Nc1ccccc1-c1nn[n-]n1 ZINC000736406920 598901420 /nfs/dbraw/zinc/90/14/20/598901420.db2.gz NHBXEFLPRIQXOJ-KRWDZBQOSA-N -1 3 364.478 3.573 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@@H](C)CC1CCCC1 ZINC000736480003 598903728 /nfs/dbraw/zinc/90/37/28/598903728.db2.gz PEOMEXRDFQSYDU-HNNXBMFYSA-N -1 3 355.486 3.822 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@@H](C)CC1CCCC1 ZINC000736480003 598903729 /nfs/dbraw/zinc/90/37/29/598903729.db2.gz PEOMEXRDFQSYDU-HNNXBMFYSA-N -1 3 355.486 3.822 20 0 FHADHM Cc1ccc(CN(C(=O)Nc2ccc(-c3nnn[n-]3)cc2)C2CC2)cc1C ZINC000737336868 598913637 /nfs/dbraw/zinc/91/36/37/598913637.db2.gz IRJKNXNLBCTEHW-UHFFFAOYSA-N -1 3 362.437 3.680 20 0 FHADHM Cc1ccc(CN(C(=O)Nc2ccc(-c3nn[n-]n3)cc2)C2CC2)cc1C ZINC000737336868 598913639 /nfs/dbraw/zinc/91/36/39/598913639.db2.gz IRJKNXNLBCTEHW-UHFFFAOYSA-N -1 3 362.437 3.680 20 0 FHADHM C[C@@H]1C[C@@H]1c1ccc(CN(c2ncc(-c3nnn[n-]3)cc2Cl)C2CC2)o1 ZINC000736242010 598936694 /nfs/dbraw/zinc/93/66/94/598936694.db2.gz YKSSWDYGXSWPBW-YGRLFVJLSA-N -1 3 370.844 3.801 20 0 FHADHM C[C@@H]1C[C@@H]1c1ccc(CN(c2ncc(-c3nn[n-]n3)cc2Cl)C2CC2)o1 ZINC000736242010 598936697 /nfs/dbraw/zinc/93/66/97/598936697.db2.gz YKSSWDYGXSWPBW-YGRLFVJLSA-N -1 3 370.844 3.801 20 0 FHADHM CC(C)C[C@@H](C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1)c1ccccc1 ZINC000735755584 598939628 /nfs/dbraw/zinc/93/96/28/598939628.db2.gz HEJDABDCHDJNJY-DNVCBOLYSA-N -1 3 363.465 3.874 20 0 FHADHM CC(C)C[C@@H](C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1)c1ccccc1 ZINC000735755584 598939629 /nfs/dbraw/zinc/93/96/29/598939629.db2.gz HEJDABDCHDJNJY-DNVCBOLYSA-N -1 3 363.465 3.874 20 0 FHADHM CC(C)[C@@H]1CCCN(C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)CC1 ZINC000735749046 598965444 /nfs/dbraw/zinc/96/54/44/598965444.db2.gz LJJCWYSENGKRJR-GFCCVEGCSA-N -1 3 362.865 3.810 20 0 FHADHM CC(C)[C@@H]1CCCN(C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)CC1 ZINC000735749046 598965445 /nfs/dbraw/zinc/96/54/45/598965445.db2.gz LJJCWYSENGKRJR-GFCCVEGCSA-N -1 3 362.865 3.810 20 0 FHADHM CC(C)[C@H](CC1CCCCC1)C(=O)NCc1cccc(-c2nnn[n-]2)c1 ZINC000735711915 598987014 /nfs/dbraw/zinc/98/70/14/598987014.db2.gz ZEEIHVTWEAJASD-SFHVURJKSA-N -1 3 355.486 3.726 20 0 FHADHM CC(C)[C@H](CC1CCCCC1)C(=O)NCc1cccc(-c2nn[n-]n2)c1 ZINC000735711915 598987015 /nfs/dbraw/zinc/98/70/15/598987015.db2.gz ZEEIHVTWEAJASD-SFHVURJKSA-N -1 3 355.486 3.726 20 0 FHADHM C[C@H](CCC1CCCCC1)NC(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000735985368 599008063 /nfs/dbraw/zinc/00/80/63/599008063.db2.gz KGFZLKGBDBPRLO-CQSZACIVSA-N -1 3 373.526 3.824 20 0 FHADHM C[C@H](CCC1CCCCC1)NC(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000735985368 599008065 /nfs/dbraw/zinc/00/80/65/599008065.db2.gz KGFZLKGBDBPRLO-CQSZACIVSA-N -1 3 373.526 3.824 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@H]1CCC[C@@H](CC)C1 ZINC000736482148 599013534 /nfs/dbraw/zinc/01/35/34/599013534.db2.gz VHXVEKHCNLTTGS-QAPCUYQASA-N -1 3 370.501 3.757 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@H]1CCC[C@@H](CC)C1 ZINC000736482148 599013536 /nfs/dbraw/zinc/01/35/36/599013536.db2.gz VHXVEKHCNLTTGS-QAPCUYQASA-N -1 3 370.501 3.757 20 0 FHADHM CC(C)C[C@H]1CCCCCN1C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000735795504 599021983 /nfs/dbraw/zinc/02/19/83/599021983.db2.gz NIBROQNUIGGAJH-CQSZACIVSA-N -1 3 360.437 3.828 20 0 FHADHM CC(C)C[C@H]1CCCCCN1C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000735795504 599021984 /nfs/dbraw/zinc/02/19/84/599021984.db2.gz NIBROQNUIGGAJH-CQSZACIVSA-N -1 3 360.437 3.828 20 0 FHADHM CCSCCOC(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736664790 599026689 /nfs/dbraw/zinc/02/66/89/599026689.db2.gz FCTDIHGQVORNDF-UHFFFAOYSA-N -1 3 369.450 3.520 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccnc2ccccc12)c1cccc(-c2nnn[n-]2)c1 ZINC000736153124 599026772 /nfs/dbraw/zinc/02/67/72/599026772.db2.gz QADNEZCHLLSCHA-CMUBDUJZSA-N -1 3 371.400 3.733 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccnc2ccccc12)c1cccc(-c2nn[n-]n2)c1 ZINC000736153124 599026773 /nfs/dbraw/zinc/02/67/73/599026773.db2.gz QADNEZCHLLSCHA-CMUBDUJZSA-N -1 3 371.400 3.733 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccnc2ccccc12)c1cccc(-c2nnn[n-]2)c1 ZINC000736153127 599026993 /nfs/dbraw/zinc/02/69/93/599026993.db2.gz QADNEZCHLLSCHA-HBWSCVEGSA-N -1 3 371.400 3.733 20 0 FHADHM C[C@H](OC(=O)C=Cc1ccnc2ccccc12)c1cccc(-c2nn[n-]n2)c1 ZINC000736153127 599026995 /nfs/dbraw/zinc/02/69/95/599026995.db2.gz QADNEZCHLLSCHA-HBWSCVEGSA-N -1 3 371.400 3.733 20 0 FHADHM C[C@@H]1CN(c2cc(Cl)ccc2-c2nnn[n-]2)C[C@H](c2ccc(F)cc2)O1 ZINC000820769687 599035697 /nfs/dbraw/zinc/03/56/97/599035697.db2.gz VPRNXLOABAUZSY-PIGZYNQJSA-N -1 3 373.819 3.626 20 0 FHADHM C[C@@H]1CN(c2cc(Cl)ccc2-c2nn[n-]n2)C[C@H](c2ccc(F)cc2)O1 ZINC000820769687 599035700 /nfs/dbraw/zinc/03/57/00/599035700.db2.gz VPRNXLOABAUZSY-PIGZYNQJSA-N -1 3 373.819 3.626 20 0 FHADHM C[C@H](Nc1nc(C(F)(F)F)ccc1-c1nnn[n-]1)c1ccc(F)c(F)c1 ZINC000736137532 599038761 /nfs/dbraw/zinc/03/87/61/599038761.db2.gz MWAYOLMLPDPVHY-ZETCQYMHSA-N -1 3 370.285 3.732 20 0 FHADHM C[C@H](Nc1nc(C(F)(F)F)ccc1-c1nn[n-]n1)c1ccc(F)c(F)c1 ZINC000736137532 599038764 /nfs/dbraw/zinc/03/87/64/599038764.db2.gz MWAYOLMLPDPVHY-ZETCQYMHSA-N -1 3 370.285 3.732 20 0 FHADHM CC1(C)[C@H](Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)[C@H]2CCCO[C@@H]21 ZINC000820582905 599043318 /nfs/dbraw/zinc/04/33/18/599043318.db2.gz AOWCEPQABJTLTO-BNOWGMLFSA-N -1 3 367.375 3.501 20 0 FHADHM CC1(C)[C@H](Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)[C@H]2CCCO[C@@H]21 ZINC000820582905 599043319 /nfs/dbraw/zinc/04/33/19/599043319.db2.gz AOWCEPQABJTLTO-BNOWGMLFSA-N -1 3 367.375 3.501 20 0 FHADHM CO[C@H](CNc1ccc(Cl)cc1-c1nnn[n-]1)c1ccc(Cl)cc1 ZINC000821676876 599045467 /nfs/dbraw/zinc/04/54/67/599045467.db2.gz JDZNAEAVBHVUSR-OAHLLOKOSA-N -1 3 364.236 3.973 20 0 FHADHM CO[C@H](CNc1ccc(Cl)cc1-c1nn[n-]n1)c1ccc(Cl)cc1 ZINC000821676876 599045471 /nfs/dbraw/zinc/04/54/71/599045471.db2.gz JDZNAEAVBHVUSR-OAHLLOKOSA-N -1 3 364.236 3.973 20 0 FHADHM CC(C)c1ccc(NC(=O)CSc2ccc(-c3nnn[n-]3)cc2F)cc1 ZINC000735928688 599062392 /nfs/dbraw/zinc/06/23/92/599062392.db2.gz QAJHRPRCTVPOLN-UHFFFAOYSA-N -1 3 371.441 3.860 20 0 FHADHM CC(C)c1ccc(NC(=O)CSc2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000735928688 599062395 /nfs/dbraw/zinc/06/23/95/599062395.db2.gz QAJHRPRCTVPOLN-UHFFFAOYSA-N -1 3 371.441 3.860 20 0 FHADHM C[C@@H](Sc1ccc(-c2nnn[n-]2)cc1F)c1nc(-c2ccccc2)no1 ZINC000736192893 599063338 /nfs/dbraw/zinc/06/33/38/599063338.db2.gz NBHURDGGDUMABI-SNVBAGLBSA-N -1 3 368.397 3.909 20 0 FHADHM C[C@@H](Sc1ccc(-c2nn[n-]n2)cc1F)c1nc(-c2ccccc2)no1 ZINC000736192893 599063342 /nfs/dbraw/zinc/06/33/42/599063342.db2.gz NBHURDGGDUMABI-SNVBAGLBSA-N -1 3 368.397 3.909 20 0 FHADHM C[C@@H](Sc1ccc(-c2nnn[n-]2)cc1F)c1nc2ccccc2c(=O)[nH]1 ZINC000736193931 599065159 /nfs/dbraw/zinc/06/51/59/599065159.db2.gz UYNXENMDDMTLHC-SECBINFHSA-N -1 3 368.397 3.508 20 0 FHADHM C[C@@H](Sc1ccc(-c2nn[n-]n2)cc1F)c1nc2ccccc2c(=O)[nH]1 ZINC000736193931 599065162 /nfs/dbraw/zinc/06/51/62/599065162.db2.gz UYNXENMDDMTLHC-SECBINFHSA-N -1 3 368.397 3.508 20 0 FHADHM CCN(C(=O)[C@H](C)Sc1ccc(-c2nnn[n-]2)cc1F)c1ccccc1 ZINC000736501173 599067597 /nfs/dbraw/zinc/06/75/97/599067597.db2.gz ABTGLKZNWRZABS-LBPRGKRZSA-N -1 3 371.441 3.540 20 0 FHADHM CCN(C(=O)[C@H](C)Sc1ccc(-c2nn[n-]n2)cc1F)c1ccccc1 ZINC000736501173 599067600 /nfs/dbraw/zinc/06/76/00/599067600.db2.gz ABTGLKZNWRZABS-LBPRGKRZSA-N -1 3 371.441 3.540 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@@H]1CCC[C@H](C)C1 ZINC000735829621 599069713 /nfs/dbraw/zinc/06/97/13/599069713.db2.gz MLFPSFRQRBRAQX-MAUKXSAKSA-N -1 3 355.486 3.678 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@@H]1CCC[C@H](C)C1 ZINC000735829621 599069715 /nfs/dbraw/zinc/06/97/15/599069715.db2.gz MLFPSFRQRBRAQX-MAUKXSAKSA-N -1 3 355.486 3.678 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@@H]1CCC[C@@H](C)C1 ZINC000735829620 599069747 /nfs/dbraw/zinc/06/97/47/599069747.db2.gz MLFPSFRQRBRAQX-CRAIPNDOSA-N -1 3 355.486 3.678 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@@H]1CCC[C@@H](C)C1 ZINC000735829620 599069750 /nfs/dbraw/zinc/06/97/50/599069750.db2.gz MLFPSFRQRBRAQX-CRAIPNDOSA-N -1 3 355.486 3.678 20 0 FHADHM Cc1sc2nc(C)nc(NCc3cc(-c4nnn[n-]4)ccc3F)c2c1C ZINC000822453437 599070263 /nfs/dbraw/zinc/07/02/63/599070263.db2.gz INBJTDOVKUVCOP-UHFFFAOYSA-N -1 3 369.429 3.548 20 0 FHADHM Cc1sc2nc(C)nc(NCc3cc(-c4nn[n-]n4)ccc3F)c2c1C ZINC000822453437 599070265 /nfs/dbraw/zinc/07/02/65/599070265.db2.gz INBJTDOVKUVCOP-UHFFFAOYSA-N -1 3 369.429 3.548 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@@H]1C[C@@H]1C1CCCCC1 ZINC000736481158 599070591 /nfs/dbraw/zinc/07/05/91/599070591.db2.gz UYCSZANLFZUQQQ-RTBURBONSA-N -1 3 367.497 3.822 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@@H]1C[C@@H]1C1CCCCC1 ZINC000736481158 599070594 /nfs/dbraw/zinc/07/05/94/599070594.db2.gz UYCSZANLFZUQQQ-RTBURBONSA-N -1 3 367.497 3.822 20 0 FHADHM Cc1ccc(N(C)C(C)C)c(C(=O)Nc2cc(-c3nnn[n-]3)ccc2C)c1 ZINC000737346092 599074192 /nfs/dbraw/zinc/07/41/92/599074192.db2.gz DKGYFEMFMIOESP-UHFFFAOYSA-N -1 3 364.453 3.580 20 0 FHADHM Cc1ccc(N(C)C(C)C)c(C(=O)Nc2cc(-c3nn[n-]n3)ccc2C)c1 ZINC000737346092 599074195 /nfs/dbraw/zinc/07/41/95/599074195.db2.gz DKGYFEMFMIOESP-UHFFFAOYSA-N -1 3 364.453 3.580 20 0 FHADHM Fc1ccc(N[C@H]2COc3c2ccc(Cl)c3Cl)c(-c2nnn[n-]2)c1 ZINC000822778992 599076453 /nfs/dbraw/zinc/07/64/53/599076453.db2.gz QRYHITJSLYZADW-LBPRGKRZSA-N -1 3 366.183 3.858 20 0 FHADHM Fc1ccc(N[C@H]2COc3c2ccc(Cl)c3Cl)c(-c2nn[n-]n2)c1 ZINC000822778992 599076455 /nfs/dbraw/zinc/07/64/55/599076455.db2.gz QRYHITJSLYZADW-LBPRGKRZSA-N -1 3 366.183 3.858 20 0 FHADHM C[C@@H](NC(=O)CCCCOc1cccc(-c2nnn[n-]2)c1)C1CCCCC1 ZINC000736104086 599079048 /nfs/dbraw/zinc/07/90/48/599079048.db2.gz ZEAXNFBXXZZJRL-OAHLLOKOSA-N -1 3 371.485 3.501 20 0 FHADHM C[C@@H](NC(=O)CCCCOc1cccc(-c2nn[n-]n2)c1)C1CCCCC1 ZINC000736104086 599079051 /nfs/dbraw/zinc/07/90/51/599079051.db2.gz ZEAXNFBXXZZJRL-OAHLLOKOSA-N -1 3 371.485 3.501 20 0 FHADHM CC(C)(C)OC(=O)c1ccc(CNc2cccc(F)c2-c2nnn[n-]2)cc1 ZINC000819946568 599082559 /nfs/dbraw/zinc/08/25/59/599082559.db2.gz OGTWLHJKHHRDEX-UHFFFAOYSA-N -1 3 369.400 3.573 20 0 FHADHM CC(C)(C)OC(=O)c1ccc(CNc2cccc(F)c2-c2nn[n-]n2)cc1 ZINC000819946568 599082562 /nfs/dbraw/zinc/08/25/62/599082562.db2.gz OGTWLHJKHHRDEX-UHFFFAOYSA-N -1 3 369.400 3.573 20 0 FHADHM Cc1ccc([C@@H]2CCCCN2C(=O)C=Cc2ccccc2-c2nnn[n-]2)o1 ZINC000737330396 599083009 /nfs/dbraw/zinc/08/30/09/599083009.db2.gz NLGODTAVNZTGIA-LUJNMSEFSA-N -1 3 363.421 3.535 20 0 FHADHM Cc1ccc([C@@H]2CCCCN2C(=O)C=Cc2ccccc2-c2nn[n-]n2)o1 ZINC000737330396 599083013 /nfs/dbraw/zinc/08/30/13/599083013.db2.gz NLGODTAVNZTGIA-LUJNMSEFSA-N -1 3 363.421 3.535 20 0 FHADHM CCC(CC)(CNc1nc(C(F)(F)F)ccc1-c1nnn[n-]1)SC ZINC000820887917 599085441 /nfs/dbraw/zinc/08/54/41/599085441.db2.gz XKZXLJWSQQZVAA-UHFFFAOYSA-N -1 3 360.409 3.614 20 0 FHADHM CCC(CC)(CNc1nc(C(F)(F)F)ccc1-c1nn[n-]n1)SC ZINC000820887917 599085443 /nfs/dbraw/zinc/08/54/43/599085443.db2.gz XKZXLJWSQQZVAA-UHFFFAOYSA-N -1 3 360.409 3.614 20 0 FHADHM C[C@@H](CNc1ccc(-c2nn[n-]n2)cc1)Oc1ccc(Br)cc1 ZINC000820276204 599091695 /nfs/dbraw/zinc/09/16/95/599091695.db2.gz UOKGFVIKQYTUAO-NSHDSACASA-N -1 3 374.242 3.509 20 0 FHADHM Fc1ccc(CSC[C@@H]2OCCc3ccccc32)c(-c2nnn[n-]2)c1 ZINC000737648124 599100404 /nfs/dbraw/zinc/10/04/04/599100404.db2.gz GAHJPYCPALTTMK-KRWDZBQOSA-N -1 3 356.426 3.553 20 0 FHADHM Fc1ccc(CSC[C@@H]2OCCc3ccccc32)c(-c2nn[n-]n2)c1 ZINC000737648124 599100405 /nfs/dbraw/zinc/10/04/05/599100405.db2.gz GAHJPYCPALTTMK-KRWDZBQOSA-N -1 3 356.426 3.553 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1CSC[C@H]1OCCc2ccccc21 ZINC000737639492 599102644 /nfs/dbraw/zinc/10/26/44/599102644.db2.gz DGFQMERBZPXRHK-QGZVFWFLSA-N -1 3 356.426 3.553 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CSC[C@H]1OCCc2ccccc21 ZINC000737639492 599102647 /nfs/dbraw/zinc/10/26/47/599102647.db2.gz DGFQMERBZPXRHK-QGZVFWFLSA-N -1 3 356.426 3.553 20 0 FHADHM Cc1ccc([C@H]2OCCC[C@@H]2CNc2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000822233379 599108237 /nfs/dbraw/zinc/10/82/37/599108237.db2.gz NRKUJBKVUCUQSX-VQIMIIECSA-N -1 3 367.428 3.894 20 0 FHADHM COc1ccc(-c2nc(CSc3ccccc3-c3nnn[n-]3)co2)cc1 ZINC000737055976 599110068 /nfs/dbraw/zinc/11/00/68/599110068.db2.gz JLWDEALRHIEFJZ-UHFFFAOYSA-N -1 3 365.418 3.823 20 0 FHADHM COc1ccc(-c2nc(CSc3ccccc3-c3nn[n-]n3)co2)cc1 ZINC000737055976 599110069 /nfs/dbraw/zinc/11/00/69/599110069.db2.gz JLWDEALRHIEFJZ-UHFFFAOYSA-N -1 3 365.418 3.823 20 0 FHADHM Cc1cccc2oc(CCNc3ccc(-c4nnn[n-]4)c(Cl)c3)nc21 ZINC000822340973 599111318 /nfs/dbraw/zinc/11/13/18/599111318.db2.gz PGYVYIPHWCIUJR-UHFFFAOYSA-N -1 3 354.801 3.624 20 0 FHADHM Cc1cccc2oc(CCNc3ccc(-c4nn[n-]n4)c(Cl)c3)nc21 ZINC000822340973 599111319 /nfs/dbraw/zinc/11/13/19/599111319.db2.gz PGYVYIPHWCIUJR-UHFFFAOYSA-N -1 3 354.801 3.624 20 0 FHADHM C[C@@H](Sc1ccc(-c2nnn[n-]2)cc1F)c1nnc(-c2cccs2)o1 ZINC000820548487 599126929 /nfs/dbraw/zinc/12/69/29/599126929.db2.gz ASOSSPMUPGSSHV-MRVPVSSYSA-N -1 3 374.426 3.971 20 0 FHADHM C[C@@H](Sc1ccc(-c2nn[n-]n2)cc1F)c1nnc(-c2cccs2)o1 ZINC000820548487 599126931 /nfs/dbraw/zinc/12/69/31/599126931.db2.gz ASOSSPMUPGSSHV-MRVPVSSYSA-N -1 3 374.426 3.971 20 0 FHADHM Cc1nc(C2CCCC2)sc1C(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000463615020 599133994 /nfs/dbraw/zinc/13/39/94/599133994.db2.gz UZKKZDAUHSNFNL-UHFFFAOYSA-N -1 3 354.439 3.542 20 0 FHADHM Cc1nc(C2CCCC2)sc1C(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000463615020 599133996 /nfs/dbraw/zinc/13/39/96/599133996.db2.gz UZKKZDAUHSNFNL-UHFFFAOYSA-N -1 3 354.439 3.542 20 0 FHADHM Cc1cc2cc(C(=O)N(C)Cc3ccc(-c4nnn[n-]4)cc3)oc2cc1C ZINC000822212728 599140484 /nfs/dbraw/zinc/14/04/84/599140484.db2.gz FGLUNFMJSJKPOG-UHFFFAOYSA-N -1 3 361.405 3.502 20 0 FHADHM Cc1cc2cc(C(=O)N(C)Cc3ccc(-c4nn[n-]n4)cc3)oc2cc1C ZINC000822212728 599140486 /nfs/dbraw/zinc/14/04/86/599140486.db2.gz FGLUNFMJSJKPOG-UHFFFAOYSA-N -1 3 361.405 3.502 20 0 FHADHM CCN(C(=O)c1cc(C)cc(F)c1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821161188 599144311 /nfs/dbraw/zinc/14/43/11/599144311.db2.gz WAMSUINXIFJUPG-ZDUSSCGKSA-N -1 3 353.401 3.538 20 0 FHADHM CCN(C(=O)c1cc(C)cc(F)c1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821161188 599144313 /nfs/dbraw/zinc/14/43/13/599144313.db2.gz WAMSUINXIFJUPG-ZDUSSCGKSA-N -1 3 353.401 3.538 20 0 FHADHM CCN(C(=O)c1cccc2cc[nH]c21)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000821160374 599144726 /nfs/dbraw/zinc/14/47/26/599144726.db2.gz JUFNACLMFKKEPI-CYBMUJFWSA-N -1 3 360.421 3.571 20 0 FHADHM CCN(C(=O)c1cccc2cc[nH]c21)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000821160374 599144728 /nfs/dbraw/zinc/14/47/28/599144728.db2.gz JUFNACLMFKKEPI-CYBMUJFWSA-N -1 3 360.421 3.571 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)CCCC1CCCC1 ZINC000820116309 599146192 /nfs/dbraw/zinc/14/61/92/599146192.db2.gz GRJMFXIBKFYDJX-UHFFFAOYSA-N -1 3 355.486 3.964 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)CCCC1CCCC1 ZINC000820116309 599146195 /nfs/dbraw/zinc/14/61/95/599146195.db2.gz GRJMFXIBKFYDJX-UHFFFAOYSA-N -1 3 355.486 3.964 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@H](C)CCc1cccc(F)c1 ZINC000822216786 599149537 /nfs/dbraw/zinc/14/95/37/599149537.db2.gz ZISCIDXXZWOSRZ-CYBMUJFWSA-N -1 3 353.401 3.522 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@H](C)CCc1cccc(F)c1 ZINC000822216786 599149538 /nfs/dbraw/zinc/14/95/38/599149538.db2.gz ZISCIDXXZWOSRZ-CYBMUJFWSA-N -1 3 353.401 3.522 20 0 FHADHM CC(C)(C)[C@@H]1CCCN(C(=S)Nc2ccccc2-c2nnn[n-]2)CC1 ZINC000735594787 599157416 /nfs/dbraw/zinc/15/74/16/599157416.db2.gz CFFSXDUBANLHOO-CYBMUJFWSA-N -1 3 358.515 3.712 20 0 FHADHM CC(C)(C)[C@@H]1CCCN(C(=S)Nc2ccccc2-c2nn[n-]n2)CC1 ZINC000735594787 599157419 /nfs/dbraw/zinc/15/74/19/599157419.db2.gz CFFSXDUBANLHOO-CYBMUJFWSA-N -1 3 358.515 3.712 20 0 FHADHM Cc1sc(NC(=O)C[C@H](C)c2ccccc2C)c(-c2nnn[n-]2)c1C ZINC000737419154 599158919 /nfs/dbraw/zinc/15/89/19/599158919.db2.gz CYDZBFVXYZEDRH-NSHDSACASA-N -1 3 355.467 3.986 20 0 FHADHM Cc1sc(NC(=O)C[C@H](C)c2ccccc2C)c(-c2nn[n-]n2)c1C ZINC000737419154 599158921 /nfs/dbraw/zinc/15/89/21/599158921.db2.gz CYDZBFVXYZEDRH-NSHDSACASA-N -1 3 355.467 3.986 20 0 FHADHM C[C@H](C(=O)Nc1ccccc1-c1nnn[n-]1)c1ccccc1C(F)(F)F ZINC000735560211 599177194 /nfs/dbraw/zinc/17/71/94/599177194.db2.gz BUMKLZWEBZKGSS-JTQLQIEISA-N -1 3 361.327 3.628 20 0 FHADHM C[C@H](C(=O)Nc1ccccc1-c1nn[n-]n1)c1ccccc1C(F)(F)F ZINC000735560211 599177197 /nfs/dbraw/zinc/17/71/97/599177197.db2.gz BUMKLZWEBZKGSS-JTQLQIEISA-N -1 3 361.327 3.628 20 0 FHADHM CC(C)(C)C1CCN(C(=O)Nc2cc(-c3nnn[n-]3)cn2C(C)(C)C)CC1 ZINC000735598373 599180246 /nfs/dbraw/zinc/18/02/46/599180246.db2.gz YZPWVYSUSCOHER-UHFFFAOYSA-N -1 3 373.505 3.713 20 0 FHADHM CC(C)(C)C1CCN(C(=O)Nc2cc(-c3nn[n-]n3)cn2C(C)(C)C)CC1 ZINC000735598373 599180247 /nfs/dbraw/zinc/18/02/47/599180247.db2.gz YZPWVYSUSCOHER-UHFFFAOYSA-N -1 3 373.505 3.713 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@H](C)c1cccc(F)c1 ZINC000736479976 599181724 /nfs/dbraw/zinc/18/17/24/599181724.db2.gz OIJZAROBZPNYHU-CQSZACIVSA-N -1 3 367.428 3.548 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@H](C)c1cccc(F)c1 ZINC000736479976 599181726 /nfs/dbraw/zinc/18/17/26/599181726.db2.gz OIJZAROBZPNYHU-CQSZACIVSA-N -1 3 367.428 3.548 20 0 FHADHM CC(C)(C)[C@H]1CCCN(C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)CC1 ZINC000735596538 599187396 /nfs/dbraw/zinc/18/73/96/599187396.db2.gz KAWKNSOOTVMPJF-LBPRGKRZSA-N -1 3 360.437 3.686 20 0 FHADHM CC(C)(C)[C@H]1CCCN(C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)CC1 ZINC000735596538 599187397 /nfs/dbraw/zinc/18/73/97/599187397.db2.gz KAWKNSOOTVMPJF-LBPRGKRZSA-N -1 3 360.437 3.686 20 0 FHADHM O=C(Nc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1)C1CC=CC1 ZINC000823356862 599219717 /nfs/dbraw/zinc/21/97/17/599219717.db2.gz PMSBGMDIMWAMFH-UHFFFAOYSA-N -1 3 365.368 3.703 20 0 FHADHM O=C(Nc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1)C1CC=CC1 ZINC000823356862 599219719 /nfs/dbraw/zinc/21/97/19/599219719.db2.gz PMSBGMDIMWAMFH-UHFFFAOYSA-N -1 3 365.368 3.703 20 0 FHADHM CCCCC(=O)Nc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1 ZINC000821040519 599220789 /nfs/dbraw/zinc/22/07/89/599220789.db2.gz MTBPTJLYCLXMIB-UHFFFAOYSA-N -1 3 355.373 3.927 20 0 FHADHM CCCCC(=O)Nc1ccc(Oc2ccccc2-c2nn[n-]n2)c(F)c1 ZINC000821040519 599220791 /nfs/dbraw/zinc/22/07/91/599220791.db2.gz MTBPTJLYCLXMIB-UHFFFAOYSA-N -1 3 355.373 3.927 20 0 FHADHM C[C@@H]1C[C@H]1[C@@H](NC(=O)c1cccc(-c2nnn[n-]2)c1)c1ccc(Cl)cc1 ZINC000736231689 599225982 /nfs/dbraw/zinc/22/59/82/599225982.db2.gz CCTHAMJFLBLPSV-LQAWEQHXSA-N -1 3 367.840 3.647 20 0 FHADHM C[C@@H]1C[C@H]1[C@@H](NC(=O)c1cccc(-c2nn[n-]n2)c1)c1ccc(Cl)cc1 ZINC000736231689 599225984 /nfs/dbraw/zinc/22/59/84/599225984.db2.gz CCTHAMJFLBLPSV-LQAWEQHXSA-N -1 3 367.840 3.647 20 0 FHADHM C[C@H](CCSc1ccccc1)OC(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000820247738 607261750 /nfs/dbraw/zinc/26/17/50/607261750.db2.gz AEGBVMXPVSAJPE-LLVKDONJSA-N -1 3 360.464 3.656 20 0 FHADHM C[C@H](CCSc1ccccc1)OC(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000820247738 607261751 /nfs/dbraw/zinc/26/17/51/607261751.db2.gz AEGBVMXPVSAJPE-LLVKDONJSA-N -1 3 360.464 3.656 20 0 FHADHM C[C@H](NC(=O)Nc1ccc2ccccc2c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820380251 599235270 /nfs/dbraw/zinc/23/52/70/599235270.db2.gz ODZOLMGNPRQMPB-ZDUSSCGKSA-N -1 3 358.405 3.903 20 0 FHADHM C[C@H](NC(=O)Nc1ccc2ccccc2c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820380251 599235272 /nfs/dbraw/zinc/23/52/72/599235272.db2.gz ODZOLMGNPRQMPB-ZDUSSCGKSA-N -1 3 358.405 3.903 20 0 FHADHM Cc1cc(C)c(NC(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c(C)c1 ZINC000822194254 599235925 /nfs/dbraw/zinc/23/59/25/599235925.db2.gz PJNNGMJMYDFHCM-CQSZACIVSA-N -1 3 350.426 3.675 20 0 FHADHM Cc1cc(C)c(NC(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c(C)c1 ZINC000822194254 599235927 /nfs/dbraw/zinc/23/59/27/599235927.db2.gz PJNNGMJMYDFHCM-CQSZACIVSA-N -1 3 350.426 3.675 20 0 FHADHM Cc1c(NC(=O)CSCc2ccc(Cl)cc2)cccc1-c1nnn[n-]1 ZINC000822076728 607269891 /nfs/dbraw/zinc/26/98/91/607269891.db2.gz RIHPVGJEFPDTHP-UHFFFAOYSA-N -1 3 373.869 3.700 20 0 FHADHM Cc1c(NC(=O)CSCc2ccc(Cl)cc2)cccc1-c1nn[n-]n1 ZINC000822076728 607269892 /nfs/dbraw/zinc/26/98/92/607269892.db2.gz RIHPVGJEFPDTHP-UHFFFAOYSA-N -1 3 373.869 3.700 20 0 FHADHM Cc1c(NC(=O)Cc2cc(Cl)ccc2Cl)cccc1-c1nnn[n-]1 ZINC000822075398 607269116 /nfs/dbraw/zinc/26/91/16/607269116.db2.gz DRMGCKDSUNRTNV-UHFFFAOYSA-N -1 3 362.220 3.663 20 0 FHADHM Cc1c(NC(=O)Cc2cc(Cl)ccc2Cl)cccc1-c1nn[n-]n1 ZINC000822075398 607269117 /nfs/dbraw/zinc/26/91/17/607269117.db2.gz DRMGCKDSUNRTNV-UHFFFAOYSA-N -1 3 362.220 3.663 20 0 FHADHM Cc1c(NC(=O)c2ccc3ccc(Cl)cc3n2)cccc1-c1nnn[n-]1 ZINC000822108432 607269131 /nfs/dbraw/zinc/26/91/31/607269131.db2.gz JOTUZKAUIUSNHL-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1c(NC(=O)c2ccc3ccc(Cl)cc3n2)cccc1-c1nn[n-]n1 ZINC000822108432 607269132 /nfs/dbraw/zinc/26/91/32/607269132.db2.gz JOTUZKAUIUSNHL-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nnn[n-]2)c1)c1cc2cc(F)ccc2o1 ZINC000738162454 599247299 /nfs/dbraw/zinc/24/72/99/599247299.db2.gz FWGXTECBWXQCJC-UHFFFAOYSA-N -1 3 357.732 3.658 20 0 FHADHM O=C(Nc1ccc(Cl)c(-c2nn[n-]n2)c1)c1cc2cc(F)ccc2o1 ZINC000738162454 599247300 /nfs/dbraw/zinc/24/73/00/599247300.db2.gz FWGXTECBWXQCJC-UHFFFAOYSA-N -1 3 357.732 3.658 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(Cl)c1)N1CCC(C2CCCC2)CC1 ZINC000823303721 599248868 /nfs/dbraw/zinc/24/88/68/599248868.db2.gz SIPLFLJIKKPZLP-UHFFFAOYSA-N -1 3 374.876 3.954 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(Cl)c1)N1CCC(C2CCCC2)CC1 ZINC000823303721 599248870 /nfs/dbraw/zinc/24/88/70/599248870.db2.gz SIPLFLJIKKPZLP-UHFFFAOYSA-N -1 3 374.876 3.954 20 0 FHADHM CCC[C@@]1(C)CCCN(C(=O)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)C1 ZINC000821028638 599249954 /nfs/dbraw/zinc/24/99/54/599249954.db2.gz XTDJWJGDMUACAT-KRWDZBQOSA-N -1 3 362.865 3.954 20 0 FHADHM CCC[C@@]1(C)CCCN(C(=O)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)C1 ZINC000821028638 599249957 /nfs/dbraw/zinc/24/99/57/599249957.db2.gz XTDJWJGDMUACAT-KRWDZBQOSA-N -1 3 362.865 3.954 20 0 FHADHM Cc1c(NC(=O)N(C)[C@H](C)c2ccc(F)cc2)cccc1-c1nnn[n-]1 ZINC000822075379 607281272 /nfs/dbraw/zinc/28/12/72/607281272.db2.gz CVJAJHFWSCRCQN-GFCCVEGCSA-N -1 3 354.389 3.539 20 0 FHADHM Cc1c(NC(=O)N(C)[C@H](C)c2ccc(F)cc2)cccc1-c1nn[n-]n1 ZINC000822075379 607281273 /nfs/dbraw/zinc/28/12/73/607281273.db2.gz CVJAJHFWSCRCQN-GFCCVEGCSA-N -1 3 354.389 3.539 20 0 FHADHM Cc1cccc(C(C)(C)NC(=O)Nc2cccc(-c3nnn[n-]3)c2C)c1 ZINC000822288778 607282779 /nfs/dbraw/zinc/28/27/79/607282779.db2.gz JJXVMXDGFKTNNA-UHFFFAOYSA-N -1 3 350.426 3.540 20 0 FHADHM Cc1cccc(C(C)(C)NC(=O)Nc2cccc(-c3nn[n-]n3)c2C)c1 ZINC000822288778 607282780 /nfs/dbraw/zinc/28/27/80/607282780.db2.gz JJXVMXDGFKTNNA-UHFFFAOYSA-N -1 3 350.426 3.540 20 0 FHADHM Cc1cc(F)cc2c1ncc(-c1nnn[n-]1)c2N(C)Cc1ccc(F)cc1 ZINC000737265063 599255997 /nfs/dbraw/zinc/25/59/97/599255997.db2.gz WVTPQCIEYCKWPC-UHFFFAOYSA-N -1 3 366.375 3.638 20 0 FHADHM Cc1cc(F)cc2c1ncc(-c1nn[n-]n1)c2N(C)Cc1ccc(F)cc1 ZINC000737265063 599255999 /nfs/dbraw/zinc/25/59/99/599255999.db2.gz WVTPQCIEYCKWPC-UHFFFAOYSA-N -1 3 366.375 3.638 20 0 FHADHM Cc1c(NC(=O)N[C@H](c2ccc(F)cc2)C(C)C)cccc1-c1nnn[n-]1 ZINC000822092647 607284140 /nfs/dbraw/zinc/28/41/40/607284140.db2.gz YELAUUDXEHNNIT-KRWDZBQOSA-N -1 3 368.416 3.833 20 0 FHADHM Cc1c(NC(=O)N[C@H](c2ccc(F)cc2)C(C)C)cccc1-c1nn[n-]n1 ZINC000822092647 607284141 /nfs/dbraw/zinc/28/41/41/607284141.db2.gz YELAUUDXEHNNIT-KRWDZBQOSA-N -1 3 368.416 3.833 20 0 FHADHM Cc1c(NC(=O)NCc2ccc3ccccc3c2)cccc1-c1nnn[n-]1 ZINC000822105873 607284170 /nfs/dbraw/zinc/28/41/70/607284170.db2.gz XSMKRNCKPQNUSP-UHFFFAOYSA-N -1 3 358.405 3.650 20 0 FHADHM Cc1c(NC(=O)NCc2ccc3ccccc3c2)cccc1-c1nn[n-]n1 ZINC000822105873 607284171 /nfs/dbraw/zinc/28/41/71/607284171.db2.gz XSMKRNCKPQNUSP-UHFFFAOYSA-N -1 3 358.405 3.650 20 0 FHADHM CC[C@@H](NC(=O)Nc1cccc(-c2nnn[n-]2)c1C)c1ccc(C)cc1 ZINC000820919461 607284597 /nfs/dbraw/zinc/28/45/97/607284597.db2.gz CHFFZSFBBQOYTN-MRXNPFEDSA-N -1 3 350.426 3.756 20 0 FHADHM CC[C@@H](NC(=O)Nc1cccc(-c2nn[n-]n2)c1C)c1ccc(C)cc1 ZINC000820919461 607284598 /nfs/dbraw/zinc/28/45/98/607284598.db2.gz CHFFZSFBBQOYTN-MRXNPFEDSA-N -1 3 350.426 3.756 20 0 FHADHM CSc1cc(C)ccc1CNC(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000821979807 607285446 /nfs/dbraw/zinc/28/54/46/607285446.db2.gz YFHRFJBBTKCAGX-UHFFFAOYSA-N -1 3 368.466 3.527 20 0 FHADHM CSc1cc(C)ccc1CNC(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000821979807 607285447 /nfs/dbraw/zinc/28/54/47/607285447.db2.gz YFHRFJBBTKCAGX-UHFFFAOYSA-N -1 3 368.466 3.527 20 0 FHADHM Cc1c(NC(=O)N2C[C@@H](c3ccccc3)C[C@@H]2C)cccc1-c1nnn[n-]1 ZINC000822085166 607285822 /nfs/dbraw/zinc/28/58/22/607285822.db2.gz WPTICRQEOLBCJA-BBRMVZONSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1c(NC(=O)N2C[C@@H](c3ccccc3)C[C@@H]2C)cccc1-c1nn[n-]n1 ZINC000822085166 607285823 /nfs/dbraw/zinc/28/58/23/607285823.db2.gz WPTICRQEOLBCJA-BBRMVZONSA-N -1 3 362.437 3.585 20 0 FHADHM Cc1c(NC(=O)N(Cc2ccccc2F)C2CC2)cccc1-c1nnn[n-]1 ZINC000822084306 607287181 /nfs/dbraw/zinc/28/71/81/607287181.db2.gz IGHKLFLJBYJNTH-UHFFFAOYSA-N -1 3 366.400 3.511 20 0 FHADHM Cc1c(NC(=O)N(Cc2ccccc2F)C2CC2)cccc1-c1nn[n-]n1 ZINC000822084306 607287182 /nfs/dbraw/zinc/28/71/82/607287182.db2.gz IGHKLFLJBYJNTH-UHFFFAOYSA-N -1 3 366.400 3.511 20 0 FHADHM C[C@H](NC(=O)c1cccc(-c2nnn[n-]2)c1)c1cccc(Cl)c1Cl ZINC000736123152 599261649 /nfs/dbraw/zinc/26/16/49/599261649.db2.gz OFGOKJHCBALIND-VIFPVBQESA-N -1 3 362.220 3.665 20 0 FHADHM C[C@H](NC(=O)c1cccc(-c2nn[n-]n2)c1)c1cccc(Cl)c1Cl ZINC000736123152 599261650 /nfs/dbraw/zinc/26/16/50/599261650.db2.gz OFGOKJHCBALIND-VIFPVBQESA-N -1 3 362.220 3.665 20 0 FHADHM C[C@@H](NC(=O)c1sccc1-c1nnn[n-]1)c1cccc(Cl)c1Cl ZINC000736124919 599261766 /nfs/dbraw/zinc/26/17/66/599261766.db2.gz IWRUWFFDSJVSHT-SSDOTTSWSA-N -1 3 368.249 3.726 20 0 FHADHM C[C@@H](NC(=O)c1sccc1-c1nn[n-]n1)c1cccc(Cl)c1Cl ZINC000736124919 599261768 /nfs/dbraw/zinc/26/17/68/599261768.db2.gz IWRUWFFDSJVSHT-SSDOTTSWSA-N -1 3 368.249 3.726 20 0 FHADHM CN(Cc1nc2ccccc2s1)c1c(-c2nnn[n-]2)cnc2ccccc21 ZINC000736832033 599259494 /nfs/dbraw/zinc/25/94/94/599259494.db2.gz YAAJEVPLGBLUHM-UHFFFAOYSA-N -1 3 373.445 3.661 20 0 FHADHM CN(Cc1nc2ccccc2s1)c1c(-c2nn[n-]n2)cnc2ccccc21 ZINC000736832033 599259495 /nfs/dbraw/zinc/25/94/95/599259495.db2.gz YAAJEVPLGBLUHM-UHFFFAOYSA-N -1 3 373.445 3.661 20 0 FHADHM Cc1c2cc(F)ccc2oc1C(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000822115645 607295194 /nfs/dbraw/zinc/29/51/94/607295194.db2.gz GXRXRBLMXABFJL-UHFFFAOYSA-N -1 3 351.341 3.621 20 0 FHADHM Cc1c2cc(F)ccc2oc1C(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000822115645 607295195 /nfs/dbraw/zinc/29/51/95/607295195.db2.gz GXRXRBLMXABFJL-UHFFFAOYSA-N -1 3 351.341 3.621 20 0 FHADHM Cc1nc(-c2ccccc2)ccc1C(=O)Nc1cccc(-c2nnn[n-]2)c1C ZINC000822420025 607297644 /nfs/dbraw/zinc/29/76/44/607297644.db2.gz YOLRORXZKICVEA-UHFFFAOYSA-N -1 3 370.416 3.798 20 0 FHADHM Cc1nc(-c2ccccc2)ccc1C(=O)Nc1cccc(-c2nn[n-]n2)c1C ZINC000822420025 607297645 /nfs/dbraw/zinc/29/76/45/607297645.db2.gz YOLRORXZKICVEA-UHFFFAOYSA-N -1 3 370.416 3.798 20 0 FHADHM O[C@H]1CCCC[C@H]1CCCNc1ccc(-c2nn[n-]n2)cc1C(F)(F)F ZINC000823706783 607306509 /nfs/dbraw/zinc/30/65/09/607306509.db2.gz PCMFXLOSQQTYLZ-NHYWBVRUSA-N -1 3 369.391 3.629 20 0 FHADHM C[C@@H](NC(=O)Nc1cccc(-n2cccc2)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820380113 599276171 /nfs/dbraw/zinc/27/61/71/599276171.db2.gz LOKPYAQTERUOSC-CQSZACIVSA-N -1 3 373.420 3.540 20 0 FHADHM C[C@@H](NC(=O)Nc1cccc(-n2cccc2)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820380113 599276172 /nfs/dbraw/zinc/27/61/72/599276172.db2.gz LOKPYAQTERUOSC-CQSZACIVSA-N -1 3 373.420 3.540 20 0 FHADHM Cc1c(NC(=O)C(F)(F)c2cccc(Cl)c2)cccc1-c1nnn[n-]1 ZINC000822060738 607321001 /nfs/dbraw/zinc/32/10/01/607321001.db2.gz IPOXNUHUPQSVSU-UHFFFAOYSA-N -1 3 363.755 3.559 20 0 FHADHM Cc1c(NC(=O)C(F)(F)c2cccc(Cl)c2)cccc1-c1nn[n-]n1 ZINC000822060738 607321002 /nfs/dbraw/zinc/32/10/02/607321002.db2.gz IPOXNUHUPQSVSU-UHFFFAOYSA-N -1 3 363.755 3.559 20 0 FHADHM Cc1c(NC(=O)c2cc3ccccc3c(Cl)n2)cccc1-c1nnn[n-]1 ZINC000822110152 607321304 /nfs/dbraw/zinc/32/13/04/607321304.db2.gz XRMUROATEXHRIJ-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM Cc1c(NC(=O)c2cc3ccccc3c(Cl)n2)cccc1-c1nn[n-]n1 ZINC000822110152 607321305 /nfs/dbraw/zinc/32/13/05/607321305.db2.gz XRMUROATEXHRIJ-UHFFFAOYSA-N -1 3 364.796 3.629 20 0 FHADHM O=C(c1ccc(-c2nnn[n-]2)cc1)N1CCCC[C@H]1c1ccc(F)cc1F ZINC000823478719 607321346 /nfs/dbraw/zinc/32/13/46/607321346.db2.gz QDFAOCSPPDDGDN-KRWDZBQOSA-N -1 3 369.375 3.512 20 0 FHADHM O=C(c1ccc(-c2nn[n-]n2)cc1)N1CCCC[C@H]1c1ccc(F)cc1F ZINC000823478719 607321347 /nfs/dbraw/zinc/32/13/47/607321347.db2.gz QDFAOCSPPDDGDN-KRWDZBQOSA-N -1 3 369.375 3.512 20 0 FHADHM Cc1c(NC(=O)c2cccc(Oc3ccncc3)c2)cccc1-c1nnn[n-]1 ZINC000822108368 607321885 /nfs/dbraw/zinc/32/18/85/607321885.db2.gz IKRGCPFKOATCKZ-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1c(NC(=O)c2cccc(Oc3ccncc3)c2)cccc1-c1nn[n-]n1 ZINC000822108368 607321886 /nfs/dbraw/zinc/32/18/86/607321886.db2.gz IKRGCPFKOATCKZ-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM C[C@H](Cc1nc2ccccc2s1)Nc1cccc(F)c1-c1nnn[n-]1 ZINC000820307515 607329159 /nfs/dbraw/zinc/32/91/59/607329159.db2.gz MWPBTHCSDQHOEI-SNVBAGLBSA-N -1 3 354.414 3.659 20 0 FHADHM C[C@H](Cc1nc2ccccc2s1)Nc1cccc(F)c1-c1nn[n-]n1 ZINC000820307515 607329160 /nfs/dbraw/zinc/32/91/60/607329160.db2.gz MWPBTHCSDQHOEI-SNVBAGLBSA-N -1 3 354.414 3.659 20 0 FHADHM Fc1cccc(Nc2ccc(OCC(F)(F)F)cc2)c1-c1nnn[n-]1 ZINC000737662522 598236063 /nfs/dbraw/zinc/23/60/63/598236063.db2.gz AVKSZRLKRDHUFO-UHFFFAOYSA-N -1 3 353.279 3.691 20 0 FHADHM Fc1cccc(Nc2ccc(OCC(F)(F)F)cc2)c1-c1nn[n-]n1 ZINC000737662522 598236065 /nfs/dbraw/zinc/23/60/65/598236065.db2.gz AVKSZRLKRDHUFO-UHFFFAOYSA-N -1 3 353.279 3.691 20 0 FHADHM CCCCOc1ccc(CNc2ccc(-c3nn[n-]n3)cc2F)cc1OC ZINC000736463573 598237837 /nfs/dbraw/zinc/23/78/37/598237837.db2.gz POWOALRXOOXPCX-UHFFFAOYSA-N -1 3 371.416 3.805 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1NCc1ccnc(Oc2ccccc2)c1 ZINC000737645271 598238343 /nfs/dbraw/zinc/23/83/43/598238343.db2.gz VJMKIMHSYDCAGR-UHFFFAOYSA-N -1 3 362.368 3.805 20 0 FHADHM CCC(CC)CNC(=O)c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000736343184 598239636 /nfs/dbraw/zinc/23/96/36/598239636.db2.gz ZPXVYQNITSDEST-UHFFFAOYSA-N -1 3 365.437 3.825 20 0 FHADHM CCC(CC)CNC(=O)c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736343184 598239637 /nfs/dbraw/zinc/23/96/37/598239637.db2.gz ZPXVYQNITSDEST-UHFFFAOYSA-N -1 3 365.437 3.825 20 0 FHADHM COc1c(Cl)cc(NCc2ccccc2-c2nnn[n-]2)cc1Cl ZINC000737024486 598249877 /nfs/dbraw/zinc/24/98/77/598249877.db2.gz IODDQSCDBDGBPD-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM COc1c(Cl)cc(NCc2ccccc2-c2nn[n-]n2)cc1Cl ZINC000737024486 598249878 /nfs/dbraw/zinc/24/98/78/598249878.db2.gz IODDQSCDBDGBPD-UHFFFAOYSA-N -1 3 350.209 3.794 20 0 FHADHM Clc1ccc2[nH]c3c(c2c1)CN(Cc1ccccc1-c1nnn[n-]1)CC3 ZINC000737572929 598252735 /nfs/dbraw/zinc/25/27/35/598252735.db2.gz HHBWXFPFIFMULG-UHFFFAOYSA-N -1 3 364.840 3.560 20 0 FHADHM Clc1ccc2[nH]c3c(c2c1)CN(Cc1ccccc1-c1nn[n-]n1)CC3 ZINC000737572929 598252737 /nfs/dbraw/zinc/25/27/37/598252737.db2.gz HHBWXFPFIFMULG-UHFFFAOYSA-N -1 3 364.840 3.560 20 0 FHADHM O=C(Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)N1CCCCC1 ZINC000738185091 598254527 /nfs/dbraw/zinc/25/45/27/598254527.db2.gz RBASADGXUFEZNL-UHFFFAOYSA-N -1 3 364.409 3.677 20 0 FHADHM O=C(Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)N1CCCCC1 ZINC000738185091 598254528 /nfs/dbraw/zinc/25/45/28/598254528.db2.gz RBASADGXUFEZNL-UHFFFAOYSA-N -1 3 364.409 3.677 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)N[C@H](c1ccc(F)cc1)C1CCC1 ZINC000738151421 598254693 /nfs/dbraw/zinc/25/46/93/598254693.db2.gz IECFHGHLLHBCMF-KRWDZBQOSA-N -1 3 366.400 3.669 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)N[C@H](c1ccc(F)cc1)C1CCC1 ZINC000738151421 598254695 /nfs/dbraw/zinc/25/46/95/598254695.db2.gz IECFHGHLLHBCMF-KRWDZBQOSA-N -1 3 366.400 3.669 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)NCc1ccc2ccccc2c1 ZINC000737294393 598265977 /nfs/dbraw/zinc/26/59/77/598265977.db2.gz MXCWXZNXFSKYND-UHFFFAOYSA-N -1 3 358.405 3.650 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)NCc1ccc2ccccc2c1 ZINC000737294393 598265978 /nfs/dbraw/zinc/26/59/78/598265978.db2.gz MXCWXZNXFSKYND-UHFFFAOYSA-N -1 3 358.405 3.650 20 0 FHADHM Cc1ccc(C)c(NC(=O)Nc2cc(-c3nnn[n-]3)cn2C(C)(C)C)c1 ZINC000737325695 598276777 /nfs/dbraw/zinc/27/67/77/598276777.db2.gz GRPZNBNJHXFEFH-UHFFFAOYSA-N -1 3 353.430 3.684 20 0 FHADHM Cc1ccc(C)c(NC(=O)Nc2cc(-c3nn[n-]n3)cn2C(C)(C)C)c1 ZINC000737325695 598276778 /nfs/dbraw/zinc/27/67/78/598276778.db2.gz GRPZNBNJHXFEFH-UHFFFAOYSA-N -1 3 353.430 3.684 20 0 FHADHM CCC(CC)CN(CC)C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000736338536 598278075 /nfs/dbraw/zinc/27/80/75/598278075.db2.gz WKERYYGCQJKCSF-UHFFFAOYSA-N -1 3 361.494 3.713 20 0 FHADHM CCC(CC)CN(CC)C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000736338536 598278077 /nfs/dbraw/zinc/27/80/77/598278077.db2.gz WKERYYGCQJKCSF-UHFFFAOYSA-N -1 3 361.494 3.713 20 0 FHADHM Cc1ccc([C@@H](C)NC(=O)Nc2cc(-c3nnn[n-]3)cn2C(C)(C)C)s1 ZINC000737320470 598279783 /nfs/dbraw/zinc/27/97/83/598279783.db2.gz KXOQKRYCKBZGNJ-LLVKDONJSA-N -1 3 373.486 3.676 20 0 FHADHM Cc1ccc([C@@H](C)NC(=O)Nc2cc(-c3nn[n-]n3)cn2C(C)(C)C)s1 ZINC000737320470 598279785 /nfs/dbraw/zinc/27/97/85/598279785.db2.gz KXOQKRYCKBZGNJ-LLVKDONJSA-N -1 3 373.486 3.676 20 0 FHADHM O=C(CCSc1cccc(Cl)c1)Nc1ccccc1-c1nnn[n-]1 ZINC000737849809 598294799 /nfs/dbraw/zinc/29/47/99/598294799.db2.gz HIRSEWOUDPANKF-UHFFFAOYSA-N -1 3 359.842 3.641 20 0 FHADHM O=C(CCSc1cccc(Cl)c1)Nc1ccccc1-c1nn[n-]n1 ZINC000737849809 598294800 /nfs/dbraw/zinc/29/48/00/598294800.db2.gz HIRSEWOUDPANKF-UHFFFAOYSA-N -1 3 359.842 3.641 20 0 FHADHM Clc1ccc2c(c1Cl)CCN(Cc1ccccc1-c1nnn[n-]1)C2 ZINC000737574748 598301110 /nfs/dbraw/zinc/30/11/10/598301110.db2.gz SDJMJRWHJJNFFG-UHFFFAOYSA-N -1 3 360.248 3.732 20 0 FHADHM Clc1ccc2c(c1Cl)CCN(Cc1ccccc1-c1nn[n-]n1)C2 ZINC000737574748 598301113 /nfs/dbraw/zinc/30/11/13/598301113.db2.gz SDJMJRWHJJNFFG-UHFFFAOYSA-N -1 3 360.248 3.732 20 0 FHADHM Cc1sc2nc(C)nc(NCc3ccc(-c4nnn[n-]4)cc3F)c2c1C ZINC000737483433 598310139 /nfs/dbraw/zinc/31/01/39/598310139.db2.gz WIQVUPUADIDYIR-UHFFFAOYSA-N -1 3 369.429 3.548 20 0 FHADHM Cc1sc2nc(C)nc(NCc3ccc(-c4nn[n-]n4)cc3F)c2c1C ZINC000737483433 598310141 /nfs/dbraw/zinc/31/01/41/598310141.db2.gz WIQVUPUADIDYIR-UHFFFAOYSA-N -1 3 369.429 3.548 20 0 FHADHM Cc1ccc(NC(=S)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)c(C)c1 ZINC000737361140 598315714 /nfs/dbraw/zinc/31/57/14/598315714.db2.gz UICUQQYJECUQJA-UHFFFAOYSA-N -1 3 358.858 3.946 20 0 FHADHM Cc1ccc(NC(=S)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)c(C)c1 ZINC000737361140 598315715 /nfs/dbraw/zinc/31/57/15/598315715.db2.gz UICUQQYJECUQJA-UHFFFAOYSA-N -1 3 358.858 3.946 20 0 FHADHM S=C(NCCC1CCCCC1)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000738402179 598319666 /nfs/dbraw/zinc/31/96/66/598319666.db2.gz ZFRDUSULYWXHEV-UHFFFAOYSA-N -1 3 364.906 3.777 20 0 FHADHM S=C(NCCC1CCCCC1)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000738402179 598319668 /nfs/dbraw/zinc/31/96/68/598319668.db2.gz ZFRDUSULYWXHEV-UHFFFAOYSA-N -1 3 364.906 3.777 20 0 FHADHM CCN(C(=S)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)[C@@H](C)C(C)C ZINC000736509324 598323790 /nfs/dbraw/zinc/32/37/90/598323790.db2.gz UVFWHSKDMFWWHF-JTQLQIEISA-N -1 3 352.895 3.583 20 0 FHADHM CCN(C(=S)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)[C@@H](C)C(C)C ZINC000736509324 598323791 /nfs/dbraw/zinc/32/37/91/598323791.db2.gz UVFWHSKDMFWWHF-JTQLQIEISA-N -1 3 352.895 3.583 20 0 FHADHM Cc1sc(NC(=O)c2csc(C(C)(C)C)n2)c(-c2nnn[n-]2)c1C ZINC000737562555 598326183 /nfs/dbraw/zinc/32/61/83/598326183.db2.gz JVUCXQQABJRDLP-UHFFFAOYSA-N -1 3 362.484 3.551 20 0 FHADHM Cc1sc(NC(=O)c2csc(C(C)(C)C)n2)c(-c2nn[n-]n2)c1C ZINC000737562555 598326184 /nfs/dbraw/zinc/32/61/84/598326184.db2.gz JVUCXQQABJRDLP-UHFFFAOYSA-N -1 3 362.484 3.551 20 0 FHADHM C[C@@H](OC(=O)Cc1ccc(-c2nnn[n-]2)cc1)c1ccc(F)cc1Cl ZINC000737194446 598331528 /nfs/dbraw/zinc/33/15/28/598331528.db2.gz KAVATYSQOMIJAC-SNVBAGLBSA-N -1 3 360.776 3.506 20 0 FHADHM C[C@@H](OC(=O)Cc1ccc(-c2nn[n-]n2)cc1)c1ccc(F)cc1Cl ZINC000737194446 598331530 /nfs/dbraw/zinc/33/15/30/598331530.db2.gz KAVATYSQOMIJAC-SNVBAGLBSA-N -1 3 360.776 3.506 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1ccc(F)cc1Cl ZINC000737194198 598331901 /nfs/dbraw/zinc/33/19/01/598331901.db2.gz DDJSHMZDJAJBHZ-OALRPVAKSA-N -1 3 372.787 3.977 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1ccc(F)cc1Cl ZINC000737194198 598331903 /nfs/dbraw/zinc/33/19/03/598331903.db2.gz DDJSHMZDJAJBHZ-OALRPVAKSA-N -1 3 372.787 3.977 20 0 FHADHM Cc1ccc(Cl)cc1N1CC[C@@H](CNc2ccc(-c3nn[n-]n3)cc2)C1 ZINC000737343938 598353579 /nfs/dbraw/zinc/35/35/79/598353579.db2.gz YYVXQGBFYZPRTA-AWEZNQCLSA-N -1 3 368.872 3.767 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1CSc1nnc(-c2ccccc2)s1 ZINC000737639829 598359511 /nfs/dbraw/zinc/35/95/11/598359511.db2.gz GXLJHGPBSZGWKY-UHFFFAOYSA-N -1 3 370.438 3.817 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CSc1nnc(-c2ccccc2)s1 ZINC000737639829 598359512 /nfs/dbraw/zinc/35/95/12/598359512.db2.gz GXLJHGPBSZGWKY-UHFFFAOYSA-N -1 3 370.438 3.817 20 0 FHADHM C[C@H](CC(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccccc1F ZINC000735975657 598364896 /nfs/dbraw/zinc/36/48/96/598364896.db2.gz NOLOJSDOLLMMRY-SNVBAGLBSA-N -1 3 359.792 3.792 20 0 FHADHM C[C@H](CC(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccccc1F ZINC000735975657 598364898 /nfs/dbraw/zinc/36/48/98/598364898.db2.gz NOLOJSDOLLMMRY-SNVBAGLBSA-N -1 3 359.792 3.792 20 0 FHADHM C[C@H](CC(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1)c1ccccc1F ZINC000735978557 598364927 /nfs/dbraw/zinc/36/49/27/598364927.db2.gz WVTJBGALUGOJTD-SNVBAGLBSA-N -1 3 359.792 3.792 20 0 FHADHM C[C@H](CC(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1)c1ccccc1F ZINC000735978557 598364929 /nfs/dbraw/zinc/36/49/29/598364929.db2.gz WVTJBGALUGOJTD-SNVBAGLBSA-N -1 3 359.792 3.792 20 0 FHADHM FC(F)(F)c1ccc(CNc2ncc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000737637116 598388623 /nfs/dbraw/zinc/38/86/23/598388623.db2.gz ZRPJLKRGHKCKAC-UHFFFAOYSA-N -1 3 354.723 3.546 20 0 FHADHM FC(F)(F)c1ccc(CNc2ncc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000737637116 598388624 /nfs/dbraw/zinc/38/86/24/598388624.db2.gz ZRPJLKRGHKCKAC-UHFFFAOYSA-N -1 3 354.723 3.546 20 0 FHADHM FC(F)(F)c1ccccc1CCNc1ncc(-c2nnn[n-]2)cc1Cl ZINC000737635429 598391469 /nfs/dbraw/zinc/39/14/69/598391469.db2.gz FLOXWKFPUMBPOK-UHFFFAOYSA-N -1 3 368.750 3.589 20 0 FHADHM FC(F)(F)c1ccccc1CCNc1ncc(-c2nn[n-]n2)cc1Cl ZINC000737635429 598391471 /nfs/dbraw/zinc/39/14/71/598391471.db2.gz FLOXWKFPUMBPOK-UHFFFAOYSA-N -1 3 368.750 3.589 20 0 FHADHM Cc1ccc(C[C@@H]2CCCN(c3ncc(-c4nnn[n-]4)cc3Cl)C2)cc1 ZINC000737334609 598393855 /nfs/dbraw/zinc/39/38/55/598393855.db2.gz JRUWAQMLVYCGJM-HNNXBMFYSA-N -1 3 368.872 3.683 20 0 FHADHM Cc1ccc(C[C@@H]2CCCN(c3ncc(-c4nn[n-]n4)cc3Cl)C2)cc1 ZINC000737334609 598393857 /nfs/dbraw/zinc/39/38/57/598393857.db2.gz JRUWAQMLVYCGJM-HNNXBMFYSA-N -1 3 368.872 3.683 20 0 FHADHM Cc1ccccc1C1CCN(C(=O)C=Cc2ccccc2-c2nnn[n-]2)CC1 ZINC000737422045 598397780 /nfs/dbraw/zinc/39/77/80/598397780.db2.gz KOIAGILEWCEPTN-ZHACJKMWSA-N -1 3 373.460 3.595 20 0 FHADHM Cc1ccccc1C1CCN(C(=O)C=Cc2ccccc2-c2nn[n-]n2)CC1 ZINC000737422045 598397781 /nfs/dbraw/zinc/39/77/81/598397781.db2.gz KOIAGILEWCEPTN-ZHACJKMWSA-N -1 3 373.460 3.595 20 0 FHADHM C[C@@H]1c2ccccc2CCN1C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000736302113 598413171 /nfs/dbraw/zinc/41/31/71/598413171.db2.gz FBMITEQJUBXMJY-LLVKDONJSA-N -1 3 368.828 3.671 20 0 FHADHM C[C@@H]1c2ccccc2CCN1C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000736302113 598413172 /nfs/dbraw/zinc/41/31/72/598413172.db2.gz FBMITEQJUBXMJY-LLVKDONJSA-N -1 3 368.828 3.671 20 0 FHADHM Cc1ccc(F)c(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCCC3)c1 ZINC000737344123 598415585 /nfs/dbraw/zinc/41/55/85/598415585.db2.gz AEADZFRDJDKIQO-UHFFFAOYSA-N -1 3 371.441 3.897 20 0 FHADHM Cc1ccc(F)c(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCCC3)c1 ZINC000737344123 598415586 /nfs/dbraw/zinc/41/55/86/598415586.db2.gz AEADZFRDJDKIQO-UHFFFAOYSA-N -1 3 371.441 3.897 20 0 FHADHM O=C(Nc1ccccc1-c1nnn[n-]1)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl ZINC000738190930 598420395 /nfs/dbraw/zinc/42/03/95/598420395.db2.gz FRRCTSXNCDBTLU-CHWSQXEVSA-N -1 3 374.231 3.916 20 0 FHADHM O=C(Nc1ccccc1-c1nn[n-]n1)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl ZINC000738190930 598420396 /nfs/dbraw/zinc/42/03/96/598420396.db2.gz FRRCTSXNCDBTLU-CHWSQXEVSA-N -1 3 374.231 3.916 20 0 FHADHM CC(C)(CNc1ncccc1-c1nnn[n-]1)c1cccc(C(F)(F)F)c1 ZINC000735671574 598420811 /nfs/dbraw/zinc/42/08/11/598420811.db2.gz ZVPATQMTWHMKIG-UHFFFAOYSA-N -1 3 362.359 3.670 20 0 FHADHM CC(C)(CNc1ncccc1-c1nn[n-]n1)c1cccc(C(F)(F)F)c1 ZINC000735671574 598420812 /nfs/dbraw/zinc/42/08/12/598420812.db2.gz ZVPATQMTWHMKIG-UHFFFAOYSA-N -1 3 362.359 3.670 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)c2sccc2SC)s1 ZINC000736679720 598420929 /nfs/dbraw/zinc/42/09/29/598420929.db2.gz ZXZRBYZOYBKDOC-UHFFFAOYSA-N -1 3 351.482 3.526 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)c2sccc2SC)s1 ZINC000736679720 598420930 /nfs/dbraw/zinc/42/09/30/598420930.db2.gz ZXZRBYZOYBKDOC-UHFFFAOYSA-N -1 3 351.482 3.526 20 0 FHADHM COc1ccc(Nc2nc(-c3ccc(-c4nnn[n-]4)cc3)cs2)cc1F ZINC000737106472 598425078 /nfs/dbraw/zinc/42/50/78/598425078.db2.gz UDANSPVOCBIRHG-UHFFFAOYSA-N -1 3 368.397 3.882 20 0 FHADHM COc1ccc(Nc2nc(-c3ccc(-c4nn[n-]n4)cc3)cs2)cc1F ZINC000737106472 598425080 /nfs/dbraw/zinc/42/50/80/598425080.db2.gz UDANSPVOCBIRHG-UHFFFAOYSA-N -1 3 368.397 3.882 20 0 FHADHM Cc1cccc(C)c1NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C(C)C ZINC000737389572 598426904 /nfs/dbraw/zinc/42/69/04/598426904.db2.gz KNIYHHHKHKQPMW-UHFFFAOYSA-N -1 3 364.453 3.926 20 0 FHADHM Cc1cccc(C)c1NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C(C)C ZINC000737389572 598426906 /nfs/dbraw/zinc/42/69/06/598426906.db2.gz KNIYHHHKHKQPMW-UHFFFAOYSA-N -1 3 364.453 3.926 20 0 FHADHM CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H](C)c1cccs1 ZINC000736113170 598427919 /nfs/dbraw/zinc/42/79/19/598427919.db2.gz XSZSUBOVEXSLME-ZDUSSCGKSA-N -1 3 370.482 3.609 20 0 FHADHM CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H](C)c1cccs1 ZINC000736113170 598427921 /nfs/dbraw/zinc/42/79/21/598427921.db2.gz XSZSUBOVEXSLME-ZDUSSCGKSA-N -1 3 370.482 3.609 20 0 FHADHM O=C(Nc1sccc1-c1nnn[n-]1)[C@@H]1C[C@@H]1c1cccc2ccccc21 ZINC000738208305 598437563 /nfs/dbraw/zinc/43/75/63/598437563.db2.gz LIMMSVFEQWVMMS-HZPDHXFCSA-N -1 3 361.430 3.824 20 0 FHADHM O=C(Nc1sccc1-c1nn[n-]n1)[C@@H]1C[C@@H]1c1cccc2ccccc21 ZINC000738208305 598437565 /nfs/dbraw/zinc/43/75/65/598437565.db2.gz LIMMSVFEQWVMMS-HZPDHXFCSA-N -1 3 361.430 3.824 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)[C@H]1C[C@H]1c1cccc2ccccc21 ZINC000738164393 598453060 /nfs/dbraw/zinc/45/30/60/598453060.db2.gz YRYOFTXWWFAHMA-IRXDYDNUSA-N -1 3 373.391 3.901 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)[C@H]1C[C@H]1c1cccc2ccccc21 ZINC000738164393 598453062 /nfs/dbraw/zinc/45/30/62/598453062.db2.gz YRYOFTXWWFAHMA-IRXDYDNUSA-N -1 3 373.391 3.901 20 0 FHADHM CCN(C(=O)c1ccc2[nH]ccc2c1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736507460 598460385 /nfs/dbraw/zinc/46/03/85/598460385.db2.gz DCZBLJDWFOIKCG-ZDUSSCGKSA-N -1 3 360.421 3.571 20 0 FHADHM CCN(C(=O)c1ccc2[nH]ccc2c1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736507460 598460386 /nfs/dbraw/zinc/46/03/86/598460386.db2.gz DCZBLJDWFOIKCG-ZDUSSCGKSA-N -1 3 360.421 3.571 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1ccc2[nH]ccc2c1 ZINC000735831383 598461788 /nfs/dbraw/zinc/46/17/88/598461788.db2.gz PORQSWIKJGMHKN-UHFFFAOYSA-N -1 3 374.448 3.646 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1ccc2[nH]ccc2c1 ZINC000735831383 598461789 /nfs/dbraw/zinc/46/17/89/598461789.db2.gz PORQSWIKJGMHKN-UHFFFAOYSA-N -1 3 374.448 3.646 20 0 FHADHM CC(=CC(=O)OCc1ccc(-c2nnn[n-]2)cc1)c1ccccc1Cl ZINC000735449465 598473716 /nfs/dbraw/zinc/47/37/16/598473716.db2.gz YXJDHAWEVPAVLZ-BENRWUELSA-N -1 3 354.797 3.667 20 0 FHADHM CC(=CC(=O)OCc1ccc(-c2nn[n-]n2)cc1)c1ccccc1Cl ZINC000735449465 598473718 /nfs/dbraw/zinc/47/37/18/598473718.db2.gz YXJDHAWEVPAVLZ-BENRWUELSA-N -1 3 354.797 3.667 20 0 FHADHM COc1ccccc1C(C)=CC(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000737143286 598481944 /nfs/dbraw/zinc/48/19/44/598481944.db2.gz TYUDPUUTNVPUTL-CMPYXILNSA-N -1 3 364.405 3.583 20 0 FHADHM COc1ccccc1C(C)=CC(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000737143286 598481946 /nfs/dbraw/zinc/48/19/46/598481946.db2.gz TYUDPUUTNVPUTL-CMPYXILNSA-N -1 3 364.405 3.583 20 0 FHADHM CC(C)Oc1ccccc1CC(=O)O[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000735914439 598482183 /nfs/dbraw/zinc/48/21/83/598482183.db2.gz SSGDUYIYCLPJEY-AWEZNQCLSA-N -1 3 366.421 3.501 20 0 FHADHM CC(C)Oc1ccccc1CC(=O)O[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000735914439 598482184 /nfs/dbraw/zinc/48/21/84/598482184.db2.gz SSGDUYIYCLPJEY-AWEZNQCLSA-N -1 3 366.421 3.501 20 0 FHADHM C[C@H](OC(=O)COc1ccc2ccccc2c1)c1cccc(-c2nnn[n-]2)c1 ZINC000736157067 598486049 /nfs/dbraw/zinc/48/60/49/598486049.db2.gz YSTZSUHDJAPLFN-AWEZNQCLSA-N -1 3 374.400 3.703 20 0 FHADHM C[C@H](OC(=O)COc1ccc2ccccc2c1)c1cccc(-c2nn[n-]n2)c1 ZINC000736157067 598486051 /nfs/dbraw/zinc/48/60/51/598486051.db2.gz YSTZSUHDJAPLFN-AWEZNQCLSA-N -1 3 374.400 3.703 20 0 FHADHM CCCc1cc(C(=O)Nc2cc(-c3nnn[n-]3)cn2C(C)(C)C)sc1C ZINC000736496925 598486506 /nfs/dbraw/zinc/48/65/06/598486506.db2.gz LWDNKMPILQJNEN-UHFFFAOYSA-N -1 3 372.498 3.998 20 0 FHADHM CCCc1cc(C(=O)Nc2cc(-c3nn[n-]n3)cn2C(C)(C)C)sc1C ZINC000736496925 598486507 /nfs/dbraw/zinc/48/65/07/598486507.db2.gz LWDNKMPILQJNEN-UHFFFAOYSA-N -1 3 372.498 3.998 20 0 FHADHM C[C@H](OC(=O)COc1cccc2ccccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000736154982 598487497 /nfs/dbraw/zinc/48/74/97/598487497.db2.gz FCMSLOQEKBWSRB-AWEZNQCLSA-N -1 3 374.400 3.703 20 0 FHADHM C[C@H](OC(=O)COc1cccc2ccccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000736154982 598487499 /nfs/dbraw/zinc/48/74/99/598487499.db2.gz FCMSLOQEKBWSRB-AWEZNQCLSA-N -1 3 374.400 3.703 20 0 FHADHM Cc1cc(OCC(=O)O[C@H](C)c2cccc(-c3nnn[n-]3)c2)ccc1Cl ZINC000737277847 598488388 /nfs/dbraw/zinc/48/83/88/598488388.db2.gz AVMMUGGCBHPDIM-GFCCVEGCSA-N -1 3 372.812 3.512 20 0 FHADHM Cc1cc(OCC(=O)O[C@H](C)c2cccc(-c3nn[n-]n3)c2)ccc1Cl ZINC000737277847 598488390 /nfs/dbraw/zinc/48/83/90/598488390.db2.gz AVMMUGGCBHPDIM-GFCCVEGCSA-N -1 3 372.812 3.512 20 0 FHADHM Cc1c2ccccc2oc1C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000737214399 598488623 /nfs/dbraw/zinc/48/86/23/598488623.db2.gz JSQBINXFPPQLQJ-UHFFFAOYSA-N -1 3 364.409 3.730 20 0 FHADHM Cc1c2ccccc2oc1C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000737214399 598488624 /nfs/dbraw/zinc/48/86/24/598488624.db2.gz JSQBINXFPPQLQJ-UHFFFAOYSA-N -1 3 364.409 3.730 20 0 FHADHM Cc1ccc(C(=O)Nc2cc(-c3nnn[n-]3)cn2C(C)(C)C)cc1Cl ZINC000737314626 598490964 /nfs/dbraw/zinc/49/09/64/598490964.db2.gz DXGATRPJWLLGIY-UHFFFAOYSA-N -1 3 358.833 3.637 20 0 FHADHM Cc1ccc(C(=O)Nc2cc(-c3nn[n-]n3)cn2C(C)(C)C)cc1Cl ZINC000737314626 598490965 /nfs/dbraw/zinc/49/09/65/598490965.db2.gz DXGATRPJWLLGIY-UHFFFAOYSA-N -1 3 358.833 3.637 20 0 FHADHM CCc1ccc([C@@H](C)C(=O)Nc2cc(-c3nnn[n-]3)cn2C(C)(C)C)cc1 ZINC000736690932 598491027 /nfs/dbraw/zinc/49/10/27/598491027.db2.gz WYOCXZUYNNRUJP-CYBMUJFWSA-N -1 3 366.469 3.728 20 0 FHADHM CCc1ccc([C@@H](C)C(=O)Nc2cc(-c3nn[n-]n3)cn2C(C)(C)C)cc1 ZINC000736690932 598491028 /nfs/dbraw/zinc/49/10/28/598491028.db2.gz WYOCXZUYNNRUJP-CYBMUJFWSA-N -1 3 366.469 3.728 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)ccc1OCc1csc(-c2ccoc2)n1 ZINC000736627603 598492173 /nfs/dbraw/zinc/49/21/73/598492173.db2.gz NNZZSFAVNNGHOY-UHFFFAOYSA-N -1 3 369.406 3.561 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)ccc1OCc1csc(-c2ccoc2)n1 ZINC000736627603 598492174 /nfs/dbraw/zinc/49/21/74/598492174.db2.gz NNZZSFAVNNGHOY-UHFFFAOYSA-N -1 3 369.406 3.561 20 0 FHADHM S=C(Nc1ccccc1-c1nnn[n-]1)N(CC1CC1)C1CCCCC1 ZINC000738409668 598497346 /nfs/dbraw/zinc/49/73/46/598497346.db2.gz VWMKWMKDMNSDSI-UHFFFAOYSA-N -1 3 356.499 3.608 20 0 FHADHM S=C(Nc1ccccc1-c1nn[n-]n1)N(CC1CC1)C1CCCCC1 ZINC000738409668 598497348 /nfs/dbraw/zinc/49/73/48/598497348.db2.gz VWMKWMKDMNSDSI-UHFFFAOYSA-N -1 3 356.499 3.608 20 0 FHADHM O=C(C[C@@H]1CCCc2ccccc21)OCc1ccc(F)cc1-c1nnn[n-]1 ZINC000737821892 598515430 /nfs/dbraw/zinc/51/54/30/598515430.db2.gz NJZFPFYFBSCVIX-AWEZNQCLSA-N -1 3 366.396 3.559 20 0 FHADHM O=C(C[C@@H]1CCCc2ccccc21)OCc1ccc(F)cc1-c1nn[n-]n1 ZINC000737821892 598515432 /nfs/dbraw/zinc/51/54/32/598515432.db2.gz NJZFPFYFBSCVIX-AWEZNQCLSA-N -1 3 366.396 3.559 20 0 FHADHM O[C@@H](CCc1ccc(Nc2ccc(-c3nnn[n-]3)cn2)cc1)c1ccccc1 ZINC000738382354 598521966 /nfs/dbraw/zinc/52/19/66/598521966.db2.gz PNXQVZRMCKBEPC-IBGZPJMESA-N -1 3 372.432 3.672 20 0 FHADHM O[C@@H](CCc1ccc(Nc2ccc(-c3nn[n-]n3)cn2)cc1)c1ccccc1 ZINC000738382354 598521967 /nfs/dbraw/zinc/52/19/67/598521967.db2.gz PNXQVZRMCKBEPC-IBGZPJMESA-N -1 3 372.432 3.672 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)[C@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000108710221 598532913 /nfs/dbraw/zinc/53/29/13/598532913.db2.gz MJFWMUZGRPGURZ-OALUTQOASA-N -1 3 355.401 3.762 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)[C@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000108710221 598532915 /nfs/dbraw/zinc/53/29/15/598532915.db2.gz MJFWMUZGRPGURZ-OALUTQOASA-N -1 3 355.401 3.762 20 0 FHADHM CN(C(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1)c1cccc(-c2nnn[n-]2)c1 ZINC000736733484 598533292 /nfs/dbraw/zinc/53/32/92/598533292.db2.gz VXWDQFUYCTZNNZ-VQTJNVASSA-N -1 3 369.428 3.786 20 0 FHADHM CN(C(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1)c1cccc(-c2nn[n-]n2)c1 ZINC000736733484 598533294 /nfs/dbraw/zinc/53/32/94/598533294.db2.gz VXWDQFUYCTZNNZ-VQTJNVASSA-N -1 3 369.428 3.786 20 0 FHADHM CN(C(=O)[C@H]1C[C@H]1c1ccc2ccccc2c1)c1cccc(-c2nnn[n-]2)c1 ZINC000736733482 598533470 /nfs/dbraw/zinc/53/34/70/598533470.db2.gz VXWDQFUYCTZNNZ-PMACEKPBSA-N -1 3 369.428 3.786 20 0 FHADHM CN(C(=O)[C@H]1C[C@H]1c1ccc2ccccc2c1)c1cccc(-c2nn[n-]n2)c1 ZINC000736733482 598533472 /nfs/dbraw/zinc/53/34/72/598533472.db2.gz VXWDQFUYCTZNNZ-PMACEKPBSA-N -1 3 369.428 3.786 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1Oc1nc(C(F)F)nc2ccccc21 ZINC000737220067 598537959 /nfs/dbraw/zinc/53/79/59/598537959.db2.gz ALYCMRKGPLHHON-UHFFFAOYSA-N -1 3 354.320 3.848 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1Oc1nc(C(F)F)nc2ccccc21 ZINC000737220067 598537961 /nfs/dbraw/zinc/53/79/61/598537961.db2.gz ALYCMRKGPLHHON-UHFFFAOYSA-N -1 3 354.320 3.848 20 0 FHADHM Cc1cc(C(=O)COc2ccc(-c3nnn[n-]3)c(F)c2)c(C)c(C)c1C ZINC000737227735 598548316 /nfs/dbraw/zinc/54/83/16/598548316.db2.gz QGEFHEDOPWVIII-UHFFFAOYSA-N -1 3 354.385 3.501 20 0 FHADHM Cc1cc(C(=O)COc2ccc(-c3nn[n-]n3)c(F)c2)c(C)c(C)c1C ZINC000737227735 598548317 /nfs/dbraw/zinc/54/83/17/598548317.db2.gz QGEFHEDOPWVIII-UHFFFAOYSA-N -1 3 354.385 3.501 20 0 FHADHM CCN(C(=O)[C@H](C)c1ccccc1F)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736503226 598552971 /nfs/dbraw/zinc/55/29/71/598552971.db2.gz UEHLLJAPMUIQNU-KGLIPLIRSA-N -1 3 367.428 3.719 20 0 FHADHM CCN(C(=O)[C@H](C)c1ccccc1F)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736503226 598552972 /nfs/dbraw/zinc/55/29/72/598552972.db2.gz UEHLLJAPMUIQNU-KGLIPLIRSA-N -1 3 367.428 3.719 20 0 FHADHM CSC[C@H](C)C(=O)Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1 ZINC000737178856 598553360 /nfs/dbraw/zinc/55/33/60/598553360.db2.gz FNHXGFMVZMGLMR-JTQLQIEISA-N -1 3 359.480 3.533 20 0 FHADHM CSC[C@H](C)C(=O)Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1 ZINC000737178856 598553362 /nfs/dbraw/zinc/55/33/62/598553362.db2.gz FNHXGFMVZMGLMR-JTQLQIEISA-N -1 3 359.480 3.533 20 0 FHADHM CC[C@@H](C)N(C)C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736322799 598564917 /nfs/dbraw/zinc/56/49/17/598564917.db2.gz OWZRKGUSTWQJRY-CYBMUJFWSA-N -1 3 366.425 3.921 20 0 FHADHM CC[C@@H](C)N(C)C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736322799 598564918 /nfs/dbraw/zinc/56/49/18/598564918.db2.gz OWZRKGUSTWQJRY-CYBMUJFWSA-N -1 3 366.425 3.921 20 0 FHADHM Fc1cccc(Cl)c1Cn1ccc(-c2ccc(-c3nnn[n-]3)cc2)n1 ZINC000737659444 598567791 /nfs/dbraw/zinc/56/77/91/598567791.db2.gz DEOPLLHXKUAVPQ-UHFFFAOYSA-N -1 3 354.776 3.571 20 0 FHADHM Fc1cccc(Cl)c1Cn1ccc(-c2ccc(-c3nn[n-]n3)cc2)n1 ZINC000737659444 598567793 /nfs/dbraw/zinc/56/77/93/598567793.db2.gz DEOPLLHXKUAVPQ-UHFFFAOYSA-N -1 3 354.776 3.571 20 0 FHADHM C[C@H](NC(=O)CCCCCc1cccs1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736100357 598567946 /nfs/dbraw/zinc/56/79/46/598567946.db2.gz KEZMYRZRZQCOGQ-AWEZNQCLSA-N -1 3 369.494 3.909 20 0 FHADHM C[C@H](NC(=O)CCCCCc1cccs1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736100357 598567948 /nfs/dbraw/zinc/56/79/48/598567948.db2.gz KEZMYRZRZQCOGQ-AWEZNQCLSA-N -1 3 369.494 3.909 20 0 FHADHM O=C(CCCOc1cccc2ccccc21)Nc1ccccc1-c1nnn[n-]1 ZINC000737837954 598574090 /nfs/dbraw/zinc/57/40/90/598574090.db2.gz WAKNSQHFLLWDBM-UHFFFAOYSA-N -1 3 373.416 3.818 20 0 FHADHM O=C(CCCOc1cccc2ccccc21)Nc1ccccc1-c1nn[n-]n1 ZINC000737837954 598574091 /nfs/dbraw/zinc/57/40/91/598574091.db2.gz WAKNSQHFLLWDBM-UHFFFAOYSA-N -1 3 373.416 3.818 20 0 FHADHM O=C(CCc1ccc(Cl)cc1Cl)Nc1ccccc1-c1nnn[n-]1 ZINC000737853538 598575302 /nfs/dbraw/zinc/57/53/02/598575302.db2.gz MQLIVOAVOIQKHE-UHFFFAOYSA-N -1 3 362.220 3.745 20 0 FHADHM O=C(CCc1ccc(Cl)cc1Cl)Nc1ccccc1-c1nn[n-]n1 ZINC000737853538 598575304 /nfs/dbraw/zinc/57/53/04/598575304.db2.gz MQLIVOAVOIQKHE-UHFFFAOYSA-N -1 3 362.220 3.745 20 0 FHADHM CCCC[C@H](CC)CNC(=S)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000736436202 598581941 /nfs/dbraw/zinc/58/19/41/598581941.db2.gz BFFNQFZHRCSUCS-NSHDSACASA-N -1 3 350.467 3.509 20 0 FHADHM CCCC[C@H](CC)CNC(=S)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000736436202 598581943 /nfs/dbraw/zinc/58/19/43/598581943.db2.gz BFFNQFZHRCSUCS-NSHDSACASA-N -1 3 350.467 3.509 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)c1cccc(Cl)c1Cl ZINC000738168302 598592933 /nfs/dbraw/zinc/59/29/33/598592933.db2.gz YUEVPOKXPNUFFK-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)c1cccc(Cl)c1Cl ZINC000738168302 598592934 /nfs/dbraw/zinc/59/29/34/598592934.db2.gz YUEVPOKXPNUFFK-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM c1cc(-c2nnn[n-]2)ccc1CSCc1nc(C2CCCCC2)no1 ZINC000738412047 598610206 /nfs/dbraw/zinc/61/02/06/598610206.db2.gz FGXNOTMQEWHTRF-UHFFFAOYSA-N -1 3 356.455 3.731 20 0 FHADHM c1cc(-c2nn[n-]n2)ccc1CSCc1nc(C2CCCCC2)no1 ZINC000738412047 598610208 /nfs/dbraw/zinc/61/02/08/598610208.db2.gz FGXNOTMQEWHTRF-UHFFFAOYSA-N -1 3 356.455 3.731 20 0 FHADHM Cc1cc(-c2noc([C@@H](C)Oc3ccc(-c4nn[n-]n4)cc3)n2)ccc1F ZINC000737225904 598611373 /nfs/dbraw/zinc/61/13/73/598611373.db2.gz KVGIYFRCGMZKLP-LLVKDONJSA-N -1 3 366.356 3.504 20 0 FHADHM C[C@H](OC(=O)c1ccc(-c2nnn[n-]2)cc1)c1ccc(C(F)(F)F)cc1 ZINC000736158343 598618361 /nfs/dbraw/zinc/61/83/61/598618361.db2.gz FYFZADBBEOJCEX-JTQLQIEISA-N -1 3 362.311 3.804 20 0 FHADHM C[C@H](OC(=O)c1ccc(-c2nn[n-]n2)cc1)c1ccc(C(F)(F)F)cc1 ZINC000736158343 598618362 /nfs/dbraw/zinc/61/83/62/598618362.db2.gz FYFZADBBEOJCEX-JTQLQIEISA-N -1 3 362.311 3.804 20 0 FHADHM CC[C@@H](NC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1)c1cccc(Cl)c1 ZINC000736366201 598624242 /nfs/dbraw/zinc/62/42/42/598624242.db2.gz ZYDQKKOIYSXJOK-OAHLLOKOSA-N -1 3 374.807 3.932 20 0 FHADHM CC[C@@H](NC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1)c1cccc(Cl)c1 ZINC000736366201 598624244 /nfs/dbraw/zinc/62/42/44/598624244.db2.gz ZYDQKKOIYSXJOK-OAHLLOKOSA-N -1 3 374.807 3.932 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)N1CCC[C@H]1CC1CCCCC1 ZINC000738160794 598628297 /nfs/dbraw/zinc/62/82/97/598628297.db2.gz BLYQHZOGPNPPFG-HNNXBMFYSA-N -1 3 372.448 3.973 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)N1CCC[C@H]1CC1CCCCC1 ZINC000738160794 598628299 /nfs/dbraw/zinc/62/82/99/598628299.db2.gz BLYQHZOGPNPPFG-HNNXBMFYSA-N -1 3 372.448 3.973 20 0 FHADHM Clc1cccc(-c2nnn[n-]2)c1N1CCc2[nH]c3ccccc3c2C1 ZINC000737574464 598632357 /nfs/dbraw/zinc/63/23/57/598632357.db2.gz KNJKWHZNNSBDJL-UHFFFAOYSA-N -1 3 350.813 3.564 20 0 FHADHM Clc1cccc(-c2nn[n-]n2)c1N1CCc2[nH]c3ccccc3c2C1 ZINC000737574464 598632358 /nfs/dbraw/zinc/63/23/58/598632358.db2.gz KNJKWHZNNSBDJL-UHFFFAOYSA-N -1 3 350.813 3.564 20 0 FHADHM Cc1ccccc1-c1nnc(SCc2ccc(F)cc2-c2nnn[n-]2)o1 ZINC000737419338 598643326 /nfs/dbraw/zinc/64/33/26/598643326.db2.gz VMPUFMDXQVLGPK-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM Cc1ccccc1-c1nnc(SCc2ccc(F)cc2-c2nn[n-]n2)o1 ZINC000737419338 598643327 /nfs/dbraw/zinc/64/33/27/598643327.db2.gz VMPUFMDXQVLGPK-UHFFFAOYSA-N -1 3 368.397 3.657 20 0 FHADHM Cc1ccc(NC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)c(C)c1 ZINC000737355168 598643645 /nfs/dbraw/zinc/64/36/45/598643645.db2.gz AXZCFAWEEMOZEY-UHFFFAOYSA-N -1 3 365.437 3.671 20 0 FHADHM Cc1ccc(NC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)c(C)c1 ZINC000737355168 598643646 /nfs/dbraw/zinc/64/36/46/598643646.db2.gz AXZCFAWEEMOZEY-UHFFFAOYSA-N -1 3 365.437 3.671 20 0 FHADHM O=C(CCCCOc1cccc(-c2nnn[n-]2)c1)Nc1cccc(Cl)c1 ZINC000737831569 598643833 /nfs/dbraw/zinc/64/38/33/598643833.db2.gz AUPDKAZURGHSRQ-UHFFFAOYSA-N -1 3 371.828 3.708 20 0 FHADHM O=C(CCCCOc1cccc(-c2nn[n-]n2)c1)Nc1cccc(Cl)c1 ZINC000737831569 598643835 /nfs/dbraw/zinc/64/38/35/598643835.db2.gz AUPDKAZURGHSRQ-UHFFFAOYSA-N -1 3 371.828 3.708 20 0 FHADHM Cc1cccc(C)c1OC(=O)CCCCOc1cccc(-c2nnn[n-]2)c1 ZINC000737388717 598644799 /nfs/dbraw/zinc/64/47/99/598644799.db2.gz DJLANMLICPRYPH-UHFFFAOYSA-N -1 3 366.421 3.638 20 0 FHADHM Cc1cccc(C)c1OC(=O)CCCCOc1cccc(-c2nn[n-]n2)c1 ZINC000737388717 598644800 /nfs/dbraw/zinc/64/48/00/598644800.db2.gz DJLANMLICPRYPH-UHFFFAOYSA-N -1 3 366.421 3.638 20 0 FHADHM Cc1nc2ccccc2nc1SCc1ccc(F)cc1-c1nnn[n-]1 ZINC000737490299 598645030 /nfs/dbraw/zinc/64/50/30/598645030.db2.gz SJNCQWFJXHONSN-UHFFFAOYSA-N -1 3 352.398 3.550 20 0 FHADHM Cc1nc2ccccc2nc1SCc1ccc(F)cc1-c1nn[n-]n1 ZINC000737490299 598645033 /nfs/dbraw/zinc/64/50/33/598645033.db2.gz SJNCQWFJXHONSN-UHFFFAOYSA-N -1 3 352.398 3.550 20 0 FHADHM CCc1ccc(OC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000736692369 598645241 /nfs/dbraw/zinc/64/52/41/598645241.db2.gz ULVFBAHEKNFBSL-UHFFFAOYSA-N -1 3 366.421 3.584 20 0 FHADHM CCc1ccc(OC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000736692369 598645242 /nfs/dbraw/zinc/64/52/42/598645242.db2.gz ULVFBAHEKNFBSL-UHFFFAOYSA-N -1 3 366.421 3.584 20 0 FHADHM C[C@@H]1CCC[C@H](OC(=O)CCCCOc2cccc(-c3nnn[n-]3)c2)C1 ZINC000736253324 598646116 /nfs/dbraw/zinc/64/61/16/598646116.db2.gz MXSOKXZLUDUGMI-PBHICJAKSA-N -1 3 358.442 3.538 20 0 FHADHM C[C@@H]1CCC[C@H](OC(=O)CCCCOc2cccc(-c3nn[n-]n3)c2)C1 ZINC000736253324 598646118 /nfs/dbraw/zinc/64/61/18/598646118.db2.gz MXSOKXZLUDUGMI-PBHICJAKSA-N -1 3 358.442 3.538 20 0 FHADHM O=C(c1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1)N1CCCCCC1 ZINC000738272413 598646787 /nfs/dbraw/zinc/64/67/87/598646787.db2.gz DQYVNECQBQDPOM-UHFFFAOYSA-N -1 3 363.421 3.675 20 0 FHADHM O=C(c1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1)N1CCCCCC1 ZINC000738272413 598646789 /nfs/dbraw/zinc/64/67/89/598646789.db2.gz DQYVNECQBQDPOM-UHFFFAOYSA-N -1 3 363.421 3.675 20 0 FHADHM O=C(CSc1ccc(-c2nnn[n-]2)cc1)Oc1ccc2ccccc2c1 ZINC000737946355 598647830 /nfs/dbraw/zinc/64/78/30/598647830.db2.gz BZIATSPOHOHSPM-UHFFFAOYSA-N -1 3 362.414 3.718 20 0 FHADHM O=C(CSc1ccc(-c2nn[n-]n2)cc1)Oc1ccc2ccccc2c1 ZINC000737946355 598647832 /nfs/dbraw/zinc/64/78/32/598647832.db2.gz BZIATSPOHOHSPM-UHFFFAOYSA-N -1 3 362.414 3.718 20 0 FHADHM Cc1ccc(Cl)c(OC(=O)CSc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737343846 598648132 /nfs/dbraw/zinc/64/81/32/598648132.db2.gz VURCWXDNCQGSLN-UHFFFAOYSA-N -1 3 360.826 3.526 20 0 FHADHM Cc1ccc(Cl)c(OC(=O)CSc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737343846 598648134 /nfs/dbraw/zinc/64/81/34/598648134.db2.gz VURCWXDNCQGSLN-UHFFFAOYSA-N -1 3 360.826 3.526 20 0 FHADHM Cc1cccc(NC(=O)c2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)n1 ZINC000737400292 598648974 /nfs/dbraw/zinc/64/89/74/598648974.db2.gz SKXWZMFOFRRYJL-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM CCc1ccc(N(CC)C(=O)CSc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000736688922 598651921 /nfs/dbraw/zinc/65/19/21/598651921.db2.gz IASGEVJBCXDANK-UHFFFAOYSA-N -1 3 367.478 3.574 20 0 FHADHM CCc1ccc(N(CC)C(=O)CSc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000736688922 598651922 /nfs/dbraw/zinc/65/19/22/598651922.db2.gz IASGEVJBCXDANK-UHFFFAOYSA-N -1 3 367.478 3.574 20 0 FHADHM Cc1ccc(C(=O)N(Cc2ccc(-c3nnn[n-]3)cc2)C(C)C)cc1Cl ZINC000737308174 598652511 /nfs/dbraw/zinc/65/25/11/598652511.db2.gz GZOZFWQKQCXZLK-UHFFFAOYSA-N -1 3 369.856 3.879 20 0 FHADHM Cc1ccc(C(=O)N(Cc2ccc(-c3nn[n-]n3)cc2)C(C)C)cc1Cl ZINC000737308174 598652512 /nfs/dbraw/zinc/65/25/12/598652512.db2.gz GZOZFWQKQCXZLK-UHFFFAOYSA-N -1 3 369.856 3.879 20 0 FHADHM CC(C)CC[C@H]1CCC[C@H]1NC(=O)CSc1ccc(-c2nnn[n-]2)cc1 ZINC000735796953 598658051 /nfs/dbraw/zinc/65/80/51/598658051.db2.gz KSKFAIRFKQLAFE-RHSMWYFYSA-N -1 3 373.526 3.680 20 0 FHADHM CC(C)CC[C@H]1CCC[C@H]1NC(=O)CSc1ccc(-c2nn[n-]n2)cc1 ZINC000735796953 598658053 /nfs/dbraw/zinc/65/80/53/598658053.db2.gz KSKFAIRFKQLAFE-RHSMWYFYSA-N -1 3 373.526 3.680 20 0 FHADHM Cc1csc(-c2cccc(OC(=O)c3sccc3-c3nnn[n-]3)c2)n1 ZINC000737447446 598659249 /nfs/dbraw/zinc/65/92/49/598659249.db2.gz BWFMLCVMZLWGAK-UHFFFAOYSA-N -1 3 369.431 3.579 20 0 FHADHM Fc1ccc(CSCc2nc(-c3cccs3)no2)c(-c2nnn[n-]2)c1 ZINC000737650555 598695790 /nfs/dbraw/zinc/69/57/90/598695790.db2.gz SNBUJYIGTVBOAB-UHFFFAOYSA-N -1 3 374.426 3.551 20 0 FHADHM Fc1ccc(CSCc2nc(-c3cccs3)no2)c(-c2nn[n-]n2)c1 ZINC000737650555 598695792 /nfs/dbraw/zinc/69/57/92/598695792.db2.gz SNBUJYIGTVBOAB-UHFFFAOYSA-N -1 3 374.426 3.551 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nnn[n-]1)c1cc2cc(Cl)ccc2o1 ZINC000738236047 598705668 /nfs/dbraw/zinc/70/56/68/598705668.db2.gz QKEKDODPZIMONT-UHFFFAOYSA-N -1 3 372.743 3.762 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nn[n-]n1)c1cc2cc(Cl)ccc2o1 ZINC000738236047 598705669 /nfs/dbraw/zinc/70/56/69/598705669.db2.gz QKEKDODPZIMONT-UHFFFAOYSA-N -1 3 372.743 3.762 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nnn[n-]1)[C@@H]1C[C@H]1c1cccc(Cl)c1 ZINC000738232096 598711716 /nfs/dbraw/zinc/71/17/16/598711716.db2.gz PBZALBGHACRAPD-GOEBONIOSA-N -1 3 372.787 3.506 20 0 FHADHM O=C(OCc1ccc(F)cc1-c1nn[n-]n1)[C@@H]1C[C@H]1c1cccc(Cl)c1 ZINC000738232096 598711717 /nfs/dbraw/zinc/71/17/17/598711717.db2.gz PBZALBGHACRAPD-GOEBONIOSA-N -1 3 372.787 3.506 20 0 FHADHM Cc1sc(NC(=O)c2cnc(-c3ccco3)s2)c(-c2nnn[n-]2)c1C ZINC000737561460 598734988 /nfs/dbraw/zinc/73/49/88/598734988.db2.gz DWENOMXKOJLDPB-UHFFFAOYSA-N -1 3 372.435 3.514 20 0 FHADHM Cc1sc(NC(=O)c2cnc(-c3ccco3)s2)c(-c2nn[n-]n2)c1C ZINC000737561460 598734989 /nfs/dbraw/zinc/73/49/89/598734989.db2.gz DWENOMXKOJLDPB-UHFFFAOYSA-N -1 3 372.435 3.514 20 0 FHADHM C[C@H](Sc1ccc(Cl)cc1)C(=O)Nc1sccc1-c1nnn[n-]1 ZINC000736193450 598752972 /nfs/dbraw/zinc/75/29/72/598752972.db2.gz RCYFYTIHAZGXOL-QMMMGPOBSA-N -1 3 365.871 3.701 20 0 FHADHM C[C@H](Sc1ccc(Cl)cc1)C(=O)Nc1sccc1-c1nn[n-]n1 ZINC000736193450 598752973 /nfs/dbraw/zinc/75/29/73/598752973.db2.gz RCYFYTIHAZGXOL-QMMMGPOBSA-N -1 3 365.871 3.701 20 0 FHADHM Fc1ccc(CNc2nc(-c3ccc(-c4nnn[n-]4)cc3)cs2)cc1 ZINC000737649122 598777224 /nfs/dbraw/zinc/77/72/24/598777224.db2.gz LWWXNOWUZUCSSY-UHFFFAOYSA-N -1 3 352.398 3.741 20 0 FHADHM Fc1ccc(CNc2nc(-c3ccc(-c4nn[n-]n4)cc3)cs2)cc1 ZINC000737649122 598777225 /nfs/dbraw/zinc/77/72/25/598777225.db2.gz LWWXNOWUZUCSSY-UHFFFAOYSA-N -1 3 352.398 3.741 20 0 FHADHM CCC(=CC(=O)OCc1cc(-c2nnn[n-]2)ccc1F)c1ccccc1 ZINC000736303071 598780414 /nfs/dbraw/zinc/78/04/14/598780414.db2.gz HNVLYHSAJOTCMA-ACCUITESSA-N -1 3 352.369 3.543 20 0 FHADHM CCC(=CC(=O)OCc1cc(-c2nn[n-]n2)ccc1F)c1ccccc1 ZINC000736303071 598780415 /nfs/dbraw/zinc/78/04/15/598780415.db2.gz HNVLYHSAJOTCMA-ACCUITESSA-N -1 3 352.369 3.543 20 0 FHADHM CC(C)[C@@H](c1ccccc1)N(C)C(=S)Nc1ccccc1-c1nnn[n-]1 ZINC000735735944 598789861 /nfs/dbraw/zinc/78/98/61/598789861.db2.gz QVUYMFTXHSKXMG-KRWDZBQOSA-N -1 3 366.494 3.893 20 0 FHADHM CC(C)[C@@H](c1ccccc1)N(C)C(=S)Nc1ccccc1-c1nn[n-]n1 ZINC000735735944 598789862 /nfs/dbraw/zinc/78/98/62/598789862.db2.gz QVUYMFTXHSKXMG-KRWDZBQOSA-N -1 3 366.494 3.893 20 0 FHADHM S=C(NC/C=C/c1ccccc1)Nc1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000738402168 598790882 /nfs/dbraw/zinc/79/08/82/598790882.db2.gz YTEAYVVZQHBBHA-QPJJXVBHSA-N -1 3 370.869 3.520 20 0 FHADHM S=C(NC/C=C/c1ccccc1)Nc1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000738402168 598790884 /nfs/dbraw/zinc/79/08/84/598790884.db2.gz YTEAYVVZQHBBHA-QPJJXVBHSA-N -1 3 370.869 3.520 20 0 FHADHM O=C(c1ccccc1)C1CCN(c2ccc(Cl)cc2-c2nnn[n-]2)CC1 ZINC000738278472 598792640 /nfs/dbraw/zinc/79/26/40/598792640.db2.gz LHAZGXUPQUSUQS-UHFFFAOYSA-N -1 3 367.840 3.619 20 0 FHADHM O=C(c1ccccc1)C1CCN(c2ccc(Cl)cc2-c2nn[n-]n2)CC1 ZINC000738278472 598792641 /nfs/dbraw/zinc/79/26/41/598792641.db2.gz LHAZGXUPQUSUQS-UHFFFAOYSA-N -1 3 367.840 3.619 20 0 FHADHM Fc1ccc(CN2CCC[C@H]2c2ccc(F)c(F)c2)c(-c2nn[n-]n2)c1 ZINC000737647394 598797194 /nfs/dbraw/zinc/79/71/94/598797194.db2.gz CTVGLUMEFYLSNM-KRWDZBQOSA-N -1 3 359.355 3.621 20 0 FHADHM Cc1cc(Oc2ncccc2-c2nnn[n-]2)ccc1NC(=O)[C@@H](C)C(C)C ZINC000737281454 598804417 /nfs/dbraw/zinc/80/44/17/598804417.db2.gz ZJSWACDLYFWGMC-ZDUSSCGKSA-N -1 3 366.425 3.593 20 0 FHADHM CC(C)Oc1ccc(NC(=S)N[C@@H]2CCCC[C@@H]2C)cc1-c1nnn[n-]1 ZINC000820173558 607367212 /nfs/dbraw/zinc/36/72/12/607367212.db2.gz HTLVHDMYSWNFCH-SWLSCSKDSA-N -1 3 374.514 3.519 20 0 FHADHM CC(C)Oc1ccc(NC(=S)N[C@@H]2CCCC[C@@H]2C)cc1-c1nn[n-]n1 ZINC000820173558 607367214 /nfs/dbraw/zinc/36/72/14/607367214.db2.gz HTLVHDMYSWNFCH-SWLSCSKDSA-N -1 3 374.514 3.519 20 0 FHADHM CCOc1ccc([C@H](Nc2ncccc2-c2nnn[n-]2)c2ccccc2)cc1 ZINC000736637138 598814482 /nfs/dbraw/zinc/81/44/82/598814482.db2.gz NCYLGMQLPRRHPH-LJQANCHMSA-N -1 3 372.432 3.862 20 0 FHADHM CCOc1ccc([C@H](Nc2ncccc2-c2nn[n-]n2)c2ccccc2)cc1 ZINC000736637138 598814484 /nfs/dbraw/zinc/81/44/84/598814484.db2.gz NCYLGMQLPRRHPH-LJQANCHMSA-N -1 3 372.432 3.862 20 0 FHADHM CCC[C@H](CC1CCCC1)C(=O)NCc1ccc(-c2nnn[n-]2)cc1F ZINC000736422651 598822399 /nfs/dbraw/zinc/82/23/99/598822399.db2.gz NHMYDPHCCJTJQY-OAHLLOKOSA-N -1 3 359.449 3.619 20 0 FHADHM CCC[C@H](CC1CCCC1)C(=O)NCc1ccc(-c2nn[n-]n2)cc1F ZINC000736422651 598822400 /nfs/dbraw/zinc/82/24/00/598822400.db2.gz NHMYDPHCCJTJQY-OAHLLOKOSA-N -1 3 359.449 3.619 20 0 FHADHM Fc1cc(-c2nnn[n-]2)cc(F)c1NCc1ccccc1OC1CCC1 ZINC000737638942 599306436 /nfs/dbraw/zinc/30/64/36/599306436.db2.gz LMGILZOYLINOBI-UHFFFAOYSA-N -1 3 357.364 3.688 20 0 FHADHM Fc1cc(-c2nn[n-]n2)cc(F)c1NCc1ccccc1OC1CCC1 ZINC000737638942 599306437 /nfs/dbraw/zinc/30/64/37/599306437.db2.gz LMGILZOYLINOBI-UHFFFAOYSA-N -1 3 357.364 3.688 20 0 FHADHM C[C@H](SCc1ccc2c(c1)OCCO2)c1ccc(-c2nnn[n-]2)cc1 ZINC000736189839 599325729 /nfs/dbraw/zinc/32/57/29/599325729.db2.gz CQEQDWOPIVSFGY-LBPRGKRZSA-N -1 3 354.435 3.632 20 0 FHADHM C[C@H](SCc1ccc2c(c1)OCCO2)c1ccc(-c2nn[n-]n2)cc1 ZINC000736189839 599325730 /nfs/dbraw/zinc/32/57/30/599325730.db2.gz CQEQDWOPIVSFGY-LBPRGKRZSA-N -1 3 354.435 3.632 20 0 FHADHM C[C@@H](S[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)C(=O)N(C)c1ccccc1 ZINC000736189698 599325735 /nfs/dbraw/zinc/32/57/35/599325735.db2.gz QKOCAUALMLLTPX-UONOGXRCSA-N -1 3 367.478 3.712 20 0 FHADHM C[C@@H](S[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)C(=O)N(C)c1ccccc1 ZINC000736189698 599325736 /nfs/dbraw/zinc/32/57/36/599325736.db2.gz QKOCAUALMLLTPX-UONOGXRCSA-N -1 3 367.478 3.712 20 0 FHADHM C[C@@H](SCCC(=O)Nc1ccc(F)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736187448 599327823 /nfs/dbraw/zinc/32/78/23/599327823.db2.gz AVDDFIWFYYUVAX-GFCCVEGCSA-N -1 3 371.441 3.829 20 0 FHADHM C[C@@H](SCCC(=O)Nc1ccc(F)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736187448 599327826 /nfs/dbraw/zinc/32/78/26/599327826.db2.gz AVDDFIWFYYUVAX-GFCCVEGCSA-N -1 3 371.441 3.829 20 0 FHADHM C[C@H](NC(=O)CS[C@@H](C)c1ccc(-c2nnn[n-]2)cc1)c1cccs1 ZINC000736103794 599327985 /nfs/dbraw/zinc/32/79/85/599327985.db2.gz FEPWHSRZEXOTQK-RYUDHWBXSA-N -1 3 373.507 3.600 20 0 FHADHM C[C@H](NC(=O)CS[C@@H](C)c1ccc(-c2nn[n-]n2)cc1)c1cccs1 ZINC000736103794 599327987 /nfs/dbraw/zinc/32/79/87/599327987.db2.gz FEPWHSRZEXOTQK-RYUDHWBXSA-N -1 3 373.507 3.600 20 0 FHADHM C[C@@H](S[C@@H](C)C(=O)Nc1cccc(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736191809 599328511 /nfs/dbraw/zinc/32/85/11/599328511.db2.gz XANXDXJINLIIJQ-NEPJUHHUSA-N -1 3 371.441 3.827 20 0 FHADHM C[C@@H](S[C@@H](C)C(=O)Nc1cccc(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736191809 599328513 /nfs/dbraw/zinc/32/85/13/599328513.db2.gz XANXDXJINLIIJQ-NEPJUHHUSA-N -1 3 371.441 3.827 20 0 FHADHM CCCCC[C@H](C)NC(=O)CS[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000736440517 599328645 /nfs/dbraw/zinc/32/86/45/599328645.db2.gz CQBZUUXHOVJTBO-KBPBESRZSA-N -1 3 361.515 3.746 20 0 FHADHM CCCCC[C@H](C)NC(=O)CS[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000736440517 599328646 /nfs/dbraw/zinc/32/86/46/599328646.db2.gz CQBZUUXHOVJTBO-KBPBESRZSA-N -1 3 361.515 3.746 20 0 FHADHM COc1ccc(-c2nn[n-]n2)cc1NCc1csc(-c2ccsc2)n1 ZINC000737062836 599328746 /nfs/dbraw/zinc/32/87/46/599328746.db2.gz QLRGQFCXSQBVDF-UHFFFAOYSA-N -1 3 370.463 3.672 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NCc1ccc(F)c(Br)c1 ZINC000737297660 599329589 /nfs/dbraw/zinc/32/95/89/599329589.db2.gz YEIUPKVMXFLXEO-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NCc1ccc(F)c(Br)c1 ZINC000737297660 599329592 /nfs/dbraw/zinc/32/95/92/599329592.db2.gz YEIUPKVMXFLXEO-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM C[C@@H](SCC(=O)Nc1ccc(Cl)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000736192466 599331022 /nfs/dbraw/zinc/33/10/22/599331022.db2.gz ZDDCZQIKSOSHIC-LLVKDONJSA-N -1 3 373.869 3.953 20 0 FHADHM C[C@@H](SCC(=O)Nc1ccc(Cl)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000736192466 599331024 /nfs/dbraw/zinc/33/10/24/599331024.db2.gz ZDDCZQIKSOSHIC-LLVKDONJSA-N -1 3 373.869 3.953 20 0 FHADHM CC(C)Oc1c(Cl)cccc1NC(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC000735905191 599332544 /nfs/dbraw/zinc/33/25/44/599332544.db2.gz YBNQYUKMZDJSFB-UHFFFAOYSA-N -1 3 372.816 3.951 20 0 FHADHM CC(C)Oc1c(Cl)cccc1NC(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC000735905191 599332547 /nfs/dbraw/zinc/33/25/47/599332547.db2.gz YBNQYUKMZDJSFB-UHFFFAOYSA-N -1 3 372.816 3.951 20 0 FHADHM CSc1ccc(NC(=O)[C@@H](C)Sc2ccccc2-c2nnn[n-]2)cc1 ZINC000821984358 599342959 /nfs/dbraw/zinc/34/29/59/599342959.db2.gz OGZLWWMIENWOGO-LLVKDONJSA-N -1 3 371.491 3.708 20 0 FHADHM CSc1ccc(NC(=O)[C@@H](C)Sc2ccccc2-c2nn[n-]n2)cc1 ZINC000821984358 599342962 /nfs/dbraw/zinc/34/29/62/599342962.db2.gz OGZLWWMIENWOGO-LLVKDONJSA-N -1 3 371.491 3.708 20 0 FHADHM Cc1cc(C)c(NC(=O)[C@@H](C)Sc2ccccc2-c2nnn[n-]2)c(C)c1 ZINC000822194456 599345586 /nfs/dbraw/zinc/34/55/86/599345586.db2.gz XZFGMJNKOHGWCK-CQSZACIVSA-N -1 3 367.478 3.911 20 0 FHADHM Cc1cc(C)c(NC(=O)[C@@H](C)Sc2ccccc2-c2nn[n-]n2)c(C)c1 ZINC000822194456 599345588 /nfs/dbraw/zinc/34/55/88/599345588.db2.gz XZFGMJNKOHGWCK-CQSZACIVSA-N -1 3 367.478 3.911 20 0 FHADHM Cc1ccccc1[C@@H](C)NC(=O)[C@@H](C)Sc1ccccc1-c1nnn[n-]1 ZINC000822345930 599348293 /nfs/dbraw/zinc/34/82/93/599348293.db2.gz WWDJMTVQYHBCEV-ZIAGYGMSSA-N -1 3 367.478 3.533 20 0 FHADHM Cc1ccccc1[C@@H](C)NC(=O)[C@@H](C)Sc1ccccc1-c1nn[n-]n1 ZINC000822345930 599348297 /nfs/dbraw/zinc/34/82/97/599348297.db2.gz WWDJMTVQYHBCEV-ZIAGYGMSSA-N -1 3 367.478 3.533 20 0 FHADHM C[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000736240628 599348470 /nfs/dbraw/zinc/34/84/70/599348470.db2.gz VPVQLIGKUDHPDT-NFAWXSAZSA-N -1 3 371.489 3.608 20 0 FHADHM C[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000736240628 599348472 /nfs/dbraw/zinc/34/84/72/599348472.db2.gz VPVQLIGKUDHPDT-NFAWXSAZSA-N -1 3 371.489 3.608 20 0 FHADHM CCc1ccccc1NC(=O)[C@H](C)Sc1ccccc1-c1nnn[n-]1 ZINC000821496894 599349853 /nfs/dbraw/zinc/34/98/53/599349853.db2.gz KVGGPOJMLDZZAU-LBPRGKRZSA-N -1 3 353.451 3.548 20 0 FHADHM CCc1ccccc1NC(=O)[C@H](C)Sc1ccccc1-c1nn[n-]n1 ZINC000821496894 599349855 /nfs/dbraw/zinc/34/98/55/599349855.db2.gz KVGGPOJMLDZZAU-LBPRGKRZSA-N -1 3 353.451 3.548 20 0 FHADHM O=C(CCSc1ccccc1-c1nnn[n-]1)Nc1cccc(Cl)c1 ZINC000822974301 599350541 /nfs/dbraw/zinc/35/05/41/599350541.db2.gz GJXWIFBESUCHLV-UHFFFAOYSA-N -1 3 359.842 3.641 20 0 FHADHM O=C(CCSc1ccccc1-c1nn[n-]n1)Nc1cccc(Cl)c1 ZINC000822974301 599350543 /nfs/dbraw/zinc/35/05/43/599350543.db2.gz GJXWIFBESUCHLV-UHFFFAOYSA-N -1 3 359.842 3.641 20 0 FHADHM CC(=O)Nc1ccc(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1Cl ZINC000819818228 599363583 /nfs/dbraw/zinc/36/35/83/599363583.db2.gz SOFLSDKAROZYRV-JTQLQIEISA-N -1 3 356.817 3.652 20 0 FHADHM CC(=O)Nc1ccc(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1Cl ZINC000819818228 599363585 /nfs/dbraw/zinc/36/35/85/599363585.db2.gz SOFLSDKAROZYRV-JTQLQIEISA-N -1 3 356.817 3.652 20 0 FHADHM CC(=O)Nc1ccc(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1Cl ZINC000819818229 599363661 /nfs/dbraw/zinc/36/36/61/599363661.db2.gz SOFLSDKAROZYRV-SNVBAGLBSA-N -1 3 356.817 3.652 20 0 FHADHM CC(=O)Nc1ccc(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1Cl ZINC000819818229 599363664 /nfs/dbraw/zinc/36/36/64/599363664.db2.gz SOFLSDKAROZYRV-SNVBAGLBSA-N -1 3 356.817 3.652 20 0 FHADHM C[C@H](OC(=O)c1ccccc1-c1ccccc1-c1nnn[n-]1)c1ccncc1 ZINC000736161042 599367481 /nfs/dbraw/zinc/36/74/81/599367481.db2.gz BNPOQUKADRIINC-AWEZNQCLSA-N -1 3 371.400 3.847 20 0 FHADHM C[C@H](OC(=O)c1ccccc1-c1ccccc1-c1nn[n-]n1)c1ccncc1 ZINC000736161042 599367484 /nfs/dbraw/zinc/36/74/84/599367484.db2.gz BNPOQUKADRIINC-AWEZNQCLSA-N -1 3 371.400 3.847 20 0 FHADHM O=C(COc1ccc(-c2nnn[n-]2)cc1Cl)c1ccc(F)c(Cl)c1 ZINC000737918359 599369086 /nfs/dbraw/zinc/36/90/86/599369086.db2.gz BZXNCGVCZYAODW-UHFFFAOYSA-N -1 3 367.167 3.574 20 0 FHADHM O=C(COc1ccc(-c2nn[n-]n2)cc1Cl)c1ccc(F)c(Cl)c1 ZINC000737918359 599369090 /nfs/dbraw/zinc/36/90/90/599369090.db2.gz BZXNCGVCZYAODW-UHFFFAOYSA-N -1 3 367.167 3.574 20 0 FHADHM CSCCCC(=O)Oc1ccc(-c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000737180164 599370169 /nfs/dbraw/zinc/37/01/69/599370169.db2.gz CKXCWXVJMMDBSP-UHFFFAOYSA-N -1 3 354.435 3.582 20 0 FHADHM CSCCCC(=O)Oc1ccc(-c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000737180164 599370171 /nfs/dbraw/zinc/37/01/71/599370171.db2.gz CKXCWXVJMMDBSP-UHFFFAOYSA-N -1 3 354.435 3.582 20 0 FHADHM CC(C)CN(C(=O)c1cc2occc2s1)c1ccc(-c2nnn[n-]2)cc1 ZINC000735817598 599371937 /nfs/dbraw/zinc/37/19/37/599371937.db2.gz CNJGXLOHNAULSC-UHFFFAOYSA-N -1 3 367.434 3.977 20 0 FHADHM CC(C)CN(C(=O)c1cc2occc2s1)c1ccc(-c2nn[n-]n2)cc1 ZINC000735817598 599371940 /nfs/dbraw/zinc/37/19/40/599371940.db2.gz CNJGXLOHNAULSC-UHFFFAOYSA-N -1 3 367.434 3.977 20 0 FHADHM Cc1cccc([C@H](C)OC(=O)CSc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000737385986 599376875 /nfs/dbraw/zinc/37/68/75/599376875.db2.gz AADDFHWQNBAOCX-ZDUSSCGKSA-N -1 3 354.435 3.572 20 0 FHADHM Cc1cccc([C@H](C)OC(=O)CSc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000737385986 599376878 /nfs/dbraw/zinc/37/68/78/599376878.db2.gz AADDFHWQNBAOCX-ZDUSSCGKSA-N -1 3 354.435 3.572 20 0 FHADHM C[C@H](Nc1ccc(Br)c(F)c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820456136 599382041 /nfs/dbraw/zinc/38/20/41/599382041.db2.gz QIGFQIVYEFGUOV-VIFPVBQESA-N -1 3 362.206 3.941 20 0 FHADHM C[C@H](Nc1ccc(Br)c(F)c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820456136 599382043 /nfs/dbraw/zinc/38/20/43/599382043.db2.gz QIGFQIVYEFGUOV-VIFPVBQESA-N -1 3 362.206 3.941 20 0 FHADHM Cc1cc(-c2nn[n-]n2)cc(C)c1OCC(=O)Nc1ccc2ccccc2c1 ZINC000822130521 599386920 /nfs/dbraw/zinc/38/69/20/599386920.db2.gz UVTDYHLAJPOAQF-UHFFFAOYSA-N -1 3 373.416 3.654 20 0 FHADHM CCOc1ccc([C@@H](C)Nc2cc(-c3nnn[n-]3)c3ccccc3n2)cc1 ZINC000736638143 599398518 /nfs/dbraw/zinc/39/85/18/599398518.db2.gz VIDYRRYZMITRQP-CYBMUJFWSA-N -1 3 360.421 3.987 20 0 FHADHM CCOc1ccc([C@@H](C)Nc2cc(-c3nn[n-]n3)c3ccccc3n2)cc1 ZINC000736638143 599398521 /nfs/dbraw/zinc/39/85/21/599398521.db2.gz VIDYRRYZMITRQP-CYBMUJFWSA-N -1 3 360.421 3.987 20 0 FHADHM COc1ccc(F)cc1[C@@H](C)Nc1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000737099973 599411601 /nfs/dbraw/zinc/41/16/01/599411601.db2.gz RTCJPLJMFYGQDF-LLVKDONJSA-N -1 3 364.384 3.736 20 0 FHADHM COc1ccc(F)cc1[C@@H](C)Nc1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000737099973 599411604 /nfs/dbraw/zinc/41/16/04/599411604.db2.gz RTCJPLJMFYGQDF-LLVKDONJSA-N -1 3 364.384 3.736 20 0 FHADHM Clc1ccc(-c2nnn[n-]2)c(NCc2cccc(Br)c2)c1 ZINC000737571106 599420566 /nfs/dbraw/zinc/42/05/66/599420566.db2.gz RUFLFPXEOLUEMH-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM Clc1ccc(-c2nn[n-]n2)c(NCc2cccc(Br)c2)c1 ZINC000737571106 599420568 /nfs/dbraw/zinc/42/05/68/599420568.db2.gz RUFLFPXEOLUEMH-UHFFFAOYSA-N -1 3 364.634 3.895 20 0 FHADHM Cc1ccc(C)n1C1CCN(c2cc(-c3nnn[n-]3)c3ccccc3n2)CC1 ZINC000737328326 599423074 /nfs/dbraw/zinc/42/30/74/599423074.db2.gz GBOLWMQINOUNJY-UHFFFAOYSA-N -1 3 373.464 3.675 20 0 FHADHM Cc1ccc(C)n1C1CCN(c2cc(-c3nn[n-]n3)c3ccccc3n2)CC1 ZINC000737328326 599423077 /nfs/dbraw/zinc/42/30/77/599423077.db2.gz GBOLWMQINOUNJY-UHFFFAOYSA-N -1 3 373.464 3.675 20 0 FHADHM Fc1ccccc1[C@H]1CCN(c2cc(-c3nnn[n-]3)c3ccccc3n2)C1 ZINC000737663892 599434601 /nfs/dbraw/zinc/43/46/01/599434601.db2.gz KUGBQBKBCHXFFA-ZDUSSCGKSA-N -1 3 360.396 3.548 20 0 FHADHM Fc1ccccc1[C@H]1CCN(c2cc(-c3nn[n-]n3)c3ccccc3n2)C1 ZINC000737663892 599434602 /nfs/dbraw/zinc/43/46/02/599434602.db2.gz KUGBQBKBCHXFFA-ZDUSSCGKSA-N -1 3 360.396 3.548 20 0 FHADHM Fc1ccccc1[C@@H]1CCN(c2cc(-c3nnn[n-]3)c3ccccc3n2)C1 ZINC000737663887 599434652 /nfs/dbraw/zinc/43/46/52/599434652.db2.gz KUGBQBKBCHXFFA-CYBMUJFWSA-N -1 3 360.396 3.548 20 0 FHADHM Fc1ccccc1[C@@H]1CCN(c2cc(-c3nn[n-]n3)c3ccccc3n2)C1 ZINC000737663887 599434653 /nfs/dbraw/zinc/43/46/53/599434653.db2.gz KUGBQBKBCHXFFA-CYBMUJFWSA-N -1 3 360.396 3.548 20 0 FHADHM c1cc(-c2nnn[n-]2)oc1CNCc1ccccc1Sc1ccccc1 ZINC000823791555 599434952 /nfs/dbraw/zinc/43/49/52/599434952.db2.gz FAASGKUKGYTSGI-UHFFFAOYSA-N -1 3 363.446 3.901 20 0 FHADHM c1cc(-c2nn[n-]n2)oc1CNCc1ccccc1Sc1ccccc1 ZINC000823791555 599434956 /nfs/dbraw/zinc/43/49/56/599434956.db2.gz FAASGKUKGYTSGI-UHFFFAOYSA-N -1 3 363.446 3.901 20 0 FHADHM C[C@H]1C[C@@H](c2ccccc2)CN1c1cc(-c2nnn[n-]2)c2ccccc2n1 ZINC000736235029 599438741 /nfs/dbraw/zinc/43/87/41/599438741.db2.gz LNONLOIXTUQAKS-GOEBONIOSA-N -1 3 356.433 3.797 20 0 FHADHM C[C@H]1C[C@@H](c2ccccc2)CN1c1cc(-c2nn[n-]n2)c2ccccc2n1 ZINC000736235029 599438743 /nfs/dbraw/zinc/43/87/43/599438743.db2.gz LNONLOIXTUQAKS-GOEBONIOSA-N -1 3 356.433 3.797 20 0 FHADHM Cc1cc(C)cc([C@H](C)NC(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000822196552 599440309 /nfs/dbraw/zinc/44/03/09/599440309.db2.gz NFNJXBBKMPLPDO-GJZGRUSLSA-N -1 3 364.453 3.605 20 0 FHADHM Cc1cc(C)cc([C@H](C)NC(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000822196552 599440311 /nfs/dbraw/zinc/44/03/11/599440311.db2.gz NFNJXBBKMPLPDO-GJZGRUSLSA-N -1 3 364.453 3.605 20 0 FHADHM CO[C@@H](c1ccc(Cl)cc1)[C@@H](C)Nc1cccc(F)c1-c1nnn[n-]1 ZINC000736962451 599443146 /nfs/dbraw/zinc/44/31/46/599443146.db2.gz OUAJDNAAXCRGJO-QLJPJBMISA-N -1 3 361.808 3.847 20 0 FHADHM CO[C@@H](c1ccc(Cl)cc1)[C@@H](C)Nc1cccc(F)c1-c1nn[n-]n1 ZINC000736962451 599443148 /nfs/dbraw/zinc/44/31/48/599443148.db2.gz OUAJDNAAXCRGJO-QLJPJBMISA-N -1 3 361.808 3.847 20 0 FHADHM Cc1sc(NC(=O)CCc2cc(Cl)cs2)c(-c2nnn[n-]2)c1C ZINC000737559887 599466781 /nfs/dbraw/zinc/46/67/81/599466781.db2.gz CGRBJKMIIJBDQH-UHFFFAOYSA-N -1 3 367.887 3.831 20 0 FHADHM Cc1sc(NC(=O)CCc2cc(Cl)cs2)c(-c2nn[n-]n2)c1C ZINC000737559887 599466782 /nfs/dbraw/zinc/46/67/82/599466782.db2.gz CGRBJKMIIJBDQH-UHFFFAOYSA-N -1 3 367.887 3.831 20 0 FHADHM CCCN(Cc1ccccc1)C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000821109221 599471395 /nfs/dbraw/zinc/47/13/95/599471395.db2.gz DAUYYVQWAXSWSR-HNNXBMFYSA-N -1 3 364.453 3.550 20 0 FHADHM CCCN(Cc1ccccc1)C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000821109221 599471398 /nfs/dbraw/zinc/47/13/98/599471398.db2.gz DAUYYVQWAXSWSR-HNNXBMFYSA-N -1 3 364.453 3.550 20 0 FHADHM C[C@@H](NC(=O)N1CCC[C@H]1c1cccs1)c1cccc(-c2nnn[n-]2)c1 ZINC000820349879 599485493 /nfs/dbraw/zinc/48/54/93/599485493.db2.gz JXIMJNJSGTXCTD-DOMZBBRYSA-N -1 3 368.466 3.536 20 0 FHADHM C[C@@H](NC(=O)N1CCC[C@H]1c1cccs1)c1cccc(-c2nn[n-]n2)c1 ZINC000820349879 599485496 /nfs/dbraw/zinc/48/54/96/599485496.db2.gz JXIMJNJSGTXCTD-DOMZBBRYSA-N -1 3 368.466 3.536 20 0 FHADHM Fc1ccc(NCCc2c[nH]c3cc(Cl)ccc23)c(-c2nnn[n-]2)c1 ZINC000822782734 599504908 /nfs/dbraw/zinc/50/49/08/599504908.db2.gz DPFPTLZBVYSEEK-UHFFFAOYSA-N -1 3 356.792 3.795 20 0 FHADHM Fc1ccc(NCCc2c[nH]c3cc(Cl)ccc23)c(-c2nn[n-]n2)c1 ZINC000822782734 599504909 /nfs/dbraw/zinc/50/49/09/599504909.db2.gz DPFPTLZBVYSEEK-UHFFFAOYSA-N -1 3 356.792 3.795 20 0 FHADHM C[C@@H](Nc1c(-c2nnn[n-]2)cnc2c(F)cc(F)cc21)c1cccc(O)c1 ZINC000820451972 599515538 /nfs/dbraw/zinc/51/55/38/599515538.db2.gz YXDYFJYSMNQODL-SECBINFHSA-N -1 3 368.347 3.572 20 0 FHADHM C[C@@H](Nc1c(-c2nn[n-]n2)cnc2c(F)cc(F)cc21)c1cccc(O)c1 ZINC000820451972 599515540 /nfs/dbraw/zinc/51/55/40/599515540.db2.gz YXDYFJYSMNQODL-SECBINFHSA-N -1 3 368.347 3.572 20 0 FHADHM Cc1cc([C@@H]2CCCN2c2ccc(-c3nn[n-]n3)cc2C(F)(F)F)no1 ZINC000737264219 599520980 /nfs/dbraw/zinc/52/09/80/599520980.db2.gz NRHZAZNEFMRBRS-AWEZNQCLSA-N -1 3 364.331 3.523 20 0 FHADHM Fc1ccc(N[C@H]2CCc3c2cccc3Br)c(-c2nnn[n-]2)c1 ZINC000822778811 599522988 /nfs/dbraw/zinc/52/29/88/599522988.db2.gz ODKDXZARYQUVOM-AWEZNQCLSA-N -1 3 374.217 3.868 20 0 FHADHM Fc1ccc(N[C@H]2CCc3c2cccc3Br)c(-c2nn[n-]n2)c1 ZINC000822778811 599522992 /nfs/dbraw/zinc/52/29/92/599522992.db2.gz ODKDXZARYQUVOM-AWEZNQCLSA-N -1 3 374.217 3.868 20 0 FHADHM C[C@@H](NC(=O)c1cc2cc(F)ccc2s1)c1cccc(-c2nnn[n-]2)c1 ZINC000820391156 599528892 /nfs/dbraw/zinc/52/88/92/599528892.db2.gz OARHRFALEVKFIU-SNVBAGLBSA-N -1 3 367.409 3.712 20 0 FHADHM C[C@@H](NC(=O)c1cc2cc(F)ccc2s1)c1cccc(-c2nn[n-]n2)c1 ZINC000820391156 599528894 /nfs/dbraw/zinc/52/88/94/599528894.db2.gz OARHRFALEVKFIU-SNVBAGLBSA-N -1 3 367.409 3.712 20 0 FHADHM Cc1cccc2c1CCN(c1c(-c3nnn[n-]3)cnc3c(C)cccc31)C2 ZINC000822340897 599529231 /nfs/dbraw/zinc/52/92/31/599529231.db2.gz MIQBYIGYPYYLRR-UHFFFAOYSA-N -1 3 356.433 3.594 20 0 FHADHM Cc1cccc2c1CCN(c1c(-c3nn[n-]n3)cnc3c(C)cccc31)C2 ZINC000822340897 599529232 /nfs/dbraw/zinc/52/92/32/599529232.db2.gz MIQBYIGYPYYLRR-UHFFFAOYSA-N -1 3 356.433 3.594 20 0 FHADHM CCCC(O)(CCC)CNc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000736434361 599530567 /nfs/dbraw/zinc/53/05/67/599530567.db2.gz FGGLGDXOIKACCC-UHFFFAOYSA-N -1 3 357.380 3.629 20 0 FHADHM CCCC(O)(CCC)CNc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000736434361 599530570 /nfs/dbraw/zinc/53/05/70/599530570.db2.gz FGGLGDXOIKACCC-UHFFFAOYSA-N -1 3 357.380 3.629 20 0 FHADHM CCSCc1ccc(C(=O)N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000821461139 599536921 /nfs/dbraw/zinc/53/69/21/599536921.db2.gz KGXUNNWXYCPUJK-ZDUSSCGKSA-N -1 3 367.478 3.611 20 0 FHADHM CCSCc1ccc(C(=O)N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)cc1 ZINC000821461139 599536923 /nfs/dbraw/zinc/53/69/23/599536923.db2.gz KGXUNNWXYCPUJK-ZDUSSCGKSA-N -1 3 367.478 3.611 20 0 FHADHM Cc1sc(NC(=O)[C@@H](C)Cc2ccccc2F)c(-c2nnn[n-]2)c1C ZINC000737561549 599540263 /nfs/dbraw/zinc/54/02/63/599540263.db2.gz ISWCCISGXAZYHE-VIFPVBQESA-N -1 3 359.430 3.501 20 0 FHADHM Cc1sc(NC(=O)[C@@H](C)Cc2ccccc2F)c(-c2nn[n-]n2)c1C ZINC000737561549 599540265 /nfs/dbraw/zinc/54/02/65/599540265.db2.gz ISWCCISGXAZYHE-VIFPVBQESA-N -1 3 359.430 3.501 20 0 FHADHM CCc1ccc([C@H](C)CC(=O)N(C)Cc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000736685117 599542296 /nfs/dbraw/zinc/54/22/96/599542296.db2.gz FREMEBFIRSDAFX-OAHLLOKOSA-N -1 3 363.465 3.581 20 0 FHADHM CCc1ccc([C@H](C)CC(=O)N(C)Cc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000736685117 599542297 /nfs/dbraw/zinc/54/22/97/599542297.db2.gz FREMEBFIRSDAFX-OAHLLOKOSA-N -1 3 363.465 3.581 20 0 FHADHM CC(C)(NC(=O)CCc1ccc(-c2nnn[n-]2)cc1)c1cccc(Cl)c1 ZINC000735671853 599547074 /nfs/dbraw/zinc/54/70/74/599547074.db2.gz NYCKIZPASDXGON-UHFFFAOYSA-N -1 3 369.856 3.504 20 0 FHADHM CC(C)(NC(=O)CCc1ccc(-c2nn[n-]n2)cc1)c1cccc(Cl)c1 ZINC000735671853 599547077 /nfs/dbraw/zinc/54/70/77/599547077.db2.gz NYCKIZPASDXGON-UHFFFAOYSA-N -1 3 369.856 3.504 20 0 FHADHM O=C(NC(c1cccs1)c1cccs1)c1sccc1-c1nnn[n-]1 ZINC000738001591 599549995 /nfs/dbraw/zinc/54/99/95/599549995.db2.gz MPTMCUVMYFJPDJ-UHFFFAOYSA-N -1 3 373.488 3.571 20 0 FHADHM O=C(NC(c1cccs1)c1cccs1)c1sccc1-c1nn[n-]n1 ZINC000738001591 599549998 /nfs/dbraw/zinc/54/99/98/599549998.db2.gz MPTMCUVMYFJPDJ-UHFFFAOYSA-N -1 3 373.488 3.571 20 0 FHADHM CCS[C@H]1CCCCN(c2c(-c3nnn[n-]3)cnc3ccccc32)C1 ZINC000821455224 599553037 /nfs/dbraw/zinc/55/30/37/599553037.db2.gz IWJNFPIIXHZHSZ-ZDUSSCGKSA-N -1 3 354.483 3.527 20 0 FHADHM CCS[C@H]1CCCCN(c2c(-c3nn[n-]n3)cnc3ccccc32)C1 ZINC000821455224 599553040 /nfs/dbraw/zinc/55/30/40/599553040.db2.gz IWJNFPIIXHZHSZ-ZDUSSCGKSA-N -1 3 354.483 3.527 20 0 FHADHM Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)Nc2cccc(-c3nnn[n-]3)c2)o1 ZINC000822233704 599555814 /nfs/dbraw/zinc/55/58/14/599555814.db2.gz TWHBFVZWFDPCIG-LRDDRELGSA-N -1 3 366.425 3.773 20 0 FHADHM Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)Nc2cccc(-c3nn[n-]n3)c2)o1 ZINC000822233704 599555817 /nfs/dbraw/zinc/55/58/17/599555817.db2.gz TWHBFVZWFDPCIG-LRDDRELGSA-N -1 3 366.425 3.773 20 0 FHADHM C[C@@H](CCc1ccccc1F)C(=O)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000820254910 599556950 /nfs/dbraw/zinc/55/69/50/599556950.db2.gz ZPGSTKUDWWFOEK-NSHDSACASA-N -1 3 373.819 3.867 20 0 FHADHM C[C@@H](CCc1ccccc1F)C(=O)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000820254910 599556952 /nfs/dbraw/zinc/55/69/52/599556952.db2.gz ZPGSTKUDWWFOEK-NSHDSACASA-N -1 3 373.819 3.867 20 0 FHADHM C[C@@H]1C[C@@H](c2ccccc2)CN1c1c(-c2nnn[n-]2)cnc2ccccc21 ZINC000820668294 599559231 /nfs/dbraw/zinc/55/92/31/599559231.db2.gz RHUICMHRPLBMMV-GDBMZVCRSA-N -1 3 356.433 3.797 20 0 FHADHM C[C@@H]1C[C@@H](c2ccccc2)CN1c1c(-c2nn[n-]n2)cnc2ccccc21 ZINC000820668294 599559233 /nfs/dbraw/zinc/55/92/33/599559233.db2.gz RHUICMHRPLBMMV-GDBMZVCRSA-N -1 3 356.433 3.797 20 0 FHADHM Cc1ccc([C@@H]2CCCCCN2C(=O)c2cccc(-c3nnn[n-]3)c2)o1 ZINC000737330001 599560913 /nfs/dbraw/zinc/56/09/13/599560913.db2.gz MAWILWKNGJGBSP-INIZCTEOSA-N -1 3 351.410 3.526 20 0 FHADHM Cc1ccc([C@@H]2CCCCCN2C(=O)c2cccc(-c3nn[n-]n3)c2)o1 ZINC000737330001 599560914 /nfs/dbraw/zinc/56/09/14/599560914.db2.gz MAWILWKNGJGBSP-INIZCTEOSA-N -1 3 351.410 3.526 20 0 FHADHM CCCCN(CC)C(=O)c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000736457093 599562187 /nfs/dbraw/zinc/56/21/87/599562187.db2.gz OCCGKVBSNILVEZ-UHFFFAOYSA-N -1 3 364.453 3.873 20 0 FHADHM COc1ccc([C@H](C)CCNc2c(F)cc(-c3nnn[n-]3)cc2F)cc1 ZINC000821777855 599588458 /nfs/dbraw/zinc/58/84/58/599588458.db2.gz NBVYRDHTRFKSTN-LLVKDONJSA-N -1 3 359.380 3.759 20 0 FHADHM COc1ccc([C@H](C)CCNc2c(F)cc(-c3nn[n-]n3)cc2F)cc1 ZINC000821777855 599588460 /nfs/dbraw/zinc/58/84/60/599588460.db2.gz NBVYRDHTRFKSTN-LLVKDONJSA-N -1 3 359.380 3.759 20 0 FHADHM C[C@H](OC(=O)[C@H]1C[C@@H]1c1cccc(F)c1F)c1cccc(-c2nnn[n-]2)c1 ZINC000820488452 599621331 /nfs/dbraw/zinc/62/13/31/599621331.db2.gz OFVJHTCBJRSIBY-VQISRLSMSA-N -1 3 370.359 3.553 20 0 FHADHM C[C@H](OC(=O)[C@H]1C[C@@H]1c1cccc(F)c1F)c1cccc(-c2nn[n-]n2)c1 ZINC000820488452 599621332 /nfs/dbraw/zinc/62/13/32/599621332.db2.gz OFVJHTCBJRSIBY-VQISRLSMSA-N -1 3 370.359 3.553 20 0 FHADHM O=C(OCc1cccc(-c2nnn[n-]2)c1)C1CCC(c2ccccc2)CC1 ZINC000823431818 599624334 /nfs/dbraw/zinc/62/43/34/599624334.db2.gz YIAFRLRXCFOWMX-UHFFFAOYSA-N -1 3 362.433 3.884 20 0 FHADHM O=C(OCc1cccc(-c2nn[n-]n2)c1)C1CCC(c2ccccc2)CC1 ZINC000823431818 599624335 /nfs/dbraw/zinc/62/43/35/599624335.db2.gz YIAFRLRXCFOWMX-UHFFFAOYSA-N -1 3 362.433 3.884 20 0 FHADHM O=C(Nc1sccc1-c1nnn[n-]1)C1CCC(c2ccccc2)CC1 ZINC000823387783 599629809 /nfs/dbraw/zinc/62/98/09/599629809.db2.gz XRWNJVPCAZGKMV-UHFFFAOYSA-N -1 3 353.451 3.841 20 0 FHADHM O=C(Nc1sccc1-c1nn[n-]n1)C1CCC(c2ccccc2)CC1 ZINC000823387783 599629810 /nfs/dbraw/zinc/62/98/10/599629810.db2.gz XRWNJVPCAZGKMV-UHFFFAOYSA-N -1 3 353.451 3.841 20 0 FHADHM C[C@@H](C(=O)Nc1sc(-c2ccccc2)cc1-c1nnn[n-]1)C(F)(F)F ZINC000819875645 599630153 /nfs/dbraw/zinc/63/01/53/599630153.db2.gz AUQBPWGCCLXJHB-QMMMGPOBSA-N -1 3 367.356 3.732 20 0 FHADHM C[C@@H](C(=O)Nc1sc(-c2ccccc2)cc1-c1nn[n-]n1)C(F)(F)F ZINC000819875645 599630154 /nfs/dbraw/zinc/63/01/54/599630154.db2.gz AUQBPWGCCLXJHB-QMMMGPOBSA-N -1 3 367.356 3.732 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1)c1ccc(Cl)s1 ZINC000823303853 599632505 /nfs/dbraw/zinc/63/25/05/599632505.db2.gz XCPFEMNCZHYLRP-UHFFFAOYSA-N -1 3 373.747 3.853 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1)c1ccc(Cl)s1 ZINC000823303853 599632506 /nfs/dbraw/zinc/63/25/06/599632506.db2.gz XCPFEMNCZHYLRP-UHFFFAOYSA-N -1 3 373.747 3.853 20 0 FHADHM O=C(OCc1cc(Cl)ccc1Cl)c1sccc1-c1nnn[n-]1 ZINC000823414368 599659897 /nfs/dbraw/zinc/65/98/97/599659897.db2.gz WBOCSGQNTOCBRZ-UHFFFAOYSA-N -1 3 355.206 3.592 20 0 FHADHM C[C@H](NC(=O)NCc1ccc2ccccc2c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820375192 599673987 /nfs/dbraw/zinc/67/39/87/599673987.db2.gz ZRGNYZUFLYRYOH-AWEZNQCLSA-N -1 3 372.432 3.580 20 0 FHADHM C[C@H](NC(=O)NCc1ccc2ccccc2c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820375192 599673988 /nfs/dbraw/zinc/67/39/88/599673988.db2.gz ZRGNYZUFLYRYOH-AWEZNQCLSA-N -1 3 372.432 3.580 20 0 FHADHM CC[C@H](C)C[C@@H](C)NC(=O)N(Cc1ccc(-c2nnn[n-]2)cc1)C(C)C ZINC000820869576 599678555 /nfs/dbraw/zinc/67/85/55/599678555.db2.gz HYTYOIIFOFKWCR-LSDHHAIUSA-N -1 3 358.490 3.611 20 0 FHADHM CC[C@H](C)C[C@@H](C)NC(=O)N(Cc1ccc(-c2nn[n-]n2)cc1)C(C)C ZINC000820869576 599678556 /nfs/dbraw/zinc/67/85/56/599678556.db2.gz HYTYOIIFOFKWCR-LSDHHAIUSA-N -1 3 358.490 3.611 20 0 FHADHM C[C@H](NC(=O)N(C)C1CCCCCCC1)c1cccc(-c2nnn[n-]2)c1 ZINC000820339638 599682056 /nfs/dbraw/zinc/68/20/56/599682056.db2.gz FMJXWOHLAOEMNI-AWEZNQCLSA-N -1 3 356.474 3.682 20 0 FHADHM C[C@H](NC(=O)N(C)C1CCCCCCC1)c1cccc(-c2nn[n-]n2)c1 ZINC000820339638 599682057 /nfs/dbraw/zinc/68/20/57/599682057.db2.gz FMJXWOHLAOEMNI-AWEZNQCLSA-N -1 3 356.474 3.682 20 0 FHADHM COc1ccc(C2CCN(c3ccc(Cl)cc3-c3nnn[n-]3)CC2)cc1 ZINC000821787142 599686680 /nfs/dbraw/zinc/68/66/80/599686680.db2.gz ORPZCALVAHJIHP-UHFFFAOYSA-N -1 3 369.856 3.913 20 0 FHADHM COc1ccc(C2CCN(c3ccc(Cl)cc3-c3nn[n-]n3)CC2)cc1 ZINC000821787142 599686681 /nfs/dbraw/zinc/68/66/81/599686681.db2.gz ORPZCALVAHJIHP-UHFFFAOYSA-N -1 3 369.856 3.913 20 0 FHADHM Fc1ccccc1-c1cnc(CNc2ccc(Cl)c(-c3nnn[n-]3)c2)o1 ZINC000822792396 599691612 /nfs/dbraw/zinc/69/16/12/599691612.db2.gz VGLHTGHXNXBNHA-UHFFFAOYSA-N -1 3 370.775 3.926 20 0 FHADHM Fc1ccccc1-c1cnc(CNc2ccc(Cl)c(-c3nn[n-]n3)c2)o1 ZINC000822792396 599691613 /nfs/dbraw/zinc/69/16/13/599691613.db2.gz VGLHTGHXNXBNHA-UHFFFAOYSA-N -1 3 370.775 3.926 20 0 FHADHM CC[C@H]1C[C@@H](C)CN1C(=O)Nc1ccc(-c2nnn[n-]2)c(C(F)(F)F)c1 ZINC000820966921 599693386 /nfs/dbraw/zinc/69/33/86/599693386.db2.gz IUVPKFPXSHSEKL-KOLCDFICSA-N -1 3 368.363 3.538 20 0 FHADHM CC[C@H]1C[C@@H](C)CN1C(=O)Nc1ccc(-c2nn[n-]n2)c(C(F)(F)F)c1 ZINC000820966921 599693387 /nfs/dbraw/zinc/69/33/87/599693387.db2.gz IUVPKFPXSHSEKL-KOLCDFICSA-N -1 3 368.363 3.538 20 0 FHADHM O=C([O-])c1occc1CNC1(c2ccc(Br)cc2)CCC1 ZINC000740281026 599712803 /nfs/dbraw/zinc/71/28/03/599712803.db2.gz HPHSTPVXSIVEEQ-UHFFFAOYSA-N -1 3 350.212 3.909 20 0 FHADHM CN(C)CCN(Cc1ccccc1)C(=O)Nc1ccc(F)c(NC(=O)[O-])c1 ZINC000737369503 599716623 /nfs/dbraw/zinc/71/66/23/599716623.db2.gz KCMALXMEICYAMN-UHFFFAOYSA-N -1 3 374.416 3.511 20 0 FHADHM Cc1ccc(C(=O)[O-])cc1NC(=O)[C@@H](C)N1CC[C@@H](c2ccccc2C)C1 ZINC000738518627 599717049 /nfs/dbraw/zinc/71/70/49/599717049.db2.gz MCDLMAWICUHUGV-SJLPKXTDSA-N -1 3 366.461 3.818 20 0 FHADHM O=C([O-])c1sccc1NC(=O)CN[C@@H](c1ccc(F)cc1)C1CCC1 ZINC000739308715 599793175 /nfs/dbraw/zinc/79/31/75/599793175.db2.gz VQYFTTIRFNJQCN-MRXNPFEDSA-N -1 3 362.426 3.655 20 0 FHADHM O=C([O-])[C@@H](NCc1cc(Cl)c2c(c1)OCCCO2)c1ccc(F)cc1 ZINC000426786448 599841949 /nfs/dbraw/zinc/84/19/49/599841949.db2.gz VQSADGAFOCONDU-INIZCTEOSA-N -1 3 365.788 3.556 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1COC(=O)C[C@@H](C)c1ccc(F)cc1 ZINC000826253639 607407910 /nfs/dbraw/zinc/40/79/10/607407910.db2.gz XTLGFRQFFHDOFG-CYBMUJFWSA-N -1 3 354.385 3.551 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1COC(=O)C[C@@H](C)c1ccc(F)cc1 ZINC000826253639 607407911 /nfs/dbraw/zinc/40/79/11/607407911.db2.gz XTLGFRQFFHDOFG-CYBMUJFWSA-N -1 3 354.385 3.551 20 0 FHADHM O=C(Nc1ccc(Sc2ccncc2)cc1)c1cccc(-c2nnn[n-]2)c1 ZINC000823355335 607408368 /nfs/dbraw/zinc/40/83/68/607408368.db2.gz AMGCHMBUQHISEX-UHFFFAOYSA-N -1 3 374.429 3.665 20 0 FHADHM O=C(Nc1ccc(Sc2ccncc2)cc1)c1cccc(-c2nn[n-]n2)c1 ZINC000823355335 607408369 /nfs/dbraw/zinc/40/83/69/607408369.db2.gz AMGCHMBUQHISEX-UHFFFAOYSA-N -1 3 374.429 3.665 20 0 FHADHM COc1cc2c(cc1OC)[C@@H](CC(=O)[O-])N(Cc1cccc(C)c1)CC2 ZINC000517750407 599984523 /nfs/dbraw/zinc/98/45/23/599984523.db2.gz HYFBZQKXWRCHBE-GOSISDBHSA-N -1 3 355.434 3.586 20 0 FHADHM COc1cc2c(cc1CN[C@@H](CCC(=O)[O-])c1ccccc1)O[C@H](C)C2 ZINC000580292793 599992771 /nfs/dbraw/zinc/99/27/71/599992771.db2.gz MJSISJQIABVUAQ-KDOFPFPSSA-N -1 3 355.434 3.714 20 0 FHADHM Cc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(C(=O)[O-])c(C)c2)c1 ZINC000738708165 600012973 /nfs/dbraw/zinc/01/29/73/600012973.db2.gz IOKSQPCDECPXIJ-UHFFFAOYSA-N -1 3 369.465 3.597 20 0 FHADHM COc1ccc([C@@H](NCC(=O)Nc2cc(C(=O)[O-])ccc2C)C(C)C)cc1 ZINC000737969337 600048467 /nfs/dbraw/zinc/04/84/67/600048467.db2.gz FUXUZXOVTNLLQE-FQEVSTJZSA-N -1 3 370.449 3.627 20 0 FHADHM O=C(NC1(c2cccc(-c3nnn[n-]3)c2)CC1)c1ccc2sccc2c1 ZINC000826428100 607420064 /nfs/dbraw/zinc/42/00/64/607420064.db2.gz OPRHDTPPFHIBGI-UHFFFAOYSA-N -1 3 361.430 3.501 20 0 FHADHM O=C(NC1(c2cccc(-c3nn[n-]n3)c2)CC1)c1ccc2sccc2c1 ZINC000826428100 607420066 /nfs/dbraw/zinc/42/00/66/607420066.db2.gz OPRHDTPPFHIBGI-UHFFFAOYSA-N -1 3 361.430 3.501 20 0 FHADHM CCN(C(=O)Nc1ccc(OC(C)C)c(-c2nnn[n-]2)c1)[C@@H](C)C(C)C ZINC000821154520 607425050 /nfs/dbraw/zinc/42/50/50/607425050.db2.gz OFEJSARPABNXRG-ZDUSSCGKSA-N -1 3 360.462 3.552 20 0 FHADHM CCN(C(=O)Nc1ccc(OC(C)C)c(-c2nn[n-]n2)c1)[C@@H](C)C(C)C ZINC000821154520 607425051 /nfs/dbraw/zinc/42/50/51/607425051.db2.gz OFEJSARPABNXRG-ZDUSSCGKSA-N -1 3 360.462 3.552 20 0 FHADHM O=C(NC1(c2cccc(-c3nnn[n-]3)c2)CC1)c1cc2ccccc2s1 ZINC000826428152 607427697 /nfs/dbraw/zinc/42/76/97/607427697.db2.gz QHONBJCFASRVCI-UHFFFAOYSA-N -1 3 361.430 3.501 20 0 FHADHM O=C(NC1(c2cccc(-c3nn[n-]n3)c2)CC1)c1cc2ccccc2s1 ZINC000826428152 607427699 /nfs/dbraw/zinc/42/76/99/607427699.db2.gz QHONBJCFASRVCI-UHFFFAOYSA-N -1 3 361.430 3.501 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)Nc1sccc1C(=O)C(C)(C)C ZINC000826251522 607432017 /nfs/dbraw/zinc/43/20/17/607432017.db2.gz RYRHLPSGOIOPKP-UHFFFAOYSA-N -1 3 369.450 3.718 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)Nc1sccc1C(=O)C(C)(C)C ZINC000826251522 607432019 /nfs/dbraw/zinc/43/20/19/607432019.db2.gz RYRHLPSGOIOPKP-UHFFFAOYSA-N -1 3 369.450 3.718 20 0 FHADHM Cc1cc2oc(=O)cc(CN3CCC4(C[C@H]4C(=O)[O-])CC3)c2cc1C(C)C ZINC000738486616 600311413 /nfs/dbraw/zinc/31/14/13/600311413.db2.gz CACMCYFOMDUPRU-SFHVURJKSA-N -1 3 369.461 3.912 20 0 FHADHM CCc1ccc(CN2CCc3cc(OC)c(OC)cc3[C@H]2CC(=O)[O-])cc1 ZINC000737265853 600316824 /nfs/dbraw/zinc/31/68/24/600316824.db2.gz URLUTKAWBZCFLE-LJQANCHMSA-N -1 3 369.461 3.840 20 0 FHADHM Cc1c(C(=O)N(C)c2ccc(-c3nnn[n-]3)cc2)sc2cccc(F)c12 ZINC000826234436 607440654 /nfs/dbraw/zinc/44/06/54/607440654.db2.gz WJDCDCXEONRVNY-UHFFFAOYSA-N -1 3 367.409 3.806 20 0 FHADHM Cc1c(C(=O)N(C)c2ccc(-c3nn[n-]n3)cc2)sc2cccc(F)c12 ZINC000826234436 607440655 /nfs/dbraw/zinc/44/06/55/607440655.db2.gz WJDCDCXEONRVNY-UHFFFAOYSA-N -1 3 367.409 3.806 20 0 FHADHM C[C@@H](N[C@H](C(=O)[O-])c1cccc(Cl)c1)c1ccc2c(c1)CCC(=O)N2 ZINC000736661269 600423786 /nfs/dbraw/zinc/42/37/86/600423786.db2.gz DNUZQFPEDATECJ-ZMZPIMSZSA-N -1 3 358.825 3.701 20 0 FHADHM COc1ccc(CN[C@H](C(=O)[O-])c2ccc(F)cc2)cc1Br ZINC000426808694 600432616 /nfs/dbraw/zinc/43/26/16/600432616.db2.gz NMKIYAKYKFKTJO-HNNXBMFYSA-N -1 3 368.202 3.512 20 0 FHADHM COc1ccc(CN[C@@H](C(=O)[O-])c2ccccc2)cc1OC1CCCC1 ZINC000738009003 600434626 /nfs/dbraw/zinc/43/46/26/600434626.db2.gz WGSPGDHCFTWNEX-HXUWFJFHSA-N -1 3 355.434 3.932 20 0 FHADHM Cc1ccc(COC(=O)c2ccccc2-c2ccccc2-c2nnn[n-]2)cn1 ZINC000822238353 607446399 /nfs/dbraw/zinc/44/63/99/607446399.db2.gz DESWRKSILPWHNN-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM Cc1ccc(COC(=O)c2ccccc2-c2ccccc2-c2nn[n-]n2)cn1 ZINC000822238353 607446401 /nfs/dbraw/zinc/44/64/01/607446401.db2.gz DESWRKSILPWHNN-UHFFFAOYSA-N -1 3 371.400 3.594 20 0 FHADHM Cc1[nH]c(C(=O)[C@H](C)N2C[C@H](c3ccccc3)C[C@@H]2C)c(C)c1C(=O)[O-] ZINC000738228853 600630646 /nfs/dbraw/zinc/63/06/46/600630646.db2.gz CTAODOCTELGCBW-YLQAJVPDSA-N -1 3 354.450 3.779 20 0 FHADHM COc1ccc(OCCN[C@@H](C(=O)[O-])c2ccc(Cl)cc2Cl)cc1 ZINC000832443899 600734510 /nfs/dbraw/zinc/73/45/10/600734510.db2.gz AWXJFKMECJLQIN-MRXNPFEDSA-N -1 3 370.232 3.796 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1SCc1noc(C2CCCCC2)n1 ZINC000822748001 607466880 /nfs/dbraw/zinc/46/68/80/607466880.db2.gz BVNJAUXKYXNZHK-UHFFFAOYSA-N -1 3 360.418 3.729 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1SCc1noc(C2CCCCC2)n1 ZINC000822748001 607466882 /nfs/dbraw/zinc/46/68/82/607466882.db2.gz BVNJAUXKYXNZHK-UHFFFAOYSA-N -1 3 360.418 3.729 20 0 FHADHM C[C@H]1CCN(C(=O)c2ccccc2NC(=O)[O-])CCN1Cc1ccccc1 ZINC000828284342 600961757 /nfs/dbraw/zinc/96/17/57/600961757.db2.gz DTLHLVRXNDQWOW-INIZCTEOSA-N -1 3 367.449 3.513 20 0 FHADHM CC(C)CCOc1ccccc1CNCc1ccc(-c2nn[n-]n2)cc1F ZINC000820076640 607478240 /nfs/dbraw/zinc/47/82/40/607478240.db2.gz QCASGOBAQAWUOP-UHFFFAOYSA-N -1 3 369.444 3.721 20 0 FHADHM Cc1cccc([C@H]2CCCN2CC(=O)N(C)c2ccccc2C(=O)[O-])c1C ZINC000738698630 600979109 /nfs/dbraw/zinc/97/91/09/600979109.db2.gz PXQOMDFLXLIXOO-HXUWFJFHSA-N -1 3 366.461 3.802 20 0 FHADHM Cn1nccc1[C@H]1CCCN([C@H](C(=O)[O-])c2ccc(Cl)cc2Cl)C1 ZINC000833061258 600990241 /nfs/dbraw/zinc/99/02/41/600990241.db2.gz RAYLMQKCDBOORI-ZBEGNZNMSA-N -1 3 368.264 3.732 20 0 FHADHM O=C([O-])[C@@H](c1ccccc1F)N1CCC([C@H](O)c2ccc(F)cc2)CC1 ZINC000833172575 601005686 /nfs/dbraw/zinc/00/56/86/601005686.db2.gz JQJIOIGBNSRDFL-RTBURBONSA-N -1 3 361.388 3.536 20 0 FHADHM Fc1cc(-c2nnn[n-]2)ccc1CNc1cccc(-c2nccs2)c1 ZINC000822744550 607489736 /nfs/dbraw/zinc/48/97/36/607489736.db2.gz WFDIJXIJHFHHBZ-UHFFFAOYSA-N -1 3 352.398 3.741 20 0 FHADHM Fc1cc(-c2nn[n-]n2)ccc1CNc1cccc(-c2nccs2)c1 ZINC000822744550 607489737 /nfs/dbraw/zinc/48/97/37/607489737.db2.gz WFDIJXIJHFHHBZ-UHFFFAOYSA-N -1 3 352.398 3.741 20 0 FHADHM CC1CCN(c2cccc(NCc3ccc(-c4nnn[n-]4)cc3F)c2)CC1 ZINC000820727777 607489999 /nfs/dbraw/zinc/48/99/99/607489999.db2.gz OSDKQWSCXWWBKN-UHFFFAOYSA-N -1 3 366.444 3.854 20 0 FHADHM CC1CCN(c2cccc(NCc3ccc(-c4nn[n-]n4)cc3F)c2)CC1 ZINC000820727777 607490001 /nfs/dbraw/zinc/49/00/01/607490001.db2.gz OSDKQWSCXWWBKN-UHFFFAOYSA-N -1 3 366.444 3.854 20 0 FHADHM Cc1ccc(CN(C)C)cc1NC(=O)c1ccccc1S[C@H](C)C(=O)[O-] ZINC000832932323 601148436 /nfs/dbraw/zinc/14/84/36/601148436.db2.gz SCQHRTKFHNAQOO-CQSZACIVSA-N -1 3 372.490 3.874 20 0 FHADHM C[C@@](NCc1csc(COc2ccc(Cl)cc2)n1)(C(=O)[O-])C1CC1 ZINC000827741524 601174394 /nfs/dbraw/zinc/17/43/94/601174394.db2.gz OCPMYTSQAINVDA-KRWDZBQOSA-N -1 3 366.870 3.718 20 0 FHADHM C[C@@H](C(=O)[O-])[C@@H](NCC(=O)N[C@@H](C)c1ccc(Cl)cc1)c1ccccc1 ZINC000827637896 601201827 /nfs/dbraw/zinc/20/18/27/601201827.db2.gz XKTDHIRNUXJTFQ-BIENJYKASA-N -1 3 374.868 3.569 20 0 FHADHM Cc1c(NC(=O)[C@H](C)CSCc2ccccc2)cccc1-c1nnn[n-]1 ZINC000822061424 607501073 /nfs/dbraw/zinc/50/10/73/607501073.db2.gz NNLFZRGFMQUHBR-CYBMUJFWSA-N -1 3 367.478 3.683 20 0 FHADHM Cc1c(NC(=O)[C@H](C)CSCc2ccccc2)cccc1-c1nn[n-]n1 ZINC000822061424 607501076 /nfs/dbraw/zinc/50/10/76/607501076.db2.gz NNLFZRGFMQUHBR-CYBMUJFWSA-N -1 3 367.478 3.683 20 0 FHADHM C[C@@H](CSCc1ccccc1)C(=O)Nc1ccc(F)cc1-c1nnn[n-]1 ZINC000820291961 607501549 /nfs/dbraw/zinc/50/15/49/607501549.db2.gz BBXCQBTUBJDWCF-LBPRGKRZSA-N -1 3 371.441 3.514 20 0 FHADHM C[C@@H](CSCc1ccccc1)C(=O)Nc1ccc(F)cc1-c1nn[n-]n1 ZINC000820291961 607501550 /nfs/dbraw/zinc/50/15/50/607501550.db2.gz BBXCQBTUBJDWCF-LBPRGKRZSA-N -1 3 371.441 3.514 20 0 FHADHM CC(C)CNC(=O)c1cccc(CN[C@H](c2ccccc2)[C@H](C)C(=O)[O-])c1 ZINC000826891263 601658004 /nfs/dbraw/zinc/65/80/04/601658004.db2.gz MILZHROTZWUDFF-JXFKEZNVSA-N -1 3 368.477 3.624 20 0 FHADHM Cc1ccc(Cl)cc1NC(=O)CN[C@H](c1ccccc1)[C@H](C)C(=O)[O-] ZINC000832934326 601658233 /nfs/dbraw/zinc/65/82/33/601658233.db2.gz CNRWMRIPAXOCRG-UGSOOPFHSA-N -1 3 360.841 3.639 20 0 FHADHM COc1cc(C(C)=O)ccc1S[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000826177651 607539342 /nfs/dbraw/zinc/53/93/42/607539342.db2.gz PRZLCDAKFZSWRD-GFCCVEGCSA-N -1 3 354.435 3.931 20 0 FHADHM COc1cc(C(C)=O)ccc1S[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000826177651 607539343 /nfs/dbraw/zinc/53/93/43/607539343.db2.gz PRZLCDAKFZSWRD-GFCCVEGCSA-N -1 3 354.435 3.931 20 0 FHADHM O=C([O-])Nc1ccc(F)c(NC(=O)c2cccc(CN3CCCC3)c2)c1 ZINC000740704516 602026348 /nfs/dbraw/zinc/02/63/48/602026348.db2.gz NUIUWKGPINLIJZ-UHFFFAOYSA-N -1 3 357.385 3.764 20 0 FHADHM CC[C@@](C)(CC(=O)[O-])NCc1csc(-c2cccc(OC)c2OC)n1 ZINC000828671920 602219278 /nfs/dbraw/zinc/21/92/78/602219278.db2.gz IMWOYHJDTQGTRI-SFHVURJKSA-N -1 3 364.467 3.560 20 0 FHADHM CC[C@](C)(CC(=O)[O-])NCc1ncc(-c2ccccc2Br)o1 ZINC000828672871 602221212 /nfs/dbraw/zinc/22/12/12/602221212.db2.gz XFMWVECNCFWMMD-MRXNPFEDSA-N -1 3 367.243 3.837 20 0 FHADHM C[C@H](c1nnc(-c2ccc(Cl)c(Cl)c2)o1)N1CC[C@@](C)(C(=O)[O-])C1 ZINC000827966798 602223025 /nfs/dbraw/zinc/22/30/25/602223025.db2.gz VHRZGDKSXIFCIQ-JDNHERCYSA-N -1 3 370.236 3.901 20 0 FHADHM COc1ccc(CNCc2cc(C)c(OCC(=O)[O-])c(C)c2)cc1Cl ZINC000832347391 602234236 /nfs/dbraw/zinc/23/42/36/602234236.db2.gz VECKESABVLLDNY-UHFFFAOYSA-N -1 3 363.841 3.719 20 0 FHADHM C[C@H](NC(=O)[O-])[C@@H]1CCCCN1Cc1ccc(OCc2ccncc2)cc1 ZINC000739005097 602259871 /nfs/dbraw/zinc/25/98/71/602259871.db2.gz VXRLWSKNECNYNU-JXFKEZNVSA-N -1 3 369.465 3.671 20 0 FHADHM CN(C[C@@H]1CCCN(Cc2ccccc2Oc2cccnc2)C1)C(=O)[O-] ZINC000739638470 602397848 /nfs/dbraw/zinc/39/78/48/602397848.db2.gz VLFAHHFSYGGRQO-INIZCTEOSA-N -1 3 355.438 3.696 20 0 FHADHM CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1ccc(NC(=O)[O-])cc1 ZINC000739611839 602600794 /nfs/dbraw/zinc/60/07/94/602600794.db2.gz CYKYWCXRBMYRJF-UHFFFAOYSA-N -1 3 374.416 3.511 20 0 FHADHM O=C([O-])Nc1ccc(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000740710310 602602694 /nfs/dbraw/zinc/60/26/94/602602694.db2.gz NWATZCLEADOYGV-SFHVURJKSA-N -1 3 368.437 3.563 20 0 FHADHM C[C@@H](NCC[C@@H]1CCCN(C(=O)[O-])C1)c1nc2ccccc2n1C(F)F ZINC000739037690 602650117 /nfs/dbraw/zinc/65/01/17/602650117.db2.gz YBIVOYOBSZUKIF-OLZOCXBDSA-N -1 3 366.412 3.862 20 0 FHADHM CC[C@H](SC)C(=O)Oc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000825160061 607589184 /nfs/dbraw/zinc/58/91/84/607589184.db2.gz XHYVEHVPFCPBGX-INIZCTEOSA-N -1 3 370.434 3.706 20 0 FHADHM CC[C@H](SC)C(=O)Oc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000825160061 607589186 /nfs/dbraw/zinc/58/91/86/607589186.db2.gz XHYVEHVPFCPBGX-INIZCTEOSA-N -1 3 370.434 3.706 20 0 FHADHM CC(=O)Nc1cccc(-c2nc(-c3cccc(-c4nnn[n-]4)c3)cs2)c1 ZINC000824005018 607643667 /nfs/dbraw/zinc/64/36/67/607643667.db2.gz IVAVVOSDFXSMRO-UHFFFAOYSA-N -1 3 362.418 3.616 20 0 FHADHM CC(=O)Nc1cccc(-c2nc(-c3cccc(-c4nn[n-]n4)c3)cs2)c1 ZINC000824005018 607643668 /nfs/dbraw/zinc/64/36/68/607643668.db2.gz IVAVVOSDFXSMRO-UHFFFAOYSA-N -1 3 362.418 3.616 20 0 FHADHM COc1ccc2c(c1)CCC[C@@H]2NCc1cccc2c1N(C(=O)[O-])CC2 ZINC000829521813 603857509 /nfs/dbraw/zinc/85/75/09/603857509.db2.gz PLOGPUQCJSDPRQ-IBGZPJMESA-N -1 3 352.434 3.903 20 0 FHADHM Cc1cc(-c2nnn[n-]2)ccc1C(=O)N1CCC[C@H]1c1ccc(Cl)cc1 ZINC000826245491 607660357 /nfs/dbraw/zinc/66/03/57/607660357.db2.gz ZNJMFTVZTOARSA-KRWDZBQOSA-N -1 3 367.840 3.806 20 0 FHADHM Cc1cc(-c2nn[n-]n2)ccc1C(=O)N1CCC[C@H]1c1ccc(Cl)cc1 ZINC000826245491 607660360 /nfs/dbraw/zinc/66/03/60/607660360.db2.gz ZNJMFTVZTOARSA-KRWDZBQOSA-N -1 3 367.840 3.806 20 0 FHADHM O=C(Nc1cccc(-c2nnn[n-]2)c1)c1ccc(CCC(F)(F)F)cc1 ZINC000153191981 607680565 /nfs/dbraw/zinc/68/05/65/607680565.db2.gz AFZSXAQMVHHVPB-UHFFFAOYSA-N -1 3 361.327 3.614 20 0 FHADHM O=C(Nc1cccc(-c2nn[n-]n2)c1)c1ccc(CCC(F)(F)F)cc1 ZINC000153191981 607680567 /nfs/dbraw/zinc/68/05/67/607680567.db2.gz AFZSXAQMVHHVPB-UHFFFAOYSA-N -1 3 361.327 3.614 20 0 FHADHM Cc1ccc(Oc2ccc(NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)cc2)cc1 ZINC000826293073 607682946 /nfs/dbraw/zinc/68/29/46/607682946.db2.gz ZOSHSHKLNUHPPR-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM Cc1ccc(Oc2ccc(NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)cc2)cc1 ZINC000826293073 607682948 /nfs/dbraw/zinc/68/29/48/607682948.db2.gz ZOSHSHKLNUHPPR-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM O=C(Nc1ccc(-c2cc3ccccc3o2)cc1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC000826451580 607690827 /nfs/dbraw/zinc/69/08/27/607690827.db2.gz MSOOYDJDGROLTI-UHFFFAOYSA-N -1 3 370.372 3.860 20 0 FHADHM O=C(Nc1ccc(-c2cc3ccccc3o2)cc1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC000826451580 607690829 /nfs/dbraw/zinc/69/08/29/607690829.db2.gz MSOOYDJDGROLTI-UHFFFAOYSA-N -1 3 370.372 3.860 20 0 FHADHM Cc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(-c2nnn[n-]2)cc1C ZINC000826284038 607699598 /nfs/dbraw/zinc/69/95/98/607699598.db2.gz IMKSBRSAZSQTIK-UHFFFAOYSA-N -1 3 361.327 3.755 20 0 FHADHM Cc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(-c2nn[n-]n2)cc1C ZINC000826284038 607699599 /nfs/dbraw/zinc/69/95/99/607699599.db2.gz IMKSBRSAZSQTIK-UHFFFAOYSA-N -1 3 361.327 3.755 20 0 FHADHM O=C([O-])N1CCC[C@@H](CN[C@@H](c2cccc(Cl)c2)c2ccccn2)C1 ZINC000831980104 604527104 /nfs/dbraw/zinc/52/71/04/604527104.db2.gz CSVZCJQMELLLHC-KSSFIOAISA-N -1 3 359.857 3.804 20 0 FHADHM CC(C)CN(CCC(=O)[O-])Cc1cc2cnn(C(C)C)c2nc1Cl ZINC000833486261 604577695 /nfs/dbraw/zinc/57/76/95/604577695.db2.gz GLPNEQKREYLIEL-UHFFFAOYSA-N -1 3 352.866 3.598 20 0 FHADHM CC(C)(C(=O)[O-])[C@@H](NCc1cnn(Cc2ccccc2)c1)c1ccccc1 ZINC000826105939 604628564 /nfs/dbraw/zinc/62/85/64/604628564.db2.gz NFEXODMHTFXRCU-FQEVSTJZSA-N -1 3 363.461 3.873 20 0 FHADHM Cc1ccc(-c2nc(CNC3(c4cccc(-c5nnn[n-]5)c4)CC3)co2)cc1 ZINC000826273559 607704695 /nfs/dbraw/zinc/70/46/95/607704695.db2.gz JKGBOKXSSPKGNT-UHFFFAOYSA-N -1 3 372.432 3.609 20 0 FHADHM Cc1ccc(-c2nc(CNC3(c4cccc(-c5nn[n-]n5)c4)CC3)co2)cc1 ZINC000826273559 607704698 /nfs/dbraw/zinc/70/46/98/607704698.db2.gz JKGBOKXSSPKGNT-UHFFFAOYSA-N -1 3 372.432 3.609 20 0 FHADHM CCc1cccc(CC(=O)N(CC)[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000825723209 607705428 /nfs/dbraw/zinc/70/54/28/607705428.db2.gz UPPQBORWDOUIQY-HNNXBMFYSA-N -1 3 363.465 3.581 20 0 FHADHM CCc1cccc(CC(=O)N(CC)[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000825723209 607705429 /nfs/dbraw/zinc/70/54/29/607705429.db2.gz UPPQBORWDOUIQY-HNNXBMFYSA-N -1 3 363.465 3.581 20 0 FHADHM CC(C)Oc1cccc(CN(C)Cc2ccc(O[C@@H](C)C(=O)[O-])cc2)c1 ZINC000833507550 604679554 /nfs/dbraw/zinc/67/95/54/604679554.db2.gz UUBNTWZUXJNXOG-INIZCTEOSA-N -1 3 357.450 3.958 20 0 FHADHM COc1cc(F)cc(CN[C@@H](C(=O)[O-])c2cccc(Br)c2)c1 ZINC000833729111 604686119 /nfs/dbraw/zinc/68/61/19/604686119.db2.gz NHAGIDCKPZZMCQ-OAHLLOKOSA-N -1 3 368.202 3.512 20 0 FHADHM Cc1ccc(C)c([C@H]2CCCN2C(=O)c2ccc(-c3nnn[n-]3)cc2C)c1 ZINC000826285077 607709465 /nfs/dbraw/zinc/70/94/65/607709465.db2.gz OWENGAUPOZNTOU-LJQANCHMSA-N -1 3 361.449 3.769 20 0 FHADHM Cc1ccc(C)c([C@H]2CCCN2C(=O)c2ccc(-c3nn[n-]n3)cc2C)c1 ZINC000826285077 607709467 /nfs/dbraw/zinc/70/94/67/607709467.db2.gz OWENGAUPOZNTOU-LJQANCHMSA-N -1 3 361.449 3.769 20 0 FHADHM Fc1cccc(F)c1-n1ccc(CSc2ccc(-c3nnn[n-]3)cc2)n1 ZINC000826377377 607712139 /nfs/dbraw/zinc/71/21/39/607712139.db2.gz OWCPUCQXWADHIQ-UHFFFAOYSA-N -1 3 370.388 3.623 20 0 FHADHM Fc1cccc(F)c1-n1ccc(CSc2ccc(-c3nn[n-]n3)cc2)n1 ZINC000826377377 607712140 /nfs/dbraw/zinc/71/21/40/607712140.db2.gz OWCPUCQXWADHIQ-UHFFFAOYSA-N -1 3 370.388 3.623 20 0 FHADHM COc1ccccc1[C@@H](CN[C@@H](C)c1cnc2ccsc2c1)NC(=O)[O-] ZINC000829600288 604761249 /nfs/dbraw/zinc/76/12/49/604761249.db2.gz ZBKJINDAJNESBW-BLLLJJGKSA-N -1 3 371.462 3.964 20 0 FHADHM CC(C)(C(=O)[O-])[C@H]1CCCN(Cc2nnc(-c3ccccc3Cl)o2)C1 ZINC000326966081 604928255 /nfs/dbraw/zinc/92/82/55/604928255.db2.gz KFYUHDHPUSQECJ-LBPRGKRZSA-N -1 3 363.845 3.713 20 0 FHADHM CC(C)(C(=O)[O-])[C@H]1CCCN(Cc2nnc(-c3ccc(Cl)cc3)o2)C1 ZINC000392706566 604939745 /nfs/dbraw/zinc/93/97/45/604939745.db2.gz XMMXNLGRRWRAMI-ZDUSSCGKSA-N -1 3 363.845 3.713 20 0 FHADHM C[C@@H](NCc1ccc(CCNC(=O)[O-])cc1)c1ccc(F)cc1N(C)C ZINC000825503692 604942801 /nfs/dbraw/zinc/94/28/01/604942801.db2.gz XDKYBWYVCDMRTP-CQSZACIVSA-N -1 3 359.445 3.553 20 0 FHADHM C[C@]1(NCc2csc(COc3ccccc3)n2)CCCC[C@@H]1C(=O)[O-] ZINC000833568901 605059750 /nfs/dbraw/zinc/05/97/50/605059750.db2.gz IGTJVCHVBMJAAK-APWZRJJASA-N -1 3 360.479 3.845 20 0 FHADHM C[C@@]1(NCc2nc3cc(C(F)(F)F)ccc3o2)CCCC[C@H]1C(=O)[O-] ZINC000833569856 605059961 /nfs/dbraw/zinc/05/99/61/605059961.db2.gz PQLTYSVJFZKZGO-MEDUHNTESA-N -1 3 356.344 3.970 20 0 FHADHM C/C(=C/CN1CCC[C@@H](Cc2nc(C3CCCCCC3)no2)C1)C(=O)[O-] ZINC000833381978 605150375 /nfs/dbraw/zinc/15/03/75/605150375.db2.gz GBKNMXLMIDXRRY-IZNAZMGOSA-N -1 3 361.486 3.793 20 0 FHADHM COc1ccc([C@H]2CCCN2CCOc2ccccc2C(=O)[O-])c(OC)c1 ZINC000364307708 605201434 /nfs/dbraw/zinc/20/14/34/605201434.db2.gz KLXMKFJVZVMDFX-GOSISDBHSA-N -1 3 371.433 3.618 20 0 FHADHM COc1ccc([C@H]2CCCN2CCOc2ccccc2C(=O)[O-])cc1OC ZINC000376883987 605201643 /nfs/dbraw/zinc/20/16/43/605201643.db2.gz QMQPNJSNEBIZDS-QGZVFWFLSA-N -1 3 371.433 3.618 20 0 FHADHM Cc1oc(-c2cccs2)nc1CN1C[C@@H]2CCC[C@@H](NC(=O)[O-])[C@H]2C1 ZINC000833934427 605438055 /nfs/dbraw/zinc/43/80/55/605438055.db2.gz JWIOFUJVYUXQTP-MELADBBJSA-N -1 3 361.467 3.580 20 0 FHADHM CC1([C@@H]2CCCN([C@H](C(=O)[O-])c3ccc(Cl)cc3Cl)C2)OCCO1 ZINC000833563127 605442667 /nfs/dbraw/zinc/44/26/67/605442667.db2.gz DEPWFSWYPOWZOC-ABAIWWIYSA-N -1 3 374.264 3.594 20 0 FHADHM Cc1c(NC(=O)N2CC[C@H]2c2ccc(Cl)cc2)cccc1-c1nnn[n-]1 ZINC000826241365 607765091 /nfs/dbraw/zinc/76/50/91/607765091.db2.gz AYRJFZGNRAKIHM-INIZCTEOSA-N -1 3 368.828 3.807 20 0 FHADHM Cc1c(NC(=O)N2CC[C@H]2c2ccc(Cl)cc2)cccc1-c1nn[n-]n1 ZINC000826241365 607765092 /nfs/dbraw/zinc/76/50/92/607765092.db2.gz AYRJFZGNRAKIHM-INIZCTEOSA-N -1 3 368.828 3.807 20 0 FHADHM Cc1cc(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)ccc1NC(=O)[O-] ZINC000829940020 605637608 /nfs/dbraw/zinc/63/76/08/605637608.db2.gz JESGIQOTXDUQGR-QAPCUYQASA-N -1 3 367.449 3.650 20 0 FHADHM CC1(C(=O)Nc2nc(-c3cccc(-c4nnn[n-]4)c3)cs2)CCCC1 ZINC000824784702 607769473 /nfs/dbraw/zinc/76/94/73/607769473.db2.gz ZLLXMSRPNIUCHD-UHFFFAOYSA-N -1 3 354.439 3.509 20 0 FHADHM CC1(C(=O)Nc2nc(-c3cccc(-c4nn[n-]n4)c3)cs2)CCCC1 ZINC000824784702 607769474 /nfs/dbraw/zinc/76/94/74/607769474.db2.gz ZLLXMSRPNIUCHD-UHFFFAOYSA-N -1 3 354.439 3.509 20 0 FHADHM O=C(CC1=CCCCC1)Nc1nc(-c2cccc(-c3nnn[n-]3)c2)cs1 ZINC000826404115 607770450 /nfs/dbraw/zinc/77/04/50/607770450.db2.gz OOFOUWHLNMVIOS-UHFFFAOYSA-N -1 3 366.450 3.819 20 0 FHADHM O=C(CC1=CCCCC1)Nc1nc(-c2cccc(-c3nn[n-]n3)c2)cs1 ZINC000826404115 607770451 /nfs/dbraw/zinc/77/04/51/607770451.db2.gz OOFOUWHLNMVIOS-UHFFFAOYSA-N -1 3 366.450 3.819 20 0 FHADHM O=C([O-])N[C@@H]1C[C@H](N[C@H](c2ccccc2)[C@H]2CCCO2)c2ccccc21 ZINC000834158232 605797410 /nfs/dbraw/zinc/79/74/10/605797410.db2.gz KRKDGLKBXHHBTI-MTQWCTHYSA-N -1 3 352.434 3.950 20 0 FHADHM O=C([O-])N1CCC[C@@H]1[C@@H]1CCC[C@@H]1NCc1csc(-c2ccco2)n1 ZINC000834111088 605990847 /nfs/dbraw/zinc/99/08/47/605990847.db2.gz ZINIHRFCGIJILB-QLFBSQMISA-N -1 3 361.467 3.804 20 0 FHADHM O=C([O-])N1CCC[C@@H]1[C@H]1CCC[C@@H]1NCc1csc(-c2ccco2)n1 ZINC000834111093 605990966 /nfs/dbraw/zinc/99/09/66/605990966.db2.gz ZINIHRFCGIJILB-SOUVJXGZSA-N -1 3 361.467 3.804 20 0 FHADHM O=C([O-])N1CCC[C@@H](N[C@H](c2cccc(Cl)c2)c2ccccn2)CC1 ZINC000834100070 606044650 /nfs/dbraw/zinc/04/46/50/606044650.db2.gz RUGHVGGYZZEFSJ-SJLPKXTDSA-N -1 3 359.857 3.947 20 0 FHADHM O=C([O-])N1CCC(CCN[C@H](c2cccc(F)c2)c2ccccn2)CC1 ZINC000834071623 606045838 /nfs/dbraw/zinc/04/58/38/606045838.db2.gz APZNCPGUFACXLU-LJQANCHMSA-N -1 3 357.429 3.680 20 0 FHADHM COc1ccc(Cl)cc1CNc1nc2ccccc2cc1-c1nnn[n-]1 ZINC000821828363 606046377 /nfs/dbraw/zinc/04/63/77/606046377.db2.gz UDPSLGLNJDFKTO-UHFFFAOYSA-N -1 3 366.812 3.689 20 0 FHADHM COc1ccc(Cl)cc1CNc1nc2ccccc2cc1-c1nn[n-]n1 ZINC000821828363 606046382 /nfs/dbraw/zinc/04/63/82/606046382.db2.gz UDPSLGLNJDFKTO-UHFFFAOYSA-N -1 3 366.812 3.689 20 0 FHADHM c1oc(-c2ccccc2)nc1CNc1nc2ccccc2cc1-c1nnn[n-]1 ZINC000823767407 606094636 /nfs/dbraw/zinc/09/46/36/606094636.db2.gz QRRDJOQDXDUYRK-UHFFFAOYSA-N -1 3 369.388 3.682 20 0 FHADHM c1oc(-c2ccccc2)nc1CNc1nc2ccccc2cc1-c1nn[n-]n1 ZINC000823767407 606094640 /nfs/dbraw/zinc/09/46/40/606094640.db2.gz QRRDJOQDXDUYRK-UHFFFAOYSA-N -1 3 369.388 3.682 20 0 FHADHM Cc1ccc(CCC(=O)Nc2sc3c(c2-c2nnn[n-]2)CC[C@@H](C)C3)o1 ZINC000822234580 606101792 /nfs/dbraw/zinc/10/17/92/606101792.db2.gz AIVPHTDOJBGIRV-SNVBAGLBSA-N -1 3 371.466 3.526 20 0 FHADHM Cc1ccc(CCC(=O)Nc2sc3c(c2-c2nn[n-]n2)CC[C@@H](C)C3)o1 ZINC000822234580 606101796 /nfs/dbraw/zinc/10/17/96/606101796.db2.gz AIVPHTDOJBGIRV-SNVBAGLBSA-N -1 3 371.466 3.526 20 0 FHADHM CC[C@H](C)[C@@H](C)N(C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000820860567 606115218 /nfs/dbraw/zinc/11/52/18/606115218.db2.gz KBRHQELETVAIGK-BFHYXJOUSA-N -1 3 356.474 3.536 20 0 FHADHM CC[C@H](C)[C@@H](C)N(C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1)C1CC1 ZINC000820860567 606115220 /nfs/dbraw/zinc/11/52/20/606115220.db2.gz KBRHQELETVAIGK-BFHYXJOUSA-N -1 3 356.474 3.536 20 0 FHADHM O=C(c1ccccc1-c1ccccc1-c1nnn[n-]1)N1C[C@@H]2CCCC[C@H]2C1 ZINC000823493764 606121153 /nfs/dbraw/zinc/12/11/53/606121153.db2.gz VMIVFFNNJJDBCX-HOTGVXAUSA-N -1 3 373.460 3.796 20 0 FHADHM O=C(c1ccccc1-c1ccccc1-c1nn[n-]n1)N1C[C@@H]2CCCC[C@H]2C1 ZINC000823493764 606121154 /nfs/dbraw/zinc/12/11/54/606121154.db2.gz VMIVFFNNJJDBCX-HOTGVXAUSA-N -1 3 373.460 3.796 20 0 FHADHM CC[C@H](C)Oc1ccc(C(=O)Nc2sc(C)c(C)c2-c2nnn[n-]2)cc1 ZINC000820877050 606121589 /nfs/dbraw/zinc/12/15/89/606121589.db2.gz YTSFGHLLEVOBOT-JTQLQIEISA-N -1 3 371.466 3.975 20 0 FHADHM CC[C@H](C)Oc1ccc(C(=O)Nc2sc(C)c(C)c2-c2nn[n-]n2)cc1 ZINC000820877050 606121590 /nfs/dbraw/zinc/12/15/90/606121590.db2.gz YTSFGHLLEVOBOT-JTQLQIEISA-N -1 3 371.466 3.975 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)Nc1sc(C)c(C)c1-c1nnn[n-]1 ZINC000819773888 606121699 /nfs/dbraw/zinc/12/16/99/606121699.db2.gz WUAQBNPIMIMTDU-CMDGGOBGSA-N -1 3 357.414 3.726 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)Nc1sc(C)c(C)c1-c1nn[n-]n1 ZINC000819773888 606121700 /nfs/dbraw/zinc/12/17/00/606121700.db2.gz WUAQBNPIMIMTDU-CMDGGOBGSA-N -1 3 357.414 3.726 20 0 FHADHM CCOc1cc(-c2nnn[n-]2)cc(Cl)c1OC(=O)[C@@H](C)C1CCCC1 ZINC000821388922 606122751 /nfs/dbraw/zinc/12/27/51/606122751.db2.gz AVIXARHWWCTRPU-JTQLQIEISA-N -1 3 364.833 3.651 20 0 FHADHM CCOc1cc(-c2nn[n-]n2)cc(Cl)c1OC(=O)[C@@H](C)C1CCCC1 ZINC000821388922 606122754 /nfs/dbraw/zinc/12/27/54/606122754.db2.gz AVIXARHWWCTRPU-JTQLQIEISA-N -1 3 364.833 3.651 20 0 FHADHM COc1ccccc1[C@@H]1CCCN1c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000821890886 606124958 /nfs/dbraw/zinc/12/49/58/606124958.db2.gz QNQWKNMYYBHLIP-INIZCTEOSA-N -1 3 355.829 3.870 20 0 FHADHM COc1ccccc1[C@@H]1CCCN1c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000821890886 606124959 /nfs/dbraw/zinc/12/49/59/606124959.db2.gz QNQWKNMYYBHLIP-INIZCTEOSA-N -1 3 355.829 3.870 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)C/C=C/c2cccc(F)c2)s1 ZINC000821465468 606126214 /nfs/dbraw/zinc/12/62/14/606126214.db2.gz IKLFZJUEIQRTEZ-GQCTYLIASA-N -1 3 357.414 3.672 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)C/C=C/c2cccc(F)c2)s1 ZINC000821465468 606126217 /nfs/dbraw/zinc/12/62/17/606126217.db2.gz IKLFZJUEIQRTEZ-GQCTYLIASA-N -1 3 357.414 3.672 20 0 FHADHM CCc1cc(-c2nnn[n-]2)c(NC(=O)C[C@H](C)c2ccc(OC)cc2)s1 ZINC000821465158 606126238 /nfs/dbraw/zinc/12/62/38/606126238.db2.gz CQLYQOUGABKHOP-NSHDSACASA-N -1 3 371.466 3.632 20 0 FHADHM CCc1cc(-c2nn[n-]n2)c(NC(=O)C[C@H](C)c2ccc(OC)cc2)s1 ZINC000821465158 606126239 /nfs/dbraw/zinc/12/62/39/606126239.db2.gz CQLYQOUGABKHOP-NSHDSACASA-N -1 3 371.466 3.632 20 0 FHADHM C[C@@H](SCC(=O)N(C)C1CCC(C)CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820689709 606179167 /nfs/dbraw/zinc/17/91/67/606179167.db2.gz BQTSWWQQJNLECS-XOYHFGRZSA-N -1 3 373.526 3.698 20 0 FHADHM C[C@@H](SCC(=O)N(C)C1CCC(C)CC1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820689709 606179168 /nfs/dbraw/zinc/17/91/68/606179168.db2.gz BQTSWWQQJNLECS-XOYHFGRZSA-N -1 3 373.526 3.698 20 0 FHADHM Cc1cncc(NC(=O)c2cccc(Nc3ccc(-c4nn[n-]n4)cc3)c2)c1 ZINC000822399195 606197300 /nfs/dbraw/zinc/19/73/00/606197300.db2.gz BYMJTCDOYALTKH-UHFFFAOYSA-N -1 3 371.404 3.566 20 0 FHADHM COc1ccc(CN[C@H](C)c2c(F)cccc2Cl)cc1-c1nnn[n-]1 ZINC000821805349 606225101 /nfs/dbraw/zinc/22/51/01/606225101.db2.gz UEUXOTWQOAZYMX-SNVBAGLBSA-N -1 3 361.808 3.519 20 0 FHADHM COc1ccc(CN[C@H](C)c2c(F)cccc2Cl)cc1-c1nn[n-]n1 ZINC000821805349 606225102 /nfs/dbraw/zinc/22/51/02/606225102.db2.gz UEUXOTWQOAZYMX-SNVBAGLBSA-N -1 3 361.808 3.519 20 0 FHADHM O=C(Nc1sc2c(c1-c1nnn[n-]1)CCCCCC2)[C@H]1C[C@@H]1C1CC1 ZINC000823387643 606233523 /nfs/dbraw/zinc/23/35/23/606233523.db2.gz SDKIRUGHVHZARF-OLZOCXBDSA-N -1 3 357.483 3.572 20 0 FHADHM O=C(Nc1sc2c(c1-c1nn[n-]n1)CCCCCC2)[C@H]1C[C@@H]1C1CC1 ZINC000823387643 606233525 /nfs/dbraw/zinc/23/35/25/606233525.db2.gz SDKIRUGHVHZARF-OLZOCXBDSA-N -1 3 357.483 3.572 20 0 FHADHM O=C(NCC1CCC1)c1ccc(Sc2ccccc2-c2nnn[n-]2)cc1 ZINC000823176716 606255643 /nfs/dbraw/zinc/25/56/43/606255643.db2.gz XKJADMVWDQHCMV-UHFFFAOYSA-N -1 3 365.462 3.548 20 0 FHADHM O=C(NCC1CCC1)c1ccc(Sc2ccccc2-c2nn[n-]n2)cc1 ZINC000823176716 606255644 /nfs/dbraw/zinc/25/56/44/606255644.db2.gz XKJADMVWDQHCMV-UHFFFAOYSA-N -1 3 365.462 3.548 20 0 FHADHM C[C@@H](Nc1ccc(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)cc1)c1ccccc1 ZINC000820455357 606260024 /nfs/dbraw/zinc/26/00/24/606260024.db2.gz HQKSCNGHISNFDB-CYBMUJFWSA-N -1 3 373.420 3.620 20 0 FHADHM C[C@@H](Nc1ccc(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)cc1)c1ccccc1 ZINC000820455357 606260026 /nfs/dbraw/zinc/26/00/26/606260026.db2.gz HQKSCNGHISNFDB-CYBMUJFWSA-N -1 3 373.420 3.620 20 0 FHADHM CCCN(C(=O)c1cc(-c2nnn[n-]2)c[nH]1)[C@@H](C)c1cc2ccccc2o1 ZINC000821082506 606260303 /nfs/dbraw/zinc/26/03/03/606260303.db2.gz LVQLAQSFZCLCJU-LBPRGKRZSA-N -1 3 364.409 3.554 20 0 FHADHM CCCN(C(=O)c1cc(-c2nn[n-]n2)c[nH]1)[C@@H](C)c1cc2ccccc2o1 ZINC000821082506 606260305 /nfs/dbraw/zinc/26/03/05/606260305.db2.gz LVQLAQSFZCLCJU-LBPRGKRZSA-N -1 3 364.409 3.554 20 0 FHADHM CC(C)Sc1ccc(C(=O)Nc2ccc(F)cc2-c2nnn[n-]2)cc1 ZINC000820183445 606262817 /nfs/dbraw/zinc/26/28/17/606262817.db2.gz CJSGFXGQQGFSLI-UHFFFAOYSA-N -1 3 357.414 3.759 20 0 FHADHM CC(C)Sc1ccc(C(=O)Nc2ccc(F)cc2-c2nn[n-]n2)cc1 ZINC000820183445 606262819 /nfs/dbraw/zinc/26/28/19/606262819.db2.gz CJSGFXGQQGFSLI-UHFFFAOYSA-N -1 3 357.414 3.759 20 0 FHADHM CC[C@H](C)Sc1ccc(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)c(C)c1 ZINC000820882310 606265103 /nfs/dbraw/zinc/26/51/03/606265103.db2.gz PDEBTRPDWZQOKV-NSHDSACASA-N -1 3 356.455 3.646 20 0 FHADHM CC[C@H](C)Sc1ccc(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)c(C)c1 ZINC000820882310 606265105 /nfs/dbraw/zinc/26/51/05/606265105.db2.gz PDEBTRPDWZQOKV-NSHDSACASA-N -1 3 356.455 3.646 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)c1ccc(Cl)cc1Cl ZINC000823345667 606265426 /nfs/dbraw/zinc/26/54/26/606265426.db2.gz BHCVBNLTYJEEBB-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)c1ccc(Cl)cc1Cl ZINC000823345667 606265428 /nfs/dbraw/zinc/26/54/28/606265428.db2.gz BHCVBNLTYJEEBB-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)c1ccc(Cl)c(Cl)c1 ZINC000823346103 606269400 /nfs/dbraw/zinc/26/94/00/606269400.db2.gz IMBMGZSMVQFDHL-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)c1ccc(Cl)c(Cl)c1 ZINC000823346103 606269401 /nfs/dbraw/zinc/26/94/01/606269401.db2.gz IMBMGZSMVQFDHL-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nnn[n-]1)[C@H]1C[C@H]1c1cccc2ccccc21 ZINC000823343720 606272319 /nfs/dbraw/zinc/27/23/19/606272319.db2.gz FHLWDRFBQUGKMU-IRXDYDNUSA-N -1 3 373.391 3.901 20 0 FHADHM O=C(Nc1ccc(F)cc1-c1nn[n-]n1)[C@H]1C[C@H]1c1cccc2ccccc21 ZINC000823343720 606272322 /nfs/dbraw/zinc/27/23/22/606272322.db2.gz FHLWDRFBQUGKMU-IRXDYDNUSA-N -1 3 373.391 3.901 20 0 FHADHM Cc1cc(Oc2ccccc2)ccc1NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC000822211917 606272712 /nfs/dbraw/zinc/27/27/12/606272712.db2.gz SZXYDLBXWZAHKR-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM Cc1cc(Oc2ccccc2)ccc1NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC000822211917 606272714 /nfs/dbraw/zinc/27/27/14/606272714.db2.gz SZXYDLBXWZAHKR-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@@H](C)c1ccccc1F ZINC000821118279 606281451 /nfs/dbraw/zinc/28/14/51/606281451.db2.gz KMGLORCGIHLQBH-LBPRGKRZSA-N -1 3 368.416 3.570 20 0 FHADHM CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@@H](C)Cc1ccccc1 ZINC000821118551 606282735 /nfs/dbraw/zinc/28/27/35/606282735.db2.gz OWONSPCLXQFYGT-AWEZNQCLSA-N -1 3 364.453 3.506 20 0 FHADHM Clc1cccc(-c2noc(CSc3cccc(-c4nnn[n-]4)c3)n2)c1 ZINC000822585557 606324223 /nfs/dbraw/zinc/32/42/23/606324223.db2.gz DWFFLBNBVCSAPM-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Clc1cccc(-c2noc(CSc3cccc(-c4nn[n-]n4)c3)n2)c1 ZINC000822585557 606324225 /nfs/dbraw/zinc/32/42/25/606324225.db2.gz DWFFLBNBVCSAPM-UHFFFAOYSA-N -1 3 370.825 3.862 20 0 FHADHM Cc1c(Cl)cccc1NC(=O)CSc1cccc(-c2nnn[n-]2)c1 ZINC000822035506 606327098 /nfs/dbraw/zinc/32/70/98/606327098.db2.gz VYLBBPPYXJUOBK-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1c(Cl)cccc1NC(=O)CSc1cccc(-c2nn[n-]n2)c1 ZINC000822035506 606327099 /nfs/dbraw/zinc/32/70/99/606327099.db2.gz VYLBBPPYXJUOBK-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM CCc1ccc(-c2noc(CSc3cccc(-c4nnn[n-]4)c3)n2)cc1 ZINC000821476342 606327579 /nfs/dbraw/zinc/32/75/79/606327579.db2.gz MTPMDYUIEKCCJQ-UHFFFAOYSA-N -1 3 364.434 3.771 20 0 FHADHM CCc1ccc(-c2noc(CSc3cccc(-c4nn[n-]n4)c3)n2)cc1 ZINC000821476342 606327580 /nfs/dbraw/zinc/32/75/80/606327580.db2.gz MTPMDYUIEKCCJQ-UHFFFAOYSA-N -1 3 364.434 3.771 20 0 FHADHM C[C@@H](OC(=O)[C@@H]1SCCc2sccc21)c1ccc(-c2nnn[n-]2)cc1 ZINC000820488839 606340207 /nfs/dbraw/zinc/34/02/07/606340207.db2.gz VIKGGWXHABYOOF-MEBBXXQBSA-N -1 3 372.475 3.563 20 0 FHADHM C[C@@H](OC(=O)[C@@H]1SCCc2sccc21)c1ccc(-c2nn[n-]n2)cc1 ZINC000820488839 606340208 /nfs/dbraw/zinc/34/02/08/606340208.db2.gz VIKGGWXHABYOOF-MEBBXXQBSA-N -1 3 372.475 3.563 20 0 FHADHM C[C@H](OC(=O)C/C=C/c1ccc(F)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820489069 606342150 /nfs/dbraw/zinc/34/21/50/606342150.db2.gz ZAMJNHQCEMTHNX-IBUXWKBASA-N -1 3 352.369 3.714 20 0 FHADHM C[C@H](OC(=O)C/C=C/c1ccc(F)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820489069 606342152 /nfs/dbraw/zinc/34/21/52/606342152.db2.gz ZAMJNHQCEMTHNX-IBUXWKBASA-N -1 3 352.369 3.714 20 0 FHADHM C[C@@H](OC(=O)c1cc2cccc(F)c2o1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820508759 606346490 /nfs/dbraw/zinc/34/64/90/606346490.db2.gz XAXGEVOSRRIBAV-SNVBAGLBSA-N -1 3 352.325 3.670 20 0 FHADHM C[C@@H](OC(=O)c1cc2cccc(F)c2o1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820508759 606346491 /nfs/dbraw/zinc/34/64/91/606346491.db2.gz XAXGEVOSRRIBAV-SNVBAGLBSA-N -1 3 352.325 3.670 20 0 FHADHM C[C@H](Oc1cccc(Cl)c1)C(=O)O[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820533328 606346697 /nfs/dbraw/zinc/34/66/97/606346697.db2.gz DNGCGWGPSRQJNK-RYUDHWBXSA-N -1 3 372.812 3.592 20 0 FHADHM C[C@H](Oc1cccc(Cl)c1)C(=O)O[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820533328 606346699 /nfs/dbraw/zinc/34/66/99/606346699.db2.gz DNGCGWGPSRQJNK-RYUDHWBXSA-N -1 3 372.812 3.592 20 0 FHADHM CC(C)OCc1ccc(C(=O)O[C@@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000820146993 606352459 /nfs/dbraw/zinc/35/24/59/606352459.db2.gz WTJWKLQICHVQCG-AWEZNQCLSA-N -1 3 366.421 3.710 20 0 FHADHM CC(C)OCc1ccc(C(=O)O[C@@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000820146993 606352461 /nfs/dbraw/zinc/35/24/61/606352461.db2.gz WTJWKLQICHVQCG-AWEZNQCLSA-N -1 3 366.421 3.710 20 0 FHADHM CCC(CC)N(CC(C)C)C(=O)Nc1cc(-c2nnn[n-]2)ccc1OC ZINC000820897823 606381943 /nfs/dbraw/zinc/38/19/43/606381943.db2.gz OPNVGJLGHBQSHG-UHFFFAOYSA-N -1 3 360.462 3.554 20 0 FHADHM CCC(CC)N(CC(C)C)C(=O)Nc1cc(-c2nn[n-]n2)ccc1OC ZINC000820897823 606381945 /nfs/dbraw/zinc/38/19/45/606381945.db2.gz OPNVGJLGHBQSHG-UHFFFAOYSA-N -1 3 360.462 3.554 20 0 FHADHM CC[C@@H](C)CN(CC)C(=O)Nc1cc(-c2nnn[n-]2)ccc1OC(C)C ZINC000820870417 606382052 /nfs/dbraw/zinc/38/20/52/606382052.db2.gz SEZOTGKZKOYFCG-CYBMUJFWSA-N -1 3 360.462 3.554 20 0 FHADHM CC[C@@H](C)CN(CC)C(=O)Nc1cc(-c2nn[n-]n2)ccc1OC(C)C ZINC000820870417 606382054 /nfs/dbraw/zinc/38/20/54/606382054.db2.gz SEZOTGKZKOYFCG-CYBMUJFWSA-N -1 3 360.462 3.554 20 0 FHADHM CCCN1C(=O)c2ccc(Cl)cc2N[C@@H]1c1ccc(-c2nnn[n-]2)s1 ZINC000821110022 606393644 /nfs/dbraw/zinc/39/36/44/606393644.db2.gz VUAGFSCLGTURLG-HNNXBMFYSA-N -1 3 374.857 3.558 20 0 FHADHM CCS[C@@H]1CCC[C@H](Nc2nc(C(F)(F)F)ccc2-c2nnn[n-]2)C1 ZINC000821455365 606400948 /nfs/dbraw/zinc/40/09/48/606400948.db2.gz JUFQMKLIUGLXQI-VHSXEESVSA-N -1 3 372.420 3.757 20 0 FHADHM CCS[C@@H]1CCC[C@H](Nc2nc(C(F)(F)F)ccc2-c2nn[n-]n2)C1 ZINC000821455365 606400949 /nfs/dbraw/zinc/40/09/49/606400949.db2.gz JUFQMKLIUGLXQI-VHSXEESVSA-N -1 3 372.420 3.757 20 0 FHADHM C[C@@H](CC(=O)N(C)c1cc(Cl)ccc1-c1nnn[n-]1)c1ccccc1 ZINC000820219870 606412101 /nfs/dbraw/zinc/41/21/01/606412101.db2.gz KPFSMVJUKUYGGS-LBPRGKRZSA-N -1 3 355.829 3.677 20 0 FHADHM C[C@@H](CC(=O)N(C)c1cc(Cl)ccc1-c1nn[n-]n1)c1ccccc1 ZINC000820219870 606412103 /nfs/dbraw/zinc/41/21/03/606412103.db2.gz KPFSMVJUKUYGGS-LBPRGKRZSA-N -1 3 355.829 3.677 20 0 FHADHM Fc1cc(F)c(F)c(CNc2cc(-c3nnn[n-]3)c3ccccc3n2)c1F ZINC000822753598 606431359 /nfs/dbraw/zinc/43/13/59/606431359.db2.gz OYQHHDXFKOPMRJ-UHFFFAOYSA-N -1 3 374.301 3.583 20 0 FHADHM Fc1cc(F)c(F)c(CNc2cc(-c3nn[n-]n3)c3ccccc3n2)c1F ZINC000822753598 606431361 /nfs/dbraw/zinc/43/13/61/606431361.db2.gz OYQHHDXFKOPMRJ-UHFFFAOYSA-N -1 3 374.301 3.583 20 0 FHADHM Fc1cc(F)c(F)c(CNc2nc3ccccc3cc2-c2nnn[n-]2)c1F ZINC000822753589 606431888 /nfs/dbraw/zinc/43/18/88/606431888.db2.gz OPTQSMQRPUQUMK-UHFFFAOYSA-N -1 3 374.301 3.583 20 0 FHADHM Fc1cc(F)c(F)c(CNc2nc3ccccc3cc2-c2nn[n-]n2)c1F ZINC000822753589 606431889 /nfs/dbraw/zinc/43/18/89/606431889.db2.gz OPTQSMQRPUQUMK-UHFFFAOYSA-N -1 3 374.301 3.583 20 0 FHADHM O[C@@H](CCc1cccc(Nc2ncccc2-c2nnn[n-]2)c1)c1ccccc1 ZINC000823675834 606433215 /nfs/dbraw/zinc/43/32/15/606433215.db2.gz ZVTQPUNSWZMTQF-IBGZPJMESA-N -1 3 372.432 3.672 20 0 FHADHM O[C@@H](CCc1cccc(Nc2ncccc2-c2nn[n-]n2)c1)c1ccccc1 ZINC000823675834 606433216 /nfs/dbraw/zinc/43/32/16/606433216.db2.gz ZVTQPUNSWZMTQF-IBGZPJMESA-N -1 3 372.432 3.672 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)cc1CNc1ccccc1OCC(F)(F)F ZINC000822761257 606442441 /nfs/dbraw/zinc/44/24/41/606442441.db2.gz FFUHBFWMROTAND-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CNc1ccccc1OCC(F)(F)F ZINC000822761257 606442443 /nfs/dbraw/zinc/44/24/43/606442443.db2.gz FFUHBFWMROTAND-UHFFFAOYSA-N -1 3 367.306 3.559 20 0 FHADHM C[C@H](Nc1ccc(F)cc1-c1nnn[n-]1)c1nc2ccccc2n1C(F)F ZINC000820455558 606443942 /nfs/dbraw/zinc/44/39/42/606443942.db2.gz JSXPRYDEIHBFKE-VIFPVBQESA-N -1 3 373.342 3.924 20 0 FHADHM C[C@H](Nc1ccc(F)cc1-c1nn[n-]n1)c1nc2ccccc2n1C(F)F ZINC000820455558 606443943 /nfs/dbraw/zinc/44/39/43/606443943.db2.gz JSXPRYDEIHBFKE-VIFPVBQESA-N -1 3 373.342 3.924 20 0 FHADHM C[C@H](NC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1c(F)cccc1Cl ZINC000820321943 606444438 /nfs/dbraw/zinc/44/44/38/606444438.db2.gz OMRLNNXAFBSTRI-USKTWTLRSA-N -1 3 371.803 3.550 20 0 FHADHM C[C@H](NC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1c(F)cccc1Cl ZINC000820321943 606444439 /nfs/dbraw/zinc/44/44/39/606444439.db2.gz OMRLNNXAFBSTRI-USKTWTLRSA-N -1 3 371.803 3.550 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)cc1CNc1ccccc1OC1CCCC1 ZINC000822761386 606448885 /nfs/dbraw/zinc/44/88/85/606448885.db2.gz LDYHVJKUQYMFHY-UHFFFAOYSA-N -1 3 353.401 3.939 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CNc1ccccc1OC1CCCC1 ZINC000822761386 606448887 /nfs/dbraw/zinc/44/88/87/606448887.db2.gz LDYHVJKUQYMFHY-UHFFFAOYSA-N -1 3 353.401 3.939 20 0 FHADHM COc1ccc([C@H](C)N(C)c2cc(-c3nnn[n-]3)c3ccccc3n2)cc1 ZINC000821777572 606450093 /nfs/dbraw/zinc/45/00/93/606450093.db2.gz IHXJKSYGVSYFNR-ZDUSSCGKSA-N -1 3 360.421 3.621 20 0 FHADHM COc1ccc([C@H](C)N(C)c2cc(-c3nn[n-]n3)c3ccccc3n2)cc1 ZINC000821777572 606450095 /nfs/dbraw/zinc/45/00/95/606450095.db2.gz IHXJKSYGVSYFNR-ZDUSSCGKSA-N -1 3 360.421 3.621 20 0 FHADHM COc1c(Cl)cc(NCc2cc(-c3nnn[n-]3)ccc2F)cc1Cl ZINC000821698290 606455214 /nfs/dbraw/zinc/45/52/14/606455214.db2.gz DESRGPJVLDBPLE-UHFFFAOYSA-N -1 3 368.199 3.933 20 0 FHADHM COc1c(Cl)cc(NCc2cc(-c3nn[n-]n3)ccc2F)cc1Cl ZINC000821698290 606455216 /nfs/dbraw/zinc/45/52/16/606455216.db2.gz DESRGPJVLDBPLE-UHFFFAOYSA-N -1 3 368.199 3.933 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)cc1CNc1ccc(Br)c(F)c1 ZINC000822754338 606463047 /nfs/dbraw/zinc/46/30/47/606463047.db2.gz YXODAZJRWWIXIG-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)cc1CNc1ccc(Br)c(F)c1 ZINC000822754338 606463048 /nfs/dbraw/zinc/46/30/48/606463048.db2.gz YXODAZJRWWIXIG-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM CC(C)(C)C(=O)c1ccc(NCc2ccc(-c3nnn[n-]3)cc2F)cc1 ZINC000819899816 606464293 /nfs/dbraw/zinc/46/42/93/606464293.db2.gz ZSYNLSRYTANCCX-UHFFFAOYSA-N -1 3 353.401 3.847 20 0 FHADHM CC(C)(C)C(=O)c1ccc(NCc2ccc(-c3nn[n-]n3)cc2F)cc1 ZINC000819899816 606464294 /nfs/dbraw/zinc/46/42/94/606464294.db2.gz ZSYNLSRYTANCCX-UHFFFAOYSA-N -1 3 353.401 3.847 20 0 FHADHM CC(C)[C@@H](NC(=O)c1cc(-c2nnn[n-]2)cs1)c1ccc(Cl)cc1 ZINC000820027007 606486653 /nfs/dbraw/zinc/48/66/53/606486653.db2.gz PFENAWGWXUFXIV-CQSZACIVSA-N -1 3 361.858 3.709 20 0 FHADHM CC(C)[C@@H](NC(=O)c1cc(-c2nn[n-]n2)cs1)c1ccc(Cl)cc1 ZINC000820027007 606486654 /nfs/dbraw/zinc/48/66/54/606486654.db2.gz PFENAWGWXUFXIV-CQSZACIVSA-N -1 3 361.858 3.709 20 0 FHADHM C[C@H]1CN(Cc2ccc(-c3nn[n-]n3)cc2OC(F)F)[C@H]1c1ccccc1 ZINC000820758782 606501867 /nfs/dbraw/zinc/50/18/67/606501867.db2.gz CVFLMFDBAKRMEE-YVEFUNNKSA-N -1 3 371.391 3.661 20 0 FHADHM C[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)cc2OC(F)F)[C@@H]1c1ccccc1 ZINC000820758779 606502234 /nfs/dbraw/zinc/50/22/34/606502234.db2.gz CVFLMFDBAKRMEE-PXAZEXFGSA-N -1 3 371.391 3.661 20 0 FHADHM CCCCN(C(=O)Cc1cccc(-c2nnn[n-]2)c1)[C@H](C)c1ccccc1 ZINC000821061585 606505435 /nfs/dbraw/zinc/50/54/35/606505435.db2.gz RHCUQUKQRPALHL-MRXNPFEDSA-N -1 3 363.465 3.799 20 0 FHADHM CCCCN(C(=O)Cc1cccc(-c2nn[n-]n2)c1)[C@H](C)c1ccccc1 ZINC000821061585 606505437 /nfs/dbraw/zinc/50/54/37/606505437.db2.gz RHCUQUKQRPALHL-MRXNPFEDSA-N -1 3 363.465 3.799 20 0 FHADHM CC[C@H](NC(=O)c1cc(-c2nnn[n-]2)cs1)c1ccc(Cl)s1 ZINC000820920007 606512569 /nfs/dbraw/zinc/51/25/69/606512569.db2.gz IUMDLSPNXWTBSY-QMMMGPOBSA-N -1 3 353.860 3.524 20 0 FHADHM CC[C@H](NC(=O)c1cc(-c2nn[n-]n2)cs1)c1ccc(Cl)s1 ZINC000820920007 606512571 /nfs/dbraw/zinc/51/25/71/606512571.db2.gz IUMDLSPNXWTBSY-QMMMGPOBSA-N -1 3 353.860 3.524 20 0 FHADHM CC[C@@H](NC(=O)c1cc(-c2nnn[n-]2)cs1)c1ccc(Cl)s1 ZINC000820920006 606512748 /nfs/dbraw/zinc/51/27/48/606512748.db2.gz IUMDLSPNXWTBSY-MRVPVSSYSA-N -1 3 353.860 3.524 20 0 FHADHM CC[C@@H](NC(=O)c1cc(-c2nn[n-]n2)cs1)c1ccc(Cl)s1 ZINC000820920006 606512749 /nfs/dbraw/zinc/51/27/49/606512749.db2.gz IUMDLSPNXWTBSY-MRVPVSSYSA-N -1 3 353.860 3.524 20 0 FHADHM C[C@@H](c1ccccc1)N(CC1CCC1)C(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000820571309 606515665 /nfs/dbraw/zinc/51/56/65/606515665.db2.gz XWTCIFUVHDATDF-ZDUSSCGKSA-N -1 3 367.478 3.932 20 0 FHADHM C[C@@H](c1ccccc1)N(CC1CCC1)C(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000820571309 606515666 /nfs/dbraw/zinc/51/56/66/606515666.db2.gz XWTCIFUVHDATDF-ZDUSSCGKSA-N -1 3 367.478 3.932 20 0 FHADHM O=C(C/C=C\c1cccc(F)c1)Nc1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000822945777 606523779 /nfs/dbraw/zinc/52/37/79/606523779.db2.gz QLVGHMYREZUSDT-RQOWECAXSA-N -1 3 357.776 3.701 20 0 FHADHM O=C(C/C=C\c1cccc(F)c1)Nc1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000822945777 606523780 /nfs/dbraw/zinc/52/37/80/606523780.db2.gz QLVGHMYREZUSDT-RQOWECAXSA-N -1 3 357.776 3.701 20 0 FHADHM CC[C@H]1CN(C(=O)c2cc(-c3nnn[n-]3)cs2)CC[C@@H]1c1ccccc1 ZINC000820989258 606523862 /nfs/dbraw/zinc/52/38/62/606523862.db2.gz PJBJTZYRTDSCCY-BBRMVZONSA-N -1 3 367.478 3.584 20 0 FHADHM CC[C@H]1CN(C(=O)c2cc(-c3nn[n-]n3)cs2)CC[C@@H]1c1ccccc1 ZINC000820989258 606523864 /nfs/dbraw/zinc/52/38/64/606523864.db2.gz PJBJTZYRTDSCCY-BBRMVZONSA-N -1 3 367.478 3.584 20 0 FHADHM CCC1(NC(=O)c2cccc(Oc3ccc(-c4nnn[n-]4)cc3)c2)CCC1 ZINC000820967882 606529103 /nfs/dbraw/zinc/52/91/03/606529103.db2.gz XUVLLZJCMJWFTD-UHFFFAOYSA-N -1 3 363.421 3.722 20 0 FHADHM CCC1(NC(=O)c2cccc(Oc3ccc(-c4nn[n-]n4)cc3)c2)CCC1 ZINC000820967882 606529104 /nfs/dbraw/zinc/52/91/04/606529104.db2.gz XUVLLZJCMJWFTD-UHFFFAOYSA-N -1 3 363.421 3.722 20 0 FHADHM CC[C@H](c1ccccc1)[C@H]1CCCN1C(=O)c1cc(-c2nnn[n-]2)cs1 ZINC000820938706 606538131 /nfs/dbraw/zinc/53/81/31/606538131.db2.gz MEPYFHPMBQOXIA-HZPDHXFCSA-N -1 3 367.478 3.727 20 0 FHADHM CC[C@H](c1ccccc1)[C@H]1CCCN1C(=O)c1cc(-c2nn[n-]n2)cs1 ZINC000820938706 606538132 /nfs/dbraw/zinc/53/81/32/606538132.db2.gz MEPYFHPMBQOXIA-HZPDHXFCSA-N -1 3 367.478 3.727 20 0 FHADHM C[C@H]1CCCN1C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000820709527 606577447 /nfs/dbraw/zinc/57/74/47/606577447.db2.gz JXVIAHDGZXVEEA-ZDUSSCGKSA-N -1 3 364.409 3.675 20 0 FHADHM C[C@H]1CCCN1C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000820709527 606577448 /nfs/dbraw/zinc/57/74/48/606577448.db2.gz JXVIAHDGZXVEEA-ZDUSSCGKSA-N -1 3 364.409 3.675 20 0 FHADHM C[C@@H](Nc1nc2ccccc2cc1-c1nnn[n-]1)c1ccc(F)cc1F ZINC000820461550 606593885 /nfs/dbraw/zinc/59/38/85/606593885.db2.gz MDCMTBQWOZNUPJ-SNVBAGLBSA-N -1 3 352.348 3.866 20 0 FHADHM C[C@@H](Nc1nc2ccccc2cc1-c1nn[n-]n1)c1ccc(F)cc1F ZINC000820461550 606593887 /nfs/dbraw/zinc/59/38/87/606593887.db2.gz MDCMTBQWOZNUPJ-SNVBAGLBSA-N -1 3 352.348 3.866 20 0 FHADHM CN(C(=O)c1cc2cccc(Cl)c2o1)c1ccc(-c2nnn[n-]2)cc1F ZINC000821573360 606602836 /nfs/dbraw/zinc/60/28/36/606602836.db2.gz NCUXKOYSSFTLPP-UHFFFAOYSA-N -1 3 371.759 3.682 20 0 FHADHM CN(C(=O)c1cc2cccc(Cl)c2o1)c1ccc(-c2nn[n-]n2)cc1F ZINC000821573360 606602837 /nfs/dbraw/zinc/60/28/37/606602837.db2.gz NCUXKOYSSFTLPP-UHFFFAOYSA-N -1 3 371.759 3.682 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)c1cc2cccc(Cl)c2o1 ZINC000823337225 606603094 /nfs/dbraw/zinc/60/30/94/606603094.db2.gz IJBFASNOVHSCOL-UHFFFAOYSA-N -1 3 357.732 3.658 20 0 FHADHM O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)c1cc2cccc(Cl)c2o1 ZINC000823337225 606603096 /nfs/dbraw/zinc/60/30/96/606603096.db2.gz IJBFASNOVHSCOL-UHFFFAOYSA-N -1 3 357.732 3.658 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)/C=C1/CC[C@H](C)C1 ZINC000820087738 606618547 /nfs/dbraw/zinc/61/85/47/606618547.db2.gz YPSVPSYWJZFGPB-ZCQLHAAUSA-N -1 3 353.470 3.598 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)/C=C1/CC[C@H](C)C1 ZINC000820087738 606618548 /nfs/dbraw/zinc/61/85/48/606618548.db2.gz YPSVPSYWJZFGPB-ZCQLHAAUSA-N -1 3 353.470 3.598 20 0 FHADHM Cc1ccc(Oc2ccccc2)c(NC(=O)c2ccc(-c3nnn[n-]3)cn2)c1 ZINC000822266519 606622660 /nfs/dbraw/zinc/62/26/60/606622660.db2.gz BWQYVOUQDDJGGH-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccc(Oc2ccccc2)c(NC(=O)c2ccc(-c3nn[n-]n3)cn2)c1 ZINC000822266519 606622661 /nfs/dbraw/zinc/62/26/61/606622661.db2.gz BWQYVOUQDDJGGH-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1[nH]ccc1C(=O)Nc1cccc(Oc2ccc(-c3nnn[n-]3)cc2)c1 ZINC000822010192 606631896 /nfs/dbraw/zinc/63/18/96/606631896.db2.gz RNVMBPCPIXBTFT-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM Cc1[nH]ccc1C(=O)Nc1cccc(Oc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000822010192 606631898 /nfs/dbraw/zinc/63/18/98/606631898.db2.gz RNVMBPCPIXBTFT-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM C[C@H](c1ccco1)N(C(=O)Nc1ccc(-c2nnn[n-]2)c(Cl)c1)C1CC1 ZINC000820570368 606657033 /nfs/dbraw/zinc/65/70/33/606657033.db2.gz IJSGNBQREMOTEA-SNVBAGLBSA-N -1 3 372.816 3.871 20 0 FHADHM C[C@H](c1ccco1)N(C(=O)Nc1ccc(-c2nn[n-]n2)c(Cl)c1)C1CC1 ZINC000820570368 606657034 /nfs/dbraw/zinc/65/70/34/606657034.db2.gz IJSGNBQREMOTEA-SNVBAGLBSA-N -1 3 372.816 3.871 20 0 FHADHM O=C(Nc1ccc2ccccc2c1)c1c(F)cc(-c2nnn[n-]2)cc1F ZINC000823355956 606661668 /nfs/dbraw/zinc/66/16/68/606661668.db2.gz HCLZJHILRBLEIF-UHFFFAOYSA-N -1 3 351.316 3.550 20 0 FHADHM O=C(Nc1ccc2ccccc2c1)c1c(F)cc(-c2nn[n-]n2)cc1F ZINC000823355956 606661669 /nfs/dbraw/zinc/66/16/69/606661669.db2.gz HCLZJHILRBLEIF-UHFFFAOYSA-N -1 3 351.316 3.550 20 0 FHADHM CN(C(=O)c1c(F)cc(-c2nnn[n-]2)cc1F)c1ccc2ccccc2c1 ZINC000821572136 606665391 /nfs/dbraw/zinc/66/53/91/606665391.db2.gz SNVUMCCGTVYWDF-UHFFFAOYSA-N -1 3 365.343 3.575 20 0 FHADHM CN(C(=O)c1c(F)cc(-c2nn[n-]n2)cc1F)c1ccc2ccccc2c1 ZINC000821572136 606665392 /nfs/dbraw/zinc/66/53/92/606665392.db2.gz SNVUMCCGTVYWDF-UHFFFAOYSA-N -1 3 365.343 3.575 20 0 FHADHM Cc1ccc([C@H](C)N(C)C(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)c(C)c1 ZINC000822228906 606669936 /nfs/dbraw/zinc/66/99/36/606669936.db2.gz IOPUMIKCINYKMM-LBPRGKRZSA-N -1 3 371.391 3.595 20 0 FHADHM Cc1ccc([C@H](C)N(C)C(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)c(C)c1 ZINC000822228906 606669937 /nfs/dbraw/zinc/66/99/37/606669937.db2.gz IOPUMIKCINYKMM-LBPRGKRZSA-N -1 3 371.391 3.595 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)[C@H](C)CSc1ccc(F)cc1 ZINC000822215950 606675376 /nfs/dbraw/zinc/67/53/76/606675376.db2.gz ADQDGKKOSPBERK-GFCCVEGCSA-N -1 3 371.441 3.681 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)[C@H](C)CSc1ccc(F)cc1 ZINC000822215950 606675377 /nfs/dbraw/zinc/67/53/77/606675377.db2.gz ADQDGKKOSPBERK-GFCCVEGCSA-N -1 3 371.441 3.681 20 0 FHADHM Cc1ccc(CNc2ncc(-c3nnn[n-]3)cc2Cl)c(OCC2CC2)c1 ZINC000822238720 606725138 /nfs/dbraw/zinc/72/51/38/606725138.db2.gz RNVIREBMJFPJAM-UHFFFAOYSA-N -1 3 370.844 3.624 20 0 FHADHM Cc1ccc(CNc2ncc(-c3nn[n-]n3)cc2Cl)c(OCC2CC2)c1 ZINC000822238720 606725139 /nfs/dbraw/zinc/72/51/39/606725139.db2.gz RNVIREBMJFPJAM-UHFFFAOYSA-N -1 3 370.844 3.624 20 0 FHADHM C[C@H](Nc1cccc(F)c1-c1nnn[n-]1)c1cccc(N2CCCC2)c1 ZINC000820461213 606732751 /nfs/dbraw/zinc/73/27/51/606732751.db2.gz FZQNGBCDJYKVLN-ZDUSSCGKSA-N -1 3 352.417 3.779 20 0 FHADHM C[C@H](Nc1cccc(F)c1-c1nn[n-]n1)c1cccc(N2CCCC2)c1 ZINC000820461213 606732752 /nfs/dbraw/zinc/73/27/52/606732752.db2.gz FZQNGBCDJYKVLN-ZDUSSCGKSA-N -1 3 352.417 3.779 20 0 FHADHM Cc1c(NC(=O)c2cc(-c3nnn[n-]3)cs2)cccc1C(F)(F)F ZINC000822105651 606739666 /nfs/dbraw/zinc/73/96/66/606739666.db2.gz WCSBBNTWYBPQEM-UHFFFAOYSA-N -1 3 353.329 3.508 20 0 FHADHM Cc1c(NC(=O)c2cc(-c3nn[n-]n3)cs2)cccc1C(F)(F)F ZINC000822105651 606739668 /nfs/dbraw/zinc/73/96/68/606739668.db2.gz WCSBBNTWYBPQEM-UHFFFAOYSA-N -1 3 353.329 3.508 20 0 FHADHM COc1ccc(C=C(Cl)c2nc3cc(F)ccc3o2)cc1-c1nnn[n-]1 ZINC000821786877 606763630 /nfs/dbraw/zinc/76/36/30/606763630.db2.gz KRKZXTMFASZIDY-GHXNOFRVSA-N -1 3 371.759 3.893 20 0 FHADHM COc1ccc(C=C(Cl)c2nc3cc(F)ccc3o2)cc1-c1nn[n-]n1 ZINC000821786877 606763631 /nfs/dbraw/zinc/76/36/31/606763631.db2.gz KRKZXTMFASZIDY-GHXNOFRVSA-N -1 3 371.759 3.893 20 0 FHADHM CC(C)CN(CC(C)(C)C)C(=O)N[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820081328 606805207 /nfs/dbraw/zinc/80/52/07/606805207.db2.gz BWNGRVJKDUYZEB-CQSZACIVSA-N -1 3 358.490 3.641 20 0 FHADHM CC(C)CN(CC(C)(C)C)C(=O)N[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820081328 606805208 /nfs/dbraw/zinc/80/52/08/606805208.db2.gz BWNGRVJKDUYZEB-CQSZACIVSA-N -1 3 358.490 3.641 20 0 FHADHM Cc1ccc(Cl)c(NC(=O)N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000822239900 606807727 /nfs/dbraw/zinc/80/77/27/606807727.db2.gz JSQINFOXCUYDLZ-LLVKDONJSA-N -1 3 356.817 3.711 20 0 FHADHM Cc1ccc(Cl)c(NC(=O)N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000822239900 606807728 /nfs/dbraw/zinc/80/77/28/606807728.db2.gz JSQINFOXCUYDLZ-LLVKDONJSA-N -1 3 356.817 3.711 20 0 FHADHM C[C@H](SCC(=O)N(C)[C@@H]1CCCC[C@H]1C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820549114 606827992 /nfs/dbraw/zinc/82/79/92/606827992.db2.gz KLRVRXQCQQKKHF-JKIFEVAISA-N -1 3 373.526 3.698 20 0 FHADHM C[C@H](SCC(=O)N(C)[C@@H]1CCCC[C@H]1C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820549114 606827994 /nfs/dbraw/zinc/82/79/94/606827994.db2.gz KLRVRXQCQQKKHF-JKIFEVAISA-N -1 3 373.526 3.698 20 0 FHADHM CSc1cc(C)ccc1CNC(=O)Nc1cc(-c2nnn[n-]2)ccc1C ZINC000821978189 606835356 /nfs/dbraw/zinc/83/53/56/606835356.db2.gz KJKOXYOPIGLNFN-UHFFFAOYSA-N -1 3 368.466 3.527 20 0 FHADHM CSc1cc(C)ccc1CNC(=O)Nc1cc(-c2nn[n-]n2)ccc1C ZINC000821978189 606835358 /nfs/dbraw/zinc/83/53/58/606835358.db2.gz KJKOXYOPIGLNFN-UHFFFAOYSA-N -1 3 368.466 3.527 20 0 FHADHM Clc1cc(CSCCCOc2cccc(-c3nnn[n-]3)c2)ccn1 ZINC000822568431 606841113 /nfs/dbraw/zinc/84/11/13/606841113.db2.gz QWBSRYWCVUJOAB-UHFFFAOYSA-N -1 3 361.858 3.617 20 0 FHADHM Clc1cc(CSCCCOc2cccc(-c3nn[n-]n3)c2)ccn1 ZINC000822568431 606841115 /nfs/dbraw/zinc/84/11/15/606841115.db2.gz QWBSRYWCVUJOAB-UHFFFAOYSA-N -1 3 361.858 3.617 20 0 FHADHM Clc1ccc(CSCCCOc2cccc(-c3nnn[n-]3)c2)cn1 ZINC000822574095 606843331 /nfs/dbraw/zinc/84/33/31/606843331.db2.gz OEBCOCNFBCSDRD-UHFFFAOYSA-N -1 3 361.858 3.617 20 0 FHADHM Clc1ccc(CSCCCOc2cccc(-c3nn[n-]n3)c2)cn1 ZINC000822574095 606843333 /nfs/dbraw/zinc/84/33/33/606843333.db2.gz OEBCOCNFBCSDRD-UHFFFAOYSA-N -1 3 361.858 3.617 20 0 FHADHM O=C(c1cc(-c2nnn[n-]2)cs1)N(c1ccc(F)cc1)C1CCCC1 ZINC000823467398 606856219 /nfs/dbraw/zinc/85/62/19/606856219.db2.gz VPHVLUJQKCAJPN-UHFFFAOYSA-N -1 3 357.414 3.657 20 0 FHADHM O=C(c1cc(-c2nn[n-]n2)cs1)N(c1ccc(F)cc1)C1CCCC1 ZINC000823467398 606856220 /nfs/dbraw/zinc/85/62/20/606856220.db2.gz VPHVLUJQKCAJPN-UHFFFAOYSA-N -1 3 357.414 3.657 20 0 FHADHM CC(C)C[C@H]1CCCCN1C(=O)Nc1cc(-c2nnn[n-]2)cn1C(C)(C)C ZINC000820061783 606870482 /nfs/dbraw/zinc/87/04/82/606870482.db2.gz FLRRAQQVPHAXRN-OAHLLOKOSA-N -1 3 373.505 3.856 20 0 FHADHM CC(C)C[C@H]1CCCCN1C(=O)Nc1cc(-c2nn[n-]n2)cn1C(C)(C)C ZINC000820061783 606870484 /nfs/dbraw/zinc/87/04/84/606870484.db2.gz FLRRAQQVPHAXRN-OAHLLOKOSA-N -1 3 373.505 3.856 20 0 FHADHM C[C@@H](OC(=O)c1cncc(-c2ccccc2)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820518913 606889847 /nfs/dbraw/zinc/88/98/47/606889847.db2.gz NIGQWWILFIMPBH-CQSZACIVSA-N -1 3 371.400 3.847 20 0 FHADHM C[C@@H](OC(=O)c1cncc(-c2ccccc2)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820518913 606889849 /nfs/dbraw/zinc/88/98/49/606889849.db2.gz NIGQWWILFIMPBH-CQSZACIVSA-N -1 3 371.400 3.847 20 0 FHADHM C[C@H](OC(=O)c1cncc(-c2ccccc2)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000820518912 606889919 /nfs/dbraw/zinc/88/99/19/606889919.db2.gz NIGQWWILFIMPBH-AWEZNQCLSA-N -1 3 371.400 3.847 20 0 FHADHM C[C@H](OC(=O)c1cncc(-c2ccccc2)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000820518912 606889921 /nfs/dbraw/zinc/88/99/21/606889921.db2.gz NIGQWWILFIMPBH-AWEZNQCLSA-N -1 3 371.400 3.847 20 0 FHADHM CCN(C[C@@H](O)c1ccc(-c2nnn[n-]2)cc1)c1ccc2ccccc2c1 ZINC000821170823 606922584 /nfs/dbraw/zinc/92/25/84/606922584.db2.gz XDJKLLSDTKQRNT-HXUWFJFHSA-N -1 3 359.433 3.580 20 0 FHADHM CCN(C[C@@H](O)c1ccc(-c2nn[n-]n2)cc1)c1ccc2ccccc2c1 ZINC000821170823 606922586 /nfs/dbraw/zinc/92/25/86/606922586.db2.gz XDJKLLSDTKQRNT-HXUWFJFHSA-N -1 3 359.433 3.580 20 0 FHADHM CCc1nnc(SCc2cccc(Cl)c2)c(-c2nnn[n-]2)c1CC ZINC000821548588 606924627 /nfs/dbraw/zinc/92/46/27/606924627.db2.gz PBWXJAFMZXQNMZ-UHFFFAOYSA-N -1 3 360.874 3.727 20 0 FHADHM CCc1nnc(SCc2cccc(Cl)c2)c(-c2nn[n-]n2)c1CC ZINC000821548588 606924628 /nfs/dbraw/zinc/92/46/28/606924628.db2.gz PBWXJAFMZXQNMZ-UHFFFAOYSA-N -1 3 360.874 3.727 20 0 FHADHM Cc1ccc(-c2nnc([C@@H](C)Oc3ccc(-c4nn[n-]n4)cc3)o2)cc1C ZINC000822213866 606925307 /nfs/dbraw/zinc/92/53/07/606925307.db2.gz DVHCZROOWOXCQZ-CYBMUJFWSA-N -1 3 362.393 3.674 20 0 FHADHM Cc1cc(NCc2ccc(F)c(-c3nnn[n-]3)c2)ccc1Br ZINC000822209386 606926228 /nfs/dbraw/zinc/92/62/28/606926228.db2.gz GRNMJVYUPHYZAR-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Cc1cc(NCc2ccc(F)c(-c3nn[n-]n3)c2)ccc1Br ZINC000822209386 606926229 /nfs/dbraw/zinc/92/62/29/606926229.db2.gz GRNMJVYUPHYZAR-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM FC(F)(F)c1ccc(N2CCC(C(F)(F)F)CC2)c(-c2nnn[n-]2)c1 ZINC000822723686 606941206 /nfs/dbraw/zinc/94/12/06/606941206.db2.gz KRHLKHOIBITWTP-UHFFFAOYSA-N -1 3 365.281 3.664 20 0 FHADHM FC(F)(F)c1ccc(N2CCC(C(F)(F)F)CC2)c(-c2nn[n-]n2)c1 ZINC000822723686 606941208 /nfs/dbraw/zinc/94/12/08/606941208.db2.gz KRHLKHOIBITWTP-UHFFFAOYSA-N -1 3 365.281 3.664 20 0 FHADHM CCc1cnc(CN(C)c2ccc(C(F)(F)F)cc2-c2nnn[n-]2)s1 ZINC000821497734 606941321 /nfs/dbraw/zinc/94/13/21/606941321.db2.gz YPDLYUGLWULCHE-UHFFFAOYSA-N -1 3 368.388 3.541 20 0 FHADHM CCc1cnc(CN(C)c2ccc(C(F)(F)F)cc2-c2nn[n-]n2)s1 ZINC000821497734 606941322 /nfs/dbraw/zinc/94/13/22/606941322.db2.gz YPDLYUGLWULCHE-UHFFFAOYSA-N -1 3 368.388 3.541 20 0 FHADHM C[C@@H](CC(=O)N(C)c1cc(Cl)ccc1-c1nnn[n-]1)c1ccccc1F ZINC000820219727 606960183 /nfs/dbraw/zinc/96/01/83/606960183.db2.gz JUCIETUOQCZHTB-NSHDSACASA-N -1 3 373.819 3.816 20 0 FHADHM C[C@@H](CC(=O)N(C)c1cc(Cl)ccc1-c1nn[n-]n1)c1ccccc1F ZINC000820219727 606960185 /nfs/dbraw/zinc/96/01/85/606960185.db2.gz JUCIETUOQCZHTB-NSHDSACASA-N -1 3 373.819 3.816 20 0 FHADHM CCn1c2ccccc2nc1SCc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000821565282 607004844 /nfs/dbraw/zinc/00/48/44/607004844.db2.gz LZRNBEVSSMLLES-UHFFFAOYSA-N -1 3 354.414 3.668 20 0 FHADHM CCn1c2ccccc2nc1SCc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000821565282 607004846 /nfs/dbraw/zinc/00/48/46/607004846.db2.gz LZRNBEVSSMLLES-UHFFFAOYSA-N -1 3 354.414 3.668 20 0 FHADHM Cc1ccccc1[C@@H](C)NC(=O)[C@H](C)Sc1cccc(-c2nnn[n-]2)c1 ZINC000822345732 607010658 /nfs/dbraw/zinc/01/06/58/607010658.db2.gz QDZMLUYDZGQASG-KGLIPLIRSA-N -1 3 367.478 3.533 20 0 FHADHM Cc1ccccc1[C@@H](C)NC(=O)[C@H](C)Sc1cccc(-c2nn[n-]n2)c1 ZINC000822345732 607010659 /nfs/dbraw/zinc/01/06/59/607010659.db2.gz QDZMLUYDZGQASG-KGLIPLIRSA-N -1 3 367.478 3.533 20 0 FHADHM C[C@@H](NC(=O)c1ccc(-c2ccco2)s1)c1cccc(-c2nnn[n-]2)c1 ZINC000820391973 607024195 /nfs/dbraw/zinc/02/41/95/607024195.db2.gz SGCQBCSUMVCZII-LLVKDONJSA-N -1 3 365.418 3.679 20 0 FHADHM C[C@@H](NC(=O)c1ccc(-c2ccco2)s1)c1cccc(-c2nn[n-]n2)c1 ZINC000820391973 607024197 /nfs/dbraw/zinc/02/41/97/607024197.db2.gz SGCQBCSUMVCZII-LLVKDONJSA-N -1 3 365.418 3.679 20 0 FHADHM Cc1cc(NCc2cc(-c3nnn[n-]3)ccc2F)c2cccc(F)c2n1 ZINC000822209769 607026349 /nfs/dbraw/zinc/02/63/49/607026349.db2.gz WCCQKSMKLPOSKZ-UHFFFAOYSA-N -1 3 352.348 3.614 20 0 FHADHM Cc1cc(NCc2cc(-c3nn[n-]n3)ccc2F)c2cccc(F)c2n1 ZINC000822209769 607026351 /nfs/dbraw/zinc/02/63/51/607026351.db2.gz WCCQKSMKLPOSKZ-UHFFFAOYSA-N -1 3 352.348 3.614 20 0 FHADHM FC(F)(F)[C@@H](Cc1ccccc1)Nc1ncc(-c2nnn[n-]2)cc1Cl ZINC000822714566 607030513 /nfs/dbraw/zinc/03/05/13/607030513.db2.gz PKEDCZLCEPPNCN-GFCCVEGCSA-N -1 3 368.750 3.501 20 0 FHADHM FC(F)(F)[C@@H](Cc1ccccc1)Nc1ncc(-c2nn[n-]n2)cc1Cl ZINC000822714566 607030515 /nfs/dbraw/zinc/03/05/15/607030515.db2.gz PKEDCZLCEPPNCN-GFCCVEGCSA-N -1 3 368.750 3.501 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)c(CSCc2ccc(-n3cccn3)cc2)c1 ZINC000822758806 607033807 /nfs/dbraw/zinc/03/38/07/607033807.db2.gz YVXDCYXYDACKPB-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)c(CSCc2ccc(-n3cccn3)cc2)c1 ZINC000822758806 607033810 /nfs/dbraw/zinc/03/38/10/607033810.db2.gz YVXDCYXYDACKPB-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM CO[C@@H](C)c1nc(CSCc2cc(F)ccc2-c2nnn[n-]2)cs1 ZINC000821675806 607035124 /nfs/dbraw/zinc/03/51/24/607035124.db2.gz UGDWDZSUJPZBFJ-VIFPVBQESA-N -1 3 365.459 3.603 20 0 FHADHM CO[C@@H](C)c1nc(CSCc2cc(F)ccc2-c2nn[n-]n2)cs1 ZINC000821675806 607035126 /nfs/dbraw/zinc/03/51/26/607035126.db2.gz UGDWDZSUJPZBFJ-VIFPVBQESA-N -1 3 365.459 3.603 20 0 FHADHM Fc1ccc(-c2nnn[n-]2)c(CSc2nnc(-c3ccccc3)s2)c1 ZINC000822758136 607039725 /nfs/dbraw/zinc/03/97/25/607039725.db2.gz JXIMRAYVMVOWNB-UHFFFAOYSA-N -1 3 370.438 3.817 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)c(CSc2nnc(-c3ccccc3)s2)c1 ZINC000822758136 607039727 /nfs/dbraw/zinc/03/97/27/607039727.db2.gz JXIMRAYVMVOWNB-UHFFFAOYSA-N -1 3 370.438 3.817 20 0 FHADHM Cc1cc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCC3)ccc1Cl ZINC000822184715 607053011 /nfs/dbraw/zinc/05/30/11/607053011.db2.gz ZYHFWTWGZGQDGL-UHFFFAOYSA-N -1 3 359.842 3.631 20 0 FHADHM Cc1cc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCC3)ccc1Cl ZINC000822184715 607053013 /nfs/dbraw/zinc/05/30/13/607053013.db2.gz ZYHFWTWGZGQDGL-UHFFFAOYSA-N -1 3 359.842 3.631 20 0 FHADHM Fc1ccc(-c2nn[n-]n2)c(CN2CCC[C@H]2c2ccc(F)c(F)c2)c1 ZINC000822758750 607066896 /nfs/dbraw/zinc/06/68/96/607066896.db2.gz XQFNFSZHTSPKJR-KRWDZBQOSA-N -1 3 359.355 3.621 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NC(=O)C=Cc1ccc(Cl)s1 ZINC000821294881 607101618 /nfs/dbraw/zinc/10/16/18/607101618.db2.gz ZGLMAURMWAQUSY-YVMONPNESA-N -1 3 374.857 3.665 20 0 FHADHM C[C@@H]1CN(c2c(Cl)cccc2-c2nnn[n-]2)C[C@@H](c2ccsc2)O1 ZINC000820768745 607115790 /nfs/dbraw/zinc/11/57/90/607115790.db2.gz PBYVUYMOBVOBTI-YGRLFVJLSA-N -1 3 361.858 3.548 20 0 FHADHM C[C@@H]1CN(c2c(Cl)cccc2-c2nn[n-]n2)C[C@@H](c2ccsc2)O1 ZINC000820768745 607115791 /nfs/dbraw/zinc/11/57/91/607115791.db2.gz PBYVUYMOBVOBTI-YGRLFVJLSA-N -1 3 361.858 3.548 20 0 FHADHM COc1cccc(CCCOc2c(Cl)cc(-c3nnn[n-]3)cc2OC)c1 ZINC000821867714 607124384 /nfs/dbraw/zinc/12/43/84/607124384.db2.gz KJESKXDKIWRRRE-UHFFFAOYSA-N -1 3 374.828 3.549 20 0 FHADHM COc1cccc(CCCOc2c(Cl)cc(-c3nn[n-]n3)cc2OC)c1 ZINC000821867714 607124386 /nfs/dbraw/zinc/12/43/86/607124386.db2.gz KJESKXDKIWRRRE-UHFFFAOYSA-N -1 3 374.828 3.549 20 0 FHADHM Cc1cccc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCCC3)c1F ZINC000822284719 607149131 /nfs/dbraw/zinc/14/91/31/607149131.db2.gz XNNPWAIOJXSDFG-UHFFFAOYSA-N -1 3 357.414 3.507 20 0 FHADHM Cc1cccc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCCC3)c1F ZINC000822284719 607149133 /nfs/dbraw/zinc/14/91/33/607149133.db2.gz XNNPWAIOJXSDFG-UHFFFAOYSA-N -1 3 357.414 3.507 20 0 FHADHM CC(C)CC[C@@H]1CCCN1C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC000820072269 607152947 /nfs/dbraw/zinc/15/29/47/607152947.db2.gz DDXKOSLTOIPXDV-YOEHRIQHSA-N -1 3 356.474 3.538 20 0 FHADHM CC(C)CC[C@@H]1CCCN1C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000820072269 607152948 /nfs/dbraw/zinc/15/29/48/607152948.db2.gz DDXKOSLTOIPXDV-YOEHRIQHSA-N -1 3 356.474 3.538 20 0 FHADHM CC(C)CC[C@@H]1CCCN1C(=O)N[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000820072293 607153003 /nfs/dbraw/zinc/15/30/03/607153003.db2.gz DTVGFJPZZWAPGT-YOEHRIQHSA-N -1 3 356.474 3.538 20 0 FHADHM CC(C)CC[C@@H]1CCCN1C(=O)N[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000820072293 607153005 /nfs/dbraw/zinc/15/30/05/607153005.db2.gz DTVGFJPZZWAPGT-YOEHRIQHSA-N -1 3 356.474 3.538 20 0 FHADHM CCc1oc(C(=O)N(CC(C)C)c2ccc(-c3nnn[n-]3)cc2)cc1C ZINC000821558691 607153683 /nfs/dbraw/zinc/15/36/83/607153683.db2.gz DWBNTIJFDWBYJP-UHFFFAOYSA-N -1 3 353.426 3.633 20 0 FHADHM CCc1oc(C(=O)N(CC(C)C)c2ccc(-c3nn[n-]n3)cc2)cc1C ZINC000821558691 607153684 /nfs/dbraw/zinc/15/36/84/607153684.db2.gz DWBNTIJFDWBYJP-UHFFFAOYSA-N -1 3 353.426 3.633 20 0 FHADHM Cc1ccccc1-c1nc(CSc2ccccc2-c2nnn[n-]2)no1 ZINC000822345869 607158067 /nfs/dbraw/zinc/15/80/67/607158067.db2.gz VENFIVNSXAKGEA-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM Cc1ccccc1-c1nc(CSc2ccccc2-c2nn[n-]n2)no1 ZINC000822345869 607158068 /nfs/dbraw/zinc/15/80/68/607158068.db2.gz VENFIVNSXAKGEA-UHFFFAOYSA-N -1 3 350.407 3.517 20 0 FHADHM CC(C)CC[C@@H]1CCCN1C(=O)CSCc1ccc(-c2nnn[n-]2)cc1 ZINC000820074012 607164582 /nfs/dbraw/zinc/16/45/82/607164582.db2.gz XWKZMLOGYGQADT-KRWDZBQOSA-N -1 3 373.526 3.527 20 0 FHADHM CC(C)CC[C@@H]1CCCN1C(=O)CSCc1ccc(-c2nn[n-]n2)cc1 ZINC000820074012 607164583 /nfs/dbraw/zinc/16/45/83/607164583.db2.gz XWKZMLOGYGQADT-KRWDZBQOSA-N -1 3 373.526 3.527 20 0 FHADHM CC1(c2ccccc2)CCC(NC(=O)c2sccc2-c2nnn[n-]2)CC1 ZINC000820637753 607168497 /nfs/dbraw/zinc/16/84/97/607168497.db2.gz ZMRHZMAELXZARM-UHFFFAOYSA-N -1 3 367.478 3.559 20 0 FHADHM CC1(c2ccccc2)CCC(NC(=O)c2sccc2-c2nn[n-]n2)CC1 ZINC000820637753 607168499 /nfs/dbraw/zinc/16/84/99/607168499.db2.gz ZMRHZMAELXZARM-UHFFFAOYSA-N -1 3 367.478 3.559 20 0 FHADHM Cc1noc(C)c1[C@@H](C)Nc1ccc(C(F)(F)F)cc1-c1nnn[n-]1 ZINC000822519399 607173923 /nfs/dbraw/zinc/17/39/23/607173923.db2.gz FRBDXVFZVUTUKU-SSDOTTSWSA-N -1 3 352.320 3.663 20 0 FHADHM Cc1noc(C)c1[C@@H](C)Nc1ccc(C(F)(F)F)cc1-c1nn[n-]n1 ZINC000822519399 607173924 /nfs/dbraw/zinc/17/39/24/607173924.db2.gz FRBDXVFZVUTUKU-SSDOTTSWSA-N -1 3 352.320 3.663 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000819764783 607189711 /nfs/dbraw/zinc/18/97/11/607189711.db2.gz KYTXXHLUKIMYSM-NTMALXAHSA-N -1 3 357.776 3.701 20 0 FHADHM CC(=Cc1ccc(F)cc1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000819764783 607189712 /nfs/dbraw/zinc/18/97/12/607189712.db2.gz KYTXXHLUKIMYSM-NTMALXAHSA-N -1 3 357.776 3.701 20 0 FHADHM C[C@@H]1CCc2sc(C(=O)Nc3ccc(-c4nnn[n-]4)cc3Cl)cc2C1 ZINC000820733485 607189921 /nfs/dbraw/zinc/18/99/21/607189921.db2.gz GIYZSZZCKTZKIE-SECBINFHSA-N -1 3 373.869 3.959 20 0 FHADHM C[C@@H]1CCc2sc(C(=O)Nc3ccc(-c4nn[n-]n4)cc3Cl)cc2C1 ZINC000820733485 607189922 /nfs/dbraw/zinc/18/99/22/607189922.db2.gz GIYZSZZCKTZKIE-SECBINFHSA-N -1 3 373.869 3.959 20 0 FHADHM CCCN(C)c1ccc(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000821088649 607190704 /nfs/dbraw/zinc/19/07/04/607190704.db2.gz QXNDUOYEWXOQNG-UHFFFAOYSA-N -1 3 370.844 3.619 20 0 FHADHM CCCN(C)c1ccc(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000821088649 607190705 /nfs/dbraw/zinc/19/07/05/607190705.db2.gz QXNDUOYEWXOQNG-UHFFFAOYSA-N -1 3 370.844 3.619 20 0 FHADHM Cc1ccccc1C[C@@H](C)NC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822356260 607196694 /nfs/dbraw/zinc/19/66/94/607196694.db2.gz POHFKZRZKVVNJN-GFCCVEGCSA-N -1 3 370.844 3.581 20 0 FHADHM Cc1ccccc1C[C@@H](C)NC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822356260 607196695 /nfs/dbraw/zinc/19/66/95/607196695.db2.gz POHFKZRZKVVNJN-GFCCVEGCSA-N -1 3 370.844 3.581 20 0 FHADHM Cc1ccc([C@@H](C)NC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)cc1 ZINC000822228595 607197565 /nfs/dbraw/zinc/19/75/65/607197565.db2.gz ACAPQVQZGIZFBR-LLVKDONJSA-N -1 3 356.817 3.711 20 0 FHADHM Cc1ccc([C@@H](C)NC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)cc1 ZINC000822228595 607197566 /nfs/dbraw/zinc/19/75/66/607197566.db2.gz ACAPQVQZGIZFBR-LLVKDONJSA-N -1 3 356.817 3.711 20 0 FHADHM C[C@@H](CNC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl)c1ccc(F)cc1 ZINC000820270038 607197934 /nfs/dbraw/zinc/19/79/34/607197934.db2.gz SVSNTCYJGHNWGP-JTQLQIEISA-N -1 3 374.807 3.584 20 0 FHADHM C[C@@H](CNC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl)c1ccc(F)cc1 ZINC000820270038 607197935 /nfs/dbraw/zinc/19/79/35/607197935.db2.gz SVSNTCYJGHNWGP-JTQLQIEISA-N -1 3 374.807 3.584 20 0 FHADHM Cc1ccc2c(c1)[C@H](NC(=O)Nc1ccc(-c3nnn[n-]3)cc1Cl)CC2 ZINC000822274597 607198510 /nfs/dbraw/zinc/19/85/10/607198510.db2.gz CBJRGYJIHXVKCO-OAHLLOKOSA-N -1 3 368.828 3.638 20 0 FHADHM Cc1ccc2c(c1)[C@H](NC(=O)Nc1ccc(-c3nn[n-]n3)cc1Cl)CC2 ZINC000822274597 607198511 /nfs/dbraw/zinc/19/85/11/607198511.db2.gz CBJRGYJIHXVKCO-OAHLLOKOSA-N -1 3 368.828 3.638 20 0 FHADHM CCOc1ccccc1NC(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000821437785 607199018 /nfs/dbraw/zinc/19/90/18/607199018.db2.gz RZBLMYOKTCIEPN-UHFFFAOYSA-N -1 3 358.789 3.563 20 0 FHADHM CCOc1ccccc1NC(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000821437785 607199019 /nfs/dbraw/zinc/19/90/19/607199019.db2.gz RZBLMYOKTCIEPN-UHFFFAOYSA-N -1 3 358.789 3.563 20 0 FHADHM C[C@H]1CN(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)c2ccccc21 ZINC000820741900 607199577 /nfs/dbraw/zinc/19/95/77/607199577.db2.gz GKEDBIXRNGQWNK-JTQLQIEISA-N -1 3 354.801 3.676 20 0 FHADHM C[C@H]1CN(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)c2ccccc21 ZINC000820741900 607199578 /nfs/dbraw/zinc/19/95/78/607199578.db2.gz GKEDBIXRNGQWNK-JTQLQIEISA-N -1 3 354.801 3.676 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)N1CCC2(CCCC2)CC1 ZINC000823313642 607201094 /nfs/dbraw/zinc/20/10/94/607201094.db2.gz GTFJWARMMNGAGH-UHFFFAOYSA-N -1 3 360.849 3.708 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)N1CCC2(CCCC2)CC1 ZINC000823313642 607201095 /nfs/dbraw/zinc/20/10/95/607201095.db2.gz GTFJWARMMNGAGH-UHFFFAOYSA-N -1 3 360.849 3.708 20 0 FHADHM CCCN(Cc1ccccc1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000821110259 607202599 /nfs/dbraw/zinc/20/25/99/607202599.db2.gz YSGYQYNNANWRQG-UHFFFAOYSA-N -1 3 370.844 3.964 20 0 FHADHM CCCN(Cc1ccccc1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000821110259 607202600 /nfs/dbraw/zinc/20/26/00/607202600.db2.gz YSGYQYNNANWRQG-UHFFFAOYSA-N -1 3 370.844 3.964 20 0 FHADHM C[C@H](N[C@@H](c1ccccc1)c1ccccn1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820414283 607208715 /nfs/dbraw/zinc/20/87/15/607208715.db2.gz XLQNGZXHQZIQDD-YWZLYKJASA-N -1 3 356.433 3.702 20 0 FHADHM CCCc1ccccc1NC(=O)C(C)(C)Oc1ccc(-c2nnn[n-]2)cc1 ZINC000821142414 607237553 /nfs/dbraw/zinc/23/75/53/607237553.db2.gz ITBUZCMQMFRLTG-UHFFFAOYSA-N -1 3 365.437 3.615 20 0 FHADHM CCCc1ccccc1NC(=O)C(C)(C)Oc1ccc(-c2nn[n-]n2)cc1 ZINC000821142414 607237554 /nfs/dbraw/zinc/23/75/54/607237554.db2.gz ITBUZCMQMFRLTG-UHFFFAOYSA-N -1 3 365.437 3.615 20 0 FHADHM Cc1ccccc1C(C)(C)C(=O)Nc1ccc(-c2nnn[n-]2)cc1Cl ZINC000822344831 607241392 /nfs/dbraw/zinc/24/13/92/607241392.db2.gz AURNEHUROIGBSD-UHFFFAOYSA-N -1 3 355.829 3.745 20 0 FHADHM Cc1ccccc1C(C)(C)C(=O)Nc1ccc(-c2nn[n-]n2)cc1Cl ZINC000822344831 607241393 /nfs/dbraw/zinc/24/13/93/607241393.db2.gz AURNEHUROIGBSD-UHFFFAOYSA-N -1 3 355.829 3.745 20 0 FHADHM COc1cccc([C@H](C)CC(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)c1 ZINC000821859269 607242249 /nfs/dbraw/zinc/24/22/49/607242249.db2.gz NKBBSPCYYXZWEW-LLVKDONJSA-N -1 3 371.828 3.661 20 0 FHADHM COc1cccc([C@H](C)CC(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)c1 ZINC000821859269 607242250 /nfs/dbraw/zinc/24/22/50/607242250.db2.gz NKBBSPCYYXZWEW-LLVKDONJSA-N -1 3 371.828 3.661 20 0 FHADHM Cc1cc(C(=O)Nc2ccc(-c3nnn[n-]3)cc2Cl)c(Cl)cc1F ZINC000822176342 607242359 /nfs/dbraw/zinc/24/23/59/607242359.db2.gz JYFHCXYGLDCFLW-UHFFFAOYSA-N -1 3 366.183 3.873 20 0 FHADHM Cc1cc(C(=O)Nc2ccc(-c3nn[n-]n3)cc2Cl)c(Cl)cc1F ZINC000822176342 607242360 /nfs/dbraw/zinc/24/23/60/607242360.db2.gz JYFHCXYGLDCFLW-UHFFFAOYSA-N -1 3 366.183 3.873 20 0 FHADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1Cl)C1(c2ccccc2)CCCC1 ZINC000823313759 607244104 /nfs/dbraw/zinc/24/41/04/607244104.db2.gz IPMCPPXJQRXDKI-UHFFFAOYSA-N -1 3 367.840 3.971 20 0 FHADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1Cl)C1(c2ccccc2)CCCC1 ZINC000823313759 607244105 /nfs/dbraw/zinc/24/41/05/607244105.db2.gz IPMCPPXJQRXDKI-UHFFFAOYSA-N -1 3 367.840 3.971 20 0 FHADHM CSc1ccc(Cl)c(C(=O)Oc2ccc(-c3nnn[n-]3)cc2F)c1 ZINC000821984805 607247829 /nfs/dbraw/zinc/24/78/29/607247829.db2.gz UEYYHUAVWWAMOL-UHFFFAOYSA-N -1 3 364.789 3.600 20 0 FHADHM CSc1ccc(Cl)c(C(=O)Oc2ccc(-c3nn[n-]n3)cc2F)c1 ZINC000821984805 607247830 /nfs/dbraw/zinc/24/78/30/607247830.db2.gz UEYYHUAVWWAMOL-UHFFFAOYSA-N -1 3 364.789 3.600 20 0 FHADHM Cc1c(Cl)cccc1NC(=S)Nc1cccc(-c2nnn[n-]2)c1C ZINC000822035438 607251799 /nfs/dbraw/zinc/25/17/99/607251799.db2.gz UWLPKHYPAJDCKO-UHFFFAOYSA-N -1 3 358.858 3.946 20 0 FHADHM Cc1c(Cl)cccc1NC(=S)Nc1cccc(-c2nn[n-]n2)c1C ZINC000822035438 607251800 /nfs/dbraw/zinc/25/18/00/607251800.db2.gz UWLPKHYPAJDCKO-UHFFFAOYSA-N -1 3 358.858 3.946 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@H](C)c2cccc(C)c2)cc1-c1nnn[n-]1 ZINC000825553811 607784152 /nfs/dbraw/zinc/78/41/52/607784152.db2.gz XOIXBIMTPWYWCI-CYBMUJFWSA-N -1 3 366.425 3.917 20 0 FHADHM CCOC(=O)Nc1ccc(N[C@H](C)c2cccc(C)c2)cc1-c1nn[n-]n1 ZINC000825553811 607784153 /nfs/dbraw/zinc/78/41/53/607784153.db2.gz XOIXBIMTPWYWCI-CYBMUJFWSA-N -1 3 366.425 3.917 20 0 FHADHM CN(C(=O)c1sccc1SC(F)F)c1ccccc1-c1nnn[n-]1 ZINC000825833165 607790851 /nfs/dbraw/zinc/79/08/51/607790851.db2.gz AHANPQRASVWDDI-UHFFFAOYSA-N -1 3 367.406 3.520 20 0 FHADHM CN(C(=O)c1sccc1SC(F)F)c1ccccc1-c1nn[n-]n1 ZINC000825833165 607790852 /nfs/dbraw/zinc/79/08/52/607790852.db2.gz AHANPQRASVWDDI-UHFFFAOYSA-N -1 3 367.406 3.520 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(Oc3ccc(-c4nn[n-]n4)cc3)cc2)nc1 ZINC000826282474 607794905 /nfs/dbraw/zinc/79/49/05/607794905.db2.gz PXNXXCOTYNBAJG-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(Oc3ccccc3-c3nnn[n-]3)cc2)nc1 ZINC000826282556 607795062 /nfs/dbraw/zinc/79/50/62/607795062.db2.gz UINAWBGWOZCGLO-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM Cc1ccc(C(=O)Nc2ccc(Oc3ccccc3-c3nn[n-]n3)cc2)nc1 ZINC000826282556 607795063 /nfs/dbraw/zinc/79/50/63/607795063.db2.gz UINAWBGWOZCGLO-UHFFFAOYSA-N -1 3 372.388 3.615 20 0 FHADHM CC[C@H](O[C@H]1CCC[C@@H](C)C1)C(=O)N(CC)c1ccc(-c2nnn[n-]2)cc1 ZINC000825153603 607797752 /nfs/dbraw/zinc/79/77/52/607797752.db2.gz ISULDHJLSBWHQY-JLSDUUJJSA-N -1 3 371.485 3.594 20 0 FHADHM CC[C@H](O[C@H]1CCC[C@@H](C)C1)C(=O)N(CC)c1ccc(-c2nn[n-]n2)cc1 ZINC000825153603 607797753 /nfs/dbraw/zinc/79/77/53/607797753.db2.gz ISULDHJLSBWHQY-JLSDUUJJSA-N -1 3 371.485 3.594 20 0 FHADHM Nc1ccc(SCc2cn3ccccc3c2-c2nnn[n-]2)c(Cl)c1 ZINC000826396405 607813437 /nfs/dbraw/zinc/81/34/37/607813437.db2.gz WNVLIXZTPKAGNY-UHFFFAOYSA-N -1 3 356.842 3.647 20 0 FHADHM Nc1ccc(SCc2cn3ccccc3c2-c2nn[n-]n2)c(Cl)c1 ZINC000826396405 607813438 /nfs/dbraw/zinc/81/34/38/607813438.db2.gz WNVLIXZTPKAGNY-UHFFFAOYSA-N -1 3 356.842 3.647 20 0 FHADHM CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)CCC(C)(C)c1ccccc1 ZINC000825958533 607816262 /nfs/dbraw/zinc/81/62/62/607816262.db2.gz ZQUFURYLASYONV-UHFFFAOYSA-N -1 3 363.465 3.583 20 0 FHADHM CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)CCC(C)(C)c1ccccc1 ZINC000825958533 607816263 /nfs/dbraw/zinc/81/62/63/607816263.db2.gz ZQUFURYLASYONV-UHFFFAOYSA-N -1 3 363.465 3.583 20 0 FHADHM c1cc(COc2ccc(C3SCCS3)cc2)cc(-c2nnn[n-]2)c1 ZINC000826516306 607817289 /nfs/dbraw/zinc/81/72/89/607817289.db2.gz GCAVXEMLXHBPDY-UHFFFAOYSA-N -1 3 356.476 3.924 20 0 FHADHM c1cc(COc2ccc(C3SCCS3)cc2)cc(-c2nn[n-]n2)c1 ZINC000826516306 607817290 /nfs/dbraw/zinc/81/72/90/607817290.db2.gz GCAVXEMLXHBPDY-UHFFFAOYSA-N -1 3 356.476 3.924 20 0 FHADHM CN(Cc1ccc(Cl)s1)c1ccc2cc(-c3nnn[n-]3)ccc2n1 ZINC000825966070 607838619 /nfs/dbraw/zinc/83/86/19/607838619.db2.gz MRNXCPDPKIHMDO-UHFFFAOYSA-N -1 3 356.842 3.766 20 0 FHADHM CN(Cc1ccc(Cl)s1)c1ccc2cc(-c3nn[n-]n3)ccc2n1 ZINC000825966070 607838620 /nfs/dbraw/zinc/83/86/20/607838620.db2.gz MRNXCPDPKIHMDO-UHFFFAOYSA-N -1 3 356.842 3.766 20 0 FHADHM COc1ccc(CNc2cccnc2-c2ccccc2)cc1-c1nnn[n-]1 ZINC000826204096 607843071 /nfs/dbraw/zinc/84/30/71/607843071.db2.gz XEXONBMNZJNTKQ-UHFFFAOYSA-N -1 3 358.405 3.549 20 0 FHADHM COc1ccc(CNc2cccnc2-c2ccccc2)cc1-c1nn[n-]n1 ZINC000826204096 607843072 /nfs/dbraw/zinc/84/30/72/607843072.db2.gz XEXONBMNZJNTKQ-UHFFFAOYSA-N -1 3 358.405 3.549 20 0 FHADHM Cn1c(CCSc2ccc(-c3nnn[n-]3)cc2Cl)nc2ccccc21 ZINC000826355001 607844909 /nfs/dbraw/zinc/84/49/09/607844909.db2.gz FZNVZCLALKFPRS-UHFFFAOYSA-N -1 3 370.869 3.742 20 0 FHADHM Cn1c(CCSc2ccc(-c3nn[n-]n3)cc2Cl)nc2ccccc21 ZINC000826355001 607844910 /nfs/dbraw/zinc/84/49/10/607844910.db2.gz FZNVZCLALKFPRS-UHFFFAOYSA-N -1 3 370.869 3.742 20 0 FHADHM Cc1cccc(C(=O)Nc2sc3c(c2-c2nnn[n-]2)CCC3)c1Cl ZINC000826296205 607861654 /nfs/dbraw/zinc/86/16/54/607861654.db2.gz MUBDESOFKHAVMB-UHFFFAOYSA-N -1 3 359.842 3.631 20 0 FHADHM Cc1cccc(C(=O)Nc2sc3c(c2-c2nn[n-]n2)CCC3)c1Cl ZINC000826296205 607861655 /nfs/dbraw/zinc/86/16/55/607861655.db2.gz MUBDESOFKHAVMB-UHFFFAOYSA-N -1 3 359.842 3.631 20 0 FHADHM CC1(NC(=O)c2ccc(Sc3ccccc3-c3nnn[n-]3)cc2)CCC1 ZINC000824838338 607861858 /nfs/dbraw/zinc/86/18/58/607861858.db2.gz ODNMJKMLQICVEX-UHFFFAOYSA-N -1 3 365.462 3.690 20 0 FHADHM CC1(NC(=O)c2ccc(Sc3ccccc3-c3nn[n-]n3)cc2)CCC1 ZINC000824838338 607861859 /nfs/dbraw/zinc/86/18/59/607861859.db2.gz ODNMJKMLQICVEX-UHFFFAOYSA-N -1 3 365.462 3.690 20 0 FHADHM O[C@@H](COc1ccc(Cc2ccccc2)cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000826505234 607873740 /nfs/dbraw/zinc/87/37/40/607873740.db2.gz QCAHZECWBBZVBO-NRFANRHFSA-N -1 3 372.428 3.570 20 0 FHADHM O[C@@H](COc1ccc(Cc2ccccc2)cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000826505234 607873741 /nfs/dbraw/zinc/87/37/41/607873741.db2.gz QCAHZECWBBZVBO-NRFANRHFSA-N -1 3 372.428 3.570 20 0 FHADHM O[C@@H](COc1ccc(Oc2ccc(-c3nnn[n-]3)cc2)cc1)c1ccccc1 ZINC000826504624 607878568 /nfs/dbraw/zinc/87/85/68/607878568.db2.gz ABZBMFJIVLHJEE-FQEVSTJZSA-N -1 3 374.400 3.771 20 0 FHADHM O[C@@H](COc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)cc1)c1ccccc1 ZINC000826504624 607878569 /nfs/dbraw/zinc/87/85/69/607878569.db2.gz ABZBMFJIVLHJEE-FQEVSTJZSA-N -1 3 374.400 3.771 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)N(C)Cc1cccc(-c2nnn[n-]2)c1 ZINC000823942769 607881063 /nfs/dbraw/zinc/88/10/63/607881063.db2.gz JIDGPUIBLZPJTK-RAXLEYEMSA-N -1 3 367.840 3.582 20 0 FHADHM CC(=Cc1ccccc1Cl)C(=O)N(C)Cc1cccc(-c2nn[n-]n2)c1 ZINC000823942769 607881064 /nfs/dbraw/zinc/88/10/64/607881064.db2.gz JIDGPUIBLZPJTK-RAXLEYEMSA-N -1 3 367.840 3.582 20 0 FHADHM CCN(C(=O)[C@@H]1CCCC(C)(C)C1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825367215 607885837 /nfs/dbraw/zinc/88/58/37/607885837.db2.gz LEIFTEOJDFMKRE-RHSMWYFYSA-N -1 3 355.486 3.993 20 0 FHADHM CCN(C(=O)[C@@H]1CCCC(C)(C)C1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825367215 607885838 /nfs/dbraw/zinc/88/58/38/607885838.db2.gz LEIFTEOJDFMKRE-RHSMWYFYSA-N -1 3 355.486 3.993 20 0 FHADHM CC1(C)CCC[C@@H](CC(=O)NC2(c3cccc(-c4nnn[n-]4)c3)CC2)C1 ZINC000824802034 607908982 /nfs/dbraw/zinc/90/89/82/607908982.db2.gz KCFUCWNUMHWPOL-AWEZNQCLSA-N -1 3 353.470 3.579 20 0 FHADHM CC1(C)CCC[C@@H](CC(=O)NC2(c3cccc(-c4nn[n-]n4)c3)CC2)C1 ZINC000824802034 607908983 /nfs/dbraw/zinc/90/89/83/607908983.db2.gz KCFUCWNUMHWPOL-AWEZNQCLSA-N -1 3 353.470 3.579 20 0 FHADHM CN(C(=O)[C@@H]1CC[C@H]2CCCC[C@H]2C1)c1ccc(-c2nnn[n-]2)cc1F ZINC000825812918 607926544 /nfs/dbraw/zinc/92/65/44/607926544.db2.gz XNQFFIURZAAYRE-VNHYZAJKSA-N -1 3 357.433 3.575 20 0 FHADHM CN(C(=O)[C@@H]1CC[C@H]2CCCC[C@H]2C1)c1ccc(-c2nn[n-]n2)cc1F ZINC000825812918 607926545 /nfs/dbraw/zinc/92/65/45/607926545.db2.gz XNQFFIURZAAYRE-VNHYZAJKSA-N -1 3 357.433 3.575 20 0 FHADHM Cc1cccc(Cl)c1NC(=O)CSc1ccccc1-c1nnn[n-]1 ZINC000826298332 607931985 /nfs/dbraw/zinc/93/19/85/607931985.db2.gz OEKJIKKHGUEGPK-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM Cc1cccc(Cl)c1NC(=O)CSc1ccccc1-c1nn[n-]n1 ZINC000826298332 607931986 /nfs/dbraw/zinc/93/19/86/607931986.db2.gz OEKJIKKHGUEGPK-UHFFFAOYSA-N -1 3 359.842 3.559 20 0 FHADHM CC(C)[C@@H](CC(=O)N1CCc2ccc(-c3nnn[n-]3)cc21)c1ccccc1 ZINC000824192718 607947103 /nfs/dbraw/zinc/94/71/03/607947103.db2.gz LOKPUDAFNIBHLS-GOSISDBHSA-N -1 3 361.449 3.586 20 0 FHADHM CC(C)[C@@H](CC(=O)N1CCc2ccc(-c3nn[n-]n3)cc21)c1ccccc1 ZINC000824192718 607947104 /nfs/dbraw/zinc/94/71/04/607947104.db2.gz LOKPUDAFNIBHLS-GOSISDBHSA-N -1 3 361.449 3.586 20 0 FHADHM CCc1nc2sccc2c(N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)n1 ZINC000825750256 607965579 /nfs/dbraw/zinc/96/55/79/607965579.db2.gz OEGKLSLWUGPVSP-JTQLQIEISA-N -1 3 351.439 3.607 20 0 FHADHM CCc1nc2sccc2c(N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)n1 ZINC000825750256 607965580 /nfs/dbraw/zinc/96/55/80/607965580.db2.gz OEGKLSLWUGPVSP-JTQLQIEISA-N -1 3 351.439 3.607 20 0 FHADHM COc1ccc(-c2nc3ccc(F)cc3n2C(C)C)cc1-c1nnn[n-]1 ZINC000826181798 607975681 /nfs/dbraw/zinc/97/56/81/607975681.db2.gz OGQKFWTVRYTGBV-UHFFFAOYSA-N -1 3 352.373 3.612 20 0 FHADHM COc1ccc(-c2nc3ccc(F)cc3n2C(C)C)cc1-c1nn[n-]n1 ZINC000826181798 607975682 /nfs/dbraw/zinc/97/56/82/607975682.db2.gz OGQKFWTVRYTGBV-UHFFFAOYSA-N -1 3 352.373 3.612 20 0 FHADHM CC(C)Oc1ccc(NCc2csc(C3CC3)n2)cc1-c1nnn[n-]1 ZINC000824329054 607982627 /nfs/dbraw/zinc/98/26/27/607982627.db2.gz GOCCSVCQOGHABY-UHFFFAOYSA-N -1 3 356.455 3.600 20 0 FHADHM CC(C)Oc1ccc(NCc2csc(C3CC3)n2)cc1-c1nn[n-]n1 ZINC000824329054 607982628 /nfs/dbraw/zinc/98/26/28/607982628.db2.gz GOCCSVCQOGHABY-UHFFFAOYSA-N -1 3 356.455 3.600 20 0 FHADHM Cc1cc(C)c2ncc(-c3nnn[n-]3)c(N3CCc4ccsc4C3)c2c1 ZINC000826263529 608019067 /nfs/dbraw/zinc/01/90/67/608019067.db2.gz FYYKDJKYZONZRT-UHFFFAOYSA-N -1 3 362.462 3.656 20 0 FHADHM Cc1cc(C)c2ncc(-c3nn[n-]n3)c(N3CCc4ccsc4C3)c2c1 ZINC000826263529 608019068 /nfs/dbraw/zinc/01/90/68/608019068.db2.gz FYYKDJKYZONZRT-UHFFFAOYSA-N -1 3 362.462 3.656 20 0 FHADHM Cc1ccc(Br)c(NCc2ccc(-c3nnn[n-]3)cc2F)c1 ZINC000826281037 608048888 /nfs/dbraw/zinc/04/88/88/608048888.db2.gz ALNSHBOQSIGZRA-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM Cc1ccc(Br)c(NCc2ccc(-c3nn[n-]n3)cc2F)c1 ZINC000826281037 608048889 /nfs/dbraw/zinc/04/88/89/608048889.db2.gz ALNSHBOQSIGZRA-UHFFFAOYSA-N -1 3 362.206 3.689 20 0 FHADHM CC(C)c1cc(NCc2cc(-c3nnn[n-]3)ccc2F)nc(C(C)C)n1 ZINC000824347673 608050619 /nfs/dbraw/zinc/05/06/19/608050619.db2.gz KDDIUKUFKBMKGO-UHFFFAOYSA-N -1 3 355.421 3.655 20 0 FHADHM CC(C)c1cc(NCc2cc(-c3nn[n-]n3)ccc2F)nc(C(C)C)n1 ZINC000824347673 608050620 /nfs/dbraw/zinc/05/06/20/608050620.db2.gz KDDIUKUFKBMKGO-UHFFFAOYSA-N -1 3 355.421 3.655 20 0 FHADHM C[C@H](c1cccc(Cl)c1)N1CCO[C@@H](c2cccc(-c3nnn[n-]3)c2)C1 ZINC000824770482 608066063 /nfs/dbraw/zinc/06/60/63/608066063.db2.gz KZGIFQWYUYDXRE-FZKQIMNGSA-N -1 3 369.856 3.655 20 0 FHADHM C[C@H](c1cccc(Cl)c1)N1CCO[C@@H](c2cccc(-c3nn[n-]n3)c2)C1 ZINC000824770482 608066064 /nfs/dbraw/zinc/06/60/64/608066064.db2.gz KZGIFQWYUYDXRE-FZKQIMNGSA-N -1 3 369.856 3.655 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)N[C@@H]1c2ccccc2CC[C@@H]1C ZINC000826278123 608105693 /nfs/dbraw/zinc/10/56/93/608105693.db2.gz RMDJRQGRCCHYGR-UGSOOPFHSA-N -1 3 362.437 3.620 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)N[C@@H]1c2ccccc2CC[C@@H]1C ZINC000826278123 608105694 /nfs/dbraw/zinc/10/56/94/608105694.db2.gz RMDJRQGRCCHYGR-UGSOOPFHSA-N -1 3 362.437 3.620 20 0 FHADHM O=C(CCCC(F)(F)F)Nc1sc2c(c1-c1nnn[n-]1)CCCCC2 ZINC000826405376 608149037 /nfs/dbraw/zinc/14/90/37/608149037.db2.gz DDPOEMTZHNLLEC-UHFFFAOYSA-N -1 3 373.404 3.868 20 0 FHADHM O=C(CCCC(F)(F)F)Nc1sc2c(c1-c1nn[n-]n1)CCCCC2 ZINC000826405376 608149038 /nfs/dbraw/zinc/14/90/38/608149038.db2.gz DDPOEMTZHNLLEC-UHFFFAOYSA-N -1 3 373.404 3.868 20 0 FHADHM CC(C)(C)[C@@H]1C[C@H](Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)CCO1 ZINC000824079364 608149739 /nfs/dbraw/zinc/14/97/39/608149739.db2.gz PAAHGNSLYAXXIH-RISCZKNCSA-N -1 3 369.391 3.891 20 0 FHADHM CC(C)(C)[C@@H]1C[C@H](Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)CCO1 ZINC000824079364 608149741 /nfs/dbraw/zinc/14/97/41/608149741.db2.gz PAAHGNSLYAXXIH-RISCZKNCSA-N -1 3 369.391 3.891 20 0 FHADHM CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H]1CC12CCCCC2 ZINC000825319066 608164436 /nfs/dbraw/zinc/16/44/36/608164436.db2.gz WNEWAMLUVRSGMZ-QGZVFWFLSA-N -1 3 368.485 3.511 20 0 FHADHM CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H]1CC12CCCCC2 ZINC000825319066 608164437 /nfs/dbraw/zinc/16/44/37/608164437.db2.gz WNEWAMLUVRSGMZ-QGZVFWFLSA-N -1 3 368.485 3.511 20 0 FHADHM C[C@H](OC(=O)[C@@H]1CCSc2ccccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000824715935 608181745 /nfs/dbraw/zinc/18/17/45/608181745.db2.gz VKZBINLGAZPESJ-BLLLJJGKSA-N -1 3 366.446 3.751 20 0 FHADHM C[C@H](OC(=O)[C@@H]1CCSc2ccccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000824715935 608181747 /nfs/dbraw/zinc/18/17/47/608181747.db2.gz VKZBINLGAZPESJ-BLLLJJGKSA-N -1 3 366.446 3.751 20 0 FHADHM C[C@@H](OC(=O)[C@H]1CCCc2sccc21)c1cccc(-c2nnn[n-]2)c1 ZINC000824714959 608182039 /nfs/dbraw/zinc/18/20/39/608182039.db2.gz PSJMOYGMWMCPDV-ABAIWWIYSA-N -1 3 354.435 3.653 20 0 FHADHM C[C@@H](OC(=O)[C@H]1CCCc2sccc21)c1cccc(-c2nn[n-]n2)c1 ZINC000824714959 608182041 /nfs/dbraw/zinc/18/20/41/608182041.db2.gz PSJMOYGMWMCPDV-ABAIWWIYSA-N -1 3 354.435 3.653 20 0 FHADHM C[C@@H](OC(=O)[C@H](C)Oc1ccccc1Cl)c1cccc(-c2nnn[n-]2)c1 ZINC000824756105 608183723 /nfs/dbraw/zinc/18/37/23/608183723.db2.gz NTKKAWFCPZUEMB-NEPJUHHUSA-N -1 3 372.812 3.592 20 0 FHADHM C[C@@H](OC(=O)[C@H](C)Oc1ccccc1Cl)c1cccc(-c2nn[n-]n2)c1 ZINC000824756105 608183724 /nfs/dbraw/zinc/18/37/24/608183724.db2.gz NTKKAWFCPZUEMB-NEPJUHHUSA-N -1 3 372.812 3.592 20 0 FHADHM Cc1ccccc1NC(=O)[C@H](C)Sc1cccc(Cl)c1-c1nnn[n-]1 ZINC000826307604 608206360 /nfs/dbraw/zinc/20/63/60/608206360.db2.gz OVYZONHCRNMAJN-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM Cc1ccccc1NC(=O)[C@H](C)Sc1cccc(Cl)c1-c1nn[n-]n1 ZINC000826307604 608206361 /nfs/dbraw/zinc/20/63/61/608206361.db2.gz OVYZONHCRNMAJN-NSHDSACASA-N -1 3 373.869 3.948 20 0 FHADHM COc1ccc(C(=O)CSc2cccc(Cl)c2-c2nnn[n-]2)cc1 ZINC000826187247 608207840 /nfs/dbraw/zinc/20/78/40/608207840.db2.gz HMOAZYVERILNIJ-UHFFFAOYSA-N -1 3 360.826 3.504 20 0 FHADHM COc1ccc(C(=O)CSc2cccc(Cl)c2-c2nn[n-]n2)cc1 ZINC000826187247 608207841 /nfs/dbraw/zinc/20/78/41/608207841.db2.gz HMOAZYVERILNIJ-UHFFFAOYSA-N -1 3 360.826 3.504 20 0 FHADHM COc1ccc([C@@H](C)N(C)c2ccc3cc(-c4nnn[n-]4)ccc3n2)cc1 ZINC000826188101 608221606 /nfs/dbraw/zinc/22/16/06/608221606.db2.gz NPKQQTPCVGRZPD-CYBMUJFWSA-N -1 3 360.421 3.621 20 0 FHADHM COc1ccc([C@@H](C)N(C)c2ccc3cc(-c4nn[n-]n4)ccc3n2)cc1 ZINC000826188101 608221607 /nfs/dbraw/zinc/22/16/07/608221607.db2.gz NPKQQTPCVGRZPD-CYBMUJFWSA-N -1 3 360.421 3.621 20 0 FHADHM Fc1ccc(C2=CCN(c3ccc4cc(-c5nnn[n-]5)ccc4n3)CC2)cc1 ZINC000826374304 608222345 /nfs/dbraw/zinc/22/23/45/608222345.db2.gz UDMYMPNGZVLAQJ-UHFFFAOYSA-N -1 3 372.407 3.848 20 0 FHADHM Fc1ccc(C2=CCN(c3ccc4cc(-c5nn[n-]n5)ccc4n3)CC2)cc1 ZINC000826374304 608222347 /nfs/dbraw/zinc/22/23/47/608222347.db2.gz UDMYMPNGZVLAQJ-UHFFFAOYSA-N -1 3 372.407 3.848 20 0 FHADHM CCOc1ccccc1[C@@H](C)Nc1ccc2cc(-c3nnn[n-]3)ccc2n1 ZINC000825654320 608225083 /nfs/dbraw/zinc/22/50/83/608225083.db2.gz WZMOHMZFWWWCKI-CYBMUJFWSA-N -1 3 360.421 3.987 20 0 FHADHM CCOc1ccccc1[C@@H](C)Nc1ccc2cc(-c3nn[n-]n3)ccc2n1 ZINC000825654320 608225084 /nfs/dbraw/zinc/22/50/84/608225084.db2.gz WZMOHMZFWWWCKI-CYBMUJFWSA-N -1 3 360.421 3.987 20 0 FHADHM Cc1cccc([C@H](Nc2ccc(F)cc2-c2nnn[n-]2)c2ccccn2)c1 ZINC000826297012 608230948 /nfs/dbraw/zinc/23/09/48/608230948.db2.gz RPEVSTXGYRQCFE-IBGZPJMESA-N -1 3 360.396 3.911 20 0 FHADHM Cc1cccc([C@H](Nc2ccc(F)cc2-c2nn[n-]n2)c2ccccn2)c1 ZINC000826297012 608230950 /nfs/dbraw/zinc/23/09/50/608230950.db2.gz RPEVSTXGYRQCFE-IBGZPJMESA-N -1 3 360.396 3.911 20 0 FHADHM CCN(C(=O)c1ccc(Cl)c(F)c1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1 ZINC000825385507 608236261 /nfs/dbraw/zinc/23/62/61/608236261.db2.gz IIMFENFOFLKBGH-NSHDSACASA-N -1 3 373.819 3.883 20 0 FHADHM CCN(C(=O)c1ccc(Cl)c(F)c1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1 ZINC000825385507 608236262 /nfs/dbraw/zinc/23/62/62/608236262.db2.gz IIMFENFOFLKBGH-NSHDSACASA-N -1 3 373.819 3.883 20 0 FHADHM COc1ccc([C@H](OC)[C@@H](C)Nc2ccc(-c3nnn[n-]3)c(Cl)c2)cc1 ZINC000826189932 608239692 /nfs/dbraw/zinc/23/96/92/608239692.db2.gz JPICCYYRBQHGMS-PIGZYNQJSA-N -1 3 373.844 3.717 20 0 FHADHM COc1ccc([C@H](OC)[C@@H](C)Nc2ccc(-c3nn[n-]n3)c(Cl)c2)cc1 ZINC000826189932 608239693 /nfs/dbraw/zinc/23/96/93/608239693.db2.gz JPICCYYRBQHGMS-PIGZYNQJSA-N -1 3 373.844 3.717 20 0 FHADHM CCc1ccc(C2=CCN(C(=O)Nc3cccc(-c4nnn[n-]4)c3)CC2)cc1 ZINC000825704942 608241026 /nfs/dbraw/zinc/24/10/26/608241026.db2.gz QXDDTYWBJYVJFH-UHFFFAOYSA-N -1 3 374.448 3.750 20 0 FHADHM CCc1ccc(C2=CCN(C(=O)Nc3cccc(-c4nn[n-]n4)c3)CC2)cc1 ZINC000825704942 608241028 /nfs/dbraw/zinc/24/10/28/608241028.db2.gz QXDDTYWBJYVJFH-UHFFFAOYSA-N -1 3 374.448 3.750 20 0 FHADHM CC(C)(Oc1ccc(-c2nnn[n-]2)cc1)C(=O)Nc1ccc(C2CC2)cc1 ZINC000824171536 608244068 /nfs/dbraw/zinc/24/40/68/608244068.db2.gz BHJJGZYKIKFUAJ-UHFFFAOYSA-N -1 3 363.421 3.540 20 0 FHADHM CC(C)(Oc1ccc(-c2nn[n-]n2)cc1)C(=O)Nc1ccc(C2CC2)cc1 ZINC000824171536 608244070 /nfs/dbraw/zinc/24/40/70/608244070.db2.gz BHJJGZYKIKFUAJ-UHFFFAOYSA-N -1 3 363.421 3.540 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccc2[nH]ccc2c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824712821 608246747 /nfs/dbraw/zinc/24/67/47/608246747.db2.gz DEFXHKAIKRJUAA-FWPCIQOSSA-N -1 3 359.389 3.666 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccc2[nH]ccc2c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824712821 608246748 /nfs/dbraw/zinc/24/67/48/608246748.db2.gz DEFXHKAIKRJUAA-FWPCIQOSSA-N -1 3 359.389 3.666 20 0 FHADHM C[C@@H](CC(=O)N(C)c1ccc(-c2nnn[n-]2)cc1)Cc1ccc(Cl)cc1 ZINC000824385608 608259463 /nfs/dbraw/zinc/25/94/63/608259463.db2.gz XPCDZQKVHLEPSO-CYBMUJFWSA-N -1 3 369.856 3.752 20 0 FHADHM C[C@@H](CC(=O)N(C)c1ccc(-c2nn[n-]n2)cc1)Cc1ccc(Cl)cc1 ZINC000824385608 608259465 /nfs/dbraw/zinc/25/94/65/608259465.db2.gz XPCDZQKVHLEPSO-CYBMUJFWSA-N -1 3 369.856 3.752 20 0 FHADHM Cc1ccc(-c2nnn[n-]2)c(N2Cc3ccccc3[C@H](c3ccccc3)C2)n1 ZINC000826274826 608273868 /nfs/dbraw/zinc/27/38/68/608273868.db2.gz GJYSXFBEDNQBHK-FQEVSTJZSA-N -1 3 368.444 3.722 20 0 FHADHM Cc1ccc(-c2nn[n-]n2)c(N2Cc3ccccc3[C@H](c3ccccc3)C2)n1 ZINC000826274826 608273870 /nfs/dbraw/zinc/27/38/70/608273870.db2.gz GJYSXFBEDNQBHK-FQEVSTJZSA-N -1 3 368.444 3.722 20 0 FHADHM C[C@H](Nc1nc2c(cc1-c1nnn[n-]1)CCCC2)c1c(F)cccc1F ZINC000824663184 608276281 /nfs/dbraw/zinc/27/62/81/608276281.db2.gz WLFODNJALCTFEJ-JTQLQIEISA-N -1 3 356.380 3.592 20 0 FHADHM C[C@H](Nc1nc2c(cc1-c1nn[n-]n1)CCCC2)c1c(F)cccc1F ZINC000824663184 608276283 /nfs/dbraw/zinc/27/62/83/608276283.db2.gz WLFODNJALCTFEJ-JTQLQIEISA-N -1 3 356.380 3.592 20 0 FHADHM Cc1cnc([C@@H](C)NCc2ccc(-c3ccccc3-c3nnn[n-]3)cc2)o1 ZINC000826317689 608291335 /nfs/dbraw/zinc/29/13/35/608291335.db2.gz KZWDCKHJQRZKRQ-CQSZACIVSA-N -1 3 360.421 3.681 20 0 FHADHM Cc1cnc([C@@H](C)NCc2ccc(-c3ccccc3-c3nn[n-]n3)cc2)o1 ZINC000826317689 608291336 /nfs/dbraw/zinc/29/13/36/608291336.db2.gz KZWDCKHJQRZKRQ-CQSZACIVSA-N -1 3 360.421 3.681 20 0 FHADHM CS[C@@H](C)CCC(=O)Oc1ccc(-c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000826226386 608291716 /nfs/dbraw/zinc/29/17/16/608291716.db2.gz YPJDFFAOGNSDQT-ZDUSSCGKSA-N -1 3 368.462 3.971 20 0 FHADHM CS[C@@H](C)CCC(=O)Oc1ccc(-c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000826226386 608291719 /nfs/dbraw/zinc/29/17/19/608291719.db2.gz YPJDFFAOGNSDQT-ZDUSSCGKSA-N -1 3 368.462 3.971 20 0 FHADHM COC[C@H](Nc1ccc(-c2nnn[n-]2)c(Cl)c1)c1ccc(F)c(F)c1 ZINC000826152102 608299708 /nfs/dbraw/zinc/29/97/08/608299708.db2.gz QXLNFVFAMDPDSI-HNNXBMFYSA-N -1 3 365.771 3.598 20 0 FHADHM COC[C@H](Nc1ccc(-c2nn[n-]n2)c(Cl)c1)c1ccc(F)c(F)c1 ZINC000826152102 608299710 /nfs/dbraw/zinc/29/97/10/608299710.db2.gz QXLNFVFAMDPDSI-HNNXBMFYSA-N -1 3 365.771 3.598 20 0 FHADHM Cc1scc(C(=O)Nc2ccc(OC(C)C)c(-c3nnn[n-]3)c2)c1C ZINC000826350313 608302004 /nfs/dbraw/zinc/30/20/04/608302004.db2.gz QGVASBSEPHDXAX-UHFFFAOYSA-N -1 3 357.439 3.585 20 0 FHADHM Cc1scc(C(=O)Nc2ccc(OC(C)C)c(-c3nn[n-]n3)c2)c1C ZINC000826350313 608302006 /nfs/dbraw/zinc/30/20/06/608302006.db2.gz QGVASBSEPHDXAX-UHFFFAOYSA-N -1 3 357.439 3.585 20 0 FHADHM Cc1nc(CNCc2ccc(-c3ccccc3-c3nnn[n-]3)cc2)cs1 ZINC000826326317 608310817 /nfs/dbraw/zinc/31/08/17/608310817.db2.gz KFTRPULIBMDSMU-UHFFFAOYSA-N -1 3 362.462 3.588 20 0 FHADHM Cc1nc(CNCc2ccc(-c3ccccc3-c3nn[n-]n3)cc2)cs1 ZINC000826326317 608310818 /nfs/dbraw/zinc/31/08/18/608310818.db2.gz KFTRPULIBMDSMU-UHFFFAOYSA-N -1 3 362.462 3.588 20 0 FHADHM Cc1sc(NC(=O)Cc2c(C)cc(C)cc2C)c(-c2nnn[n-]2)c1C ZINC000826262993 608339656 /nfs/dbraw/zinc/33/96/56/608339656.db2.gz GYRASUDMLCWGAA-UHFFFAOYSA-N -1 3 355.467 3.652 20 0 FHADHM Cc1sc(NC(=O)Cc2c(C)cc(C)cc2C)c(-c2nn[n-]n2)c1C ZINC000826262993 608339658 /nfs/dbraw/zinc/33/96/58/608339658.db2.gz GYRASUDMLCWGAA-UHFFFAOYSA-N -1 3 355.467 3.652 20 0 FHADHM CCN(C(=O)[C@H](C)c1cccs1)c1ccc(-c2nnn[n-]2)c(Cl)c1 ZINC000825367980 608345154 /nfs/dbraw/zinc/34/51/54/608345154.db2.gz YTTNXOZTTYOAND-SNVBAGLBSA-N -1 3 361.858 3.738 20 0 FHADHM CCN(C(=O)[C@H](C)c1cccs1)c1ccc(-c2nn[n-]n2)c(Cl)c1 ZINC000825367980 608345156 /nfs/dbraw/zinc/34/51/56/608345156.db2.gz YTTNXOZTTYOAND-SNVBAGLBSA-N -1 3 361.858 3.738 20 0 FHADHM Fc1c(CSCc2ccn(-c3ccccc3)n2)cccc1-c1nnn[n-]1 ZINC000826370976 608404779 /nfs/dbraw/zinc/40/47/79/608404779.db2.gz NSLBYOJJTPUXFE-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM Fc1c(CSCc2ccn(-c3ccccc3)n2)cccc1-c1nn[n-]n1 ZINC000826370976 608404780 /nfs/dbraw/zinc/40/47/80/608404780.db2.gz NSLBYOJJTPUXFE-UHFFFAOYSA-N -1 3 366.425 3.625 20 0 FHADHM CC[C@@H](C)n1ncc(NCc2ccc(OC)c(-c3nnn[n-]3)c2)c1C1CC1 ZINC000825083309 608427936 /nfs/dbraw/zinc/42/79/36/608427936.db2.gz ZVBNAQFPKJZWLB-GFCCVEGCSA-N -1 3 367.457 3.532 20 0 FHADHM CC[C@@H](C)n1ncc(NCc2ccc(OC)c(-c3nn[n-]n3)c2)c1C1CC1 ZINC000825083309 608427938 /nfs/dbraw/zinc/42/79/38/608427938.db2.gz ZVBNAQFPKJZWLB-GFCCVEGCSA-N -1 3 367.457 3.532 20 0 FHADHM CC(C)(C)Oc1cccc(CNc2ccc(-c3nnn[n-]3)c(Cl)c2)n1 ZINC000824123964 608439166 /nfs/dbraw/zinc/43/91/66/608439166.db2.gz OKFAVGJOZGGGOZ-UHFFFAOYSA-N -1 3 358.833 3.705 20 0 FHADHM CC(C)(C)Oc1cccc(CNc2ccc(-c3nn[n-]n3)c(Cl)c2)n1 ZINC000824123964 608439167 /nfs/dbraw/zinc/43/91/67/608439167.db2.gz OKFAVGJOZGGGOZ-UHFFFAOYSA-N -1 3 358.833 3.705 20 0 FHADHM O=C(OCc1cccc(-c2nnn[n-]2)c1F)c1cc(Cl)sc1Cl ZINC000826466124 608440472 /nfs/dbraw/zinc/44/04/72/608440472.db2.gz PNPNMGJPFWZLSD-UHFFFAOYSA-N -1 3 373.196 3.731 20 0 FHADHM O=C(OCc1cccc(-c2nn[n-]n2)c1F)c1cc(Cl)sc1Cl ZINC000826466124 608440474 /nfs/dbraw/zinc/44/04/74/608440474.db2.gz PNPNMGJPFWZLSD-UHFFFAOYSA-N -1 3 373.196 3.731 20 0 FHADHM C[C@@H](C(=O)OCc1cccc(-c2nnn[n-]2)c1F)c1cccc(Cl)c1 ZINC000824052031 608448838 /nfs/dbraw/zinc/44/88/38/608448838.db2.gz KNWFWOUCYMVYCB-SNVBAGLBSA-N -1 3 360.776 3.506 20 0 FHADHM C[C@@H](C(=O)OCc1cccc(-c2nn[n-]n2)c1F)c1cccc(Cl)c1 ZINC000824052031 608448840 /nfs/dbraw/zinc/44/88/40/608448840.db2.gz KNWFWOUCYMVYCB-SNVBAGLBSA-N -1 3 360.776 3.506 20 0 FHADHM C[C@H](C(=O)OCc1cccc(-c2nnn[n-]2)c1F)c1ccc(Cl)s1 ZINC000824053500 608450537 /nfs/dbraw/zinc/45/05/37/608450537.db2.gz ZZUZGUIVZBXWLC-QMMMGPOBSA-N -1 3 366.805 3.568 20 0 FHADHM C[C@H](C(=O)OCc1cccc(-c2nn[n-]n2)c1F)c1ccc(Cl)s1 ZINC000824053500 608450539 /nfs/dbraw/zinc/45/05/39/608450539.db2.gz ZZUZGUIVZBXWLC-QMMMGPOBSA-N -1 3 366.805 3.568 20 0 FHADHM Cc1cccc(C)c1NC(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000826296987 608469245 /nfs/dbraw/zinc/46/92/45/608469245.db2.gz QJQPDMKTCHXABI-UHFFFAOYSA-N -1 3 374.448 3.805 20 0 FHADHM Cc1cccc(C)c1NC(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000826296987 608469248 /nfs/dbraw/zinc/46/92/48/608469248.db2.gz QJQPDMKTCHXABI-UHFFFAOYSA-N -1 3 374.448 3.805 20 0 FHADHM C[C@H]1CCC[C@H](CC(=O)N2CC=C(c3ccc(-c4nnn[n-]4)cc3)CC2)C1 ZINC000824925520 608477921 /nfs/dbraw/zinc/47/79/21/608477921.db2.gz DQTKHVJBUVMVHZ-HOTGVXAUSA-N -1 3 365.481 3.699 20 0 FHADHM C[C@H]1CCC[C@H](CC(=O)N2CC=C(c3ccc(-c4nn[n-]n4)cc3)CC2)C1 ZINC000824925520 608477924 /nfs/dbraw/zinc/47/79/24/608477924.db2.gz DQTKHVJBUVMVHZ-HOTGVXAUSA-N -1 3 365.481 3.699 20 0 FHADHM Fc1cc(Br)ccc1NCc1cccc(-c2nnn[n-]2)c1F ZINC000826372226 608479637 /nfs/dbraw/zinc/47/96/37/608479637.db2.gz NINXAXOMAZNAOL-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM Fc1cc(Br)ccc1NCc1cccc(-c2nn[n-]n2)c1F ZINC000826372226 608479638 /nfs/dbraw/zinc/47/96/38/608479638.db2.gz NINXAXOMAZNAOL-UHFFFAOYSA-N -1 3 366.169 3.520 20 0 FHADHM CCC(CC)[C@@H](C)C(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000825097428 608480008 /nfs/dbraw/zinc/48/00/08/608480008.db2.gz WNQAXZUCRNPNJE-CQSZACIVSA-N -1 3 353.470 3.555 20 0 FHADHM CCC(CC)[C@@H](C)C(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000825097428 608480009 /nfs/dbraw/zinc/48/00/09/608480009.db2.gz WNQAXZUCRNPNJE-CQSZACIVSA-N -1 3 353.470 3.555 20 0 FHADHM C[C@H](NCc1csc(C2CCCC2)n1)c1cccc(-c2nn[n-]n2)c1 ZINC000824626714 608484520 /nfs/dbraw/zinc/48/45/20/608484520.db2.gz SDYKOUYKDWQIBB-LBPRGKRZSA-N -1 3 354.483 3.832 20 0 FHADHM Cc1oc(-c2ccccc2)nc1CN[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC000826339936 608486615 /nfs/dbraw/zinc/48/66/15/608486615.db2.gz ABNOKSPYFZQKKK-ZDUSSCGKSA-N -1 3 360.421 3.681 20 0 FHADHM CC[C@H](C(=O)N1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1)c1ccccc1 ZINC000825038692 608487952 /nfs/dbraw/zinc/48/79/52/608487952.db2.gz GCVYRVJOGRJXPW-FQEVSTJZSA-N -1 3 373.460 3.676 20 0 FHADHM CC[C@H](C(=O)N1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1)c1ccccc1 ZINC000825038692 608487954 /nfs/dbraw/zinc/48/79/54/608487954.db2.gz GCVYRVJOGRJXPW-FQEVSTJZSA-N -1 3 373.460 3.676 20 0 FHADHM Cc1ccc(-c2cnc(CN[C@H](C)c3cccc(-c4nn[n-]n4)c3)o2)cc1 ZINC000826273669 608489994 /nfs/dbraw/zinc/48/99/94/608489994.db2.gz OVCBWDISLLRKAQ-CQSZACIVSA-N -1 3 360.421 3.681 20 0 FHADHM Cc1ccc(-c2nc(CN[C@@H](C)c3cccc(-c4nn[n-]n4)c3)cs2)o1 ZINC000826273393 608491305 /nfs/dbraw/zinc/49/13/05/608491305.db2.gz BRTUWBLLYUNYDB-LBPRGKRZSA-N -1 3 366.450 3.742 20 0 FHADHM C[C@H](NC(=O)Nc1ccc(F)cc1-c1nnn[n-]1)c1ccccc1Cl ZINC000826232147 608493875 /nfs/dbraw/zinc/49/38/75/608493875.db2.gz UCYUHRHFFYUIEN-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM C[C@H](NC(=O)Nc1ccc(F)cc1-c1nn[n-]n1)c1ccccc1Cl ZINC000826232147 608493877 /nfs/dbraw/zinc/49/38/77/608493877.db2.gz UCYUHRHFFYUIEN-VIFPVBQESA-N -1 3 360.780 3.542 20 0 FHADHM FC(F)Oc1cc(-c2nnn[n-]2)ccc1COc1ccc2[nH]ccc2c1 ZINC000826369701 608498700 /nfs/dbraw/zinc/49/87/00/608498700.db2.gz NILWYUYPSJLGDZ-UHFFFAOYSA-N -1 3 357.320 3.528 20 0 FHADHM FC(F)Oc1cc(-c2nn[n-]n2)ccc1COc1ccc2[nH]ccc2c1 ZINC000826369701 608498701 /nfs/dbraw/zinc/49/87/01/608498701.db2.gz NILWYUYPSJLGDZ-UHFFFAOYSA-N -1 3 357.320 3.528 20 0 FHADHM c1csc([C@@H]2c3ccsc3CCN2Cc2ccc(-c3nnn[n-]3)o2)c1 ZINC000826525826 608506060 /nfs/dbraw/zinc/50/60/60/608506060.db2.gz APGQOLRTLDWXEW-INIZCTEOSA-N -1 3 369.475 3.730 20 0 FHADHM c1csc([C@@H]2c3ccsc3CCN2Cc2ccc(-c3nn[n-]n3)o2)c1 ZINC000826525826 608506061 /nfs/dbraw/zinc/50/60/61/608506061.db2.gz APGQOLRTLDWXEW-INIZCTEOSA-N -1 3 369.475 3.730 20 0 FHADHM CCc1nc([C@H](C)N[C@@H]2CCCc3cc(-c4nn[n-]n4)ccc32)cs1 ZINC000825746168 608510739 /nfs/dbraw/zinc/51/07/39/608510739.db2.gz SJPHVJKLPSXUQC-XHDPSFHLSA-N -1 3 354.483 3.614 20 0 FHADHM C[C@@H]1C[C@H]1c1ccc(CN(Cc2ccc(-c3nnn[n-]3)s2)C2CC2)o1 ZINC000824899617 608518505 /nfs/dbraw/zinc/51/85/05/608518505.db2.gz LSYWAFYOQMILFR-IAQYHMDHSA-N -1 3 355.467 3.809 20 0 FHADHM C[C@@H]1C[C@H]1c1ccc(CN(Cc2ccc(-c3nn[n-]n3)s2)C2CC2)o1 ZINC000824899617 608518506 /nfs/dbraw/zinc/51/85/06/608518506.db2.gz LSYWAFYOQMILFR-IAQYHMDHSA-N -1 3 355.467 3.809 20 0 FHADHM Cc1ccc(-c2cnc(CNC3(c4cccc(-c5nnn[n-]5)c4)CC3)o2)cc1 ZINC000826273527 608532518 /nfs/dbraw/zinc/53/25/18/608532518.db2.gz IJPXRTSHNKUSNA-UHFFFAOYSA-N -1 3 372.432 3.609 20 0 FHADHM Cc1ccc(-c2cnc(CNC3(c4cccc(-c5nn[n-]n5)c4)CC3)o2)cc1 ZINC000826273527 608532519 /nfs/dbraw/zinc/53/25/19/608532519.db2.gz IJPXRTSHNKUSNA-UHFFFAOYSA-N -1 3 372.432 3.609 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CN[C@H](C)c1ccc(F)cc1Cl ZINC000826169845 608535506 /nfs/dbraw/zinc/53/55/06/608535506.db2.gz HMLOAZZAZRFVFJ-SNVBAGLBSA-N -1 3 361.808 3.519 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CN[C@H](C)c1ccc(F)cc1Cl ZINC000826169845 608535508 /nfs/dbraw/zinc/53/55/08/608535508.db2.gz HMLOAZZAZRFVFJ-SNVBAGLBSA-N -1 3 361.808 3.519 20 0 FHADHM C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)Cc1ccc(-c2nnn[n-]2)o1 ZINC000824761764 608541676 /nfs/dbraw/zinc/54/16/76/608541676.db2.gz CHSJLWAXMBUHBH-VIFPVBQESA-N -1 3 352.225 3.960 20 0 FHADHM CCC[C@H](NCc1ccc(-c2nn[n-]n2)cc1OC)c1ccc(F)cc1F ZINC000825241980 608553555 /nfs/dbraw/zinc/55/35/55/608553555.db2.gz GAQTWSXZDAXOPC-KRWDZBQOSA-N -1 3 373.407 3.785 20 0 FHADHM COc1cc(-c2nnn[n-]2)ccc1CN[C@@H](C)c1c(F)cccc1Cl ZINC000826170344 608553791 /nfs/dbraw/zinc/55/37/91/608553791.db2.gz XCBRCLMVGKGCAY-JTQLQIEISA-N -1 3 361.808 3.519 20 0 FHADHM COc1cc(-c2nn[n-]n2)ccc1CN[C@@H](C)c1c(F)cccc1Cl ZINC000826170344 608553792 /nfs/dbraw/zinc/55/37/92/608553792.db2.gz XCBRCLMVGKGCAY-JTQLQIEISA-N -1 3 361.808 3.519 20 0 FHADHM O=C(Nc1ccc(F)cc1Cl)c1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000826454702 608574196 /nfs/dbraw/zinc/57/41/96/608574196.db2.gz HWRKHIPTUIEMJO-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM O=C(Nc1ccc(F)cc1Cl)c1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000826454702 608574197 /nfs/dbraw/zinc/57/41/97/608574197.db2.gz HWRKHIPTUIEMJO-UHFFFAOYSA-N -1 3 352.156 3.565 20 0 FHADHM CCN(C(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1)c1cc(C)cc(C)c1 ZINC000825379608 608575315 /nfs/dbraw/zinc/57/53/15/608575315.db2.gz IVTKHYVXJXIZBE-UHFFFAOYSA-N -1 3 355.829 3.804 20 0 FHADHM CCN(C(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1)c1cc(C)cc(C)c1 ZINC000825379608 608575316 /nfs/dbraw/zinc/57/53/16/608575316.db2.gz IVTKHYVXJXIZBE-UHFFFAOYSA-N -1 3 355.829 3.804 20 0 FHADHM C[C@@H]1CN(C(=O)c2ccc(Cl)c(-c3nnn[n-]3)c2)c2ccccc2S1 ZINC000824974665 608576592 /nfs/dbraw/zinc/57/65/92/608576592.db2.gz CWNHMTUHJXJOIG-SNVBAGLBSA-N -1 3 371.853 3.661 20 0 FHADHM C[C@@H]1CN(C(=O)c2ccc(Cl)c(-c3nn[n-]n3)c2)c2ccccc2S1 ZINC000824974665 608576593 /nfs/dbraw/zinc/57/65/93/608576593.db2.gz CWNHMTUHJXJOIG-SNVBAGLBSA-N -1 3 371.853 3.661 20 0 FHADHM CCCOc1ccc(NC(=O)N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000825339122 608600074 /nfs/dbraw/zinc/60/00/74/608600074.db2.gz NXLINZIAMMWMDI-CYBMUJFWSA-N -1 3 366.425 3.538 20 0 FHADHM CCCOc1ccc(NC(=O)N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000825339122 608600075 /nfs/dbraw/zinc/60/00/75/608600075.db2.gz NXLINZIAMMWMDI-CYBMUJFWSA-N -1 3 366.425 3.538 20 0 FHADHM C[C@@H]1CC[C@H](C)N(C(=O)Nc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)C1 ZINC000824909786 608604708 /nfs/dbraw/zinc/60/47/08/608604708.db2.gz UTACEAFEHCSWTC-ZJUUUORDSA-N -1 3 368.363 3.538 20 0 FHADHM C[C@@H]1CC[C@H](C)N(C(=O)Nc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)C1 ZINC000824909786 608604709 /nfs/dbraw/zinc/60/47/09/608604709.db2.gz UTACEAFEHCSWTC-ZJUUUORDSA-N -1 3 368.363 3.538 20 0 FHADHM CCN(Cc1ccc(-c2nnn[n-]2)o1)Cc1ccc(Cl)c(Cl)c1 ZINC000825434606 608620755 /nfs/dbraw/zinc/62/07/55/608620755.db2.gz BBYVCJQJCDEPPE-UHFFFAOYSA-N -1 3 352.225 3.789 20 0 FHADHM Cc1nc2ccccc2nc1SCc1cccc(-c2nnn[n-]2)c1F ZINC000826329121 608669278 /nfs/dbraw/zinc/66/92/78/608669278.db2.gz QMXKVPGCCSWMSW-UHFFFAOYSA-N -1 3 352.398 3.550 20 0 FHADHM Cc1nc2ccccc2nc1SCc1cccc(-c2nn[n-]n2)c1F ZINC000826329121 608669280 /nfs/dbraw/zinc/66/92/80/608669280.db2.gz QMXKVPGCCSWMSW-UHFFFAOYSA-N -1 3 352.398 3.550 20 0 FHADHM CCc1ccc(NC(=O)N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)cc1C ZINC000825712394 608819967 /nfs/dbraw/zinc/81/99/67/608819967.db2.gz QHJOEZMYGDLUOZ-CYBMUJFWSA-N -1 3 350.426 3.620 20 0 FHADHM CCc1ccc(NC(=O)N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)cc1C ZINC000825712394 608819970 /nfs/dbraw/zinc/81/99/70/608819970.db2.gz QHJOEZMYGDLUOZ-CYBMUJFWSA-N -1 3 350.426 3.620 20 0 FHADHM O=C(O[C@@H](C1CCCCC1)C(F)(F)F)c1ccc(-c2nnn[n-]2)cc1 ZINC000826462232 608827233 /nfs/dbraw/zinc/82/72/33/608827233.db2.gz RRZPKGGDTGRBCT-ZDUSSCGKSA-N -1 3 354.332 3.535 20 0 FHADHM O=C(O[C@@H](C1CCCCC1)C(F)(F)F)c1ccc(-c2nn[n-]n2)cc1 ZINC000826462232 608827235 /nfs/dbraw/zinc/82/72/35/608827235.db2.gz RRZPKGGDTGRBCT-ZDUSSCGKSA-N -1 3 354.332 3.535 20 0 FHADHM Cc1cc(C)cc(C2=CCN(C(=O)c3ccc(-c4nnn[n-]4)cc3C)CC2)c1 ZINC000826264719 608829557 /nfs/dbraw/zinc/82/95/57/608829557.db2.gz YAJWMWDYZYMTGC-UHFFFAOYSA-N -1 3 373.460 3.721 20 0 FHADHM Cc1cc(C)cc(C2=CCN(C(=O)c3ccc(-c4nn[n-]n4)cc3C)CC2)c1 ZINC000826264719 608829561 /nfs/dbraw/zinc/82/95/61/608829561.db2.gz YAJWMWDYZYMTGC-UHFFFAOYSA-N -1 3 373.460 3.721 20 0 FHADHM CCCCOc1ccc(CNc2cccc(-c3nnn[n-]3)c2)cc1OC ZINC000825291029 608867548 /nfs/dbraw/zinc/86/75/48/608867548.db2.gz LQDLDEQIEQAHKM-UHFFFAOYSA-N -1 3 353.426 3.666 20 0 FHADHM CCCCOc1ccc(CNc2cccc(-c3nn[n-]n3)c2)cc1OC ZINC000825291029 608867549 /nfs/dbraw/zinc/86/75/49/608867549.db2.gz LQDLDEQIEQAHKM-UHFFFAOYSA-N -1 3 353.426 3.666 20 0 FHADHM Cc1cc(CNc2cccc(-c3nnn[n-]3)c2)ccc1Oc1cccnc1 ZINC000826267114 608868826 /nfs/dbraw/zinc/86/88/26/608868826.db2.gz QVZUSCOUCYTRSG-UHFFFAOYSA-N -1 3 358.405 3.975 20 0 FHADHM Cc1cc(CNc2cccc(-c3nn[n-]n3)c2)ccc1Oc1cccnc1 ZINC000826267114 608868827 /nfs/dbraw/zinc/86/88/27/608868827.db2.gz QVZUSCOUCYTRSG-UHFFFAOYSA-N -1 3 358.405 3.975 20 0 FHADHM CC(C)C(=O)Nc1cccc(N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000824185335 609164049 /nfs/dbraw/zinc/16/40/49/609164049.db2.gz WIGASIIUVHMCOW-CYBMUJFWSA-N -1 3 350.426 3.634 20 0 FHADHM CC(C)C(=O)Nc1cccc(N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1 ZINC000824185335 609164051 /nfs/dbraw/zinc/16/40/51/609164051.db2.gz WIGASIIUVHMCOW-CYBMUJFWSA-N -1 3 350.426 3.634 20 0 FHADHM C[C@@H](Nc1ccc(N2CCCCC2)cn1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824656453 609178188 /nfs/dbraw/zinc/17/81/88/609178188.db2.gz KFNISGLDEFMCNU-CYBMUJFWSA-N -1 3 367.432 3.564 20 0 FHADHM C[C@@H](Nc1ccc(N2CCCCC2)cn1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824656453 609178189 /nfs/dbraw/zinc/17/81/89/609178189.db2.gz KFNISGLDEFMCNU-CYBMUJFWSA-N -1 3 367.432 3.564 20 0 FHADHM CCNc1ccc(-c2nn[n-]n2)cc1NCc1csc(C(C)(C)C)n1 ZINC000825481337 609178208 /nfs/dbraw/zinc/17/82/08/609178208.db2.gz XEEAITOOMSAXRN-UHFFFAOYSA-N -1 3 357.487 3.665 20 0 FHADHM C[C@@H](Nc1ccc(N2CCCC2)c(F)c1)c1cccc(-c2nnn[n-]2)c1 ZINC000824656066 609180320 /nfs/dbraw/zinc/18/03/20/609180320.db2.gz HBOPLFACSBSCLZ-CYBMUJFWSA-N -1 3 352.417 3.779 20 0 FHADHM C[C@@H](Nc1ccc(N2CCCC2)c(F)c1)c1cccc(-c2nn[n-]n2)c1 ZINC000824656066 609180321 /nfs/dbraw/zinc/18/03/21/609180321.db2.gz HBOPLFACSBSCLZ-CYBMUJFWSA-N -1 3 352.417 3.779 20 0 FHADHM COc1c(F)cc(N[C@H]2CCCc3cc(-c4nnn[n-]4)ccc32)cc1F ZINC000826167346 609180986 /nfs/dbraw/zinc/18/09/86/609180986.db2.gz ZMZHATXCRJBYJM-INIZCTEOSA-N -1 3 357.364 3.643 20 0 FHADHM COc1c(F)cc(N[C@H]2CCCc3cc(-c4nn[n-]n4)ccc32)cc1F ZINC000826167346 609180987 /nfs/dbraw/zinc/18/09/87/609180987.db2.gz ZMZHATXCRJBYJM-INIZCTEOSA-N -1 3 357.364 3.643 20 0 FHADHM COc1cc(CNc2ccc(Cl)c(-c3nnn[n-]3)c2)ccc1OC(C)C ZINC000826179305 609199684 /nfs/dbraw/zinc/19/96/84/609199684.db2.gz ITKUZRYJGWIPLV-UHFFFAOYSA-N -1 3 373.844 3.928 20 0 FHADHM COc1cc(CNc2ccc(Cl)c(-c3nn[n-]n3)c2)ccc1OC(C)C ZINC000826179305 609199686 /nfs/dbraw/zinc/19/96/86/609199686.db2.gz ITKUZRYJGWIPLV-UHFFFAOYSA-N -1 3 373.844 3.928 20 0 FHADHM Cn1cc(CNc2ccc(Cl)c(-c3nnn[n-]3)c2)c(-c2cccs2)n1 ZINC000826361752 609200125 /nfs/dbraw/zinc/20/01/25/609200125.db2.gz NBOXMNDGYCLJNX-UHFFFAOYSA-N -1 3 371.857 3.594 20 0 FHADHM Cn1cc(CNc2ccc(Cl)c(-c3nn[n-]n3)c2)c(-c2cccs2)n1 ZINC000826361752 609200127 /nfs/dbraw/zinc/20/01/27/609200127.db2.gz NBOXMNDGYCLJNX-UHFFFAOYSA-N -1 3 371.857 3.594 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1)c1cccc(O)c1 ZINC000826455426 609227957 /nfs/dbraw/zinc/22/79/57/609227957.db2.gz NRRLPSBPGUOICZ-UHFFFAOYSA-N -1 3 373.372 3.617 20 0 FHADHM O=C(Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)cc1)c1cccc(O)c1 ZINC000826455426 609227959 /nfs/dbraw/zinc/22/79/59/609227959.db2.gz NRRLPSBPGUOICZ-UHFFFAOYSA-N -1 3 373.372 3.617 20 0 FHADHM C[C@H](Nc1ccc(Br)cc1)c1ccc(-c2nnn[n-]2)c(F)c1 ZINC000824658596 609266765 /nfs/dbraw/zinc/26/67/65/609266765.db2.gz YQBVGJPACMWNAG-VIFPVBQESA-N -1 3 362.206 3.941 20 0 FHADHM C[C@H](Nc1ccc(Br)cc1)c1ccc(-c2nn[n-]n2)c(F)c1 ZINC000824658596 609266767 /nfs/dbraw/zinc/26/67/67/609266767.db2.gz YQBVGJPACMWNAG-VIFPVBQESA-N -1 3 362.206 3.941 20 0 FHADHM Cc1nc2cc(NC(=S)Nc3ccccc3-c3nnn[n-]3)ccc2s1 ZINC000826328932 609274135 /nfs/dbraw/zinc/27/41/35/609274135.db2.gz JPKZSUSBHGEYRK-UHFFFAOYSA-N -1 3 367.463 3.594 20 0 FHADHM Cc1nc2cc(NC(=S)Nc3ccccc3-c3nn[n-]n3)ccc2s1 ZINC000826328932 609274136 /nfs/dbraw/zinc/27/41/36/609274136.db2.gz JPKZSUSBHGEYRK-UHFFFAOYSA-N -1 3 367.463 3.594 20 0 FHADHM c1cnn(-c2cccc(N[C@@H]3CCCc4cc(-c5nnn[n-]5)ccc43)c2)c1 ZINC000826517049 609274445 /nfs/dbraw/zinc/27/44/45/609274445.db2.gz NPBGYXJKYHJBPU-LJQANCHMSA-N -1 3 357.421 3.542 20 0 FHADHM c1cnn(-c2cccc(N[C@@H]3CCCc4cc(-c5nn[n-]n5)ccc43)c2)c1 ZINC000826517049 609274447 /nfs/dbraw/zinc/27/44/47/609274447.db2.gz NPBGYXJKYHJBPU-LJQANCHMSA-N -1 3 357.421 3.542 20 0 FHADHM COc1ccc(OC(F)F)c(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2)c1 ZINC000826211136 609275910 /nfs/dbraw/zinc/27/59/10/609275910.db2.gz QNVBHCGUPDZXPA-SNVBAGLBSA-N -1 3 361.352 3.650 20 0 FHADHM COc1ccc(OC(F)F)c(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2)c1 ZINC000826211136 609275912 /nfs/dbraw/zinc/27/59/12/609275912.db2.gz QNVBHCGUPDZXPA-SNVBAGLBSA-N -1 3 361.352 3.650 20 0 FHADHM Cc1cc(N[C@@H](C)c2cccc(-c3nnn[n-]3)c2)nn1-c1ccc(C)cc1 ZINC000826281291 609281700 /nfs/dbraw/zinc/28/17/00/609281700.db2.gz LRVYRKKHYOULFZ-HNNXBMFYSA-N -1 3 359.437 3.842 20 0 FHADHM Cc1cc(N[C@@H](C)c2cccc(-c3nn[n-]n3)c2)nn1-c1ccc(C)cc1 ZINC000826281291 609281702 /nfs/dbraw/zinc/28/17/02/609281702.db2.gz LRVYRKKHYOULFZ-HNNXBMFYSA-N -1 3 359.437 3.842 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccccc1-c1nnn[n-]1)c1nc(C2CC2)cs1 ZINC000824712953 609283091 /nfs/dbraw/zinc/28/30/91/609283091.db2.gz FQNRUGZWOJSOCX-TYBABMIJSA-N -1 3 367.434 3.518 20 0 FHADHM C[C@@H](OC(=O)C=Cc1ccccc1-c1nn[n-]n1)c1nc(C2CC2)cs1 ZINC000824712953 609283092 /nfs/dbraw/zinc/28/30/92/609283092.db2.gz FQNRUGZWOJSOCX-TYBABMIJSA-N -1 3 367.434 3.518 20 0 FHADHM O=C(c1ccc(Cl)c(-c2nnn[n-]2)c1)N(CC1CC1)C1CCCCC1 ZINC000826472559 609298915 /nfs/dbraw/zinc/29/89/15/609298915.db2.gz OKOUMRKEOFGSKW-UHFFFAOYSA-N -1 3 359.861 3.705 20 0 FHADHM O=C(c1ccc(Cl)c(-c2nn[n-]n2)c1)N(CC1CC1)C1CCCCC1 ZINC000826472559 609298916 /nfs/dbraw/zinc/29/89/16/609298916.db2.gz OKOUMRKEOFGSKW-UHFFFAOYSA-N -1 3 359.861 3.705 20 0 FHADHM CN(Cc1cc2ccccc2o1)C(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1 ZINC000825953928 609301422 /nfs/dbraw/zinc/30/14/22/609301422.db2.gz RTTHLVZYEAISLS-UHFFFAOYSA-N -1 3 367.796 3.539 20 0 FHADHM CN(Cc1cc2ccccc2o1)C(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1 ZINC000825953928 609301423 /nfs/dbraw/zinc/30/14/23/609301423.db2.gz RTTHLVZYEAISLS-UHFFFAOYSA-N -1 3 367.796 3.539 20 0 FHADHM CCCCCNC(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000825276319 609302591 /nfs/dbraw/zinc/30/25/91/609302591.db2.gz VLMFCOTVRUQFDC-UHFFFAOYSA-N -1 3 351.410 3.579 20 0 FHADHM CCCCCNC(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000825276319 609302593 /nfs/dbraw/zinc/30/25/93/609302593.db2.gz VLMFCOTVRUQFDC-UHFFFAOYSA-N -1 3 351.410 3.579 20 0 FHADHM O=C(c1ccccc1Oc1ccccc1-c1nnn[n-]1)N1CCCCCC1 ZINC000826474181 609303775 /nfs/dbraw/zinc/30/37/75/609303775.db2.gz DYJOCWCRINLZNY-UHFFFAOYSA-N -1 3 363.421 3.675 20 0 FHADHM O=C(c1ccccc1Oc1ccccc1-c1nn[n-]n1)N1CCCCCC1 ZINC000826474181 609303776 /nfs/dbraw/zinc/30/37/76/609303776.db2.gz DYJOCWCRINLZNY-UHFFFAOYSA-N -1 3 363.421 3.675 20 0 FHADHM Cc1nnc(SCCc2ccc3ccccc3c2)c(-c2nnn[n-]2)c1C ZINC000826337559 609309195 /nfs/dbraw/zinc/30/91/95/609309195.db2.gz STJSHZRMCJCPHN-UHFFFAOYSA-N -1 3 362.462 3.762 20 0 FHADHM Cc1nnc(SCCc2ccc3ccccc3c2)c(-c2nn[n-]n2)c1C ZINC000826337559 609309197 /nfs/dbraw/zinc/30/91/97/609309197.db2.gz STJSHZRMCJCPHN-UHFFFAOYSA-N -1 3 362.462 3.762 20 0 FHADHM CC(C)[C@H](C)N(C)C(=O)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000824192968 609310822 /nfs/dbraw/zinc/31/08/22/609310822.db2.gz PMZUGANPIXNFSN-AWEZNQCLSA-N -1 3 365.437 3.776 20 0 FHADHM CC(C)[C@H](C)N(C)C(=O)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000824192968 609310823 /nfs/dbraw/zinc/31/08/23/609310823.db2.gz PMZUGANPIXNFSN-AWEZNQCLSA-N -1 3 365.437 3.776 20 0 FHADHM O=C(NCCCC1CC1)c1ccccc1Oc1ccccc1-c1nnn[n-]1 ZINC000826436588 609321485 /nfs/dbraw/zinc/32/14/85/609321485.db2.gz ZJELGPDMZJFDFU-UHFFFAOYSA-N -1 3 363.421 3.579 20 0 FHADHM O=C(NCCCC1CC1)c1ccccc1Oc1ccccc1-c1nn[n-]n1 ZINC000826436588 609321487 /nfs/dbraw/zinc/32/14/87/609321487.db2.gz ZJELGPDMZJFDFU-UHFFFAOYSA-N -1 3 363.421 3.579 20 0 FHADHM COc1cc(Cl)ccc1CN[C@@H](C)c1ccc(-c2nnn[n-]2)cc1F ZINC000826180168 609335090 /nfs/dbraw/zinc/33/50/90/609335090.db2.gz VISHAQIKFMPYAH-JTQLQIEISA-N -1 3 361.808 3.519 20 0 FHADHM COc1cc(Cl)ccc1CN[C@@H](C)c1ccc(-c2nn[n-]n2)cc1F ZINC000826180168 609335092 /nfs/dbraw/zinc/33/50/92/609335092.db2.gz VISHAQIKFMPYAH-JTQLQIEISA-N -1 3 361.808 3.519 20 0 FHADHM Cc1c(NCc2cccc(-c3nnn[n-]3)c2)cnn1-c1cc(C)ccc1C ZINC000826284365 609344388 /nfs/dbraw/zinc/34/43/88/609344388.db2.gz ROOFFVPCLMWWJR-UHFFFAOYSA-N -1 3 359.437 3.590 20 0 FHADHM Cc1c(NCc2cccc(-c3nn[n-]n3)c2)cnn1-c1cc(C)ccc1C ZINC000826284365 609344390 /nfs/dbraw/zinc/34/43/90/609344390.db2.gz ROOFFVPCLMWWJR-UHFFFAOYSA-N -1 3 359.437 3.590 20 0 FHADHM CCC(=O)Nc1ccc(C)c(N[C@@H](C)c2ccc(-c3nnn[n-]3)cc2F)c1 ZINC000825034889 609346049 /nfs/dbraw/zinc/34/60/49/609346049.db2.gz SQIJKNUCWPMOHD-LBPRGKRZSA-N -1 3 368.416 3.836 20 0 FHADHM CCC(=O)Nc1ccc(C)c(N[C@@H](C)c2ccc(-c3nn[n-]n3)cc2F)c1 ZINC000825034889 609346051 /nfs/dbraw/zinc/34/60/51/609346051.db2.gz SQIJKNUCWPMOHD-LBPRGKRZSA-N -1 3 368.416 3.836 20 0 FHADHM CCOc1ccc(OCC)c(N[C@H](C)c2ccc(-c3nnn[n-]3)cc2F)c1 ZINC000825643793 609349429 /nfs/dbraw/zinc/34/94/29/609349429.db2.gz VHQBROSJLQNIAE-GFCCVEGCSA-N -1 3 371.416 3.976 20 0 FHADHM CCOc1ccc(OCC)c(N[C@H](C)c2ccc(-c3nn[n-]n3)cc2F)c1 ZINC000825643793 609349431 /nfs/dbraw/zinc/34/94/31/609349431.db2.gz VHQBROSJLQNIAE-GFCCVEGCSA-N -1 3 371.416 3.976 20 0 FHADHM Brc1cc(-c2nn[n-]n2)ccc1CN1CC[C@@H]1c1ccccc1 ZINC000823821718 609363552 /nfs/dbraw/zinc/36/35/52/609363552.db2.gz YELARGUZXOACEZ-MRXNPFEDSA-N -1 3 370.254 3.576 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)[C@@H]1CCC(C)(C)C1 ZINC000824255776 609377343 /nfs/dbraw/zinc/37/73/43/609377343.db2.gz XKQPCZYCJJIKBL-QGZVFWFLSA-N -1 3 355.486 3.678 20 0 FHADHM CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)[C@@H]1CCC(C)(C)C1 ZINC000824255776 609377345 /nfs/dbraw/zinc/37/73/45/609377345.db2.gz XKQPCZYCJJIKBL-QGZVFWFLSA-N -1 3 355.486 3.678 20 0 FHADHM Cc1ccc(-c2ccc(C(=O)N(C)c3cccc(-c4nnn[n-]4)c3)s2)o1 ZINC000826273836 609378731 /nfs/dbraw/zinc/37/87/31/609378731.db2.gz WLZRDHVRJUXJKX-UHFFFAOYSA-N -1 3 365.418 3.773 20 0 FHADHM Cc1ccc(-c2ccc(C(=O)N(C)c3cccc(-c4nn[n-]n4)c3)s2)o1 ZINC000826273836 609378733 /nfs/dbraw/zinc/37/87/33/609378733.db2.gz WLZRDHVRJUXJKX-UHFFFAOYSA-N -1 3 365.418 3.773 20 0 FHADHM Cc1cccc(Oc2ccc(NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)cc2)c1 ZINC000826300940 609409032 /nfs/dbraw/zinc/40/90/32/609409032.db2.gz MBYORQYCPQYKCS-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM Cc1cccc(Oc2ccc(NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)cc2)c1 ZINC000826300940 609409034 /nfs/dbraw/zinc/40/90/34/609409034.db2.gz MBYORQYCPQYKCS-UHFFFAOYSA-N -1 3 360.377 3.548 20 0 FHADHM CCc1nnc([C@@H](C)Sc2ccc(-c3nnn[n-]3)c(C(F)(F)F)c2)o1 ZINC000825762668 609452725 /nfs/dbraw/zinc/45/27/25/609452725.db2.gz GMZYDBQKPSYNHJ-SSDOTTSWSA-N -1 3 370.360 3.684 20 0 FHADHM CCc1nnc([C@@H](C)Sc2ccc(-c3nn[n-]n3)c(C(F)(F)F)c2)o1 ZINC000825762668 609452728 /nfs/dbraw/zinc/45/27/28/609452728.db2.gz GMZYDBQKPSYNHJ-SSDOTTSWSA-N -1 3 370.360 3.684 20 0 FHADHM Clc1cc2ncc(Oc3ccc(-c4nn[n-]n4)cc3)nc2cc1Cl ZINC000826351553 609455040 /nfs/dbraw/zinc/45/50/40/609455040.db2.gz QXAKRUPLXUGKSQ-UHFFFAOYSA-N -1 3 359.176 3.909 20 0 FHADHM Oc1cccc(CNc2ccc(OCc3cccc(-c4nnn[n-]4)c3)cc2)c1 ZINC000826511669 609485481 /nfs/dbraw/zinc/48/54/81/609485481.db2.gz ZWZBRYBGQWOHCM-UHFFFAOYSA-N -1 3 373.416 3.763 20 0 FHADHM Oc1cccc(CNc2ccc(OCc3cccc(-c4nn[n-]n4)c3)cc2)c1 ZINC000826511669 609485483 /nfs/dbraw/zinc/48/54/83/609485483.db2.gz ZWZBRYBGQWOHCM-UHFFFAOYSA-N -1 3 373.416 3.763 20 0 FHADHM C[C@H](NC(=O)c1ccc(-c2ccccc2)o1)c1cccc(-c2nnn[n-]2)c1 ZINC000824513284 609504040 /nfs/dbraw/zinc/50/40/40/609504040.db2.gz AQJZFKAZUFCEBZ-ZDUSSCGKSA-N -1 3 359.389 3.618 20 0 FHADHM C[C@H](NC(=O)c1ccc(-c2ccccc2)o1)c1cccc(-c2nn[n-]n2)c1 ZINC000824513284 609504041 /nfs/dbraw/zinc/50/40/41/609504041.db2.gz AQJZFKAZUFCEBZ-ZDUSSCGKSA-N -1 3 359.389 3.618 20 0 FHADHM FC(F)Oc1cc(NCc2ccc(-c3nnn[n-]3)cc2)ccc1Cl ZINC000826369740 609513774 /nfs/dbraw/zinc/51/37/74/609513774.db2.gz OYALSPYTQUYJFP-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM FC(F)Oc1cc(NCc2ccc(-c3nn[n-]n3)cc2)ccc1Cl ZINC000826369740 609513776 /nfs/dbraw/zinc/51/37/76/609513776.db2.gz OYALSPYTQUYJFP-UHFFFAOYSA-N -1 3 351.744 3.734 20 0 FHADHM CCOc1ccc([C@@H](C)Nc2nccc(C)c2-c2nnn[n-]2)cc1OCC ZINC000825638291 609519212 /nfs/dbraw/zinc/51/92/12/609519212.db2.gz JANYDVBXKDBYFP-CYBMUJFWSA-N -1 3 368.441 3.541 20 0 FHADHM CCOc1ccc([C@@H](C)Nc2nccc(C)c2-c2nn[n-]n2)cc1OCC ZINC000825638291 609519213 /nfs/dbraw/zinc/51/92/13/609519213.db2.gz JANYDVBXKDBYFP-CYBMUJFWSA-N -1 3 368.441 3.541 20 0 FHADHM CC/C(C)=C(\C)C(=O)Nc1ccc(Oc2cccc(-c3nnn[n-]3)c2)nc1 ZINC000825050094 609527663 /nfs/dbraw/zinc/52/76/63/609527663.db2.gz GSXWMINSWCNCIP-OUKQBFOZSA-N -1 3 364.409 3.739 20 0 FHADHM CC/C(C)=C(\C)C(=O)Nc1ccc(Oc2cccc(-c3nn[n-]n3)c2)nc1 ZINC000825050094 609527664 /nfs/dbraw/zinc/52/76/64/609527664.db2.gz GSXWMINSWCNCIP-OUKQBFOZSA-N -1 3 364.409 3.739 20 0 FHADHM Cc1c(Cl)cnc(NCc2ccccc2COC(C)C)c1-c1nnn[n-]1 ZINC000826240229 609528805 /nfs/dbraw/zinc/52/88/05/609528805.db2.gz JKZLNFPJHYMYHN-UHFFFAOYSA-N -1 3 372.860 3.761 20 0 FHADHM Cc1c(Cl)cnc(NCc2ccccc2COC(C)C)c1-c1nn[n-]n1 ZINC000826240229 609528807 /nfs/dbraw/zinc/52/88/07/609528807.db2.gz JKZLNFPJHYMYHN-UHFFFAOYSA-N -1 3 372.860 3.761 20 0 FHADHM CC/C(C)=C(/C)C(=O)Nc1ccc(Oc2ccc(-c3nn[n-]n3)cc2)nc1 ZINC000825052439 609529959 /nfs/dbraw/zinc/52/99/59/609529959.db2.gz WNHVPFORLJBGRY-SEYXRHQNSA-N -1 3 364.409 3.739 20 0 FHADHM Cc1c(Cl)cnc(N[C@H](C)c2c(F)cccc2F)c1-c1nnn[n-]1 ZINC000826239204 609537324 /nfs/dbraw/zinc/53/73/24/609537324.db2.gz ZWKLYHQEXAQFLN-MRVPVSSYSA-N -1 3 350.760 3.675 20 0 FHADHM Cc1c(Cl)cnc(N[C@H](C)c2c(F)cccc2F)c1-c1nn[n-]n1 ZINC000826239204 609537326 /nfs/dbraw/zinc/53/73/26/609537326.db2.gz ZWKLYHQEXAQFLN-MRVPVSSYSA-N -1 3 350.760 3.675 20 0 FHADHM Cc1c(Cl)cnc(N[C@@H](C)c2c(F)cccc2F)c1-c1nnn[n-]1 ZINC000826239205 609537619 /nfs/dbraw/zinc/53/76/19/609537619.db2.gz ZWKLYHQEXAQFLN-QMMMGPOBSA-N -1 3 350.760 3.675 20 0 FHADHM Cc1c(Cl)cnc(N[C@@H](C)c2c(F)cccc2F)c1-c1nn[n-]n1 ZINC000826239205 609537620 /nfs/dbraw/zinc/53/76/20/609537620.db2.gz ZWKLYHQEXAQFLN-QMMMGPOBSA-N -1 3 350.760 3.675 20 0 FHADHM Cc1c(Cl)cnc(NC[C@H](C)c2nc3ccccc3o2)c1-c1nnn[n-]1 ZINC000826239273 609567173 /nfs/dbraw/zinc/56/71/73/609567173.db2.gz BIGFBGDOJLMUDE-VIFPVBQESA-N -1 3 369.816 3.580 20 0 FHADHM Cc1c(Cl)cnc(NC[C@H](C)c2nc3ccccc3o2)c1-c1nn[n-]n1 ZINC000826239273 609567176 /nfs/dbraw/zinc/56/71/76/609567176.db2.gz BIGFBGDOJLMUDE-VIFPVBQESA-N -1 3 369.816 3.580 20 0 FHADHM C[C@@H]1CC[C@@H](C(F)(F)F)CN1c1ccc2cc(-c3nnn[n-]3)ccc2n1 ZINC000824906695 609575971 /nfs/dbraw/zinc/57/59/71/609575971.db2.gz CWTRFAWZIFAQSN-ZWNOBZJWSA-N -1 3 362.359 3.582 20 0 FHADHM C[C@@H]1CC[C@@H](C(F)(F)F)CN1c1ccc2cc(-c3nn[n-]n3)ccc2n1 ZINC000824906695 609575972 /nfs/dbraw/zinc/57/59/72/609575972.db2.gz CWTRFAWZIFAQSN-ZWNOBZJWSA-N -1 3 362.359 3.582 20 0 FHADHM C[C@H](CN(C)c1ccc(-c2nn[n-]n2)cc1C(F)(F)F)c1nccs1 ZINC000824412832 609606353 /nfs/dbraw/zinc/60/63/53/609606353.db2.gz GOYZVBPCKJLSGP-SECBINFHSA-N -1 3 368.388 3.582 20 0 FHADHM