smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CS(=O)(=O)[N-]c1cc(C(=O)N[C@H]2CCCc3sccc32)ccc1F ZINC000159999534 495860079 /nfs/dbraw/zinc/86/00/79/495860079.db2.gz KZIPKZJHZAILQU-ZDUSSCGKSA-N -1 3 368.455 3.066 20 70 FGIDHM CSc1cc(C(=O)Nc2nnc(-c3ccc(C)o3)[n-]2)ccc1NC(C)=O ZINC000160248907 495917862 /nfs/dbraw/zinc/91/78/62/495917862.db2.gz OFXMWYXMVAOIBK-UHFFFAOYSA-N -1 3 371.422 3.306 20 70 FGIDHM CSc1cc(C(=O)Nc2nc(-c3ccc(C)o3)n[n-]2)ccc1NC(C)=O ZINC000160248907 495917869 /nfs/dbraw/zinc/91/78/69/495917869.db2.gz OFXMWYXMVAOIBK-UHFFFAOYSA-N -1 3 371.422 3.306 20 70 FGIDHM CSc1cc(C(=O)Nc2n[n-]c(-c3ccc(C)o3)n2)ccc1NC(C)=O ZINC000160248907 495917872 /nfs/dbraw/zinc/91/78/72/495917872.db2.gz OFXMWYXMVAOIBK-UHFFFAOYSA-N -1 3 371.422 3.306 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3cnc4c(cnn4CC(C)C)c3)[n-]2)o1 ZINC000160351495 495942244 /nfs/dbraw/zinc/94/22/44/495942244.db2.gz XSWNSKKTVXMMOW-UHFFFAOYSA-N -1 3 365.397 3.026 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3cnc4c(cnn4CC(C)C)c3)n2)o1 ZINC000160351495 495942246 /nfs/dbraw/zinc/94/22/46/495942246.db2.gz XSWNSKKTVXMMOW-UHFFFAOYSA-N -1 3 365.397 3.026 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3cnc4c(cnn4CC(C)C)c3)n[n-]2)o1 ZINC000160351495 495942248 /nfs/dbraw/zinc/94/22/48/495942248.db2.gz XSWNSKKTVXMMOW-UHFFFAOYSA-N -1 3 365.397 3.026 20 70 FGIDHM CCc1noc(C)c1CS(=O)(=O)c1nc(C)c(Cc2ccccc2)[n-]1 ZINC000160382303 495949295 /nfs/dbraw/zinc/94/92/95/495949295.db2.gz PNNFRCMYAQQRKA-UHFFFAOYSA-N -1 3 359.451 3.142 20 70 FGIDHM CCc1noc(C)c1CS(=O)(=O)c1nc(Cc2ccccc2)c(C)[n-]1 ZINC000160382303 495949300 /nfs/dbraw/zinc/94/93/00/495949300.db2.gz PNNFRCMYAQQRKA-UHFFFAOYSA-N -1 3 359.451 3.142 20 70 FGIDHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)c3cc(-c4cccnc4)on3)cc2)n1 ZINC000161171685 496119312 /nfs/dbraw/zinc/11/93/12/496119312.db2.gz ZYMGUAVIILFNRU-UHFFFAOYSA-N -1 3 373.372 3.048 20 70 FGIDHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)c3ccc(Cl)nc3C)cc2)n1 ZINC000161250884 496136709 /nfs/dbraw/zinc/13/67/09/496136709.db2.gz LBBDHMMSWQWQRV-UHFFFAOYSA-N -1 3 354.797 3.354 20 70 FGIDHM CCn1c(=O)c2cc(F)ccc2nc1S[C@H](C)c1nc(C)cc(=O)[n-]1 ZINC000159472994 495740746 /nfs/dbraw/zinc/74/07/46/495740746.db2.gz FYMBORVIGRDVQT-SNVBAGLBSA-N -1 3 360.414 3.213 20 70 FGIDHM O=S(=O)([N-]CCc1ccccc1O)c1ccc(F)cc1C(F)(F)F ZINC000159663106 495780933 /nfs/dbraw/zinc/78/09/33/495780933.db2.gz OBJGHEFUYMQYDN-UHFFFAOYSA-N -1 3 363.332 3.071 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3cccc(NC(=O)NC(C)C)c3)[n-]2)o1 ZINC000160182419 495903494 /nfs/dbraw/zinc/90/34/94/495903494.db2.gz JUOXTKBVHZWBTQ-UHFFFAOYSA-N -1 3 368.397 3.155 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3cccc(NC(=O)NC(C)C)c3)n2)o1 ZINC000160182419 495903498 /nfs/dbraw/zinc/90/34/98/495903498.db2.gz JUOXTKBVHZWBTQ-UHFFFAOYSA-N -1 3 368.397 3.155 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3cccc(NC(=O)NC(C)C)c3)n[n-]2)o1 ZINC000160182419 495903501 /nfs/dbraw/zinc/90/35/01/495903501.db2.gz JUOXTKBVHZWBTQ-UHFFFAOYSA-N -1 3 368.397 3.155 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3ccc(OC4CCOCC4)cc3)[n-]2)o1 ZINC000160296409 495929508 /nfs/dbraw/zinc/92/95/08/495929508.db2.gz VCXCLNKEVNRCCY-UHFFFAOYSA-N -1 3 368.393 3.183 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3ccc(OC4CCOCC4)cc3)n2)o1 ZINC000160296409 495929511 /nfs/dbraw/zinc/92/95/11/495929511.db2.gz VCXCLNKEVNRCCY-UHFFFAOYSA-N -1 3 368.393 3.183 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3ccc(OC4CCOCC4)cc3)n[n-]2)o1 ZINC000160296409 495929514 /nfs/dbraw/zinc/92/95/14/495929514.db2.gz VCXCLNKEVNRCCY-UHFFFAOYSA-N -1 3 368.393 3.183 20 70 FGIDHM COc1ccc(C(=O)Nc2nnc(-c3ccc(C)o3)[n-]2)cc1OC(F)F ZINC000160339134 495940051 /nfs/dbraw/zinc/94/00/51/495940051.db2.gz FUOUZBBTVUOCAO-UHFFFAOYSA-N -1 3 364.308 3.235 20 70 FGIDHM COc1ccc(C(=O)Nc2nc(-c3ccc(C)o3)n[n-]2)cc1OC(F)F ZINC000160339134 495940057 /nfs/dbraw/zinc/94/00/57/495940057.db2.gz FUOUZBBTVUOCAO-UHFFFAOYSA-N -1 3 364.308 3.235 20 70 FGIDHM COc1ccc(C(=O)Nc2n[n-]c(-c3ccc(C)o3)n2)cc1OC(F)F ZINC000160339134 495940061 /nfs/dbraw/zinc/94/00/61/495940061.db2.gz FUOUZBBTVUOCAO-UHFFFAOYSA-N -1 3 364.308 3.235 20 70 FGIDHM Cc1cc(F)cc2c(=O)c(C(=O)N(C)Cc3cc(Cl)cn3C)c[n-]c12 ZINC000160368465 495947339 /nfs/dbraw/zinc/94/73/39/495947339.db2.gz KPAZZVBOKYBHAP-UHFFFAOYSA-N -1 3 361.804 3.240 20 70 FGIDHM CCS(=O)(=O)c1cccc(S(=O)(=O)[N-]c2c(C)cccc2Cl)c1 ZINC000161045457 496092127 /nfs/dbraw/zinc/09/21/27/496092127.db2.gz HQMDBHOEBGZNCB-UHFFFAOYSA-N -1 3 373.883 3.243 20 70 FGIDHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)[C@H](C)Oc3cccc(F)c3)cc2)n1 ZINC000161179594 496121547 /nfs/dbraw/zinc/12/15/47/496121547.db2.gz JAXXIDHUDWJMSF-ZDUSSCGKSA-N -1 3 367.380 3.290 20 70 FGIDHM Cc1cc(Cl)cc(NC(=O)c2ccc(=O)n(-c3ccccc3F)n2)c1[O-] ZINC000159395749 495724291 /nfs/dbraw/zinc/72/42/91/495724291.db2.gz GCKBQBJJOFGCRK-UHFFFAOYSA-N -1 3 373.771 3.291 20 70 FGIDHM Cc1cccc2c(CCC(=O)Nc3ccccc3[N-]S(C)(=O)=O)c[nH]c21 ZINC000159721831 495795000 /nfs/dbraw/zinc/79/50/00/495795000.db2.gz AXEOJIQPFKNOET-UHFFFAOYSA-N -1 3 371.462 3.419 20 70 FGIDHM COc1cc(F)c([C@@H](C)NC(=O)NCc2ccc([O-])c(F)c2)cc1OC ZINC000159977956 495854666 /nfs/dbraw/zinc/85/46/66/495854666.db2.gz HVGCYUHZGOXNCN-SNVBAGLBSA-N -1 3 366.364 3.248 20 70 FGIDHM CC(=O)N1CCCc2ccc(S(=O)(=O)[N-]c3c(C)cccc3F)cc21 ZINC000160812425 496047977 /nfs/dbraw/zinc/04/79/77/496047977.db2.gz CERCRTYBSACMRN-UHFFFAOYSA-N -1 3 362.426 3.234 20 70 FGIDHM CCCn1c(=O)[n-]nc1S(=O)(=O)Cc1ccc(-c2ccccc2)cc1 ZINC000160923461 496067699 /nfs/dbraw/zinc/06/76/99/496067699.db2.gz PWVJYRMTIFRIJO-UHFFFAOYSA-N -1 3 357.435 3.035 20 70 FGIDHM CCCOc1cccc(CCNC(=O)c2cc(NC(C)=O)ccc2[O-])c1 ZINC000159736825 495797505 /nfs/dbraw/zinc/79/75/05/495797505.db2.gz WXXOQCPBXGYJRB-UHFFFAOYSA-N -1 3 356.422 3.112 20 70 FGIDHM CC[C@@H]([N-]S(=O)(=O)c1ccccc1OC(F)(F)F)c1nccs1 ZINC000159918670 495839791 /nfs/dbraw/zinc/83/97/91/495839791.db2.gz DVLMIUBORGSJGQ-SECBINFHSA-N -1 3 366.386 3.471 20 70 FGIDHM O=C(COc1cccc(I)c1)Nc1ccccc1[O-] ZINC000159969803 495853576 /nfs/dbraw/zinc/85/35/76/495853576.db2.gz ZWMRVMAGBUIUIF-UHFFFAOYSA-N -1 3 369.158 3.014 20 70 FGIDHM O=S(=O)(C[C@@H]1CCCCO1)[N-]c1ccc(Br)c(Cl)c1 ZINC000160367079 495946844 /nfs/dbraw/zinc/94/68/44/495946844.db2.gz FTSRXEXDOZPVJM-JTQLQIEISA-N -1 3 368.680 3.413 20 70 FGIDHM O=C(Cc1ccc([O-])cc1Cl)N[C@@H]1CCN(c2ncccc2Cl)C1 ZINC000160382714 495950618 /nfs/dbraw/zinc/95/06/18/495950618.db2.gz ZEGZEOAOIZXKBB-GFCCVEGCSA-N -1 3 366.248 3.032 20 70 FGIDHM CCc1cc(=O)[n-]c(CN(C)Cc2c(C)nn(-c3ccccc3C)c2C)n1 ZINC000160983748 496080036 /nfs/dbraw/zinc/08/00/36/496080036.db2.gz UYHPXTNYMMTEFL-UHFFFAOYSA-N -1 3 365.481 3.488 20 70 FGIDHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)CCOCc3ccccc3)cc2)n1 ZINC000161153590 496115751 /nfs/dbraw/zinc/11/57/51/496115751.db2.gz BBVWFRSFNJEJNB-UHFFFAOYSA-N -1 3 363.417 3.291 20 70 FGIDHM COc1cc(C(=O)Nc2c(C)nn(-c3ccccc3)c2C)cc(OC)c1[O-] ZINC000161191375 496123401 /nfs/dbraw/zinc/12/34/01/496123401.db2.gz IFYXPWBZHMGXOW-UHFFFAOYSA-N -1 3 367.405 3.464 20 70 FGIDHM CCS(=O)(=O)[N-]c1ccc(NC(=O)[C@H]2CCC[C@@H](C)C2)cc1OC ZINC000161234787 496133687 /nfs/dbraw/zinc/13/36/87/496133687.db2.gz NWMWQRXIBMGSPO-OLZOCXBDSA-N -1 3 354.472 3.222 20 70 FGIDHM Cc1cc([N-]C(=O)[C@@H](C)Nc2ccc(OC3CCOCC3)c(C)c2)on1 ZINC000161240688 496136079 /nfs/dbraw/zinc/13/60/79/496136079.db2.gz IOOLZNJFMCTJOF-CQSZACIVSA-N -1 3 359.426 3.288 20 70 FGIDHM Cc1noc([N-]C(=O)c2cc(NC(=O)NC(C)(C)C)ccc2Cl)n1 ZINC000161247210 496137338 /nfs/dbraw/zinc/13/73/38/496137338.db2.gz XIOKDJWRTBCHFB-UHFFFAOYSA-N -1 3 351.794 3.204 20 70 FGIDHM COc1cc(C(=O)Nc2nnc(-c3ccc(C)o3)[n-]2)ccc1OC(F)F ZINC000160432009 495961406 /nfs/dbraw/zinc/96/14/06/495961406.db2.gz SAHSNJBGIPEREK-UHFFFAOYSA-N -1 3 364.308 3.235 20 70 FGIDHM COc1cc(C(=O)Nc2nc(-c3ccc(C)o3)n[n-]2)ccc1OC(F)F ZINC000160432009 495961409 /nfs/dbraw/zinc/96/14/09/495961409.db2.gz SAHSNJBGIPEREK-UHFFFAOYSA-N -1 3 364.308 3.235 20 70 FGIDHM COc1cc(C(=O)Nc2n[n-]c(-c3ccc(C)o3)n2)ccc1OC(F)F ZINC000160432009 495961411 /nfs/dbraw/zinc/96/14/11/495961411.db2.gz SAHSNJBGIPEREK-UHFFFAOYSA-N -1 3 364.308 3.235 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3ccc(N4CCC(C)CC4)nc3)[n-]2)o1 ZINC000160441025 495964213 /nfs/dbraw/zinc/96/42/13/495964213.db2.gz LWZZRRBNMIQZQK-UHFFFAOYSA-N -1 3 366.425 3.257 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3ccc(N4CCC(C)CC4)nc3)n2)o1 ZINC000160441025 495964219 /nfs/dbraw/zinc/96/42/19/495964219.db2.gz LWZZRRBNMIQZQK-UHFFFAOYSA-N -1 3 366.425 3.257 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3ccc(N4CCC(C)CC4)nc3)n[n-]2)o1 ZINC000160441025 495964224 /nfs/dbraw/zinc/96/42/24/495964224.db2.gz LWZZRRBNMIQZQK-UHFFFAOYSA-N -1 3 366.425 3.257 20 70 FGIDHM Cc1cc(F)cc2c(=O)c(C(=O)N3CCO[C@@H](c4ccsc4)C3)c[n-]c12 ZINC000160546878 495989637 /nfs/dbraw/zinc/98/96/37/495989637.db2.gz WKGQHYQUMUECJL-MRXNPFEDSA-N -1 3 372.421 3.251 20 70 FGIDHM O=S(=O)(Cc1c(Cl)cccc1Cl)[N-]C[C@@H](O)Cc1ccccc1 ZINC000161033901 496089676 /nfs/dbraw/zinc/08/96/76/496089676.db2.gz NHWBIEUYSQAUKE-ZDUSSCGKSA-N -1 3 374.289 3.016 20 70 FGIDHM Cc1cccc(Cl)c1[N-]S(=O)(=O)c1cccc(C(=O)N(C)C)c1 ZINC000161051639 496093219 /nfs/dbraw/zinc/09/32/19/496093219.db2.gz PGSSPVCGGHTLHZ-UHFFFAOYSA-N -1 3 352.843 3.151 20 70 FGIDHM Cc1nc(-c2ccc(S(=O)(=O)[N-]C3(C)CCOCC3)s2)cs1 ZINC000161048223 496093607 /nfs/dbraw/zinc/09/36/07/496093607.db2.gz OIWXUONQHFKSLF-UHFFFAOYSA-N -1 3 358.510 3.027 20 70 FGIDHM COc1cc(C(=O)N[C@H](c2ccccc2)c2ccccn2)cc(OC)c1[O-] ZINC000161322372 496153098 /nfs/dbraw/zinc/15/30/98/496153098.db2.gz WBGIJYLJDMOSQB-LJQANCHMSA-N -1 3 364.401 3.324 20 70 FGIDHM COc1cc(C(=O)Nc2ccccc2-n2nc(C)cc2C)cc(OC)c1[O-] ZINC000161470938 496183198 /nfs/dbraw/zinc/18/31/98/496183198.db2.gz NBNLQOKYAYSGQA-UHFFFAOYSA-N -1 3 367.405 3.464 20 70 FGIDHM O=S(=O)([N-][C@H](C[C@H]1CCOC1)c1ccccc1)c1ccc(F)c(F)c1 ZINC000159869800 495829356 /nfs/dbraw/zinc/82/93/56/495829356.db2.gz AWWMGXIMVYPCBZ-FZKQIMNGSA-N -1 3 367.417 3.411 20 70 FGIDHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)C=Cc3ccc(Cl)nc3)cc2)n1 ZINC000160096045 495882536 /nfs/dbraw/zinc/88/25/36/495882536.db2.gz XOAACBBBEHLYJK-YCRREMRBSA-N -1 3 366.808 3.446 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3[nH]c4c(c3C)C(=O)CC(C)(C)C4)[n-]2)o1 ZINC000160435058 495963110 /nfs/dbraw/zinc/96/31/10/495963110.db2.gz VQCGRDGEXVNRBS-UHFFFAOYSA-N -1 3 367.409 3.417 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3[nH]c4c(c3C)C(=O)CC(C)(C)C4)n2)o1 ZINC000160435058 495963114 /nfs/dbraw/zinc/96/31/14/495963114.db2.gz VQCGRDGEXVNRBS-UHFFFAOYSA-N -1 3 367.409 3.417 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3[nH]c4c(c3C)C(=O)CC(C)(C)C4)n[n-]2)o1 ZINC000160435058 495963121 /nfs/dbraw/zinc/96/31/21/495963121.db2.gz VQCGRDGEXVNRBS-UHFFFAOYSA-N -1 3 367.409 3.417 20 70 FGIDHM CSc1cc(C(=O)Nc2ccccc2[N-]S(C)(=O)=O)ccc1F ZINC000161097589 496102162 /nfs/dbraw/zinc/10/21/62/496102162.db2.gz XLUXQMFDYHFKJV-UHFFFAOYSA-N -1 3 354.428 3.171 20 70 FGIDHM CCc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)CCC(=O)N3)cc1CC ZINC000160044430 495871361 /nfs/dbraw/zinc/87/13/61/495871361.db2.gz MGDGGQZPMBPNHT-UHFFFAOYSA-N -1 3 358.463 3.497 20 70 FGIDHM O=C([N-]OCc1cccnc1)C12C[C@H]3C[C@H](CC(Br)(C3)C1)C2 ZINC000160718726 496027510 /nfs/dbraw/zinc/02/75/10/496027510.db2.gz XTTUNLSAOUZJRA-CBHXASLJSA-N -1 3 365.271 3.363 20 70 FGIDHM CN(C)[C@H](CNC(=O)c1ccc(Br)c([O-])c1)c1ccccc1 ZINC000160924749 496068791 /nfs/dbraw/zinc/06/87/91/496068791.db2.gz KWLMHUZHNDFBDO-OAHLLOKOSA-N -1 3 363.255 3.187 20 70 FGIDHM CC1([N-]S(=O)(=O)c2ccc(Cl)cc2C(F)(F)F)CCOCC1 ZINC000161038563 496090842 /nfs/dbraw/zinc/09/08/42/496090842.db2.gz BKXRVSIDLMWMRM-UHFFFAOYSA-N -1 3 357.781 3.206 20 70 FGIDHM CCn1c(=O)c2cc(F)ccc2nc1S[C@@H](C)c1nc(C)cc(=O)[n-]1 ZINC000159472899 495740423 /nfs/dbraw/zinc/74/04/23/495740423.db2.gz FYMBORVIGRDVQT-JTQLQIEISA-N -1 3 360.414 3.213 20 70 FGIDHM CCN(CCc1ccccc1)C(=O)CCc1c(C)nc2cc(=O)[n-]n2c1C ZINC000159913954 495840184 /nfs/dbraw/zinc/84/01/84/495840184.db2.gz KWJZIEFURPVPSS-UHFFFAOYSA-N -1 3 366.465 3.076 20 70 FGIDHM COCCCOc1ccc(C(=O)Nc2nnc(-c3ccc(C)o3)[n-]2)cc1 ZINC000160422761 495959572 /nfs/dbraw/zinc/95/95/72/495959572.db2.gz HWXNCHHEUNMKIG-UHFFFAOYSA-N -1 3 356.382 3.041 20 70 FGIDHM COCCCOc1ccc(C(=O)Nc2nc(-c3ccc(C)o3)n[n-]2)cc1 ZINC000160422761 495959578 /nfs/dbraw/zinc/95/95/78/495959578.db2.gz HWXNCHHEUNMKIG-UHFFFAOYSA-N -1 3 356.382 3.041 20 70 FGIDHM COCCCOc1ccc(C(=O)Nc2n[n-]c(-c3ccc(C)o3)n2)cc1 ZINC000160422761 495959582 /nfs/dbraw/zinc/95/95/82/495959582.db2.gz HWXNCHHEUNMKIG-UHFFFAOYSA-N -1 3 356.382 3.041 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3cccc(Oc4cnccn4)c3)[n-]2)o1 ZINC000160442537 495964340 /nfs/dbraw/zinc/96/43/40/495964340.db2.gz QVAVANSVIZZXJW-UHFFFAOYSA-N -1 3 362.349 3.208 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3cccc(Oc4cnccn4)c3)n2)o1 ZINC000160442537 495964346 /nfs/dbraw/zinc/96/43/46/495964346.db2.gz QVAVANSVIZZXJW-UHFFFAOYSA-N -1 3 362.349 3.208 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3cccc(Oc4cnccn4)c3)n[n-]2)o1 ZINC000160442537 495964354 /nfs/dbraw/zinc/96/43/54/495964354.db2.gz QVAVANSVIZZXJW-UHFFFAOYSA-N -1 3 362.349 3.208 20 70 FGIDHM CC(C)c1cccc(NC(=O)c2cccc([C@@]3(C)NC(=O)[N-]C3=O)c2)c1 ZINC000160979074 496078615 /nfs/dbraw/zinc/07/86/15/496078615.db2.gz ZWGGTKQPLWGGSK-HXUWFJFHSA-N -1 3 351.406 3.117 20 70 FGIDHM COc1ccc(C(=O)Nc2ccc(-c3nc(C)cc(=O)[n-]3)cc2)cc1F ZINC000161198490 496126146 /nfs/dbraw/zinc/12/61/46/496126146.db2.gz DUNXEWVAAMTREJ-UHFFFAOYSA-N -1 3 353.353 3.145 20 70 FGIDHM COc1cc(C(=O)N[C@@H](c2ccccc2)c2ccccn2)cc(OC)c1[O-] ZINC000161322240 496152285 /nfs/dbraw/zinc/15/22/85/496152285.db2.gz WBGIJYLJDMOSQB-IBGZPJMESA-N -1 3 364.401 3.324 20 70 FGIDHM C[C@@H](CSCc1ccccc1)C(=O)Nc1nnc(-c2ccccn2)[n-]1 ZINC000159603603 495767691 /nfs/dbraw/zinc/76/76/91/495767691.db2.gz YPLRILKMKYORKK-ZDUSSCGKSA-N -1 3 353.451 3.375 20 70 FGIDHM C[C@@H](CSCc1ccccc1)C(=O)Nc1nc(-c2ccccn2)n[n-]1 ZINC000159603603 495767694 /nfs/dbraw/zinc/76/76/94/495767694.db2.gz YPLRILKMKYORKK-ZDUSSCGKSA-N -1 3 353.451 3.375 20 70 FGIDHM C[C@@H](CSCc1ccccc1)C(=O)Nc1n[n-]c(-c2ccccn2)n1 ZINC000159603603 495767703 /nfs/dbraw/zinc/76/77/03/495767703.db2.gz YPLRILKMKYORKK-ZDUSSCGKSA-N -1 3 353.451 3.375 20 70 FGIDHM CN(Cc1nc(=O)c2cc(-c3ccccc3)sc2[n-]1)C[C@H]1CCC[C@@H]1O ZINC000159634337 495774731 /nfs/dbraw/zinc/77/47/31/495774731.db2.gz BKIONGFIFRFESA-ZBFHGGJFSA-N -1 3 369.490 3.244 20 70 FGIDHM CCc1ccc(S(=O)(=O)[N-]c2ccc(N3CCNC3=O)cc2)cc1CC ZINC000160014482 495863212 /nfs/dbraw/zinc/86/32/12/495863212.db2.gz LQRBUYYDQKMZQP-UHFFFAOYSA-N -1 3 373.478 3.142 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)COc3ccccc3C(F)(F)F)[n-]2)o1 ZINC000160163584 495899893 /nfs/dbraw/zinc/89/98/93/495899893.db2.gz QLAOZLXNLMHABC-UHFFFAOYSA-N -1 3 366.299 3.409 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)COc3ccccc3C(F)(F)F)n2)o1 ZINC000160163584 495899898 /nfs/dbraw/zinc/89/98/98/495899898.db2.gz QLAOZLXNLMHABC-UHFFFAOYSA-N -1 3 366.299 3.409 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)COc3ccccc3C(F)(F)F)n[n-]2)o1 ZINC000160163584 495899902 /nfs/dbraw/zinc/89/99/02/495899902.db2.gz QLAOZLXNLMHABC-UHFFFAOYSA-N -1 3 366.299 3.409 20 70 FGIDHM CC(=O)N1CCc2cc(S(=O)(=O)[N-]c3c(C)cccc3Cl)ccc21 ZINC000161063065 496095578 /nfs/dbraw/zinc/09/55/78/496095578.db2.gz RDXNKWXUJMAWJP-UHFFFAOYSA-N -1 3 364.854 3.358 20 70 FGIDHM CCS(=O)(=O)[N-]c1ccc(NC(=O)[C@@H]2CCC[C@@H](C)C2)cc1OC ZINC000161234682 496133263 /nfs/dbraw/zinc/13/32/63/496133263.db2.gz NWMWQRXIBMGSPO-CHWSQXEVSA-N -1 3 354.472 3.222 20 70 FGIDHM COc1ccc(C(=O)Nc2ccccc2[O-])cc1I ZINC000159574876 495761920 /nfs/dbraw/zinc/76/19/20/495761920.db2.gz KBNKGKHAJVFODR-UHFFFAOYSA-N -1 3 369.158 3.258 20 70 FGIDHM C[C@@H](c1ccsc1)N1CCN(C(=O)NCc2ccc([O-])c(F)c2)CC1 ZINC000159725385 495794952 /nfs/dbraw/zinc/79/49/52/495794952.db2.gz GQDGKYYPFPBYMN-ZDUSSCGKSA-N -1 3 363.458 3.181 20 70 FGIDHM CCc1cc(=O)[n-]c(CN(C)CC(=O)Nc2ccc(Cl)c(Cl)c2)n1 ZINC000160527656 495983099 /nfs/dbraw/zinc/98/30/99/495983099.db2.gz DYOXRXDIRHKTSX-UHFFFAOYSA-N -1 3 369.252 3.122 20 70 FGIDHM Cc1ccc([O-])c(CN(C)CC(=O)Nc2c(Cl)cccc2Cl)n1 ZINC000161438292 496176364 /nfs/dbraw/zinc/17/63/64/496176364.db2.gz YDJCCDPNGDVVKA-UHFFFAOYSA-N -1 3 354.237 3.473 20 70 FGIDHM Cc1cc(F)cc2c(=O)c(C(=O)N[C@H](C)CNc3ccccc3)c[n-]c12 ZINC000159582463 495762952 /nfs/dbraw/zinc/76/29/52/495762952.db2.gz DLKDZPDAUOWITH-CYBMUJFWSA-N -1 3 353.397 3.206 20 70 FGIDHM O=C(NCC1(CCO)CCC1)c1cc(OCc2ccccc2)ccc1[O-] ZINC000160166231 495899551 /nfs/dbraw/zinc/89/95/51/495899551.db2.gz BWTXRNKFKHYWLG-UHFFFAOYSA-N -1 3 355.434 3.254 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)COc3ccc(F)cc3Cl)[n-]2)o1 ZINC000160329471 495938001 /nfs/dbraw/zinc/93/80/01/495938001.db2.gz OCANBRMMUVRNLF-UHFFFAOYSA-N -1 3 350.737 3.183 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)COc3ccc(F)cc3Cl)n2)o1 ZINC000160329471 495938007 /nfs/dbraw/zinc/93/80/07/495938007.db2.gz OCANBRMMUVRNLF-UHFFFAOYSA-N -1 3 350.737 3.183 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)COc3ccc(F)cc3Cl)n[n-]2)o1 ZINC000160329471 495938014 /nfs/dbraw/zinc/93/80/14/495938014.db2.gz OCANBRMMUVRNLF-UHFFFAOYSA-N -1 3 350.737 3.183 20 70 FGIDHM Cc1nc(C)c(CCC(=O)N2C[C@@H](C)CSc3ccccc32)c(=O)[n-]1 ZINC000159532003 495753728 /nfs/dbraw/zinc/75/37/28/495753728.db2.gz YFUVXBQQGOXYEE-GFCCVEGCSA-N -1 3 357.479 3.094 20 70 FGIDHM O=S(=O)([N-][C@H](C[C@@H]1CCOC1)c1ccccc1)c1ccc(F)c(F)c1 ZINC000159869531 495828754 /nfs/dbraw/zinc/82/87/54/495828754.db2.gz AWWMGXIMVYPCBZ-SCLBCKFNSA-N -1 3 367.417 3.411 20 70 FGIDHM O=C(NCc1ccc([O-])c(F)c1)NC1CCN(Cc2ccsc2)CC1 ZINC000160135860 495892973 /nfs/dbraw/zinc/89/29/73/495892973.db2.gz BTNWFMIQRDUBEI-UHFFFAOYSA-N -1 3 363.458 3.057 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3sccc3Br)[n-]2)o1 ZINC000160266222 495922469 /nfs/dbraw/zinc/92/24/69/495922469.db2.gz IDLWOXNJQZICOT-UHFFFAOYSA-N -1 3 353.201 3.449 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3sccc3Br)n2)o1 ZINC000160266222 495922472 /nfs/dbraw/zinc/92/24/72/495922472.db2.gz IDLWOXNJQZICOT-UHFFFAOYSA-N -1 3 353.201 3.449 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3cc(-c4csc(C)n4)c[nH]3)[n-]2)o1 ZINC000160325851 495936364 /nfs/dbraw/zinc/93/63/64/495936364.db2.gz IKWYAEUJKKBXJX-UHFFFAOYSA-N -1 3 354.395 3.385 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3cc(-c4csc(C)n4)c[nH]3)n2)o1 ZINC000160325851 495936372 /nfs/dbraw/zinc/93/63/72/495936372.db2.gz IKWYAEUJKKBXJX-UHFFFAOYSA-N -1 3 354.395 3.385 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3cc(-c4csc(C)n4)c[nH]3)n[n-]2)o1 ZINC000160325851 495936378 /nfs/dbraw/zinc/93/63/78/495936378.db2.gz IKWYAEUJKKBXJX-UHFFFAOYSA-N -1 3 354.395 3.385 20 70 FGIDHM Cc1nc2c(c(C(F)(F)F)n1)C[C@H](C(=O)Nc1ccccc1[O-])CC2 ZINC000160521153 495981747 /nfs/dbraw/zinc/98/17/47/495981747.db2.gz YMNTZIOUNNEPLG-SNVBAGLBSA-N -1 3 351.328 3.253 20 70 FGIDHM Cn1cc([N-]S(=O)(=O)c2ccc(C(C)(C)C)s2)cc(Cl)c1=O ZINC000160533891 495986126 /nfs/dbraw/zinc/98/61/26/495986126.db2.gz JTYDLFVFQIMTAL-UHFFFAOYSA-N -1 3 360.888 3.199 20 70 FGIDHM COc1cc(C(=O)Nc2ccc(Br)cc2)cc(OC)c1[O-] ZINC000160684179 496019830 /nfs/dbraw/zinc/01/98/30/496019830.db2.gz SVRUHGVZQQVALZ-UHFFFAOYSA-N -1 3 352.184 3.424 20 70 FGIDHM CC[C@H](C(=O)Nc1ccc(-c2nc(C)cc(=O)[n-]2)cc1)c1c(C)noc1C ZINC000161127590 496110092 /nfs/dbraw/zinc/11/00/92/496110092.db2.gz WYOSXHYADCVLOE-INIZCTEOSA-N -1 3 366.421 3.482 20 70 FGIDHM CC[C@@H](C(=O)Nc1ccc(-c2nc(C)cc(=O)[n-]2)cc1)c1c(C)noc1C ZINC000161127727 496110188 /nfs/dbraw/zinc/11/01/88/496110188.db2.gz WYOSXHYADCVLOE-MRXNPFEDSA-N -1 3 366.421 3.482 20 70 FGIDHM COc1cc(C(=O)N(Cc2ccc(F)cc2F)C2CC2)cc(OC)c1[O-] ZINC000161406812 496170192 /nfs/dbraw/zinc/17/01/92/496170192.db2.gz VGDLINSYLUWBML-UHFFFAOYSA-N -1 3 363.360 3.492 20 70 FGIDHM Cc1cc(F)cc2c(=O)c(C(=O)N(C)CCOCc3ccccc3)c[n-]c12 ZINC000159483103 495742719 /nfs/dbraw/zinc/74/27/19/495742719.db2.gz CFMRFBURVVVGEE-UHFFFAOYSA-N -1 3 368.408 3.264 20 70 FGIDHM CN(Cc1nc(=O)c2cc(-c3ccccc3)sc2[n-]1)C[C@@H]1CCC[C@@H]1O ZINC000159634193 495774222 /nfs/dbraw/zinc/77/42/22/495774222.db2.gz BKIONGFIFRFESA-HOCLYGCPSA-N -1 3 369.490 3.244 20 70 FGIDHM COc1ccc2nc([N-]C(=O)c3cc(Cn4cc(C)cn4)on3)sc2c1 ZINC000160652396 496012854 /nfs/dbraw/zinc/01/28/54/496012854.db2.gz DIUBNXCUVUPHRJ-UHFFFAOYSA-N -1 3 369.406 3.098 20 70 FGIDHM Cc1ccc(CN(CCN(C)C)C(=O)c2cc(F)cc(Cl)c2[O-])o1 ZINC000161042215 496091518 /nfs/dbraw/zinc/09/15/18/496091518.db2.gz ZAWJBXBCDTWWIX-UHFFFAOYSA-N -1 3 354.809 3.290 20 70 FGIDHM COc1ccc(OC)c(C(=O)Nc2ccc(-c3nc(C)cc(=O)[n-]3)cc2)c1 ZINC000161200457 496126095 /nfs/dbraw/zinc/12/60/95/496126095.db2.gz JUXIGOVMJAITHT-UHFFFAOYSA-N -1 3 365.389 3.015 20 70 FGIDHM Cc1cccc(C(=O)Nc2ccc3nc(N4CCOCC4)sc3c2)c1[O-] ZINC000217491130 496998340 /nfs/dbraw/zinc/99/83/40/496998340.db2.gz YOZNKYBVWWLXRB-UHFFFAOYSA-N -1 3 369.446 3.399 20 70 FGIDHM O=c1[n-]nc(SCCCSCc2ccccc2)n1C[C@H]1CCCO1 ZINC000159714867 495792690 /nfs/dbraw/zinc/79/26/90/495792690.db2.gz DPVXSOLGJCVJGO-OAHLLOKOSA-N -1 3 365.524 3.166 20 70 FGIDHM COc1ccsc1S(=O)(=O)[N-]c1c(F)cccc1Br ZINC000160094510 495882770 /nfs/dbraw/zinc/88/27/70/495882770.db2.gz XMNKFOLBKIYHQS-UHFFFAOYSA-N -1 3 366.233 3.459 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3cc(C4CC4)nc4onc(C)c43)[n-]2)o1 ZINC000160270117 495923283 /nfs/dbraw/zinc/92/32/83/495923283.db2.gz DKHDKZSZXUYPFV-UHFFFAOYSA-N -1 3 364.365 3.347 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3cc(C4CC4)nc4onc(C)c43)n2)o1 ZINC000160270117 495923288 /nfs/dbraw/zinc/92/32/88/495923288.db2.gz DKHDKZSZXUYPFV-UHFFFAOYSA-N -1 3 364.365 3.347 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3cc(C4CC4)nc4onc(C)c43)n[n-]2)o1 ZINC000160270117 495923295 /nfs/dbraw/zinc/92/32/95/495923295.db2.gz DKHDKZSZXUYPFV-UHFFFAOYSA-N -1 3 364.365 3.347 20 70 FGIDHM C[C@H](Cc1cccc(Cl)c1)C(=O)NCCCNC(=O)c1cccc([O-])c1 ZINC000160280512 495926181 /nfs/dbraw/zinc/92/61/81/495926181.db2.gz WBBQORIRMDHONN-CQSZACIVSA-N -1 3 374.868 3.161 20 70 FGIDHM CCO[C@@H](C)c1nc(CC(=O)Nc2nnc(-c3ccc(C)o3)[n-]2)cs1 ZINC000160312613 495932455 /nfs/dbraw/zinc/93/24/55/495932455.db2.gz OUNALZPXPHDADI-JTQLQIEISA-N -1 3 361.427 3.108 20 70 FGIDHM CCO[C@@H](C)c1nc(CC(=O)Nc2nc(-c3ccc(C)o3)n[n-]2)cs1 ZINC000160312613 495932462 /nfs/dbraw/zinc/93/24/62/495932462.db2.gz OUNALZPXPHDADI-JTQLQIEISA-N -1 3 361.427 3.108 20 70 FGIDHM CCO[C@@H](C)c1nc(CC(=O)Nc2n[n-]c(-c3ccc(C)o3)n2)cs1 ZINC000160312613 495932467 /nfs/dbraw/zinc/93/24/67/495932467.db2.gz OUNALZPXPHDADI-JTQLQIEISA-N -1 3 361.427 3.108 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3ccc(NC(=O)NC(C)C)cc3)[n-]2)o1 ZINC000160373266 495948630 /nfs/dbraw/zinc/94/86/30/495948630.db2.gz SPVSVMLMSXBRAN-UHFFFAOYSA-N -1 3 368.397 3.155 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3ccc(NC(=O)NC(C)C)cc3)n2)o1 ZINC000160373266 495948634 /nfs/dbraw/zinc/94/86/34/495948634.db2.gz SPVSVMLMSXBRAN-UHFFFAOYSA-N -1 3 368.397 3.155 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3ccc(NC(=O)NC(C)C)cc3)n[n-]2)o1 ZINC000160373266 495948640 /nfs/dbraw/zinc/94/86/40/495948640.db2.gz SPVSVMLMSXBRAN-UHFFFAOYSA-N -1 3 368.397 3.155 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3cnn(-c4ccc(Cl)cc4)c3)[n-]2)o1 ZINC000160376995 495949973 /nfs/dbraw/zinc/94/99/73/495949973.db2.gz FNDVVWUYTKSCLY-UHFFFAOYSA-N -1 3 368.784 3.465 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3cnn(-c4ccc(Cl)cc4)c3)n2)o1 ZINC000160376995 495949978 /nfs/dbraw/zinc/94/99/78/495949978.db2.gz FNDVVWUYTKSCLY-UHFFFAOYSA-N -1 3 368.784 3.465 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3cnn(-c4ccc(Cl)cc4)c3)n[n-]2)o1 ZINC000160376995 495949984 /nfs/dbraw/zinc/94/99/84/495949984.db2.gz FNDVVWUYTKSCLY-UHFFFAOYSA-N -1 3 368.784 3.465 20 70 FGIDHM Cc1nc2c(c(C(F)(F)F)n1)C[C@@H](C(=O)Nc1ccccc1[O-])CC2 ZINC000160521278 495982342 /nfs/dbraw/zinc/98/23/42/495982342.db2.gz YMNTZIOUNNEPLG-JTQLQIEISA-N -1 3 351.328 3.253 20 70 FGIDHM [O-]C(=NO[C@H]1CCCCO1)Nc1ccnn1Cc1ccc(Cl)c(F)c1 ZINC000160619929 496005226 /nfs/dbraw/zinc/00/52/26/496005226.db2.gz UPUILNUAABHPKK-HNNXBMFYSA-N -1 3 368.796 3.304 20 70 FGIDHM O=C(Cc1ccc([O-])cc1Cl)N1CCC(c2nnc3ccccn32)CC1 ZINC000161032129 496089103 /nfs/dbraw/zinc/08/91/03/496089103.db2.gz PWMGYEBNEKKVJM-UHFFFAOYSA-N -1 3 370.840 3.037 20 70 FGIDHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)c3cnn(-c4ccccc4)c3)cc2)n1 ZINC000161197147 496124970 /nfs/dbraw/zinc/12/49/70/496124970.db2.gz KSPVSZYDTGDEHN-UHFFFAOYSA-N -1 3 371.400 3.183 20 70 FGIDHM CCS(=O)(=O)[N-]c1ccc(NC(=O)[C@@H]2CCC[C@H](C)C2)cc1OC ZINC000161234455 496133226 /nfs/dbraw/zinc/13/32/26/496133226.db2.gz NWMWQRXIBMGSPO-QWHCGFSZSA-N -1 3 354.472 3.222 20 70 FGIDHM CCS(=O)(=O)[N-]c1ccc(NC(=O)[C@H]2CCC[C@H](C)C2)cc1OC ZINC000161234563 496133552 /nfs/dbraw/zinc/13/35/52/496133552.db2.gz NWMWQRXIBMGSPO-STQMWFEESA-N -1 3 354.472 3.222 20 70 FGIDHM Cc1cc([N-]C(=O)[C@H](C)Nc2ccc(OC3CCOCC3)c(C)c2)on1 ZINC000161240577 496135605 /nfs/dbraw/zinc/13/56/05/496135605.db2.gz IOOLZNJFMCTJOF-AWEZNQCLSA-N -1 3 359.426 3.288 20 70 FGIDHM O=C(NCc1cccc(F)c1)NCc1ccc([O-])c(Br)c1 ZINC000159963415 495850707 /nfs/dbraw/zinc/85/07/07/495850707.db2.gz YUIOCFNWKZOEMI-UHFFFAOYSA-N -1 3 353.191 3.293 20 70 FGIDHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)c3ccc(OC(C)C)nc3)cc2)n1 ZINC000161172209 496119355 /nfs/dbraw/zinc/11/93/55/496119355.db2.gz QZNKKIQOIUQXBU-UHFFFAOYSA-N -1 3 364.405 3.180 20 70 FGIDHM O=S(=O)([N-]Cc1ccc(OCC2CC2)nc1)c1ccc(F)cc1Cl ZINC000159768219 495804954 /nfs/dbraw/zinc/80/49/54/495804954.db2.gz YYEBNMSQKKRKBY-UHFFFAOYSA-N -1 3 370.833 3.141 20 70 FGIDHM O=S(=O)([N-][C@H](C[C@H]1CCOC1)c1ccccc1)c1cc(F)cc(F)c1 ZINC000159797791 495811581 /nfs/dbraw/zinc/81/15/81/495811581.db2.gz BCBOQIRQLIODHA-FZKQIMNGSA-N -1 3 367.417 3.411 20 70 FGIDHM COc1ccsc1S(=O)(=O)[N-][C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000159842255 495822950 /nfs/dbraw/zinc/82/29/50/495822950.db2.gz IQFDHTQHZDZYPG-UKRRQHHQSA-N -1 3 367.492 3.203 20 70 FGIDHM CCc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)NC(=O)[C@H](C)O3)cc1CC ZINC000160004552 495861246 /nfs/dbraw/zinc/86/12/46/495861246.db2.gz SSCDNBYWNHVATC-LBPRGKRZSA-N -1 3 374.462 3.332 20 70 FGIDHM CCc1ccc(S(=O)(=O)[N-]c2ccc(CC(=O)N(C)C)cc2)cc1CC ZINC000160055923 495873825 /nfs/dbraw/zinc/87/38/25/495873825.db2.gz UHKFRGKFGAWRGJ-UHFFFAOYSA-N -1 3 374.506 3.243 20 70 FGIDHM O=C(NCc1ccc([O-])c(F)c1)N[C@@H]1CCCN(c2cccc(F)c2)C1 ZINC000160215342 495911527 /nfs/dbraw/zinc/91/15/27/495911527.db2.gz NACYYYGKQDBYRG-OAHLLOKOSA-N -1 3 361.392 3.139 20 70 FGIDHM CCOC(=O)c1sc2[n-]c(-c3ccc4c(c3)ncn4C)nc(=O)c2c1C ZINC000160322807 495935448 /nfs/dbraw/zinc/93/54/48/495935448.db2.gz ZHBMMZWZDPOTOW-UHFFFAOYSA-N -1 3 368.418 3.023 20 70 FGIDHM COc1cc(C(=O)N(C)Cc2nc3ccccc3s2)cc(OC)c1[O-] ZINC000161067335 496096973 /nfs/dbraw/zinc/09/69/73/496096973.db2.gz WCCVWAIFDDNHOU-UHFFFAOYSA-N -1 3 358.419 3.291 20 70 FGIDHM CC(C)CCC1CCN(C(=O)c2cccc([C@@]3(C)NC(=O)[N-]C3=O)c2)CC1 ZINC000161357296 496159052 /nfs/dbraw/zinc/15/90/52/496159052.db2.gz OPLFJSKSLYKRIR-OAQYLSRUSA-N -1 3 371.481 3.030 20 70 FGIDHM O=S(=O)([N-]C[C@@H](O)C1CCCCC1)c1ccc(F)cc1C(F)(F)F ZINC000159559166 495759545 /nfs/dbraw/zinc/75/95/45/495759545.db2.gz OYPSKFDFFLDJQN-CYBMUJFWSA-N -1 3 369.380 3.064 20 70 FGIDHM Cc1cc(F)cc2c(=O)c(C(=O)N[C@@H](C)CNc3ccccc3)c[n-]c12 ZINC000159582317 495762876 /nfs/dbraw/zinc/76/28/76/495762876.db2.gz DLKDZPDAUOWITH-ZDUSSCGKSA-N -1 3 353.397 3.206 20 70 FGIDHM COc1cc(F)c(S(=O)(=O)[N-][C@@H](C)Cc2ccc(C)s2)cc1OC ZINC000159669150 495783883 /nfs/dbraw/zinc/78/38/83/495783883.db2.gz AIZLHTPFSGUPEY-JTQLQIEISA-N -1 3 373.471 3.122 20 70 FGIDHM CC[C@@H](C)c1ccc([C@@H](NC(=O)C2CC3(C2)NC(=O)[N-]C3=O)C(C)C)cc1 ZINC000159696113 495789268 /nfs/dbraw/zinc/78/92/68/495789268.db2.gz ZDENNAHMQXMBBV-DUJZXKQVSA-N -1 3 371.481 3.002 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3ccc(OC[C@H]4CCCO4)cc3)[n-]2)o1 ZINC000160424011 495958915 /nfs/dbraw/zinc/95/89/15/495958915.db2.gz YLCNXHWDIUMLEJ-OAHLLOKOSA-N -1 3 368.393 3.183 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3ccc(OC[C@H]4CCCO4)cc3)n2)o1 ZINC000160424011 495958920 /nfs/dbraw/zinc/95/89/20/495958920.db2.gz YLCNXHWDIUMLEJ-OAHLLOKOSA-N -1 3 368.393 3.183 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3ccc(OC[C@H]4CCCO4)cc3)n[n-]2)o1 ZINC000160424011 495958926 /nfs/dbraw/zinc/95/89/26/495958926.db2.gz YLCNXHWDIUMLEJ-OAHLLOKOSA-N -1 3 368.393 3.183 20 70 FGIDHM COc1cc(C(=O)Nc2cccc(Br)c2)cc(OC)c1[O-] ZINC000160686261 496019289 /nfs/dbraw/zinc/01/92/89/496019289.db2.gz BNGVXUIVVDUONL-UHFFFAOYSA-N -1 3 352.184 3.424 20 70 FGIDHM CC(=O)Nc1ccc([O-])c(C(=O)NCCc2csc(C(C)(C)C)n2)c1 ZINC000160708551 496024971 /nfs/dbraw/zinc/02/49/71/496024971.db2.gz OLGMYNWHRCUTQN-UHFFFAOYSA-N -1 3 361.467 3.077 20 70 FGIDHM CCCn1c(=O)[n-]nc1S(=O)(=O)Cc1ccccc1Oc1ccccc1 ZINC000160923742 496067797 /nfs/dbraw/zinc/06/77/97/496067797.db2.gz CQXCJQIDQSEZCS-UHFFFAOYSA-N -1 3 373.434 3.160 20 70 FGIDHM O=C(Cc1cccc(I)c1)Nc1ccccc1[O-] ZINC000160953284 496073293 /nfs/dbraw/zinc/07/32/93/496073293.db2.gz JDSHFRXQQCLZCN-UHFFFAOYSA-N -1 3 353.159 3.178 20 70 FGIDHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)c3cc4ccccc4n3C)cc2)n1 ZINC000161157164 496117239 /nfs/dbraw/zinc/11/72/39/496117239.db2.gz BMCXXRWXNYMDAW-UHFFFAOYSA-N -1 3 358.401 3.489 20 70 FGIDHM COc1ccc(F)cc1C(=O)Nc1ccc(-c2nc(C)cc(=O)[n-]2)cc1 ZINC000161187318 496122476 /nfs/dbraw/zinc/12/24/76/496122476.db2.gz NVAZZQFDLKHWRP-UHFFFAOYSA-N -1 3 353.353 3.145 20 70 FGIDHM CCn1c(C)cc(C(=O)Nc2ccc(-c3nc(C)cc(=O)[n-]3)cc2)c1C ZINC000161192510 496123808 /nfs/dbraw/zinc/12/38/08/496123808.db2.gz GERAFHUKTYGZJX-UHFFFAOYSA-N -1 3 350.422 3.436 20 70 FGIDHM Cc1cccc(O[C@H](C)C(=O)Nc2ccc(-c3nc(C)cc(=O)[n-]3)cc2)c1 ZINC000161204482 496126871 /nfs/dbraw/zinc/12/68/71/496126871.db2.gz VOHDOAVHCDVSNW-OAHLLOKOSA-N -1 3 363.417 3.460 20 70 FGIDHM CCc1ccc(CC)c(NC(=O)NCCCNC(=O)c2cccc([O-])c2)c1 ZINC000161479262 496183826 /nfs/dbraw/zinc/18/38/26/496183826.db2.gz VUZCSEPKMSPSQK-UHFFFAOYSA-N -1 3 369.465 3.459 20 70 FGIDHM CCC[C@@H]([N-]S(=O)(=O)c1ccsc1C(=O)OC)c1ccccc1 ZINC000218120717 497000215 /nfs/dbraw/zinc/00/02/15/497000215.db2.gz HTOMGBSYCDWUJM-CYBMUJFWSA-N -1 3 353.465 3.354 20 70 FGIDHM CCC(CC)c1cc(C(=O)Nc2ccccc2[N-]S(C)(=O)=O)on1 ZINC000159720503 495794088 /nfs/dbraw/zinc/79/40/88/495794088.db2.gz NGLUDJUJLCXRHA-UHFFFAOYSA-N -1 3 351.428 3.202 20 70 FGIDHM CC[C@@H]([N-]S(=O)(=O)c1ccc(OC(F)(F)F)cc1)c1nccs1 ZINC000159946384 495848166 /nfs/dbraw/zinc/84/81/66/495848166.db2.gz XJVYURZQOBULQH-LLVKDONJSA-N -1 3 366.386 3.471 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)CCCOCCc3ccccc3)[n-]2)o1 ZINC000160232706 495914014 /nfs/dbraw/zinc/91/40/14/495914014.db2.gz HAABYFRSWSEGOT-UHFFFAOYSA-N -1 3 354.410 3.351 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)CCCOCCc3ccccc3)n2)o1 ZINC000160232706 495914020 /nfs/dbraw/zinc/91/40/20/495914020.db2.gz HAABYFRSWSEGOT-UHFFFAOYSA-N -1 3 354.410 3.351 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)CCCOCCc3ccccc3)n[n-]2)o1 ZINC000160232706 495914025 /nfs/dbraw/zinc/91/40/25/495914025.db2.gz HAABYFRSWSEGOT-UHFFFAOYSA-N -1 3 354.410 3.351 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3cccc(OC[C@H]4CCCO4)c3)[n-]2)o1 ZINC000160322454 495935478 /nfs/dbraw/zinc/93/54/78/495935478.db2.gz HTPRHWXYCVLDQN-OAHLLOKOSA-N -1 3 368.393 3.183 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3cccc(OC[C@H]4CCCO4)c3)n2)o1 ZINC000160322454 495935482 /nfs/dbraw/zinc/93/54/82/495935482.db2.gz HTPRHWXYCVLDQN-OAHLLOKOSA-N -1 3 368.393 3.183 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3cccc(OC[C@H]4CCCO4)c3)n[n-]2)o1 ZINC000160322454 495935486 /nfs/dbraw/zinc/93/54/86/495935486.db2.gz HTPRHWXYCVLDQN-OAHLLOKOSA-N -1 3 368.393 3.183 20 70 FGIDHM Cc1cccc(C(=O)Nc2cccc(S(=O)(=O)NC(C)(C)C)c2)c1[O-] ZINC000218103052 496999970 /nfs/dbraw/zinc/99/99/70/496999970.db2.gz JINLVQXMCMUUNJ-UHFFFAOYSA-N -1 3 362.451 3.030 20 70 FGIDHM Cc1nc(-c2ccc(S(=O)(=O)[N-]Cc3ccncc3)s2)cs1 ZINC000159538671 495754753 /nfs/dbraw/zinc/75/47/53/495754753.db2.gz UDIRUBDGOXSNFU-UHFFFAOYSA-N -1 3 351.478 3.054 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3ccc(NC(=O)[C@@H]4C[C@@H]4C)cc3)[n-]2)o1 ZINC000160201532 495907377 /nfs/dbraw/zinc/90/73/77/495907377.db2.gz FFCPPGLFTFPVJE-IINYFYTJSA-N -1 3 365.393 3.220 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3ccc(NC(=O)[C@@H]4C[C@@H]4C)cc3)n2)o1 ZINC000160201532 495907381 /nfs/dbraw/zinc/90/73/81/495907381.db2.gz FFCPPGLFTFPVJE-IINYFYTJSA-N -1 3 365.393 3.220 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3ccc(NC(=O)[C@@H]4C[C@@H]4C)cc3)n[n-]2)o1 ZINC000160201532 495907385 /nfs/dbraw/zinc/90/73/85/495907385.db2.gz FFCPPGLFTFPVJE-IINYFYTJSA-N -1 3 365.393 3.220 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3cccc(NC(=O)[C@H]4C[C@@H]4C)c3)[n-]2)o1 ZINC000160251784 495919000 /nfs/dbraw/zinc/91/90/00/495919000.db2.gz FFEYCNRBVBZKAL-HZMBPMFUSA-N -1 3 365.393 3.220 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3cccc(NC(=O)[C@H]4C[C@@H]4C)c3)n2)o1 ZINC000160251784 495919005 /nfs/dbraw/zinc/91/90/05/495919005.db2.gz FFEYCNRBVBZKAL-HZMBPMFUSA-N -1 3 365.393 3.220 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3cccc(NC(=O)[C@H]4C[C@@H]4C)c3)n[n-]2)o1 ZINC000160251784 495919008 /nfs/dbraw/zinc/91/90/08/495919008.db2.gz FFEYCNRBVBZKAL-HZMBPMFUSA-N -1 3 365.393 3.220 20 70 FGIDHM [O-]C(=NO[C@@H]1CCCCO1)Nc1ccnn1Cc1ccc(Cl)c(F)c1 ZINC000160619808 496005175 /nfs/dbraw/zinc/00/51/75/496005175.db2.gz UPUILNUAABHPKK-OAHLLOKOSA-N -1 3 368.796 3.304 20 70 FGIDHM CCc1cc(=O)[n-]c(CN2CCC(C(=O)c3ccc(Cl)cc3)CC2)n1 ZINC000160975653 496077447 /nfs/dbraw/zinc/07/74/47/496077447.db2.gz LAMMOUGOQAVIHY-UHFFFAOYSA-N -1 3 359.857 3.493 20 70 FGIDHM CC(C)c1cccc(NC(=O)c2cccc([C@]3(C)NC(=O)[N-]C3=O)c2)c1 ZINC000160979186 496079207 /nfs/dbraw/zinc/07/92/07/496079207.db2.gz ZWGGTKQPLWGGSK-FQEVSTJZSA-N -1 3 351.406 3.117 20 70 FGIDHM Cc1cccc(O[C@@H](C)C(=O)Nc2ccc(-c3nc(C)cc(=O)[n-]3)cc2)c1 ZINC000161204372 496126749 /nfs/dbraw/zinc/12/67/49/496126749.db2.gz VOHDOAVHCDVSNW-HNNXBMFYSA-N -1 3 363.417 3.460 20 70 FGIDHM COc1ccsc1S(=O)(=O)[N-][C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000159842118 495823032 /nfs/dbraw/zinc/82/30/32/495823032.db2.gz IQFDHTQHZDZYPG-HIFRSBDPSA-N -1 3 367.492 3.203 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3ccc(Br)s3)[n-]2)o1 ZINC000160240298 495916089 /nfs/dbraw/zinc/91/60/89/495916089.db2.gz XAOUTNAYKYJLBS-UHFFFAOYSA-N -1 3 353.201 3.449 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3ccc(Br)s3)n2)o1 ZINC000160240298 495916094 /nfs/dbraw/zinc/91/60/94/495916094.db2.gz XAOUTNAYKYJLBS-UHFFFAOYSA-N -1 3 353.201 3.449 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3ccc(Br)s3)n[n-]2)o1 ZINC000160240298 495916098 /nfs/dbraw/zinc/91/60/98/495916098.db2.gz XAOUTNAYKYJLBS-UHFFFAOYSA-N -1 3 353.201 3.449 20 70 FGIDHM CCCn1c(=O)[n-]nc1S[C@H]1CCN(c2ccc(Cl)c(F)c2)C1=O ZINC000160458768 495968176 /nfs/dbraw/zinc/96/81/76/495968176.db2.gz HENKXXJMHPMDOW-LBPRGKRZSA-N -1 3 370.837 3.084 20 70 FGIDHM CCOc1ccc(S(=O)(=O)[N-]c2ccnc(C)c2)cc1Br ZINC000160630869 496007151 /nfs/dbraw/zinc/00/71/51/496007151.db2.gz JQVCYLSCKTZMFD-UHFFFAOYSA-N -1 3 371.256 3.352 20 70 FGIDHM Cc1ccc(OCCCC(=O)Nc2nnc(-c3ccccn3)[n-]2)c(C)c1 ZINC000160885669 496061137 /nfs/dbraw/zinc/06/11/37/496061137.db2.gz WONRHXOMIJKOMT-UHFFFAOYSA-N -1 3 351.410 3.281 20 70 FGIDHM Cc1ccc(OCCCC(=O)Nc2nc(-c3ccccn3)n[n-]2)c(C)c1 ZINC000160885669 496061138 /nfs/dbraw/zinc/06/11/38/496061138.db2.gz WONRHXOMIJKOMT-UHFFFAOYSA-N -1 3 351.410 3.281 20 70 FGIDHM Cc1ccc(OCCCC(=O)Nc2n[n-]c(-c3ccccn3)n2)c(C)c1 ZINC000160885669 496061139 /nfs/dbraw/zinc/06/11/39/496061139.db2.gz WONRHXOMIJKOMT-UHFFFAOYSA-N -1 3 351.410 3.281 20 70 FGIDHM CCC(CC)(CC)CNC(=O)N1CCN(C(=O)c2cccc([O-])c2)CC1 ZINC000159803940 495813588 /nfs/dbraw/zinc/81/35/88/495813588.db2.gz UQDCBPJTAQPPHI-UHFFFAOYSA-N -1 3 361.486 3.076 20 70 FGIDHM CCc1ccc(S(=O)(=O)[N-]c2ccc(Cn3cncn3)cc2)cc1CC ZINC000160044986 495870548 /nfs/dbraw/zinc/87/05/48/495870548.db2.gz WXILKLTVWBCSHJ-UHFFFAOYSA-N -1 3 370.478 3.252 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3ccc(NC(=O)[C@H]4C[C@@H]4C)cc3)[n-]2)o1 ZINC000160201676 495907983 /nfs/dbraw/zinc/90/79/83/495907983.db2.gz FFCPPGLFTFPVJE-HZMBPMFUSA-N -1 3 365.393 3.220 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3ccc(NC(=O)[C@H]4C[C@@H]4C)cc3)n2)o1 ZINC000160201676 495907989 /nfs/dbraw/zinc/90/79/89/495907989.db2.gz FFCPPGLFTFPVJE-HZMBPMFUSA-N -1 3 365.393 3.220 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3ccc(NC(=O)[C@H]4C[C@@H]4C)cc3)n[n-]2)o1 ZINC000160201676 495907994 /nfs/dbraw/zinc/90/79/94/495907994.db2.gz FFCPPGLFTFPVJE-HZMBPMFUSA-N -1 3 365.393 3.220 20 70 FGIDHM C[C@@H](Cc1ccc(Cl)cc1)C(=O)NCCCNC(=O)c1cccc([O-])c1 ZINC000160280123 495925865 /nfs/dbraw/zinc/92/58/65/495925865.db2.gz ICINYDQEULAIDR-AWEZNQCLSA-N -1 3 374.868 3.161 20 70 FGIDHM CN(Cc1cc(Br)cn1C)C(=O)Cc1ccc([O-])cc1Cl ZINC000160616350 496003449 /nfs/dbraw/zinc/00/34/49/496003449.db2.gz OWUDTXYLSSNWMO-UHFFFAOYSA-N -1 3 371.662 3.348 20 70 FGIDHM CCC(=O)c1cccc(NC(=O)[C@@H]2CCCN2C(=O)c2ccccc2[O-])c1 ZINC000160744221 496033240 /nfs/dbraw/zinc/03/32/40/496033240.db2.gz JYTAMICEJYGWOB-KRWDZBQOSA-N -1 3 366.417 3.228 20 70 FGIDHM CC(C)Sc1ccccc1NC(=O)C[N-]S(=O)(=O)c1cccs1 ZINC000160912117 496065569 /nfs/dbraw/zinc/06/55/69/496065569.db2.gz XOUCCWFWZLKYFJ-UHFFFAOYSA-N -1 3 370.521 3.166 20 70 FGIDHM CCS(=O)(=O)c1ccc(S(=O)(=O)[N-]c2c(C)cccc2Cl)cc1 ZINC000161049239 496093627 /nfs/dbraw/zinc/09/36/27/496093627.db2.gz AKGQRJYMWUZJOH-UHFFFAOYSA-N -1 3 373.883 3.243 20 70 FGIDHM O=C(Cc1ccc([O-])cc1Cl)N1CCC[C@H]1c1nnc2n1CCCCC2 ZINC000161390113 496165850 /nfs/dbraw/zinc/16/58/50/496165850.db2.gz JEYSNTPHPCZMOJ-INIZCTEOSA-N -1 3 374.872 3.270 20 70 FGIDHM CC[C@H](C)c1ccc([C@@H](NC(=O)C2CC3(C2)NC(=O)[N-]C3=O)C(C)C)cc1 ZINC000159696241 495789066 /nfs/dbraw/zinc/78/90/66/495789066.db2.gz ZDENNAHMQXMBBV-BLNXHDMLSA-N -1 3 371.481 3.002 20 70 FGIDHM COc1cc(F)c([C@H](C)NC(=O)NCc2ccc([O-])c(F)c2)cc1OC ZINC000159977822 495854461 /nfs/dbraw/zinc/85/44/61/495854461.db2.gz HVGCYUHZGOXNCN-JTQLQIEISA-N -1 3 366.364 3.248 20 70 FGIDHM COc1ccc2[nH]cc(CC(=O)Nc3nnc(-c4ccc(C)o4)[n-]3)c2c1 ZINC000160164276 495899642 /nfs/dbraw/zinc/89/96/42/495899642.db2.gz IWNZFFMEZDPEKJ-UHFFFAOYSA-N -1 3 351.366 3.044 20 70 FGIDHM COc1ccc2[nH]cc(CC(=O)Nc3nc(-c4ccc(C)o4)n[n-]3)c2c1 ZINC000160164276 495899645 /nfs/dbraw/zinc/89/96/45/495899645.db2.gz IWNZFFMEZDPEKJ-UHFFFAOYSA-N -1 3 351.366 3.044 20 70 FGIDHM COc1ccc2[nH]cc(CC(=O)Nc3n[n-]c(-c4ccc(C)o4)n3)c2c1 ZINC000160164276 495899647 /nfs/dbraw/zinc/89/96/47/495899647.db2.gz IWNZFFMEZDPEKJ-UHFFFAOYSA-N -1 3 351.366 3.044 20 70 FGIDHM CN(CCOCC1CC1)Cc1cccc([N-]S(=O)(=O)c2ccccc2)c1 ZINC000160420456 495959638 /nfs/dbraw/zinc/95/96/38/495959638.db2.gz GGCOIZHEMGZINA-UHFFFAOYSA-N -1 3 374.506 3.346 20 70 FGIDHM Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1ccccc1[N-]S(C)(=O)=O ZINC000160541509 495988300 /nfs/dbraw/zinc/98/83/00/495988300.db2.gz PCTKSWMMBNGQLI-RYUDHWBXSA-N -1 3 350.465 3.170 20 70 FGIDHM CCc1cc(=O)[n-]c(CN[C@@H](C(=O)Nc2ccccc2)c2ccccc2)n1 ZINC000160901878 496064317 /nfs/dbraw/zinc/06/43/17/496064317.db2.gz QXLBBXSSDVBYOB-HXUWFJFHSA-N -1 3 362.433 3.214 20 70 FGIDHM O=S(=O)(Cc1ccc(F)cc1F)[N-]c1c(F)c(F)cc(F)c1F ZINC000161008901 496084111 /nfs/dbraw/zinc/08/41/11/496084111.db2.gz IQOPCIMGEOVTPN-UHFFFAOYSA-N -1 3 355.259 3.463 20 70 FGIDHM CCN(CC)C(=O)c1sccc1S(=O)(=O)[N-]C1CCCCCC1 ZINC000159569428 495760583 /nfs/dbraw/zinc/76/05/83/495760583.db2.gz UFFJHVQOACWWTN-UHFFFAOYSA-N -1 3 358.529 3.231 20 70 FGIDHM CS(=O)(=O)[N-]c1ccccc1NC(=O)[C@@H]1C[C@H]1c1cc(F)ccc1F ZINC000159721601 495794625 /nfs/dbraw/zinc/79/46/25/495794625.db2.gz PLMQJGFZCQHJRT-WCQYABFASA-N -1 3 366.389 3.079 20 70 FGIDHM CS(=O)(=O)[N-]c1cc(C(=O)N[C@@H]2CCCc3sccc32)ccc1F ZINC000159999391 495859437 /nfs/dbraw/zinc/85/94/37/495859437.db2.gz KZIPKZJHZAILQU-CYBMUJFWSA-N -1 3 368.455 3.066 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3ccn(-c4cccc(Cl)c4)n3)[n-]2)o1 ZINC000160267323 495923351 /nfs/dbraw/zinc/92/33/51/495923351.db2.gz LDCFYNYVEBYLKV-UHFFFAOYSA-N -1 3 368.784 3.465 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3ccn(-c4cccc(Cl)c4)n3)n2)o1 ZINC000160267323 495923356 /nfs/dbraw/zinc/92/33/56/495923356.db2.gz LDCFYNYVEBYLKV-UHFFFAOYSA-N -1 3 368.784 3.465 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3ccn(-c4cccc(Cl)c4)n3)n[n-]2)o1 ZINC000160267323 495923363 /nfs/dbraw/zinc/92/33/63/495923363.db2.gz LDCFYNYVEBYLKV-UHFFFAOYSA-N -1 3 368.784 3.465 20 70 FGIDHM COc1cccc(-c2nc(C)c(C(=O)NCc3ccc([O-])c(F)c3)[nH]2)c1 ZINC000160313395 495932333 /nfs/dbraw/zinc/93/23/33/495932333.db2.gz KZTOXJLYGHTHMF-UHFFFAOYSA-N -1 3 355.369 3.168 20 70 FGIDHM Cc1ccsc1[C@@H]1C[C@H]1C(=O)Nc1ccccc1[N-]S(C)(=O)=O ZINC000160541623 495988042 /nfs/dbraw/zinc/98/80/42/495988042.db2.gz PCTKSWMMBNGQLI-VXGBXAGGSA-N -1 3 350.465 3.170 20 70 FGIDHM CCC(=O)c1cccc(NC(=O)CCNC(=O)c2ccc(C)cc2[O-])c1 ZINC000160754408 496035951 /nfs/dbraw/zinc/03/59/51/496035951.db2.gz ASOINIMEEVRBRH-UHFFFAOYSA-N -1 3 354.406 3.052 20 70 FGIDHM CC1([N-]S(=O)(=O)c2cc(C(F)(F)F)ccc2Cl)CCOCC1 ZINC000161011455 496084076 /nfs/dbraw/zinc/08/40/76/496084076.db2.gz GYJWXAMSPHDFAT-UHFFFAOYSA-N -1 3 357.781 3.206 20 70 FGIDHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)c3cc(F)cc4nc[nH]c43)cc2)n1 ZINC000161162442 496118141 /nfs/dbraw/zinc/11/81/41/496118141.db2.gz BJFLBUOVQLQOCO-UHFFFAOYSA-N -1 3 363.352 3.013 20 70 FGIDHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)c3cc(F)cc4[nH]cnc43)cc2)n1 ZINC000161162442 496118145 /nfs/dbraw/zinc/11/81/45/496118145.db2.gz BJFLBUOVQLQOCO-UHFFFAOYSA-N -1 3 363.352 3.013 20 70 FGIDHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)CCOc3ccccc3F)cc2)n1 ZINC000161207778 496127299 /nfs/dbraw/zinc/12/72/99/496127299.db2.gz KUHXQAHBTZFORS-UHFFFAOYSA-N -1 3 367.380 3.292 20 70 FGIDHM CC[C@H](C)c1ccc([C@H](NC(=O)C2CC3(C2)NC(=O)[N-]C3=O)C(C)C)cc1 ZINC000159695998 495789930 /nfs/dbraw/zinc/78/99/30/495789930.db2.gz ZDENNAHMQXMBBV-XPWDIBGMSA-N -1 3 371.481 3.002 20 70 FGIDHM O=S(=O)(Cc1c(Cl)cccc1Cl)[N-]CC1(O)CCCCC1 ZINC000159806030 495813189 /nfs/dbraw/zinc/81/31/89/495813189.db2.gz DYPYJXNSQBBEDO-UHFFFAOYSA-N -1 3 352.283 3.108 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)CCc3cnn(-c4ccccc4)c3)[n-]2)o1 ZINC000160182709 495903251 /nfs/dbraw/zinc/90/32/51/495903251.db2.gz YUDHUWVVOAPUOU-UHFFFAOYSA-N -1 3 362.393 3.130 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)CCc3cnn(-c4ccccc4)c3)n2)o1 ZINC000160182709 495903254 /nfs/dbraw/zinc/90/32/54/495903254.db2.gz YUDHUWVVOAPUOU-UHFFFAOYSA-N -1 3 362.393 3.130 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)CCc3cnn(-c4ccccc4)c3)n[n-]2)o1 ZINC000160182709 495903262 /nfs/dbraw/zinc/90/32/62/495903262.db2.gz YUDHUWVVOAPUOU-UHFFFAOYSA-N -1 3 362.393 3.130 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3sc(-c4ccccn4)nc3C)[n-]2)o1 ZINC000160255746 495920403 /nfs/dbraw/zinc/92/04/03/495920403.db2.gz CWTGMWJYQQKGCC-UHFFFAOYSA-N -1 3 366.406 3.452 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3sc(-c4ccccn4)nc3C)n2)o1 ZINC000160255746 495920408 /nfs/dbraw/zinc/92/04/08/495920408.db2.gz CWTGMWJYQQKGCC-UHFFFAOYSA-N -1 3 366.406 3.452 20 70 FGIDHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)CCOc3ccc(F)cc3)cc2)n1 ZINC000161179342 496121600 /nfs/dbraw/zinc/12/16/00/496121600.db2.gz MNQGTSLAYITRTO-UHFFFAOYSA-N -1 3 367.380 3.292 20 70 FGIDHM [O-]C(=NO[C@@H]1CCCCO1)Nc1c(F)cc(Br)cc1F ZINC000161226749 496132166 /nfs/dbraw/zinc/13/21/66/496132166.db2.gz VDSVBZZUEBZNOP-SNVBAGLBSA-N -1 3 351.147 3.307 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)CCCc3nc4ccccc4[nH]3)[n-]2)o1 ZINC000160217724 495911745 /nfs/dbraw/zinc/91/17/45/495911745.db2.gz JHLRZTKUVURSBX-UHFFFAOYSA-N -1 3 350.382 3.211 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)CCCc3nc4ccccc4[nH]3)n2)o1 ZINC000160217724 495911752 /nfs/dbraw/zinc/91/17/52/495911752.db2.gz JHLRZTKUVURSBX-UHFFFAOYSA-N -1 3 350.382 3.211 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)CCCc3nc4ccccc4[nH]3)n[n-]2)o1 ZINC000160217724 495911759 /nfs/dbraw/zinc/91/17/59/495911759.db2.gz JHLRZTKUVURSBX-UHFFFAOYSA-N -1 3 350.382 3.211 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3cc(C)n(-c4nccs4)c3C)[n-]2)o1 ZINC000160248494 495917649 /nfs/dbraw/zinc/91/76/49/495917649.db2.gz PFANIYWRHPZCPI-UHFFFAOYSA-N -1 3 368.422 3.489 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3cc(C)n(-c4nccs4)c3C)n2)o1 ZINC000160248494 495917653 /nfs/dbraw/zinc/91/76/53/495917653.db2.gz PFANIYWRHPZCPI-UHFFFAOYSA-N -1 3 368.422 3.489 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3cc(C)n(-c4nccs4)c3C)n[n-]2)o1 ZINC000160248494 495917660 /nfs/dbraw/zinc/91/76/60/495917660.db2.gz PFANIYWRHPZCPI-UHFFFAOYSA-N -1 3 368.422 3.489 20 70 FGIDHM Cc1cc(C)n(-c2ccc(C(=O)Nc3nnc(-c4ccc(C)o4)[n-]3)cc2)n1 ZINC000160362579 495946209 /nfs/dbraw/zinc/94/62/09/495946209.db2.gz PFAGABGEQAHYOH-UHFFFAOYSA-N -1 3 362.393 3.428 20 70 FGIDHM Cc1cc(C)n(-c2ccc(C(=O)Nc3nc(-c4ccc(C)o4)n[n-]3)cc2)n1 ZINC000160362579 495946211 /nfs/dbraw/zinc/94/62/11/495946211.db2.gz PFAGABGEQAHYOH-UHFFFAOYSA-N -1 3 362.393 3.428 20 70 FGIDHM Cc1cc(C)n(-c2ccc(C(=O)Nc3n[n-]c(-c4ccc(C)o4)n3)cc2)n1 ZINC000160362579 495946214 /nfs/dbraw/zinc/94/62/14/495946214.db2.gz PFAGABGEQAHYOH-UHFFFAOYSA-N -1 3 362.393 3.428 20 70 FGIDHM COC(=O)c1cccc2nc(NC(=O)Cc3c(Cl)cccc3OC)[n-]c21 ZINC000160784540 496042204 /nfs/dbraw/zinc/04/22/04/496042204.db2.gz FBEPRJDBBADZNY-UHFFFAOYSA-N -1 3 373.796 3.193 20 70 FGIDHM COC(=O)c1cccc2[n-]c(NC(=O)Cc3c(Cl)cccc3OC)nc21 ZINC000160784540 496042206 /nfs/dbraw/zinc/04/22/06/496042206.db2.gz FBEPRJDBBADZNY-UHFFFAOYSA-N -1 3 373.796 3.193 20 70 FGIDHM COc1cccc2c1CC[C@@H]2NC(=O)c1c[n-]c2c(C)cc(F)cc2c1=O ZINC000161369984 496161006 /nfs/dbraw/zinc/16/10/06/496161006.db2.gz HFVAOFOKGLRKAX-KRWDZBQOSA-N -1 3 366.392 3.402 20 70 FGIDHM Cc1cccc(C(=O)N2CCN(CCOc3ccccc3Cl)CC2)c1[O-] ZINC000217605711 496999222 /nfs/dbraw/zinc/99/92/22/496999222.db2.gz UIGQAFUPFDEVRK-UHFFFAOYSA-N -1 3 374.868 3.191 20 70 FGIDHM Cc1ccc([O-])c(C(=O)Nc2cccc(S(=O)(=O)NC(C)(C)C)c2)c1 ZINC000218102950 497000599 /nfs/dbraw/zinc/00/05/99/497000599.db2.gz QLDCCAAPRYLYRE-UHFFFAOYSA-N -1 3 362.451 3.030 20 70 FGIDHM COc1ccc(-c2cc(C(=O)[N-]c3nnc(C(F)(F)F)s3)n[nH]2)cc1 ZINC000160128298 495891246 /nfs/dbraw/zinc/89/12/46/495891246.db2.gz YJMSLRKXBWPTBX-UHFFFAOYSA-N -1 3 369.328 3.208 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3cccc(OC[C@@H]4CCCO4)c3)[n-]2)o1 ZINC000160322341 495934610 /nfs/dbraw/zinc/93/46/10/495934610.db2.gz HTPRHWXYCVLDQN-HNNXBMFYSA-N -1 3 368.393 3.183 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3cccc(OC[C@@H]4CCCO4)c3)n2)o1 ZINC000160322341 495934613 /nfs/dbraw/zinc/93/46/13/495934613.db2.gz HTPRHWXYCVLDQN-HNNXBMFYSA-N -1 3 368.393 3.183 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3cccc(OC[C@@H]4CCCO4)c3)n[n-]2)o1 ZINC000160322341 495934619 /nfs/dbraw/zinc/93/46/19/495934619.db2.gz HTPRHWXYCVLDQN-HNNXBMFYSA-N -1 3 368.393 3.183 20 70 FGIDHM CC[C@@H](CC(=O)Nc1nnc(-c2ccccn2)[n-]1)c1ccc(OC)cc1 ZINC000160544752 495988529 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O=C(CCCOc1ccc2c(c1)CCC2)Nc1nc(-c2ccccn2)n[n-]1 ZINC000160881932 496059856 /nfs/dbraw/zinc/05/98/56/496059856.db2.gz IJWQZGAWQRHJLD-UHFFFAOYSA-N -1 3 363.421 3.153 20 70 FGIDHM O=C(CCCOc1ccc2c(c1)CCC2)Nc1n[n-]c(-c2ccccn2)n1 ZINC000160881932 496059859 /nfs/dbraw/zinc/05/98/59/496059859.db2.gz IJWQZGAWQRHJLD-UHFFFAOYSA-N -1 3 363.421 3.153 20 70 FGIDHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)Cn3ccc4ccccc43)cc2)n1 ZINC000161154397 496115741 /nfs/dbraw/zinc/11/57/41/496115741.db2.gz QQRGTSSLWILAEC-UHFFFAOYSA-N -1 3 358.401 3.339 20 70 FGIDHM COC(=O)c1ccc(F)c([N-]C(=O)c2csc([C@@H]3CCCO3)n2)c1 ZINC000161502803 496187425 /nfs/dbraw/zinc/18/74/25/496187425.db2.gz BGXXBVTWIOEDCC-ZDUSSCGKSA-N -1 3 350.371 3.173 20 70 FGIDHM Cc1noc(Cl)c1CCC(=O)Nc1ccc(-c2nc(C)cc(=O)[n-]2)cc1 ZINC000161145118 567870087 /nfs/dbraw/zinc/87/00/87/567870087.db2.gz IWBGVCFJLLTHDT-UHFFFAOYSA-N -1 3 372.812 3.266 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3ccc(N4CCC(C)=N4)cc3)[n-]2)o1 ZINC000160164134 495899963 /nfs/dbraw/zinc/89/99/63/495899963.db2.gz NHTLQVMFQBANIR-UHFFFAOYSA-N -1 3 350.382 3.211 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3ccc(N4CCC(C)=N4)cc3)n2)o1 ZINC000160164134 495899968 /nfs/dbraw/zinc/89/99/68/495899968.db2.gz NHTLQVMFQBANIR-UHFFFAOYSA-N -1 3 350.382 3.211 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3ccc(N4CCC(C)=N4)cc3)n[n-]2)o1 ZINC000160164134 495899973 /nfs/dbraw/zinc/89/99/73/495899973.db2.gz NHTLQVMFQBANIR-UHFFFAOYSA-N -1 3 350.382 3.211 20 70 FGIDHM CCOc1ccc(C(=O)Nc2nnc(-c3ccc(C)o3)[n-]2)cc1OCC ZINC000160224880 495912392 /nfs/dbraw/zinc/91/23/92/495912392.db2.gz UGXSRGMHIYXIPL-UHFFFAOYSA-N -1 3 356.382 3.423 20 70 FGIDHM CCOc1ccc(C(=O)Nc2nc(-c3ccc(C)o3)n[n-]2)cc1OCC ZINC000160224880 495912397 /nfs/dbraw/zinc/91/23/97/495912397.db2.gz UGXSRGMHIYXIPL-UHFFFAOYSA-N -1 3 356.382 3.423 20 70 FGIDHM CCOc1ccc(C(=O)Nc2n[n-]c(-c3ccc(C)o3)n2)cc1OCC ZINC000160224880 495912400 /nfs/dbraw/zinc/91/24/00/495912400.db2.gz UGXSRGMHIYXIPL-UHFFFAOYSA-N -1 3 356.382 3.423 20 70 FGIDHM CCC(=O)c1cccc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2[O-])c1 ZINC000160744363 496033530 /nfs/dbraw/zinc/03/35/30/496033530.db2.gz JYTAMICEJYGWOB-QGZVFWFLSA-N -1 3 366.417 3.228 20 70 FGIDHM O=C(CCCOc1ccc2c(c1)CCC2)Nc1nnc(C(F)(F)F)[n-]1 ZINC000160802848 496045853 /nfs/dbraw/zinc/04/58/53/496045853.db2.gz WPLNBOBXMBRBAT-UHFFFAOYSA-N -1 3 354.332 3.110 20 70 FGIDHM O=C(CCCOc1ccc2c(c1)CCC2)Nc1nc(C(F)(F)F)n[n-]1 ZINC000160802848 496045859 /nfs/dbraw/zinc/04/58/59/496045859.db2.gz WPLNBOBXMBRBAT-UHFFFAOYSA-N -1 3 354.332 3.110 20 70 FGIDHM COC(=O)c1ccc(Cl)c([N-]S(=O)(=O)Cc2cccc(F)c2)c1 ZINC000160905496 496064715 /nfs/dbraw/zinc/06/47/15/496064715.db2.gz BUGHYDXDAUPGFR-UHFFFAOYSA-N -1 3 357.790 3.208 20 70 FGIDHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)c3coc(Br)c3)cc2)n1 ZINC000161180127 496121719 /nfs/dbraw/zinc/12/17/19/496121719.db2.gz HHXCUIOIEHYCMD-UHFFFAOYSA-N -1 3 374.194 3.353 20 70 FGIDHM COc1cccc(CCC(=O)Nc2ccc(-c3nc(C)cc(=O)[n-]3)cc2)c1 ZINC000161192368 496123551 /nfs/dbraw/zinc/12/35/51/496123551.db2.gz NYMGMXATYSGOOC-UHFFFAOYSA-N -1 3 363.417 3.325 20 70 FGIDHM CCC[C@H]([N-]S(=O)(=O)c1ccsc1C(=O)OC)c1ccccc1 ZINC000218120798 497000367 /nfs/dbraw/zinc/00/03/67/497000367.db2.gz HTOMGBSYCDWUJM-ZDUSSCGKSA-N -1 3 353.465 3.354 20 70 FGIDHM COc1cc(F)c(S(=O)(=O)[N-][C@H](C)Cc2ccc(C)s2)cc1OC ZINC000159669001 495783229 /nfs/dbraw/zinc/78/32/29/495783229.db2.gz AIZLHTPFSGUPEY-SNVBAGLBSA-N -1 3 373.471 3.122 20 70 FGIDHM Cc1nc(-c2ccc(S(=O)(=O)[N-]CC3(O)CCCCC3)s2)cs1 ZINC000159809476 495814577 /nfs/dbraw/zinc/81/45/77/495814577.db2.gz YANBROZKUFSKKV-UHFFFAOYSA-N -1 3 372.537 3.154 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3cnc4onc(C(C)C)c4c3)[n-]2)o1 ZINC000160165600 495899294 /nfs/dbraw/zinc/89/92/94/495899294.db2.gz IBAGSWXLDKASGM-UHFFFAOYSA-N -1 3 352.354 3.285 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3cnc4onc(C(C)C)c4c3)n2)o1 ZINC000160165600 495899298 /nfs/dbraw/zinc/89/92/98/495899298.db2.gz IBAGSWXLDKASGM-UHFFFAOYSA-N -1 3 352.354 3.285 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3cnc4onc(C(C)C)c4c3)n[n-]2)o1 ZINC000160165600 495899304 /nfs/dbraw/zinc/89/93/04/495899304.db2.gz IBAGSWXLDKASGM-UHFFFAOYSA-N -1 3 352.354 3.285 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3cccc(Nc4cnccn4)c3)[n-]2)o1 ZINC000160175452 495902437 /nfs/dbraw/zinc/90/24/37/495902437.db2.gz ZWGPDPAVOVPONY-UHFFFAOYSA-N -1 3 361.365 3.159 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3cccc(Nc4cnccn4)c3)n2)o1 ZINC000160175452 495902439 /nfs/dbraw/zinc/90/24/39/495902439.db2.gz ZWGPDPAVOVPONY-UHFFFAOYSA-N -1 3 361.365 3.159 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3cccc(Nc4cnccn4)c3)n[n-]2)o1 ZINC000160175452 495902441 /nfs/dbraw/zinc/90/24/41/495902441.db2.gz ZWGPDPAVOVPONY-UHFFFAOYSA-N -1 3 361.365 3.159 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3ccc4c(c3)NC(=O)[C@@H](C)S4)[n-]2)o1 ZINC000160189319 495904707 /nfs/dbraw/zinc/90/47/07/495904707.db2.gz RGOWYSZVCCFJCI-SECBINFHSA-N -1 3 369.406 3.058 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3ccc4c(c3)NC(=O)[C@@H](C)S4)n2)o1 ZINC000160189319 495904711 /nfs/dbraw/zinc/90/47/11/495904711.db2.gz RGOWYSZVCCFJCI-SECBINFHSA-N -1 3 369.406 3.058 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3ccc4c(c3)NC(=O)[C@@H](C)S4)n[n-]2)o1 ZINC000160189319 495904716 /nfs/dbraw/zinc/90/47/16/495904716.db2.gz RGOWYSZVCCFJCI-SECBINFHSA-N -1 3 369.406 3.058 20 70 FGIDHM CCc1ccc(S(=O)(=O)[N-]c2ccc(C(C)(C)C(N)=O)cc2)cc1CC ZINC000160217448 495912116 /nfs/dbraw/zinc/91/21/16/495912116.db2.gz NEUDBHWCKFZNLO-UHFFFAOYSA-N -1 3 374.506 3.375 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3cc(C)nc4c3cnn4C(C)C)[n-]2)o1 ZINC000160236855 495914762 /nfs/dbraw/zinc/91/47/62/495914762.db2.gz YIKCQGSURRRCMM-UHFFFAOYSA-N -1 3 365.397 3.259 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3cc(C)nc4c3cnn4C(C)C)n2)o1 ZINC000160236855 495914766 /nfs/dbraw/zinc/91/47/66/495914766.db2.gz YIKCQGSURRRCMM-UHFFFAOYSA-N -1 3 365.397 3.259 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3cc(C)nc4c3cnn4C(C)C)n[n-]2)o1 ZINC000160236855 495914773 /nfs/dbraw/zinc/91/47/73/495914773.db2.gz YIKCQGSURRRCMM-UHFFFAOYSA-N -1 3 365.397 3.259 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3oc(Br)cc3C)[n-]2)o1 ZINC000160303864 495930762 /nfs/dbraw/zinc/93/07/62/495930762.db2.gz XSGXDQJDLVYIGY-UHFFFAOYSA-N -1 3 351.160 3.289 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3oc(Br)cc3C)n2)o1 ZINC000160303864 495930764 /nfs/dbraw/zinc/93/07/64/495930764.db2.gz XSGXDQJDLVYIGY-UHFFFAOYSA-N -1 3 351.160 3.289 20 70 FGIDHM Cc1cc(F)cc2c(=O)c(C(=O)N(C)[C@@H](C)Cc3ccc(O)cc3)c[n-]c12 ZINC000160487073 495973672 /nfs/dbraw/zinc/97/36/72/495973672.db2.gz VGVNDIBFVKOMND-ZDUSSCGKSA-N -1 3 368.408 3.384 20 70 FGIDHM Cc1cc(F)cc2c(=O)c(C(=O)N(C)[C@H](C)Cc3ccc(O)cc3)c[n-]c12 ZINC000160487176 495974336 /nfs/dbraw/zinc/97/43/36/495974336.db2.gz VGVNDIBFVKOMND-CYBMUJFWSA-N -1 3 368.408 3.384 20 70 FGIDHM COc1ccc(CCC(=O)[N-]OCc2cccnc2)cc1Br ZINC000160747798 496034814 /nfs/dbraw/zinc/03/48/14/496034814.db2.gz QWLYNSRVUVNXIV-UHFFFAOYSA-N -1 3 365.227 3.033 20 70 FGIDHM CCCCN(CC(F)(F)F)C(=O)c1ccc(F)c([N-]S(C)(=O)=O)c1 ZINC000160913353 496066884 /nfs/dbraw/zinc/06/68/84/496066884.db2.gz GVMSSIWQCQYMIU-UHFFFAOYSA-N -1 3 370.368 3.002 20 70 FGIDHM Cc1ccc(/C=C/CC(=O)N2CCN(C(=O)c3ccc([O-])cc3)CC2)cc1 ZINC000159801330 495811631 /nfs/dbraw/zinc/81/16/31/495811631.db2.gz HDDOMZODZGNWBV-NSCUHMNNSA-N -1 3 364.445 3.089 20 70 FGIDHM CC[C@H]([N-]S(=O)(=O)c1ccc(C(=O)OC)cc1Cl)c1nccs1 ZINC000159930554 495844307 /nfs/dbraw/zinc/84/43/07/495844307.db2.gz XAHVXINJOFHQJC-NSHDSACASA-N -1 3 374.871 3.013 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3cccc(NC(=O)[C@H]4C[C@H]4C)c3)[n-]2)o1 ZINC000160252043 495918575 /nfs/dbraw/zinc/91/85/75/495918575.db2.gz FFEYCNRBVBZKAL-YGRLFVJLSA-N -1 3 365.393 3.220 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3cccc(NC(=O)[C@H]4C[C@H]4C)c3)n2)o1 ZINC000160252043 495918580 /nfs/dbraw/zinc/91/85/80/495918580.db2.gz FFEYCNRBVBZKAL-YGRLFVJLSA-N -1 3 365.393 3.220 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3cccc(NC(=O)[C@H]4C[C@H]4C)c3)n[n-]2)o1 ZINC000160252043 495918583 /nfs/dbraw/zinc/91/85/83/495918583.db2.gz FFEYCNRBVBZKAL-YGRLFVJLSA-N -1 3 365.393 3.220 20 70 FGIDHM CCOc1cc(CN(C)Cc2nc(CC)cc(=O)[n-]2)ccc1OC(F)F ZINC000160794875 496043395 /nfs/dbraw/zinc/04/33/95/496043395.db2.gz XSPFHVOFFKCICQ-UHFFFAOYSA-N -1 3 367.396 3.377 20 70 FGIDHM [O-]C(=NO[C@H]1CCCCO1)Nc1c(F)cc(Br)cc1F ZINC000161226859 496132240 /nfs/dbraw/zinc/13/22/40/496132240.db2.gz VDSVBZZUEBZNOP-JTQLQIEISA-N -1 3 351.147 3.307 20 70 FGIDHM Cc1nc(-c2ccc(S(=O)(=O)[N-][C@H]3CC[C@@H](CO)CC3)s2)cs1 ZINC000161359085 496160029 /nfs/dbraw/zinc/16/00/29/496160029.db2.gz FDGLDLMGVNAGHK-HAQNSBGRSA-N -1 3 372.537 3.009 20 70 FGIDHM CCCCc1ccc(NC(=O)C(=O)[N-]c2sccc2C(=O)OC)cc1 ZINC000159552540 495758542 /nfs/dbraw/zinc/75/85/42/495758542.db2.gz QATCSUDPADIOGV-UHFFFAOYSA-N -1 3 360.435 3.455 20 70 FGIDHM CN(Cc1nc(=O)c2c(-c3ccccc3)csc2[n-]1)C[C@@H]1CCC[C@@H]1O ZINC000159763659 495803338 /nfs/dbraw/zinc/80/33/38/495803338.db2.gz RITSNXJBQUMPPQ-HOCLYGCPSA-N -1 3 369.490 3.244 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3cccc(NC(=O)[C@@H]4C[C@H]4C)c3)[n-]2)o1 ZINC000160251912 495918868 /nfs/dbraw/zinc/91/88/68/495918868.db2.gz FFEYCNRBVBZKAL-QMTHXVAHSA-N -1 3 365.393 3.220 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3cccc(NC(=O)[C@@H]4C[C@H]4C)c3)n2)o1 ZINC000160251912 495918873 /nfs/dbraw/zinc/91/88/73/495918873.db2.gz FFEYCNRBVBZKAL-QMTHXVAHSA-N -1 3 365.393 3.220 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3cccc(NC(=O)[C@@H]4C[C@H]4C)c3)n[n-]2)o1 ZINC000160251912 495918877 /nfs/dbraw/zinc/91/88/77/495918877.db2.gz FFEYCNRBVBZKAL-QMTHXVAHSA-N -1 3 365.393 3.220 20 70 FGIDHM CCCN(CCC)C(=O)CCCC(=O)Nc1nnc(-c2ccc(C)o2)[n-]1 ZINC000160299291 495929346 /nfs/dbraw/zinc/92/93/46/495929346.db2.gz LSADMQJYZLMPQN-UHFFFAOYSA-N -1 3 361.446 3.131 20 70 FGIDHM CCCN(CCC)C(=O)CCCC(=O)Nc1nc(-c2ccc(C)o2)n[n-]1 ZINC000160299291 495929349 /nfs/dbraw/zinc/92/93/49/495929349.db2.gz LSADMQJYZLMPQN-UHFFFAOYSA-N -1 3 361.446 3.131 20 70 FGIDHM CCCN(CCC)C(=O)CCCC(=O)Nc1n[n-]c(-c2ccc(C)o2)n1 ZINC000160299291 495929353 /nfs/dbraw/zinc/92/93/53/495929353.db2.gz LSADMQJYZLMPQN-UHFFFAOYSA-N -1 3 361.446 3.131 20 70 FGIDHM Cc1cc(=O)[n-]c(-c2cccc(NC(=O)c3c(F)cc(F)cc3F)c2)n1 ZINC000160692452 496022416 /nfs/dbraw/zinc/02/24/16/496022416.db2.gz DJYVSQWQRBEYDK-UHFFFAOYSA-N -1 3 359.307 3.415 20 70 FGIDHM C[N-]S(=O)(=O)c1cc(C(=O)Nc2ccccc2SC(C)C)c(C)o1 ZINC000160891574 496062196 /nfs/dbraw/zinc/06/21/96/496062196.db2.gz BTACZPOPYUCKLK-UHFFFAOYSA-N -1 3 368.480 3.249 20 70 FGIDHM Cc1cc(F)cc2c(=O)c(C(=O)N3CCC(OC(C)(C)C)CC3)c[n-]c12 ZINC000160924416 496067948 /nfs/dbraw/zinc/06/79/48/496067948.db2.gz JKLKWXYAILJYCN-UHFFFAOYSA-N -1 3 360.429 3.395 20 70 FGIDHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)c3ccc(N(C)C)cc3F)cc2)n1 ZINC000161252030 496138373 /nfs/dbraw/zinc/13/83/73/496138373.db2.gz UUAOQVVEXCRJSJ-UHFFFAOYSA-N -1 3 366.396 3.203 20 70 FGIDHM Cc1nc(C)c(CC(=O)N(CCc2ccccc2)c2ccccc2)c(=O)[n-]1 ZINC000161329911 496153867 /nfs/dbraw/zinc/15/38/67/496153867.db2.gz KEUHNEYJQQDXSO-UHFFFAOYSA-N -1 3 361.445 3.205 20 70 FGIDHM CCCOc1cccc(CCNC(=O)c2c[n-]c3ccccc3c2=O)c1 ZINC000159716036 495792975 /nfs/dbraw/zinc/79/29/75/495792975.db2.gz METRLEVKFOWZJR-UHFFFAOYSA-N -1 3 350.418 3.289 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3cnn(Cc4ccccc4)c3C)[n-]2)o1 ZINC000160338992 495940720 /nfs/dbraw/zinc/94/07/20/495940720.db2.gz RGCCPAORTQNKCH-UHFFFAOYSA-N -1 3 362.393 3.179 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3cnn(Cc4ccccc4)c3C)n2)o1 ZINC000160338992 495940727 /nfs/dbraw/zinc/94/07/27/495940727.db2.gz RGCCPAORTQNKCH-UHFFFAOYSA-N -1 3 362.393 3.179 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3cnn(Cc4ccccc4)c3C)n[n-]2)o1 ZINC000160338992 495940731 /nfs/dbraw/zinc/94/07/31/495940731.db2.gz RGCCPAORTQNKCH-UHFFFAOYSA-N -1 3 362.393 3.179 20 70 FGIDHM CCCN(CC(=O)Nc1ccc(F)c(F)c1F)Cc1nc(C)ccc1[O-] ZINC000160744294 496033231 /nfs/dbraw/zinc/03/32/31/496033231.db2.gz JNNXETGALILIFV-UHFFFAOYSA-N -1 3 367.371 3.364 20 70 FGIDHM CC(=O)N1c2ccc(S(=O)(=O)[N-]c3c(C)cccc3F)cc2C[C@@H]1C ZINC000160809188 496046746 /nfs/dbraw/zinc/04/67/46/496046746.db2.gz IQUACJZKEGFMGN-LBPRGKRZSA-N -1 3 362.426 3.232 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3ccn(-c4c(F)cccc4F)n3)[n-]2)o1 ZINC000160364856 495945748 /nfs/dbraw/zinc/94/57/48/495945748.db2.gz XVYHZGPIGLLQQA-UHFFFAOYSA-N -1 3 370.319 3.089 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3ccn(-c4c(F)cccc4F)n3)n2)o1 ZINC000160364856 495945752 /nfs/dbraw/zinc/94/57/52/495945752.db2.gz XVYHZGPIGLLQQA-UHFFFAOYSA-N -1 3 370.319 3.089 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3ccn(-c4c(F)cccc4F)n3)n[n-]2)o1 ZINC000160364856 495945759 /nfs/dbraw/zinc/94/57/59/495945759.db2.gz XVYHZGPIGLLQQA-UHFFFAOYSA-N -1 3 370.319 3.089 20 70 FGIDHM COc1cc(C)ccc1CNC(=O)c1c[n-]c2c(C)cc(F)cc2c1=O ZINC000160366696 495947123 /nfs/dbraw/zinc/94/71/23/495947123.db2.gz MTXZTNDCMAUKDJ-UHFFFAOYSA-N -1 3 354.381 3.223 20 70 FGIDHM CCN(c1ccc(C(=O)Nc2nnc(-c3ccc(C)o3)[n-]2)cn1)C(C)C ZINC000160390023 495952164 /nfs/dbraw/zinc/95/21/64/495952164.db2.gz JVFPDIKRFBXVDH-UHFFFAOYSA-N -1 3 354.414 3.255 20 70 FGIDHM CCN(c1ccc(C(=O)Nc2nc(-c3ccc(C)o3)n[n-]2)cn1)C(C)C ZINC000160390023 495952170 /nfs/dbraw/zinc/95/21/70/495952170.db2.gz JVFPDIKRFBXVDH-UHFFFAOYSA-N -1 3 354.414 3.255 20 70 FGIDHM CCN(c1ccc(C(=O)Nc2n[n-]c(-c3ccc(C)o3)n2)cn1)C(C)C ZINC000160390023 495952177 /nfs/dbraw/zinc/95/21/77/495952177.db2.gz JVFPDIKRFBXVDH-UHFFFAOYSA-N -1 3 354.414 3.255 20 70 FGIDHM COc1cc(C(=O)N(C)Cc2ccccc2N2CCCC2)cc(OC)c1[O-] ZINC000161148469 496115041 /nfs/dbraw/zinc/11/50/41/496115041.db2.gz QPNBJBCGLVPDJI-UHFFFAOYSA-N -1 3 370.449 3.282 20 70 FGIDHM COc1ccc([O-])c(C(=O)NCCc2ccc(Br)s2)c1 ZINC000218313899 497001097 /nfs/dbraw/zinc/00/10/97/497001097.db2.gz PPUXGPVSZDQNER-UHFFFAOYSA-N -1 3 356.241 3.197 20 70 FGIDHM O=C(Nc1ccccc1N1CCC(CO)CC1)c1cc(-c2ccco2)[n-]n1 ZINC000160298870 495929376 /nfs/dbraw/zinc/92/93/76/495929376.db2.gz MYQUPSKUUYWULR-UHFFFAOYSA-N -1 3 366.421 3.131 20 70 FGIDHM O=C(Nc1ccccc1N1CCC(CO)CC1)c1cc(-c2ccco2)n[n-]1 ZINC000160298870 495929378 /nfs/dbraw/zinc/92/93/78/495929378.db2.gz MYQUPSKUUYWULR-UHFFFAOYSA-N -1 3 366.421 3.131 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3ccc(C(=O)c4cc[nH]c4)cc3)[n-]2)o1 ZINC000160384439 495950655 /nfs/dbraw/zinc/95/06/55/495950655.db2.gz MLCKAIOJGSXLRM-UHFFFAOYSA-N -1 3 361.361 3.185 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3ccc(C(=O)c4cc[nH]c4)cc3)n2)o1 ZINC000160384439 495950662 /nfs/dbraw/zinc/95/06/62/495950662.db2.gz MLCKAIOJGSXLRM-UHFFFAOYSA-N -1 3 361.361 3.185 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3ccc(C(=O)c4cc[nH]c4)cc3)n[n-]2)o1 ZINC000160384439 495950665 /nfs/dbraw/zinc/95/06/65/495950665.db2.gz MLCKAIOJGSXLRM-UHFFFAOYSA-N -1 3 361.361 3.185 20 70 FGIDHM O=C(CSc1nccc2ccccc21)Nc1nnc(C(F)(F)F)[n-]1 ZINC000160805069 496045633 /nfs/dbraw/zinc/04/56/33/496045633.db2.gz GYJNEZBGKAZNBV-UHFFFAOYSA-N -1 3 353.329 3.103 20 70 FGIDHM O=C(CSc1nccc2ccccc21)Nc1nc(C(F)(F)F)n[n-]1 ZINC000160805069 496045635 /nfs/dbraw/zinc/04/56/35/496045635.db2.gz GYJNEZBGKAZNBV-UHFFFAOYSA-N -1 3 353.329 3.103 20 70 FGIDHM CC(=O)N(C)c1ccc(S(=O)(=O)[N-]c2c(C)cccc2Cl)cc1 ZINC000161061747 496095795 /nfs/dbraw/zinc/09/57/95/496095795.db2.gz QSJWUFYELMWYKD-UHFFFAOYSA-N -1 3 352.843 3.432 20 70 FGIDHM C[C@H](CSCc1ccccc1)C(=O)Nc1nnc(-c2ccccn2)[n-]1 ZINC000159603722 495767754 /nfs/dbraw/zinc/76/77/54/495767754.db2.gz YPLRILKMKYORKK-CYBMUJFWSA-N -1 3 353.451 3.375 20 70 FGIDHM C[C@H](CSCc1ccccc1)C(=O)Nc1nc(-c2ccccn2)n[n-]1 ZINC000159603722 495767761 /nfs/dbraw/zinc/76/77/61/495767761.db2.gz YPLRILKMKYORKK-CYBMUJFWSA-N -1 3 353.451 3.375 20 70 FGIDHM C[C@H](CSCc1ccccc1)C(=O)Nc1n[n-]c(-c2ccccn2)n1 ZINC000159603722 495767768 /nfs/dbraw/zinc/76/77/68/495767768.db2.gz YPLRILKMKYORKK-CYBMUJFWSA-N -1 3 353.451 3.375 20 70 FGIDHM Cc1cc2cc(NC(=O)NCCCNC(=O)c3cccc([O-])c3)ccc2[nH]1 ZINC000159652920 495778493 /nfs/dbraw/zinc/77/84/93/495778493.db2.gz CKYXYCNNTZVCKU-UHFFFAOYSA-N -1 3 366.421 3.124 20 70 FGIDHM O=S(=O)([N-]CCc1ccccc1O)c1cc(C(F)(F)F)ccc1F ZINC000159663004 495781133 /nfs/dbraw/zinc/78/11/33/495781133.db2.gz CNFFWBDQIUDBLC-UHFFFAOYSA-N -1 3 363.332 3.071 20 70 FGIDHM CC[C@@H]([N-]S(=O)(=O)Cc1cc(-c2ccccc2)no1)c1nccs1 ZINC000159930987 495843368 /nfs/dbraw/zinc/84/33/68/495843368.db2.gz AJFCMCKSTOXSRE-CQSZACIVSA-N -1 3 363.464 3.369 20 70 FGIDHM Cc1cc(C)c([N-]S(=O)(=O)c2cncc(F)c2)c(Br)c1 ZINC000160037360 495868287 /nfs/dbraw/zinc/86/82/87/495868287.db2.gz AEFSCIZZIXXKJW-UHFFFAOYSA-N -1 3 359.220 3.401 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3ccc(NC(=O)[C@@H]4C[C@H]4C)cc3)[n-]2)o1 ZINC000160201813 495907774 /nfs/dbraw/zinc/90/77/74/495907774.db2.gz FFCPPGLFTFPVJE-QMTHXVAHSA-N -1 3 365.393 3.220 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3ccc(NC(=O)[C@@H]4C[C@H]4C)cc3)n2)o1 ZINC000160201813 495907781 /nfs/dbraw/zinc/90/77/81/495907781.db2.gz FFCPPGLFTFPVJE-QMTHXVAHSA-N -1 3 365.393 3.220 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3ccc(NC(=O)[C@@H]4C[C@H]4C)cc3)n[n-]2)o1 ZINC000160201813 495907789 /nfs/dbraw/zinc/90/77/89/495907789.db2.gz FFCPPGLFTFPVJE-QMTHXVAHSA-N -1 3 365.393 3.220 20 70 FGIDHM CCCCn1ncc(C(=O)NCc2ccc([O-])c(Br)c2)c1C ZINC000160977578 496078521 /nfs/dbraw/zinc/07/85/21/496078521.db2.gz AAPVTLJGNPYHFN-UHFFFAOYSA-N -1 3 366.259 3.390 20 70 FGIDHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)c3ccccc3-n3cccn3)cc2)n1 ZINC000161169919 496119524 /nfs/dbraw/zinc/11/95/24/496119524.db2.gz NAICYRZNLDARSN-UHFFFAOYSA-N -1 3 371.400 3.183 20 70 FGIDHM CSc1cc(C(=O)Nc2ccc(-c3nc(C)cc(=O)[n-]3)cc2)ccn1 ZINC000161153455 567882329 /nfs/dbraw/zinc/88/23/29/567882329.db2.gz AYHKJEUMEVXKME-UHFFFAOYSA-N -1 3 352.419 3.115 20 70 FGIDHM C[C@H](c1ccsc1)N1CCN(C(=O)NCc2ccc([O-])c(F)c2)CC1 ZINC000159725515 495795286 /nfs/dbraw/zinc/79/52/86/495795286.db2.gz GQDGKYYPFPBYMN-CYBMUJFWSA-N -1 3 363.458 3.181 20 70 FGIDHM CC[C@H]([N-]S(=O)(=O)c1cccc(OC(F)(F)F)c1)c1nccs1 ZINC000159985687 495857404 /nfs/dbraw/zinc/85/74/04/495857404.db2.gz YZRDMDDEIHEHJX-NSHDSACASA-N -1 3 366.386 3.471 20 70 FGIDHM COC(=O)c1sc2ccccc2c1S(=O)(=O)[N-]CC1(C2CC2)CC1 ZINC000160167854 495900003 /nfs/dbraw/zinc/90/00/03/495900003.db2.gz SLROKGCUEPEJGL-UHFFFAOYSA-N -1 3 365.476 3.156 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3ccc(NC(=O)[C@H]4C[C@H]4C)cc3)[n-]2)o1 ZINC000160201944 495907482 /nfs/dbraw/zinc/90/74/82/495907482.db2.gz FFCPPGLFTFPVJE-YGRLFVJLSA-N -1 3 365.393 3.220 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3ccc(NC(=O)[C@H]4C[C@H]4C)cc3)n2)o1 ZINC000160201944 495907487 /nfs/dbraw/zinc/90/74/87/495907487.db2.gz FFCPPGLFTFPVJE-YGRLFVJLSA-N -1 3 365.393 3.220 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3ccc(NC(=O)[C@H]4C[C@H]4C)cc3)n[n-]2)o1 ZINC000160201944 495907493 /nfs/dbraw/zinc/90/74/93/495907493.db2.gz FFCPPGLFTFPVJE-YGRLFVJLSA-N -1 3 365.393 3.220 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)Cc3ccc(OC(F)(F)F)cc3)[n-]2)o1 ZINC000160391664 495951774 /nfs/dbraw/zinc/95/17/74/495951774.db2.gz BSFNHSBWXCILPU-UHFFFAOYSA-N -1 3 366.299 3.453 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)Cc3ccc(OC(F)(F)F)cc3)n2)o1 ZINC000160391664 495951778 /nfs/dbraw/zinc/95/17/78/495951778.db2.gz BSFNHSBWXCILPU-UHFFFAOYSA-N -1 3 366.299 3.453 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)Cc3ccc(OC(F)(F)F)cc3)n[n-]2)o1 ZINC000160391664 495951784 /nfs/dbraw/zinc/95/17/84/495951784.db2.gz BSFNHSBWXCILPU-UHFFFAOYSA-N -1 3 366.299 3.453 20 70 FGIDHM COC(=O)c1ccc(S(=O)(=O)[N-]c2c(C)cccc2F)cc1Cl ZINC000160807628 496046682 /nfs/dbraw/zinc/04/66/82/496046682.db2.gz PPONLPVTTJOJIE-UHFFFAOYSA-N -1 3 357.790 3.375 20 70 FGIDHM COCc1nc2cc([N-]S(=O)(=O)Cc3cccc(F)c3)ccc2o1 ZINC000161002061 496083123 /nfs/dbraw/zinc/08/31/23/496083123.db2.gz IEFKNXVQLBNUIU-UHFFFAOYSA-N -1 3 350.371 3.055 20 70 FGIDHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)CSCc3ccccn3)cc2)n1 ZINC000161160684 496117002 /nfs/dbraw/zinc/11/70/02/496117002.db2.gz MNJDUBRRSASONT-UHFFFAOYSA-N -1 3 366.446 3.012 20 70 FGIDHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)c3ccn(-c4ccccc4)n3)cc2)n1 ZINC000161175316 496120553 /nfs/dbraw/zinc/12/05/53/496120553.db2.gz MCBUGTMSJFDQDQ-UHFFFAOYSA-N -1 3 371.400 3.183 20 70 FGIDHM CCCn1c2ccccc2nc1NC(=O)c1cc(OC)c([O-])c(OC)c1 ZINC000159468844 495738862 /nfs/dbraw/zinc/73/88/62/495738862.db2.gz OBRYSNDAKKXGDP-UHFFFAOYSA-N -1 3 355.394 3.421 20 70 FGIDHM CC[C@@H]([N-]S(=O)(=O)c1cccc(OC(F)(F)F)c1)c1nccs1 ZINC000159985809 495857442 /nfs/dbraw/zinc/85/74/42/495857442.db2.gz YZRDMDDEIHEHJX-LLVKDONJSA-N -1 3 366.386 3.471 20 70 FGIDHM O=C(c1ccc2c(c1)C(=O)[N-]C2=O)N(Cc1ccco1)Cc1cccs1 ZINC000160246770 495917109 /nfs/dbraw/zinc/91/71/09/495917109.db2.gz OWGUIOXSJJTYME-UHFFFAOYSA-N -1 3 366.398 3.067 20 70 FGIDHM CCC(CC)c1cc(C(=O)[N-]c2nc(CN3CCOCC3)cs2)on1 ZINC000161030179 496088810 /nfs/dbraw/zinc/08/88/10/496088810.db2.gz IWIGZUSYSRTHLU-UHFFFAOYSA-N -1 3 364.471 3.119 20 70 FGIDHM Cc1nc(C)c(CC(=O)N2CCCC[C@@H]2CCCc2ccccc2)c(=O)[n-]1 ZINC000161168496 496119221 /nfs/dbraw/zinc/11/92/21/496119221.db2.gz ARWDYVCQPXBJDT-LJQANCHMSA-N -1 3 367.493 3.333 20 70 FGIDHM O=S(=O)([N-][C@H](C[C@@H]1CCOC1)c1ccccc1)c1ccc(F)cc1F ZINC000159862079 495826259 /nfs/dbraw/zinc/82/62/59/495826259.db2.gz OFIJMSZOCWSQJK-SUMWQHHRSA-N -1 3 367.417 3.411 20 70 FGIDHM Cc1noc(C)c1C[C@@H](C)[N-]S(=O)(=O)c1ccccc1C(F)(F)F ZINC000159903297 495836050 /nfs/dbraw/zinc/83/60/50/495836050.db2.gz NKWMKSVDZGCZPQ-SECBINFHSA-N -1 3 362.373 3.220 20 70 FGIDHM CCCc1ccccc1NC(=O)c1ccc(F)c([N-]S(C)(=O)=O)c1 ZINC000160029454 495867483 /nfs/dbraw/zinc/86/74/83/495867483.db2.gz XDOVHWJWJQOHTK-UHFFFAOYSA-N -1 3 350.415 3.402 20 70 FGIDHM CC(C)(C)c1csc(NC(=O)c2ccc(F)c([N-]S(C)(=O)=O)c2)n1 ZINC000160871699 496057745 /nfs/dbraw/zinc/05/77/45/496057745.db2.gz LLRMXKIFBAAIQE-UHFFFAOYSA-N -1 3 371.459 3.204 20 70 FGIDHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)c3cc(-c4ccncc4)on3)cc2)n1 ZINC000161161770 496118266 /nfs/dbraw/zinc/11/82/66/496118266.db2.gz PBOOSZGBJZUFMQ-UHFFFAOYSA-N -1 3 373.372 3.048 20 70 FGIDHM O=c1[n-]nc(SCCCSCc2ccccc2)n1C[C@@H]1CCCO1 ZINC000159714742 495793111 /nfs/dbraw/zinc/79/31/11/495793111.db2.gz DPVXSOLGJCVJGO-HNNXBMFYSA-N -1 3 365.524 3.166 20 70 FGIDHM O=S(=O)([N-][C@@H](C[C@@H]1CCOC1)c1ccccc1)c1ccc(F)c(F)c1 ZINC000159869652 495829242 /nfs/dbraw/zinc/82/92/42/495829242.db2.gz AWWMGXIMVYPCBZ-UGSOOPFHSA-N -1 3 367.417 3.411 20 70 FGIDHM COc1ccc(C(=O)CCC(=O)Nc2nnc(-c3ccc(C)o3)[n-]2)cc1F ZINC000160260313 495921375 /nfs/dbraw/zinc/92/13/75/495921375.db2.gz CDTNOGRYFDGELF-UHFFFAOYSA-N -1 3 372.356 3.122 20 70 FGIDHM COc1ccc(C(=O)CCC(=O)Nc2nc(-c3ccc(C)o3)n[n-]2)cc1F ZINC000160260313 495921380 /nfs/dbraw/zinc/92/13/80/495921380.db2.gz CDTNOGRYFDGELF-UHFFFAOYSA-N -1 3 372.356 3.122 20 70 FGIDHM COc1ccc(C(=O)CCC(=O)Nc2n[n-]c(-c3ccc(C)o3)n2)cc1F ZINC000160260313 495921383 /nfs/dbraw/zinc/92/13/83/495921383.db2.gz CDTNOGRYFDGELF-UHFFFAOYSA-N -1 3 372.356 3.122 20 70 FGIDHM C[C@@H](Cc1cccc(Cl)c1)C(=O)NCCCNC(=O)c1cccc([O-])c1 ZINC000160280380 495925914 /nfs/dbraw/zinc/92/59/14/495925914.db2.gz WBBQORIRMDHONN-AWEZNQCLSA-N -1 3 374.868 3.161 20 70 FGIDHM CC(=O)c1ccc(OCCCC(=O)Nc2nnc(-c3ccc(C)o3)[n-]2)cc1 ZINC000160397574 495953435 /nfs/dbraw/zinc/95/34/35/495953435.db2.gz KATDJHHCICANNW-UHFFFAOYSA-N -1 3 368.393 3.373 20 70 FGIDHM CC(=O)c1ccc(OCCCC(=O)Nc2nc(-c3ccc(C)o3)n[n-]2)cc1 ZINC000160397574 495953442 /nfs/dbraw/zinc/95/34/42/495953442.db2.gz KATDJHHCICANNW-UHFFFAOYSA-N -1 3 368.393 3.373 20 70 FGIDHM CC(=O)c1ccc(OCCCC(=O)Nc2n[n-]c(-c3ccc(C)o3)n2)cc1 ZINC000160397574 495953446 /nfs/dbraw/zinc/95/34/46/495953446.db2.gz KATDJHHCICANNW-UHFFFAOYSA-N -1 3 368.393 3.373 20 70 FGIDHM O=C(CSc1nccc2ccccc21)Nc1nnc(-c2ccccn2)[n-]1 ZINC000160883666 496059879 /nfs/dbraw/zinc/05/98/79/496059879.db2.gz UZLGXPRIMYRGOX-UHFFFAOYSA-N -1 3 362.418 3.146 20 70 FGIDHM O=C(CSc1nccc2ccccc21)Nc1nc(-c2ccccn2)n[n-]1 ZINC000160883666 496059884 /nfs/dbraw/zinc/05/98/84/496059884.db2.gz UZLGXPRIMYRGOX-UHFFFAOYSA-N -1 3 362.418 3.146 20 70 FGIDHM O=C(CSc1nccc2ccccc21)Nc1n[n-]c(-c2ccccn2)n1 ZINC000160883666 496059887 /nfs/dbraw/zinc/05/98/87/496059887.db2.gz UZLGXPRIMYRGOX-UHFFFAOYSA-N -1 3 362.418 3.146 20 70 FGIDHM CCc1ccc(OCC(=O)Nc2ccc(-c3nc(C)cc(=O)[n-]3)cc2)cc1 ZINC000161207505 496126974 /nfs/dbraw/zinc/12/69/74/496126974.db2.gz LLJAPXMQYXVOPJ-UHFFFAOYSA-N -1 3 363.417 3.325 20 70 FGIDHM Cc1nc(C)c(CCC(=O)N(Cc2ccco2)Cc2ccccc2)c(=O)[n-]1 ZINC000160100052 495882985 /nfs/dbraw/zinc/88/29/85/495882985.db2.gz PEWJESGSRLYGKV-UHFFFAOYSA-N -1 3 365.433 3.141 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3cnn(-c4ccccc4Cl)c3)[n-]2)o1 ZINC000160337801 495939066 /nfs/dbraw/zinc/93/90/66/495939066.db2.gz YLFFUNGGFHJPCK-UHFFFAOYSA-N -1 3 368.784 3.465 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3cnn(-c4ccccc4Cl)c3)n2)o1 ZINC000160337801 495939073 /nfs/dbraw/zinc/93/90/73/495939073.db2.gz YLFFUNGGFHJPCK-UHFFFAOYSA-N -1 3 368.784 3.465 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3cnn(-c4ccccc4Cl)c3)n[n-]2)o1 ZINC000160337801 495939079 /nfs/dbraw/zinc/93/90/79/495939079.db2.gz YLFFUNGGFHJPCK-UHFFFAOYSA-N -1 3 368.784 3.465 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)Cc3cccc(Br)c3)[n-]2)o1 ZINC000160390186 495952093 /nfs/dbraw/zinc/95/20/93/495952093.db2.gz SISQRSJBESDLQT-UHFFFAOYSA-N -1 3 361.199 3.317 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)Cc3cccc(Br)c3)n2)o1 ZINC000160390186 495952097 /nfs/dbraw/zinc/95/20/97/495952097.db2.gz 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495904193 /nfs/dbraw/zinc/90/41/93/495904193.db2.gz RGOWYSZVCCFJCI-VIFPVBQESA-N -1 3 369.406 3.058 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3ccc4c(c3)NC(=O)[C@H](C)S4)n[n-]2)o1 ZINC000160189178 495904198 /nfs/dbraw/zinc/90/41/98/495904198.db2.gz RGOWYSZVCCFJCI-VIFPVBQESA-N -1 3 369.406 3.058 20 70 FGIDHM CCOc1ccc(C(=O)CCC(=O)Nc2nnc(-c3ccc(C)o3)[n-]2)cc1 ZINC000160327857 495935794 /nfs/dbraw/zinc/93/57/94/495935794.db2.gz OUOOCIPJRKBJCL-UHFFFAOYSA-N -1 3 368.393 3.373 20 70 FGIDHM CCOc1ccc(C(=O)CCC(=O)Nc2nc(-c3ccc(C)o3)n[n-]2)cc1 ZINC000160327857 495935800 /nfs/dbraw/zinc/93/58/00/495935800.db2.gz OUOOCIPJRKBJCL-UHFFFAOYSA-N -1 3 368.393 3.373 20 70 FGIDHM CCOc1ccc(C(=O)CCC(=O)Nc2n[n-]c(-c3ccc(C)o3)n2)cc1 ZINC000160327857 495935808 /nfs/dbraw/zinc/93/58/08/495935808.db2.gz OUOOCIPJRKBJCL-UHFFFAOYSA-N -1 3 368.393 3.373 20 70 FGIDHM Cc1ccc(/C=C/CC(=O)N2CCN(C(=O)c3ccccc3[O-])CC2)cc1 ZINC000160622128 496006160 /nfs/dbraw/zinc/00/61/60/496006160.db2.gz PZDIFUVVXSWTSO-SNAWJCMRSA-N -1 3 364.445 3.089 20 70 FGIDHM COc1cc(C(=O)NCc2ccc(Br)s2)cc(OC)c1[O-] ZINC000161433059 496176051 /nfs/dbraw/zinc/17/60/51/496176051.db2.gz MIPFYHASMWXYKO-UHFFFAOYSA-N -1 3 372.240 3.163 20 70 FGIDHM CS(=O)(=O)[N-]c1ccccc1NC(=O)[C@H]1C[C@@H]1c1cc(F)ccc1F ZINC000159721482 495794718 /nfs/dbraw/zinc/79/47/18/495794718.db2.gz PLMQJGFZCQHJRT-YPMHNXCESA-N -1 3 366.389 3.079 20 70 FGIDHM CCC(CC)(CC)CNC(=O)N1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000159726437 495796272 /nfs/dbraw/zinc/79/62/72/495796272.db2.gz RIMXMDRNPLIZQI-UHFFFAOYSA-N -1 3 361.486 3.076 20 70 FGIDHM CN(Cc1nc(=O)c2c(-c3ccccc3)csc2[n-]1)C[C@H]1CCC[C@@H]1O ZINC000159763814 495803656 /nfs/dbraw/zinc/80/36/56/495803656.db2.gz RITSNXJBQUMPPQ-ZBFHGGJFSA-N -1 3 369.490 3.244 20 70 FGIDHM CC(C)CCC[C@@H](C)N(CCC(C)C)C(=O)C1CC2(C1)NC(=O)[N-]C2=O ZINC000159785778 495808503 /nfs/dbraw/zinc/80/85/03/495808503.db2.gz CZYZRSHVRAGZSX-LSWWBPAMSA-N -1 3 365.518 3.064 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)Cc3csc(-c4cccnc4)n3)[n-]2)o1 ZINC000160255098 495919787 /nfs/dbraw/zinc/91/97/87/495919787.db2.gz ZYDRIEZWIIGYCQ-UHFFFAOYSA-N -1 3 366.406 3.073 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)Cc3csc(-c4cccnc4)n3)n2)o1 ZINC000160255098 495919792 /nfs/dbraw/zinc/91/97/92/495919792.db2.gz ZYDRIEZWIIGYCQ-UHFFFAOYSA-N -1 3 366.406 3.073 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)Cc3csc(-c4cccnc4)n3)n[n-]2)o1 ZINC000160255098 495919794 /nfs/dbraw/zinc/91/97/94/495919794.db2.gz ZYDRIEZWIIGYCQ-UHFFFAOYSA-N -1 3 366.406 3.073 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)CCCc3nc(C(C)(C)C)no3)[n-]2)o1 ZINC000160284415 495927099 /nfs/dbraw/zinc/92/70/99/495927099.db2.gz MYPGJFULHALWHU-UHFFFAOYSA-N -1 3 358.402 3.015 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)CCCc3nc(C(C)(C)C)no3)n2)o1 ZINC000160284415 495927101 /nfs/dbraw/zinc/92/71/01/495927101.db2.gz MYPGJFULHALWHU-UHFFFAOYSA-N -1 3 358.402 3.015 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)CCCc3nc(C(C)(C)C)no3)n[n-]2)o1 ZINC000160284415 495927102 /nfs/dbraw/zinc/92/71/02/495927102.db2.gz MYPGJFULHALWHU-UHFFFAOYSA-N -1 3 358.402 3.015 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)CCCOc3ccc(F)cc3F)[n-]2)o1 ZINC000160426902 495960860 /nfs/dbraw/zinc/96/08/60/495960860.db2.gz WPCBPUHKBKSSBY-UHFFFAOYSA-N -1 3 362.336 3.449 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)CCCOc3ccc(F)cc3F)n2)o1 ZINC000160426902 495960863 /nfs/dbraw/zinc/96/08/63/495960863.db2.gz WPCBPUHKBKSSBY-UHFFFAOYSA-N -1 3 362.336 3.449 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)CCCOc3ccc(F)cc3F)n[n-]2)o1 ZINC000160426902 495960866 /nfs/dbraw/zinc/96/08/66/495960866.db2.gz WPCBPUHKBKSSBY-UHFFFAOYSA-N -1 3 362.336 3.449 20 70 FGIDHM CC(C)(C)c1nc(CCNC(=O)c2c[n-]c3ccccc3c2=O)cs1 ZINC000160657828 496014016 /nfs/dbraw/zinc/01/40/16/496014016.db2.gz JUGAETFUICJXJN-UHFFFAOYSA-N -1 3 355.463 3.255 20 70 FGIDHM CN(C)[C@@H](CNC(=O)c1ccc(Br)c([O-])c1)c1ccccc1 ZINC000160924608 496067913 /nfs/dbraw/zinc/06/79/13/496067913.db2.gz KWLMHUZHNDFBDO-HNNXBMFYSA-N -1 3 363.255 3.187 20 70 FGIDHM CCOc1ccc(CC(=O)Nc2ccc(-c3nc(C)cc(=O)[n-]3)cc2)cc1 ZINC000161206029 496126642 /nfs/dbraw/zinc/12/66/42/496126642.db2.gz JSVJAEKSUBFENT-UHFFFAOYSA-N -1 3 363.417 3.325 20 70 FGIDHM O=S(=O)([N-][C@@H](C[C@H]1CCOC1)c1ccccc1)c1cc(F)cc(F)c1 ZINC000159797926 495811725 /nfs/dbraw/zinc/81/17/25/495811725.db2.gz BCBOQIRQLIODHA-ACJLOTCBSA-N -1 3 367.417 3.411 20 70 FGIDHM CCc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)NC(=O)[C@@H](C)O3)cc1CC ZINC000160004685 495861309 /nfs/dbraw/zinc/86/13/09/495861309.db2.gz SSCDNBYWNHVATC-GFCCVEGCSA-N -1 3 374.462 3.332 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)CCc3c(C)nn(CC(C)C)c3C)[n-]2)o1 ZINC000160255912 495919903 /nfs/dbraw/zinc/91/99/03/495919903.db2.gz FEKNNCGUXITGMU-UHFFFAOYSA-N -1 3 370.457 3.414 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)CCc3c(C)nn(CC(C)C)c3C)n2)o1 ZINC000160255912 495919907 /nfs/dbraw/zinc/91/99/07/495919907.db2.gz FEKNNCGUXITGMU-UHFFFAOYSA-N -1 3 370.457 3.414 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)CCc3c(C)nn(CC(C)C)c3C)n[n-]2)o1 ZINC000160255912 495919910 /nfs/dbraw/zinc/91/99/10/495919910.db2.gz FEKNNCGUXITGMU-UHFFFAOYSA-N -1 3 370.457 3.414 20 70 FGIDHM CNS(=O)(=O)c1csc(C(=O)[N-]c2ccccc2SC(C)C)c1 ZINC000160901375 496064269 /nfs/dbraw/zinc/06/42/69/496064269.db2.gz PDZDPDQAMGAILQ-UHFFFAOYSA-N -1 3 370.521 3.409 20 70 FGIDHM CCC(=O)c1cccc(S(=O)(=O)[N-]c2cc(F)c(OC)cc2F)c1 ZINC000160107594 495885115 /nfs/dbraw/zinc/88/51/15/495885115.db2.gz FAMQRJHGNWORDA-UHFFFAOYSA-N -1 3 355.362 3.367 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)CCc3nc(-c4cccs4)no3)[n-]2)o1 ZINC000160222060 495912624 /nfs/dbraw/zinc/91/26/24/495912624.db2.gz JVBRSQWUMGMDFW-UHFFFAOYSA-N -1 3 370.394 3.056 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)CCc3nc(-c4cccs4)no3)n2)o1 ZINC000160222060 495912629 /nfs/dbraw/zinc/91/26/29/495912629.db2.gz JVBRSQWUMGMDFW-UHFFFAOYSA-N -1 3 370.394 3.056 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)CCc3nc(-c4cccs4)no3)n[n-]2)o1 ZINC000160222060 495912636 /nfs/dbraw/zinc/91/26/36/495912636.db2.gz JVBRSQWUMGMDFW-UHFFFAOYSA-N -1 3 370.394 3.056 20 70 FGIDHM CC(=O)c1cccc(OCCCC(=O)Nc2nnc(-c3ccc(C)o3)[n-]2)c1 ZINC000160282902 495926099 /nfs/dbraw/zinc/92/60/99/495926099.db2.gz HOUCQDTYTAJNNM-UHFFFAOYSA-N -1 3 368.393 3.373 20 70 FGIDHM CC(=O)c1cccc(OCCCC(=O)Nc2nc(-c3ccc(C)o3)n[n-]2)c1 ZINC000160282902 495926105 /nfs/dbraw/zinc/92/61/05/495926105.db2.gz HOUCQDTYTAJNNM-UHFFFAOYSA-N -1 3 368.393 3.373 20 70 FGIDHM CC(=O)c1cccc(OCCCC(=O)Nc2n[n-]c(-c3ccc(C)o3)n2)c1 ZINC000160282902 495926113 /nfs/dbraw/zinc/92/61/13/495926113.db2.gz HOUCQDTYTAJNNM-UHFFFAOYSA-N -1 3 368.393 3.373 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)COc3ccc(F)c(Cl)c3)[n-]2)o1 ZINC000160341506 495940546 /nfs/dbraw/zinc/94/05/46/495940546.db2.gz JIWBXNPJSVFFPP-UHFFFAOYSA-N -1 3 350.737 3.183 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)COc3ccc(F)c(Cl)c3)n2)o1 ZINC000160341506 495940553 /nfs/dbraw/zinc/94/05/53/495940553.db2.gz JIWBXNPJSVFFPP-UHFFFAOYSA-N -1 3 350.737 3.183 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)COc3ccc(F)c(Cl)c3)n[n-]2)o1 ZINC000160341506 495940560 /nfs/dbraw/zinc/94/05/60/495940560.db2.gz JIWBXNPJSVFFPP-UHFFFAOYSA-N -1 3 350.737 3.183 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3cc(C4CC4)n(C(C)(C)C)n3)[n-]2)o1 ZINC000160408315 495956691 /nfs/dbraw/zinc/95/66/91/495956691.db2.gz LQSKFSAFHYTWFP-UHFFFAOYSA-N -1 3 354.414 3.454 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3cc(C4CC4)n(C(C)(C)C)n3)n2)o1 ZINC000160408315 495956695 /nfs/dbraw/zinc/95/66/95/495956695.db2.gz LQSKFSAFHYTWFP-UHFFFAOYSA-N -1 3 354.414 3.454 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3cc(C4CC4)n(C(C)(C)C)n3)n[n-]2)o1 ZINC000160408315 495956702 /nfs/dbraw/zinc/95/67/02/495956702.db2.gz LQSKFSAFHYTWFP-UHFFFAOYSA-N -1 3 354.414 3.454 20 70 FGIDHM Cc1cc(C(=O)Nc2ccc(F)c(S(=O)(=O)[N-]C(C)(C)C)c2)oc1C ZINC000160644351 496010509 /nfs/dbraw/zinc/01/05/09/496010509.db2.gz ROVPYXKLMXBKRB-UHFFFAOYSA-N -1 3 368.430 3.365 20 70 FGIDHM Cc1noc(C)c1[C@@H](C)C(=O)Nc1ccc(-c2nc(C)cc(=O)[n-]2)cc1 ZINC000161132403 496110006 /nfs/dbraw/zinc/11/00/06/496110006.db2.gz QCIRAXGQEQZILA-LLVKDONJSA-N -1 3 352.394 3.092 20 70 FGIDHM CC[C@@H](C)c1ccc([C@H](NC(=O)C2CC3(C2)NC(=O)[N-]C3=O)C(C)C)cc1 ZINC000159695858 495789889 /nfs/dbraw/zinc/78/98/89/495789889.db2.gz ZDENNAHMQXMBBV-QTTNPNKWSA-N -1 3 371.481 3.002 20 70 FGIDHM CS(=O)(=O)[N-]c1ccccc1NC(=O)[C@H]1C[C@H]1c1cc(F)ccc1F ZINC000159721692 495795359 /nfs/dbraw/zinc/79/53/59/495795359.db2.gz PLMQJGFZCQHJRT-AAEUAGOBSA-N -1 3 366.389 3.079 20 70 FGIDHM CCc1ccc(S(=O)(=O)[N-]c2cc(C(N)=O)ccc2Cl)cc1CC ZINC000160039096 495869494 /nfs/dbraw/zinc/86/94/94/495869494.db2.gz YUBFHIYJCMJTIF-UHFFFAOYSA-N -1 3 366.870 3.365 20 70 FGIDHM CCC(O)(CC)C[N-]S(=O)(=O)c1ccc(-c2csc(C)n2)s1 ZINC000160210163 495910645 /nfs/dbraw/zinc/91/06/45/495910645.db2.gz ZWLLGNCTUYCQIC-UHFFFAOYSA-N -1 3 360.526 3.009 20 70 FGIDHM CCO[C@H](C)c1nc(CC(=O)Nc2nnc(-c3ccc(C)o3)[n-]2)cs1 ZINC000160312756 495932269 /nfs/dbraw/zinc/93/22/69/495932269.db2.gz OUNALZPXPHDADI-SNVBAGLBSA-N -1 3 361.427 3.108 20 70 FGIDHM CCO[C@H](C)c1nc(CC(=O)Nc2nc(-c3ccc(C)o3)n[n-]2)cs1 ZINC000160312756 495932277 /nfs/dbraw/zinc/93/22/77/495932277.db2.gz OUNALZPXPHDADI-SNVBAGLBSA-N -1 3 361.427 3.108 20 70 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Cc1ccc(-c2nnc(NC(=O)Cc3ccccc3Br)[n-]2)o1 ZINC000160390910 495951828 /nfs/dbraw/zinc/95/18/28/495951828.db2.gz BROHUOVQAOPKOU-UHFFFAOYSA-N -1 3 361.199 3.317 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)Cc3ccccc3Br)n2)o1 ZINC000160390910 495951831 /nfs/dbraw/zinc/95/18/31/495951831.db2.gz BROHUOVQAOPKOU-UHFFFAOYSA-N -1 3 361.199 3.317 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)Cc3ccccc3Br)n[n-]2)o1 ZINC000160390910 495951835 /nfs/dbraw/zinc/95/18/35/495951835.db2.gz BROHUOVQAOPKOU-UHFFFAOYSA-N -1 3 361.199 3.317 20 70 FGIDHM CSc1nc(C)c(CCC(=O)Nc2nnc(-c3ccc(C)o3)[n-]2)c(C)n1 ZINC000160417620 495958046 /nfs/dbraw/zinc/95/80/46/495958046.db2.gz MUTGNUHEWKDOKF-UHFFFAOYSA-N -1 3 372.454 3.073 20 70 FGIDHM CSc1nc(C)c(CCC(=O)Nc2nc(-c3ccc(C)o3)n[n-]2)c(C)n1 ZINC000160417620 495958051 /nfs/dbraw/zinc/95/80/51/495958051.db2.gz MUTGNUHEWKDOKF-UHFFFAOYSA-N -1 3 372.454 3.073 20 70 FGIDHM CSc1nc(C)c(CCC(=O)Nc2n[n-]c(-c3ccc(C)o3)n2)c(C)n1 ZINC000160417620 495958057 /nfs/dbraw/zinc/95/80/57/495958057.db2.gz 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361.392 3.139 20 70 FGIDHM Cn1cc([N-]S(=O)(=O)c2ccc(Cl)c(Cl)c2)cc(Cl)c1=O ZINC000160253700 495918812 /nfs/dbraw/zinc/91/88/12/495918812.db2.gz POCDOVZBJSFHLO-UHFFFAOYSA-N -1 3 367.641 3.146 20 70 FGIDHM CCc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)CCN3C(N)=O)cc1CC ZINC000160323092 495934655 /nfs/dbraw/zinc/93/46/55/495934655.db2.gz PSSYWOKKKQOHNN-UHFFFAOYSA-N -1 3 373.478 3.053 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3cc(Br)cs3)[n-]2)o1 ZINC000160374251 495948050 /nfs/dbraw/zinc/94/80/50/495948050.db2.gz LTISSFIKFRGXDY-UHFFFAOYSA-N -1 3 353.201 3.449 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3cc(Br)cs3)n2)o1 ZINC000160374251 495948055 /nfs/dbraw/zinc/94/80/55/495948055.db2.gz LTISSFIKFRGXDY-UHFFFAOYSA-N -1 3 353.201 3.449 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3cc(Br)cs3)n[n-]2)o1 ZINC000160374251 495948061 /nfs/dbraw/zinc/94/80/61/495948061.db2.gz LTISSFIKFRGXDY-UHFFFAOYSA-N -1 3 353.201 3.449 20 70 FGIDHM O=C(Cc1ccc([O-])cc1Cl)N[C@H]1CCN(c2ncccc2Cl)C1 ZINC000160382584 495949857 /nfs/dbraw/zinc/94/98/57/495949857.db2.gz ZEGZEOAOIZXKBB-LBPRGKRZSA-N -1 3 366.248 3.032 20 70 FGIDHM Cc1cccc(C(=O)Nc2nnc(-c3ccccn3)[n-]2)c1Br ZINC000160833237 496051313 /nfs/dbraw/zinc/05/13/13/496051313.db2.gz DNARFWWXZUGZCB-UHFFFAOYSA-N -1 3 358.199 3.190 20 70 FGIDHM Cc1cccc(C(=O)Nc2nc(-c3ccccn3)n[n-]2)c1Br ZINC000160833237 496051320 /nfs/dbraw/zinc/05/13/20/496051320.db2.gz DNARFWWXZUGZCB-UHFFFAOYSA-N -1 3 358.199 3.190 20 70 FGIDHM Cc1cccc(C(=O)Nc2n[n-]c(-c3ccccn3)n2)c1Br ZINC000160833237 496051324 /nfs/dbraw/zinc/05/13/24/496051324.db2.gz DNARFWWXZUGZCB-UHFFFAOYSA-N -1 3 358.199 3.190 20 70 FGIDHM COc1ccc(C(=O)Nc2ccccc2[O-])c(I)c1 ZINC000160952568 496073647 /nfs/dbraw/zinc/07/36/47/496073647.db2.gz ZKCWHPUICOZQNE-UHFFFAOYSA-N -1 3 369.158 3.258 20 70 FGIDHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)CSCc3cccnc3)cc2)n1 ZINC000161152281 496115540 /nfs/dbraw/zinc/11/55/40/496115540.db2.gz VOYHWAWQYNQYSW-UHFFFAOYSA-N -1 3 366.446 3.012 20 70 FGIDHM CCn1nc(C(C)C)cc1C(=O)Nc1ccc(-c2nc(C)cc(=O)[n-]2)cc1 ZINC000161176755 496120633 /nfs/dbraw/zinc/12/06/33/496120633.db2.gz XWPVTSYKMRQVTI-UHFFFAOYSA-N -1 3 365.437 3.337 20 70 FGIDHM Cc1cc(N(C)C)ccc1[N-]S(=O)(=O)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000159684860 495786884 /nfs/dbraw/zinc/78/68/84/495786884.db2.gz XGHCAFDFRXDJIE-UHFFFAOYSA-N -1 3 373.478 3.092 20 70 FGIDHM CS(=O)(=O)[N-]c1ccccc1NC(=O)[C@@H]1C[C@@H]1c1cccc(F)c1F ZINC000159720800 495793681 /nfs/dbraw/zinc/79/36/81/495793681.db2.gz GAMOKPVESPQBES-VXGBXAGGSA-N -1 3 366.389 3.079 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3ccc(NC(=O)C(C)C)cc3)[n-]2)o1 ZINC000160180980 495903396 /nfs/dbraw/zinc/90/33/96/495903396.db2.gz VLDKEUOJJJMJIQ-UHFFFAOYSA-N -1 3 353.382 3.220 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3ccc(NC(=O)C(C)C)cc3)n2)o1 ZINC000160180980 495903401 /nfs/dbraw/zinc/90/34/01/495903401.db2.gz VLDKEUOJJJMJIQ-UHFFFAOYSA-N -1 3 353.382 3.220 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3ccc(NC(=O)C(C)C)cc3)n[n-]2)o1 ZINC000160180980 495903408 /nfs/dbraw/zinc/90/34/08/495903408.db2.gz VLDKEUOJJJMJIQ-UHFFFAOYSA-N -1 3 353.382 3.220 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)CCc3nnc(-c4ccsc4)o3)[n-]2)o1 ZINC000160199979 495906540 /nfs/dbraw/zinc/90/65/40/495906540.db2.gz MESNAFHQLRMFKZ-UHFFFAOYSA-N -1 3 370.394 3.056 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)CCc3nnc(-c4ccsc4)o3)n2)o1 ZINC000160199979 495906548 /nfs/dbraw/zinc/90/65/48/495906548.db2.gz MESNAFHQLRMFKZ-UHFFFAOYSA-N -1 3 370.394 3.056 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)CCc3nnc(-c4ccsc4)o3)n[n-]2)o1 ZINC000160199979 495906557 /nfs/dbraw/zinc/90/65/57/495906557.db2.gz MESNAFHQLRMFKZ-UHFFFAOYSA-N -1 3 370.394 3.056 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)Cc3c(C)nn(CC(C)C)c3C)[n-]2)o1 ZINC000160202372 495907830 /nfs/dbraw/zinc/90/78/30/495907830.db2.gz WOQDAOADESQKMB-UHFFFAOYSA-N -1 3 356.430 3.024 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)Cc3c(C)nn(CC(C)C)c3C)n2)o1 ZINC000160202372 495907837 /nfs/dbraw/zinc/90/78/37/495907837.db2.gz WOQDAOADESQKMB-UHFFFAOYSA-N -1 3 356.430 3.024 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)Cc3c(C)nn(CC(C)C)c3C)n[n-]2)o1 ZINC000160202372 495907842 /nfs/dbraw/zinc/90/78/42/495907842.db2.gz WOQDAOADESQKMB-UHFFFAOYSA-N -1 3 356.430 3.024 20 70 FGIDHM O=C([N-]O[C@@H]1CCCCO1)Nc1ccc(F)cc1OCC(F)(F)F ZINC000160356462 495943639 /nfs/dbraw/zinc/94/36/39/495943639.db2.gz GHUYXXUBGSSEQQ-GFCCVEGCSA-N -1 3 352.284 3.347 20 70 FGIDHM [O-]C(=NO[C@@H]1CCCCO1)Nc1ccc(F)cc1OCC(F)(F)F ZINC000160356462 495943637 /nfs/dbraw/zinc/94/36/37/495943637.db2.gz GHUYXXUBGSSEQQ-GFCCVEGCSA-N -1 3 352.284 3.347 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3csc(Br)c3)[n-]2)o1 ZINC000160355872 495943696 /nfs/dbraw/zinc/94/36/96/495943696.db2.gz KLRDEEHZVDOFNX-UHFFFAOYSA-N -1 3 353.201 3.449 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3csc(Br)c3)n2)o1 ZINC000160355872 495943699 /nfs/dbraw/zinc/94/36/99/495943699.db2.gz KLRDEEHZVDOFNX-UHFFFAOYSA-N -1 3 353.201 3.449 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3csc(Br)c3)n[n-]2)o1 ZINC000160355872 495943703 /nfs/dbraw/zinc/94/37/03/495943703.db2.gz KLRDEEHZVDOFNX-UHFFFAOYSA-N -1 3 353.201 3.449 20 70 FGIDHM CC[C@H](CC(=O)Nc1nnc(-c2ccccn2)[n-]1)c1ccc(OC)cc1 ZINC000160544882 495988493 /nfs/dbraw/zinc/98/84/93/495988493.db2.gz PRTZNJBYMPRPKQ-CYBMUJFWSA-N -1 3 351.410 3.398 20 70 FGIDHM CC[C@H](CC(=O)Nc1nc(-c2ccccn2)n[n-]1)c1ccc(OC)cc1 ZINC000160544882 495988499 /nfs/dbraw/zinc/98/84/99/495988499.db2.gz PRTZNJBYMPRPKQ-CYBMUJFWSA-N -1 3 351.410 3.398 20 70 FGIDHM CC[C@H](CC(=O)Nc1n[n-]c(-c2ccccn2)n1)c1ccc(OC)cc1 ZINC000160544882 495988504 /nfs/dbraw/zinc/98/85/04/495988504.db2.gz PRTZNJBYMPRPKQ-CYBMUJFWSA-N -1 3 351.410 3.398 20 70 FGIDHM COC(=O)c1ccc(F)c([N-]C(=O)c2csc([C@H]3CCCO3)n2)c1 ZINC000161502925 496187690 /nfs/dbraw/zinc/18/76/90/496187690.db2.gz BGXXBVTWIOEDCC-CYBMUJFWSA-N -1 3 350.371 3.173 20 70 FGIDHM CS(=O)(=O)[N-]c1ccccc1NC(=O)[C@H]1C[C@H]1c1cccc(F)c1F ZINC000159721136 495794252 /nfs/dbraw/zinc/79/42/52/495794252.db2.gz GAMOKPVESPQBES-RYUDHWBXSA-N -1 3 366.389 3.079 20 70 FGIDHM COc1cccc(-c2cc(C(=O)[N-]c3nnc(C(F)(F)F)s3)n[nH]2)c1 ZINC000160135662 495892584 /nfs/dbraw/zinc/89/25/84/495892584.db2.gz OFQCBUGPJVVHFW-UHFFFAOYSA-N -1 3 369.328 3.208 20 70 FGIDHM Cc1cccc(-n2cc(C(=O)Nc3ccc(Br)cc3[O-])nn2)c1 ZINC000160139397 495893766 /nfs/dbraw/zinc/89/37/66/495893766.db2.gz OWBFTGJEZGVIRD-UHFFFAOYSA-N -1 3 373.210 3.296 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3nn(-c4ccccc4)c4c3CCC4)[n-]2)o1 ZINC000160202945 495907687 /nfs/dbraw/zinc/90/76/87/495907687.db2.gz FPBQBOFINWZENR-UHFFFAOYSA-N -1 3 374.404 3.300 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3nn(-c4ccccc4)c4c3CCC4)n2)o1 ZINC000160202945 495907693 /nfs/dbraw/zinc/90/76/93/495907693.db2.gz FPBQBOFINWZENR-UHFFFAOYSA-N -1 3 374.404 3.300 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3nn(-c4ccccc4)c4c3CCC4)n[n-]2)o1 ZINC000160202945 495907695 /nfs/dbraw/zinc/90/76/95/495907695.db2.gz FPBQBOFINWZENR-UHFFFAOYSA-N -1 3 374.404 3.300 20 70 FGIDHM COc1ccc2c(CC(=O)Nc3nnc(-c4ccc(C)o4)[n-]3)coc2c1 ZINC000160331318 495937861 /nfs/dbraw/zinc/93/78/61/495937861.db2.gz NWIWCIIVSCKZBV-UHFFFAOYSA-N -1 3 352.350 3.309 20 70 FGIDHM COc1ccc2c(CC(=O)Nc3nc(-c4ccc(C)o4)n[n-]3)coc2c1 ZINC000160331318 495937867 /nfs/dbraw/zinc/93/78/67/495937867.db2.gz NWIWCIIVSCKZBV-UHFFFAOYSA-N -1 3 352.350 3.309 20 70 FGIDHM COc1ccc2c(CC(=O)Nc3n[n-]c(-c4ccc(C)o4)n3)coc2c1 ZINC000160331318 495937870 /nfs/dbraw/zinc/93/78/70/495937870.db2.gz NWIWCIIVSCKZBV-UHFFFAOYSA-N -1 3 352.350 3.309 20 70 FGIDHM Cc1ccc(C)c([C@@H]2CCCN2C(=O)CCc2c(C)nc(C)[n-]c2=O)c1 ZINC000160621266 496004927 /nfs/dbraw/zinc/00/49/27/496004927.db2.gz UIOJGGRKJUWRRT-IBGZPJMESA-N -1 3 353.466 3.300 20 70 FGIDHM CC(C)(CCC(=O)NCCCNC(=O)c1cccc([O-])c1)c1ccccc1 ZINC000160727238 496030304 /nfs/dbraw/zinc/03/03/04/496030304.db2.gz VYPLLBBHKRIADQ-UHFFFAOYSA-N -1 3 368.477 3.386 20 70 FGIDHM CCc1cc(=O)[n-]c(CN[C@H](C(=O)Nc2ccccc2)c2ccccc2)n1 ZINC000160901722 496064891 /nfs/dbraw/zinc/06/48/91/496064891.db2.gz QXLBBXSSDVBYOB-FQEVSTJZSA-N -1 3 362.433 3.214 20 70 FGIDHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)c3cc(C(C)(C)C)nn3C)cc2)n1 ZINC000161164477 496118247 /nfs/dbraw/zinc/11/82/47/496118247.db2.gz SYCQKGOPUGZBFO-UHFFFAOYSA-N -1 3 365.437 3.029 20 70 FGIDHM O=C([N-]CC1CCN(C(=O)c2cccc3ccccc32)CC1)C(F)(F)F ZINC000216733157 568137046 /nfs/dbraw/zinc/13/70/46/568137046.db2.gz PXIXFYZZUOEHTH-UHFFFAOYSA-N -1 3 364.367 3.371 20 70 FGIDHM CS(=O)(=O)[N-]c1cc(C(=O)NCc2ccc3ccccc3c2)ccc1F ZINC000159858347 495825445 /nfs/dbraw/zinc/82/54/45/495825445.db2.gz GPFBXKOTYLPAPP-UHFFFAOYSA-N -1 3 372.421 3.280 20 70 FGIDHM O=S(=O)([N-][C@@H](C[C@@H]1CCOC1)c1ccccc1)c1ccc(F)cc1F ZINC000159862207 495826761 /nfs/dbraw/zinc/82/67/61/495826761.db2.gz OFIJMSZOCWSQJK-GUYCJALGSA-N -1 3 367.417 3.411 20 70 FGIDHM Cc1cc(C(=O)Nc2cc(-c3nccn3C)[n-]n2)c(C)cc1Br ZINC000160899090 496063673 /nfs/dbraw/zinc/06/36/73/496063673.db2.gz RCXCAUJROQSDHY-UHFFFAOYSA-N -1 3 374.242 3.442 20 70 FGIDHM Cc1cc(C(=O)Nc2cc(-c3nccn3C)n[n-]2)c(C)cc1Br ZINC000160899090 496063675 /nfs/dbraw/zinc/06/36/75/496063675.db2.gz RCXCAUJROQSDHY-UHFFFAOYSA-N -1 3 374.242 3.442 20 70 FGIDHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)CCn3cnc4ccccc43)cc2)n1 ZINC000161196870 496124867 /nfs/dbraw/zinc/12/48/67/496124867.db2.gz CRUKKAQPCODFHO-UHFFFAOYSA-N -1 3 373.416 3.124 20 70 FGIDHM O=C(CCNC(=O)C1CCCCC1)Nc1ccc(Br)cc1[O-] ZINC000160138835 495894366 /nfs/dbraw/zinc/89/43/66/495894366.db2.gz ODRXCEQBTJIFRH-UHFFFAOYSA-N -1 3 369.259 3.180 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3cnn(-c4ccccc4F)c3C)[n-]2)o1 ZINC000160323347 495935551 /nfs/dbraw/zinc/93/55/51/495935551.db2.gz XVOXMRQUERDVIN-UHFFFAOYSA-N -1 3 366.356 3.259 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3cnn(-c4ccccc4F)c3C)n2)o1 ZINC000160323347 495935554 /nfs/dbraw/zinc/93/55/54/495935554.db2.gz XVOXMRQUERDVIN-UHFFFAOYSA-N -1 3 366.356 3.259 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3cnn(-c4ccccc4F)c3C)n[n-]2)o1 ZINC000160323347 495935558 /nfs/dbraw/zinc/93/55/58/495935558.db2.gz XVOXMRQUERDVIN-UHFFFAOYSA-N -1 3 366.356 3.259 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3ccc(OC[C@@H]4CCCO4)cc3)[n-]2)o1 ZINC000160423875 495959545 /nfs/dbraw/zinc/95/95/45/495959545.db2.gz YLCNXHWDIUMLEJ-HNNXBMFYSA-N -1 3 368.393 3.183 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3ccc(OC[C@@H]4CCCO4)cc3)n2)o1 ZINC000160423875 495959547 /nfs/dbraw/zinc/95/95/47/495959547.db2.gz YLCNXHWDIUMLEJ-HNNXBMFYSA-N -1 3 368.393 3.183 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3ccc(OC[C@@H]4CCCO4)cc3)n[n-]2)o1 ZINC000160423875 495959554 /nfs/dbraw/zinc/95/95/54/495959554.db2.gz YLCNXHWDIUMLEJ-HNNXBMFYSA-N -1 3 368.393 3.183 20 70 FGIDHM COc1ccc(OCCCC(=O)Nc2nnc(-c3ccc(C)o3)[n-]2)cc1 ZINC000160434468 495962632 /nfs/dbraw/zinc/96/26/32/495962632.db2.gz HPJTUVHLLCXQIX-UHFFFAOYSA-N -1 3 356.382 3.179 20 70 FGIDHM COc1ccc(OCCCC(=O)Nc2nc(-c3ccc(C)o3)n[n-]2)cc1 ZINC000160434468 495962635 /nfs/dbraw/zinc/96/26/35/495962635.db2.gz HPJTUVHLLCXQIX-UHFFFAOYSA-N -1 3 356.382 3.179 20 70 FGIDHM COc1ccc(OCCCC(=O)Nc2n[n-]c(-c3ccc(C)o3)n2)cc1 ZINC000160434468 495962638 /nfs/dbraw/zinc/96/26/38/495962638.db2.gz HPJTUVHLLCXQIX-UHFFFAOYSA-N -1 3 356.382 3.179 20 70 FGIDHM O=C(CCCc1ccc(Br)s1)[N-]OCc1cccnc1 ZINC000160743217 496033744 /nfs/dbraw/zinc/03/37/44/496033744.db2.gz UNPYBUIIWAJCBM-UHFFFAOYSA-N -1 3 355.257 3.476 20 70 FGIDHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)[C@@H](C)Oc3cccc(F)c3)cc2)n1 ZINC000161179466 496121392 /nfs/dbraw/zinc/12/13/92/496121392.db2.gz JAXXIDHUDWJMSF-CYBMUJFWSA-N -1 3 367.380 3.290 20 70 FGIDHM O=C(Cc1ccc([O-])cc1Cl)NCc1nnc(-c2ccccc2)s1 ZINC000161331598 496154001 /nfs/dbraw/zinc/15/40/01/496154001.db2.gz ZMVBQXLZZYWGBC-UHFFFAOYSA-N -1 3 359.838 3.423 20 70 FGIDHM COc1cc(C(=O)N(Cc2ccco2)Cc2ccco2)cc(OC)c1[O-] ZINC000161399004 496168673 /nfs/dbraw/zinc/16/86/73/496168673.db2.gz XWFOOEQQKBZGLI-UHFFFAOYSA-N -1 3 357.362 3.438 20 70 FGIDHM Cc1ccc(-c2nnc(NC(=O)c3cnn(-c4cccc(Cl)c4)c3)[n-]2)o1 ZINC000160335872 495938688 /nfs/dbraw/zinc/93/86/88/495938688.db2.gz NOWFVQXSWNWKHM-UHFFFAOYSA-N -1 3 368.784 3.465 20 70 FGIDHM Cc1ccc(-c2n[n-]c(NC(=O)c3cnn(-c4cccc(Cl)c4)c3)n2)o1 ZINC000160335872 495938691 /nfs/dbraw/zinc/93/86/91/495938691.db2.gz NOWFVQXSWNWKHM-UHFFFAOYSA-N -1 3 368.784 3.465 20 70 FGIDHM Cc1ccc(-c2nc(NC(=O)c3cnn(-c4cccc(Cl)c4)c3)n[n-]2)o1 ZINC000160335872 495938698 /nfs/dbraw/zinc/93/86/98/495938698.db2.gz NOWFVQXSWNWKHM-UHFFFAOYSA-N -1 3 368.784 3.465 20 70 FGIDHM [O-]C(=NO[C@H]1CCCCO1)Nc1ccc(F)cc1OCC(F)(F)F ZINC000160356582 495943407 /nfs/dbraw/zinc/94/34/07/495943407.db2.gz GHUYXXUBGSSEQQ-LBPRGKRZSA-N -1 3 352.284 3.347 20 70 FGIDHM O=C([N-]O[C@H]1CCCCO1)Nc1ccc(F)cc1OCC(F)(F)F ZINC000160356582 495943410 /nfs/dbraw/zinc/94/34/10/495943410.db2.gz GHUYXXUBGSSEQQ-LBPRGKRZSA-N -1 3 352.284 3.347 20 70 FGIDHM CC(C)c1csc(NC(=O)c2ccc(F)c([N-]S(C)(=O)=O)c2)n1 ZINC000160878062 496058996 /nfs/dbraw/zinc/05/89/96/496058996.db2.gz KDVLNUCSZGPMHC-UHFFFAOYSA-N -1 3 357.432 3.029 20 70 FGIDHM